A0A096MYM4_PAPAN Loading...

Transporter

Transporter that mediates cellular uptake of betaine and GABA in a sodium- and chloride-dependent process. May have a role in regulation of GABAergic transmission in the brain through the reuptake of GABA into presynaptic terminals, as well as in osmotic regulation. Probably also involved in renal and hepatic osmotic regulation.

AlphaFold DB , UniProt , Accession A0A096MYM4, Species PAPAN (Papio anubis, Olive baboon), Gene SLC6A12, Length 614 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.8	Very low	30.8	Very low	233 Å²	233	147.1 Å²	147.1	100%	1.148	83%	0.829	S	S	*	*				0	62.9	0	-69.9	-176.9	173.4	0	0	106.4
2	D	35.2	Very low	30.8	Very low	174 Å²	174	144.8 Å²	144.8	93%	0.93	82%	0.824	S	S	*	*				54.1	93.2	67	-68.2	-44.2	0	0	0	113
3	G	28.3	Very low	31	Very low	73 Å²	73	142.4 Å²	142.4	75%	0.753	82%	0.818	S	S	*	*			trans	-162.6	102.2	171.6	0	0	0	0	0	108.4
4	K	31.2	Very low	31	Very low	216 Å²	216	139.6 Å²	139.6	94%	0.939	82%	0.82	S	S	*	*			trans	-52.3	136.2	-175.6	-67	167.9	173.4	177.2	0	113.1
5	V	29.3	Very low	31	Very low	136 Å²	136	136.3 Å²	136.3	82%	0.824	80%	0.802	S	S	*	*			trans	-102.8	110.7	158.4	178.1	0	0	0	0	107.3
6	A	29.7	Very low	30.8	Very low	93 Å²	93	133.7 Å²	133.7	77%	0.769	79%	0.793	S	S	*	*			trans	-85.3	121.4	168.6	0	0	0	0	0	108.4
7	V	29.5	Very low	30.6	Very low	127 Å²	127	139.6 Å²	139.6	77%	0.77	80%	0.799	S	S	*	*			trans	-86.1	116.3	164.5	177	0	0	0	0	106.7
8	Q	25.6	Very low	30.8	Very low	160 Å²	160	136.2 Å²	136.2	75%	0.748	78%	0.781	S	S	*	*			trans	-94.5	93.7	177.7	-163.5	169.7	1.3	0	0	107.5	H10	Q8-H10 PolarHBondContact O-N 3.28Å
9	E	29.1	Very low	30.9	Very low	180 Å²	180	134 Å²	134	84%	0.841	77%	0.772	S	S	*	*			trans	-78.4	107.8	165.9	-82.8	-171.7	160.6	0	0	108.9	G11	E9-G11 PolarHBondContact O-N 3.25Å; E9-G11 VanDerWaalsContact O-N 3.16Å
10	H	29.6	Very low	31.3	Very low	164 Å²	164	133.7 Å²	133.7	76%	0.759	76%	0.763	S	S	*	*			trans	-75.8	90.5	164.8	-83.6	-52.9	0	0	0	109.7	Q8	Q8-H10 PolarHBondContact O-N 3.28Å
11	G	34.6	Very low	31.4	Very low	62 Å²	62	134.7 Å²	134.7	64%	0.639	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-83.9	138.8	157.6	0	0	0	0	0	110.2	E9	E9-G11 PolarHBondContact O-N 3.25Å; E9-G11 VanDerWaalsContact O-N 3.16Å
12	P	31.2	Very low	31.2	Very low	119 Å²	119	125.2 Å²	125.2	77%	0.773	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-66.5	149.8	173.7	29.7	-32.3	0	0	0	109.6	A14	P12-A14 PolarHBondContact O-N 3.46Å
13	P	33.1	Very low	31.4	Very low	114 Å²	114	122.5 Å²	122.5	74%	0.74	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-64.3	124.8	173.4	27.5	-30.9	0	0	0	108.3	V15	P13-V15 VanDerWaalsContact C-N 3.28Å; P13-V15 PolarHBondContact O-N 3.49Å
14	A	30.8	Very low	31.7	Very low	103 Å²	103	124.2 Å²	124.2	85%	0.851	69%	0.692	S	S	*	*			trans	-65.7	93.5	169.2	0	0	0	0	0	108.1	P12 S16	P12-A14 PolarHBondContact O-N 3.46Å; A14-S16 PolarHBondContact O-N 3.01Å
15	V	30.7	Very low	32.3	Very low	91 Å²	91	119.5 Å²	119.5	55%	0.552	68%	0.676	S	S	*	*			trans	-64.5	112.5	166.7	176.8	0	0	0	0	106.9	P13 W17	P13-V15 VanDerWaalsContact C-N 3.28Å; P13-V15 PolarHBondContact O-N 3.49Å; V15-W17 HydrophobicContact CG1-CD2 4.29Å; V15-W17 HydrophobicContact CG1-CG 4.44Å; V15-W17 HydrophobicContact CG1-CZ2 4.4Å; V15-W17 VanDerWaalsContact O-CD1 3.23Å; V15-W17 PolarHBondContact O-N 3.48Å; V15-W17 VanDerWaalsContact O-N 3.14Å
16	S	28.3	Very low	33.5	Very low	94 Å²	94	117.7 Å²	117.7	66%	0.657	66%	0.662	S	S	*	*			trans	-59.3	108.6	163.9	161.3	0	0	0	0	108.3	A14 V18	A14-S16 PolarHBondContact O-N 3.01Å; S16-V18 PolarHBondContact O-N 3.09Å
17	W	27.3	Very low	34.4	Very low	234 Å²	234	119 Å²	119	89%	0.886	65%	0.652	S	S	*	*			trans	-89.4	41.2	175.1	-74.9	99.7	0	0	0	112.4	V15	V15-W17 HydrophobicContact CG1-CD2 4.29Å; V15-W17 HydrophobicContact CG1-CG 4.44Å; V15-W17 HydrophobicContact CG1-CZ2 4.4Å; V15-W17 VanDerWaalsContact O-CD1 3.23Å; V15-W17 PolarHBondContact O-N 3.48Å; V15-W17 VanDerWaalsContact O-N 3.14Å
18	V	33.8	Very low	35.6	Very low	79 Å²	79	118.6 Å²	118.6	48%	0.479	64%	0.642	S	S	.	*	S	Bend	trans	-97.3	121.2	161.2	-175.2	0	0	0	0	106.6	S16 E20	S16-V18 PolarHBondContact O-N 3.09Å; V18-E20 PolarHBondContact O-N 2.91Å
19	P	33.3	Very low	37.2	Very low	94 Å²	94	113.6 Å²	113.6	61%	0.61	62%	0.62	S	S	*	*			trans	-66.3	109.2	177	-3.2	15.7	0	0	0	109	E21 G22	P19-E21 PolarHBondContact O-N 3.04Å; P19-E21 VanDerWaalsContact O-N 3.1Å; P19-G22 PolarHBondContact O-N 3.25Å
20	E	38.2	Very low	38.6	Very low	127 Å²	127	111.3 Å²	111.3	59%	0.593	61%	0.61	S	S	*	*	H	α-helix	trans	-54.9	-24.3	171.3	-81.3	-169.9	-179.6	0	0	112.3	V18 G22 K24	V18-E20 PolarHBondContact O-N 2.91Å; E20-G22 VanDerWaalsContact C-N 3.35Å; E20-K24 VanDerWaalsContact O-CB 3.28Å; E20-K24 WeakPolarHBondContact O-CB 3.4Å; E20-K24 VanDerWaalsContact O-CG 3.29Å; E20-K24 WeakPolarHBondContact O-CG 3.34Å; E20-K24 PolarHBondContact O-N 3.23Å; E20-K24 IonicContact OE2-NZ 2.7Å; E20-K24 PolarHBondContact OE2-NZ 2.56Å
21	E	34.9	Very low	40.1	Very low	156 Å²	156	110.5 Å²	110.5	73%	0.729	61%	0.611	S	S	*	*	H	α-helix	trans	-68.1	-31.5	177.3	-74.1	-178.9	163	0	0	112.8	P19 L25	P19-E21 PolarHBondContact O-N 3.04Å; P19-E21 VanDerWaalsContact O-N 3.1Å; E21-L25 VanDerWaalsContact O-CB 3.29Å; E21-L25 WeakPolarHBondContact O-CB 3.47Å; E21-L25 WeakPolarHBondContact O-CD1 3.46Å; E21-L25 WeakPolarHBondContact O-CG 3.39Å; E21-L25 PolarHBondContact O-N 3.33Å
22	G	32.6	Very low	41.4	Very low	34 Å²	34	112.4 Å²	112.4	35%	0.351	60%	0.603	S	S	.	*	H	α-helix	trans	-73.5	-42.4	176.5	0	0	0	0	0	112.3	P19 E20 D26	P19-G22 PolarHBondContact O-N 3.25Å; E20-G22 VanDerWaalsContact C-N 3.35Å; G22-D26 WeakPolarHBondContact O-CB 3.42Å; G22-D26 PolarHBondContact O-N 3.09Å
23	E	37.6	Very low	43.5	Very low	117 Å²	117	108.9 Å²	108.9	55%	0.547	58%	0.579	S	S	.	*	H	α-helix	trans	-70.4	-35.3	175.5	-74.7	-175.6	161.7	0	0	112.5	Q27	E23-Q27 VanDerWaalsContact O-CB 3.26Å; E23-Q27 WeakPolarHBondContact O-CB 3.41Å; E23-Q27 WeakPolarHBondContact O-CG 3.42Å; E23-Q27 PolarHBondContact O-N 2.64Å
24	K	35.9	Very low	45.5	Very low	108 Å²	108	108.8 Å²	108.8	47%	0.47	57%	0.567	S	S	.	*	H	α-helix	trans	-69.3	-40.2	173.6	-77.8	173.7	-176	156.6	0	112.5	E20 Q27 E28	E20-K24 VanDerWaalsContact O-CB 3.28Å; E20-K24 WeakPolarHBondContact O-CB 3.4Å; E20-K24 VanDerWaalsContact O-CG 3.29Å; E20-K24 WeakPolarHBondContact O-CG 3.34Å; E20-K24 PolarHBondContact O-N 3.23Å; E20-K24 IonicContact OE2-NZ 2.7Å; E20-K24 PolarHBondContact OE2-NZ 2.56Å; K24-Q27 PolarHBondContact O-N 2.92Å; K24-E28 VanDerWaalsContact O-CB 3.3Å; K24-E28 WeakPolarHBondContact O-CB 3.23Å; K24-E28 WeakPolarHBondContact O-CG 3.41Å; K24-E28 PolarHBondContact O-N 2.73Å
25	L	43.1	Very low	47.8	Very low	117 Å²	117	111.5 Å²	111.5	61%	0.613	57%	0.568	S	S	*	*	H	α-helix	trans	-64.6	-42.5	173.9	-90.1	156.8	0	0	0	111.5	E21 D29	E21-L25 VanDerWaalsContact O-CB 3.29Å; E21-L25 WeakPolarHBondContact O-CB 3.47Å; E21-L25 WeakPolarHBondContact O-CD1 3.46Å; E21-L25 WeakPolarHBondContact O-CG 3.39Å; E21-L25 PolarHBondContact O-N 3.33Å; L25-D29 WeakPolarHBondContact O-CB 3.4Å; L25-D29 PolarHBondContact O-N 2.85Å
26	D	54.4	Low	49.9	Very low	98 Å²	98	109.4 Å²	109.4	52%	0.524	55%	0.55	S	S	.	.	H	α-helix	trans	-69.8	-35.2	177.5	-76.8	-27.6	0	0	0	112.2	G22 E30	G22-D26 WeakPolarHBondContact O-CB 3.42Å; G22-D26 PolarHBondContact O-N 3.09Å; D26-E30 WeakPolarHBondContact O-CB 3.35Å; D26-E30 WeakPolarHBondContact O-CG 3.4Å; D26-E30 PolarHBondContact O-N 3.33Å
27	Q	50	Low	52.6	Low	121 Å²	121	106.4 Å²	106.4	57%	0.565	53%	0.534	S	S	*	.	H	α-helix	trans	-70.9	-43	173.3	-84.2	177	-20.3	0	0	113.1	E23 K24 D29 E30 D31	E23-Q27 VanDerWaalsContact O-CB 3.26Å; E23-Q27 WeakPolarHBondContact O-CB 3.41Å; E23-Q27 WeakPolarHBondContact O-CG 3.42Å; E23-Q27 PolarHBondContact O-N 2.64Å; K24-Q27 PolarHBondContact O-N 2.92Å; Q27-D29 VanDerWaalsContact C-N 3.25Å; Q27-D29 PolarHBondContact O-N 3.34Å; Q27-E30 PolarHBondContact O-N 3Å; Q27-D31 WeakPolarHBondContact O-CB 3.4Å; Q27-D31 PolarHBondContact O-N 3.1Å
28	E	54.8	Low	55.6	Low	119 Å²	119	100 Å²	100	56%	0.556	51%	0.514	S	S	*	.	H	α-helix	trans	-63.6	-32.9	174.6	-78.8	-177.1	-179.7	0	0	111.8	K24 Q32	K24-E28 VanDerWaalsContact O-CB 3.3Å; K24-E28 WeakPolarHBondContact O-CB 3.23Å; K24-E28 WeakPolarHBondContact O-CG 3.41Å; K24-E28 PolarHBondContact O-N 2.73Å; E28-Q32 VanDerWaalsContact O-CG 3.26Å; E28-Q32 WeakPolarHBondContact O-CG 3.42Å; E28-Q32 PolarHBondContact O-N 2.95Å
29	D	57.2	Low	58.5	Low	54 Å²	54	96.9 Å²	96.9	29%	0.289	49%	0.494	S	S	.	.	H	α-helix	trans	-74.8	-33.9	175.6	-140.2	26	0	0	0	111.6	L25 Q27 V33 K417	L25-D29 WeakPolarHBondContact O-CB 3.4Å; L25-D29 PolarHBondContact O-N 2.85Å; Q27-D29 VanDerWaalsContact C-N 3.25Å; Q27-D29 PolarHBondContact O-N 3.34Å; D29-V33 WeakPolarHBondContact O-CG2 3.29Å; D29-K417 WeakPolarHBondContact OD1-CE 3.44Å; D29-K417 IonicContact OD1-NZ 2.76Å; D29-K417 PolarHBondContact OD1-NZ 3.43Å
30	E	58.8	Low	61.2	Low	132 Å²	132	96.5 Å²	96.5	62%	0.617	49%	0.486	S	S	*	.	H	α-helix	trans	-69.3	-42.7	172.1	-81.5	-170.3	166.2	0	0	112.9	D26 Q27 Q32 V33	D26-E30 WeakPolarHBondContact O-CB 3.35Å; D26-E30 WeakPolarHBondContact O-CG 3.4Å; D26-E30 PolarHBondContact O-N 3.33Å; Q27-E30 PolarHBondContact O-N 3Å; E30-Q32 PolarHBondContact O-N 3.03Å; E30-Q32 VanDerWaalsContact O-N 3.16Å; E30-V33 PolarHBondContact O-N 3.49Å; E30-V33 VanDerWaalsContact O-N 3.07Å
31	D	60.8	Low	63.7	Low	148 Å²	148	92.5 Å²	92.5	79%	0.791	47%	0.472	S	S	*	.	H	α-helix	trans	-64.3	-19.2	177.6	-80.9	-20	0	0	0	112.9	Q27	Q27-D31 WeakPolarHBondContact O-CB 3.4Å; Q27-D31 PolarHBondContact O-N 3.1Å
32	Q	62.3	Low	66.5	Low	101 Å²	101	90 Å²	90	47%	0.472	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-10.9	175.9	-73.1	177.1	27.9	0	0	114.5	E28 E30 K34 K417	E28-Q32 VanDerWaalsContact O-CG 3.26Å; E28-Q32 WeakPolarHBondContact O-CG 3.42Å; E28-Q32 PolarHBondContact O-N 2.95Å; E30-Q32 PolarHBondContact O-N 3.03Å; E30-Q32 VanDerWaalsContact O-N 3.16Å; Q32-K34 PolarHBondContact O-N 3.42Å; Q32-K417 VanDerWaalsContact OE1-NZ 3.11Å
33	V	75.6	Confident	69.4	Low	45 Å²	45	93 Å²	93	27%	0.273	47%	0.465	S	S	.	.			trans	-79.5	109	-179.6	175.4	0	0	0	0	109.4	D29 E30 R416	D29-V33 WeakPolarHBondContact O-CG2 3.29Å; E30-V33 PolarHBondContact O-N 3.49Å; E30-V33 VanDerWaalsContact O-N 3.07Å; V33-R416 HydrophobicContact CG1-CB 4.02Å
34	K	75.3	Confident	72.1	Confident	113 Å²	113	87.5 Å²	87.5	49%	0.491	44%	0.44	S	S	.	.			trans	-69.1	145.1	174.9	-67.3	-172.5	-179.3	178.2	0	111.5	Q32 R416 S418	Q32-K34 PolarHBondContact O-N 3.42Å; K34-R416 WeakPolarHBondContact CB-O 3.42Å; K34-R416 PolarHBondContact N-O 3.01Å; K34-S418 PolarHBondContact NZ-OG 2.78Å
35	D	79.1	Confident	75	Confident	160 Å²	160	82.4 Å²	82.4	86%	0.856	42%	0.417	S	S	*	.			trans	-57.7	142.9	168.3	-80.4	-32.1	0	0	0	111.6	G37	D35-G37 PolarHBondContact O-N 3.42Å
36	R	75.7	Confident	77.5	Confident	46 Å²	46	78.6 Å²	78.6	17%	0.174	40%	0.399	C	S	.	.			trans	-59.5	-21.3	-176.4	-167.8	171.6	-173.5	-102.7	-2.3	113.6	S101 G103 S307 Y308 D409	R36-S101 PolarHBondContact NH1-O 3.19Å; R36-G103 VanDerWaalsContact NH2-N 3.11Å; R36-S307 VanDerWaalsContact NH1-C 3.33Å; R36-S307 PolarHBondContact NH1-O 3.48Å; R36-S307 PolarHBondContact NH1-OG 2.87Å; R36-S307 PolarHBondContact NH2-OG 2.87Å; R36-Y308 HydrophobicContact CG-CE1 3.96Å; R36-Y308 WeakPolarHBondContact O-CE1 3.3Å; R36-D409 IonicContact CZ-OD2 3.1Å; R36-D409 VanDerWaalsContact CZ-OD2 3.26Å; R36-D409 IonicContact NE-OD1 3.84Å; R36-D409 PolarHBondContact NE-OD1 3.41Å; R36-D409 VanDerWaalsContact NE-OD1 3.1Å; R36-D409 IonicContact NE-OD2 2.73Å; R36-D409 PolarHBondContact NE-OD2 3.28Å; R36-D409 IonicContact NH2-OD2 2.87Å; R36-D409 PolarHBondContact NH2-OD2 3.49Å
37	G	83.3	Confident	79.5	Confident	32 Å²	32	75.2 Å²	75.2	33%	0.33	38%	0.38	S	S	.	.			trans	77	168.8	-174.5	0	0	0	0	0	112.8	D35	D35-G37 PolarHBondContact O-N 3.42Å
38	Q	91.8	Very high	81.6	Confident	100 Å²	100	69.4 Å²	69.4	47%	0.467	35%	0.353	S	S	.	.			trans	-139.8	164.3	176.6	-70.6	-179.1	-16.4	0	0	108.7	Y308	Q38-Y308 WeakPolarHBondContact CA-O 3.38Å
39	W	92.9	Very high	83.6	Confident	13 Å²	13	63.8 Å²	63.8	5%	0.049	33%	0.327	C	S	.	.			trans	-57.5	136.9	168.2	-63.1	112.7	0	0	0	110.8	S41 E44 F45 S48 V232 T235 L305 Y308	W39-S41 VanDerWaalsContact C-N 3.31Å; W39-E44 HydrophobicContact CE3-CB 3.89Å; W39-E44 HydrophobicContact CZ3-CB 4.49Å; W39-F45 HydrophobicContact CD2-CB 4.16Å; W39-F45 HydrophobicContact CG-CB 3.91Å; W39-F45 AromaticContact NE1-CD2 3.53Å; W39-S48 WeakPolarHBondContact CH2-OG 3.49Å; W39-S48 WeakPolarHBondContact CZ3-OG 3.5Å; W39-V232 HydrophobicContact CD2-CB 4.3Å; W39-V232 HydrophobicContact CE3-CB 3.78Å; W39-V232 HydrophobicContact CE3-CG1 4.37Å; W39-V232 HydrophobicContact CH2-CB 3.83Å; W39-V232 HydrophobicContact CH2-CG1 3.62Å; W39-V232 HydrophobicContact CZ2-CB 4.32Å; W39-V232 HydrophobicContact CZ2-CG1 3.85Å; W39-V232 HydrophobicContact CZ3-CB 3.54Å; W39-V232 HydrophobicContact CZ3-CG1 3.91Å; W39-V232 WeakPolarHBondContact CZ3-O 3.26Å; W39-T235 HydrophobicContact CH2-CG2 4.27Å; W39-T235 HydrophobicContact CZ3-CG2 4.43Å; W39-L305 HydrophobicContact CH2-CD2 4.01Å; W39-L305 HydrophobicContact CZ2-CB 4.49Å; W39-L305 HydrophobicContact CZ2-CD2 3.67Å; W39-L305 PolarHBondContact NE1-O 3.46Å; W39-Y308 VanDerWaalsContact CD1-C 3.45Å; W39-Y308 VanDerWaalsContact CD1-O 3.32Å; W39-Y308 PolarHBondContact N-O 2.73Å
40	N	89.9	Confident	85.5	Confident	86 Å²	86	61.4 Å²	61.4	46%	0.46	32%	0.315	S	S	.	.	S	Bend	trans	-73.5	-31	178.4	-52	-64	0	0	0	111	E44	N40-E44 VanDerWaalsContact CB-OE2 3.25Å; N40-E44 WeakPolarHBondContact CB-OE2 3.42Å; N40-E44 PolarHBondContact N-OE2 3.41Å; N40-E44 PolarHBondContact ND2-OE2 2.82Å
41	S	92.4	Very high	87.2	Confident	42 Å²	42	55.2 Å²	55.2	29%	0.294	29%	0.287	S	S	.	.	S	Bend	trans	-141.6	157.6	176.2	86.7	0	0	0	0	111.9	W39 M43 E44 Y240	W39-S41 VanDerWaalsContact C-N 3.31Å; S41-M43 PolarHBondContact O-N 3.28Å; S41-M43 PolarHBondContact OG-N 3.34Å; S41-E44 WeakPolarHBondContact O-CB 3.46Å; S41-E44 PolarHBondContact O-N 3.11Å; S41-E44 WeakPolarHBondContact OG-CG 3.4Å; S41-E44 PolarHBondContact OG-N 3.07Å; S41-Y240 PolarHBondContact OG-OH 3.22Å
42	K	92.9	Very high	88.8	Confident	103 Å²	103	48.8 Å²	48.8	45%	0.448	25%	0.252	S	S	.	.	H	α-helix	trans	-59.8	-34	174	-174.4	176.1	-177	178.8	0	112.4	E44 F45 V46 D318	K42-E44 VanDerWaalsContact C-N 3.33Å; K42-F45 WeakPolarHBondContact O-CB 3.29Å; K42-F45 PolarHBondContact O-N 3.02Å; K42-V46 HydrophobicContact CG-CG2 4.37Å; K42-V46 WeakPolarHBondContact O-CG2 3.29Å; K42-V46 PolarHBondContact O-N 3.48Å; K42-D318 WeakPolarHBondContact CE-OD1 3.45Å; K42-D318 WeakPolarHBondContact CE-OD2 3.26Å; K42-D318 IonicContact NZ-OD1 3.04Å; K42-D318 PolarHBondContact NZ-OD1 3.06Å; K42-D318 IonicContact NZ-OD2 2.66Å; K42-D318 PolarHBondContact NZ-OD2 3.03Å
43	M	94	Very high	90.3	Very high	99 Å²	99	44 Å²	44	49%	0.488	23%	0.23	S	C	.	.	H	α-helix	trans	-67.5	-34.7	179.3	-172.9	64	77	0	0	111.7	S41 F45 V46 L47 Y240	S41-M43 PolarHBondContact O-N 3.28Å; S41-M43 PolarHBondContact OG-N 3.34Å; M43-F45 VanDerWaalsContact C-N 3.32Å; M43-F45 PolarHBondContact O-N 3.03Å; M43-V46 PolarHBondContact O-N 3.37Å; M43-L47 HydrophobicContact CG-CD1 3.74Å; M43-L47 HydrophobicContact CG-CG 4.05Å; M43-L47 WeakPolarHBondContact O-CB 3.29Å; M43-L47 WeakPolarHBondContact O-CG 3.08Å; M43-L47 PolarHBondContact O-N 3.27Å; M43-L47 HydrophobicContact SD-CD1 4.07Å; M43-L47 HydrophobicContact SD-CD2 4.36Å; M43-L47 HydrophobicContact SD-CG 3.88Å; M43-Y240 HydrophobicContact CG-CE1 3.73Å
44	E	94.5	Very high	91.2	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-60.9	-42.8	174.5	-67.2	-179.8	177.7	0	0	111	W39 N40 S41 K42 S48 G236 K237 Y240	W39-E44 HydrophobicContact CE3-CB 3.89Å; W39-E44 HydrophobicContact CZ3-CB 4.49Å; N40-E44 VanDerWaalsContact CB-OE2 3.25Å; N40-E44 WeakPolarHBondContact CB-OE2 3.42Å; N40-E44 PolarHBondContact N-OE2 3.41Å; N40-E44 PolarHBondContact ND2-OE2 2.82Å; S41-E44 WeakPolarHBondContact O-CB 3.46Å; S41-E44 PolarHBondContact O-N 3.11Å; S41-E44 WeakPolarHBondContact OG-CG 3.4Å; S41-E44 PolarHBondContact OG-N 3.07Å; K42-E44 VanDerWaalsContact C-N 3.33Å; E44-S48 VanDerWaalsContact O-CB 3.26Å; E44-S48 WeakPolarHBondContact O-CB 3.44Å; E44-S48 PolarHBondContact O-N 2.96Å; E44-S48 PolarHBondContact O-OG 2.97Å; E44-G236 WeakPolarHBondContact CG-O 3.13Å; E44-K237 WeakPolarHBondContact OE1-CE 3.5Å; E44-K237 IonicContact OE1-NZ 2.63Å; E44-K237 PolarHBondContact OE1-NZ 3.3Å; E44-Y240 HydrophobicContact CG-CE2 3.84Å
45	F	95.3	Very high	91.9	Very high	1 Å²	1	37.1 Å²	37.1	0%	0.004	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-53.5	173	168.1	-111.9	0	0	0	111.9	W39 K42 M43 L47 S48 V49 V94 L305 N309 D318	W39-F45 HydrophobicContact CD2-CB 4.16Å; W39-F45 HydrophobicContact CG-CB 3.91Å; W39-F45 AromaticContact NE1-CD2 3.53Å; K42-F45 WeakPolarHBondContact O-CB 3.29Å; K42-F45 PolarHBondContact O-N 3.02Å; M43-F45 VanDerWaalsContact C-N 3.32Å; M43-F45 PolarHBondContact O-N 3.03Å; F45-L47 PolarHBondContact O-N 3.09Å; F45-S48 PolarHBondContact O-N 3.44Å; F45-V49 HydrophobicContact CD2-CG2 3.8Å; F45-V49 HydrophobicContact CE2-CG2 3.39Å; F45-V49 HydrophobicContact CZ-CG2 3.79Å; F45-V49 WeakPolarHBondContact O-CG2 3.38Å; F45-V49 PolarHBondContact O-N 3.4Å; F45-V94 HydrophobicContact CZ-CG1 3.9Å; F45-L305 HydrophobicContact CE2-CB 4.32Å; F45-N309 VanDerWaalsContact CD2-OD1 3.24Å; F45-N309 WeakPolarHBondContact CD2-OD1 3.46Å; F45-N309 WeakPolarHBondContact CE2-ND2 3.28Å; F45-N309 VanDerWaalsContact CG-OD1 3.22Å; F45-N309 WeakPolarHBondContact CG-OD1 3.33Å; F45-N309 VanDerWaalsContact CZ-ND2 3.27Å; F45-N309 WeakPolarHBondContact CZ-ND2 3.49Å; F45-D318 HydrophobicContact CE1-CB 4.12Å
46	V	96.6	Very high	92.4	Very high	37 Å²	37	29.6 Å²	29.6	22%	0.224	16%	0.157	C	C	.	.	H	α-helix	trans	-60	-44.7	-176.2	171.1	0	0	0	0	111.3	K42 M43 A50 L322	K42-V46 HydrophobicContact CG-CG2 4.37Å; K42-V46 WeakPolarHBondContact O-CG2 3.29Å; K42-V46 PolarHBondContact O-N 3.48Å; M43-V46 PolarHBondContact O-N 3.37Å; V46-A50 VanDerWaalsContact O-CB 3.25Å; V46-A50 WeakPolarHBondContact O-CB 3.22Å; V46-A50 PolarHBondContact O-N 2.97Å; V46-L322 HydrophobicContact CG1-CD2 4.05Å
47	L	95.9	Very high	93	Very high	26 Å²	26	27.7 Å²	27.7	14%	0.136	15%	0.152	C	C	.	.	H	α-helix	trans	-70.2	-35.1	178.4	-68.4	176.7	0	0	0	112.5	M43 F45 A50 G51 V239 Y240 T244	M43-L47 HydrophobicContact CG-CD1 3.74Å; M43-L47 HydrophobicContact CG-CG 4.05Å; M43-L47 WeakPolarHBondContact O-CB 3.29Å; M43-L47 WeakPolarHBondContact O-CG 3.08Å; M43-L47 PolarHBondContact O-N 3.27Å; M43-L47 HydrophobicContact SD-CD1 4.07Å; M43-L47 HydrophobicContact SD-CD2 4.36Å; M43-L47 HydrophobicContact SD-CG 3.88Å; F45-L47 PolarHBondContact O-N 3.09Å; L47-A50 PolarHBondContact O-N 2.98Å; L47-G51 PolarHBondContact O-N 3.47Å; L47-V239 HydrophobicContact CB-CB 4.13Å; L47-V239 HydrophobicContact CB-CG2 3.83Å; L47-Y240 HydrophobicContact CD1-CD1 3.64Å; L47-Y240 HydrophobicContact CD1-CE1 3.83Å; L47-Y240 HydrophobicContact CD1-CG 4.02Å; L47-T244 HydrophobicContact CD2-CG2 4.32Å
48	S	95.4	Very high	93.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-66	-42.3	175.4	-57.3	0	0	0	0	111.6	W39 E44 F45 G51 E52	W39-S48 WeakPolarHBondContact CH2-OG 3.49Å; W39-S48 WeakPolarHBondContact CZ3-OG 3.5Å; E44-S48 VanDerWaalsContact O-CB 3.26Å; E44-S48 WeakPolarHBondContact O-CB 3.44Å; E44-S48 PolarHBondContact O-N 2.96Å; E44-S48 PolarHBondContact O-OG 2.97Å; F45-S48 PolarHBondContact O-N 3.44Å; S48-G51 PolarHBondContact O-N 3.03Å; S48-E52 PolarHBondContact O-N 2.89Å; S48-E52 VanDerWaalsContact O-N 3.15Å
49	V	96.8	Very high	93.4	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-69	-38.8	175	-178.2	0	0	0	0	111.1	F45 G51 E52 I53 F90 L302 L305 L322	F45-V49 HydrophobicContact CD2-CG2 3.8Å; F45-V49 HydrophobicContact CE2-CG2 3.39Å; F45-V49 HydrophobicContact CZ-CG2 3.79Å; F45-V49 WeakPolarHBondContact O-CG2 3.38Å; F45-V49 PolarHBondContact O-N 3.4Å; V49-G51 VanDerWaalsContact C-N 3.35Å; V49-E52 PolarHBondContact O-N 2.89Å; V49-I53 HydrophobicContact CG1-CD1 4.47Å; V49-I53 HydrophobicContact CG1-CG2 4.23Å; V49-I53 WeakPolarHBondContact O-CG1 3.18Å; V49-I53 WeakPolarHBondContact O-CG2 3.35Å; V49-I53 PolarHBondContact O-N 2.93Å; V49-I53 VanDerWaalsContact O-N 3.09Å; V49-F90 HydrophobicContact CG1-CE1 4.42Å; V49-F90 HydrophobicContact CG1-CE2 4.46Å; V49-F90 HydrophobicContact CG1-CZ 3.6Å; V49-L302 HydrophobicContact CG1-CD2 4.12Å; V49-L305 HydrophobicContact CB-CD1 4.4Å; V49-L305 HydrophobicContact CG2-CB 4.18Å; V49-L305 HydrophobicContact CG2-CD1 3.71Å; V49-L322 HydrophobicContact CB-CD1 3.89Å; V49-L322 HydrophobicContact CB-CD2 4.45Å; V49-L322 HydrophobicContact CG1-CD1 3.68Å; V49-L322 HydrophobicContact CG1-CD2 4.44Å
50	A	96.1	Very high	93.1	Very high	5 Å²	5	22.3 Å²	22.3	4%	0.041	12%	0.118	C	C	.	.	H	α-helix	trans	-62	-42.3	175.2	0	0	0	0	0	111.7	V46 L47 E52 I53 I54 L322 L325	V46-A50 VanDerWaalsContact O-CB 3.25Å; V46-A50 WeakPolarHBondContact O-CB 3.22Å; V46-A50 PolarHBondContact O-N 2.97Å; L47-A50 PolarHBondContact O-N 2.98Å; A50-E52 VanDerWaalsContact C-N 3.33Å; A50-E52 PolarHBondContact O-N 3.32Å; A50-I53 PolarHBondContact O-N 3.25Å; A50-I54 WeakPolarHBondContact O-CB 3.45Å; A50-I54 VanDerWaalsContact O-CG1 3.28Å; A50-I54 WeakPolarHBondContact O-CG1 3.32Å; A50-I54 PolarHBondContact O-N 3.24Å; A50-L322 HydrophobicContact CB-CD2 3.95Å; A50-L325 HydrophobicContact CB-CD2 4.31Å
51	G	93.9	Very high	93.1	Very high	2 Å²	2	21.6 Å²	21.6	2%	0.021	11%	0.109	C	C	.	.	H	α-helix	trans	-63.8	-35.4	176.8	0	0	0	0	0	113.4	L47 S48 V49 D394	L47-G51 PolarHBondContact O-N 3.47Å; S48-G51 PolarHBondContact O-N 3.03Å; V49-G51 VanDerWaalsContact C-N 3.35Å; G51-D394 CarbonylContact O-C 3.24Å; G51-D394 WeakPolarHBondContact O-CB 3.3Å
52	E	94.3	Very high	93.2	Very high	12 Å²	12	19.6 Å²	19.6	6%	0.056	10%	0.095	C	C	.	.	H	α-helix	trans	-66.7	-51.2	174.8	172.4	61.8	179.4	0	0	112.2	S48 V49 A50 I54 A296 C301 S395 V398	S48-E52 PolarHBondContact O-N 2.89Å; S48-E52 VanDerWaalsContact O-N 3.15Å; V49-E52 PolarHBondContact O-N 2.89Å; A50-E52 VanDerWaalsContact C-N 3.33Å; A50-E52 PolarHBondContact O-N 3.32Å; E52-I54 VanDerWaalsContact C-N 3.33Å; E52-I54 PolarHBondContact O-N 2.98Å; E52-A296 HydrophobicContact CG-CB 3.82Å; E52-A296 WeakPolarHBondContact OE1-CB 3.44Å; E52-C301 HydrophobicContact CG-CB 4.37Å; E52-C301 PolarHBondContact OE1-SG 3.32Å; E52-C301 VanDerWaalsContact OE1-SG 3.39Å; E52-S395 PolarHBondContact O-OG 3.22Å; E52-S395 VanDerWaalsContact OE2-CA 3.27Å; E52-S395 WeakPolarHBondContact OE2-CA 3.31Å; E52-V398 HydrophobicContact CB-CB 4.16Å; E52-V398 HydrophobicContact CB-CG1 3.97Å; E52-V398 HydrophobicContact CB-CG2 4.13Å; E52-V398 HydrophobicContact CG-CB 4.39Å; E52-V398 HydrophobicContact CG-CG1 3.83Å; E52-V398 WeakPolarHBondContact OE2-CB 3.1Å
53	I	94.9	Very high	93.3	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-82	-17.9	-169.9	75.1	-172.9	0	0	0	111.8	V49 A50 N58 F90 S294 L302 L322 N326	V49-I53 HydrophobicContact CG1-CD1 4.47Å; V49-I53 HydrophobicContact CG1-CG2 4.23Å; V49-I53 WeakPolarHBondContact O-CG1 3.18Å; V49-I53 WeakPolarHBondContact O-CG2 3.35Å; V49-I53 PolarHBondContact O-N 2.93Å; V49-I53 VanDerWaalsContact O-N 3.09Å; A50-I53 PolarHBondContact O-N 3.25Å; I53-N58 PolarHBondContact O-OD1 3.13Å; I53-F90 HydrophobicContact CD1-CE2 4.38Å; I53-F90 HydrophobicContact CD1-CZ 4.35Å; I53-F90 HydrophobicContact CG2-CE2 3.8Å; I53-F90 HydrophobicContact CG2-CZ 4.32Å; I53-S294 CarbonylContact C-O 3.29Å; I53-L302 HydrophobicContact CG2-CD2 4.47Å; I53-L322 HydrophobicContact CD1-CB 3.99Å; I53-L322 HydrophobicContact CD1-CD2 4.35Å; I53-N326 HydrophobicContact CD1-CB 3.87Å; I53-N326 HydrophobicContact CG1-CB 4.03Å; I53-N326 PolarHBondContact O-OD1 3.3Å
54	I	93.6	Very high	93.1	Very high	9 Å²	9	12.8 Å²	12.8	5%	0.046	6%	0.062	C	C	.	.	S	Bend	trans	-111.2	83.4	-179.5	-54.7	178.1	0	0	0	108.3	A50 E52 N58 Y247 L325 N326 T329 L391	A50-I54 WeakPolarHBondContact O-CB 3.45Å; A50-I54 VanDerWaalsContact O-CG1 3.28Å; A50-I54 WeakPolarHBondContact O-CG1 3.32Å; A50-I54 PolarHBondContact O-N 3.24Å; E52-I54 VanDerWaalsContact C-N 3.33Å; E52-I54 PolarHBondContact O-N 2.98Å; I54-N58 WeakPolarHBondContact CA-OD1 3.31Å; I54-Y247 WeakPolarHBondContact CD1-OH 3.04Å; I54-L325 HydrophobicContact CD1-CD2 4.15Å; I54-L325 HydrophobicContact CD1-CG 3.89Å; I54-N326 HydrophobicContact CG1-CB 4.41Å; I54-T329 HydrophobicContact CG2-CG2 3.6Å; I54-L391 HydrophobicContact CG2-CD2 4.47Å; I54-L391 WeakPolarHBondContact O-CD2 3.43Å
55	G	90.3	Very high	93	Very high	4 Å²	4	13.3 Å²	13.3	4%	0.041	7%	0.065	C	C	.	.	S	Bend	trans	-118.8	-158.7	-178.5	0	0	0	0	0	112.5	G57 N58	G55-G57 PolarHBondContact O-N 2.88Å; G55-N58 PolarHBondContact N-OD1 2.98Å; G55-N58 PolarHBondContact O-N 3.37Å; G55-N58 PolarHBondContact O-OD1 3.41Å
56	L	89.1	Confident	93	Very high	2 Å²	2	13.3 Å²	13.3	1%	0.01	6%	0.064	C	C	.	.	H	α-helix	trans	-58.3	-36.7	179.6	-61.1	169	0	0	0	111.9	N58 V59 W60 Y133 I136 L388 L391	L56-N58 PolarHBondContact O-N 3.32Å; L56-N58 VanDerWaalsContact O-N 3.15Å; L56-V59 PolarHBondContact O-N 3.47Å; L56-W60 VanDerWaalsContact C-NE1 3.35Å; L56-W60 HydrophobicContact CB-CD2 4.17Å; L56-W60 HydrophobicContact CB-CH2 4.35Å; L56-W60 HydrophobicContact CB-CZ2 3.66Å; L56-W60 HydrophobicContact CD1-CH2 3.94Å; L56-W60 HydrophobicContact CD1-CZ2 3.84Å; L56-W60 HydrophobicContact CG-CZ2 4.36Å; L56-W60 PolarHBondContact O-N 3.37Å; L56-W60 PolarHBondContact O-NE1 3.32Å; L56-Y133 HydrophobicContact CD1-CE2 4.26Å; L56-I136 HydrophobicContact CD1-CB 4.1Å; L56-I136 HydrophobicContact CD1-CD1 3.8Å; L56-I136 HydrophobicContact CD1-CG2 3.52Å; L56-L388 HydrophobicContact CD2-CB 4.34Å; L56-L388 HydrophobicContact CD2-CD2 3.54Å; L56-L391 HydrophobicContact CD2-CB 4.21Å
57	G	89.1	Confident	92.8	Very high	6 Å²	6	14.1 Å²	14.1	6%	0.062	6%	0.064	C	C	.	.	H	α-helix	trans	-53.7	-34	178.8	0	0	0	0	0	114.2	G55 V59 R61 F62	G55-G57 PolarHBondContact O-N 2.88Å; G57-V59 VanDerWaalsContact C-N 3.33Å; G57-R61 WeakPolarHBondContact O-CB 3.34Å; G57-R61 PolarHBondContact O-N 2.95Å; G57-F62 PolarHBondContact O-N 2.81Å
58	N	93.4	Very high	92.6	Very high	3 Å²	3	16.6 Å²	16.6	2%	0.016	7%	0.074	C	C	.	.	H	α-helix	trans	-69.2	-33.2	178.3	-58.7	73.6	0	0	0	112.2	I53 I54 G55 L56 P63 N326 S330	I53-N58 PolarHBondContact O-OD1 3.13Å; I54-N58 WeakPolarHBondContact CA-OD1 3.31Å; G55-N58 PolarHBondContact N-OD1 2.98Å; G55-N58 PolarHBondContact O-N 3.37Å; G55-N58 PolarHBondContact O-OD1 3.41Å; L56-N58 PolarHBondContact O-N 3.32Å; L56-N58 VanDerWaalsContact O-N 3.15Å; N58-P63 WeakPolarHBondContact O-CD 3.34Å; N58-N326 PolarHBondContact ND2-OD1 2.99Å; N58-S330 PolarHBondContact ND2-OG 3.2Å
59	V	89.6	Confident	92.6	Very high	6 Å²	6	16.6 Å²	16.6	4%	0.036	7%	0.074	C	C	.	.	H	α-helix	trans	-89.3	-47.2	-176.5	-176	0	0	0	0	111.1	L56 G57 P63 L250 A333 V337 L391	L56-V59 PolarHBondContact O-N 3.47Å; G57-V59 VanDerWaalsContact C-N 3.33Å; V59-P63 WeakPolarHBondContact O-CD 3.38Å; V59-P63 VanDerWaalsContact O-CG 3.3Å; V59-P63 WeakPolarHBondContact O-CG 3.46Å; V59-L250 HydrophobicContact CG2-CD2 4.49Å; V59-A333 HydrophobicContact CG2-CB 4.26Å; V59-V337 HydrophobicContact CG1-CG2 4.18Å; V59-V337 VanDerWaalsContact O-CG2 3.25Å; V59-V337 WeakPolarHBondContact O-CG2 3.49Å; V59-L391 HydrophobicContact CG2-CD1 3.9Å
60	W	86	Confident	92.4	Very high	24 Å²	24	17 Å²	17	9%	0.091	8%	0.077	C	C	.	.	H	α-helix	trans	-105.1	-11.3	-168.9	67.6	3	0	0	0	116.3	L56 I136 P360 L362 A363 F364	L56-W60 VanDerWaalsContact C-NE1 3.35Å; L56-W60 HydrophobicContact CB-CD2 4.17Å; L56-W60 HydrophobicContact CB-CH2 4.35Å; L56-W60 HydrophobicContact CB-CZ2 3.66Å; L56-W60 HydrophobicContact CD1-CH2 3.94Å; L56-W60 HydrophobicContact CD1-CZ2 3.84Å; L56-W60 HydrophobicContact CG-CZ2 4.36Å; L56-W60 PolarHBondContact O-N 3.37Å; L56-W60 PolarHBondContact O-NE1 3.32Å; W60-I136 HydrophobicContact CH2-CD1 3.71Å; W60-I136 HydrophobicContact CH2-CG1 4.05Å; W60-I136 HydrophobicContact CH2-CG2 3.71Å; W60-I136 HydrophobicContact CZ2-CD1 3.83Å; W60-I136 HydrophobicContact CZ3-CG2 4.24Å; W60-P360 HydrophobicContact CH2-CG 4.3Å; W60-P360 HydrophobicContact CZ3-CB 4.37Å; W60-P360 HydrophobicContact CZ3-CG 4.43Å; W60-L362 HydrophobicContact CB-CB 4.28Å; W60-L362 HydrophobicContact CB-CD2 3.93Å; W60-L362 HydrophobicContact CB-CG 4.38Å; W60-L362 WeakPolarHBondContact O-CD2 3.34Å; W60-A363 HydrophobicContact CE3-CB 3.49Å; W60-A363 VanDerWaalsContact CE3-CB 3.49Å; W60-A363 HydrophobicContact CZ3-CB 3.83Å; W60-F364 HydrophobicContact CZ3-CE2 4.06Å
61	R	90.9	Very high	92.3	Very high	70 Å²	70	16.8 Å²	16.8	26%	0.264	8%	0.076	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-52.3	-173.6	-174.6	-179.2	176.5	149.7	0.8	110.3	G57 Y64 L65	G57-R61 WeakPolarHBondContact O-CB 3.34Å; G57-R61 PolarHBondContact O-N 2.95Å; R61-Y64 PolarHBondContact O-N 2.63Å; R61-L65 HydrophobicContact CG-CD1 4.01Å; R61-L65 HydrophobicContact CG-CG 4.29Å; R61-L65 WeakPolarHBondContact O-CG 3.4Å; R61-L65 PolarHBondContact O-N 3.09Å
62	F	94.6	Very high	92.4	Very high	1 Å²	1	17.7 Å²	17.7	0%	0.004	9%	0.085	C	C	.	.	H	α-helix	trans	-56.1	-48.3	180	175.9	-94.5	0	0	0	113.3	G57 Y64 L65 C66 F74 F75 Y78 Y270 Q290 S330	G57-F62 PolarHBondContact O-N 2.81Å; F62-Y64 VanDerWaalsContact C-N 3.34Å; F62-Y64 PolarHBondContact O-N 3.34Å; F62-L65 PolarHBondContact O-N 2.7Å; F62-C66 WeakPolarHBondContact O-CB 3.19Å; F62-C66 PolarHBondContact O-N 3.48Å; F62-F74 HydrophobicContact CE2-CE1 4.27Å; F62-F75 HydrophobicContact CE1-CE1 4.42Å; F62-F75 HydrophobicContact CE1-CZ 4.46Å; F62-F75 AromaticContact CZ-CE1 3.75Å; F62-F75 HydrophobicContact CZ-CE1 3.75Å; F62-F75 HydrophobicContact CZ-CZ 4.13Å; F62-Y78 HydrophobicContact CD2-CD2 4.35Å; F62-Y78 AromaticContact CD2-CE2 3.81Å; F62-Y78 HydrophobicContact CD2-CE2 3.81Å; F62-Y78 HydrophobicContact CE2-CD1 4.39Å; F62-Y78 AromaticContact CE2-CD2 3.74Å; F62-Y78 HydrophobicContact CE2-CD2 3.74Å; F62-Y78 HydrophobicContact CE2-CE1 4.13Å; F62-Y78 AromaticContact CE2-CE2 3.41Å; F62-Y78 HydrophobicContact CE2-CE2 3.41Å; F62-Y78 VanDerWaalsContact CE2-CE2 3.41Å; F62-Y78 HydrophobicContact CE2-CG 4.21Å; F62-Y78 AromaticContact CE2-CZ 3.62Å; F62-Y270 WeakPolarHBondContact CE1-OH 3.45Å; F62-Q290 HydrophobicContact CD2-CG 4.04Å; F62-S330 VanDerWaalsContact CD1-CB 3.46Å; F62-S330 VanDerWaalsContact CD1-O 3.26Å; F62-S330 WeakPolarHBondContact CD1-O 3.3Å
63	P	94.3	Very high	92.5	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-63.1	-42.4	-179.6	-27.8	41.6	0	0	0	112.2	N58 V59 C66 Y67 V337 F338	N58-P63 WeakPolarHBondContact O-CD 3.34Å; V59-P63 WeakPolarHBondContact O-CD 3.38Å; V59-P63 VanDerWaalsContact O-CG 3.3Å; V59-P63 WeakPolarHBondContact O-CG 3.46Å; P63-C66 WeakPolarHBondContact O-CB 3.45Å; P63-C66 PolarHBondContact O-N 2.86Å; P63-Y67 PolarHBondContact O-N 2.91Å; P63-V337 HydrophobicContact CB-CB 4.25Å; P63-V337 HydrophobicContact CB-CG1 4.31Å; P63-V337 HydrophobicContact CB-CG2 4.45Å; P63-V337 HydrophobicContact CG-CB 4.46Å; P63-V337 HydrophobicContact CG-CG2 4.19Å; P63-F338 HydrophobicContact CB-CD2 3.9Å; P63-F338 HydrophobicContact CB-CE2 3.58Å; P63-F338 VanDerWaalsContact O-CE2 3.28Å; P63-F338 WeakPolarHBondContact O-CE2 3.16Å
64	Y	91.2	Very high	92.6	Very high	58 Å²	58	17.1 Å²	17.1	23%	0.227	8%	0.082	C	C	.	.	H	α-helix	trans	-60.8	-45.5	176.7	176.2	-94	0	0	0	111.8	R61 F62 C66 Y67 K68 A356 E357	R61-Y64 PolarHBondContact O-N 2.63Å; F62-Y64 VanDerWaalsContact C-N 3.34Å; F62-Y64 PolarHBondContact O-N 3.34Å; Y64-C66 VanDerWaalsContact C-N 3.35Å; Y64-C66 PolarHBondContact O-N 2.97Å; Y64-Y67 PolarHBondContact O-N 3.18Å; Y64-K68 HydrophobicContact CE1-CB 4.35Å; Y64-K68 HydrophobicContact CE1-CD 3.84Å; Y64-K68 WeakPolarHBondContact O-CB 3.4Å; Y64-K68 PolarHBondContact O-N 3.33Å; Y64-A356 WeakPolarHBondContact CE2-O 3.48Å; Y64-E357 WeakPolarHBondContact CD2-O 2.86Å
65	L	92.6	Very high	92.7	Very high	13 Å²	13	17.9 Å²	17.9	7%	0.068	9%	0.086	C	C	.	.	H	α-helix	trans	-63.3	-40.4	177.2	-70.8	-178.6	0	0	0	112.1	R61 F62 K68 N69 F74 D286 Q290	R61-L65 HydrophobicContact CG-CD1 4.01Å; R61-L65 HydrophobicContact CG-CG 4.29Å; R61-L65 WeakPolarHBondContact O-CG 3.4Å; R61-L65 PolarHBondContact O-N 3.09Å; F62-L65 PolarHBondContact O-N 2.7Å; L65-K68 PolarHBondContact O-N 2.9Å; L65-N69 WeakPolarHBondContact O-CB 3.5Å; L65-N69 PolarHBondContact O-N 2.9Å; L65-N69 PolarHBondContact O-ND2 3.13Å; L65-F74 HydrophobicContact CB-CE1 4.26Å; L65-F74 HydrophobicContact CB-CZ 4.07Å; L65-D286 HydrophobicContact CD2-CB 4.15Å; L65-Q290 HydrophobicContact CD1-CB 3.87Å; L65-Q290 HydrophobicContact CD1-CG 4.14Å
66	C	94.8	Very high	93	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-57.3	-52.3	175.1	-172.2	0	0	0	0	110.7	F62 P63 Y64 N69 G71 F74 F75 Y270	F62-C66 WeakPolarHBondContact O-CB 3.19Å; F62-C66 PolarHBondContact O-N 3.48Å; P63-C66 WeakPolarHBondContact O-CB 3.45Å; P63-C66 PolarHBondContact O-N 2.86Å; Y64-C66 VanDerWaalsContact C-N 3.35Å; Y64-C66 PolarHBondContact O-N 2.97Å; C66-N69 PolarHBondContact O-N 3.39Å; C66-G71 WeakPolarHBondContact O-CA 3.26Å; C66-G71 PolarHBondContact O-N 2.96Å; C66-G71 PolarHBondContact SG-O 2.86Å; C66-G71 VanDerWaalsContact SG-O 3.37Å; C66-F74 HydrophobicContact CB-CD1 4.08Å; C66-F75 VanDerWaalsContact SG-CE2 3.56Å; C66-Y270 HydrophobicContact CB-CD2 4.03Å; C66-Y270 HydrophobicContact CB-CE2 3.56Å; C66-Y270 WeakPolarHBondContact SG-CE2 3.37Å; C66-Y270 PolarHBondContact SG-O 2.95Å
67	Y	92.4	Very high	93.4	Very high	54 Å²	54	21.4 Å²	21.4	21%	0.212	10%	0.102	C	C	.	.	H	α-helix	trans	-58.8	-52.6	177	161.9	-108.4	0	0	0	113.1	P63 Y64 N69 G70 Y269 F338 S353 A356	P63-Y67 PolarHBondContact O-N 2.91Å; Y64-Y67 PolarHBondContact O-N 3.18Å; Y67-N69 PolarHBondContact O-N 3.38Å; Y67-G70 PolarHBondContact O-N 2.9Å; Y67-Y269 HydrophobicContact CD2-CD1 4.42Å; Y67-Y269 AromaticContact CE2-CD1 3.81Å; Y67-Y269 HydrophobicContact CE2-CD1 3.81Å; Y67-F338 HydrophobicContact CD1-CE1 4.47Å; Y67-F338 HydrophobicContact CD1-CZ 4.26Å; Y67-F338 AromaticContact CD2-CE1 3.97Å; Y67-F338 HydrophobicContact CD2-CE1 3.97Å; Y67-F338 HydrophobicContact CD2-CZ 4.36Å; Y67-F338 AromaticContact CG-CE1 3.78Å; Y67-F338 HydrophobicContact CG-CE1 3.78Å; Y67-F338 AromaticContact CG-CZ 3.72Å; Y67-F338 HydrophobicContact CG-CZ 3.72Å; Y67-S353 VanDerWaalsContact OH-CA 3.29Å; Y67-S353 WeakPolarHBondContact OH-CA 3.35Å; Y67-S353 VanDerWaalsContact OH-CB 3.25Å; Y67-S353 WeakPolarHBondContact OH-CB 3.47Å; Y67-A356 HydrophobicContact CD1-CB 4.31Å; Y67-A356 HydrophobicContact CE1-CB 4Å
68	K	91.7	Very high	93.7	Very high	79 Å²	79	21.1 Å²	21.1	34%	0.343	10%	0.1	S	C	.	.	H	α-helix	trans	-59.1	-33	-179	178.2	-170.3	166.7	-151	0	112.8	Y64 L65 R277 D286	Y64-K68 HydrophobicContact CE1-CB 4.35Å; Y64-K68 HydrophobicContact CE1-CD 3.84Å; Y64-K68 WeakPolarHBondContact O-CB 3.4Å; Y64-K68 PolarHBondContact O-N 3.33Å; L65-K68 PolarHBondContact O-N 2.9Å; K68-R277 PolarHBondContact O-NE 2.97Å; K68-R277 PolarHBondContact O-NH2 3.38Å; K68-R277 VanDerWaalsContact O-NH2 3.15Å; K68-D286 IonicContact NZ-OD2 3.47Å; K68-D286 PolarHBondContact NZ-OD2 2.73Å
69	N	94.4	Very high	93.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	29	-169.8	-65.9	-39.6	0	0	0	113.9	L65 C66 Y67 F74 R277 V283 D286	L65-N69 WeakPolarHBondContact O-CB 3.5Å; L65-N69 PolarHBondContact O-N 2.9Å; L65-N69 PolarHBondContact O-ND2 3.13Å; C66-N69 PolarHBondContact O-N 3.39Å; Y67-N69 PolarHBondContact O-N 3.38Å; N69-F74 HydrophobicContact CB-CB 4.31Å; N69-F74 HydrophobicContact CB-CD2 3.44Å; N69-F74 VanDerWaalsContact CB-CD2 3.44Å; N69-F74 HydrophobicContact CB-CE2 4Å; N69-F74 HydrophobicContact CB-CG 4.1Å; N69-R277 PolarHBondContact OD1-NH2 3.31Å; N69-V283 HydrophobicContact CB-CB 4.36Å; N69-V283 HydrophobicContact CB-CG1 4.05Å; N69-V283 HydrophobicContact CB-CG2 3.94Å; N69-D286 WeakPolarHBondContact ND2-CB 3.33Å; N69-D286 PolarHBondContact ND2-OD2 3.2Å
70	G	93.4	Very high	94.2	Very high	7 Å²	7	28.3 Å²	28.3	7%	0.072	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.2	26.9	171.3	0	0	0	0	0	114.4	Y67 G72 A73 P273 D274	Y67-G70 PolarHBondContact O-N 2.9Å; G70-G72 PolarHBondContact O-N 3.35Å; G70-A73 WeakPolarHBondContact O-CB 3.38Å; G70-A73 PolarHBondContact O-N 2.85Å; G70-P273 WeakPolarHBondContact O-CA 3.25Å; G70-D274 PolarHBondContact O-N 3.4Å
71	G	94.6	Very high	94.7	Very high	2 Å²	2	27.2 Å²	27.2	2%	0.021	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	54.2	-121.9	176.7	0	0	0	0	0	111.5	C66 A73 F74 Y270	C66-G71 WeakPolarHBondContact O-CA 3.26Å; C66-G71 PolarHBondContact O-N 2.96Å; C66-G71 PolarHBondContact SG-O 2.86Å; C66-G71 VanDerWaalsContact SG-O 3.37Å; G71-A73 PolarHBondContact O-N 3.03Å; G71-F74 VanDerWaalsContact O-CB 3.28Å; G71-F74 WeakPolarHBondContact O-CB 3.4Å; G71-F74 PolarHBondContact O-N 2.96Å; G71-Y270 CarbonylContact C-O 3.52Å; G71-Y270 VanDerWaalsContact CA-O 3.25Å; G71-Y270 WeakPolarHBondContact CA-O 3.13Å
72	G	94.8	Very high	95	Very high	20 Å²	20	23.9 Å²	23.9	21%	0.206	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-56.3	-24.1	179.6	0	0	0	0	0	115	G70 F74 F75 L271	G70-G72 PolarHBondContact O-N 3.35Å; G72-F74 VanDerWaalsContact C-N 3.28Å; G72-F74 PolarHBondContact O-N 2.97Å; G72-F75 WeakPolarHBondContact O-CD2 3.49Å; G72-F75 PolarHBondContact O-N 3.39Å; G72-L271 WeakPolarHBondContact CA-O 3.48Å; G72-L271 PolarHBondContact N-O 2.99Å
73	A	96.8	Very high	95.1	Very high	1 Å²	1	28 Å²	28	1%	0.008	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-68	-29.5	177.6	0	0	0	0	0	112.3	G70 G71 F75 I76 P77 P273 D274 L275 L278	G70-A73 WeakPolarHBondContact O-CB 3.38Å; G70-A73 PolarHBondContact O-N 2.85Å; G71-A73 PolarHBondContact O-N 3.03Å; A73-F75 PolarHBondContact O-N 3.23Å; A73-I76 PolarHBondContact O-N 3.21Å; A73-I76 VanDerWaalsContact O-N 3.11Å; A73-P77 WeakPolarHBondContact O-CD 3.41Å; A73-P273 HydrophobicContact CB-CB 4.37Å; A73-D274 WeakPolarHBondContact CB-O 3.16Å; A73-L275 HydrophobicContact CB-CD2 4.05Å; A73-L278 HydrophobicContact CB-CD2 4.36Å; A73-L278 HydrophobicContact CB-CG 4.29Å
74	F	97.1	Very high	95.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-61.2	-24.8	-179.7	-178.7	-111.6	0	0	0	113.3	F62 L65 C66 N69 G71 G72 I76 P77 Y78 V283 D286 A287	F62-F74 HydrophobicContact CE2-CE1 4.27Å; L65-F74 HydrophobicContact CB-CE1 4.26Å; L65-F74 HydrophobicContact CB-CZ 4.07Å; C66-F74 HydrophobicContact CB-CD1 4.08Å; N69-F74 HydrophobicContact CB-CB 4.31Å; N69-F74 HydrophobicContact CB-CD2 3.44Å; N69-F74 VanDerWaalsContact CB-CD2 3.44Å; N69-F74 HydrophobicContact CB-CE2 4Å; N69-F74 HydrophobicContact CB-CG 4.1Å; G71-F74 VanDerWaalsContact O-CB 3.28Å; G71-F74 WeakPolarHBondContact O-CB 3.4Å; G71-F74 PolarHBondContact O-N 2.96Å; G72-F74 VanDerWaalsContact C-N 3.28Å; G72-F74 PolarHBondContact O-N 2.97Å; F74-I76 PolarHBondContact O-N 2.97Å; F74-P77 HydrophobicContact CD2-CG 4.46Å; F74-P77 WeakPolarHBondContact O-CD 3.43Å; F74-P77 VanDerWaalsContact O-CG 3.29Å; F74-P77 WeakPolarHBondContact O-CG 3.21Å; F74-Y78 HydrophobicContact CE1-CD2 4.23Å; F74-Y78 VanDerWaalsContact O-CB 3.31Å; F74-Y78 WeakPolarHBondContact O-CB 3.42Å; F74-Y78 PolarHBondContact O-N 2.64Å; F74-Y78 VanDerWaalsContact O-N 3.1Å; F74-V283 HydrophobicContact CD2-CG1 4.02Å; F74-D286 HydrophobicContact CE2-CB 4.33Å; F74-A287 HydrophobicContact CD2-CB 4.48Å; F74-A287 HydrophobicContact CE2-CB 3.69Å; F74-A287 HydrophobicContact CZ-CB 3.97Å
75	F	96.3	Very high	95.4	Very high	26 Å²	26	26.4 Å²	26.4	11%	0.114	13%	0.131	C	C	.	.	H	α-helix	trans	-63.8	-25.4	176.8	-72.7	-79.9	0	0	0	113.3	F62 C66 G72 A73 F79 L271 F331	F62-F75 HydrophobicContact CE1-CE1 4.42Å; F62-F75 HydrophobicContact CE1-CZ 4.46Å; F62-F75 AromaticContact CZ-CE1 3.75Å; F62-F75 HydrophobicContact CZ-CE1 3.75Å; F62-F75 HydrophobicContact CZ-CZ 4.13Å; C66-F75 VanDerWaalsContact SG-CE2 3.56Å; G72-F75 WeakPolarHBondContact O-CD2 3.49Å; G72-F75 PolarHBondContact O-N 3.39Å; A73-F75 PolarHBondContact O-N 3.23Å; F75-F79 HydrophobicContact CB-CD2 3.97Å; F75-F79 HydrophobicContact CB-CE2 3.81Å; F75-F79 AromaticContact CD1-CE2 3.82Å; F75-F79 HydrophobicContact CD1-CE2 3.82Å; F75-F79 HydrophobicContact CD1-CZ 4.01Å; F75-F79 HydrophobicContact CG-CE2 4.2Å; F75-F79 WeakPolarHBondContact O-CB 3.3Å; F75-F79 WeakPolarHBondContact O-CD2 3.32Å; F75-F79 WeakPolarHBondContact O-CG 3.46Å; F75-F79 PolarHBondContact O-N 3.39Å; F75-L271 HydrophobicContact CE2-CD2 3.99Å; F75-L271 HydrophobicContact CZ-CD2 4.46Å; F75-F331 AromaticContact CE1-CD2 3.74Å; F75-F331 HydrophobicContact CE1-CD2 3.74Å; F75-F331 HydrophobicContact CE1-CE2 4.18Å; F75-F331 HydrophobicContact CE2-CE2 4.38Å; F75-F331 AromaticContact CZ-CD2 3.51Å; F75-F331 HydrophobicContact CZ-CD2 3.51Å; F75-F331 AromaticContact CZ-CE2 3.72Å; F75-F331 HydrophobicContact CZ-CE2 3.72Å
76	I	96.8	Very high	95.6	Very high	79 Å²	79	25.8 Å²	25.8	41%	0.405	13%	0.127	S	C	.	.	H	α-helix	trans	-62.7	-61.3	177.7	-65.4	164.4	0	0	0	110.9	A73 F74 Y78 F79 I80 L275 L278	A73-I76 PolarHBondContact O-N 3.21Å; A73-I76 VanDerWaalsContact O-N 3.11Å; F74-I76 PolarHBondContact O-N 2.97Å; I76-Y78 VanDerWaalsContact C-N 3.3Å; I76-Y78 PolarHBondContact O-N 3.25Å; I76-F79 PolarHBondContact O-N 3.37Å; I76-I80 HydrophobicContact CG2-CD1 4.15Å; I76-I80 WeakPolarHBondContact O-CG1 3.43Å; I76-I80 PolarHBondContact O-N 2.94Å; I76-I80 VanDerWaalsContact O-N 3.13Å; I76-L275 HydrophobicContact CD1-CD2 4.31Å; I76-L278 HydrophobicContact CD1-CD1 3.84Å
77	P	96	Very high	95.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.2	-37.2	176.4	24	-32.9	0	0	0	111.7	A73 F74 F79 I80 F81 L278 V283 W284 A287	A73-P77 WeakPolarHBondContact O-CD 3.41Å; F74-P77 HydrophobicContact CD2-CG 4.46Å; F74-P77 WeakPolarHBondContact O-CD 3.43Å; F74-P77 VanDerWaalsContact O-CG 3.29Å; F74-P77 WeakPolarHBondContact O-CG 3.21Å; P77-F79 PolarHBondContact O-N 3.42Å; P77-I80 PolarHBondContact O-N 3.48Å; P77-F81 WeakPolarHBondContact O-CD2 3.14Å; P77-F81 PolarHBondContact O-N 3.02Å; P77-L278 HydrophobicContact CG-CD2 4.11Å; P77-V283 HydrophobicContact CG-CG1 3.77Å; P77-W284 HydrophobicContact CB-CD2 3.76Å; P77-W284 HydrophobicContact CB-CE3 3.54Å; P77-W284 HydrophobicContact CB-CG 4.34Å; P77-W284 HydrophobicContact CB-CH2 4.22Å; P77-W284 HydrophobicContact CB-CZ2 4.41Å; P77-W284 HydrophobicContact CB-CZ3 3.79Å; P77-A287 HydrophobicContact CB-CB 3.8Å; P77-A287 HydrophobicContact CG-CB 4.17Å
78	Y	96.9	Very high	96	Very high	1 Å²	1	24 Å²	24	0%	0.004	12%	0.121	C	C	.	.	H	α-helix	trans	-57.6	-48.8	177.1	-177.3	-93.8	0	0	0	112.5	F62 F74 I76 I80 F81 F82 Q290 I291 S327	F62-Y78 HydrophobicContact CD2-CD2 4.35Å; F62-Y78 AromaticContact CD2-CE2 3.81Å; F62-Y78 HydrophobicContact CD2-CE2 3.81Å; F62-Y78 HydrophobicContact CE2-CD1 4.39Å; F62-Y78 AromaticContact CE2-CD2 3.74Å; F62-Y78 HydrophobicContact CE2-CD2 3.74Å; F62-Y78 HydrophobicContact CE2-CE1 4.13Å; F62-Y78 AromaticContact CE2-CE2 3.41Å; F62-Y78 HydrophobicContact CE2-CE2 3.41Å; F62-Y78 VanDerWaalsContact CE2-CE2 3.41Å; F62-Y78 HydrophobicContact CE2-CG 4.21Å; F62-Y78 AromaticContact CE2-CZ 3.62Å; F74-Y78 HydrophobicContact CE1-CD2 4.23Å; F74-Y78 VanDerWaalsContact O-CB 3.31Å; F74-Y78 WeakPolarHBondContact O-CB 3.42Å; F74-Y78 PolarHBondContact O-N 2.64Å; F74-Y78 VanDerWaalsContact O-N 3.1Å; I76-Y78 VanDerWaalsContact C-N 3.3Å; I76-Y78 PolarHBondContact O-N 3.25Å; Y78-I80 PolarHBondContact O-N 3.27Å; Y78-F81 PolarHBondContact O-N 3.34Å; Y78-F82 WeakPolarHBondContact O-CB 3.36Å; Y78-F82 PolarHBondContact O-N 2.85Å; Y78-Q290 HydrophobicContact CE2-CG 4.13Å; Y78-I291 HydrophobicContact CD1-CD1 4.43Å; Y78-I291 HydrophobicContact CD2-CD1 3.84Å; Y78-I291 HydrophobicContact CD2-CG1 4.04Å; Y78-I291 HydrophobicContact CE1-CD1 3.99Å; Y78-I291 HydrophobicContact CE2-CD1 3.32Å; Y78-I291 HydrophobicContact CE2-CG1 3.9Å; Y78-I291 HydrophobicContact CG-CD1 4.37Å; Y78-I291 VanDerWaalsContact CZ-CD1 3.42Å; Y78-S327 WeakPolarHBondContact OH-CB 3.21Å; Y78-S327 PolarHBondContact OH-OG 3.43Å
79	F	96.7	Very high	96.3	Very high	93 Å²	93	20.2 Å²	20.2	41%	0.408	11%	0.105	S	C	.	.	H	α-helix	trans	-70.2	-30.4	179.3	-73.6	-50.3	0	0	0	113.1	F75 I76 P77 F82 F83	F75-F79 HydrophobicContact CB-CD2 3.97Å; F75-F79 HydrophobicContact CB-CE2 3.81Å; F75-F79 AromaticContact CD1-CE2 3.82Å; F75-F79 HydrophobicContact CD1-CE2 3.82Å; F75-F79 HydrophobicContact CD1-CZ 4.01Å; F75-F79 HydrophobicContact CG-CE2 4.2Å; F75-F79 WeakPolarHBondContact O-CB 3.3Å; F75-F79 WeakPolarHBondContact O-CD2 3.32Å; F75-F79 WeakPolarHBondContact O-CG 3.46Å; F75-F79 PolarHBondContact O-N 3.39Å; I76-F79 PolarHBondContact O-N 3.37Å; P77-F79 PolarHBondContact O-N 3.42Å; F79-F82 HydrophobicContact CD1-CB 4.47Å; F79-F82 HydrophobicContact CD1-CD1 4.49Å; F79-F82 WeakPolarHBondContact O-CB 3.48Å; F79-F82 PolarHBondContact O-N 3.43Å; F79-F83 HydrophobicContact CB-CD2 4.49Å; F79-F83 HydrophobicContact CB-CE2 4.44Å; F79-F83 WeakPolarHBondContact O-CD2 3.23Å; F79-F83 PolarHBondContact O-N 3.03Å
80	I	96.4	Very high	96.4	Very high	67 Å²	67	20.2 Å²	20.2	34%	0.344	11%	0.105	S	C	.	.	H	α-helix	trans	-60.8	-52.9	171.5	-69.7	166	0	0	0	109.5	I76 P77 Y78 F82 F83 V84 W284 L508	I76-I80 HydrophobicContact CG2-CD1 4.15Å; I76-I80 WeakPolarHBondContact O-CG1 3.43Å; I76-I80 PolarHBondContact O-N 2.94Å; I76-I80 VanDerWaalsContact O-N 3.13Å; P77-I80 PolarHBondContact O-N 3.48Å; Y78-I80 PolarHBondContact O-N 3.27Å; I80-F82 VanDerWaalsContact C-N 3.29Å; I80-F82 PolarHBondContact O-N 3.13Å; I80-F83 PolarHBondContact O-N 2.83Å; I80-V84 HydrophobicContact CG2-CG2 4.39Å; I80-V84 WeakPolarHBondContact O-CB 3.3Å; I80-V84 VanDerWaalsContact O-CG2 3.3Å; I80-V84 WeakPolarHBondContact O-CG2 3.34Å; I80-V84 PolarHBondContact O-N 2.7Å; I80-W284 HydrophobicContact CD1-CH2 3.64Å; I80-W284 HydrophobicContact CD1-CZ3 3.64Å; I80-L508 HydrophobicContact CG2-CD2 4.23Å
81	F	96.3	Very high	96.7	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-62.5	-35.5	176.5	-83.7	-84.2	0	0	0	112.5	P77 Y78 C85 G86 W284 A287 G288 I291 L508 T512	P77-F81 WeakPolarHBondContact O-CD2 3.14Å; P77-F81 PolarHBondContact O-N 3.02Å; Y78-F81 PolarHBondContact O-N 3.34Å; F81-C85 HydrophobicContact CD1-CB 4.3Å; F81-C85 CarbonylContact O-C 3.6Å; F81-C85 WeakPolarHBondContact O-CA 3.38Å; F81-C85 WeakPolarHBondContact O-CB 3.29Å; F81-C85 PolarHBondContact O-N 3.33Å; F81-G86 PolarHBondContact O-N 2.6Å; F81-W284 HydrophobicContact CE2-CE3 4.33Å; F81-W284 VanDerWaalsContact CE2-O 3.23Å; F81-W284 WeakPolarHBondContact CE2-O 3.45Å; F81-A287 HydrophobicContact CD2-CB 4.18Å; F81-G288 VanDerWaalsContact CD1-CA 3.41Å; F81-G288 VanDerWaalsContact CG-CA 3.5Å; F81-I291 HydrophobicContact CB-CB 4.29Å; F81-I291 HydrophobicContact CB-CG1 3.85Å; F81-L508 HydrophobicContact CD1-CD2 3.63Å; F81-L508 HydrophobicContact CD1-CG 4.15Å; F81-L508 HydrophobicContact CD2-CD2 4.28Å; F81-L508 HydrophobicContact CE1-CD1 4.25Å; F81-L508 HydrophobicContact CE1-CD2 3.53Å; F81-L508 HydrophobicContact CE1-CG 3.52Å; F81-L508 HydrophobicContact CE2-CD1 4.34Å; F81-L508 HydrophobicContact CE2-CD2 4.17Å; F81-L508 HydrophobicContact CE2-CG 4.39Å; F81-L508 HydrophobicContact CG-CD2 4.02Å; F81-L508 HydrophobicContact CZ-CD1 3.85Å; F81-L508 HydrophobicContact CZ-CD2 3.81Å; F81-L508 HydrophobicContact CZ-CG 3.65Å; F81-T512 HydrophobicContact CZ-CG2 4.35Å; F81-T512 WeakPolarHBondContact CZ-OG1 3.49Å
82	F	97	Very high	96.8	Very high	1 Å²	1	19.8 Å²	19.8	0%	0.004	10%	0.101	C	C	.	.	I	π-helix	trans	-58.5	-51.3	176.9	177.1	-96.1	0	0	0	112.6	Y78 F79 I80 G86 I87 I291 F295 C323 F324 S327	Y78-F82 WeakPolarHBondContact O-CB 3.36Å; Y78-F82 PolarHBondContact O-N 2.85Å; F79-F82 HydrophobicContact CD1-CB 4.47Å; F79-F82 HydrophobicContact CD1-CD1 4.49Å; F79-F82 WeakPolarHBondContact O-CB 3.48Å; F79-F82 PolarHBondContact O-N 3.43Å; I80-F82 VanDerWaalsContact C-N 3.29Å; I80-F82 PolarHBondContact O-N 3.13Å; F82-G86 WeakPolarHBondContact O-CA 3.32Å; F82-G86 PolarHBondContact O-N 3.05Å; F82-I87 HydrophobicContact CD1-CD1 4.02Å; F82-I87 HydrophobicContact CE1-CD1 3.42Å; F82-I87 VanDerWaalsContact CE1-CD1 3.42Å; F82-I87 HydrophobicContact CE1-CG1 4.19Å; F82-I87 HydrophobicContact CZ-CD1 3.74Å; F82-I87 HydrophobicContact CZ-CG1 4.16Å; F82-I87 PolarHBondContact O-N 2.96Å; F82-I291 HydrophobicContact CB-CD1 4.04Å; F82-I291 HydrophobicContact CD2-CD1 4.28Å; F82-F295 HydrophobicContact CD2-CE2 4.25Å; F82-F295 AromaticContact CD2-CZ 3.61Å; F82-F295 HydrophobicContact CD2-CZ 3.61Å; F82-F295 HydrophobicContact CE2-CE2 4.25Å; F82-F295 AromaticContact CE2-CZ 3.68Å; F82-F295 HydrophobicContact CE2-CZ 3.68Å; F82-C323 HydrophobicContact CE2-CB 4.1Å; F82-C323 WeakPolarHBondContact CE2-O 3.33Å; F82-C323 HydrophobicContact CZ-CB 4.23Å; F82-F324 HydrophobicContact CE1-CD1 4.32Å; F82-F324 AromaticContact CE1-CE1 3.93Å; F82-F324 HydrophobicContact CE1-CE1 3.93Å; F82-F324 HydrophobicContact CE1-CE2 4.3Å; F82-F324 AromaticContact CE1-CZ 3.91Å; F82-F324 HydrophobicContact CE1-CZ 3.91Å; F82-F324 AromaticContact CZ-CD1 3.95Å; F82-F324 HydrophobicContact CZ-CD1 3.95Å; F82-F324 HydrophobicContact CZ-CD2 4.26Å; F82-F324 HydrophobicContact CZ-CE1 4.03Å; F82-F324 HydrophobicContact CZ-CE2 4.32Å; F82-F324 HydrophobicContact CZ-CG 4.06Å; F82-F324 HydrophobicContact CZ-CZ 4.21Å; F82-S327 VanDerWaalsContact CD2-OG 3.3Å; F82-S327 WeakPolarHBondContact CD2-OG 3.36Å; F82-S327 VanDerWaalsContact CE2-OG 3.22Å; F82-S327 WeakPolarHBondContact CE2-OG 3.2Å
83	F	96.8	Very high	97	Very high	86 Å²	86	18.9 Å²	18.9	38%	0.377	9%	0.091	S	C	.	.	I	π-helix	trans	-80	-31	-178.1	-71.2	-65.5	0	0	0	113.3	F79 I80 I87 P88 F324	F79-F83 HydrophobicContact CB-CD2 4.49Å; F79-F83 HydrophobicContact CB-CE2 4.44Å; F79-F83 WeakPolarHBondContact O-CD2 3.23Å; F79-F83 PolarHBondContact O-N 3.03Å; I80-F83 PolarHBondContact O-N 2.83Å; F83-I87 HydrophobicContact CD1-CD1 4.03Å; F83-I87 HydrophobicContact CE1-CD1 4.25Å; F83-P88 WeakPolarHBondContact O-CD 3.29Å; F83-P88 WeakPolarHBondContact O-CG 3.4Å; F83-F324 AromaticContact CE1-CZ 4Å; F83-F324 HydrophobicContact CE1-CZ 4Å; F83-F324 HydrophobicContact CZ-CZ 4.21Å
84	V	95.9	Very high	97	Very high	26 Å²	26	18.8 Å²	18.8	16%	0.158	9%	0.09	C	C	.	.	I	π-helix	trans	-91.2	-34.2	-174.2	173.6	0	0	0	0	112.9	I80 S500 L504 T505 L508	I80-V84 HydrophobicContact CG2-CG2 4.39Å; I80-V84 WeakPolarHBondContact O-CB 3.3Å; I80-V84 VanDerWaalsContact O-CG2 3.3Å; I80-V84 WeakPolarHBondContact O-CG2 3.34Å; I80-V84 PolarHBondContact O-N 2.7Å; V84-S500 WeakPolarHBondContact O-CB 3.34Å; V84-L504 HydrophobicContact CG1-CB 3.36Å; V84-L504 HydrophobicContact CG1-CD1 4.41Å; V84-L504 HydrophobicContact CG2-CD1 4.39Å; V84-T505 PolarHBondContact O-OG1 2.82Å; V84-L508 HydrophobicContact CB-CD2 4.44Å; V84-L508 HydrophobicContact CG1-CD2 4.11Å
85	C	95.7	Very high	97.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.09	C	C	.	.	I	π-helix	trans	-118	-52.1	-177.5	-60	0	0	0	0	111.9	F81 P88 V89 F292 T505	F81-C85 HydrophobicContact CD1-CB 4.3Å; F81-C85 CarbonylContact O-C 3.6Å; F81-C85 WeakPolarHBondContact O-CA 3.38Å; F81-C85 WeakPolarHBondContact O-CB 3.29Å; F81-C85 PolarHBondContact O-N 3.33Å; C85-P88 WeakPolarHBondContact O-CD 3.22Å; C85-V89 WeakPolarHBondContact O-CB 3.37Å; C85-V89 VanDerWaalsContact O-CG2 3.22Å; C85-V89 WeakPolarHBondContact O-CG2 3.48Å; C85-V89 PolarHBondContact O-N 3.48Å; C85-F292 HydrophobicContact CB-CE2 3.73Å; C85-F292 HydrophobicContact CB-CZ 4.02Å; C85-T505 HydrophobicContact CB-CG2 4.25Å
86	G	96.5	Very high	97.1	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.085	C	C	.	.	I	π-helix	trans	-54.5	-71.2	-173.9	0	0	0	0	0	112.9	F81 F82 V89 F90	F81-G86 PolarHBondContact O-N 2.6Å; F82-G86 WeakPolarHBondContact O-CA 3.32Å; F82-G86 PolarHBondContact O-N 3.05Å; G86-V89 PolarHBondContact O-N 3.27Å; G86-F90 WeakPolarHBondContact O-CB 3.42Å; G86-F90 PolarHBondContact O-N 2.83Å
87	I	97.6	Very high	97.1	Very high	14 Å²	14	13.8 Å²	13.8	7%	0.072	7%	0.066	C	C	.	.	H	α-helix	trans	-56.4	-49.2	-179.2	-68.1	168.2	0	0	0	111.9	F82 F83 F91 V320 C323 F324	F82-I87 HydrophobicContact CD1-CD1 4.02Å; F82-I87 HydrophobicContact CE1-CD1 3.42Å; F82-I87 VanDerWaalsContact CE1-CD1 3.42Å; F82-I87 HydrophobicContact CE1-CG1 4.19Å; F82-I87 HydrophobicContact CZ-CD1 3.74Å; F82-I87 HydrophobicContact CZ-CG1 4.16Å; F82-I87 PolarHBondContact O-N 2.96Å; F83-I87 HydrophobicContact CD1-CD1 4.03Å; F83-I87 HydrophobicContact CE1-CD1 4.25Å; I87-F91 VanDerWaalsContact O-CB 3.26Å; I87-F91 WeakPolarHBondContact O-CB 3.41Å; I87-F91 PolarHBondContact O-N 3.43Å; I87-V320 HydrophobicContact CG2-CG2 4.21Å; I87-C323 HydrophobicContact CD1-CB 4.47Å; I87-C323 HydrophobicContact CG1-CB 3.66Å; I87-F324 HydrophobicContact CD1-CE2 4.28Å
88	P	97.8	Very high	97.2	Very high	2 Å²	2	13.8 Å²	13.8	1%	0.013	7%	0.066	C	C	.	.	H	α-helix	trans	-62.7	-46.5	-176.6	-26.2	37.6	0	0	0	113.6	F83 C85 L92 V497 W501	F83-P88 WeakPolarHBondContact O-CD 3.29Å; F83-P88 WeakPolarHBondContact O-CG 3.4Å; C85-P88 WeakPolarHBondContact O-CD 3.22Å; P88-L92 WeakPolarHBondContact O-CB 3.11Å; P88-L92 PolarHBondContact O-N 2.79Å; P88-V497 HydrophobicContact CB-CG1 4.45Å; P88-W501 VanDerWaalsContact C-NE1 3.27Å; P88-W501 PolarHBondContact O-NE1 2.81Å
89	V	97.8	Very high	97.2	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-75.3	-38	-176.5	-172.2	0	0	0	0	111	C85 G86 F91 L92 E93 I297 V469 T505	C85-V89 WeakPolarHBondContact O-CB 3.37Å; C85-V89 VanDerWaalsContact O-CG2 3.22Å; C85-V89 WeakPolarHBondContact O-CG2 3.48Å; C85-V89 PolarHBondContact O-N 3.48Å; G86-V89 PolarHBondContact O-N 3.27Å; V89-F91 VanDerWaalsContact C-N 3.31Å; V89-F91 PolarHBondContact O-N 3.27Å; V89-L92 WeakPolarHBondContact O-CB 3.34Å; V89-L92 PolarHBondContact O-N 2.68Å; V89-L92 VanDerWaalsContact O-N 3.12Å; V89-E93 PolarHBondContact O-N 3.31Å; V89-I297 HydrophobicContact CB-CD1 4.37Å; V89-I297 HydrophobicContact CB-CG2 3.91Å; V89-I297 HydrophobicContact CG1-CG2 3.33Å; V89-V469 HydrophobicContact CG2-CG2 3.86Å; V89-T505 HydrophobicContact CG2-CG2 3.51Å
90	F	98.2	Very high	97.2	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-55	-49.1	172	-171.2	-78.8	0	0	0	111.6	V49 I53 G86 L92 E93 V94 F295 I297 L302 C319 L322	V49-F90 HydrophobicContact CG1-CE1 4.42Å; V49-F90 HydrophobicContact CG1-CE2 4.46Å; V49-F90 HydrophobicContact CG1-CZ 3.6Å; I53-F90 HydrophobicContact CD1-CE2 4.38Å; I53-F90 HydrophobicContact CD1-CZ 4.35Å; I53-F90 HydrophobicContact CG2-CE2 3.8Å; I53-F90 HydrophobicContact CG2-CZ 4.32Å; G86-F90 WeakPolarHBondContact O-CB 3.42Å; G86-F90 PolarHBondContact O-N 2.83Å; F90-L92 VanDerWaalsContact C-N 3.34Å; F90-L92 PolarHBondContact O-N 3.35Å; F90-E93 PolarHBondContact O-N 3.42Å; F90-V94 HydrophobicContact CD1-CG2 4.17Å; F90-V94 HydrophobicContact CE1-CG2 3.95Å; F90-V94 WeakPolarHBondContact O-CG2 3.08Å; F90-V94 PolarHBondContact O-N 3.39Å; F90-F295 HydrophobicContact CB-CD2 4.4Å; F90-F295 HydrophobicContact CD2-CB 4.05Å; F90-F295 AromaticContact CD2-CD2 3.92Å; F90-F295 HydrophobicContact CD2-CD2 3.92Å; F90-F295 HydrophobicContact CD2-CG 4.41Å; F90-F295 HydrophobicContact CG-CD2 4.47Å; F90-I297 HydrophobicContact CB-CD1 4.3Å; F90-I297 HydrophobicContact CB-CG1 4.42Å; F90-L302 HydrophobicContact CB-CD1 4.31Å; F90-L302 HydrophobicContact CD1-CD1 4.41Å; F90-L302 HydrophobicContact CD2-CD1 3.34Å; F90-L302 HydrophobicContact CD2-CD2 4.14Å; F90-L302 HydrophobicContact CD2-CG 4.38Å; F90-L302 HydrophobicContact CE1-CD2 4.39Å; F90-L302 HydrophobicContact CE2-CD1 3.62Å; F90-L302 HydrophobicContact CE2-CD2 3.49Å; F90-L302 VanDerWaalsContact CE2-CD2 3.49Å; F90-L302 HydrophobicContact CE2-CG 4.21Å; F90-L302 HydrophobicContact CG-CD1 3.79Å; F90-L302 HydrophobicContact CZ-CD1 4.29Å; F90-L302 HydrophobicContact CZ-CD2 3.66Å; F90-C319 HydrophobicContact CD1-CB 3.72Å; F90-C319 HydrophobicContact CE1-CB 3.98Å; F90-L322 HydrophobicContact CE1-CB 4.47Å; F90-L322 HydrophobicContact CZ-CB 4.34Å
91	F	98.3	Very high	97.1	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-64.8	-38.4	177.3	173.7	-123.3	0	0	0	112.2	I87 V89 E93 A95 Y316 C319 I485 P493 V497 W501	I87-F91 VanDerWaalsContact O-CB 3.26Å; I87-F91 WeakPolarHBondContact O-CB 3.41Å; I87-F91 PolarHBondContact O-N 3.43Å; V89-F91 VanDerWaalsContact C-N 3.31Å; V89-F91 PolarHBondContact O-N 3.27Å; F91-E93 PolarHBondContact O-N 3.08Å; F91-A95 HydrophobicContact CD2-CB 4.38Å; F91-A95 HydrophobicContact CE2-CB 4.02Å; F91-A95 HydrophobicContact CZ-CB 4.29Å; F91-A95 WeakPolarHBondContact O-CB 3.37Å; F91-A95 PolarHBondContact O-N 3.28Å; F91-Y316 HydrophobicContact CD1-CD2 4.03Å; F91-Y316 HydrophobicContact CD2-CD2 4.1Å; F91-Y316 AromaticContact CE1-CD2 3.88Å; F91-Y316 HydrophobicContact CE1-CD2 3.88Å; F91-Y316 VanDerWaalsContact CE2-CA 3.45Å; F91-Y316 AromaticContact CE2-CD2 3.97Å; F91-Y316 HydrophobicContact CE2-CD2 3.97Å; F91-Y316 HydrophobicContact CE2-CG 4.31Å; F91-Y316 HydrophobicContact CG-CD2 4.13Å; F91-Y316 AromaticContact CZ-CD2 3.86Å; F91-Y316 HydrophobicContact CZ-CD2 3.86Å; F91-Y316 HydrophobicContact CZ-CG 4.3Å; F91-C319 HydrophobicContact CB-CB 4.11Å; F91-C319 HydrophobicContact CD2-CB 4.18Å; F91-I485 HydrophobicContact CE1-CD1 3.85Å; F91-I485 HydrophobicContact CZ-CD1 3.91Å; F91-I485 HydrophobicContact CZ-CG1 4.33Å; F91-I485 HydrophobicContact CZ-CG2 3.85Å; F91-P493 HydrophobicContact CE1-CB 4.24Å; F91-P493 HydrophobicContact CE1-CG 3.78Å; F91-P493 HydrophobicContact CZ-CG 3.89Å; F91-V497 HydrophobicContact CD1-CG1 3.88Å; F91-V497 HydrophobicContact CE1-CG1 4.3Å; F91-W501 AromaticContact CD1-CH2 3.85Å; F91-W501 HydrophobicContact CD1-CH2 3.85Å; F91-W501 AromaticContact CD1-CZ2 3.65Å; F91-W501 HydrophobicContact CD1-CZ2 3.65Å; F91-W501 AromaticContact CE1-CH2 3.81Å; F91-W501 HydrophobicContact CE1-CH2 3.81Å; F91-W501 HydrophobicContact CE1-CZ2 4.11Å
92	L	97.9	Very high	96.9	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-56.7	-50.2	176.5	-179.1	157.3	0	0	0	111.1	P88 V89 F90 A95 L96 V469 I472 F481 W501	P88-L92 WeakPolarHBondContact O-CB 3.11Å; P88-L92 PolarHBondContact O-N 2.79Å; V89-L92 WeakPolarHBondContact O-CB 3.34Å; V89-L92 PolarHBondContact O-N 2.68Å; V89-L92 VanDerWaalsContact O-N 3.12Å; F90-L92 VanDerWaalsContact C-N 3.34Å; F90-L92 PolarHBondContact O-N 3.35Å; L92-A95 PolarHBondContact O-N 3.49Å; L92-L96 WeakPolarHBondContact O-CB 3.33Å; L92-L96 PolarHBondContact O-N 2.81Å; L92-V469 HydrophobicContact CD1-CG2 4.26Å; L92-I472 HydrophobicContact CD1-CB 4.06Å; L92-I472 HydrophobicContact CD1-CG1 4.15Å; L92-I472 HydrophobicContact CD1-CG2 4.11Å; L92-I472 HydrophobicContact CD2-CG1 4.16Å; L92-I472 HydrophobicContact CG-CG1 4.36Å; L92-F481 HydrophobicContact CG-CE1 4.28Å; L92-W501 HydrophobicContact CB-CZ2 3.78Å; L92-W501 HydrophobicContact CD1-CD2 4.31Å; L92-W501 HydrophobicContact CD1-CG 4.32Å; L92-W501 HydrophobicContact CG-CZ2 4.47Å
93	E	97.9	Very high	96.7	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-67.1	-43.8	-178.1	-76.3	-173.9	-129.3	0	0	113.2	V89 F90 F91 A95 L96 G97 C298 L302 T303	V89-E93 PolarHBondContact O-N 3.31Å; F90-E93 PolarHBondContact O-N 3.42Å; F91-E93 PolarHBondContact O-N 3.08Å; E93-A95 VanDerWaalsContact C-N 3.35Å; E93-A95 PolarHBondContact O-N 2.86Å; E93-L96 WeakPolarHBondContact O-CB 3.25Å; E93-L96 PolarHBondContact O-N 3.5Å; E93-G97 PolarHBondContact O-N 2.96Å; E93-C298 WeakPolarHBondContact OE1-CA 3.4Å; E93-C298 PolarHBondContact OE1-N 2.86Å; E93-L302 HydrophobicContact CB-CB 3.76Å; E93-L302 HydrophobicContact CB-CD1 4.36Å; E93-T303 WeakPolarHBondContact O-CA 3.38Å
94	V	98.1	Very high	96.4	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-63.9	-43.4	177.5	176.5	0	0	0	0	110.6	F45 F90 G97 Q98 L302 C315 C319	F45-V94 HydrophobicContact CZ-CG1 3.9Å; F90-V94 HydrophobicContact CD1-CG2 4.17Å; F90-V94 HydrophobicContact CE1-CG2 3.95Å; F90-V94 WeakPolarHBondContact O-CG2 3.08Å; F90-V94 PolarHBondContact O-N 3.39Å; V94-G97 PolarHBondContact O-N 3.03Å; V94-Q98 WeakPolarHBondContact O-CB 3.36Å; V94-Q98 PolarHBondContact O-N 3.42Å; V94-L302 HydrophobicContact CG2-CB 3.95Å; V94-L302 HydrophobicContact CG2-CD2 4.41Å; V94-C315 HydrophobicContact CG1-CB 3.94Å; V94-C319 VanDerWaalsContact CB-SG 3.59Å
95	A	97.9	Very high	96.4	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-65.8	-40.1	177.3	0	0	0	0	0	111.7	F91 L92 E93 Q98 Y99 F481 I485 M488	F91-A95 HydrophobicContact CD2-CB 4.38Å; F91-A95 HydrophobicContact CE2-CB 4.02Å; F91-A95 HydrophobicContact CZ-CB 4.29Å; F91-A95 WeakPolarHBondContact O-CB 3.37Å; F91-A95 PolarHBondContact O-N 3.28Å; L92-A95 PolarHBondContact O-N 3.49Å; E93-A95 VanDerWaalsContact C-N 3.35Å; E93-A95 PolarHBondContact O-N 2.86Å; A95-Q98 PolarHBondContact O-N 2.95Å; A95-Y99 WeakPolarHBondContact O-CB 3.49Å; A95-Y99 PolarHBondContact O-N 3.16Å; A95-F481 HydrophobicContact CB-CE1 4.5Å; A95-F481 HydrophobicContact CB-CZ 4.06Å; A95-I485 HydrophobicContact CB-CD1 4.44Å; A95-I485 HydrophobicContact CB-CG1 4.3Å; A95-M488 HydrophobicContact CB-CE 4.24Å
96	L	97.5	Very high	96.3	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-58.6	-52	175	-178	68.1	0	0	0	110.4	L92 E93 Q98 Y99 T100 A107 W108 I111 T303 I472 F481	L92-L96 WeakPolarHBondContact O-CB 3.33Å; L92-L96 PolarHBondContact O-N 2.81Å; E93-L96 WeakPolarHBondContact O-CB 3.25Å; E93-L96 PolarHBondContact O-N 3.5Å; L96-Q98 PolarHBondContact O-N 3.05Å; L96-Y99 PolarHBondContact O-N 3.26Å; L96-T100 HydrophobicContact CD1-CG2 4.38Å; L96-T100 WeakPolarHBondContact O-CG2 3.16Å; L96-T100 PolarHBondContact O-N 3.27Å; L96-T100 PolarHBondContact O-OG1 3Å; L96-A107 HydrophobicContact CG-CB 4.47Å; L96-W108 HydrophobicContact CD2-CD2 4.27Å; L96-W108 HydrophobicContact CD2-CH2 4.03Å; L96-W108 HydrophobicContact CD2-CZ2 3.6Å; L96-I111 HydrophobicContact CD1-CD1 4.02Å; L96-I111 HydrophobicContact CD1-CG1 3.71Å; L96-T303 HydrophobicContact CD2-CG2 4.48Å; L96-I472 HydrophobicContact CD1-CD1 4.07Å; L96-F481 HydrophobicContact CB-CZ 4.43Å; L96-F481 HydrophobicContact CD1-CE2 4.4Å
97	G	97.1	Very high	96.3	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-57.3	-50.5	177.4	0	0	0	0	0	112.2	E93 V94 Y99 T100 S101 T303 S307	E93-G97 PolarHBondContact O-N 2.96Å; V94-G97 PolarHBondContact O-N 3.03Å; G97-Y99 PolarHBondContact O-N 3.27Å; G97-T100 PolarHBondContact O-N 3.07Å; G97-S101 WeakPolarHBondContact O-CA 3.22Å; G97-S101 PolarHBondContact O-N 3.4Å; G97-T303 VanDerWaalsContact CA-O 3.3Å; G97-T303 WeakPolarHBondContact CA-O 3.25Å; G97-S307 VanDerWaalsContact C-CA 3.46Å; G97-S307 WeakPolarHBondContact O-CA 3.3Å; G97-S307 VanDerWaalsContact O-CB 3.31Å; G97-S307 WeakPolarHBondContact O-CB 3.28Å
98	Q	97.6	Very high	96.2	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-62	-42.6	179.9	-176.1	173.5	-58.1	0	0	112.2	V94 A95 L96 S101 G306 N309 Y311 N313 M488	V94-Q98 WeakPolarHBondContact O-CB 3.36Å; V94-Q98 PolarHBondContact O-N 3.42Å; A95-Q98 PolarHBondContact O-N 2.95Å; L96-Q98 PolarHBondContact O-N 3.05Å; Q98-S101 PolarHBondContact O-OG 3.38Å; Q98-G306 VanDerWaalsContact CA-O 3.28Å; Q98-G306 WeakPolarHBondContact CA-O 3.3Å; Q98-G306 PolarHBondContact N-O 3.25Å; Q98-N309 HydrophobicContact CB-CB 4.44Å; Q98-N309 HydrophobicContact CG-CB 3.94Å; Q98-N309 PolarHBondContact OE1-ND2 3.1Å; Q98-Y311 PolarHBondContact NE2-O 2.91Å; Q98-N313 PolarHBondContact NE2-O 3.21Å; Q98-M488 HydrophobicContact CB-SD 4.34Å; Q98-M488 HydrophobicContact CG-SD 4.11Å
99	Y	97	Very high	96	Very high	3 Å²	3	9.7 Å²	9.7	1%	0.012	5%	0.048	C	C	.	.	H	α-helix	trans	-64.4	-47.5	178.9	173.4	-117.4	0	0	0	112	A95 L96 G97 I111 Y311 Y476 N484 M488 L579 P580	A95-Y99 WeakPolarHBondContact O-CB 3.49Å; A95-Y99 PolarHBondContact O-N 3.16Å; L96-Y99 PolarHBondContact O-N 3.26Å; G97-Y99 PolarHBondContact O-N 3.27Å; Y99-I111 HydrophobicContact CD1-CD1 4.01Å; Y99-I111 HydrophobicContact CE1-CD1 3.76Å; Y99-Y311 HydrophobicContact CD2-CE2 4.07Å; Y99-Y476 PolarHBondContact OH-OH 3.28Å; Y99-N484 HydrophobicContact CD2-CB 4.07Å; Y99-N484 WeakPolarHBondContact CE1-ND2 3.28Å; Y99-N484 HydrophobicContact CE2-CB 3.9Å; Y99-N484 VanDerWaalsContact CZ-ND2 3.3Å; Y99-N484 PolarHBondContact OH-ND2 3.25Å; Y99-M488 VanDerWaalsContact CA-SD 3.58Å; Y99-M488 HydrophobicContact CD2-SD 4.4Å; Y99-L579 HydrophobicContact CE1-CB 4.44Å; Y99-L579 HydrophobicContact CE1-CD1 4.17Å; Y99-L579 HydrophobicContact CE1-CD2 4.28Å; Y99-P580 HydrophobicContact CE2-CB 4.08Å; Y99-P580 HydrophobicContact CE2-CG 4.31Å; Y99-P580 WeakPolarHBondContact CE2-O 3.36Å; Y99-P580 PolarHBondContact OH-O 3.29Å
100	T	95.3	Very high	95.9	Very high	9 Å²	9	12.1 Å²	12.1	6%	0.055	6%	0.058	C	C	.	.	H	α-helix	trans	-81.5	-24.4	-176.7	60.9	0	0	0	0	112.7	L96 G97 Q102 A107 I111 L579	L96-T100 HydrophobicContact CD1-CG2 4.38Å; L96-T100 WeakPolarHBondContact O-CG2 3.16Å; L96-T100 PolarHBondContact O-N 3.27Å; L96-T100 PolarHBondContact O-OG1 3Å; G97-T100 PolarHBondContact O-N 3.07Å; T100-Q102 WeakPolarHBondContact O-CG 3.05Å; T100-Q102 PolarHBondContact O-N 2.69Å; T100-A107 HydrophobicContact CG2-CB 4.26Å; T100-A107 WeakPolarHBondContact OG1-CB 3.32Å; T100-I111 HydrophobicContact CG2-CD1 4.03Å; T100-I111 HydrophobicContact CG2-CG1 3.83Å; T100-L579 HydrophobicContact CG2-CD2 3.94Å
101	S	94.7	Very high	95.7	Very high	46 Å²	46	12.1 Å²	12.1	32%	0.322	6%	0.058	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	42.4	-170.1	-62.8	0	0	0	0	111.8	R36 G97 Q98	R36-S101 PolarHBondContact NH1-O 3.19Å; G97-S101 WeakPolarHBondContact O-CA 3.22Å; G97-S101 PolarHBondContact O-N 3.4Å; Q98-S101 PolarHBondContact O-OG 3.38Å
102	Q	92.8	Very high	95.6	Very high	33 Å²	33	12.1 Å²	12.1	15%	0.154	6%	0.058	C	C	.	.	S	Bend	trans	-139.6	153.8	-175.9	-68.6	-59.2	-61	0	0	110.2	T100 T106 A107 K110 S307	T100-Q102 WeakPolarHBondContact O-CG 3.05Å; T100-Q102 PolarHBondContact O-N 2.69Å; Q102-T106 WeakPolarHBondContact CB-OG1 3.37Å; Q102-T106 PolarHBondContact OE1-OG1 3.4Å; Q102-A107 HydrophobicContact CB-CB 4.24Å; Q102-K110 HydrophobicContact CG-CD 4.3Å; Q102-S307 WeakPolarHBondContact O-CB 3.48Å
103	G	92.4	Very high	95.4	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.067	C	C	.	.			trans	-67.7	172.6	170.6	0	0	0	0	0	112.5	R36 V105 T106 A107 D409	R36-G103 VanDerWaalsContact NH2-N 3.11Å; G103-V105 PolarHBondContact O-N 2.83Å; G103-T106 PolarHBondContact O-N 2.98Å; G103-T106 PolarHBondContact O-OG1 3.48Å; G103-A107 WeakPolarHBondContact O-CB 3.49Å; G103-A107 PolarHBondContact O-N 3.45Å; G103-D409 PolarHBondContact N-OD2 3.48Å
104	S	91.6	Very high	95.2	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.007	7%	0.07	C	C	.	.	H	α-helix	trans	-50.4	-53.9	-171.4	56.1	0	0	0	0	113.8	W108	S104-W108 PolarHBondContact O-N 3.28Å
105	V	94.6	Very high	95.1	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.9	-48.3	-177.1	-176.4	0	0	0	0	112.4	G103 R109 L120 V123 A406 M410	G103-V105 PolarHBondContact O-N 2.83Å; V105-R109 WeakPolarHBondContact O-CB 3.48Å; V105-R109 PolarHBondContact O-N 3.45Å; V105-L120 HydrophobicContact CG1-CD2 3.92Å; V105-L120 HydrophobicContact CG1-CG 4.17Å; V105-L120 HydrophobicContact CG2-CD2 3.98Å; V105-L120 HydrophobicContact CG2-CG 4.46Å; V105-V123 HydrophobicContact CG2-CG2 3.6Å; V105-A406 HydrophobicContact CG2-CB 4.39Å; V105-M410 HydrophobicContact CB-CG 4.29Å; V105-M410 HydrophobicContact CB-SD 3.99Å; V105-M410 HydrophobicContact CG1-CG 4.19Å; V105-M410 HydrophobicContact CG1-SD 3.75Å; V105-M410 HydrophobicContact CG2-SD 4.07Å
106	T	94.4	Very high	94.9	Very high	11 Å²	11	16.8 Å²	16.8	7%	0.067	8%	0.082	C	C	.	.	H	α-helix	trans	-74.1	-31.6	-176.5	41.9	0	0	0	0	112.2	Q102 G103 R109 K110 D409 M410	Q102-T106 WeakPolarHBondContact CB-OG1 3.37Å; Q102-T106 PolarHBondContact OE1-OG1 3.4Å; G103-T106 PolarHBondContact O-N 2.98Å; G103-T106 PolarHBondContact O-OG1 3.48Å; T106-R109 PolarHBondContact O-N 2.92Å; T106-K110 WeakPolarHBondContact O-CG 3.43Å; T106-K110 PolarHBondContact O-N 3.36Å; T106-D409 HydrophobicContact CG2-CB 4.18Å; T106-D409 WeakPolarHBondContact OG1-CB 3.37Å; T106-M410 HydrophobicContact CG2-CG 4.18Å
107	A	95.8	Very high	94.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-58.7	-52.6	171.4	0	0	0	0	0	111.1	L96 T100 Q102 G103 R109 K110 I111 T303	L96-A107 HydrophobicContact CG-CB 4.47Å; T100-A107 HydrophobicContact CG2-CB 4.26Å; T100-A107 WeakPolarHBondContact OG1-CB 3.32Å; Q102-A107 HydrophobicContact CB-CB 4.24Å; G103-A107 WeakPolarHBondContact O-CB 3.49Å; G103-A107 PolarHBondContact O-N 3.45Å; A107-R109 VanDerWaalsContact C-N 3.35Å; A107-R109 PolarHBondContact O-N 2.91Å; A107-K110 PolarHBondContact O-N 3Å; A107-I111 WeakPolarHBondContact O-CB 3.41Å; A107-I111 WeakPolarHBondContact O-CG1 3.38Å; A107-I111 PolarHBondContact O-N 3.26Å; A107-T303 HydrophobicContact CB-CG2 4.03Å
108	W	95.9	Very high	94.8	Very high	1 Å²	1	16.8 Å²	16.8	0%	0.004	8%	0.082	C	C	.	.	H	α-helix	trans	-63.7	-38.5	177.6	-72.7	113.8	0	0	0	112.6	L96 S104 K110 I111 C112 I118 E468 C471 I472	L96-W108 HydrophobicContact CD2-CD2 4.27Å; L96-W108 HydrophobicContact CD2-CH2 4.03Å; L96-W108 HydrophobicContact CD2-CZ2 3.6Å; S104-W108 PolarHBondContact O-N 3.28Å; W108-K110 VanDerWaalsContact C-N 3.32Å; W108-K110 PolarHBondContact O-N 3.4Å; W108-I111 PolarHBondContact O-N 3Å; W108-C112 CarbonylContact O-C 3.52Å; W108-C112 VanDerWaalsContact O-C 3.24Å; W108-C112 PolarHBondContact O-N 3Å; W108-C112 VanDerWaalsContact O-O 3.08Å; W108-I118 HydrophobicContact CD2-CB 4.16Å; W108-I118 HydrophobicContact CD2-CD1 4.4Å; W108-I118 HydrophobicContact CD2-CG2 4Å; W108-I118 HydrophobicContact CE3-CD1 4.16Å; W108-I118 HydrophobicContact CG-CB 4.18Å; W108-I118 HydrophobicContact CG-CG2 4.26Å; W108-I118 HydrophobicContact CH2-CD1 4.39Å; W108-I118 HydrophobicContact CZ2-CG2 3.91Å; W108-I118 HydrophobicContact CZ3-CD1 4.15Å; W108-E468 HydrophobicContact CH2-CB 3.92Å; W108-E468 HydrophobicContact CH2-CG 3.98Å; W108-E468 HydrophobicContact CZ2-CB 3.96Å; W108-E468 HydrophobicContact CZ2-CG 3.55Å; W108-C471 HydrophobicContact CZ3-CB 3.97Å; W108-I472 HydrophobicContact CH2-CD1 4.12Å; W108-I472 HydrophobicContact CH2-CG1 3.78Å; W108-I472 HydrophobicContact CZ3-CD1 3.88Å; W108-I472 HydrophobicContact CZ3-CG1 3.92Å
109	R	94.6	Very high	94.7	Very high	100 Å²	100	16.8 Å²	16.8	38%	0.377	8%	0.082	S	C	.	.	H	α-helix	trans	-60.2	-39.6	174.7	-174.5	-178.7	-67.1	158.2	4.5	112.5	V105 T106 A107 P113 Q116	V105-R109 WeakPolarHBondContact O-CB 3.48Å; V105-R109 PolarHBondContact O-N 3.45Å; T106-R109 PolarHBondContact O-N 2.92Å; A107-R109 VanDerWaalsContact C-N 3.35Å; A107-R109 PolarHBondContact O-N 2.91Å; R109-P113 VanDerWaalsContact O-CD 3.3Å; R109-P113 WeakPolarHBondContact O-CD 3.49Å; R109-P113 VanDerWaalsContact O-CG 3.28Å; R109-P113 WeakPolarHBondContact O-CG 3.22Å; R109-Q116 HydrophobicContact CB-CB 4.3Å
110	K	94.3	Very high	94.6	Very high	51 Å²	51	18 Å²	18	22%	0.222	9%	0.089	C	C	.	.	H	α-helix	trans	-75.5	-33.7	178.8	-74.8	-162.9	173.2	-158	0	113.1	Q102 T106 A107 W108 P575 D576 S578 L579	Q102-K110 HydrophobicContact CG-CD 4.3Å; T106-K110 WeakPolarHBondContact O-CG 3.43Å; T106-K110 PolarHBondContact O-N 3.36Å; A107-K110 PolarHBondContact O-N 3Å; W108-K110 VanDerWaalsContact C-N 3.32Å; W108-K110 PolarHBondContact O-N 3.4Å; K110-P575 CarbonylContact O-C 3.41Å; K110-P575 WeakPolarHBondContact O-CA 3.32Å; K110-D576 HydrophobicContact CB-CB 4.03Å; K110-D576 HydrophobicContact CG-CB 4.1Å; K110-D576 PolarHBondContact O-N 3.35Å; K110-S578 PolarHBondContact NZ-OG 2.65Å; K110-S578 VanDerWaalsContact NZ-OG 3.12Å; K110-L579 HydrophobicContact CB-CD1 4.14Å; K110-L579 HydrophobicContact CB-CD2 4.18Å; K110-L579 HydrophobicContact CB-CG 4.3Å; K110-L579 HydrophobicContact CD-CD2 4.02Å; K110-L579 HydrophobicContact CD-CG 4.49Å; K110-L579 WeakPolarHBondContact O-CD1 3.12Å
111	I	94.9	Very high	94.7	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-79.9	-49.1	-177.3	-70.8	-78.9	0	0	0	111.4	L96 Y99 T100 A107 W108 I472 Y476 P575 L579	L96-I111 HydrophobicContact CD1-CD1 4.02Å; L96-I111 HydrophobicContact CD1-CG1 3.71Å; Y99-I111 HydrophobicContact CD1-CD1 4.01Å; Y99-I111 HydrophobicContact CE1-CD1 3.76Å; T100-I111 HydrophobicContact CG2-CD1 4.03Å; T100-I111 HydrophobicContact CG2-CG1 3.83Å; A107-I111 WeakPolarHBondContact O-CB 3.41Å; A107-I111 WeakPolarHBondContact O-CG1 3.38Å; A107-I111 PolarHBondContact O-N 3.26Å; W108-I111 PolarHBondContact O-N 3Å; I111-I472 HydrophobicContact CG2-CD1 3.77Å; I111-Y476 HydrophobicContact CD1-CD2 4.44Å; I111-Y476 HydrophobicContact CD1-CE2 3.91Å; I111-Y476 HydrophobicContact CG2-CD2 3.76Å; I111-Y476 HydrophobicContact CG2-CE2 4.24Å; I111-Y476 HydrophobicContact CG2-CG 4.08Å; I111-P575 WeakPolarHBondContact O-CB 3.43Å; I111-L579 HydrophobicContact CD1-CD1 3.93Å; I111-L579 HydrophobicContact CG1-CD1 4.42Å
112	C	94.9	Very high	94.7	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.071	C	C	.	.			trans	-151.1	93.9	178	-166	0	0	0	0	109.9	W108 L114 F115 Q116 C471	W108-C112 CarbonylContact O-C 3.52Å; W108-C112 VanDerWaalsContact O-C 3.24Å; W108-C112 PolarHBondContact O-N 3Å; W108-C112 VanDerWaalsContact O-O 3.08Å; C112-L114 PolarHBondContact O-N 3.38Å; C112-F115 HydrophobicContact CB-CD2 4.48Å; C112-F115 PolarHBondContact O-N 3.17Å; C112-Q116 PolarHBondContact O-N 3.11Å; C112-C471 VanDerWaalsContact CB-SG 3.52Å
113	P	93.8	Very high	94.8	Very high	29 Å²	29	15.2 Å²	15.2	19%	0.188	7%	0.072	C	C	.	.	G	3₁₀ helix	trans	-49.8	-32.3	178.9	-27.6	29.6	0	0	0	114.5	R109 F115 Q116 L572	R109-P113 VanDerWaalsContact O-CD 3.3Å; R109-P113 WeakPolarHBondContact O-CD 3.49Å; R109-P113 VanDerWaalsContact O-CG 3.28Å; R109-P113 WeakPolarHBondContact O-CG 3.22Å; P113-F115 VanDerWaalsContact C-N 3.27Å; P113-F115 PolarHBondContact O-N 3.47Å; P113-Q116 WeakPolarHBondContact O-CG 3.49Å; P113-Q116 PolarHBondContact O-N 3.01Å; P113-L572 HydrophobicContact CB-CD2 3.87Å; P113-L572 WeakPolarHBondContact CD-O 3.49Å
114	L	94.3	Very high	95	Very high	12 Å²	12	16.9 Å²	16.9	6%	0.063	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-59.2	-35.8	177	-169.9	64.5	0	0	0	113.4	C112 T554 L558 L569 L572 I573	C112-L114 PolarHBondContact O-N 3.38Å; L114-T554 HydrophobicContact CD1-CG2 3.79Å; L114-T554 HydrophobicContact CG-CG2 4.04Å; L114-T554 WeakPolarHBondContact O-CA 3.15Å; L114-T554 PolarHBondContact O-OG1 2.94Å; L114-L558 HydrophobicContact CD1-CD1 4.01Å; L114-L558 HydrophobicContact CD1-CD2 3.93Å; L114-L558 HydrophobicContact CD1-CG 3.69Å; L114-L569 HydrophobicContact CD2-CD1 3.79Å; L114-L572 HydrophobicContact CB-CB 3.92Å; L114-L572 HydrophobicContact CD1-CB 4.14Å; L114-L572 HydrophobicContact CD1-CD1 3.94Å; L114-L572 PolarHBondContact N-O 2.83Å; L114-I573 HydrophobicContact CD2-CG2 3.93Å
115	F	94.9	Very high	95.2	Very high	30 Å²	30	16.9 Å²	16.9	13%	0.132	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-106.1	19.4	-175.8	-71.5	-74.9	0	0	0	112.8	C112 P113 G117 I118 F467 C471 V475 V550	C112-F115 HydrophobicContact CB-CD2 4.48Å; C112-F115 PolarHBondContact O-N 3.17Å; P113-F115 VanDerWaalsContact C-N 3.27Å; P113-F115 PolarHBondContact O-N 3.47Å; F115-G117 PolarHBondContact O-N 3.42Å; F115-I118 HydrophobicContact CB-CD1 3.83Å; F115-I118 HydrophobicContact CB-CG1 4.29Å; F115-I118 HydrophobicContact CD1-CD1 4.4Å; F115-I118 HydrophobicContact CG-CD1 4.42Å; F115-I118 WeakPolarHBondContact O-CB 3.38Å; F115-I118 WeakPolarHBondContact O-CG1 3.22Å; F115-I118 PolarHBondContact O-N 3.45Å; F115-F467 HydrophobicContact CE1-CD1 4.16Å; F115-C471 HydrophobicContact CB-CB 4.4Å; F115-C471 HydrophobicContact CD2-CB 4.18Å; F115-C471 HydrophobicContact CG-CB 4.24Å; F115-V475 HydrophobicContact CE2-CB 4.48Å; F115-V475 HydrophobicContact CE2-CG1 4.29Å; F115-V475 HydrophobicContact CE2-CG2 3.88Å; F115-V550 HydrophobicContact CD1-CG1 4.35Å
116	Q	94.6	Very high	95.2	Very high	26 Å²	26	16.9 Å²	16.9	12%	0.121	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-20.1	174.8	70.7	176.8	-30.2	0	0	113.7	R109 C112 P113 I118 G119 L120 T557	R109-Q116 HydrophobicContact CB-CB 4.3Å; C112-Q116 PolarHBondContact O-N 3.11Å; P113-Q116 WeakPolarHBondContact O-CG 3.49Å; P113-Q116 PolarHBondContact O-N 3.01Å; Q116-I118 PolarHBondContact O-N 3.42Å; Q116-G119 PolarHBondContact O-N 3.25Å; Q116-L120 PolarHBondContact O-N 3.43Å; Q116-T557 PolarHBondContact NE2-OG1 2.92Å
117	G	95.7	Very high	95.2	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-61.3	-22.1	174	0	0	0	0	0	114.1	F115 L120 A121	F115-G117 PolarHBondContact O-N 3.42Å; G117-L120 PolarHBondContact O-N 2.85Å; G117-A121 WeakPolarHBondContact O-CB 3.34Å; G117-A121 PolarHBondContact O-N 3.35Å
118	I	96.8	Very high	95.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-60.8	-54.4	174	-64.9	176.1	0	0	0	110.1	W108 F115 Q116 L120 A121 S122 F467 E468 C471 V550	W108-I118 HydrophobicContact CD2-CB 4.16Å; W108-I118 HydrophobicContact CD2-CD1 4.4Å; W108-I118 HydrophobicContact CD2-CG2 4Å; W108-I118 HydrophobicContact CE3-CD1 4.16Å; W108-I118 HydrophobicContact CG-CB 4.18Å; W108-I118 HydrophobicContact CG-CG2 4.26Å; W108-I118 HydrophobicContact CH2-CD1 4.39Å; W108-I118 HydrophobicContact CZ2-CG2 3.91Å; W108-I118 HydrophobicContact CZ3-CD1 4.15Å; F115-I118 HydrophobicContact CB-CD1 3.83Å; F115-I118 HydrophobicContact CB-CG1 4.29Å; F115-I118 HydrophobicContact CD1-CD1 4.4Å; F115-I118 HydrophobicContact CG-CD1 4.42Å; F115-I118 WeakPolarHBondContact O-CB 3.38Å; F115-I118 WeakPolarHBondContact O-CG1 3.22Å; F115-I118 PolarHBondContact O-N 3.45Å; Q116-I118 PolarHBondContact O-N 3.42Å; I118-L120 VanDerWaalsContact C-N 3.25Å; I118-L120 PolarHBondContact O-N 3.1Å; I118-A121 WeakPolarHBondContact O-CB 3.34Å; I118-A121 PolarHBondContact O-N 3.34Å; I118-S122 PolarHBondContact O-N 2.87Å; I118-S122 PolarHBondContact O-OG 3.4Å; I118-F467 HydrophobicContact CD1-CB 3.97Å; I118-F467 HydrophobicContact CG1-CB 4.17Å; I118-E468 HydrophobicContact CD1-CG 4.38Å; I118-E468 HydrophobicContact CG2-CG 3.42Å; I118-E468 VanDerWaalsContact CG2-CG 3.42Å; I118-C471 HydrophobicContact CD1-CB 4.16Å; I118-V550 HydrophobicContact CG1-CG1 4.27Å; I118-V550 HydrophobicContact CG1-CG2 4.11Å
119	G	95.8	Very high	95.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-63.3	-32.3	179.5	0	0	0	0	0	113.1	Q116 S122 V123	Q116-G119 PolarHBondContact O-N 3.25Å; G119-S122 PolarHBondContact O-N 3.35Å; G119-V123 WeakPolarHBondContact O-CG2 3.29Å; G119-V123 PolarHBondContact O-N 2.93Å; G119-V123 VanDerWaalsContact O-N 3.07Å
120	L	95.6	Very high	95.2	Very high	30 Å²	30	15.4 Å²	15.4	16%	0.157	8%	0.082	C	C	.	.	H	α-helix	trans	-68.7	-38.4	173.5	-69	172.4	0	0	0	112.1	V105 Q116 G117 I118 S122 V123 V124 F553	V105-L120 HydrophobicContact CG1-CD2 3.92Å; V105-L120 HydrophobicContact CG1-CG 4.17Å; V105-L120 HydrophobicContact CG2-CD2 3.98Å; V105-L120 HydrophobicContact CG2-CG 4.46Å; Q116-L120 PolarHBondContact O-N 3.43Å; G117-L120 PolarHBondContact O-N 2.85Å; I118-L120 VanDerWaalsContact C-N 3.25Å; I118-L120 PolarHBondContact O-N 3.1Å; L120-S122 VanDerWaalsContact C-N 3.34Å; L120-V123 PolarHBondContact O-N 3.38Å; L120-V124 WeakPolarHBondContact O-CG2 2.88Å; L120-V124 PolarHBondContact O-N 2.84Å; L120-F553 HydrophobicContact CD1-CD1 3.48Å; L120-F553 VanDerWaalsContact CD1-CD1 3.48Å; L120-F553 HydrophobicContact CD1-CD2 3.7Å; L120-F553 HydrophobicContact CD1-CE1 3.3Å; L120-F553 HydrophobicContact CD1-CE2 3.53Å; L120-F553 HydrophobicContact CD1-CG 3.68Å; L120-F553 HydrophobicContact CD1-CZ 3.33Å
121	A	96.4	Very high	95.2	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-61.3	-44	174.1	0	0	0	0	0	111.3	G117 I118 V123 V124 I125 L464 S546 C549 V550	G117-A121 WeakPolarHBondContact O-CB 3.34Å; G117-A121 PolarHBondContact O-N 3.35Å; I118-A121 WeakPolarHBondContact O-CB 3.34Å; I118-A121 PolarHBondContact O-N 3.34Å; A121-V123 VanDerWaalsContact C-N 3.35Å; A121-V123 PolarHBondContact O-N 2.97Å; A121-V124 PolarHBondContact O-N 3.01Å; A121-V124 VanDerWaalsContact O-N 3.17Å; A121-I125 WeakPolarHBondContact O-CG1 3.31Å; A121-I125 PolarHBondContact O-N 2.81Å; A121-L464 HydrophobicContact CB-CD1 3.76Å; A121-L464 HydrophobicContact CB-CD2 3.5Å; A121-L464 HydrophobicContact CB-CG 4.29Å; A121-S546 VanDerWaalsContact CB-O 3.24Å; A121-S546 WeakPolarHBondContact CB-O 3.23Å; A121-C549 HydrophobicContact CB-CB 3.92Å; A121-V550 HydrophobicContact CB-CG2 4.3Å
122	S	94.7	Very high	95.2	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.007	8%	0.075	C	C	.	.	H	α-helix	trans	-58.3	-44.6	173.9	-55.9	0	0	0	0	111.6	I118 G119 L120 V124 I125 E126 C298 Q299	I118-S122 PolarHBondContact O-N 2.87Å; I118-S122 PolarHBondContact O-OG 3.4Å; G119-S122 PolarHBondContact O-N 3.35Å; L120-S122 VanDerWaalsContact C-N 3.34Å; S122-V124 VanDerWaalsContact C-N 3.31Å; S122-V124 PolarHBondContact O-N 3.03Å; S122-I125 PolarHBondContact O-N 3.47Å; S122-E126 WeakPolarHBondContact O-CB 3.24Å; S122-E126 WeakPolarHBondContact O-CG 3.32Å; S122-E126 PolarHBondContact O-N 3.38Å; S122-C298 PolarHBondContact OG-O 3.34Å; S122-C298 VanDerWaalsContact OG-O 3.05Å; S122-Q299 WeakPolarHBondContact CB-O 3.39Å
123	V	95.6	Very high	95.2	Very high	28 Å²	28	14.8 Å²	14.8	17%	0.17	8%	0.079	C	C	.	.	H	α-helix	trans	-61.2	-36.8	175.8	167.1	0	0	0	0	112.8	V105 G119 L120 A121 S127 L403 A406	V105-V123 HydrophobicContact CG2-CG2 3.6Å; G119-V123 WeakPolarHBondContact O-CG2 3.29Å; G119-V123 PolarHBondContact O-N 2.93Å; G119-V123 VanDerWaalsContact O-N 3.07Å; L120-V123 PolarHBondContact O-N 3.38Å; A121-V123 VanDerWaalsContact C-N 3.35Å; A121-V123 PolarHBondContact O-N 2.97Å; V123-S127 WeakPolarHBondContact O-CB 3.39Å; V123-S127 PolarHBondContact O-N 3.5Å; V123-S127 PolarHBondContact O-OG 2.94Å; V123-L403 HydrophobicContact CG1-CD1 3.71Å; V123-A406 HydrophobicContact CG2-CB 3.76Å
124	V	96.3	Very high	95.3	Very high	35 Å²	35	13.4 Å²	13.4	21%	0.212	7%	0.07	C	C	.	.	H	α-helix	trans	-65.8	-45.6	175.5	171.8	0	0	0	0	110.9	L120 A121 S122 S127 Y128	L120-V124 WeakPolarHBondContact O-CG2 2.88Å; L120-V124 PolarHBondContact O-N 2.84Å; A121-V124 PolarHBondContact O-N 3.01Å; A121-V124 VanDerWaalsContact O-N 3.17Å; S122-V124 VanDerWaalsContact C-N 3.31Å; S122-V124 PolarHBondContact O-N 3.03Å; V124-S127 WeakPolarHBondContact O-CB 3.28Å; V124-S127 PolarHBondContact O-N 3.49Å; V124-Y128 HydrophobicContact CG1-CD2 4.14Å; V124-Y128 HydrophobicContact CG1-CE2 3.49Å; V124-Y128 VanDerWaalsContact CG1-CE2 3.49Å; V124-Y128 WeakPolarHBondContact O-CD2 3.32Å; V124-Y128 PolarHBondContact O-N 3.44Å; V124-Y128 VanDerWaalsContact O-N 3.16Å
125	I	95	Very high	95.5	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-59.8	-47.2	176.3	-68.6	174.2	0	0	0	110.6	A121 S122 S127 Y128 L129 Q299 S456 C460 L461 L464	A121-I125 WeakPolarHBondContact O-CG1 3.31Å; A121-I125 PolarHBondContact O-N 2.81Å; S122-I125 PolarHBondContact O-N 3.47Å; I125-S127 VanDerWaalsContact C-N 3.32Å; I125-S127 PolarHBondContact O-N 2.82Å; I125-Y128 WeakPolarHBondContact O-CB 3.07Å; I125-Y128 PolarHBondContact O-N 3.12Å; I125-Y128 VanDerWaalsContact O-N 3.13Å; I125-L129 HydrophobicContact CG2-CD1 4.03Å; I125-L129 HydrophobicContact CG2-CG 4.46Å; I125-L129 PolarHBondContact O-N 3.48Å; I125-Q299 HydrophobicContact CG2-CG 4.45Å; I125-S456 WeakPolarHBondContact CG2-OG 3.2Å; I125-C460 HydrophobicContact CD1-CB 4.34Å; I125-L461 HydrophobicContact CD1-CD2 4Å; I125-L461 HydrophobicContact CG2-CD2 4.43Å; I125-L464 HydrophobicContact CD1-CD1 3.36Å
126	E	94.2	Very high	95.6	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-60	-41	176.7	-77.4	-61	150.9	0	0	112.9	S122 Y128 L129 N130 Q299 C301 C399 C402	S122-E126 WeakPolarHBondContact O-CB 3.24Å; S122-E126 WeakPolarHBondContact O-CG 3.32Å; S122-E126 PolarHBondContact O-N 3.38Å; E126-Y128 PolarHBondContact O-N 3.19Å; E126-L129 PolarHBondContact O-N 3.08Å; E126-N130 WeakPolarHBondContact O-CB 3.38Å; E126-N130 PolarHBondContact O-N 2.92Å; E126-N130 PolarHBondContact O-ND2 2.99Å; E126-Q299 WeakPolarHBondContact CG-O 3.49Å; E126-Q299 WeakPolarHBondContact OE1-CB 3.33Å; E126-Q299 VanDerWaalsContact OE1-O 3.12Å; E126-C301 VanDerWaalsContact CD-SG 3.59Å; E126-C301 PolarHBondContact OE1-SG 3.2Å; E126-C399 WeakPolarHBondContact OE2-CA 3.23Å; E126-C399 WeakPolarHBondContact OE2-CB 3.5Å; E126-C402 HydrophobicContact CG-CB 4.43Å
127	S	95.6	Very high	95.7	Very high	38 Å²	38	10.6 Å²	10.6	27%	0.266	6%	0.057	S	C	.	.	H	α-helix	trans	-60.7	-39.1	177	-59.8	0	0	0	0	110.8	V123 V124 I125 I131	V123-S127 WeakPolarHBondContact O-CB 3.39Å; V123-S127 PolarHBondContact O-N 3.5Å; V123-S127 PolarHBondContact O-OG 2.94Å; V124-S127 WeakPolarHBondContact O-CB 3.28Å; V124-S127 PolarHBondContact O-N 3.49Å; I125-S127 VanDerWaalsContact C-N 3.32Å; I125-S127 PolarHBondContact O-N 2.82Å; S127-I131 VanDerWaalsContact O-CD1 3.32Å; S127-I131 WeakPolarHBondContact O-CD1 3.23Å; S127-I131 VanDerWaalsContact O-CG1 3.28Å; S127-I131 WeakPolarHBondContact O-CG1 3.31Å; S127-I131 PolarHBondContact O-N 3Å
128	Y	95.7	Very high	95.8	Very high	37 Å²	37	10.6 Å²	10.6	15%	0.145	6%	0.057	C	C	.	.	H	α-helix	trans	-69.3	-46	174.6	-61.7	-38.6	0	0	0	112.5	V124 I125 E126 N130 I131 Y132 F451 A455 L542 S545	V124-Y128 HydrophobicContact CG1-CD2 4.14Å; V124-Y128 HydrophobicContact CG1-CE2 3.49Å; V124-Y128 VanDerWaalsContact CG1-CE2 3.49Å; V124-Y128 WeakPolarHBondContact O-CD2 3.32Å; V124-Y128 PolarHBondContact O-N 3.44Å; V124-Y128 VanDerWaalsContact O-N 3.16Å; I125-Y128 WeakPolarHBondContact O-CB 3.07Å; I125-Y128 PolarHBondContact O-N 3.12Å; I125-Y128 VanDerWaalsContact O-N 3.13Å; E126-Y128 PolarHBondContact O-N 3.19Å; Y128-N130 VanDerWaalsContact C-N 3.31Å; Y128-N130 PolarHBondContact O-N 3Å; Y128-I131 PolarHBondContact O-N 3.44Å; Y128-I131 VanDerWaalsContact O-N 3.08Å; Y128-Y132 WeakPolarHBondContact O-CD1 3.48Å; Y128-Y132 PolarHBondContact O-N 3.11Å; Y128-F451 HydrophobicContact CD1-CD1 4.42Å; Y128-F451 AromaticContact CD1-CE1 3.82Å; Y128-F451 HydrophobicContact CD1-CE1 3.82Å; Y128-F451 HydrophobicContact CG-CE1 4.38Å; Y128-A455 HydrophobicContact CD2-CB 3.69Å; Y128-A455 HydrophobicContact CE2-CB 4.42Å; Y128-A455 HydrophobicContact CG-CB 3.88Å; Y128-L542 HydrophobicContact CD1-CD2 4.38Å; Y128-L542 HydrophobicContact CE1-CD2 3.81Å; Y128-L542 HydrophobicContact CE2-CD2 4.27Å; Y128-S545 WeakPolarHBondContact CE2-OG 3.45Å; Y128-S545 PolarHBondContact OH-OG 3.06Å
129	L	94.3	Very high	95.9	Very high	6 Å²	6	10.6 Å²	10.6	3%	0.031	6%	0.058	C	C	.	.	H	α-helix	trans	-53.8	-48	176.2	-75.5	169.6	0	0	0	111.4	I125 E126 I131 Y132 Y133 Q299	I125-L129 HydrophobicContact CG2-CD1 4.03Å; I125-L129 HydrophobicContact CG2-CG 4.46Å; I125-L129 PolarHBondContact O-N 3.48Å; E126-L129 PolarHBondContact O-N 3.08Å; L129-I131 PolarHBondContact O-N 3.46Å; L129-Y132 HydrophobicContact CD2-CE1 3.73Å; L129-Y132 WeakPolarHBondContact CD2-OH 3.5Å; L129-Y132 HydrophobicContact CG-CE1 4.43Å; L129-Y132 PolarHBondContact O-N 2.91Å; L129-Y133 WeakPolarHBondContact O-CB 3.49Å; L129-Y133 PolarHBondContact O-N 3.35Å; L129-Q299 HydrophobicContact CD1-CG 4.38Å
130	N	95.3	Very high	96	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-57.7	-32.8	178.2	-85.1	-75.5	0	0	0	113.6	E126 Y128 W221 Q396 C399 V400	E126-N130 WeakPolarHBondContact O-CB 3.38Å; E126-N130 PolarHBondContact O-N 2.92Å; E126-N130 PolarHBondContact O-ND2 2.99Å; Y128-N130 VanDerWaalsContact C-N 3.31Å; Y128-N130 PolarHBondContact O-N 3Å; N130-W221 WeakPolarHBondContact O-CZ2 3.26Å; N130-Q396 PolarHBondContact O-NE2 3.38Å; N130-Q396 PolarHBondContact OD1-NE2 3.49Å; N130-C399 PolarHBondContact ND2-O 2.9Å; N130-C399 VanDerWaalsContact ND2-O 3.11Å; N130-V400 WeakPolarHBondContact OD1-CA 3.31Å; N130-V400 WeakPolarHBondContact OD1-CG2 3.44Å; N130-V400 PolarHBondContact OD1-N 3.18Å
131	I	95.2	Very high	96.1	Very high	17 Å²	17	9.7 Å²	9.7	9%	0.087	5%	0.053	C	C	.	.	H	α-helix	trans	-76.3	-50.4	-178.8	-68.3	162.7	0	0	0	111.4	S127 Y128 L129 C432 I435 M439 F451	S127-I131 VanDerWaalsContact O-CD1 3.32Å; S127-I131 WeakPolarHBondContact O-CD1 3.23Å; S127-I131 VanDerWaalsContact O-CG1 3.28Å; S127-I131 WeakPolarHBondContact O-CG1 3.31Å; S127-I131 PolarHBondContact O-N 3Å; Y128-I131 PolarHBondContact O-N 3.44Å; Y128-I131 VanDerWaalsContact O-N 3.08Å; L129-I131 PolarHBondContact O-N 3.46Å; I131-C432 HydrophobicContact CG1-CB 4.39Å; I131-I435 HydrophobicContact CD1-CD1 4.14Å; I131-I435 HydrophobicContact CD1-CG2 4.2Å; I131-I435 HydrophobicContact CG1-CG2 4.47Å; I131-I435 HydrophobicContact CG2-CB 4.32Å; I131-I435 HydrophobicContact CG2-CG2 3.7Å; I131-M439 HydrophobicContact CG2-CE 3.92Å; I131-M439 HydrophobicContact CG2-SD 4.32Å; I131-F451 HydrophobicContact CG2-CE1 4.37Å
132	Y	94.8	Very high	96.2	Very high	1 Å²	1	10.2 Å²	10.2	0%	0.004	6%	0.055	C	C	.	.	H	α-helix	trans	-92.7	-33.3	-170.2	86.8	-94.9	0	0	0	113.7	Y128 L129 I134 I135 F448 F451 D452	Y128-Y132 WeakPolarHBondContact O-CD1 3.48Å; Y128-Y132 PolarHBondContact O-N 3.11Å; L129-Y132 HydrophobicContact CD2-CE1 3.73Å; L129-Y132 WeakPolarHBondContact CD2-OH 3.5Å; L129-Y132 HydrophobicContact CG-CE1 4.43Å; L129-Y132 PolarHBondContact O-N 2.91Å; Y132-I134 VanDerWaalsContact C-N 3.32Å; Y132-I134 PolarHBondContact O-N 3.34Å; Y132-I135 VanDerWaalsContact O-CB 3.23Å; Y132-I135 WeakPolarHBondContact O-CB 3.31Å; Y132-I135 VanDerWaalsContact O-CG1 3.23Å; Y132-I135 WeakPolarHBondContact O-CG1 3.18Å; Y132-I135 PolarHBondContact O-N 3.45Å; Y132-I135 VanDerWaalsContact O-N 3.13Å; Y132-F448 HydrophobicContact CD2-CD2 4.16Å; Y132-F448 AromaticContact CD2-CE2 3.71Å; Y132-F448 HydrophobicContact CD2-CE2 3.71Å; Y132-F448 HydrophobicContact CD2-CZ 4.14Å; Y132-F448 WeakPolarHBondContact O-CE2 3.43Å; Y132-F451 HydrophobicContact CD1-CB 3.81Å; Y132-F451 HydrophobicContact CD1-CD1 4.25Å; Y132-F451 HydrophobicContact CG-CB 3.82Å; Y132-D452 HydrophobicContact CD2-CB 4.3Å; Y132-D452 HydrophobicContact CE2-CB 3.91Å
133	Y	94.7	Very high	96.3	Very high	20 Å²	20	10.2 Å²	10.2	8%	0.078	6%	0.055	C	C	.	.	H	α-helix	trans	-65.2	-38.7	-172.2	-169.5	-96.3	0	0	0	111.6	L56 L129 I135 I136 G392 S395	L56-Y133 HydrophobicContact CD1-CE2 4.26Å; L129-Y133 WeakPolarHBondContact O-CB 3.49Å; L129-Y133 PolarHBondContact O-N 3.35Å; Y133-I135 PolarHBondContact O-N 3.01Å; Y133-I135 VanDerWaalsContact O-N 3.14Å; Y133-I136 HydrophobicContact CD2-CD1 4.04Å; Y133-I136 HydrophobicContact CE2-CD1 4.22Å; Y133-I136 WeakPolarHBondContact O-CB 3.45Å; Y133-I136 PolarHBondContact O-N 3.36Å; Y133-G392 WeakPolarHBondContact CE1-O 3.43Å; Y133-S395 PolarHBondContact OH-OG 3Å
134	I	96.8	Very high	96.4	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-63.2	-20.8	178.4	-156.5	171.9	0	0	0	113.8	Y132 I136 L137 A138 L217 A220 W221 Q396	Y132-I134 VanDerWaalsContact C-N 3.32Å; Y132-I134 PolarHBondContact O-N 3.34Å; I134-I136 PolarHBondContact O-N 3.49Å; I134-L137 HydrophobicContact CG1-CD2 4.4Å; I134-L137 WeakPolarHBondContact O-CB 3.33Å; I134-L137 PolarHBondContact O-N 2.86Å; I134-A138 PolarHBondContact O-N 2.95Å; I134-L217 HydrophobicContact CG2-CD1 3.72Å; I134-A220 HydrophobicContact CD1-CB 4.11Å; I134-A220 HydrophobicContact CG1-CB 4Å; I134-W221 HydrophobicContact CB-CZ2 4.38Å; I134-W221 HydrophobicContact CD1-CD2 3.44Å; I134-W221 VanDerWaalsContact CD1-CD2 3.44Å; I134-W221 HydrophobicContact CD1-CE3 3.87Å; I134-W221 HydrophobicContact CD1-CG 3.73Å; I134-W221 HydrophobicContact CD1-CH2 4.2Å; I134-W221 HydrophobicContact CD1-CZ2 3.77Å; I134-W221 HydrophobicContact CD1-CZ3 4.24Å; I134-W221 HydrophobicContact CG2-CZ2 3.77Å; I134-Q396 HydrophobicContact CB-CG 4.26Å; I134-Q396 HydrophobicContact CD1-CG 4.03Å; I134-Q396 HydrophobicContact CG1-CG 4.1Å
135	I	97.5	Very high	96.5	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-60.5	-32	175.7	-53.2	-60.4	0	0	0	110.5	Y132 Y133 L137 A138 W139 L217 M439 V440 F448	Y132-I135 VanDerWaalsContact O-CB 3.23Å; Y132-I135 WeakPolarHBondContact O-CB 3.31Å; Y132-I135 VanDerWaalsContact O-CG1 3.23Å; Y132-I135 WeakPolarHBondContact O-CG1 3.18Å; Y132-I135 PolarHBondContact O-N 3.45Å; Y132-I135 VanDerWaalsContact O-N 3.13Å; Y133-I135 PolarHBondContact O-N 3.01Å; Y133-I135 VanDerWaalsContact O-N 3.14Å; I135-L137 VanDerWaalsContact C-N 3.32Å; I135-L137 PolarHBondContact O-N 2.96Å; I135-A138 WeakPolarHBondContact O-CB 3.39Å; I135-A138 PolarHBondContact O-N 3.46Å; I135-A138 VanDerWaalsContact O-N 3.14Å; I135-W139 HydrophobicContact CG2-CD2 4.35Å; I135-W139 HydrophobicContact CG2-CH2 4.21Å; I135-W139 HydrophobicContact CG2-CZ2 3.6Å; I135-W139 PolarHBondContact O-N 3.39Å; I135-W139 VanDerWaalsContact O-N 3.1Å; I135-L217 HydrophobicContact CD1-CD1 3.85Å; I135-L217 HydrophobicContact CD1-CD2 3.88Å; I135-M439 HydrophobicContact CD1-CB 3.95Å; I135-M439 HydrophobicContact CD1-SD 4.49Å; I135-M439 HydrophobicContact CG1-CB 3.92Å; I135-M439 HydrophobicContact CG1-SD 3.9Å; I135-M439 HydrophobicContact CG2-CB 4.44Å; I135-V440 HydrophobicContact CD1-CG1 4.18Å; I135-V440 HydrophobicContact CG2-CG1 4.22Å; I135-F448 HydrophobicContact CB-CD2 4.06Å; I135-F448 HydrophobicContact CB-CE2 4.24Å; I135-F448 HydrophobicContact CG1-CD2 4.46Å; I135-F448 HydrophobicContact CG2-CD2 4.22Å
136	I	96.4	Very high	96.6	Very high	5 Å²	5	14.1 Å²	14.1	3%	0.026	7%	0.071	C	C	.	.	H	α-helix	trans	-64.8	-38.1	176.8	-56.1	160.2	0	0	0	111.3	L56 W60 Y133 I134 A138 W139 A140 F364 F448	L56-I136 HydrophobicContact CD1-CB 4.1Å; L56-I136 HydrophobicContact CD1-CD1 3.8Å; L56-I136 HydrophobicContact CD1-CG2 3.52Å; W60-I136 HydrophobicContact CH2-CD1 3.71Å; W60-I136 HydrophobicContact CH2-CG1 4.05Å; W60-I136 HydrophobicContact CH2-CG2 3.71Å; W60-I136 HydrophobicContact CZ2-CD1 3.83Å; W60-I136 HydrophobicContact CZ3-CG2 4.24Å; Y133-I136 HydrophobicContact CD2-CD1 4.04Å; Y133-I136 HydrophobicContact CE2-CD1 4.22Å; Y133-I136 WeakPolarHBondContact O-CB 3.45Å; Y133-I136 PolarHBondContact O-N 3.36Å; I134-I136 PolarHBondContact O-N 3.49Å; I136-A138 VanDerWaalsContact C-N 3.29Å; I136-A138 PolarHBondContact O-N 3.34Å; I136-W139 HydrophobicContact CB-CE3 4.32Å; I136-W139 HydrophobicContact CG1-CE3 4.18Å; I136-W139 HydrophobicContact CG1-CZ3 3.99Å; I136-W139 HydrophobicContact CG2-CE3 4.44Å; I136-W139 PolarHBondContact O-N 2.59Å; I136-A140 PolarHBondContact O-N 3.12Å; I136-F364 HydrophobicContact CG2-CE2 4Å; I136-F364 HydrophobicContact CG2-CZ 3.99Å; I136-F448 HydrophobicContact CD1-CE2 4.33Å; I136-F448 HydrophobicContact CD1-CZ 4.04Å; I136-F448 HydrophobicContact CG1-CE2 3.85Å; I136-F448 HydrophobicContact CG1-CZ 3.79Å
137	L	97.2	Very high	96.7	Very high	4 Å²	4	14.2 Å²	14.2	2%	0.021	7%	0.071	C	C	.	.	H	α-helix	trans	-65.7	-35.7	175.4	-76.2	66.3	0	0	0	110.8	I134 I135 W139 A140 L141 A220 L393	I134-L137 HydrophobicContact CG1-CD2 4.4Å; I134-L137 WeakPolarHBondContact O-CB 3.33Å; I134-L137 PolarHBondContact O-N 2.86Å; I135-L137 VanDerWaalsContact C-N 3.32Å; I135-L137 PolarHBondContact O-N 2.96Å; L137-W139 VanDerWaalsContact C-N 3.35Å; L137-A140 PolarHBondContact O-N 3.04Å; L137-L141 WeakPolarHBondContact O-CB 3.35Å; L137-L141 VanDerWaalsContact O-CG 3.3Å; L137-L141 WeakPolarHBondContact O-CG 3.48Å; L137-L141 PolarHBondContact O-N 3.04Å; L137-A220 HydrophobicContact CB-CB 4.07Å; L137-L393 HydrophobicContact CD2-CB 4.19Å; L137-L393 HydrophobicContact CD2-CD1 4.01Å
138	A	98.2	Very high	96.7	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.4	-43	174.9	0	0	0	0	0	111.3	I134 I135 I136 F142 C216 L217	I134-A138 PolarHBondContact O-N 2.95Å; I135-A138 WeakPolarHBondContact O-CB 3.39Å; I135-A138 PolarHBondContact O-N 3.46Å; I135-A138 VanDerWaalsContact O-N 3.14Å; I136-A138 VanDerWaalsContact C-N 3.29Å; I136-A138 PolarHBondContact O-N 3.34Å; A138-F142 WeakPolarHBondContact O-CB 3.41Å; A138-F142 PolarHBondContact O-N 3.43Å; A138-C216 HydrophobicContact CB-CB 4.11Å; A138-C216 WeakPolarHBondContact O-CB 3.25Å; A138-L217 HydrophobicContact CB-CB 3.9Å; A138-L217 HydrophobicContact CB-CD1 4.39Å
139	W	98.3	Very high	96.5	Very high	1 Å²	1	20.1 Å²	20.1	0%	0.004	10%	0.098	C	C	.	.	H	α-helix	trans	-63.3	-45.4	172.7	-58.7	-32.5	0	0	0	111.9	I135 I136 L137 L141 F142 Y143 W192 L197 P360 F364 M445 F448	I135-W139 HydrophobicContact CG2-CD2 4.35Å; I135-W139 HydrophobicContact CG2-CH2 4.21Å; I135-W139 HydrophobicContact CG2-CZ2 3.6Å; I135-W139 PolarHBondContact O-N 3.39Å; I135-W139 VanDerWaalsContact O-N 3.1Å; I136-W139 HydrophobicContact CB-CE3 4.32Å; I136-W139 HydrophobicContact CG1-CE3 4.18Å; I136-W139 HydrophobicContact CG1-CZ3 3.99Å; I136-W139 HydrophobicContact CG2-CE3 4.44Å; I136-W139 PolarHBondContact O-N 2.59Å; L137-W139 VanDerWaalsContact C-N 3.35Å; W139-L141 VanDerWaalsContact C-N 3.35Å; W139-L141 PolarHBondContact O-N 2.91Å; W139-F142 WeakPolarHBondContact O-CB 3.24Å; W139-F142 PolarHBondContact O-N 2.9Å; W139-F142 VanDerWaalsContact O-N 3.17Å; W139-Y143 WeakPolarHBondContact O-CD2 3.49Å; W139-Y143 PolarHBondContact O-N 3.33Å; W139-W192 HydrophobicContact CB-CZ3 4.3Å; W139-W192 AromaticContact CD2-CH2 3.7Å; W139-W192 HydrophobicContact CD2-CH2 3.7Å; W139-W192 HydrophobicContact CD2-CZ3 4.31Å; W139-W192 AromaticContact CE3-CH2 3.8Å; W139-W192 HydrophobicContact CE3-CH2 3.8Å; W139-W192 HydrophobicContact CG-CH2 4.02Å; W139-W192 HydrophobicContact CG-CZ3 4.14Å; W139-W192 HydrophobicContact CZ2-CH2 4.5Å; W139-W192 HydrophobicContact CZ3-CH2 4.26Å; W139-L197 HydrophobicContact CZ2-CD2 4.37Å; W139-P360 HydrophobicContact CZ3-CB 4.19Å; W139-P360 HydrophobicContact CZ3-CG 4.11Å; W139-F364 HydrophobicContact CB-CD1 4.43Å; W139-F364 HydrophobicContact CB-CE1 3.77Å; W139-F364 HydrophobicContact CB-CE2 4.13Å; W139-F364 HydrophobicContact CB-CZ 3.6Å; W139-F364 HydrophobicContact CE3-CD2 4.33Å; W139-F364 AromaticContact CE3-CE2 3.76Å; W139-F364 HydrophobicContact CE3-CE2 3.76Å; W139-F364 HydrophobicContact CE3-CZ 4.31Å; W139-M445 HydrophobicContact CH2-SD 3.69Å; W139-M445 HydrophobicContact CZ2-SD 3.95Å; W139-F448 HydrophobicContact CH2-CB 4.49Å; W139-F448 AromaticContact CH2-CD1 3.71Å; W139-F448 HydrophobicContact CH2-CD1 3.71Å; W139-F448 AromaticContact CH2-CD2 3.69Å; W139-F448 HydrophobicContact CH2-CD2 3.69Å; W139-F448 AromaticContact CH2-CE1 3.77Å; W139-F448 HydrophobicContact CH2-CE1 3.77Å; W139-F448 AromaticContact CH2-CE2 3.72Å; W139-F448 HydrophobicContact CH2-CE2 3.72Å; W139-F448 AromaticContact CH2-CG 3.69Å; W139-F448 HydrophobicContact CH2-CG 3.69Å; W139-F448 AromaticContact CH2-CZ 3.77Å; W139-F448 HydrophobicContact CH2-CZ 3.77Å; W139-F448 HydrophobicContact CZ2-CD2 4.34Å; W139-F448 HydrophobicContact CZ2-CG 4.36Å; W139-F448 HydrophobicContact CZ3-CD1 4.42Å; W139-F448 HydrophobicContact CZ3-CD2 4.38Å; W139-F448 HydrophobicContact CZ3-CE1 4.02Å; W139-F448 AromaticContact CZ3-CE2 3.94Å; W139-F448 HydrophobicContact CZ3-CE2 3.94Å; W139-F448 AromaticContact CZ3-CZ 3.76Å; W139-F448 HydrophobicContact CZ3-CZ 3.76Å
140	A	97.6	Very high	96.3	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.008	14%	0.136	C	C	.	.	H	α-helix	trans	-62.7	-39.7	178.9	0	0	0	0	0	112.6	I136 L137 Y143 L144 F364 F385 L388 I389	I136-A140 PolarHBondContact O-N 3.12Å; L137-A140 PolarHBondContact O-N 3.04Å; A140-Y143 PolarHBondContact O-N 3.48Å; A140-L144 WeakPolarHBondContact O-CB 3.31Å; A140-L144 PolarHBondContact O-N 3.44Å; A140-F364 HydrophobicContact CB-CE1 4.37Å; A140-F364 HydrophobicContact CB-CZ 4.4Å; A140-F385 HydrophobicContact CB-CD1 4.44Å; A140-L388 HydrophobicContact CB-CB 4.29Å; A140-I389 HydrophobicContact CB-CD1 4.47Å; A140-I389 HydrophobicContact CB-CG1 3.71Å
141	L	98.4	Very high	96.1	Very high	10 Å²	10	30.6 Å²	30.6	5%	0.052	16%	0.16	C	C	.	.	H	α-helix	trans	-63.1	-42.6	172.7	-76.4	167.7	0	0	0	111.7	L137 W139 Y143 L144 F145 C216 L219 A220 I389	L137-L141 WeakPolarHBondContact O-CB 3.35Å; L137-L141 VanDerWaalsContact O-CG 3.3Å; L137-L141 WeakPolarHBondContact O-CG 3.48Å; L137-L141 PolarHBondContact O-N 3.04Å; W139-L141 VanDerWaalsContact C-N 3.35Å; W139-L141 PolarHBondContact O-N 2.91Å; L141-Y143 PolarHBondContact O-N 3.26Å; L141-L144 PolarHBondContact O-N 2.66Å; L141-F145 HydrophobicContact CB-CE2 4.32Å; L141-F145 HydrophobicContact CD2-CZ 4.5Å; L141-F145 WeakPolarHBondContact O-CD2 3.47Å; L141-F145 WeakPolarHBondContact O-CG 3.39Å; L141-F145 PolarHBondContact O-N 2.87Å; L141-C216 HydrophobicContact CB-CB 4.12Å; L141-C216 WeakPolarHBondContact CD1-O 3.21Å; L141-L219 HydrophobicContact CD1-CB 4.38Å; L141-L219 HydrophobicContact CD1-CD2 4.25Å; L141-L219 HydrophobicContact CD1-CG 4.27Å; L141-L219 HydrophobicContact CD2-CD2 4.24Å; L141-A220 HydrophobicContact CD1-CB 3.95Å; L141-I389 HydrophobicContact CD2-CD1 3.72Å; L141-I389 HydrophobicContact CD2-CG1 4.46Å; L141-I389 HydrophobicContact CG-CD1 4.09Å; L141-I389 HydrophobicContact CG-CG1 4.42Å
142	F	98.4	Very high	96	Very high	11 Å²	11	29.9 Å²	29.9	5%	0.048	16%	0.156	C	C	.	.	H	α-helix	trans	-59	-47	176.3	-174.7	-81.7	0	0	0	111.8	A138 W139 F145 S146 F191 V196 E212 L213	A138-F142 WeakPolarHBondContact O-CB 3.41Å; A138-F142 PolarHBondContact O-N 3.43Å; W139-F142 WeakPolarHBondContact O-CB 3.24Å; W139-F142 PolarHBondContact O-N 2.9Å; W139-F142 VanDerWaalsContact O-N 3.17Å; F142-F145 PolarHBondContact O-N 3.36Å; F142-S146 WeakPolarHBondContact O-CB 3.39Å; F142-S146 PolarHBondContact O-N 3.38Å; F142-S146 PolarHBondContact O-OG 2.93Å; F142-F191 HydrophobicContact CE1-CE1 4.41Å; F142-F191 AromaticContact CE1-CZ 3.89Å; F142-F191 HydrophobicContact CE1-CZ 3.89Å; F142-V196 HydrophobicContact CD1-CB 4.47Å; F142-V196 HydrophobicContact CD1-CG1 4.07Å; F142-V196 HydrophobicContact CD1-CG2 3.83Å; F142-V196 HydrophobicContact CE1-CB 4.35Å; F142-V196 HydrophobicContact CE1-CG1 4.4Å; F142-V196 HydrophobicContact CE1-CG2 3.62Å; F142-V196 HydrophobicContact CG-CG1 4.44Å; F142-E212 HydrophobicContact CD2-CB 4.28Å; F142-E212 HydrophobicContact CE2-CB 3.89Å; F142-E212 VanDerWaalsContact CE2-OE2 3.32Å; F142-E212 WeakPolarHBondContact CE2-OE2 3.41Å; F142-L213 HydrophobicContact CB-CD2 3.84Å; F142-L213 HydrophobicContact CD2-CD2 3.77Å; F142-L213 HydrophobicContact CG-CD2 3.91Å
143	Y	98.1	Very high	95.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.8	-38.1	176.6	-90.1	-92.6	0	0	0	112.7	W139 A140 L141 S146 S147 W154 F191 W192 V196 F364 P368 F385	W139-Y143 WeakPolarHBondContact O-CD2 3.49Å; W139-Y143 PolarHBondContact O-N 3.33Å; A140-Y143 PolarHBondContact O-N 3.48Å; L141-Y143 PolarHBondContact O-N 3.26Å; Y143-S146 CarbonylContact O-C 3.6Å; Y143-S146 PolarHBondContact O-N 2.89Å; Y143-S147 PolarHBondContact O-N 2.82Å; Y143-S147 PolarHBondContact O-OG 3.43Å; Y143-W154 HydrophobicContact CD1-CE3 4.07Å; Y143-W154 AromaticContact CD1-CH2 3.76Å; Y143-W154 HydrophobicContact CD1-CH2 3.76Å; Y143-W154 HydrophobicContact CD1-CZ2 4.37Å; Y143-W154 AromaticContact CD1-CZ3 3.59Å; Y143-W154 HydrophobicContact CD1-CZ3 3.59Å; Y143-W154 HydrophobicContact CE1-CD2 4.42Å; Y143-W154 HydrophobicContact CE1-CE3 4.02Å; Y143-W154 HydrophobicContact CE1-CH2 4.43Å; Y143-W154 HydrophobicContact CE1-CZ3 4.02Å; Y143-F191 AromaticContact CD1-CE1 3.98Å; Y143-F191 HydrophobicContact CD1-CE1 3.98Å; Y143-F191 AromaticContact CE1-CD1 3.72Å; Y143-F191 HydrophobicContact CE1-CD1 3.72Å; Y143-F191 AromaticContact CE1-CE1 3.46Å; Y143-F191 HydrophobicContact CE1-CE1 3.46Å; Y143-F191 VanDerWaalsContact CE1-CE1 3.46Å; Y143-F191 HydrophobicContact CE2-CE1 4.26Å; Y143-F191 AromaticContact CZ-CD1 3.75Å; Y143-F191 AromaticContact CZ-CE1 3.63Å; Y143-F191 WeakPolarHBondContact OH-CD1 3.17Å; Y143-W192 AromaticContact CE2-CE3 3.74Å; Y143-W192 HydrophobicContact CE2-CE3 3.74Å; Y143-W192 AromaticContact CE2-CZ3 3.88Å; Y143-W192 HydrophobicContact CE2-CZ3 3.88Å; Y143-V196 HydrophobicContact CE2-CG1 4.4Å; Y143-V196 HydrophobicContact CE2-CG2 3.86Å; Y143-F364 AromaticContact CD2-CD1 3.5Å; Y143-F364 HydrophobicContact CD2-CD1 3.5Å; Y143-F364 VanDerWaalsContact CD2-CD1 3.5Å; Y143-F364 AromaticContact CD2-CE1 3.94Å; Y143-F364 HydrophobicContact CD2-CE1 3.94Å; Y143-F364 HydrophobicContact CE2-CB 4.05Å; Y143-F364 AromaticContact CE2-CD1 3.46Å; Y143-F364 HydrophobicContact CE2-CD1 3.46Å; Y143-F364 VanDerWaalsContact CE2-CD1 3.46Å; Y143-F364 HydrophobicContact CE2-CE1 4.3Å; Y143-F364 HydrophobicContact CE2-CG 4.1Å; Y143-F364 HydrophobicContact CG-CD1 4.18Å; Y143-F364 PolarHBondContact OH-O 3.25Å; Y143-P368 HydrophobicContact CE1-CG 4.25Å; Y143-F385 VanDerWaalsContact CB-CE1 3.4Å; Y143-F385 AromaticContact CD1-CE1 3.94Å; Y143-F385 HydrophobicContact CD1-CE1 3.94Å; Y143-F385 AromaticContact CD1-CE2 3.67Å; Y143-F385 HydrophobicContact CD1-CE2 3.67Å; Y143-F385 AromaticContact CD1-CZ 3.22Å; Y143-F385 HydrophobicContact CD1-CZ 3.22Å; Y143-F385 HydrophobicContact CD2-CE1 4.29Å; Y143-F385 HydrophobicContact CD2-CZ 4.37Å; Y143-F385 HydrophobicContact CE1-CZ 4.06Å; Y143-F385 HydrophobicContact CG-CD1 4.33Å; Y143-F385 AromaticContact CG-CE1 3.63Å; Y143-F385 HydrophobicContact CG-CE1 3.63Å; Y143-F385 AromaticContact CG-CE2 3.97Å; Y143-F385 HydrophobicContact CG-CE2 3.97Å; Y143-F385 AromaticContact CG-CZ 3.41Å; Y143-F385 HydrophobicContact CG-CZ 3.41Å; Y143-F385 VanDerWaalsContact CG-CZ 3.41Å
144	L	97.8	Very high	95.9	Very high	19 Å²	19	29.9 Å²	29.9	10%	0.099	16%	0.159	C	C	.	.	H	α-helix	trans	-60.2	-48.3	174.4	178.4	60.4	0	0	0	110.8	A140 L141 S146 S147 F148 C382 F385 I386 I389	A140-L144 WeakPolarHBondContact O-CB 3.31Å; A140-L144 PolarHBondContact O-N 3.44Å; L141-L144 PolarHBondContact O-N 2.66Å; L144-S146 VanDerWaalsContact C-N 3.29Å; L144-S146 PolarHBondContact O-N 3.47Å; L144-S147 WeakPolarHBondContact O-CB 3.46Å; L144-S147 PolarHBondContact O-N 3.16Å; L144-S147 VanDerWaalsContact O-N 3.08Å; L144-F148 HydrophobicContact CD1-CE2 4.1Å; L144-F148 HydrophobicContact CD1-CZ 4.15Å; L144-F148 HydrophobicContact CG-CE2 4.05Å; L144-F148 VanDerWaalsContact O-CD2 3.25Å; L144-F148 WeakPolarHBondContact O-CD2 3.35Å; L144-F148 WeakPolarHBondContact O-CE2 3.25Å; L144-C382 HydrophobicContact CD1-CB 4.28Å; L144-F385 HydrophobicContact CB-CB 4.08Å; L144-I386 HydrophobicContact CD1-CD1 4.35Å; L144-I386 HydrophobicContact CD1-CG1 3.92Å; L144-I386 HydrophobicContact CD2-CG1 4.07Å; L144-I389 HydrophobicContact CB-CD1 4.27Å; L144-I389 HydrophobicContact CD2-CD1 3.6Å
145	F	97.7	Very high	95.6	Very high	106 Å²	106	31.1 Å²	31.1	47%	0.465	17%	0.166	S	C	.	.	H	α-helix	trans	-62.8	-37.8	176.5	-65.3	-41.5	0	0	0	112.5	L141 F142 S147 F148 L219	L141-F145 HydrophobicContact CB-CE2 4.32Å; L141-F145 HydrophobicContact CD2-CZ 4.5Å; L141-F145 WeakPolarHBondContact O-CD2 3.47Å; L141-F145 WeakPolarHBondContact O-CG 3.39Å; L141-F145 PolarHBondContact O-N 2.87Å; F142-F145 PolarHBondContact O-N 3.36Å; F145-S147 PolarHBondContact O-N 3.4Å; F145-F148 PolarHBondContact O-N 2.99Å; F145-L219 HydrophobicContact CE2-CD2 3.94Å; F145-L219 HydrophobicContact CZ-CD2 3.61Å
146	S	96.5	Very high	95.2	Very high	21 Å²	21	32.5 Å²	32.5	15%	0.147	18%	0.175	C	C	.	.	H	α-helix	trans	-69.1	-17.7	175.8	-59.1	0	0	0	0	113.5	F142 Y143 L144 T149 P153	F142-S146 WeakPolarHBondContact O-CB 3.39Å; F142-S146 PolarHBondContact O-N 3.38Å; F142-S146 PolarHBondContact O-OG 2.93Å; Y143-S146 CarbonylContact O-C 3.6Å; Y143-S146 PolarHBondContact O-N 2.89Å; L144-S146 VanDerWaalsContact C-N 3.29Å; L144-S146 PolarHBondContact O-N 3.47Å; S146-T149 PolarHBondContact O-OG1 2.87Å; S146-T149 VanDerWaalsContact O-OG1 3.08Å; S146-P153 VanDerWaalsContact O-CD 3.28Å; S146-P153 WeakPolarHBondContact O-CD 3.31Å
147	S	96.8	Very high	94.9	Very high	1 Å²	1	34 Å²	34	1%	0.007	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-14.7	178.9	-58.3	0	0	0	0	113.5	Y143 L144 F145 T149 S381 C382	Y143-S147 PolarHBondContact O-N 2.82Å; Y143-S147 PolarHBondContact O-OG 3.43Å; L144-S147 WeakPolarHBondContact O-CB 3.46Å; L144-S147 PolarHBondContact O-N 3.16Å; L144-S147 VanDerWaalsContact O-N 3.08Å; F145-S147 PolarHBondContact O-N 3.4Å; S147-T149 PolarHBondContact O-N 2.73Å; S147-S381 PolarHBondContact OG-OG 3.35Å; S147-C382 VanDerWaalsContact CB-SG 3.52Å
148	F	95.1	Very high	94.5	Very high	143 Å²	143	38.6 Å²	38.6	63%	0.627	22%	0.218	S	C	*	.	S	Bend	trans	-83.6	54.7	177.9	-63.7	-69.6	0	0	0	112.2	L144 F145	L144-F148 HydrophobicContact CD1-CE2 4.1Å; L144-F148 HydrophobicContact CD1-CZ 4.15Å; L144-F148 HydrophobicContact CG-CE2 4.05Å; L144-F148 VanDerWaalsContact O-CD2 3.25Å; L144-F148 WeakPolarHBondContact O-CD2 3.35Å; L144-F148 WeakPolarHBondContact O-CE2 3.25Å; F145-F148 PolarHBondContact O-N 2.99Å
149	T	92.6	Very high	94.3	Very high	57 Å²	57	40.6 Å²	40.6	35%	0.35	23%	0.228	S	C	.	.	S	Bend	trans	-132.7	155.5	-178.2	48.5	0	0	0	0	109.8	S146 S147 E151 Q378	S146-T149 PolarHBondContact O-OG1 2.87Å; S146-T149 VanDerWaalsContact O-OG1 3.08Å; S147-T149 PolarHBondContact O-N 2.73Å; T149-E151 WeakPolarHBondContact CB-O 3.11Å; T149-E151 PolarHBondContact O-N 2.96Å; T149-E151 PolarHBondContact OG1-O 3.09Å; T149-Q378 WeakPolarHBondContact O-CG 3.16Å
150	S	88.4	Confident	94.1	Very high	120 Å²	120	47.4 Å²	47.4	84%	0.839	27%	0.27	S	S	*	.	S	Bend	trans	-66.4	-29.9	178.2	53	0	0	0	0	112.4	Q378	S150-Q378 PolarHBondContact O-NE2 3.39Å
151	E	90.9	Very high	93.9	Very high	106 Å²	106	49.6 Å²	49.6	50%	0.495	28%	0.278	S	S	.	.	S	Bend	trans	-134	131.5	174.9	-177.9	176.3	-165.8	0	0	107.6	T149 T156	T149-E151 WeakPolarHBondContact CB-O 3.11Å; T149-E151 PolarHBondContact O-N 2.96Å; T149-E151 PolarHBondContact OG1-O 3.09Å; E151-T156 WeakPolarHBondContact OE1-CG2 3.05Å
152	L	93.9	Very high	93.7	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	28%	0.283	C	S	.	.			trans	-64.8	132.8	-175.8	-66.5	174.2	0	0	0	110	W154 T155 V371 T372 Q378	L152-W154 HydrophobicContact CB-CD2 4.32Å; L152-W154 HydrophobicContact CB-CZ2 4.15Å; L152-W154 HydrophobicContact CD1-CZ2 3.92Å; L152-W154 HydrophobicContact CD2-CH2 4.11Å; L152-W154 HydrophobicContact CD2-CZ2 3.83Å; L152-W154 HydrophobicContact CG-CZ2 4.2Å; L152-W154 PolarHBondContact O-N 3.04Å; L152-T155 WeakPolarHBondContact CB-OG1 3.37Å; L152-T155 VanDerWaalsContact O-CB 3.25Å; L152-T155 WeakPolarHBondContact O-CB 3.33Å; L152-T155 PolarHBondContact O-N 3.37Å; L152-T155 PolarHBondContact O-OG1 3.35Å; L152-V371 HydrophobicContact CD1-CG1 4.12Å; L152-T372 HydrophobicContact CD1-CG2 4.37Å; L152-Q378 HydrophobicContact CD2-CG 4.23Å; L152-Q378 HydrophobicContact CG-CG 4.39Å
153	P	93.8	Very high	93.4	Very high	21 Å²	21	51.6 Å²	51.6	14%	0.136	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.7	-171.9	-26.1	35.4	0	0	0	115.3	S146 N159 W161 F191	S146-P153 VanDerWaalsContact O-CD 3.28Å; S146-P153 WeakPolarHBondContact O-CD 3.31Å; P153-N159 PolarHBondContact O-ND2 3.34Å; P153-W161 HydrophobicContact CB-CH2 4.24Å; P153-W161 HydrophobicContact CB-CZ2 4.03Å; P153-F191 HydrophobicContact CB-CD2 4.13Å; P153-F191 HydrophobicContact CB-CE2 3.69Å; P153-F191 HydrophobicContact CB-CZ 4.4Å; P153-F191 HydrophobicContact CG-CE2 4.47Å
154	W	93.7	Very high	92.8	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	12.7	178.3	54.5	82.5	0	0	0	113.6	Y143 L152 V188 F191 P368 T372 S381 F385	Y143-W154 HydrophobicContact CD1-CE3 4.07Å; Y143-W154 AromaticContact CD1-CH2 3.76Å; Y143-W154 HydrophobicContact CD1-CH2 3.76Å; Y143-W154 HydrophobicContact CD1-CZ2 4.37Å; Y143-W154 AromaticContact CD1-CZ3 3.59Å; Y143-W154 HydrophobicContact CD1-CZ3 3.59Å; Y143-W154 HydrophobicContact CE1-CD2 4.42Å; Y143-W154 HydrophobicContact CE1-CE3 4.02Å; Y143-W154 HydrophobicContact CE1-CH2 4.43Å; Y143-W154 HydrophobicContact CE1-CZ3 4.02Å; L152-W154 HydrophobicContact CB-CD2 4.32Å; L152-W154 HydrophobicContact CB-CZ2 4.15Å; L152-W154 HydrophobicContact CD1-CZ2 3.92Å; L152-W154 HydrophobicContact CD2-CH2 4.11Å; L152-W154 HydrophobicContact CD2-CZ2 3.83Å; L152-W154 HydrophobicContact CG-CZ2 4.2Å; L152-W154 PolarHBondContact O-N 3.04Å; W154-V188 HydrophobicContact CB-CB 4.36Å; W154-V188 HydrophobicContact CB-CG1 4.34Å; W154-V188 HydrophobicContact CB-CG2 4.1Å; W154-V188 HydrophobicContact CG-CG2 4.42Å; W154-V188 WeakPolarHBondContact O-CG2 3.35Å; W154-F191 HydrophobicContact CB-CB 3.79Å; W154-F191 HydrophobicContact CB-CD1 4.12Å; W154-F191 HydrophobicContact CB-CD2 4.49Å; W154-F191 HydrophobicContact CB-CG 3.88Å; W154-F191 HydrophobicContact CD2-CD1 4.44Å; W154-F191 HydrophobicContact CD2-CE1 4.49Å; W154-F191 AromaticContact CE3-CD1 3.76Å; W154-F191 HydrophobicContact CE3-CD1 3.76Å; W154-F191 AromaticContact CE3-CE1 3.45Å; W154-F191 HydrophobicContact CE3-CE1 3.45Å; W154-F191 VanDerWaalsContact CE3-CE1 3.45Å; W154-F191 HydrophobicContact CE3-CE2 4.27Å; W154-F191 HydrophobicContact CE3-CG 4.3Å; W154-F191 AromaticContact CE3-CZ 3.72Å; W154-F191 HydrophobicContact CE3-CZ 3.72Å; W154-F191 AromaticContact CZ3-CE1 3.85Å; W154-F191 HydrophobicContact CZ3-CE1 3.85Å; W154-F191 HydrophobicContact CZ3-CZ 4Å; W154-P368 HydrophobicContact CZ2-CB 4.47Å; W154-P368 PolarHBondContact NE1-O 3.4Å; W154-T372 VanDerWaalsContact CD1-CG2 3.4Å; W154-S381 VanDerWaalsContact CZ2-OG 3.27Å; W154-S381 WeakPolarHBondContact CZ2-OG 3.45Å; W154-F385 HydrophobicContact CH2-CE2 4.18Å; W154-F385 HydrophobicContact CZ2-CE2 4.26Å
155	T	90.7	Very high	92.2	Very high	27 Å²	27	64 Å²	64	17%	0.166	35%	0.348	C	S	.	.	S	Bend	trans	-81.3	-38	176.6	-49.1	0	0	0	0	111.8	L152	L152-T155 WeakPolarHBondContact CB-OG1 3.37Å; L152-T155 VanDerWaalsContact O-CB 3.25Å; L152-T155 WeakPolarHBondContact O-CB 3.33Å; L152-T155 PolarHBondContact O-N 3.37Å; L152-T155 PolarHBondContact O-OG1 3.35Å
156	T	89.5	Confident	91.7	Very high	28 Å²	28	59.7 Å²	59.7	17%	0.172	33%	0.331	C	S	.	.			trans	-118.3	158.5	-169	59.2	0	0	0	0	112.8	E151 S158 N159 N162 P187	E151-T156 WeakPolarHBondContact OE1-CG2 3.05Å; T156-S158 PolarHBondContact OG1-OG 3.12Å; T156-N159 PolarHBondContact O-ND2 3.11Å; T156-N159 PolarHBondContact OG1-ND2 2.89Å; T156-N162 PolarHBondContact O-OD1 3.01Å; T156-P187 WeakPolarHBondContact O-CB 3.42Å
157	C	89.4	Confident	91.1	Very high	36 Å²	36	60 Å²	60	24%	0.243	33%	0.332	C	S	.	.	S	Bend	trans	-93	11.8	173.7	-71.1	0	0	0	0	113.5	N162 C166 V167	C157-N162 WeakPolarHBondContact CA-OD1 3.48Å; C157-N162 VanDerWaalsContact O-CB 3.26Å; C157-N162 WeakPolarHBondContact O-CB 3.5Å; C157-N162 PolarHBondContact O-OD1 2.71Å; C157-C166 VanDerWaalsContact CA-SG 3.57Å; C157-C166 HydrophobicContact CB-CB 3.6Å; C157-C166 WeakPolarHBondContact CB-SG 3.31Å; C157-C166 WeakPolarHBondContact SG-CB 3.28Å; C157-C166 PolarHBondContact SG-O 3.24Å; C157-C166 VanDerWaalsContact SG-O 3.42Å; C157-C166 CovalentContact SG-SG 2.04Å; C157-C166 PolarHBondContact SG-SG 3.17Å; C157-V167 PolarHBondContact SG-N 3.18Å
158	S	89.4	Confident	90	Very high	102 Å²	102	61.4 Å²	61.4	71%	0.713	34%	0.339	S	S	*	.			trans	-94.2	15.4	-173.6	60	0	0	0	0	114.1	T156	T156-S158 PolarHBondContact OG1-OG 3.12Å
159	N	92.5	Very high	88.6	Confident	41 Å²	41	59.6 Å²	59.6	22%	0.219	33%	0.331	C	S	.	.	S	Bend	trans	-94	160.8	-175.3	-55.6	-81.5	0	0	0	112.1	P153 T156 W161 N162	P153-N159 PolarHBondContact O-ND2 3.34Å; T156-N159 PolarHBondContact O-ND2 3.11Å; T156-N159 PolarHBondContact OG1-ND2 2.89Å; N159-W161 HydrophobicContact CB-CD2 3.64Å; N159-W161 HydrophobicContact CB-CE3 3.98Å; N159-W161 HydrophobicContact CB-CG 4.29Å; N159-W161 HydrophobicContact CB-CH2 3.76Å; N159-W161 HydrophobicContact CB-CZ2 3.36Å; N159-W161 HydrophobicContact CB-CZ3 4.05Å; N159-W161 PolarHBondContact O-N 3.4Å; N159-W161 VanDerWaalsContact O-N 3.09Å; N159-N162 WeakPolarHBondContact CA-OD1 3.2Å; N159-N162 VanDerWaalsContact CB-OD1 3.22Å; N159-N162 WeakPolarHBondContact CB-OD1 3.25Å; N159-N162 PolarHBondContact N-OD1 2.99Å; N159-N162 PolarHBondContact ND2-OD1 3.26Å; N159-N162 WeakPolarHBondContact O-CB 3.26Å; N159-N162 PolarHBondContact O-N 3.38Å
160	V	94.6	Very high	87.1	Confident	145 Å²	145	60.7 Å²	60.7	88%	0.879	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-18.6	-177.4	-61.3	0	0	0	0	114.6
161	W	94.1	Very high	85.5	Confident	47 Å²	47	60.9 Å²	60.9	18%	0.178	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-9.2	177.5	52.7	82.6	0	0	0	113.2	P153 N159 F191 R194 R195	P153-W161 HydrophobicContact CB-CH2 4.24Å; P153-W161 HydrophobicContact CB-CZ2 4.03Å; N159-W161 HydrophobicContact CB-CD2 3.64Å; N159-W161 HydrophobicContact CB-CE3 3.98Å; N159-W161 HydrophobicContact CB-CG 4.29Å; N159-W161 HydrophobicContact CB-CH2 3.76Å; N159-W161 HydrophobicContact CB-CZ2 3.36Å; N159-W161 HydrophobicContact CB-CZ3 4.05Å; N159-W161 PolarHBondContact O-N 3.4Å; N159-W161 VanDerWaalsContact O-N 3.09Å; W161-F191 AromaticContact CE2-CD2 3.88Å; W161-F191 HydrophobicContact CH2-CE2 4.49Å; W161-F191 AromaticContact CZ2-CD2 3.7Å; W161-F191 HydrophobicContact CZ2-CD2 3.7Å; W161-F191 HydrophobicContact CZ2-CE2 4.02Å; W161-F191 AromaticContact NE1-CD2 3.94Å; W161-R194 HydrophobicContact CB-CB 4.32Å; W161-R194 WeakPolarHBondContact O-CD 3.45Å; W161-R195 HydrophobicContact CB-CB 4.13Å; W161-R195 HydrophobicContact CD2-CB 3.66Å; W161-R195 HydrophobicContact CD2-CG 3.8Å; W161-R195 HydrophobicContact CE3-CB 4.15Å; W161-R195 VanDerWaalsContact CE3-CD 3.42Å; W161-R195 HydrophobicContact CE3-CG 3.82Å; W161-R195 HydrophobicContact CG-CB 3.66Å; W161-R195 HydrophobicContact CG-CG 4.33Å; W161-R195 HydrophobicContact CH2-CG 4.32Å; W161-R195 HydrophobicContact CZ2-CG 4.32Å; W161-R195 HydrophobicContact CZ3-CG 4.07Å
162	N	94.3	Very high	83.8	Confident	27 Å²	27	61.8 Å²	61.8	14%	0.144	33%	0.33	C	S	.	.			trans	-77.3	152.4	-175.6	-69.3	125.7	0	0	0	112.6	T156 C157 N159 C166 E190	T156-N162 PolarHBondContact O-OD1 3.01Å; C157-N162 WeakPolarHBondContact CA-OD1 3.48Å; C157-N162 VanDerWaalsContact O-CB 3.26Å; C157-N162 WeakPolarHBondContact O-CB 3.5Å; C157-N162 PolarHBondContact O-OD1 2.71Å; N159-N162 WeakPolarHBondContact CA-OD1 3.2Å; N159-N162 VanDerWaalsContact CB-OD1 3.22Å; N159-N162 WeakPolarHBondContact CB-OD1 3.25Å; N159-N162 PolarHBondContact N-OD1 2.99Å; N159-N162 PolarHBondContact ND2-OD1 3.26Å; N159-N162 WeakPolarHBondContact O-CB 3.26Å; N159-N162 PolarHBondContact O-N 3.38Å; N162-C166 HydrophobicContact CB-CB 4.33Å; N162-E190 WeakPolarHBondContact CA-OE2 3.29Å; N162-E190 WeakPolarHBondContact CB-OE2 3.22Å; N162-E190 PolarHBondContact ND2-OE2 3.48Å
163	T	90.9	Very high	81.3	Confident	36 Å²	36	67.9 Å²	67.9	22%	0.221	37%	0.373	C	S	.	.			trans	-101.8	167.4	173.1	73.4	0	0	0	0	112.2	H165 C166 E190 R194	T163-H165 PolarHBondContact O-N 3.07Å; T163-H165 PolarHBondContact OG1-N 3.35Å; T163-C166 VanDerWaalsContact O-CB 3.28Å; T163-C166 WeakPolarHBondContact O-CB 3.17Å; T163-C166 PolarHBondContact O-N 2.85Å; T163-C166 VanDerWaalsContact O-N 3.1Å; T163-E190 WeakPolarHBondContact CB-OE1 3.3Å; T163-E190 PolarHBondContact N-OE2 2.73Å; T163-E190 PolarHBondContact OG1-OE1 2.93Å; T163-R194 VanDerWaalsContact CG2-NH1 3.31Å
164	E	86.5	Confident	78.9	Confident	190 Å²	190	68.9 Å²	68.9	89%	0.888	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-18.7	172.1	-61.5	-177.7	176.8	0	0	112.9	C166	E164-C166 VanDerWaalsContact C-N 3.35Å
165	H	85.4	Confident	76.5	Confident	90 Å²	90	74.3 Å²	74.3	42%	0.417	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-0.6	177.4	-57	-62	0	0	0	113.6	T163 V167 F184 T185	T163-H165 PolarHBondContact O-N 3.07Å; T163-H165 PolarHBondContact OG1-N 3.35Å; H165-V167 PolarHBondContact O-N 3.35Å; H165-F184 WeakPolarHBondContact O-CA 3.46Å; H165-T185 PolarHBondContact O-N 3.06Å; H165-T185 PolarHBondContact O-OG1 2.9Å
166	C	86.9	Confident	74.3	Confident	15 Å²	15	75.5 Å²	75.5	10%	0.101	45%	0.45	C	S	.	.	B	Isolated β-bridge	trans	-72.5	124.2	176.1	-171.3	0	0	0	0	110.5	C157 N162 T163 E164 T185 E190	C157-C166 VanDerWaalsContact CA-SG 3.57Å; C157-C166 HydrophobicContact CB-CB 3.6Å; C157-C166 WeakPolarHBondContact CB-SG 3.31Å; C157-C166 WeakPolarHBondContact SG-CB 3.28Å; C157-C166 PolarHBondContact SG-O 3.24Å; C157-C166 VanDerWaalsContact SG-O 3.42Å; C157-C166 CovalentContact SG-SG 2.04Å; C157-C166 PolarHBondContact SG-SG 3.17Å; N162-C166 HydrophobicContact CB-CB 4.33Å; T163-C166 VanDerWaalsContact O-CB 3.28Å; T163-C166 WeakPolarHBondContact O-CB 3.17Å; T163-C166 PolarHBondContact O-N 2.85Å; T163-C166 VanDerWaalsContact O-N 3.1Å; E164-C166 VanDerWaalsContact C-N 3.35Å; C166-T185 WeakPolarHBondContact CA-O 3.18Å; C166-E190 VanDerWaalsContact CB-OE2 3.3Å; C166-E190 WeakPolarHBondContact CB-OE2 3.42Å
167	V	82.9	Confident	72.2	Confident	27 Å²	27	80.9 Å²	80.9	16%	0.164	48%	0.482	C	S	.	.			trans	-119.7	128.5	177.9	-177	0	0	0	0	110.6	C157 H165 F169 F184 T185 P187	C157-V167 PolarHBondContact SG-N 3.18Å; H165-V167 PolarHBondContact O-N 3.35Å; V167-F169 HydrophobicContact CB-CE2 4.34Å; V167-F169 HydrophobicContact CB-CZ 4.34Å; V167-F169 VanDerWaalsContact O-CD2 3.3Å; V167-F169 WeakPolarHBondContact O-CD2 3.34Å; V167-F169 WeakPolarHBondContact O-CE2 3.45Å; V167-F169 PolarHBondContact O-N 2.96Å; V167-F184 HydrophobicContact CG2-CB 3.85Å; V167-F184 HydrophobicContact CG2-CD1 3.25Å; V167-F184 HydrophobicContact CG2-CE1 3.96Å; V167-F184 HydrophobicContact CG2-CG 3.72Å; V167-T185 PolarHBondContact N-O 2.63Å; V167-P187 WeakPolarHBondContact O-CD 3.19Å
168	D	75.2	Confident	70.3	Confident	31 Å²	31	83.9 Å²	83.9	17%	0.166	50%	0.499	C	S	.	.			trans	-82.4	99.9	167.9	-179.5	6.1	0	0	0	109.8	L170 N171	D168-L170 PolarHBondContact O-N 3.19Å; D168-L170 WeakPolarHBondContact OD1-CB 3.49Å; D168-L170 PolarHBondContact OD1-N 3.39Å; D168-N171 PolarHBondContact O-N 3.05Å; D168-N171 PolarHBondContact OD2-ND2 2.95Å
169	F	65.1	Low	68.2	Low	105 Å²	105	82.9 Å²	82.9	46%	0.461	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-11.3	-179.3	-66.3	-84.1	0	0	0	113.9	V167	V167-F169 HydrophobicContact CB-CE2 4.34Å; V167-F169 HydrophobicContact CB-CZ 4.34Å; V167-F169 VanDerWaalsContact O-CD2 3.3Å; V167-F169 WeakPolarHBondContact O-CD2 3.34Å; V167-F169 WeakPolarHBondContact O-CE2 3.45Å; V167-F169 PolarHBondContact O-N 2.96Å
170	L	60.9	Low	66.1	Low	79 Å²	79	87.5 Å²	87.5	41%	0.414	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-23	-179.2	-65.4	168.7	0	0	0	113.3	D168 M373	D168-L170 PolarHBondContact O-N 3.19Å; D168-L170 WeakPolarHBondContact OD1-CB 3.49Å; D168-L170 PolarHBondContact OD1-N 3.39Å; L170-M373 HydrophobicContact CD1-CE 4.33Å; L170-M373 HydrophobicContact CD1-CG 3.92Å; L170-M373 HydrophobicContact CD2-CE 3.88Å; L170-M373 HydrophobicContact CD2-CG 3.79Å; L170-M373 HydrophobicContact CD2-SD 4.11Å; L170-M373 HydrophobicContact CG-CE 4.35Å; L170-M373 HydrophobicContact CG-CG 4.48Å
171	N	55.8	Low	63.7	Low	124 Å²	124	85.1 Å²	85.1	66%	0.663	51%	0.511	S	S	*	.	S	Bend	trans	-97.7	-0.4	-173.3	-93.7	-41.7	0	0	0	115.3	D168 S173	D168-N171 PolarHBondContact O-N 3.05Å; D168-N171 PolarHBondContact OD2-ND2 2.95Å; N171-S173 PolarHBondContact O-N 3.01Å
172	H	54.2	Low	61.6	Low	125 Å²	125	87.7 Å²	87.7	58%	0.579	53%	0.525	S	S	*	.			trans	-83.5	87.8	-178.2	-89.5	-81.2	0	0	0	113.8	G174	H172-G174 PolarHBondContact ND1-O 3.38Å
173	S	41.4	Very low	60.3	Low	129 Å²	129	93.8 Å²	93.8	90%	0.902	56%	0.558	S	S	*	*			trans	-86	8.5	153.9	37.6	0	0	0	0	112.8	N171	N171-S173 PolarHBondContact O-N 3.01Å
174	G	43.5	Very low	59.5	Low	43 Å²	43	95.6 Å²	95.6	44%	0.443	56%	0.563	S	S	.	*			trans	-117.2	77	176	0	0	0	0	0	112	H172 G176	H172-G174 PolarHBondContact ND1-O 3.38Å; G174-G176 PolarHBondContact O-N 3.47Å
175	A	44.3	Very low	59.4	Low	114 Å²	114	88.6 Å²	88.6	94%	0.942	53%	0.533	S	S	*	.			trans	-74.3	62	167.5	0	0	0	0	0	110.6
176	G	44.2	Very low	59.5	Low	52 Å²	52	84.7 Å²	84.7	54%	0.536	52%	0.516	S	S	.	.	S	Bend	trans	-114.8	104.3	170.3	0	0	0	0	0	109.2	G174	G174-G176 PolarHBondContact O-N 3.47Å
177	T	45.4	Very low	59.7	Low	140 Å²	140	84.5 Å²	84.5	86%	0.859	52%	0.515	S	S	*	.			trans	58.3	64.1	165.5	51.6	0	0	0	0	116.6	T179	T177-T179 PolarHBondContact O-N 3.07Å
178	V	48.4	Very low	60.1	Low	99 Å²	99	83.3 Å²	83.3	60%	0.6	51%	0.507	S	S	*	.			trans	-85.4	101.8	153	-176.7	0	0	0	0	106.9	F184	V178-F184 HydrophobicContact CG1-CD2 4.07Å; V178-F184 HydrophobicContact CG1-CE2 3.49Å; V178-F184 VanDerWaalsContact CG1-CE2 3.49Å; V178-F184 HydrophobicContact CG1-CZ 4.26Å
179	T	45.6	Very low	60.7	Low	81 Å²	81	83.6 Å²	83.6	50%	0.497	51%	0.508	S	S	.	.			trans	-63.1	134.4	169.2	31.5	0	0	0	0	109.1	T177 S181	T177-T179 PolarHBondContact O-N 3.07Å; T179-S181 PolarHBondContact O-N 2.88Å
180	P	48.7	Very low	62.1	Low	139 Å²	139	78.9 Å²	78.9	90%	0.903	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	12.8	-176.7	-14.9	28.9	0	0	0	114.9
181	S	43.8	Very low	63.7	Low	95 Å²	95	75.2 Å²	75.2	66%	0.664	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	1.9	-164.9	61.8	0	0	0	0	115	T179	T179-S181 PolarHBondContact O-N 2.88Å
182	E	49.8	Very low	65.6	Low	100 Å²	100	69.4 Å²	69.4	47%	0.467	44%	0.437	S	S	.	.	S	Bend	trans	-117.6	133.2	177.1	-66.2	-173.2	164.4	0	0	110.6	F184	E182-F184 VanDerWaalsContact C-N 3.27Å; E182-F184 HydrophobicContact CB-CD2 4.34Å; E182-F184 HydrophobicContact CB-CE1 4.31Å; E182-F184 HydrophobicContact CB-CE2 3.79Å; E182-F184 HydrophobicContact CB-CZ 3.79Å; E182-F184 VanDerWaalsContact O-CD2 3.28Å; E182-F184 WeakPolarHBondContact O-CD2 3.46Å; E182-F184 PolarHBondContact O-N 3.27Å; E182-F184 WeakPolarHBondContact OE2-CZ 2.91Å
183	N	67.6	Low	67.5	Low	156 Å²	156	65.7 Å²	65.7	83%	0.834	42%	0.42	S	S	*	.			trans	-75.6	77.3	179.1	-71.3	-21.9	0	0	0	109.9
184	F	75.1	Confident	70.1	Confident	73 Å²	73	65.9 Å²	65.9	32%	0.32	40%	0.401	S	S	.	.			trans	-66.3	142	176.1	-64.6	-69.4	0	0	0	111.8	H165 V167 V178 E182	H165-F184 WeakPolarHBondContact O-CA 3.46Å; V167-F184 HydrophobicContact CG2-CB 3.85Å; V167-F184 HydrophobicContact CG2-CD1 3.25Å; V167-F184 HydrophobicContact CG2-CE1 3.96Å; V167-F184 HydrophobicContact CG2-CG 3.72Å; V178-F184 HydrophobicContact CG1-CD2 4.07Å; V178-F184 HydrophobicContact CG1-CE2 3.49Å; V178-F184 VanDerWaalsContact CG1-CE2 3.49Å; V178-F184 HydrophobicContact CG1-CZ 4.26Å; E182-F184 VanDerWaalsContact C-N 3.27Å; E182-F184 HydrophobicContact CB-CD2 4.34Å; E182-F184 HydrophobicContact CB-CE1 4.31Å; E182-F184 HydrophobicContact CB-CE2 3.79Å; E182-F184 HydrophobicContact CB-CZ 3.79Å; E182-F184 VanDerWaalsContact O-CD2 3.28Å; E182-F184 WeakPolarHBondContact O-CD2 3.46Å; E182-F184 PolarHBondContact O-N 3.27Å; E182-F184 WeakPolarHBondContact OE2-CZ 2.91Å
185	T	83.4	Confident	72.6	Confident	43 Å²	43	66.3 Å²	66.3	26%	0.264	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-115.2	156.7	179.7	50.4	0	0	0	0	110.4	H165 C166 V167 E190	H165-T185 PolarHBondContact O-N 3.06Å; H165-T185 PolarHBondContact O-OG1 2.9Å; C166-T185 WeakPolarHBondContact CA-O 3.18Å; V167-T185 PolarHBondContact N-O 2.63Å; T185-E190 PolarHBondContact OG1-OE1 3.37Å
186	S	86.8	Confident	75.1	Confident	9 Å²	9	60.9 Å²	60.9	6%	0.063	34%	0.344	C	S	.	.			trans	-94.6	153.6	175.6	73.2	0	0	0	0	111.5	V188 M189 E190	S186-V188 PolarHBondContact O-N 3.31Å; S186-M189 WeakPolarHBondContact O-CB 3.46Å; S186-M189 PolarHBondContact O-N 3.31Å; S186-M189 VanDerWaalsContact O-N 3.1Å; S186-M189 VanDerWaalsContact OG-CG 3.29Å; S186-M189 WeakPolarHBondContact OG-CG 3.01Å; S186-M189 PolarHBondContact OG-N 2.96Å; S186-E190 PolarHBondContact O-N 3.33Å
187	P	91.3	Very high	77.6	Confident	10 Å²	10	58.8 Å²	58.8	7%	0.065	32%	0.321	C	S	.	.	H	α-helix	trans	-59.3	-31.3	-180	22.2	-33.9	0	0	0	113	T156 V167 F191	T156-P187 WeakPolarHBondContact O-CB 3.42Å; V167-P187 WeakPolarHBondContact O-CD 3.19Å; P187-F191 WeakPolarHBondContact O-CB 3.25Å; P187-F191 PolarHBondContact O-N 3.27Å
188	V	91.3	Very high	79.9	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.012	29%	0.289	C	S	.	.	H	α-helix	trans	-71	-42.1	176.7	-168	0	0	0	0	112.2	W154 S186 E190 F191 W192 I365 P368 K369	W154-V188 HydrophobicContact CB-CB 4.36Å; W154-V188 HydrophobicContact CB-CG1 4.34Å; W154-V188 HydrophobicContact CB-CG2 4.1Å; W154-V188 HydrophobicContact CG-CG2 4.42Å; W154-V188 WeakPolarHBondContact O-CG2 3.35Å; S186-V188 PolarHBondContact O-N 3.31Å; V188-E190 VanDerWaalsContact C-N 3.35Å; V188-F191 PolarHBondContact O-N 2.99Å; V188-W192 PolarHBondContact O-N 3.07Å; V188-I365 HydrophobicContact CG1-CG2 4.39Å; V188-I365 WeakPolarHBondContact CG1-O 3.28Å; V188-P368 HydrophobicContact CG1-CB 4.05Å; V188-K369 HydrophobicContact CB-CB 4.38Å; V188-K369 HydrophobicContact CG1-CB 4.47Å; V188-K369 HydrophobicContact CG2-CB 3.85Å; V188-K369 HydrophobicContact CG2-CG 4.04Å
189	M	89.1	Confident	82.1	Confident	38 Å²	38	50.6 Å²	50.6	19%	0.187	27%	0.27	C	S	.	.	H	α-helix	trans	-60.3	-46.8	174.1	-76.2	-64.2	-65.2	0	0	110.9	S186 F191 W192 E193 I365	S186-M189 WeakPolarHBondContact O-CB 3.46Å; S186-M189 PolarHBondContact O-N 3.31Å; S186-M189 VanDerWaalsContact O-N 3.1Å; S186-M189 VanDerWaalsContact OG-CG 3.29Å; S186-M189 WeakPolarHBondContact OG-CG 3.01Å; S186-M189 PolarHBondContact OG-N 2.96Å; M189-F191 PolarHBondContact O-N 2.99Å; M189-W192 PolarHBondContact O-N 3.35Å; M189-E193 WeakPolarHBondContact O-CB 3.16Å; M189-E193 PolarHBondContact O-N 3.47Å; M189-I365 HydrophobicContact CE-CD1 4.13Å; M189-I365 HydrophobicContact CG-CG2 4.02Å; M189-I365 HydrophobicContact SD-CB 4.2Å; M189-I365 HydrophobicContact SD-CD1 3.34Å; M189-I365 WeakPolarHBondContact SD-CD1 3.47Å; M189-I365 HydrophobicContact SD-CG1 3.88Å; M189-I365 HydrophobicContact SD-CG2 3.36Å; M189-I365 WeakPolarHBondContact SD-CG2 3.29Å
190	E	93.2	Very high	84.5	Confident	5 Å²	5	47.5 Å²	47.5	2%	0.023	25%	0.251	C	S	.	.	H	α-helix	trans	-68.4	-34.4	178.7	-66.6	-161.5	159.5	0	0	112.6	N162 T163 C166 T185 S186 V188 R194 R195	N162-E190 WeakPolarHBondContact CA-OE2 3.29Å; N162-E190 WeakPolarHBondContact CB-OE2 3.22Å; N162-E190 PolarHBondContact ND2-OE2 3.48Å; T163-E190 WeakPolarHBondContact CB-OE1 3.3Å; T163-E190 PolarHBondContact N-OE2 2.73Å; T163-E190 PolarHBondContact OG1-OE1 2.93Å; C166-E190 VanDerWaalsContact CB-OE2 3.3Å; C166-E190 WeakPolarHBondContact CB-OE2 3.42Å; T185-E190 PolarHBondContact OG1-OE1 3.37Å; S186-E190 PolarHBondContact O-N 3.33Å; V188-E190 VanDerWaalsContact C-N 3.35Å; E190-R194 WeakPolarHBondContact O-CA 3.38Å; E190-R194 WeakPolarHBondContact O-CB 3.39Å; E190-R194 PolarHBondContact O-N 2.86Å; E190-R195 PolarHBondContact O-N 2.99Å
191	F	95.8	Very high	86.6	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.009	24%	0.239	C	C	.	.	I	π-helix	trans	-59.5	-48.8	171.2	-176.8	-100.1	0	0	0	110.9	F142 Y143 P153 W154 W161 P187 V188 M189 R195 V196	F142-F191 HydrophobicContact CE1-CE1 4.41Å; F142-F191 AromaticContact CE1-CZ 3.89Å; F142-F191 HydrophobicContact CE1-CZ 3.89Å; Y143-F191 AromaticContact CD1-CE1 3.98Å; Y143-F191 HydrophobicContact CD1-CE1 3.98Å; Y143-F191 AromaticContact CE1-CD1 3.72Å; Y143-F191 HydrophobicContact CE1-CD1 3.72Å; Y143-F191 AromaticContact CE1-CE1 3.46Å; Y143-F191 HydrophobicContact CE1-CE1 3.46Å; Y143-F191 VanDerWaalsContact CE1-CE1 3.46Å; Y143-F191 HydrophobicContact CE2-CE1 4.26Å; Y143-F191 AromaticContact CZ-CD1 3.75Å; Y143-F191 AromaticContact CZ-CE1 3.63Å; Y143-F191 WeakPolarHBondContact OH-CD1 3.17Å; P153-F191 HydrophobicContact CB-CD2 4.13Å; P153-F191 HydrophobicContact CB-CE2 3.69Å; P153-F191 HydrophobicContact CB-CZ 4.4Å; P153-F191 HydrophobicContact CG-CE2 4.47Å; W154-F191 HydrophobicContact CB-CB 3.79Å; W154-F191 HydrophobicContact CB-CD1 4.12Å; W154-F191 HydrophobicContact CB-CD2 4.49Å; W154-F191 HydrophobicContact CB-CG 3.88Å; W154-F191 HydrophobicContact CD2-CD1 4.44Å; W154-F191 HydrophobicContact CD2-CE1 4.49Å; W154-F191 AromaticContact CE3-CD1 3.76Å; W154-F191 HydrophobicContact CE3-CD1 3.76Å; W154-F191 AromaticContact CE3-CE1 3.45Å; W154-F191 HydrophobicContact CE3-CE1 3.45Å; W154-F191 VanDerWaalsContact CE3-CE1 3.45Å; W154-F191 HydrophobicContact CE3-CE2 4.27Å; W154-F191 HydrophobicContact CE3-CG 4.3Å; W154-F191 AromaticContact CE3-CZ 3.72Å; W154-F191 HydrophobicContact CE3-CZ 3.72Å; W154-F191 AromaticContact CZ3-CE1 3.85Å; W154-F191 HydrophobicContact CZ3-CE1 3.85Å; W154-F191 HydrophobicContact CZ3-CZ 4Å; W161-F191 AromaticContact CE2-CD2 3.88Å; W161-F191 HydrophobicContact CH2-CE2 4.49Å; W161-F191 AromaticContact CZ2-CD2 3.7Å; W161-F191 HydrophobicContact CZ2-CD2 3.7Å; W161-F191 HydrophobicContact CZ2-CE2 4.02Å; W161-F191 AromaticContact NE1-CD2 3.94Å; P187-F191 WeakPolarHBondContact O-CB 3.25Å; P187-F191 PolarHBondContact O-N 3.27Å; V188-F191 PolarHBondContact O-N 2.99Å; M189-F191 PolarHBondContact O-N 2.99Å; F191-R195 HydrophobicContact CD2-CB 3.94Å; F191-R195 HydrophobicContact CD2-CG 3.91Å; F191-R195 HydrophobicContact CE2-CB 4.26Å; F191-R195 HydrophobicContact CE2-CG 3.73Å; F191-R195 HydrophobicContact CG-CB 4.5Å; F191-R195 WeakPolarHBondContact O-CA 3.48Å; F191-R195 VanDerWaalsContact O-CB 3.25Å; F191-R195 WeakPolarHBondContact O-CB 3.31Å; F191-R195 PolarHBondContact O-N 3.28Å; F191-V196 HydrophobicContact CD1-CG2 3.77Å; F191-V196 HydrophobicContact CE1-CG2 3.46Å; F191-V196 VanDerWaalsContact CE1-CG2 3.46Å; F191-V196 HydrophobicContact CZ-CG2 4Å; F191-V196 WeakPolarHBondContact O-CG2 3.38Å; F191-V196 PolarHBondContact O-N 2.96Å
192	W	95.4	Very high	88.9	Confident	3 Å²	3	40.7 Å²	40.7	1%	0.011	21%	0.207	C	C	.	.	I	π-helix	trans	-62.3	-56.8	177.8	176.1	-113.5	0	0	0	112.7	W139 Y143 V188 M189 V196 L197 P360 F364 I365 M445	W139-W192 HydrophobicContact CB-CZ3 4.3Å; W139-W192 AromaticContact CD2-CH2 3.7Å; W139-W192 HydrophobicContact CD2-CH2 3.7Å; W139-W192 HydrophobicContact CD2-CZ3 4.31Å; W139-W192 AromaticContact CE3-CH2 3.8Å; W139-W192 HydrophobicContact CE3-CH2 3.8Å; W139-W192 HydrophobicContact CG-CH2 4.02Å; W139-W192 HydrophobicContact CG-CZ3 4.14Å; W139-W192 HydrophobicContact CZ2-CH2 4.5Å; W139-W192 HydrophobicContact CZ3-CH2 4.26Å; Y143-W192 AromaticContact CE2-CE3 3.74Å; Y143-W192 HydrophobicContact CE2-CE3 3.74Å; Y143-W192 AromaticContact CE2-CZ3 3.88Å; Y143-W192 HydrophobicContact CE2-CZ3 3.88Å; V188-W192 PolarHBondContact O-N 3.07Å; M189-W192 PolarHBondContact O-N 3.35Å; W192-V196 HydrophobicContact CE3-CB 4.15Å; W192-V196 HydrophobicContact CE3-CG1 4.12Å; W192-V196 HydrophobicContact CE3-CG2 4.45Å; W192-V196 HydrophobicContact CZ3-CG1 4.08Å; W192-L197 HydrophobicContact CD2-CD1 4.08Å; W192-L197 HydrophobicContact CD2-CG 4.26Å; W192-L197 VanDerWaalsContact CE2-CD1 3.49Å; W192-L197 HydrophobicContact CE3-CG 4.47Å; W192-L197 HydrophobicContact CG-CD1 4.48Å; W192-L197 HydrophobicContact CH2-CD1 4.44Å; W192-L197 HydrophobicContact CH2-CD2 4.27Å; W192-L197 HydrophobicContact CH2-CG 4.48Å; W192-L197 HydrophobicContact CZ2-CD1 3.72Å; W192-L197 HydrophobicContact CZ2-CD2 4.31Å; W192-L197 HydrophobicContact CZ2-CG 4.22Å; W192-L197 WeakPolarHBondContact O-CB 3.45Å; W192-L197 WeakPolarHBondContact O-CG 3.27Å; W192-L197 PolarHBondContact O-N 2.92Å; W192-P360 HydrophobicContact CZ2-CB 4.29Å; W192-F364 HydrophobicContact CD2-CB 4.1Å; W192-F364 HydrophobicContact CE3-CB 3.66Å; W192-F364 HydrophobicContact CE3-CG 4.21Å; W192-F364 HydrophobicContact CH2-CB 4.03Å; W192-F364 AromaticContact CH2-CD2 3.77Å; W192-F364 HydrophobicContact CH2-CD2 3.77Å; W192-F364 HydrophobicContact CH2-CE2 4.46Å; W192-F364 AromaticContact CH2-CG 3.94Å; W192-F364 HydrophobicContact CH2-CG 3.94Å; W192-F364 HydrophobicContact CZ2-CB 4.47Å; W192-F364 HydrophobicContact CZ2-CD2 4.49Å; W192-F364 HydrophobicContact CZ3-CB 3.61Å; W192-F364 HydrophobicContact CZ3-CD1 4.15Å; W192-F364 AromaticContact CZ3-CD2 3.96Å; W192-F364 HydrophobicContact CZ3-CD2 3.96Å; W192-F364 AromaticContact CZ3-CG 3.64Å; W192-F364 HydrophobicContact CZ3-CG 3.64Å; W192-I365 HydrophobicContact CB-CD1 4.41Å; W192-I365 HydrophobicContact CB-CG1 3.98Å; W192-I365 HydrophobicContact CG-CD1 4.07Å; W192-I365 HydrophobicContact CG-CG1 3.97Å; W192-M445 HydrophobicContact CZ2-SD 4.46Å
193	E	93.9	Very high	91	Very high	46 Å²	46	36.4 Å²	36.4	22%	0.215	19%	0.187	C	C	.	.	I	π-helix	trans	-74.7	-37.8	-171.6	-66.8	-172.2	161.4	0	0	112.6	M189 S198 I199 N526	M189-E193 WeakPolarHBondContact O-CB 3.16Å; M189-E193 PolarHBondContact O-N 3.47Å; E193-S198 CarbonylContact O-C 3.56Å; E193-S198 WeakPolarHBondContact O-CA 3.18Å; E193-S198 PolarHBondContact O-N 2.84Å; E193-I199 HydrophobicContact CB-CG2 4.02Å; E193-I199 HydrophobicContact CG-CG2 4.48Å; E193-I199 PolarHBondContact O-N 3.42Å; E193-N526 PolarHBondContact OE1-ND2 3.41Å
194	R	95.1	Very high	92.2	Very high	133 Å²	133	34.9 Å²	34.9	50%	0.502	17%	0.174	S	C	.	.	I	π-helix	trans	-102.4	-32.1	-172.3	-58.9	-178.9	149.8	-109	-4.6	114.1	W161 T163 E190 S198	W161-R194 HydrophobicContact CB-CB 4.32Å; W161-R194 WeakPolarHBondContact O-CD 3.45Å; T163-R194 VanDerWaalsContact CG2-NH1 3.31Å; E190-R194 WeakPolarHBondContact O-CA 3.38Å; E190-R194 WeakPolarHBondContact O-CB 3.39Å; E190-R194 PolarHBondContact O-N 2.86Å; R194-S198 PolarHBondContact O-OG 3.36Å
195	R	96.1	Very high	93.1	Very high	53 Å²	53	35.2 Å²	35.2	20%	0.2	18%	0.18	C	C	.	.	I	π-helix	trans	-95.9	-50.7	-178.8	177.9	57.3	-174.8	95.8	-5.8	113.4	W161 E190 F191 R210 E212	W161-R195 HydrophobicContact CB-CB 4.13Å; W161-R195 HydrophobicContact CD2-CB 3.66Å; W161-R195 HydrophobicContact CD2-CG 3.8Å; W161-R195 HydrophobicContact CE3-CB 4.15Å; W161-R195 VanDerWaalsContact CE3-CD 3.42Å; W161-R195 HydrophobicContact CE3-CG 3.82Å; W161-R195 HydrophobicContact CG-CB 3.66Å; W161-R195 HydrophobicContact CG-CG 4.33Å; W161-R195 HydrophobicContact CH2-CG 4.32Å; W161-R195 HydrophobicContact CZ2-CG 4.32Å; W161-R195 HydrophobicContact CZ3-CG 4.07Å; E190-R195 PolarHBondContact O-N 2.99Å; F191-R195 HydrophobicContact CD2-CB 3.94Å; F191-R195 HydrophobicContact CD2-CG 3.91Å; F191-R195 HydrophobicContact CE2-CB 4.26Å; F191-R195 HydrophobicContact CE2-CG 3.73Å; F191-R195 HydrophobicContact CG-CB 4.5Å; F191-R195 WeakPolarHBondContact O-CA 3.48Å; F191-R195 VanDerWaalsContact O-CB 3.25Å; F191-R195 WeakPolarHBondContact O-CB 3.31Å; F191-R195 PolarHBondContact O-N 3.28Å; R195-R210 PolarHBondContact O-NH2 3.03Å; R195-E212 IonicContact CZ-OE1 3.62Å; R195-E212 IonicContact CZ-OE2 3.66Å; R195-E212 IonicContact NH1-OE2 2.72Å; R195-E212 PolarHBondContact NH1-OE2 3.43Å; R195-E212 VanDerWaalsContact NH2-CD 3.26Å; R195-E212 IonicContact NH2-OE1 2.73Å; R195-E212 PolarHBondContact NH2-OE1 3.35Å; R195-E212 IonicContact NH2-OE2 3.26Å; R195-E212 PolarHBondContact NH2-OE2 2.92Å
196	V	96.8	Very high	93.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.183	C	C	.	.	I	π-helix	trans	-73.2	-62.8	-178.9	-175.5	0	0	0	0	109.4	F142 Y143 F191 W192 L213	F142-V196 HydrophobicContact CD1-CB 4.47Å; F142-V196 HydrophobicContact CD1-CG1 4.07Å; F142-V196 HydrophobicContact CD1-CG2 3.83Å; F142-V196 HydrophobicContact CE1-CB 4.35Å; F142-V196 HydrophobicContact CE1-CG1 4.4Å; F142-V196 HydrophobicContact CE1-CG2 3.62Å; F142-V196 HydrophobicContact CG-CG1 4.44Å; Y143-V196 HydrophobicContact CE2-CG1 4.4Å; Y143-V196 HydrophobicContact CE2-CG2 3.86Å; F191-V196 HydrophobicContact CD1-CG2 3.77Å; F191-V196 HydrophobicContact CE1-CG2 3.46Å; F191-V196 VanDerWaalsContact CE1-CG2 3.46Å; F191-V196 HydrophobicContact CZ-CG2 4Å; F191-V196 WeakPolarHBondContact O-CG2 3.38Å; F191-V196 PolarHBondContact O-N 2.96Å; W192-V196 HydrophobicContact CE3-CB 4.15Å; W192-V196 HydrophobicContact CE3-CG1 4.12Å; W192-V196 HydrophobicContact CE3-CG2 4.45Å; W192-V196 HydrophobicContact CZ3-CG1 4.08Å; V196-L213 HydrophobicContact CG1-CD1 4.37Å; V196-L213 HydrophobicContact CG1-CD2 4.13Å; V196-L213 WeakPolarHBondContact O-CD1 3.33Å
197	L	96.1	Very high	94	Very high	7 Å²	7	37.6 Å²	37.6	4%	0.037	20%	0.199	C	C	.	.	I	π-helix	trans	-80.9	-41.2	-176.4	-60.9	-179	0	0	0	112.7	W139 W192 I199 R210 M445	W139-L197 HydrophobicContact CZ2-CD2 4.37Å; W192-L197 HydrophobicContact CD2-CD1 4.08Å; W192-L197 HydrophobicContact CD2-CG 4.26Å; W192-L197 VanDerWaalsContact CE2-CD1 3.49Å; W192-L197 HydrophobicContact CE3-CG 4.47Å; W192-L197 HydrophobicContact CG-CD1 4.48Å; W192-L197 HydrophobicContact CH2-CD1 4.44Å; W192-L197 HydrophobicContact CH2-CD2 4.27Å; W192-L197 HydrophobicContact CH2-CG 4.48Å; W192-L197 HydrophobicContact CZ2-CD1 3.72Å; W192-L197 HydrophobicContact CZ2-CD2 4.31Å; W192-L197 HydrophobicContact CZ2-CG 4.22Å; W192-L197 WeakPolarHBondContact O-CB 3.45Å; W192-L197 WeakPolarHBondContact O-CG 3.27Å; W192-L197 PolarHBondContact O-N 2.92Å; L197-I199 VanDerWaalsContact C-N 3.31Å; L197-I199 HydrophobicContact CB-CB 4.22Å; L197-R210 WeakPolarHBondContact O-CD 3.42Å; L197-M445 HydrophobicContact CD1-CB 4.14Å; L197-M445 HydrophobicContact CD1-CG 4.08Å; L197-M445 HydrophobicContact CD1-SD 4.4Å
198	S	95.7	Very high	94.3	Very high	28 Å²	28	39.7 Å²	39.7	20%	0.196	22%	0.217	C	C	.	.			trans	50.4	53.6	-163.7	-61.7	0	0	0	0	111.1	E193 R194 R210 E442	E193-S198 CarbonylContact O-C 3.56Å; E193-S198 WeakPolarHBondContact O-CA 3.18Å; E193-S198 PolarHBondContact O-N 2.84Å; R194-S198 PolarHBondContact O-OG 3.36Å; S198-R210 PolarHBondContact OG-NH1 3.41Å; S198-R210 PolarHBondContact OG-NH2 2.99Å; S198-E442 WeakPolarHBondContact O-CB 3.41Å; S198-E442 VanDerWaalsContact O-CG 3.29Å; S198-E442 WeakPolarHBondContact O-CG 3.36Å
199	I	93.9	Very high	94.6	Very high	40 Å²	40	43.4 Å²	43.4	21%	0.205	24%	0.236	C	C	.	.			trans	-63.2	133.3	-165.4	-164.3	168	0	0	0	112.9	E193 L197 E442 M445 Y446 Y525	E193-I199 HydrophobicContact CB-CG2 4.02Å; E193-I199 HydrophobicContact CG-CG2 4.48Å; E193-I199 PolarHBondContact O-N 3.42Å; L197-I199 VanDerWaalsContact C-N 3.31Å; L197-I199 HydrophobicContact CB-CB 4.22Å; I199-E442 WeakPolarHBondContact CA-O 3.24Å; I199-M445 HydrophobicContact CD1-CB 4.02Å; I199-M445 HydrophobicContact CD1-CG 4.24Å; I199-Y446 HydrophobicContact CD1-CE2 4.29Å; I199-Y446 HydrophobicContact CG1-CE2 4.02Å; I199-Y525 HydrophobicContact CD1-CD1 4.37Å; I199-Y525 HydrophobicContact CD1-CE1 3.49Å; I199-Y525 VanDerWaalsContact CD1-CE1 3.49Å
200	T	95.4	Very high	95	Very high	16 Å²	16	43.9 Å²	43.9	10%	0.098	24%	0.236	C	C	.	.			trans	-78.6	172.8	175.5	62	0	0	0	0	112.6	G202 D205 E442 G443 Y446	T200-G202 PolarHBondContact O-N 2.98Å; T200-G202 PolarHBondContact OG1-O 3.27Å; T200-D205 VanDerWaalsContact CB-O 3.25Å; T200-D205 WeakPolarHBondContact CB-O 3.48Å; T200-D205 VanDerWaalsContact CG2-O 3.31Å; T200-D205 WeakPolarHBondContact CG2-O 3.39Å; T200-D205 PolarHBondContact OG1-O 2.92Å; T200-E442 HydrophobicContact CG2-CB 3.55Å; T200-E442 PolarHBondContact N-O 2.98Å; T200-G443 VanDerWaalsContact OG1-CA 3.3Å; T200-G443 WeakPolarHBondContact OG1-CA 3.21Å; T200-Y446 WeakPolarHBondContact O-CE2 3.43Å; T200-Y446 PolarHBondContact O-OH 2.93Å
201	S	92	Very high	95.2	Very high	91 Å²	91	51.5 Å²	51.5	64%	0.636	27%	0.265	S	S	*	.	S	Bend	trans	-63.5	-21.4	178.6	62.5	0	0	0	0	114.6
202	G	92.8	Very high	95.3	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.275	C	S	.	.	S	Bend	trans	176.2	173	-177.8	0	0	0	0	0	113.8	T200 H204 D205 Y529	T200-G202 PolarHBondContact O-N 2.98Å; T200-G202 PolarHBondContact OG1-O 3.27Å; G202-H204 PolarHBondContact O-N 2.98Å; G202-H204 VanDerWaalsContact O-N 3.1Å; G202-D205 PolarHBondContact O-N 3.44Å; G202-D205 VanDerWaalsContact O-O 3.06Å; G202-Y529 VanDerWaalsContact CA-CE2 3.45Å
203	I	94.1	Very high	95.4	Very high	10 Å²	10	53.8 Å²	53.8	5%	0.051	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.3	-176.3	-164.1	173.1	0	0	0	114.3	D205 Y446 I447 L450 Y529 Y531 P532 W534	I203-D205 VanDerWaalsContact C-N 3.29Å; I203-Y446 HydrophobicContact CB-CG 4.29Å; I203-I447 HydrophobicContact CD1-CG1 4.26Å; I203-I447 HydrophobicContact CG1-CG1 4.23Å; I203-L450 HydrophobicContact CD1-CD1 3.38Å; I203-L450 HydrophobicContact CD1-CG 4.46Å; I203-Y529 VanDerWaalsContact CG2-OH 3.29Å; I203-Y529 WeakPolarHBondContact CG2-OH 3.34Å; I203-Y529 PolarHBondContact N-OH 3.24Å; I203-Y531 HydrophobicContact CD1-CD1 4.29Å; I203-Y531 HydrophobicContact CD1-CE1 4.08Å; I203-Y531 HydrophobicContact CG2-CD1 4.48Å; I203-P532 HydrophobicContact CG2-CG 3.78Å; I203-W534 HydrophobicContact CB-CH2 4.36Å; I203-W534 HydrophobicContact CD1-CH2 4.11Å; I203-W534 HydrophobicContact CD1-CZ3 4.29Å; I203-W534 HydrophobicContact CG1-CH2 3.99Å; I203-W534 HydrophobicContact CG2-CH2 3.6Å; I203-W534 HydrophobicContact CG2-CZ2 3.64Å
204	H	92.8	Very high	95.6	Very high	123 Å²	123	51.9 Å²	51.9	57%	0.569	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-20.1	178	22.8	-78.5	0	0	0	112.5	G202 W534	G202-H204 PolarHBondContact O-N 2.98Å; G202-H204 VanDerWaalsContact O-N 3.1Å; H204-W534 HydrophobicContact CB-CZ2 4.49Å
205	D	94.3	Very high	95.8	Very high	80 Å²	80	50.2 Å²	50.2	43%	0.428	27%	0.268	S	S	.	.			trans	-113.2	98.2	175.4	-179.4	16.4	0	0	0	108.8	T200 G202 I203 G207	T200-D205 VanDerWaalsContact CB-O 3.25Å; T200-D205 WeakPolarHBondContact CB-O 3.48Å; T200-D205 VanDerWaalsContact CG2-O 3.31Å; T200-D205 WeakPolarHBondContact CG2-O 3.39Å; T200-D205 PolarHBondContact OG1-O 2.92Å; G202-D205 PolarHBondContact O-N 3.44Å; G202-D205 VanDerWaalsContact O-O 3.06Å; I203-D205 VanDerWaalsContact C-N 3.29Å; D205-G207 PolarHBondContact O-N 2.8Å; D205-G207 PolarHBondContact OD1-N 3.07Å
206	L	92.9	Very high	95.9	Very high	64 Å²	64	48.1 Å²	48.1	34%	0.335	26%	0.262	S	S	.	.			trans	-73.4	-18.6	180	-67.1	178.1	0	0	0	112.9	T441 E442 G443 I447	L206-T441 VanDerWaalsContact O-CB 3.24Å; L206-T441 WeakPolarHBondContact O-CB 3.23Å; L206-T441 PolarHBondContact O-OG1 3.29Å; L206-E442 PolarHBondContact O-N 3.25Å; L206-G443 PolarHBondContact O-N 3.3Å; L206-I447 HydrophobicContact CD2-CD1 3.59Å; L206-I447 HydrophobicContact CD2-CG1 4.43Å
207	G	95.7	Very high	96	Very high	38 Å²	38	48.1 Å²	48.1	39%	0.392	26%	0.262	S	S	.	.			trans	56.7	-156.7	-174.7	0	0	0	0	0	114	D205 E442	D205-G207 PolarHBondContact O-N 2.8Å; D205-G207 PolarHBondContact OD1-N 3.07Å; G207-E442 WeakPolarHBondContact CA-OE2 3.22Å
208	A	96.9	Very high	96.1	Very high	54 Å²	54	51.3 Å²	51.3	45%	0.446	28%	0.278	S	S	.	.			trans	-82.5	159.6	179.9	0	0	0	0	0	112.8	T441 E442	A208-T441 WeakPolarHBondContact O-CA 3.37Å; A208-T441 WeakPolarHBondContact O-CB 3.23Å; A208-E442 PolarHBondContact N-OE2 2.95Å; A208-E442 WeakPolarHBondContact O-CG 3.45Å; A208-E442 PolarHBondContact O-N 3.35Å
209	L	97.7	Very high	96.2	Very high	81 Å²	81	52.9 Å²	52.9	42%	0.424	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-72.4	126.2	170.3	-177.8	69.6	0	0	0	110	W211 A214 L437 V440 T441	L209-W211 PolarHBondContact O-N 3.24Å; L209-A214 HydrophobicContact CD1-CB 4.5Å; L209-A214 HydrophobicContact CD2-CB 4.3Å; L209-A214 HydrophobicContact CG-CB 4.44Å; L209-L437 HydrophobicContact CD1-CB 4.32Å; L209-L437 HydrophobicContact CD1-CD2 4.27Å; L209-L437 WeakPolarHBondContact CD1-O 3.34Å; L209-V440 HydrophobicContact CD1-CG2 3.82Å; L209-T441 HydrophobicContact CD1-CG2 4.14Å
210	R	97.9	Very high	96.4	Very high	47 Å²	47	51 Å²	51	18%	0.177	28%	0.275	C	S	.	.			trans	-76.5	89.6	172.7	-56	-60.3	-63.1	171.2	-4.3	109.1	R195 L197 S198 E212 L213 A214 V440 E442	R195-R210 PolarHBondContact O-NH2 3.03Å; L197-R210 WeakPolarHBondContact O-CD 3.42Å; S198-R210 PolarHBondContact OG-NH1 3.41Å; S198-R210 PolarHBondContact OG-NH2 2.99Å; R210-E212 VanDerWaalsContact C-N 3.25Å; R210-E212 PolarHBondContact O-N 3.37Å; R210-L213 HydrophobicContact CB-CB 4.03Å; R210-L213 HydrophobicContact CB-CD1 3.98Å; R210-L213 HydrophobicContact CB-CG 4.12Å; R210-L213 HydrophobicContact CG-CD1 4.31Å; R210-L213 PolarHBondContact O-N 3.45Å; R210-A214 PolarHBondContact O-N 3.3Å; R210-V440 VanDerWaalsContact CB-O 3.23Å; R210-V440 WeakPolarHBondContact CB-O 3.32Å; R210-V440 WeakPolarHBondContact CG-O 3.47Å; R210-V440 PolarHBondContact N-O 3.44Å; R210-E442 HydrophobicContact CG-CG 4.32Å; R210-E442 IonicContact NH1-OE1 2.66Å
211	W	97.3	Very high	96.5	Very high	165 Å²	165	50.8 Å²	50.8	63%	0.625	27%	0.272	S	S	*	.	H	α-helix	trans	-58	-33.8	-171.8	69.6	-91.6	0	0	0	113.7	L209 A214 L215	L209-W211 PolarHBondContact O-N 3.24Å; W211-A214 WeakPolarHBondContact O-CB 3.38Å; W211-A214 PolarHBondContact O-N 3.12Å; W211-L215 HydrophobicContact CE3-CD1 3.67Å; W211-L215 HydrophobicContact CE3-CG 4.42Å; W211-L215 HydrophobicContact CZ3-CD1 3.62Å; W211-L215 WeakPolarHBondContact O-CG 3.48Å; W211-L215 PolarHBondContact O-N 3.04Å
212	E	97.8	Very high	96.8	Very high	50 Å²	50	49.4 Å²	49.4	23%	0.234	26%	0.26	C	S	.	.	H	α-helix	trans	-66	-40.9	176	-63.8	173.2	156	0	0	111.8	F142 R195 R210 L215 C216	F142-E212 HydrophobicContact CD2-CB 4.28Å; F142-E212 HydrophobicContact CE2-CB 3.89Å; F142-E212 VanDerWaalsContact CE2-OE2 3.32Å; F142-E212 WeakPolarHBondContact CE2-OE2 3.41Å; R195-E212 IonicContact CZ-OE1 3.62Å; R195-E212 IonicContact CZ-OE2 3.66Å; R195-E212 IonicContact NH1-OE2 2.72Å; R195-E212 PolarHBondContact NH1-OE2 3.43Å; R195-E212 VanDerWaalsContact NH2-CD 3.26Å; R195-E212 IonicContact NH2-OE1 2.73Å; R195-E212 PolarHBondContact NH2-OE1 3.35Å; R195-E212 IonicContact NH2-OE2 3.26Å; R195-E212 PolarHBondContact NH2-OE2 2.92Å; R210-E212 VanDerWaalsContact C-N 3.25Å; R210-E212 PolarHBondContact O-N 3.37Å; E212-L215 PolarHBondContact O-N 2.82Å; E212-C216 PolarHBondContact O-N 3.43Å; E212-C216 PolarHBondContact O-SG 3.04Å
213	L	98.1	Very high	97	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.016	28%	0.275	C	S	.	.	H	α-helix	trans	-68.6	-36.4	173.4	-69.8	-177.6	0	0	0	111.4	F142 V196 R210 L215 C216 L217 V440	F142-L213 HydrophobicContact CB-CD2 3.84Å; F142-L213 HydrophobicContact CD2-CD2 3.77Å; F142-L213 HydrophobicContact CG-CD2 3.91Å; V196-L213 HydrophobicContact CG1-CD1 4.37Å; V196-L213 HydrophobicContact CG1-CD2 4.13Å; V196-L213 WeakPolarHBondContact O-CD1 3.33Å; R210-L213 HydrophobicContact CB-CB 4.03Å; R210-L213 HydrophobicContact CB-CD1 3.98Å; R210-L213 HydrophobicContact CB-CG 4.12Å; R210-L213 HydrophobicContact CG-CD1 4.31Å; R210-L213 PolarHBondContact O-N 3.45Å; L213-L215 VanDerWaalsContact C-N 3.31Å; L213-L215 PolarHBondContact O-N 3.13Å; L213-C216 PolarHBondContact O-N 3.04Å; L213-L217 VanDerWaalsContact O-CB 3.28Å; L213-L217 WeakPolarHBondContact O-CB 3.23Å; L213-L217 PolarHBondContact O-N 3.09Å; L213-V440 HydrophobicContact CB-CB 3.97Å; L213-V440 HydrophobicContact CB-CG1 4.11Å
214	A	98.4	Very high	97	Very high	7 Å²	7	51.8 Å²	51.8	6%	0.058	27%	0.272	C	S	.	.	H	α-helix	trans	-61.2	-39.3	173.4	0	0	0	0	0	111.9	L209 R210 W211 L217 L218 L437 V440	L209-A214 HydrophobicContact CD1-CB 4.5Å; L209-A214 HydrophobicContact CD2-CB 4.3Å; L209-A214 HydrophobicContact CG-CB 4.44Å; R210-A214 PolarHBondContact O-N 3.3Å; W211-A214 WeakPolarHBondContact O-CB 3.38Å; W211-A214 PolarHBondContact O-N 3.12Å; A214-L217 PolarHBondContact O-N 2.69Å; A214-L218 WeakPolarHBondContact O-CB 3.48Å; A214-L218 PolarHBondContact O-N 3.34Å; A214-L437 HydrophobicContact CB-CD2 3.86Å; A214-V440 HydrophobicContact CB-CG2 4.32Å
215	L	98.5	Very high	97.2	Very high	97 Å²	97	48 Å²	48	51%	0.508	25%	0.254	S	S	.	.	H	α-helix	trans	-68	-40.5	173	-69.2	177.5	0	0	0	112.5	W211 E212 L213 L217 L218 L219	W211-L215 HydrophobicContact CE3-CD1 3.67Å; W211-L215 HydrophobicContact CE3-CG 4.42Å; W211-L215 HydrophobicContact CZ3-CD1 3.62Å; W211-L215 WeakPolarHBondContact O-CG 3.48Å; W211-L215 PolarHBondContact O-N 3.04Å; E212-L215 PolarHBondContact O-N 2.82Å; L213-L215 VanDerWaalsContact C-N 3.31Å; L213-L215 PolarHBondContact O-N 3.13Å; L215-L217 VanDerWaalsContact C-N 3.31Å; L215-L217 PolarHBondContact O-N 3.42Å; L215-L218 PolarHBondContact O-N 3.46Å; L215-L219 WeakPolarHBondContact O-CB 3.43Å; L215-L219 PolarHBondContact O-N 3.43Å
216	C	98.6	Very high	97.2	Very high	9 Å²	9	49.2 Å²	49.2	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-63.2	-39.6	174.5	-65.8	0	0	0	0	111.5	A138 L141 E212 L213 L219 A220	A138-C216 HydrophobicContact CB-CB 4.11Å; A138-C216 WeakPolarHBondContact O-CB 3.25Å; L141-C216 HydrophobicContact CB-CB 4.12Å; L141-C216 WeakPolarHBondContact CD1-O 3.21Å; E212-C216 PolarHBondContact O-N 3.43Å; E212-C216 PolarHBondContact O-SG 3.04Å; L213-C216 PolarHBondContact O-N 3.04Å; C216-L219 PolarHBondContact O-N 3.4Å; C216-A220 PolarHBondContact O-N 2.85Å
217	L	98.6	Very high	97.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.9	-43	174.9	179	59.8	0	0	0	111.5	I134 I135 A138 L213 A214 L215 L219 A220 W221 Y433 V440	I134-L217 HydrophobicContact CG2-CD1 3.72Å; I135-L217 HydrophobicContact CD1-CD1 3.85Å; I135-L217 HydrophobicContact CD1-CD2 3.88Å; A138-L217 HydrophobicContact CB-CB 3.9Å; A138-L217 HydrophobicContact CB-CD1 4.39Å; L213-L217 VanDerWaalsContact O-CB 3.28Å; L213-L217 WeakPolarHBondContact O-CB 3.23Å; L213-L217 PolarHBondContact O-N 3.09Å; A214-L217 PolarHBondContact O-N 2.69Å; L215-L217 VanDerWaalsContact C-N 3.31Å; L215-L217 PolarHBondContact O-N 3.42Å; L217-L219 VanDerWaalsContact C-N 3.33Å; L217-L219 PolarHBondContact O-N 2.77Å; L217-A220 PolarHBondContact O-N 3.31Å; L217-W221 PolarHBondContact O-N 3.32Å; L217-Y433 HydrophobicContact CB-CE2 4.41Å; L217-Y433 HydrophobicContact CD2-CD2 4.1Å; L217-Y433 HydrophobicContact CD2-CE2 4.31Å; L217-Y433 HydrophobicContact CG-CD2 3.9Å; L217-Y433 HydrophobicContact CG-CE2 4.16Å; L217-V440 HydrophobicContact CD2-CG1 4.12Å; L217-V440 HydrophobicContact CD2-CG2 4.27Å
218	L	98.6	Very high	97	Very high	74 Å²	74	45.1 Å²	45.1	39%	0.387	23%	0.225	S	C	.	.	H	α-helix	trans	-59.9	-46	174.2	-179.2	62.5	0	0	0	110.7	A214 L215 A220 W221 V222 Y433	A214-L218 WeakPolarHBondContact O-CB 3.48Å; A214-L218 PolarHBondContact O-N 3.34Å; L215-L218 PolarHBondContact O-N 3.46Å; L218-A220 PolarHBondContact O-N 3.28Å; L218-W221 PolarHBondContact O-N 2.95Å; L218-V222 VanDerWaalsContact O-CG2 3.3Å; L218-V222 WeakPolarHBondContact O-CG2 3.46Å; L218-V222 PolarHBondContact O-N 3.01Å; L218-Y433 HydrophobicContact CB-CD2 4.38Å; L218-Y433 HydrophobicContact CB-CE2 3.66Å; L218-Y433 HydrophobicContact CD1-CD2 4.39Å; L218-Y433 HydrophobicContact CD1-CE2 4.13Å; L218-Y433 HydrophobicContact CG-CE2 4.48Å
219	L	98.5	Very high	96.6	Very high	62 Å²	62	46.8 Å²	46.8	33%	0.325	22%	0.22	S	C	.	.	H	α-helix	trans	-60.8	-43.4	177.2	179.4	61	0	0	0	111.7	L141 F145 L215 C216 L217 W221 V222 I223	L141-L219 HydrophobicContact CD1-CB 4.38Å; L141-L219 HydrophobicContact CD1-CD2 4.25Å; L141-L219 HydrophobicContact CD1-CG 4.27Å; L141-L219 HydrophobicContact CD2-CD2 4.24Å; F145-L219 HydrophobicContact CE2-CD2 3.94Å; F145-L219 HydrophobicContact CZ-CD2 3.61Å; L215-L219 WeakPolarHBondContact O-CB 3.43Å; L215-L219 PolarHBondContact O-N 3.43Å; C216-L219 PolarHBondContact O-N 3.4Å; L217-L219 VanDerWaalsContact C-N 3.33Å; L217-L219 PolarHBondContact O-N 2.77Å; L219-W221 VanDerWaalsContact C-N 3.34Å; L219-W221 PolarHBondContact O-N 3.25Å; L219-V222 PolarHBondContact O-N 3.29Å; L219-I223 HydrophobicContact CD1-CD1 4.15Å; L219-I223 HydrophobicContact CD1-CG1 4.27Å; L219-I223 HydrophobicContact CG-CD1 3.99Å; L219-I223 VanDerWaalsContact O-CG1 3.31Å; L219-I223 WeakPolarHBondContact O-CG1 3.35Å; L219-I223 PolarHBondContact O-N 3.2Å
220	A	98.1	Very high	96.2	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-58.6	-44.7	175.9	0	0	0	0	0	111.8	I134 L137 L141 C216 L217 L218 I223 C224	I134-A220 HydrophobicContact CD1-CB 4.11Å; I134-A220 HydrophobicContact CG1-CB 4Å; L137-A220 HydrophobicContact CB-CB 4.07Å; L141-A220 HydrophobicContact CD1-CB 3.95Å; C216-A220 PolarHBondContact O-N 2.85Å; L217-A220 PolarHBondContact O-N 3.31Å; L218-A220 PolarHBondContact O-N 3.28Å; A220-I223 PolarHBondContact O-N 3.37Å; A220-C224 WeakPolarHBondContact O-CB 3.35Å; A220-C224 PolarHBondContact O-N 3.17Å
221	W	97.9	Very high	95.7	Very high	10 Å²	10	47.4 Å²	47.4	4%	0.038	22%	0.221	C	C	.	.	H	α-helix	trans	-65.1	-38.8	175.6	-84.7	110.6	0	0	0	113.1	N130 I134 L217 L218 L219 C224 Y225 V400 A429 C432 Y433	N130-W221 WeakPolarHBondContact O-CZ2 3.26Å; I134-W221 HydrophobicContact CB-CZ2 4.38Å; I134-W221 HydrophobicContact CD1-CD2 3.44Å; I134-W221 VanDerWaalsContact CD1-CD2 3.44Å; I134-W221 HydrophobicContact CD1-CE3 3.87Å; I134-W221 HydrophobicContact CD1-CG 3.73Å; I134-W221 HydrophobicContact CD1-CH2 4.2Å; I134-W221 HydrophobicContact CD1-CZ2 3.77Å; I134-W221 HydrophobicContact CD1-CZ3 4.24Å; I134-W221 HydrophobicContact CG2-CZ2 3.77Å; L217-W221 PolarHBondContact O-N 3.32Å; L218-W221 PolarHBondContact O-N 2.95Å; L219-W221 VanDerWaalsContact C-N 3.34Å; L219-W221 PolarHBondContact O-N 3.25Å; W221-C224 PolarHBondContact O-N 3.49Å; W221-Y225 VanDerWaalsContact O-CB 3.3Å; W221-Y225 WeakPolarHBondContact O-CB 3.29Å; W221-Y225 PolarHBondContact O-N 3.42Å; W221-V400 HydrophobicContact CH2-CG2 4.31Å; W221-V400 HydrophobicContact CZ3-CG2 3.95Å; W221-A429 HydrophobicContact CD2-CB 4.12Å; W221-A429 HydrophobicContact CE3-CB 3.43Å; W221-A429 VanDerWaalsContact CE3-CB 3.43Å; W221-A429 HydrophobicContact CZ3-CB 3.88Å; W221-C432 HydrophobicContact CH2-CB 3.52Å; W221-C432 HydrophobicContact CZ2-CB 3.15Å; W221-Y433 AromaticContact CD1-CD2 3.95Å
222	V	97.6	Very high	95.2	Very high	63 Å²	63	39.9 Å²	39.9	38%	0.382	19%	0.194	S	C	.	.	H	α-helix	trans	-62.9	-46.1	175.8	169.7	0	0	0	0	110.8	L218 L219 Y225 F226	L218-V222 VanDerWaalsContact O-CG2 3.3Å; L218-V222 WeakPolarHBondContact O-CG2 3.46Å; L218-V222 PolarHBondContact O-N 3.01Å; L219-V222 PolarHBondContact O-N 3.29Å; V222-Y225 PolarHBondContact O-N 2.82Å; V222-F226 HydrophobicContact CG1-CD2 3.91Å; V222-F226 HydrophobicContact CG1-CE2 3.74Å; V222-F226 WeakPolarHBondContact O-CD2 3.05Å; V222-F226 PolarHBondContact O-N 3.44Å
223	I	96.3	Very high	94.7	Very high	59 Å²	59	43.1 Å²	43.1	30%	0.303	21%	0.207	S	C	.	.	H	α-helix	trans	-60.1	-51.1	175.6	-66	167.3	0	0	0	109.6	L219 A220 Y225 F226 C227 L393	L219-I223 HydrophobicContact CD1-CD1 4.15Å; L219-I223 HydrophobicContact CD1-CG1 4.27Å; L219-I223 HydrophobicContact CG-CD1 3.99Å; L219-I223 VanDerWaalsContact O-CG1 3.31Å; L219-I223 WeakPolarHBondContact O-CG1 3.35Å; L219-I223 PolarHBondContact O-N 3.2Å; A220-I223 PolarHBondContact O-N 3.37Å; I223-Y225 VanDerWaalsContact C-N 3.32Å; I223-Y225 PolarHBondContact O-N 3.48Å; I223-F226 PolarHBondContact O-N 2.9Å; I223-C227 PolarHBondContact O-N 2.99Å; I223-C227 PolarHBondContact O-SG 3.43Å; I223-L393 HydrophobicContact CG2-CD1 3.84Å; I223-L393 HydrophobicContact CG2-CD2 3.94Å
224	C	95.7	Very high	94.3	Very high	1 Å²	1	44 Å²	44	1%	0.007	21%	0.213	C	C	.	.	H	α-helix	trans	-56.7	-44.5	179.6	-172.4	0	0	0	0	112.1	A220 W221 F226 C227 I228 L393	A220-C224 WeakPolarHBondContact O-CB 3.35Å; A220-C224 PolarHBondContact O-N 3.17Å; W221-C224 PolarHBondContact O-N 3.49Å; C224-F226 PolarHBondContact O-N 3.38Å; C224-C227 PolarHBondContact O-N 2.89Å; C224-I228 WeakPolarHBondContact O-CG1 3.5Å; C224-I228 PolarHBondContact O-N 3.06Å; C224-L393 HydrophobicContact CB-CD1 4.45Å
225	Y	95.6	Very high	93.9	Very high	44 Å²	44	43.6 Å²	43.6	17%	0.173	21%	0.21	C	C	.	.	H	α-helix	trans	-55.8	-52.2	177.9	175.1	-94.5	0	0	0	111.7	W221 V222 I223 C227 I228 W229 I425 L426	W221-Y225 VanDerWaalsContact O-CB 3.3Å; W221-Y225 WeakPolarHBondContact O-CB 3.29Å; W221-Y225 PolarHBondContact O-N 3.42Å; V222-Y225 PolarHBondContact O-N 2.82Å; I223-Y225 VanDerWaalsContact C-N 3.32Å; I223-Y225 PolarHBondContact O-N 3.48Å; Y225-C227 VanDerWaalsContact C-N 3.31Å; Y225-C227 PolarHBondContact O-N 3.31Å; Y225-I228 PolarHBondContact O-N 3.47Å; Y225-W229 HydrophobicContact CE1-CB 4.43Å; Y225-W229 HydrophobicContact CE1-CE3 4.45Å; Y225-W229 WeakPolarHBondContact O-CB 3.32Å; Y225-W229 PolarHBondContact O-N 2.89Å; Y225-I425 HydrophobicContact CD2-CB 4.5Å; Y225-I425 HydrophobicContact CD2-CG2 3.69Å; Y225-I425 HydrophobicContact CE2-CB 4.4Å; Y225-I425 HydrophobicContact CE2-CG2 4.06Å; Y225-L426 HydrophobicContact CD2-CB 4.35Å; Y225-L426 HydrophobicContact CD2-CD1 4.29Å; Y225-L426 HydrophobicContact CE2-CB 3.74Å; Y225-L426 HydrophobicContact CE2-CD1 4.16Å
226	F	94.1	Very high	93.4	Very high	105 Å²	105	39 Å²	39	46%	0.461	19%	0.186	S	C	.	.	H	α-helix	trans	-70.1	-25.8	-178.8	-72.6	-62.5	0	0	0	113.3	V222 I223 C224 W229	V222-F226 HydrophobicContact CG1-CD2 3.91Å; V222-F226 HydrophobicContact CG1-CE2 3.74Å; V222-F226 WeakPolarHBondContact O-CD2 3.05Å; V222-F226 PolarHBondContact O-N 3.44Å; I223-F226 PolarHBondContact O-N 2.9Å; C224-F226 PolarHBondContact O-N 3.38Å; F226-W229 HydrophobicContact CD1-CD2 4.13Å; F226-W229 AromaticContact CD1-CE3 3.8Å; F226-W229 HydrophobicContact CD1-CE3 3.8Å; F226-W229 HydrophobicContact CD1-CH2 4.28Å; F226-W229 AromaticContact CD1-CZ3 3.88Å; F226-W229 HydrophobicContact CD1-CZ3 3.88Å; F226-W229 HydrophobicContact CE1-CE3 4.05Å; F226-W229 HydrophobicContact CE1-CH2 4.46Å; F226-W229 AromaticContact CE1-CZ3 3.85Å; F226-W229 HydrophobicContact CE1-CZ3 3.85Å; F226-W229 PolarHBondContact O-NE1 3.34Å
227	C	92.6	Very high	93.1	Very high	14 Å²	14	44.2 Å²	44.2	10%	0.095	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-38.1	172.7	-69.4	0	0	0	0	112.1	I223 C224 Y225 S234 T235 V238	I223-C227 PolarHBondContact O-N 2.99Å; I223-C227 PolarHBondContact O-SG 3.43Å; C224-C227 PolarHBondContact O-N 2.89Å; Y225-C227 VanDerWaalsContact C-N 3.31Å; Y225-C227 PolarHBondContact O-N 3.31Å; C227-S234 CarbonylContact O-C 3.59Å; C227-S234 VanDerWaalsContact O-CB 3.27Å; C227-S234 WeakPolarHBondContact O-CB 3.25Å; C227-S234 PolarHBondContact O-OG 2.93Å; C227-T235 PolarHBondContact O-N 2.86Å; C227-V238 HydrophobicContact CB-CG2 4.42Å
228	I	92.2	Very high	92.9	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-108.6	-5.8	-172	71.5	-177	0	0	0	115.7	C224 Y225 K230 G231 F397 V400 R421 I425	C224-I228 WeakPolarHBondContact O-CG1 3.5Å; C224-I228 PolarHBondContact O-N 3.06Å; Y225-I228 PolarHBondContact O-N 3.47Å; I228-K230 VanDerWaalsContact C-N 3.26Å; I228-K230 PolarHBondContact O-N 2.9Å; I228-K230 VanDerWaalsContact O-N 3.1Å; I228-G231 WeakPolarHBondContact O-CA 3.12Å; I228-G231 PolarHBondContact O-N 3.32Å; I228-F397 HydrophobicContact CG2-CB 3.5Å; I228-F397 VanDerWaalsContact CG2-CB 3.5Å; I228-F397 HydrophobicContact CG2-CD2 3.98Å; I228-F397 HydrophobicContact CG2-CG 4.2Å; I228-V400 HydrophobicContact CD1-CB 3.61Å; I228-V400 HydrophobicContact CD1-CG1 3.25Å; I228-V400 HydrophobicContact CD1-CG2 4.34Å; I228-R421 PolarHBondContact O-NH1 3.24Å; I228-I425 HydrophobicContact CD1-CD1 4.38Å; I228-I425 HydrophobicContact CD1-CG1 4.33Å; I228-I425 HydrophobicContact CD1-CG2 3.63Å; I228-I425 HydrophobicContact CG1-CD1 4.06Å; I228-I425 HydrophobicContact CG1-CG1 4.49Å; I228-I425 HydrophobicContact CG1-CG2 3.79Å
229	W	89.8	Confident	92.6	Very high	90 Å²	90	42.7 Å²	42.7	34%	0.341	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-39.7	-172.2	67.5	-26.3	0	0	0	114.3	Y225 F226 G231 R421	Y225-W229 HydrophobicContact CE1-CB 4.43Å; Y225-W229 HydrophobicContact CE1-CE3 4.45Å; Y225-W229 WeakPolarHBondContact O-CB 3.32Å; Y225-W229 PolarHBondContact O-N 2.89Å; F226-W229 HydrophobicContact CD1-CD2 4.13Å; F226-W229 AromaticContact CD1-CE3 3.8Å; F226-W229 HydrophobicContact CD1-CE3 3.8Å; F226-W229 HydrophobicContact CD1-CH2 4.28Å; F226-W229 AromaticContact CD1-CZ3 3.88Å; F226-W229 HydrophobicContact CD1-CZ3 3.88Å; F226-W229 HydrophobicContact CE1-CE3 4.05Å; F226-W229 HydrophobicContact CE1-CH2 4.46Å; F226-W229 AromaticContact CE1-CZ3 3.85Å; F226-W229 HydrophobicContact CE1-CZ3 3.85Å; F226-W229 PolarHBondContact O-NE1 3.34Å; W229-G231 VanDerWaalsContact C-N 3.33Å; W229-R421 PolarHBondContact O-NH1 2.99Å; W229-R421 VanDerWaalsContact O-NH1 3.14Å
230	K	88.8	Confident	92.4	Very high	137 Å²	137	44.1 Å²	44.1	60%	0.596	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.1	16.2	176.1	-57.6	177	178.8	-179.8	0	113.8	I228	I228-K230 VanDerWaalsContact C-N 3.26Å; I228-K230 PolarHBondContact O-N 2.9Å; I228-K230 VanDerWaalsContact O-N 3.1Å
231	G	87.4	Confident	92.2	Very high	3 Å²	3	49.6 Å²	49.6	3%	0.031	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	-149.8	179	0	0	0	0	0	113.5	I228 W229 K233 S234 T235	I228-G231 WeakPolarHBondContact O-CA 3.12Å; I228-G231 PolarHBondContact O-N 3.32Å; W229-G231 VanDerWaalsContact C-N 3.33Å; G231-K233 PolarHBondContact O-N 3.03Å; G231-S234 PolarHBondContact O-N 3.35Å; G231-T235 WeakPolarHBondContact O-CB 3.24Å; G231-T235 PolarHBondContact O-N 3.21Å; G231-T235 PolarHBondContact O-OG1 2.84Å
232	V	86.4	Confident	92	Very high	8 Å²	8	49.4 Å²	49.4	5%	0.048	23%	0.227	C	C	.	.	H	α-helix	trans	-49.3	-25.2	-177.8	-63.5	0	0	0	0	114.5	W39 G236 Y308	W39-V232 HydrophobicContact CD2-CB 4.3Å; W39-V232 HydrophobicContact CE3-CB 3.78Å; W39-V232 HydrophobicContact CE3-CG1 4.37Å; W39-V232 HydrophobicContact CH2-CB 3.83Å; W39-V232 HydrophobicContact CH2-CG1 3.62Å; W39-V232 HydrophobicContact CZ2-CB 4.32Å; W39-V232 HydrophobicContact CZ2-CG1 3.85Å; W39-V232 HydrophobicContact CZ3-CB 3.54Å; W39-V232 HydrophobicContact CZ3-CG1 3.91Å; W39-V232 WeakPolarHBondContact CZ3-O 3.26Å; V232-G236 WeakPolarHBondContact O-CA 3.29Å; V232-G236 PolarHBondContact O-N 3.24Å; V232-Y308 HydrophobicContact CG1-CD1 4.07Å; V232-Y308 HydrophobicContact CG1-CD2 3.63Å; V232-Y308 HydrophobicContact CG1-CE1 4.18Å; V232-Y308 HydrophobicContact CG1-CE2 3.76Å; V232-Y308 HydrophobicContact CG1-CG 3.8Å; V232-Y308 HydrophobicContact CG2-CD1 4.17Å; V232-Y308 HydrophobicContact CG2-CE1 4.45Å
233	K	87.6	Confident	91.8	Very high	118 Å²	118	46.8 Å²	46.8	51%	0.513	21%	0.212	S	C	.	.	H	α-helix	trans	-72.9	-32.3	175.7	-65.2	-172.1	177.1	-178.7	0	114.3	G231 K237	G231-K233 PolarHBondContact O-N 3.03Å; K233-K237 WeakPolarHBondContact O-CG 3.33Å
234	S	90.2	Very high	91.7	Very high	20 Å²	20	47 Å²	47	14%	0.14	22%	0.216	C	C	.	.	H	α-helix	trans	-86.7	-50.2	175.3	179.9	0	0	0	0	110.1	C227 G231 G236 K237 V238	C227-S234 CarbonylContact O-C 3.59Å; C227-S234 VanDerWaalsContact O-CB 3.27Å; C227-S234 WeakPolarHBondContact O-CB 3.25Å; C227-S234 PolarHBondContact O-OG 2.93Å; G231-S234 PolarHBondContact O-N 3.35Å; S234-G236 VanDerWaalsContact C-N 3.31Å; S234-G236 PolarHBondContact O-N 3.14Å; S234-K237 PolarHBondContact O-N 3.47Å; S234-V238 PolarHBondContact O-N 3.04Å; S234-V238 VanDerWaalsContact O-N 3.1Å
235	T	89.4	Confident	91.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-44.3	-55	171.3	-63.1	0	0	0	0	110.9	W39 C227 G231 K237 V238 V239 F397	W39-T235 HydrophobicContact CH2-CG2 4.27Å; W39-T235 HydrophobicContact CZ3-CG2 4.43Å; C227-T235 PolarHBondContact O-N 2.86Å; G231-T235 WeakPolarHBondContact O-CB 3.24Å; G231-T235 PolarHBondContact O-N 3.21Å; G231-T235 PolarHBondContact O-OG1 2.84Å; T235-K237 PolarHBondContact O-N 2.72Å; T235-K237 VanDerWaalsContact O-N 3.1Å; T235-V238 PolarHBondContact O-N 2.57Å; T235-V239 WeakPolarHBondContact O-CG1 3.43Å; T235-V239 PolarHBondContact O-N 3.35Å; T235-F397 HydrophobicContact CG2-CD2 3.6Å; T235-F397 HydrophobicContact CG2-CE2 3.09Å; T235-F397 HydrophobicContact CG2-CZ 3.88Å
236	G	88.6	Confident	91.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.7	-20	-179.9	0	0	0	0	0	115.3	E44 V232 S234 V239 Y240	E44-G236 WeakPolarHBondContact CG-O 3.13Å; V232-G236 WeakPolarHBondContact O-CA 3.29Å; V232-G236 PolarHBondContact O-N 3.24Å; S234-G236 VanDerWaalsContact C-N 3.31Å; S234-G236 PolarHBondContact O-N 3.14Å; G236-V239 WeakPolarHBondContact O-CG2 3.49Å; G236-Y240 WeakPolarHBondContact O-CD2 3.28Å; G236-Y240 WeakPolarHBondContact O-CE2 3.37Å
237	K	91.7	Very high	91.3	Very high	119 Å²	119	45 Å²	45	52%	0.517	21%	0.207	S	C	.	.	H	α-helix	trans	-88.1	-40.6	175.3	-64.9	-57	-175	-155.3	0	112.5	E44 K233 S234 T235 V239 Y240	E44-K237 WeakPolarHBondContact OE1-CE 3.5Å; E44-K237 IonicContact OE1-NZ 2.63Å; E44-K237 PolarHBondContact OE1-NZ 3.3Å; K233-K237 WeakPolarHBondContact O-CG 3.33Å; S234-K237 PolarHBondContact O-N 3.47Å; T235-K237 PolarHBondContact O-N 2.72Å; T235-K237 VanDerWaalsContact O-N 3.1Å; K237-V239 VanDerWaalsContact C-N 3.31Å; K237-V239 PolarHBondContact O-N 2.99Å; K237-Y240 PolarHBondContact O-N 3.17Å
238	V	92.9	Very high	91.4	Very high	41 Å²	41	49.1 Å²	49.1	25%	0.248	23%	0.228	C	C	.	.	H	α-helix	trans	-62.5	-41.4	-179.9	175.6	0	0	0	0	110.8	C227 S234 T235 Y240 F241 T242	C227-V238 HydrophobicContact CB-CG2 4.42Å; S234-V238 PolarHBondContact O-N 3.04Å; S234-V238 VanDerWaalsContact O-N 3.1Å; T235-V238 PolarHBondContact O-N 2.57Å; V238-Y240 PolarHBondContact O-N 3.2Å; V238-Y240 VanDerWaalsContact O-N 3.09Å; V238-F241 PolarHBondContact O-N 2.87Å; V238-T242 HydrophobicContact CG1-CG2 3.67Å; V238-T242 PolarHBondContact O-N 3.33Å; V238-T242 VanDerWaalsContact O-N 3.15Å; V238-T242 PolarHBondContact O-OG1 3.21Å
239	V	93.8	Very high	91.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-22.9	-178.2	-65.6	0	0	0	0	115.3	L47 T235 G236 K237 F241 T242 A243 F397	L47-V239 HydrophobicContact CB-CB 4.13Å; L47-V239 HydrophobicContact CB-CG2 3.83Å; T235-V239 WeakPolarHBondContact O-CG1 3.43Å; T235-V239 PolarHBondContact O-N 3.35Å; G236-V239 WeakPolarHBondContact O-CG2 3.49Å; K237-V239 VanDerWaalsContact C-N 3.31Å; K237-V239 PolarHBondContact O-N 2.99Å; V239-F241 PolarHBondContact O-N 3.31Å; V239-T242 WeakPolarHBondContact CA-OG1 3.43Å; V239-A243 HydrophobicContact CB-CB 4.41Å; V239-A243 WeakPolarHBondContact O-CB 3.27Å; V239-A243 PolarHBondContact O-N 3.21Å; V239-F397 HydrophobicContact CG1-CE1 4.14Å; V239-F397 HydrophobicContact CG1-CE2 3.49Å; V239-F397 VanDerWaalsContact CG1-CE2 3.49Å; V239-F397 HydrophobicContact CG1-CZ 3.09Å
240	Y	93.9	Very high	91.4	Very high	92 Å²	92	45.3 Å²	45.3	36%	0.361	21%	0.214	S	C	.	.	H	α-helix	trans	-59.4	-32.7	175.7	-83.3	-85.3	0	0	0	112.1	S41 M43 E44 L47 G236 K237 V238 T244	S41-Y240 PolarHBondContact OG-OH 3.22Å; M43-Y240 HydrophobicContact CG-CE1 3.73Å; E44-Y240 HydrophobicContact CG-CE2 3.84Å; L47-Y240 HydrophobicContact CD1-CD1 3.64Å; L47-Y240 HydrophobicContact CD1-CE1 3.83Å; L47-Y240 HydrophobicContact CD1-CG 4.02Å; G236-Y240 WeakPolarHBondContact O-CD2 3.28Å; G236-Y240 WeakPolarHBondContact O-CE2 3.37Å; K237-Y240 PolarHBondContact O-N 3.17Å; V238-Y240 PolarHBondContact O-N 3.2Å; V238-Y240 VanDerWaalsContact O-N 3.09Å; Y240-T244 WeakPolarHBondContact O-CB 3.01Å; Y240-T244 WeakPolarHBondContact O-CG2 3.46Å; Y240-T244 PolarHBondContact O-OG1 3.22Å
241	F	93.8	Very high	91.6	Very high	117 Å²	117	43 Å²	43	51%	0.513	21%	0.211	S	C	.	.	H	α-helix	trans	-96.4	-50.4	177.4	-176.2	-108.4	0	0	0	111.5	V238 V239 A243 T244 F245 F390	V238-F241 PolarHBondContact O-N 2.87Å; V239-F241 PolarHBondContact O-N 3.31Å; F241-A243 PolarHBondContact O-N 3.11Å; F241-T244 PolarHBondContact O-N 3.15Å; F241-T244 PolarHBondContact O-OG1 3.34Å; F241-F245 HydrophobicContact CE2-CD2 4.27Å; F241-F245 HydrophobicContact CZ-CD2 4.05Å; F241-F245 WeakPolarHBondContact O-CB 3.43Å; F241-F245 PolarHBondContact O-N 3.3Å; F241-F390 HydrophobicContact CD1-CE2 4.1Å; F241-F390 HydrophobicContact CD1-CZ 4.13Å; F241-F390 HydrophobicContact CE1-CD2 4.39Å; F241-F390 HydrophobicContact CE1-CE1 4.46Å; F241-F390 AromaticContact CE1-CE2 3.4Å; F241-F390 HydrophobicContact CE1-CE2 3.4Å; F241-F390 VanDerWaalsContact CE1-CE2 3.4Å; F241-F390 AromaticContact CE1-CZ 3.47Å; F241-F390 HydrophobicContact CE1-CZ 3.47Å; F241-F390 VanDerWaalsContact CE1-CZ 3.47Å; F241-F390 HydrophobicContact CZ-CE2 4.06Å; F241-F390 HydrophobicContact CZ-CZ 4.41Å
242	T	94.4	Very high	91.9	Very high	6 Å²	6	45.9 Å²	45.9	4%	0.037	23%	0.225	C	C	.	.	H	α-helix	trans	-66	-36.2	-173	54.5	0	0	0	0	112.4	V238 V239 P246 F390 L393 D394	V238-T242 HydrophobicContact CG1-CG2 3.67Å; V238-T242 PolarHBondContact O-N 3.33Å; V238-T242 VanDerWaalsContact O-N 3.15Å; V238-T242 PolarHBondContact O-OG1 3.21Å; V239-T242 WeakPolarHBondContact CA-OG1 3.43Å; T242-P246 WeakPolarHBondContact O-CD 3.46Å; T242-P246 WeakPolarHBondContact O-CG 3.43Å; T242-F390 HydrophobicContact CG2-CD1 3.89Å; T242-F390 HydrophobicContact CG2-CE1 4.29Å; T242-F390 HydrophobicContact CG2-CG 4.27Å; T242-L393 HydrophobicContact CG2-CD2 4.31Å; T242-D394 WeakPolarHBondContact CB-OD1 2.98Å; T242-D394 PolarHBondContact OG1-OD1 3.42Å; T242-D394 PolarHBondContact OG1-OD2 3.19Å
243	A	93.1	Very high	92.1	Very high	7 Å²	7	46 Å²	46	6%	0.058	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-22.3	179.8	0	0	0	0	0	113.2	V239 F241 Y247 D394	V239-A243 HydrophobicContact CB-CB 4.41Å; V239-A243 WeakPolarHBondContact O-CB 3.27Å; V239-A243 PolarHBondContact O-N 3.21Å; F241-A243 PolarHBondContact O-N 3.11Å; A243-Y247 WeakPolarHBondContact O-CD2 3.26Å; A243-Y247 WeakPolarHBondContact O-CE2 3.36Å; A243-D394 WeakPolarHBondContact CA-OD2 3.43Å; A243-D394 WeakPolarHBondContact CB-OD2 3.4Å; A243-D394 PolarHBondContact N-OD2 2.87Å
244	T	93.6	Very high	92.4	Very high	65 Å²	65	42.7 Å²	42.7	40%	0.399	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-32.6	-176.7	63.2	0	0	0	0	113	L47 Y240 F241 Y247 L248	L47-T244 HydrophobicContact CD2-CG2 4.32Å; Y240-T244 WeakPolarHBondContact O-CB 3.01Å; Y240-T244 WeakPolarHBondContact O-CG2 3.46Å; Y240-T244 PolarHBondContact O-OG1 3.22Å; F241-T244 PolarHBondContact O-N 3.15Å; F241-T244 PolarHBondContact O-OG1 3.34Å; T244-Y247 WeakPolarHBondContact O-CB 3.39Å; T244-Y247 PolarHBondContact O-N 2.87Å; T244-Y247 VanDerWaalsContact O-N 3.14Å; T244-L248 PolarHBondContact O-N 3.3Å
245	F	93.3	Very high	92.6	Very high	31 Å²	31	46 Å²	46	14%	0.136	23%	0.232	C	C	.	.	H	α-helix	trans	-58.9	-41.5	179.8	-179.7	-87	0	0	0	113.5	F241 Y247 L248 M249 L383 I386 M387 F390	F241-F245 HydrophobicContact CE2-CD2 4.27Å; F241-F245 HydrophobicContact CZ-CD2 4.05Å; F241-F245 WeakPolarHBondContact O-CB 3.43Å; F241-F245 PolarHBondContact O-N 3.3Å; F245-Y247 PolarHBondContact O-N 3.32Å; F245-L248 WeakPolarHBondContact O-CB 3.45Å; F245-L248 PolarHBondContact O-N 3.46Å; F245-L248 VanDerWaalsContact O-N 3.14Å; F245-M249 HydrophobicContact CD1-CG 3.89Å; F245-M249 HydrophobicContact CE1-CG 3.32Å; F245-M249 HydrophobicContact CE1-SD 4.28Å; F245-M249 HydrophobicContact CE2-CG 4.42Å; F245-M249 HydrophobicContact CZ-CG 3.63Å; F245-M249 HydrophobicContact CZ-SD 4.02Å; F245-M249 PolarHBondContact O-N 3.21Å; F245-L383 HydrophobicContact CZ-CD2 4.37Å; F245-I386 HydrophobicContact CD1-CG2 4.3Å; F245-I386 HydrophobicContact CE1-CB 4.36Å; F245-I386 HydrophobicContact CE1-CG2 3.61Å; F245-I386 HydrophobicContact CZ-CG2 3.93Å; F245-M387 HydrophobicContact CE1-CB 4.43Å; F245-F390 HydrophobicContact CB-CD2 3.89Å; F245-F390 HydrophobicContact CB-CE2 4.21Å; F245-F390 AromaticContact CD1-CD2 3.5Å; F245-F390 HydrophobicContact CD1-CD2 3.5Å; F245-F390 VanDerWaalsContact CD1-CD2 3.5Å; F245-F390 AromaticContact CD1-CE2 3.79Å; F245-F390 HydrophobicContact CD1-CE2 3.79Å; F245-F390 HydrophobicContact CD2-CE2 4.49Å; F245-F390 HydrophobicContact CE1-CD2 4.23Å; F245-F390 HydrophobicContact CE1-CE2 4.26Å; F245-F390 AromaticContact CG-CD2 3.83Å; F245-F390 HydrophobicContact CG-CD2 3.83Å; F245-F390 AromaticContact CG-CE2 3.91Å; F245-F390 HydrophobicContact CG-CE2 3.91Å
246	P	91.7	Very high	92.7	Very high	4 Å²	4	49 Å²	49	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-33.2	175.3	-27.8	36.3	0	0	0	113.9	T242 M249 L250 M387 F390 L391	T242-P246 WeakPolarHBondContact O-CD 3.46Å; T242-P246 WeakPolarHBondContact O-CG 3.43Å; P246-M249 PolarHBondContact O-N 2.8Å; P246-L250 WeakPolarHBondContact O-CB 3.27Å; P246-L250 VanDerWaalsContact O-CG 3.25Å; P246-L250 WeakPolarHBondContact O-CG 3.41Å; P246-L250 PolarHBondContact O-N 3.02Å; P246-M387 HydrophobicContact CB-CG 4.05Å; P246-F390 HydrophobicContact CG-CB 4.16Å; P246-L391 HydrophobicContact CB-CD1 4.41Å; P246-L391 HydrophobicContact CB-CD2 3.58Å; P246-L391 HydrophobicContact CB-CG 3.83Å; P246-L391 HydrophobicContact CG-CD2 3.78Å; P246-L391 HydrophobicContact CG-CG 3.85Å
247	Y	92.3	Very high	92.8	Very high	71 Å²	71	49 Å²	49	28%	0.278	24%	0.243	S	C	.	.	H	α-helix	trans	-67.5	-43.7	174.8	-73	-85.7	0	0	0	112.6	I54 A243 T244 F245 M249 L250 V251 L325 T329	I54-Y247 WeakPolarHBondContact CD1-OH 3.04Å; A243-Y247 WeakPolarHBondContact O-CD2 3.26Å; A243-Y247 WeakPolarHBondContact O-CE2 3.36Å; T244-Y247 WeakPolarHBondContact O-CB 3.39Å; T244-Y247 PolarHBondContact O-N 2.87Å; T244-Y247 VanDerWaalsContact O-N 3.14Å; F245-Y247 PolarHBondContact O-N 3.32Å; Y247-M249 PolarHBondContact O-N 3.39Å; Y247-L250 PolarHBondContact O-N 3Å; Y247-V251 WeakPolarHBondContact O-CG2 3.34Å; Y247-V251 PolarHBondContact O-N 3.14Å; Y247-L325 HydrophobicContact CE1-CD1 4.15Å; Y247-L325 WeakPolarHBondContact OH-CD1 3.26Å; Y247-L325 WeakPolarHBondContact OH-CD2 3.38Å; Y247-L325 WeakPolarHBondContact OH-CG 3.32Å; Y247-T329 HydrophobicContact CE1-CG2 4.19Å; Y247-T329 VanDerWaalsContact CE1-OG1 3.3Å; Y247-T329 WeakPolarHBondContact CE1-OG1 3.14Å; Y247-T329 PolarHBondContact OH-OG1 2.93Å
248	L	93.5	Very high	93	Very high	102 Å²	102	46.6 Å²	46.6	53%	0.534	24%	0.239	S	C	.	.	H	α-helix	trans	-56.5	-45.7	173.9	175.7	63.1	0	0	0	109.9	T244 F245 V251 I252	T244-L248 PolarHBondContact O-N 3.3Å; F245-L248 WeakPolarHBondContact O-CB 3.45Å; F245-L248 PolarHBondContact O-N 3.46Å; F245-L248 VanDerWaalsContact O-N 3.14Å; L248-V251 PolarHBondContact O-N 3.21Å; L248-I252 HydrophobicContact CD1-CD1 4.09Å; L248-I252 HydrophobicContact CG-CD1 4Å; L248-I252 VanDerWaalsContact O-CG1 3.31Å; L248-I252 WeakPolarHBondContact O-CG1 3.08Å; L248-I252 PolarHBondContact O-N 2.99Å
249	M	91.1	Very high	93	Very high	3 Å²	3	49 Å²	49	2%	0.015	25%	0.254	C	S	.	.	H	α-helix	trans	-66.6	-41.2	178.1	-76.6	-52.8	-47.1	0	0	113.5	F245 P246 Y247 V251 I252 L253 L383 M387	F245-M249 HydrophobicContact CD1-CG 3.89Å; F245-M249 HydrophobicContact CE1-CG 3.32Å; F245-M249 HydrophobicContact CE1-SD 4.28Å; F245-M249 HydrophobicContact CE2-CG 4.42Å; F245-M249 HydrophobicContact CZ-CG 3.63Å; F245-M249 HydrophobicContact CZ-SD 4.02Å; F245-M249 PolarHBondContact O-N 3.21Å; P246-M249 PolarHBondContact O-N 2.8Å; Y247-M249 PolarHBondContact O-N 3.39Å; M249-V251 VanDerWaalsContact C-N 3.3Å; M249-V251 PolarHBondContact O-N 3.38Å; M249-I252 PolarHBondContact O-N 2.9Å; M249-I252 HydrophobicContact SD-CD1 4.18Å; M249-L253 HydrophobicContact CE-CD1 4.39Å; M249-L253 HydrophobicContact CE-CG 4.1Å; M249-L253 WeakPolarHBondContact O-CB 3.46Å; M249-L253 VanDerWaalsContact O-CG 3.32Å; M249-L253 WeakPolarHBondContact O-CG 3.28Å; M249-L253 PolarHBondContact O-N 3.49Å; M249-L383 HydrophobicContact CE-CB 3.54Å; M249-L383 HydrophobicContact CE-CD1 4.15Å; M249-L383 HydrophobicContact CE-CG 4.35Å; M249-L383 HydrophobicContact SD-CB 3.91Å; M249-L383 HydrophobicContact SD-CD1 4.23Å; M249-L383 HydrophobicContact SD-CD2 4.05Å; M249-L383 HydrophobicContact SD-CG 4.3Å; M249-M387 HydrophobicContact CB-CB 4.16Å; M249-M387 HydrophobicContact CB-CG 4.03Å; M249-M387 HydrophobicContact CB-SD 3.62Å; M249-M387 HydrophobicContact CG-CB 4.21Å
250	L	91.4	Very high	92.9	Very high	7 Å²	7	49.5 Å²	49.5	4%	0.037	26%	0.256	C	S	.	.	H	α-helix	trans	-60.9	-39.4	175.1	-76.3	173.2	0	0	0	111.6	V59 P246 Y247 L254 T329 A333 V336 M387	V59-L250 HydrophobicContact CG2-CD2 4.49Å; P246-L250 WeakPolarHBondContact O-CB 3.27Å; P246-L250 VanDerWaalsContact O-CG 3.25Å; P246-L250 WeakPolarHBondContact O-CG 3.41Å; P246-L250 PolarHBondContact O-N 3.02Å; Y247-L250 PolarHBondContact O-N 3Å; L250-L254 WeakPolarHBondContact O-CB 3.45Å; L250-L254 PolarHBondContact O-N 2.87Å; L250-T329 HydrophobicContact CD1-CG2 3.77Å; L250-A333 HydrophobicContact CD2-CB 4.17Å; L250-V336 HydrophobicContact CD2-CG2 4.24Å; L250-M387 HydrophobicContact CD2-SD 4.46Å; L250-M387 HydrophobicContact CG-SD 4.44Å
251	V	94.1	Very high	92.9	Very high	88 Å²	88	48.2 Å²	48.2	53%	0.533	26%	0.259	S	S	.	.	H	α-helix	trans	-65	-46	175.3	171.5	0	0	0	0	111.1	Y247 L248 M249 L254 V255	Y247-V251 WeakPolarHBondContact O-CG2 3.34Å; Y247-V251 PolarHBondContact O-N 3.14Å; L248-V251 PolarHBondContact O-N 3.21Å; M249-V251 VanDerWaalsContact C-N 3.3Å; M249-V251 PolarHBondContact O-N 3.38Å; V251-L254 PolarHBondContact O-N 3.2Å; V251-V255 WeakPolarHBondContact O-CG2 3.33Å; V251-V255 PolarHBondContact O-N 3.09Å
252	I	92.8	Very high	92.7	Very high	64 Å²	64	43.1 Å²	43.1	33%	0.328	24%	0.239	S	C	.	.	H	α-helix	trans	-61.4	-48.6	177.9	-68.7	167.1	0	0	0	110.6	L248 M249 L254 V255 R256 W380	L248-I252 HydrophobicContact CD1-CD1 4.09Å; L248-I252 HydrophobicContact CG-CD1 4Å; L248-I252 VanDerWaalsContact O-CG1 3.31Å; L248-I252 WeakPolarHBondContact O-CG1 3.08Å; L248-I252 PolarHBondContact O-N 2.99Å; M249-I252 PolarHBondContact O-N 2.9Å; M249-I252 HydrophobicContact SD-CD1 4.18Å; I252-L254 VanDerWaalsContact C-N 3.29Å; I252-L254 PolarHBondContact O-N 3.27Å; I252-V255 PolarHBondContact O-N 3.11Å; I252-R256 WeakPolarHBondContact O-CB 3.36Å; I252-R256 PolarHBondContact O-N 2.9Å; I252-W380 HydrophobicContact CG2-CH2 4.19Å; I252-W380 HydrophobicContact CG2-CZ3 3.82Å
253	L	91.1	Very high	92.7	Very high	12 Å²	12	43 Å²	43	6%	0.063	24%	0.239	C	C	.	.	H	α-helix	trans	-68.1	-28.8	179.2	-69.6	175.9	0	0	0	112.3	M249 G257 V336 W380 F384 M387	M249-L253 HydrophobicContact CE-CD1 4.39Å; M249-L253 HydrophobicContact CE-CG 4.1Å; M249-L253 WeakPolarHBondContact O-CB 3.46Å; M249-L253 VanDerWaalsContact O-CG 3.32Å; M249-L253 WeakPolarHBondContact O-CG 3.28Å; M249-L253 PolarHBondContact O-N 3.49Å; L253-G257 WeakPolarHBondContact O-CA 3.48Å; L253-G257 PolarHBondContact O-N 3.04Å; L253-V336 HydrophobicContact CB-CG1 3.59Å; L253-V336 HydrophobicContact CD1-CG1 4.36Å; L253-W380 HydrophobicContact CD2-CE3 4.07Å; L253-W380 HydrophobicContact CD2-CZ3 4.2Å; L253-F384 HydrophobicContact CD1-CD2 4.39Å; L253-M387 HydrophobicContact CD1-CE 4.08Å; L253-M387 HydrophobicContact CD1-SD 4.17Å
254	L	93.9	Very high	92.7	Very high	47 Å²	47	50.6 Å²	50.6	25%	0.246	27%	0.268	C	S	.	.	H	α-helix	trans	-65.9	-53.4	173	179.4	66.1	0	0	0	110.3	L250 V251 I252 R256 G257 V258 V332 F335 V336	L250-L254 WeakPolarHBondContact O-CB 3.45Å; L250-L254 PolarHBondContact O-N 2.87Å; V251-L254 PolarHBondContact O-N 3.2Å; I252-L254 VanDerWaalsContact C-N 3.29Å; I252-L254 PolarHBondContact O-N 3.27Å; L254-R256 VanDerWaalsContact C-N 3.29Å; L254-R256 PolarHBondContact O-N 3Å; L254-G257 PolarHBondContact O-N 3.24Å; L254-V258 HydrophobicContact CD1-CG1 3.98Å; L254-V258 WeakPolarHBondContact O-CG1 3.3Å; L254-V258 VanDerWaalsContact O-CG2 3.29Å; L254-V258 WeakPolarHBondContact O-CG2 2.82Å; L254-V258 PolarHBondContact O-N 3.29Å; L254-V332 HydrophobicContact CD2-CG1 4.13Å; L254-F335 HydrophobicContact CD1-CB 3.54Å; L254-V336 HydrophobicContact CB-CG2 3.81Å; L254-V336 HydrophobicContact CD1-CG2 4.17Å
255	V	94.5	Very high	92.7	Very high	90 Å²	90	52 Å²	52	55%	0.545	27%	0.27	S	S	.	.	H	α-helix	trans	-58.8	-44.5	178.2	173.9	0	0	0	0	110.3	V251 I252 T259	V251-V255 WeakPolarHBondContact O-CG2 3.33Å; V251-V255 PolarHBondContact O-N 3.09Å; I252-V255 PolarHBondContact O-N 3.11Å; V255-T259 WeakPolarHBondContact O-CB 3.37Å; V255-T259 WeakPolarHBondContact O-CG2 3.28Å; V255-T259 PolarHBondContact O-N 3.05Å; V255-T259 PolarHBondContact O-OG1 3.06Å
256	R	90.8	Very high	92.7	Very high	62 Å²	62	50.6 Å²	50.6	23%	0.234	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-49.1	176.4	-179.3	56.1	-177.2	157.4	1.9	111.8	I252 L254 V258 T259 L260 M374 W380	I252-R256 WeakPolarHBondContact O-CB 3.36Å; I252-R256 PolarHBondContact O-N 2.9Å; L254-R256 VanDerWaalsContact C-N 3.29Å; L254-R256 PolarHBondContact O-N 3Å; R256-V258 PolarHBondContact O-N 3.32Å; R256-T259 PolarHBondContact O-N 3.35Å; R256-T259 PolarHBondContact O-OG1 3.42Å; R256-L260 WeakPolarHBondContact O-CG 3.15Å; R256-L260 PolarHBondContact O-N 2.95Å; R256-M374 HydrophobicContact CG-SD 4.25Å; R256-W380 HydrophobicContact CB-CH2 3.98Å; R256-W380 HydrophobicContact CB-CZ3 4.27Å; R256-W380 HydrophobicContact CG-CH2 3.81Å; R256-W380 HydrophobicContact CG-CZ2 4.04Å; R256-W380 HydrophobicContact CG-CZ3 4.2Å
257	G	91.7	Very high	92.9	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-59.1	-48.5	-177.4	0	0	0	0	0	112.5	L253 L254 T259 L260 A263 S339	L253-G257 WeakPolarHBondContact O-CA 3.48Å; L253-G257 PolarHBondContact O-N 3.04Å; L254-G257 PolarHBondContact O-N 3.24Å; G257-T259 PolarHBondContact O-N 3.31Å; G257-L260 WeakPolarHBondContact O-CB 3.3Å; G257-L260 PolarHBondContact O-N 3.11Å; G257-A263 VanDerWaalsContact O-CB 3.28Å; G257-A263 WeakPolarHBondContact O-CB 3.18Å; G257-S339 WeakPolarHBondContact CA-OG 3.32Å; G257-S339 WeakPolarHBondContact O-CB 3.08Å
258	V	95.1	Very high	93	Very high	69 Å²	69	51.6 Å²	51.6	42%	0.418	27%	0.272	S	S	.	.	H	α-helix	trans	-72.3	-15.2	-178.6	-56.4	0	0	0	0	114.1	L254 R256 I267	L254-V258 HydrophobicContact CD1-CG1 3.98Å; L254-V258 WeakPolarHBondContact O-CG1 3.3Å; L254-V258 VanDerWaalsContact O-CG2 3.29Å; L254-V258 WeakPolarHBondContact O-CG2 2.82Å; L254-V258 PolarHBondContact O-N 3.29Å; R256-V258 PolarHBondContact O-N 3.32Å; V258-I267 HydrophobicContact CG1-CD1 4.35Å
259	T	93.6	Very high	92.9	Very high	92 Å²	92	52.1 Å²	52.1	56%	0.564	27%	0.268	S	S	*	.	H	α-helix	trans	-91.2	-6.9	175.8	53.2	0	0	0	0	113.3	V255 R256 G257	V255-T259 WeakPolarHBondContact O-CB 3.37Å; V255-T259 WeakPolarHBondContact O-CG2 3.28Å; V255-T259 PolarHBondContact O-N 3.05Å; V255-T259 PolarHBondContact O-OG1 3.06Å; R256-T259 PolarHBondContact O-N 3.35Å; R256-T259 PolarHBondContact O-OG1 3.42Å; G257-T259 PolarHBondContact O-N 3.31Å
260	L	92	Very high	93.1	Very high	10 Å²	10	52 Å²	52	5%	0.052	27%	0.267	C	S	.	.	S	Bend	trans	-74.2	148.5	174.9	-70.2	166.8	0	0	0	111.3	R256 G257 A263 I340 F343 M374	R256-L260 WeakPolarHBondContact O-CG 3.15Å; R256-L260 PolarHBondContact O-N 2.95Å; G257-L260 WeakPolarHBondContact O-CB 3.3Å; G257-L260 PolarHBondContact O-N 3.11Å; L260-A263 VanDerWaalsContact O-CB 3.3Å; L260-A263 WeakPolarHBondContact O-CB 3.46Å; L260-A263 PolarHBondContact O-N 3.29Å; L260-I340 HydrophobicContact CD1-CG1 4.37Å; L260-F343 HydrophobicContact CB-CB 3.8Å; L260-F343 HydrophobicContact CB-CD2 3.88Å; L260-F343 HydrophobicContact CB-CG 3.84Å; L260-F343 HydrophobicContact CD1-CB 4.04Å; L260-F343 HydrophobicContact CD1-CD1 3.79Å; L260-F343 HydrophobicContact CD1-CE1 4.35Å; L260-F343 HydrophobicContact CD1-CG 3.85Å; L260-F343 HydrophobicContact CD2-CD1 4.38Å; L260-F343 HydrophobicContact CD2-CD2 4.13Å; L260-F343 HydrophobicContact CD2-CE1 4.32Å; L260-F343 HydrophobicContact CD2-CE2 4.07Å; L260-F343 HydrophobicContact CD2-CG 4.26Å; L260-F343 HydrophobicContact CD2-CZ 4.17Å; L260-F343 HydrophobicContact CG-CB 4.48Å; L260-F343 HydrophobicContact CG-CD1 4.48Å; L260-F343 HydrophobicContact CG-CD2 4.39Å; L260-F343 HydrophobicContact CG-CG 4.2Å; L260-M374 HydrophobicContact CD1-CE 3.61Å; L260-M374 HydrophobicContact CD1-SD 4.25Å
261	P	92.2	Very high	93.3	Very high	65 Å²	65	54.1 Å²	54.1	42%	0.422	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	144.6	171.4	25.7	-29.8	0	0	0	109.8	A263 F343	P261-A263 PolarHBondContact O-N 2.91Å; P261-F343 HydrophobicContact CG-CD2 3.75Å; P261-F343 HydrophobicContact CG-CE2 3.86Å; P261-F343 WeakPolarHBondContact O-CA 3.29Å; P261-F343 VanDerWaalsContact O-CB 3.31Å; P261-F343 WeakPolarHBondContact O-CB 3.42Å; P261-F343 WeakPolarHBondContact O-CD2 3.25Å
262	G	91.6	Very high	93.3	Very high	10 Å²	10	57 Å²	57	10%	0.103	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	-5.8	179.4	0	0	0	0	0	116.4	Y264 Q265 G266 G342	G262-Y264 PolarHBondContact O-N 3.48Å; G262-Q265 WeakPolarHBondContact O-CB 3.46Å; G262-Q265 PolarHBondContact O-N 3.42Å; G262-Q265 VanDerWaalsContact O-N 3.08Å; G262-G266 PolarHBondContact O-N 3.46Å; G262-G342 CarbonylContact O-C 3.58Å
263	A	93.9	Very high	93.5	Very high	4 Å²	4	58 Å²	58	3%	0.033	30%	0.295	C	S	.	.	H	α-helix	trans	-55.4	-38.3	178.1	0	0	0	0	0	113.5	G257 L260 P261 Q265 G266 I267 S339	G257-A263 VanDerWaalsContact O-CB 3.28Å; G257-A263 WeakPolarHBondContact O-CB 3.18Å; L260-A263 VanDerWaalsContact O-CB 3.3Å; L260-A263 WeakPolarHBondContact O-CB 3.46Å; L260-A263 PolarHBondContact O-N 3.29Å; P261-A263 PolarHBondContact O-N 2.91Å; A263-Q265 PolarHBondContact O-N 2.97Å; A263-G266 PolarHBondContact O-N 2.91Å; A263-I267 WeakPolarHBondContact O-CG1 3.41Å; A263-I267 PolarHBondContact O-N 3.31Å; A263-S339 WeakPolarHBondContact CA-O 3.26Å
264	Y	93.6	Very high	93.7	Very high	166 Å²	166	60.6 Å²	60.6	65%	0.651	31%	0.309	S	S	*	.	H	α-helix	trans	-58.3	-36.5	179.2	-179.9	-114.4	0	0	0	112.4	G262 I267 I268	G262-Y264 PolarHBondContact O-N 3.48Å; Y264-I267 PolarHBondContact O-N 3.37Å; Y264-I268 HydrophobicContact CD1-CD1 3.78Å; Y264-I268 HydrophobicContact CE1-CD1 3.31Å; Y264-I268 HydrophobicContact CE1-CG1 4.25Å; Y264-I268 HydrophobicContact CE2-CD1 4.32Å; Y264-I268 HydrophobicContact CE2-CG1 4.42Å; Y264-I268 HydrophobicContact CG-CD1 4.45Å; Y264-I268 WeakPolarHBondContact O-CG1 3.37Å; Y264-I268 PolarHBondContact O-N 3.05Å
265	Q	92.6	Very high	93.7	Very high	96 Å²	96	63.6 Å²	63.6	45%	0.449	32%	0.324	S	S	.	.	H	α-helix	trans	-71.9	-44.5	-175.7	-90.4	57.7	-14.6	0	0	108.7	G262 A263 I267 I268 Y269	G262-Q265 WeakPolarHBondContact O-CB 3.46Å; G262-Q265 PolarHBondContact O-N 3.42Å; G262-Q265 VanDerWaalsContact O-N 3.08Å; A263-Q265 PolarHBondContact O-N 2.97Å; Q265-I267 VanDerWaalsContact C-N 3.33Å; Q265-I267 PolarHBondContact O-N 3.12Å; Q265-I268 WeakPolarHBondContact O-CB 3.36Å; Q265-I268 PolarHBondContact O-N 3.46Å; Q265-I268 VanDerWaalsContact O-N 3.15Å; Q265-Y269 VanDerWaalsContact O-CD2 3.27Å; Q265-Y269 WeakPolarHBondContact O-CD2 3.36Å; Q265-Y269 PolarHBondContact O-N 3.02Å
266	G	93.8	Very high	93.8	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-53.4	-47.7	170.9	0	0	0	0	0	113.2	G262 A263 I268 Y269 Y270 F338	G262-G266 PolarHBondContact O-N 3.46Å; A263-G266 PolarHBondContact O-N 2.91Å; G266-I268 VanDerWaalsContact C-N 3.32Å; G266-I268 PolarHBondContact O-N 3.26Å; G266-Y269 PolarHBondContact O-N 3.48Å; G266-Y269 VanDerWaalsContact O-N 3.11Å; G266-Y270 PolarHBondContact O-N 3.02Å; G266-F338 WeakPolarHBondContact CA-O 3.5Å; G266-F338 WeakPolarHBondContact O-CD1 3.25Å
267	I	95.6	Very high	93.9	Very high	34 Å²	34	66.9 Å²	66.9	17%	0.174	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-37.3	178.4	-64.9	167.3	0	0	0	111.6	V258 A263 Y264 Q265 Y270 L271 F335	V258-I267 HydrophobicContact CG1-CD1 4.35Å; A263-I267 WeakPolarHBondContact O-CG1 3.41Å; A263-I267 PolarHBondContact O-N 3.31Å; Y264-I267 PolarHBondContact O-N 3.37Å; Q265-I267 VanDerWaalsContact C-N 3.33Å; Q265-I267 PolarHBondContact O-N 3.12Å; I267-Y270 WeakPolarHBondContact O-CB 3.5Å; I267-Y270 PolarHBondContact O-N 3.17Å; I267-L271 HydrophobicContact CG2-CD1 4.11Å; I267-L271 PolarHBondContact O-N 3.03Å; I267-F335 HydrophobicContact CD1-CD1 4.14Å; I267-F335 HydrophobicContact CG1-CD1 4.12Å; I267-F335 HydrophobicContact CG2-CD1 4.14Å; I267-F335 HydrophobicContact CG2-CE1 3.87Å
268	I	94.8	Very high	94	Very high	62 Å²	62	68.6 Å²	68.6	32%	0.318	34%	0.341	S	S	.	.	H	α-helix	trans	-60	-47.1	172.4	-71.6	167.2	0	0	0	110.2	Y264 Q265 G266 Y270 L271 K272	Y264-I268 HydrophobicContact CD1-CD1 3.78Å; Y264-I268 HydrophobicContact CE1-CD1 3.31Å; Y264-I268 HydrophobicContact CE1-CG1 4.25Å; Y264-I268 HydrophobicContact CE2-CD1 4.32Å; Y264-I268 HydrophobicContact CE2-CG1 4.42Å; Y264-I268 HydrophobicContact CG-CD1 4.45Å; Y264-I268 WeakPolarHBondContact O-CG1 3.37Å; Y264-I268 PolarHBondContact O-N 3.05Å; Q265-I268 WeakPolarHBondContact O-CB 3.36Å; Q265-I268 PolarHBondContact O-N 3.46Å; Q265-I268 VanDerWaalsContact O-N 3.15Å; G266-I268 VanDerWaalsContact C-N 3.32Å; G266-I268 PolarHBondContact O-N 3.26Å; I268-Y270 PolarHBondContact O-N 3.07Å; I268-L271 PolarHBondContact O-N 3.28Å; I268-K272 HydrophobicContact CG2-CB 4.13Å; I268-K272 HydrophobicContact CG2-CD 4.15Å; I268-K272 WeakPolarHBondContact O-CA 3.39Å; I268-K272 WeakPolarHBondContact O-CB 3.26Å; I268-K272 PolarHBondContact O-N 3.15Å
269	Y	91.2	Very high	93.9	Very high	113 Å²	113	73.2 Å²	73.2	44%	0.443	36%	0.355	S	S	.	.	H	α-helix	trans	-62.5	-32.4	177.7	-84.1	-82.6	0	0	0	112.9	Y67 Q265 G266 I352	Y67-Y269 HydrophobicContact CD2-CD1 4.42Å; Y67-Y269 AromaticContact CE2-CD1 3.81Å; Y67-Y269 HydrophobicContact CE2-CD1 3.81Å; Q265-Y269 VanDerWaalsContact O-CD2 3.27Å; Q265-Y269 WeakPolarHBondContact O-CD2 3.36Å; Q265-Y269 PolarHBondContact O-N 3.02Å; G266-Y269 PolarHBondContact O-N 3.48Å; G266-Y269 VanDerWaalsContact O-N 3.11Å; Y269-I352 HydrophobicContact CD2-CB 4.21Å; Y269-I352 HydrophobicContact CD2-CD1 3.19Å; Y269-I352 HydrophobicContact CD2-CG1 4.2Å; Y269-I352 HydrophobicContact CE2-CB 4.34Å; Y269-I352 HydrophobicContact CE2-CD1 3.61Å; Y269-I352 HydrophobicContact CE2-CG1 4.37Å; Y269-I352 HydrophobicContact CG-CB 4.36Å; Y269-I352 HydrophobicContact CG-CD1 3.94Å; Y269-I352 HydrophobicContact CG-CG2 4.35Å
270	Y	94.6	Very high	93.7	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-67.7	-42.9	176.1	-180	-137.8	0	0	0	113	F62 C66 G71 G266 I267 I268 F331 F335 F338	F62-Y270 WeakPolarHBondContact CE1-OH 3.45Å; C66-Y270 HydrophobicContact CB-CD2 4.03Å; C66-Y270 HydrophobicContact CB-CE2 3.56Å; C66-Y270 WeakPolarHBondContact SG-CE2 3.37Å; C66-Y270 PolarHBondContact SG-O 2.95Å; G71-Y270 CarbonylContact C-O 3.52Å; G71-Y270 VanDerWaalsContact CA-O 3.25Å; G71-Y270 WeakPolarHBondContact CA-O 3.13Å; G266-Y270 PolarHBondContact O-N 3.02Å; I267-Y270 WeakPolarHBondContact O-CB 3.5Å; I267-Y270 PolarHBondContact O-N 3.17Å; I268-Y270 PolarHBondContact O-N 3.07Å; Y270-F331 HydrophobicContact CE1-CD2 4.46Å; Y270-F331 HydrophobicContact CE1-CE2 4.47Å; Y270-F331 PolarHBondContact OH-O 3.28Å; Y270-F335 HydrophobicContact CE1-CD2 4.09Å; Y270-F335 HydrophobicContact CE1-CE2 4.15Å; Y270-F338 AromaticContact CD2-CD2 3.83Å; Y270-F338 HydrophobicContact CD2-CD2 3.83Å; Y270-F338 HydrophobicContact CD2-CE2 4.08Å; Y270-F338 HydrophobicContact CD2-CG 4.35Å; Y270-F338 HydrophobicContact CG-CB 4.32Å; Y270-F338 AromaticContact CG-CD2 3.98Å; Y270-F338 HydrophobicContact CG-CD2 3.98Å; Y270-F338 HydrophobicContact CG-CG 4.1Å
271	L	95.8	Very high	93.4	Very high	52 Å²	52	73.7 Å²	73.7	27%	0.272	36%	0.357	S	S	.	.	H	α-helix	trans	-112.4	-13.8	-166.3	-64.2	179.6	0	0	0	115.5	G72 F75 I267 I268 P273 F331 F335	G72-L271 WeakPolarHBondContact CA-O 3.48Å; G72-L271 PolarHBondContact N-O 2.99Å; F75-L271 HydrophobicContact CE2-CD2 3.99Å; F75-L271 HydrophobicContact CZ-CD2 4.46Å; I267-L271 HydrophobicContact CG2-CD1 4.11Å; I267-L271 PolarHBondContact O-N 3.03Å; I268-L271 PolarHBondContact O-N 3.28Å; L271-P273 VanDerWaalsContact O-CD 3.26Å; L271-P273 WeakPolarHBondContact O-CD 3.37Å; L271-P273 VanDerWaalsContact O-N 3.12Å; L271-F331 HydrophobicContact CD2-CE2 4.02Å; L271-F335 HydrophobicContact CD1-CE1 3.89Å; L271-F335 HydrophobicContact CD1-CZ 3.65Å
272	K	94.8	Very high	93.2	Very high	148 Å²	148	72.6 Å²	72.6	64%	0.643	35%	0.346	S	S	*	.			trans	-61.6	117.4	-179.2	-177.2	175.5	-179.9	-179.4	0	109.6	I268	I268-K272 HydrophobicContact CG2-CB 4.13Å; I268-K272 HydrophobicContact CG2-CD 4.15Å; I268-K272 WeakPolarHBondContact O-CA 3.39Å; I268-K272 WeakPolarHBondContact O-CB 3.26Å; I268-K272 PolarHBondContact O-N 3.15Å
273	P	96.3	Very high	93.2	Very high	86 Å²	86	72.1 Å²	72.1	56%	0.558	34%	0.342	S	S	*	.			trans	-78.1	128.1	-174.6	30	-33.1	0	0	0	110.9	G70 A73 L271	G70-P273 WeakPolarHBondContact O-CA 3.25Å; A73-P273 HydrophobicContact CB-CB 4.37Å; L271-P273 VanDerWaalsContact O-CD 3.26Å; L271-P273 WeakPolarHBondContact O-CD 3.37Å; L271-P273 VanDerWaalsContact O-N 3.12Å
274	D	95.1	Very high	93.1	Very high	66 Å²	66	75.5 Å²	75.5	35%	0.353	35%	0.353	S	S	.	.			trans	-112.3	96.7	164.6	-179	5.1	0	0	0	109.9	G70 A73 F276 R277	G70-D274 PolarHBondContact O-N 3.4Å; A73-D274 WeakPolarHBondContact CB-O 3.16Å; D274-F276 PolarHBondContact O-N 3.07Å; D274-F276 WeakPolarHBondContact OD1-CB 3.2Å; D274-F276 PolarHBondContact OD1-N 3.04Å; D274-R277 HydrophobicContact CB-CG 4.14Å; D274-R277 WeakPolarHBondContact O-CB 3.27Å; D274-R277 PolarHBondContact O-N 3.24Å; D274-R277 WeakPolarHBondContact OD2-CG 3.49Å
275	L	95.3	Very high	92.8	Very high	110 Å²	110	68.1 Å²	68.1	58%	0.576	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-67.8	-19	-177.9	-61.8	177.9	0	0	0	113	A73 I76 R277 L278	A73-L275 HydrophobicContact CB-CD2 4.05Å; I76-L275 HydrophobicContact CD1-CD2 4.31Å; L275-R277 PolarHBondContact O-N 3.31Å; L275-L278 HydrophobicContact CD2-CD1 3.98Å; L275-L278 WeakPolarHBondContact O-CB 3.46Å; L275-L278 PolarHBondContact O-N 3.4Å
276	F	95.6	Very high	92.7	Very high	156 Å²	156	64.2 Å²	64.2	68%	0.684	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-68.2	-28.4	177.4	-69.3	-79.6	0	0	0	111.8	D274 L278 K279	D274-F276 PolarHBondContact O-N 3.07Å; D274-F276 WeakPolarHBondContact OD1-CB 3.2Å; D274-F276 PolarHBondContact OD1-N 3.04Å; F276-L278 PolarHBondContact O-N 3.42Å; F276-K279 WeakPolarHBondContact O-CB 3.33Å; F276-K279 PolarHBondContact O-N 2.99Å
277	R	93.6	Very high	92.7	Very high	65 Å²	65	64.2 Å²	64.2	25%	0.245	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-61.4	-27.6	175.2	-65.9	-70.2	-68.7	130.1	4.7	112.4	K68 N69 D274 L275 K279 D280 V283	K68-R277 PolarHBondContact O-NE 2.97Å; K68-R277 PolarHBondContact O-NH2 3.38Å; K68-R277 VanDerWaalsContact O-NH2 3.15Å; N69-R277 PolarHBondContact OD1-NH2 3.31Å; D274-R277 HydrophobicContact CB-CG 4.14Å; D274-R277 WeakPolarHBondContact O-CB 3.27Å; D274-R277 PolarHBondContact O-N 3.24Å; D274-R277 WeakPolarHBondContact OD2-CG 3.49Å; L275-R277 PolarHBondContact O-N 3.31Å; R277-K279 PolarHBondContact O-N 3.31Å; R277-K279 VanDerWaalsContact O-N 3.1Å; R277-D280 IonicContact CZ-OD2 3.73Å; R277-D280 IonicContact NH1-OD2 3.96Å; R277-D280 PolarHBondContact NH1-OD2 3.49Å; R277-D280 IonicContact NH2-OD2 2.7Å; R277-D280 VanDerWaalsContact O-CB 3.31Å; R277-D280 WeakPolarHBondContact O-CB 3.29Å; R277-D280 PolarHBondContact O-N 3.3Å; R277-V283 HydrophobicContact CB-CG2 4.21Å; R277-V283 WeakPolarHBondContact O-CG2 3.32Å
278	L	93.4	Very high	92.5	Very high	37 Å²	37	62.6 Å²	62.6	19%	0.194	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-63.3	-18.8	178.5	-62.8	177.6	0	0	0	114.2	A73 I76 P77 L275 F276 D280 V283 W284	A73-L278 HydrophobicContact CB-CD2 4.36Å; A73-L278 HydrophobicContact CB-CG 4.29Å; I76-L278 HydrophobicContact CD1-CD1 3.84Å; P77-L278 HydrophobicContact CG-CD2 4.11Å; L275-L278 HydrophobicContact CD2-CD1 3.98Å; L275-L278 WeakPolarHBondContact O-CB 3.46Å; L275-L278 PolarHBondContact O-N 3.4Å; F276-L278 PolarHBondContact O-N 3.42Å; L278-D280 VanDerWaalsContact C-N 3.3Å; L278-V283 HydrophobicContact CD2-CG1 4.22Å; L278-W284 PolarHBondContact O-NE1 3.21Å; L278-W284 VanDerWaalsContact O-NE1 3.07Å
279	K	91.9	Very high	92.2	Very high	166 Å²	166	60.6 Å²	60.6	72%	0.722	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-73.5	-23.7	172.9	-64.3	-178	-180	179.5	0	112.5	F276 R277 P281	F276-K279 WeakPolarHBondContact O-CB 3.33Å; F276-K279 PolarHBondContact O-N 2.99Å; R277-K279 PolarHBondContact O-N 3.31Å; R277-K279 VanDerWaalsContact O-N 3.1Å; K279-P281 WeakPolarHBondContact O-CD 3.25Å
280	D	89.6	Confident	92.3	Very high	58 Å²	58	55.2 Å²	55.2	31%	0.31	27%	0.268	S	S	.	.	S	Bend	trans	-78.5	113.9	176.1	-179	-0.7	0	0	0	108.7	R277 L278 Q282 V283	R277-D280 IonicContact CZ-OD2 3.73Å; R277-D280 IonicContact NH1-OD2 3.96Å; R277-D280 PolarHBondContact NH1-OD2 3.49Å; R277-D280 IonicContact NH2-OD2 2.7Å; R277-D280 VanDerWaalsContact O-CB 3.31Å; R277-D280 WeakPolarHBondContact O-CB 3.29Å; R277-D280 PolarHBondContact O-N 3.3Å; L278-D280 VanDerWaalsContact C-N 3.3Å; D280-Q282 PolarHBondContact O-N 3.31Å; D280-Q282 VanDerWaalsContact OD1-CB 3.23Å; D280-Q282 WeakPolarHBondContact OD1-CB 3.07Å; D280-Q282 PolarHBondContact OD1-N 3.46Å; D280-V283 HydrophobicContact CB-CG2 4.21Å; D280-V283 WeakPolarHBondContact O-CB 3.48Å; D280-V283 WeakPolarHBondContact O-CG2 3.44Å; D280-V283 PolarHBondContact O-N 3.25Å
281	P	86.4	Confident	92.3	Very high	54 Å²	54	55.2 Å²	55.2	35%	0.351	27%	0.268	S	S	.	.	H	α-helix	trans	-73.4	-8.5	-175.8	4.4	11.7	0	0	0	112.6	K279 V283 W284 M285 F515	K279-P281 WeakPolarHBondContact O-CD 3.25Å; P281-V283 PolarHBondContact O-N 3.14Å; P281-W284 PolarHBondContact O-N 2.94Å; P281-M285 PolarHBondContact O-N 2.84Å; P281-F515 HydrophobicContact CB-CD1 3.94Å; P281-F515 HydrophobicContact CB-CD2 4.21Å; P281-F515 HydrophobicContact CB-CE1 3.4Å; P281-F515 HydrophobicContact CB-CE2 3.65Å; P281-F515 HydrophobicContact CB-CG 4.36Å; P281-F515 HydrophobicContact CB-CZ 3.23Å; P281-F515 HydrophobicContact CG-CD2 4.46Å; P281-F515 HydrophobicContact CG-CE1 4.03Å; P281-F515 HydrophobicContact CG-CE2 3.54Å; P281-F515 HydrophobicContact CG-CZ 3.31Å; P281-F515 WeakPolarHBondContact O-CE1 3.49Å
282	Q	88.1	Confident	92.2	Very high	42 Å²	42	52.7 Å²	52.7	20%	0.196	26%	0.255	C	S	.	.	H	α-helix	trans	-58.1	-34.8	165.8	-173.1	68.4	41.4	0	0	112	D280 W284 M285 D286	D280-Q282 PolarHBondContact O-N 3.31Å; D280-Q282 VanDerWaalsContact OD1-CB 3.23Å; D280-Q282 WeakPolarHBondContact OD1-CB 3.07Å; D280-Q282 PolarHBondContact OD1-N 3.46Å; Q282-W284 VanDerWaalsContact C-N 3.26Å; Q282-W284 PolarHBondContact O-N 3.46Å; Q282-M285 VanDerWaalsContact CD-CE 3.43Å; Q282-M285 PolarHBondContact O-N 3.05Å; Q282-D286 PolarHBondContact NE2-OD1 3.49Å; Q282-D286 WeakPolarHBondContact O-CB 3.4Å; Q282-D286 PolarHBondContact O-N 3.44Å
283	V	92	Very high	91.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.8	-40.5	177.6	173.8	0	0	0	0	110.7	N69 F74 P77 R277 L278 D280 P281 A287	N69-V283 HydrophobicContact CB-CB 4.36Å; N69-V283 HydrophobicContact CB-CG1 4.05Å; N69-V283 HydrophobicContact CB-CG2 3.94Å; F74-V283 HydrophobicContact CD2-CG1 4.02Å; P77-V283 HydrophobicContact CG-CG1 3.77Å; R277-V283 HydrophobicContact CB-CG2 4.21Å; R277-V283 WeakPolarHBondContact O-CG2 3.32Å; L278-V283 HydrophobicContact CD2-CG1 4.22Å; D280-V283 HydrophobicContact CB-CG2 4.21Å; D280-V283 WeakPolarHBondContact O-CB 3.48Å; D280-V283 WeakPolarHBondContact O-CG2 3.44Å; D280-V283 PolarHBondContact O-N 3.25Å; P281-V283 PolarHBondContact O-N 3.14Å; V283-A287 WeakPolarHBondContact O-CB 3.47Å; V283-A287 PolarHBondContact O-N 3.03Å
284	W	90.9	Very high	91.8	Very high	74 Å²	74	43.4 Å²	43.4	28%	0.28	21%	0.207	S	C	.	.	H	α-helix	trans	-72.1	-37.8	179.5	-64.7	81.6	0	0	0	111.9	P77 I80 F81 L278 P281 Q282 A287 G288	P77-W284 HydrophobicContact CB-CD2 3.76Å; P77-W284 HydrophobicContact CB-CE3 3.54Å; P77-W284 HydrophobicContact CB-CG 4.34Å; P77-W284 HydrophobicContact CB-CH2 4.22Å; P77-W284 HydrophobicContact CB-CZ2 4.41Å; P77-W284 HydrophobicContact CB-CZ3 3.79Å; I80-W284 HydrophobicContact CD1-CH2 3.64Å; I80-W284 HydrophobicContact CD1-CZ3 3.64Å; F81-W284 HydrophobicContact CE2-CE3 4.33Å; F81-W284 VanDerWaalsContact CE2-O 3.23Å; F81-W284 WeakPolarHBondContact CE2-O 3.45Å; L278-W284 PolarHBondContact O-NE1 3.21Å; L278-W284 VanDerWaalsContact O-NE1 3.07Å; P281-W284 PolarHBondContact O-N 2.94Å; Q282-W284 VanDerWaalsContact C-N 3.26Å; Q282-W284 PolarHBondContact O-N 3.46Å; W284-A287 PolarHBondContact O-N 2.8Å; W284-G288 PolarHBondContact O-N 3.19Å
285	M	87.6	Confident	91.8	Very high	12 Å²	12	40.3 Å²	40.3	6%	0.059	19%	0.19	C	C	.	.	H	α-helix	trans	-63.6	-49	172.4	-63.1	-160.2	-63.7	0	0	112	P281 Q282 A287 G288 T289 T512 F515 S516	P281-M285 PolarHBondContact O-N 2.84Å; Q282-M285 VanDerWaalsContact CD-CE 3.43Å; Q282-M285 PolarHBondContact O-N 3.05Å; M285-A287 VanDerWaalsContact C-N 3.26Å; M285-A287 PolarHBondContact O-N 3.26Å; M285-G288 PolarHBondContact O-N 2.69Å; M285-T289 WeakPolarHBondContact O-CB 3.27Å; M285-T289 VanDerWaalsContact O-CG2 3.25Å; M285-T289 WeakPolarHBondContact O-CG2 3.5Å; M285-T289 PolarHBondContact O-N 3.34Å; M285-T289 PolarHBondContact O-OG1 3.41Å; M285-T512 HydrophobicContact CB-CG2 4.29Å; M285-T512 HydrophobicContact CG-CG2 3.91Å; M285-F515 HydrophobicContact CE-CD1 3.88Å; M285-F515 HydrophobicContact CE-CE1 3.62Å; M285-F515 HydrophobicContact CG-CD1 3.5Å; M285-F515 HydrophobicContact CG-CE1 3.94Å; M285-F515 HydrophobicContact SD-CD1 3.31Å; M285-F515 WeakPolarHBondContact SD-CD1 3.3Å; M285-F515 HydrophobicContact SD-CE1 3.73Å; M285-F515 HydrophobicContact SD-CG 4.36Å; M285-S516 WeakPolarHBondContact SD-CA 3.46Å; M285-S516 WeakPolarHBondContact SD-CB 3.39Å; M285-S516 PolarHBondContact SD-N 3.49Å; M285-S516 VanDerWaalsContact SD-N 3.4Å
286	D	90.5	Very high	91.7	Very high	14 Å²	14	35.1 Å²	35.1	8%	0.075	16%	0.163	C	C	.	.	H	α-helix	trans	-60.2	-39.4	179.2	-75.3	5	0	0	0	110.3	L65 K68 N69 F74 Q282 T289 Q290	L65-D286 HydrophobicContact CD2-CB 4.15Å; K68-D286 IonicContact NZ-OD2 3.47Å; K68-D286 PolarHBondContact NZ-OD2 2.73Å; N69-D286 WeakPolarHBondContact ND2-CB 3.33Å; N69-D286 PolarHBondContact ND2-OD2 3.2Å; F74-D286 HydrophobicContact CE2-CB 4.33Å; Q282-D286 PolarHBondContact NE2-OD1 3.49Å; Q282-D286 WeakPolarHBondContact O-CB 3.4Å; Q282-D286 PolarHBondContact O-N 3.44Å; D286-T289 PolarHBondContact O-OG1 2.95Å; D286-Q290 WeakPolarHBondContact O-CB 3.33Å; D286-Q290 PolarHBondContact O-N 3.02Å
287	A	93.4	Very high	91.7	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.5	-49.2	175.2	0	0	0	0	0	112.9	F74 P77 F81 V283 W284 M285 Q290 I291	F74-A287 HydrophobicContact CD2-CB 4.48Å; F74-A287 HydrophobicContact CE2-CB 3.69Å; F74-A287 HydrophobicContact CZ-CB 3.97Å; P77-A287 HydrophobicContact CB-CB 3.8Å; P77-A287 HydrophobicContact CG-CB 4.17Å; F81-A287 HydrophobicContact CD2-CB 4.18Å; V283-A287 WeakPolarHBondContact O-CB 3.47Å; V283-A287 PolarHBondContact O-N 3.03Å; W284-A287 PolarHBondContact O-N 2.8Å; M285-A287 VanDerWaalsContact C-N 3.26Å; M285-A287 PolarHBondContact O-N 3.26Å; A287-Q290 PolarHBondContact O-N 3.27Å; A287-I291 PolarHBondContact O-N 3Å; A287-I291 VanDerWaalsContact O-N 3.13Å
288	G	91.3	Very high	91.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-63.4	-51.8	179.5	0	0	0	0	0	111.9	F81 W284 M285 Q290 I291 F292	F81-G288 VanDerWaalsContact CD1-CA 3.41Å; F81-G288 VanDerWaalsContact CG-CA 3.5Å; W284-G288 PolarHBondContact O-N 3.19Å; M285-G288 PolarHBondContact O-N 2.69Å; G288-Q290 VanDerWaalsContact C-N 3.26Å; G288-Q290 PolarHBondContact O-N 2.83Å; G288-I291 PolarHBondContact O-N 3.09Å; G288-I291 VanDerWaalsContact O-N 3.09Å; G288-F292 WeakPolarHBondContact O-CD2 3.32Å; G288-F292 PolarHBondContact O-N 3.18Å
289	T	88.8	Confident	91.7	Very high	19 Å²	19	23.2 Å²	23.2	12%	0.117	11%	0.112	C	C	.	.	H	α-helix	trans	-61.1	-35.2	179.1	59.7	0	0	0	0	112.5	M285 D286 F293 L462	M285-T289 WeakPolarHBondContact O-CB 3.27Å; M285-T289 VanDerWaalsContact O-CG2 3.25Å; M285-T289 WeakPolarHBondContact O-CG2 3.5Å; M285-T289 PolarHBondContact O-N 3.34Å; M285-T289 PolarHBondContact O-OG1 3.41Å; D286-T289 PolarHBondContact O-OG1 2.95Å; T289-F293 VanDerWaalsContact O-CB 3.27Å; T289-F293 WeakPolarHBondContact O-CB 3.49Å; T289-F293 PolarHBondContact O-N 3.04Å; T289-L462 HydrophobicContact CG2-CD1 4.09Å
290	Q	93.3	Very high	91.7	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-63.3	-42.7	173.5	179.3	59.3	33.6	0	0	112.5	F62 L65 Y78 D286 A287 G288 S294	F62-Q290 HydrophobicContact CD2-CG 4.04Å; L65-Q290 HydrophobicContact CD1-CB 3.87Å; L65-Q290 HydrophobicContact CD1-CG 4.14Å; Y78-Q290 HydrophobicContact CE2-CG 4.13Å; D286-Q290 WeakPolarHBondContact O-CB 3.33Å; D286-Q290 PolarHBondContact O-N 3.02Å; A287-Q290 PolarHBondContact O-N 3.27Å; G288-Q290 VanDerWaalsContact C-N 3.26Å; G288-Q290 PolarHBondContact O-N 2.83Å; Q290-S294 WeakPolarHBondContact O-CB 3.45Å; Q290-S294 PolarHBondContact O-N 3.49Å
291	I	94.8	Very high	92	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-63.2	-50.3	176.6	-71.6	-69.1	0	0	0	110.5	Y78 F81 F82 A287 G288 F293 S294 F295	Y78-I291 HydrophobicContact CD1-CD1 4.43Å; Y78-I291 HydrophobicContact CD2-CD1 3.84Å; Y78-I291 HydrophobicContact CD2-CG1 4.04Å; Y78-I291 HydrophobicContact CE1-CD1 3.99Å; Y78-I291 HydrophobicContact CE2-CD1 3.32Å; Y78-I291 HydrophobicContact CE2-CG1 3.9Å; Y78-I291 HydrophobicContact CG-CD1 4.37Å; Y78-I291 VanDerWaalsContact CZ-CD1 3.42Å; F81-I291 HydrophobicContact CB-CB 4.29Å; F81-I291 HydrophobicContact CB-CG1 3.85Å; F82-I291 HydrophobicContact CB-CD1 4.04Å; F82-I291 HydrophobicContact CD2-CD1 4.28Å; A287-I291 PolarHBondContact O-N 3Å; A287-I291 VanDerWaalsContact O-N 3.13Å; G288-I291 PolarHBondContact O-N 3.09Å; G288-I291 VanDerWaalsContact O-N 3.09Å; I291-F293 PolarHBondContact O-N 3.24Å; I291-S294 PolarHBondContact O-N 3.47Å; I291-F295 HydrophobicContact CD1-CE1 3.89Å; I291-F295 HydrophobicContact CD1-CZ 4.25Å; I291-F295 HydrophobicContact CG2-CD1 4.38Å; I291-F295 VanDerWaalsContact O-CB 3.25Å; I291-F295 WeakPolarHBondContact O-CB 3.5Å; I291-F295 WeakPolarHBondContact O-CD1 3.45Å; I291-F295 WeakPolarHBondContact O-CG 3.4Å; I291-F295 PolarHBondContact O-N 2.83Å
292	F	93.4	Very high	92.5	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-60	-48.2	-178.2	-87.5	-94.4	0	0	0	112.6	C85 G288 A296 I297 L461 L462 S465 C509	C85-F292 HydrophobicContact CB-CE2 3.73Å; C85-F292 HydrophobicContact CB-CZ 4.02Å; G288-F292 WeakPolarHBondContact O-CD2 3.32Å; G288-F292 PolarHBondContact O-N 3.18Å; F292-A296 PolarHBondContact O-N 2.74Å; F292-I297 HydrophobicContact CD1-CB 3.95Å; F292-I297 HydrophobicContact CD1-CG2 3.58Å; F292-I297 HydrophobicContact CE1-CB 4.36Å; F292-I297 HydrophobicContact CE1-CG2 3.53Å; F292-I297 PolarHBondContact O-N 2.72Å; F292-I297 VanDerWaalsContact O-N 3.12Å; F292-L461 HydrophobicContact CB-CB 4.19Å; F292-L461 HydrophobicContact CB-CD1 4.19Å; F292-L461 HydrophobicContact CD1-CB 4.16Å; F292-L462 HydrophobicContact CD2-CD2 3.87Å; F292-L462 HydrophobicContact CE2-CD2 3.73Å; F292-L462 HydrophobicContact CG-CD2 4.46Å; F292-L462 HydrophobicContact CZ-CD2 4.26Å; F292-S465 VanDerWaalsContact CE1-OG 3.25Å; F292-S465 WeakPolarHBondContact CE1-OG 3.41Å; F292-S465 WeakPolarHBondContact CZ-OG 3.44Å; F292-C509 VanDerWaalsContact CZ-SG 3.5Å
293	F	89.3	Confident	92.9	Very high	34 Å²	34	8 Å²	8	15%	0.149	4%	0.037	C	C	.	.	H	α-helix	trans	-68	-44.5	179.7	-171.9	-93.1	0	0	0	112	T289 I291 F295 A296 L461	T289-F293 VanDerWaalsContact O-CB 3.27Å; T289-F293 WeakPolarHBondContact O-CB 3.49Å; T289-F293 PolarHBondContact O-N 3.04Å; I291-F293 PolarHBondContact O-N 3.24Å; F293-F295 PolarHBondContact O-N 3.46Å; F293-A296 PolarHBondContact O-N 2.7Å; F293-L461 HydrophobicContact CB-CD1 4.49Å
294	S	93.8	Very high	93	Very high	5 Å²	5	8.1 Å²	8.1	4%	0.035	4%	0.037	C	C	.	.	H	α-helix	trans	-69	-22.4	-178.6	-176.3	0	0	0	0	113.4	I53 Q290 I291 N326	I53-S294 CarbonylContact C-O 3.29Å; Q290-S294 WeakPolarHBondContact O-CB 3.45Å; Q290-S294 PolarHBondContact O-N 3.49Å; I291-S294 PolarHBondContact O-N 3.47Å; S294-N326 PolarHBondContact O-ND2 3.1Å; S294-N326 PolarHBondContact OG-ND2 3.46Å; S294-N326 PolarHBondContact OG-OD1 3.48Å
295	F	94.7	Very high	93.3	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	0.5	-178.5	-77	47	0	0	0	111.9	F82 F90 I291 F293 I297 C323 N326	F82-F295 HydrophobicContact CD2-CE2 4.25Å; F82-F295 AromaticContact CD2-CZ 3.61Å; F82-F295 HydrophobicContact CD2-CZ 3.61Å; F82-F295 HydrophobicContact CE2-CE2 4.25Å; F82-F295 AromaticContact CE2-CZ 3.68Å; F82-F295 HydrophobicContact CE2-CZ 3.68Å; F90-F295 HydrophobicContact CB-CD2 4.4Å; F90-F295 HydrophobicContact CD2-CB 4.05Å; F90-F295 AromaticContact CD2-CD2 3.92Å; F90-F295 HydrophobicContact CD2-CD2 3.92Å; F90-F295 HydrophobicContact CD2-CG 4.41Å; F90-F295 HydrophobicContact CG-CD2 4.47Å; I291-F295 HydrophobicContact CD1-CE1 3.89Å; I291-F295 HydrophobicContact CD1-CZ 4.25Å; I291-F295 HydrophobicContact CG2-CD1 4.38Å; I291-F295 VanDerWaalsContact O-CB 3.25Å; I291-F295 WeakPolarHBondContact O-CB 3.5Å; I291-F295 WeakPolarHBondContact O-CD1 3.45Å; I291-F295 WeakPolarHBondContact O-CG 3.4Å; I291-F295 PolarHBondContact O-N 2.83Å; F293-F295 PolarHBondContact O-N 3.46Å; F295-I297 HydrophobicContact CB-CD1 3.5Å; F295-I297 HydrophobicContact CB-CG1 3.63Å; F295-I297 HydrophobicContact CD2-CD1 4.12Å; F295-I297 HydrophobicContact CG-CD1 4.15Å; F295-I297 PolarHBondContact O-N 2.85Å; F295-C323 HydrophobicContact CE2-CB 3.63Å; F295-C323 WeakPolarHBondContact CE2-SG 3.21Å; F295-C323 HydrophobicContact CZ-CB 4.19Å; F295-N326 WeakPolarHBondContact CD1-ND2 3.35Å; F295-N326 HydrophobicContact CE1-CB 4.43Å; F295-N326 WeakPolarHBondContact CE1-ND2 3.5Å
296	A	93.9	Very high	93.7	Very high	2 Å²	2	4.1 Å²	4.1	2%	0.017	2%	0.022	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	33.8	-173.1	0	0	0	0	0	113.6	E52 F292 F293	E52-A296 HydrophobicContact CG-CB 3.82Å; E52-A296 WeakPolarHBondContact OE1-CB 3.44Å; F292-A296 PolarHBondContact O-N 2.74Å; F293-A296 PolarHBondContact O-N 2.7Å
297	I	95	Very high	94	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.02	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	140.7	-177.3	-69	167.3	0	0	0	110.2	V89 F90 F292 F295 Q299 L302	V89-I297 HydrophobicContact CB-CD1 4.37Å; V89-I297 HydrophobicContact CB-CG2 3.91Å; V89-I297 HydrophobicContact CG1-CG2 3.33Å; F90-I297 HydrophobicContact CB-CD1 4.3Å; F90-I297 HydrophobicContact CB-CG1 4.42Å; F292-I297 HydrophobicContact CD1-CB 3.95Å; F292-I297 HydrophobicContact CD1-CG2 3.58Å; F292-I297 HydrophobicContact CE1-CB 4.36Å; F292-I297 HydrophobicContact CE1-CG2 3.53Å; F292-I297 PolarHBondContact O-N 2.72Å; F292-I297 VanDerWaalsContact O-N 3.12Å; F295-I297 HydrophobicContact CB-CD1 3.5Å; F295-I297 HydrophobicContact CB-CG1 3.63Å; F295-I297 HydrophobicContact CD2-CD1 4.12Å; F295-I297 HydrophobicContact CG-CD1 4.15Å; F295-I297 PolarHBondContact O-N 2.85Å; I297-Q299 PolarHBondContact O-N 3.39Å; I297-L302 HydrophobicContact CG1-CD1 4.29Å
298	C	94.1	Very high	94.1	Very high	0 Å²	0	4.1 Å²	4.1	0%	0	2%	0.022	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	8.7	-176.1	-56.5	0	0	0	0	114.9	E93 S122 L461 L464 S465 E468	E93-C298 WeakPolarHBondContact OE1-CA 3.4Å; E93-C298 PolarHBondContact OE1-N 2.86Å; S122-C298 PolarHBondContact OG-O 3.34Å; S122-C298 VanDerWaalsContact OG-O 3.05Å; C298-L461 HydrophobicContact CB-CD2 4.26Å; C298-L464 HydrophobicContact CB-CB 3.96Å; C298-S465 WeakPolarHBondContact SG-CA 3.48Å; C298-S465 VanDerWaalsContact SG-CB 3.59Å; C298-S465 PolarHBondContact SG-N 2.87Å; C298-S465 VanDerWaalsContact SG-N 3.42Å; C298-E468 PolarHBondContact SG-OE2 3Å
299	Q	93.3	Very high	94.3	Very high	7 Å²	7	4.5 Å²	4.5	3%	0.033	2%	0.023	C	C	.	.	S	Bend	trans	-91.2	-15.5	178	-48.2	-177.8	-24.4	0	0	111.5	S122 I125 E126 L129 I297 C301 L461	S122-Q299 WeakPolarHBondContact CB-O 3.39Å; I125-Q299 HydrophobicContact CG2-CG 4.45Å; E126-Q299 WeakPolarHBondContact CG-O 3.49Å; E126-Q299 WeakPolarHBondContact OE1-CB 3.33Å; E126-Q299 VanDerWaalsContact OE1-O 3.12Å; L129-Q299 HydrophobicContact CD1-CG 4.38Å; I297-Q299 PolarHBondContact O-N 3.39Å; Q299-C301 VanDerWaalsContact C-N 3.27Å; Q299-C301 PolarHBondContact O-N 3.06Å; Q299-L461 HydrophobicContact CG-CD2 3.94Å
300	G	92.3	Very high	94.6	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.045	C	C	.	.	S	Bend	trans	86.4	-9.1	177.1	0	0	0	0	0	114.1	L302 T303 A304 C402	G300-L302 PolarHBondContact O-N 2.93Å; G300-T303 PolarHBondContact O-N 3.15Å; G300-A304 PolarHBondContact O-N 3Å; G300-C402 PolarHBondContact O-SG 3.17Å
301	C	94.8	Very high	94.6	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-53.7	-48.7	171.5	-75.4	0	0	0	0	112.1	E52 E126 Q299 T303 A304 L305 V398	E52-C301 HydrophobicContact CG-CB 4.37Å; E52-C301 PolarHBondContact OE1-SG 3.32Å; E52-C301 VanDerWaalsContact OE1-SG 3.39Å; E126-C301 VanDerWaalsContact CD-SG 3.59Å; E126-C301 PolarHBondContact OE1-SG 3.2Å; Q299-C301 VanDerWaalsContact C-N 3.27Å; Q299-C301 PolarHBondContact O-N 3.06Å; C301-T303 VanDerWaalsContact C-N 3.34Å; C301-T303 PolarHBondContact O-N 3.39Å; C301-A304 PolarHBondContact O-N 3.1Å; C301-L305 WeakPolarHBondContact O-CG 3.3Å; C301-L305 PolarHBondContact O-N 3.05Å; C301-V398 HydrophobicContact CB-CG1 3.89Å
302	L	96.9	Very high	94.7	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-65.1	-38.6	-178.4	-60.4	179.8	0	0	0	112.2	V49 I53 F90 E93 V94 I297 G300 G306	V49-L302 HydrophobicContact CG1-CD2 4.12Å; I53-L302 HydrophobicContact CG2-CD2 4.47Å; F90-L302 HydrophobicContact CB-CD1 4.31Å; F90-L302 HydrophobicContact CD1-CD1 4.41Å; F90-L302 HydrophobicContact CD2-CD1 3.34Å; F90-L302 HydrophobicContact CD2-CD2 4.14Å; F90-L302 HydrophobicContact CD2-CG 4.38Å; F90-L302 HydrophobicContact CE1-CD2 4.39Å; F90-L302 HydrophobicContact CE2-CD1 3.62Å; F90-L302 HydrophobicContact CE2-CD2 3.49Å; F90-L302 VanDerWaalsContact CE2-CD2 3.49Å; F90-L302 HydrophobicContact CE2-CG 4.21Å; F90-L302 HydrophobicContact CG-CD1 3.79Å; F90-L302 HydrophobicContact CZ-CD1 4.29Å; F90-L302 HydrophobicContact CZ-CD2 3.66Å; E93-L302 HydrophobicContact CB-CB 3.76Å; E93-L302 HydrophobicContact CB-CD1 4.36Å; V94-L302 HydrophobicContact CG2-CB 3.95Å; V94-L302 HydrophobicContact CG2-CD2 4.41Å; I297-L302 HydrophobicContact CG1-CD1 4.29Å; G300-L302 PolarHBondContact O-N 2.93Å; L302-G306 PolarHBondContact O-N 3.02Å
303	T	96.6	Very high	94.8	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.006	9%	0.091	C	C	.	.	H	α-helix	trans	-63.6	-45.1	173.6	-57.5	0	0	0	0	110.6	E93 L96 G97 A107 G300 C301 S307	E93-T303 WeakPolarHBondContact O-CA 3.38Å; L96-T303 HydrophobicContact CD2-CG2 4.48Å; G97-T303 VanDerWaalsContact CA-O 3.3Å; G97-T303 WeakPolarHBondContact CA-O 3.25Å; A107-T303 HydrophobicContact CB-CG2 4.03Å; G300-T303 PolarHBondContact O-N 3.15Å; C301-T303 VanDerWaalsContact C-N 3.34Å; C301-T303 PolarHBondContact O-N 3.39Å; T303-S307 VanDerWaalsContact O-CB 3.29Å; T303-S307 WeakPolarHBondContact O-CB 3.41Å; T303-S307 PolarHBondContact O-N 2.88Å
304	A	95.3	Very high	95.2	Very high	2 Å²	2	19.8 Å²	19.8	2%	0.017	9%	0.092	C	C	.	.	H	α-helix	trans	-63	-51.2	177.3	0	0	0	0	0	111.9	G300 C301 G306 S307 Y308 C402 T405	G300-A304 PolarHBondContact O-N 3Å; C301-A304 PolarHBondContact O-N 3.1Å; A304-G306 PolarHBondContact O-N 2.64Å; A304-S307 WeakPolarHBondContact O-CB 3.42Å; A304-S307 PolarHBondContact O-N 3.07Å; A304-S307 PolarHBondContact O-OG 3.46Å; A304-Y308 WeakPolarHBondContact O-CD2 3.47Å; A304-C402 HydrophobicContact CB-CB 4.34Å; A304-T405 HydrophobicContact CB-CG2 4.28Å
305	L	95.6	Very high	95.3	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.01	9%	0.09	C	C	.	.	H	α-helix	trans	-63.7	-42.7	180	-65.7	178.4	0	0	0	112.3	W39 F45 V49 C301 S307 Y308 V398	W39-L305 HydrophobicContact CH2-CD2 4.01Å; W39-L305 HydrophobicContact CZ2-CB 4.49Å; W39-L305 HydrophobicContact CZ2-CD2 3.67Å; W39-L305 PolarHBondContact NE1-O 3.46Å; F45-L305 HydrophobicContact CE2-CB 4.32Å; V49-L305 HydrophobicContact CB-CD1 4.4Å; V49-L305 HydrophobicContact CG2-CB 4.18Å; V49-L305 HydrophobicContact CG2-CD1 3.71Å; C301-L305 WeakPolarHBondContact O-CG 3.3Å; C301-L305 PolarHBondContact O-N 3.05Å; L305-S307 PolarHBondContact O-N 3.16Å; L305-Y308 PolarHBondContact O-N 2.98Å; L305-V398 HydrophobicContact CD1-CG1 3.76Å; L305-V398 HydrophobicContact CD1-CG2 4.28Å; L305-V398 HydrophobicContact CD2-CG1 4.26Å; L305-V398 HydrophobicContact CD2-CG2 4.32Å; L305-V398 HydrophobicContact CG-CG1 4.12Å
306	G	96.6	Very high	95.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62.5	-31.6	176.9	0	0	0	0	0	112.5	Q98 L302 A304 Y308 N309	Q98-G306 VanDerWaalsContact CA-O 3.28Å; Q98-G306 WeakPolarHBondContact CA-O 3.3Å; Q98-G306 PolarHBondContact N-O 3.25Å; L302-G306 PolarHBondContact O-N 3.02Å; A304-G306 PolarHBondContact O-N 2.64Å; G306-Y308 PolarHBondContact O-N 3.04Å; G306-N309 WeakPolarHBondContact O-CB 3.35Å; G306-N309 PolarHBondContact O-N 3.06Å
307	S	96.6	Very high	95.6	Very high	4 Å²	4	27.5 Å²	27.5	3%	0.028	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-15.1	-179.1	78.2	0	0	0	0	115.7	R36 G97 Q102 T303 A304 L305 N309	R36-S307 VanDerWaalsContact NH1-C 3.33Å; R36-S307 PolarHBondContact NH1-O 3.48Å; R36-S307 PolarHBondContact NH1-OG 2.87Å; R36-S307 PolarHBondContact NH2-OG 2.87Å; G97-S307 VanDerWaalsContact C-CA 3.46Å; G97-S307 WeakPolarHBondContact O-CA 3.3Å; G97-S307 VanDerWaalsContact O-CB 3.31Å; G97-S307 WeakPolarHBondContact O-CB 3.28Å; Q102-S307 WeakPolarHBondContact O-CB 3.48Å; T303-S307 VanDerWaalsContact O-CB 3.29Å; T303-S307 WeakPolarHBondContact O-CB 3.41Å; T303-S307 PolarHBondContact O-N 2.88Å; A304-S307 WeakPolarHBondContact O-CB 3.42Å; A304-S307 PolarHBondContact O-N 3.07Å; A304-S307 PolarHBondContact O-OG 3.46Å; L305-S307 PolarHBondContact O-N 3.16Å; S307-N309 VanDerWaalsContact C-N 3.34Å
308	Y	95.2	Very high	95.7	Very high	11 Å²	11	28 Å²	28	4%	0.043	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-1.9	172.8	-67.4	-74.4	0	0	0	112.6	R36 Q38 W39 V232 A304 L305 G306 T405	R36-Y308 HydrophobicContact CG-CE1 3.96Å; R36-Y308 WeakPolarHBondContact O-CE1 3.3Å; Q38-Y308 WeakPolarHBondContact CA-O 3.38Å; W39-Y308 VanDerWaalsContact CD1-C 3.45Å; W39-Y308 VanDerWaalsContact CD1-O 3.32Å; W39-Y308 PolarHBondContact N-O 2.73Å; V232-Y308 HydrophobicContact CG1-CD1 4.07Å; V232-Y308 HydrophobicContact CG1-CD2 3.63Å; V232-Y308 HydrophobicContact CG1-CE1 4.18Å; V232-Y308 HydrophobicContact CG1-CE2 3.76Å; V232-Y308 HydrophobicContact CG1-CG 3.8Å; V232-Y308 HydrophobicContact CG2-CD1 4.17Å; V232-Y308 HydrophobicContact CG2-CE1 4.45Å; A304-Y308 WeakPolarHBondContact O-CD2 3.47Å; L305-Y308 PolarHBondContact O-N 2.98Å; G306-Y308 PolarHBondContact O-N 3.04Å; Y308-T405 HydrophobicContact CE2-CG2 4.1Å; Y308-T405 PolarHBondContact OH-OG1 3.13Å
309	N	96.4	Very high	95.9	Very high	7 Å²	7	28 Å²	28	4%	0.037	13%	0.126	C	C	.	.	S	Bend	trans	-71.6	156.7	174.5	-73.1	-20.3	0	0	0	111.7	F45 Q98 G306 S307 N313	F45-N309 VanDerWaalsContact CD2-OD1 3.24Å; F45-N309 WeakPolarHBondContact CD2-OD1 3.46Å; F45-N309 WeakPolarHBondContact CE2-ND2 3.28Å; F45-N309 VanDerWaalsContact CG-OD1 3.22Å; F45-N309 WeakPolarHBondContact CG-OD1 3.33Å; F45-N309 VanDerWaalsContact CZ-ND2 3.27Å; F45-N309 WeakPolarHBondContact CZ-ND2 3.49Å; Q98-N309 HydrophobicContact CB-CB 4.44Å; Q98-N309 HydrophobicContact CG-CB 3.94Å; Q98-N309 PolarHBondContact OE1-ND2 3.1Å; G306-N309 WeakPolarHBondContact O-CB 3.35Å; G306-N309 PolarHBondContact O-N 3.06Å; S307-N309 VanDerWaalsContact C-N 3.34Å; N309-N313 HydrophobicContact CB-CB 4.31Å
310	K	94.7	Very high	96.1	Very high	129 Å²	129	29.4 Å²	29.4	56%	0.561	14%	0.135	S	C	*	.			trans	-68	143.1	165.3	-63.1	179.5	-178.8	-179.7	0	109	H312 N313	K310-H312 PolarHBondContact O-N 2.98Å; K310-H312 VanDerWaalsContact O-N 3.16Å; K310-N313 VanDerWaalsContact O-CB 3.31Å; K310-N313 WeakPolarHBondContact O-CB 3.15Å; K310-N313 PolarHBondContact O-N 2.62Å
311	Y	94.1	Very high	96.4	Very high	50 Å²	50	32.2 Å²	32.2	20%	0.196	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-40.4	-177.4	-172.9	-98.8	0	0	0	113.3	Q98 Y99 N313 D487 M488 P580	Q98-Y311 PolarHBondContact NE2-O 2.91Å; Y99-Y311 HydrophobicContact CD2-CE2 4.07Å; Y311-N313 PolarHBondContact O-N 3.24Å; Y311-D487 VanDerWaalsContact CE1-OD2 3.29Å; Y311-D487 WeakPolarHBondContact CE1-OD2 3.36Å; Y311-D487 PolarHBondContact OH-OD2 3.21Å; Y311-M488 HydrophobicContact CD1-CG 4.31Å; Y311-M488 HydrophobicContact CD2-CG 4.19Å; Y311-M488 HydrophobicContact CE1-CG 3.89Å; Y311-M488 HydrophobicContact CE2-CG 3.76Å; Y311-M488 HydrophobicContact CE2-SD 4.38Å; Y311-M488 HydrophobicContact CG-CG 4.45Å; Y311-P580 HydrophobicContact CE2-CB 4Å; Y311-P580 HydrophobicContact CE2-CG 3.83Å
312	H	95.5	Very high	96.5	Very high	137 Å²	137	32.4 Å²	32.4	63%	0.634	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91	16	178.9	-64.7	-59.1	0	0	0	115.2	K310 D487 M488	K310-H312 PolarHBondContact O-N 2.98Å; K310-H312 VanDerWaalsContact O-N 3.16Å; H312-D487 PolarHBondContact CE1-O 2.83Å; H312-M488 VanDerWaalsContact CA-O 3.3Å; H312-M488 WeakPolarHBondContact CA-O 3.42Å; H312-M488 PolarHBondContact ND1-O 3.49Å
313	N	96.2	Very high	96.6	Very high	26 Å²	26	32.4 Å²	32.4	14%	0.139	16%	0.16	C	C	.	.			trans	-67.9	139.5	172.3	-179.1	59.4	0	0	0	110.2	Q98 N309 K310 Y311 C315 D318	Q98-N313 PolarHBondContact NE2-O 3.21Å; N309-N313 HydrophobicContact CB-CB 4.31Å; K310-N313 VanDerWaalsContact O-CB 3.31Å; K310-N313 WeakPolarHBondContact O-CB 3.15Å; K310-N313 PolarHBondContact O-N 2.62Å; Y311-N313 PolarHBondContact O-N 3.24Å; N313-C315 PolarHBondContact O-N 3.48Å; N313-D318 PolarHBondContact ND2-OD2 3.41Å
314	N	97.1	Very high	96.6	Very high	33 Å²	33	37.3 Å²	37.3	18%	0.176	18%	0.181	C	C	.	.			trans	-79.3	73	178.9	-168.2	-20.8	0	0	0	111.2	Y316 K317 D318 Y491	N314-Y316 PolarHBondContact O-N 2.86Å; N314-K317 PolarHBondContact O-N 3.33Å; N314-K317 PolarHBondContact OD1-N 3.38Å; N314-D318 VanDerWaalsContact O-CG 3.28Å; N314-D318 PolarHBondContact O-N 3.27Å; N314-Y491 VanDerWaalsContact CG-OH 3.31Å; N314-Y491 WeakPolarHBondContact ND2-CE1 3.37Å; N314-Y491 PolarHBondContact ND2-OH 3.29Å; N314-Y491 VanDerWaalsContact ND2-OH 3.09Å; N314-Y491 PolarHBondContact OD1-OH 3.12Å
315	C	96.8	Very high	96.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.3	-28.5	-177.8	55.4	0	0	0	0	113.1	V94 N313 D318 C319	V94-C315 HydrophobicContact CG1-CB 3.94Å; N313-C315 PolarHBondContact O-N 3.48Å; C315-D318 PolarHBondContact O-N 3.44Å; C315-C319 WeakPolarHBondContact O-CB 3.32Å; C315-C319 PolarHBondContact O-N 3.49Å; C315-C319 PolarHBondContact O-SG 3.03Å
316	Y	97.6	Very high	96.8	Very high	36 Å²	36	40.2 Å²	40.2	14%	0.141	20%	0.196	C	C	.	.	H	α-helix	trans	-62.1	-50.4	178.5	178.4	-112.5	0	0	0	112.3	F91 N314 D318 C319 V320 Y491 P493 W494 V497	F91-Y316 HydrophobicContact CD1-CD2 4.03Å; F91-Y316 HydrophobicContact CD2-CD2 4.1Å; F91-Y316 AromaticContact CE1-CD2 3.88Å; F91-Y316 HydrophobicContact CE1-CD2 3.88Å; F91-Y316 VanDerWaalsContact CE2-CA 3.45Å; F91-Y316 AromaticContact CE2-CD2 3.97Å; F91-Y316 HydrophobicContact CE2-CD2 3.97Å; F91-Y316 HydrophobicContact CE2-CG 4.31Å; F91-Y316 HydrophobicContact CG-CD2 4.13Å; F91-Y316 AromaticContact CZ-CD2 3.86Å; F91-Y316 HydrophobicContact CZ-CD2 3.86Å; F91-Y316 HydrophobicContact CZ-CG 4.3Å; N314-Y316 PolarHBondContact O-N 2.86Å; Y316-D318 VanDerWaalsContact C-N 3.29Å; Y316-D318 PolarHBondContact O-N 3.37Å; Y316-C319 PolarHBondContact O-N 2.95Å; Y316-V320 HydrophobicContact CD2-CG2 4.39Å; Y316-V320 HydrophobicContact CE1-CG2 4.5Å; Y316-V320 HydrophobicContact CE2-CG2 3.97Å; Y316-V320 WeakPolarHBondContact O-CG2 3.27Å; Y316-V320 PolarHBondContact O-N 3.39Å; Y316-V320 VanDerWaalsContact O-N 3.08Å; Y316-Y491 HydrophobicContact CD1-CE2 4.01Å; Y316-P493 HydrophobicContact CD2-CB 3.95Å; Y316-P493 HydrophobicContact CD2-CG 4.37Å; Y316-P493 HydrophobicContact CE2-CB 3.87Å; Y316-P493 HydrophobicContact CG-CB 4.35Å; Y316-W494 WeakPolarHBondContact OH-CB 3.37Å; Y316-V497 HydrophobicContact CE2-CG2 4.17Å
317	K	96.7	Very high	96.8	Very high	132 Å²	132	40.8 Å²	40.8	57%	0.574	20%	0.2	S	C	*	.	H	α-helix	trans	-62.4	-39.7	177.2	-74.4	-172.3	-179.9	-179.1	0	111.7	N314 A321	N314-K317 PolarHBondContact O-N 3.33Å; N314-K317 PolarHBondContact OD1-N 3.38Å; K317-A321 WeakPolarHBondContact O-CB 3.49Å; K317-A321 PolarHBondContact O-N 2.9Å
318	D	97.3	Very high	96.8	Very high	11 Å²	11	43 Å²	43	6%	0.059	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-47.9	179.9	-60.4	-17	0	0	0	110.6	K42 F45 N313 N314 C315 Y316 V320 A321 L322	K42-D318 WeakPolarHBondContact CE-OD1 3.45Å; K42-D318 WeakPolarHBondContact CE-OD2 3.26Å; K42-D318 IonicContact NZ-OD1 3.04Å; K42-D318 PolarHBondContact NZ-OD1 3.06Å; K42-D318 IonicContact NZ-OD2 2.66Å; K42-D318 PolarHBondContact NZ-OD2 3.03Å; F45-D318 HydrophobicContact CE1-CB 4.12Å; N313-D318 PolarHBondContact ND2-OD2 3.41Å; N314-D318 VanDerWaalsContact O-CG 3.28Å; N314-D318 PolarHBondContact O-N 3.27Å; C315-D318 PolarHBondContact O-N 3.44Å; Y316-D318 VanDerWaalsContact C-N 3.29Å; Y316-D318 PolarHBondContact O-N 3.37Å; D318-V320 PolarHBondContact O-N 2.91Å; D318-A321 PolarHBondContact O-N 3.3Å; D318-L322 WeakPolarHBondContact O-CB 3.26Å; D318-L322 WeakPolarHBondContact O-CD1 3.36Å; D318-L322 VanDerWaalsContact O-CG 3.24Å; D318-L322 WeakPolarHBondContact O-CG 3.49Å; D318-L322 PolarHBondContact O-N 3.17Å
319	C	97.9	Very high	96.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.3	-46.9	178.6	-69	0	0	0	0	112.2	F90 F91 V94 C315 Y316 L322 C323	F90-C319 HydrophobicContact CD1-CB 3.72Å; F90-C319 HydrophobicContact CE1-CB 3.98Å; F91-C319 HydrophobicContact CB-CB 4.11Å; F91-C319 HydrophobicContact CD2-CB 4.18Å; V94-C319 VanDerWaalsContact CB-SG 3.59Å; C315-C319 WeakPolarHBondContact O-CB 3.32Å; C315-C319 PolarHBondContact O-N 3.49Å; C315-C319 PolarHBondContact O-SG 3.03Å; Y316-C319 PolarHBondContact O-N 2.95Å; C319-L322 PolarHBondContact O-N 3.47Å; C319-C323 WeakPolarHBondContact O-CB 3.47Å; C319-C323 PolarHBondContact O-N 3.29Å; C319-C323 PolarHBondContact O-SG 3.13Å
320	V	97.8	Very high	96.8	Very high	36 Å²	36	42.6 Å²	42.6	22%	0.218	22%	0.217	C	C	.	.	H	α-helix	trans	-60.8	-48.6	178.3	173.6	0	0	0	0	110.4	I87 Y316 D318 L322 C323 F324	I87-V320 HydrophobicContact CG2-CG2 4.21Å; Y316-V320 HydrophobicContact CD2-CG2 4.39Å; Y316-V320 HydrophobicContact CE1-CG2 4.5Å; Y316-V320 HydrophobicContact CE2-CG2 3.97Å; Y316-V320 WeakPolarHBondContact O-CG2 3.27Å; Y316-V320 PolarHBondContact O-N 3.39Å; Y316-V320 VanDerWaalsContact O-N 3.08Å; D318-V320 PolarHBondContact O-N 2.91Å; V320-L322 VanDerWaalsContact C-N 3.35Å; V320-L322 PolarHBondContact O-N 2.95Å; V320-C323 PolarHBondContact O-N 2.88Å; V320-F324 HydrophobicContact CG1-CD2 3.84Å; V320-F324 HydrophobicContact CG1-CE2 3.86Å; V320-F324 VanDerWaalsContact O-CD2 3.29Å; V320-F324 WeakPolarHBondContact O-CD2 3.36Å; V320-F324 PolarHBondContact O-N 3.42Å; V320-F324 VanDerWaalsContact O-N 3.11Å
321	A	98	Very high	96.9	Very high	60 Å²	60	40.1 Å²	40.1	50%	0.496	21%	0.207	S	C	.	.	H	α-helix	trans	-60.6	-43.5	179.5	0	0	0	0	0	112.3	K317 D318 F324 L325	K317-A321 WeakPolarHBondContact O-CB 3.49Å; K317-A321 PolarHBondContact O-N 2.9Å; D318-A321 PolarHBondContact O-N 3.3Å; A321-F324 PolarHBondContact O-N 3.22Å; A321-L325 WeakPolarHBondContact O-CB 3.35Å; A321-L325 PolarHBondContact O-N 2.79Å
322	L	98	Very high	96.9	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-65.6	-41.3	178.6	-75.4	163.8	0	0	0	112.6	V46 V49 A50 I53 F90 D318 C319 V320 L325 N326	V46-L322 HydrophobicContact CG1-CD2 4.05Å; V49-L322 HydrophobicContact CB-CD1 3.89Å; V49-L322 HydrophobicContact CB-CD2 4.45Å; V49-L322 HydrophobicContact CG1-CD1 3.68Å; V49-L322 HydrophobicContact CG1-CD2 4.44Å; A50-L322 HydrophobicContact CB-CD2 3.95Å; I53-L322 HydrophobicContact CD1-CB 3.99Å; I53-L322 HydrophobicContact CD1-CD2 4.35Å; F90-L322 HydrophobicContact CE1-CB 4.47Å; F90-L322 HydrophobicContact CZ-CB 4.34Å; D318-L322 WeakPolarHBondContact O-CB 3.26Å; D318-L322 WeakPolarHBondContact O-CD1 3.36Å; D318-L322 VanDerWaalsContact O-CG 3.24Å; D318-L322 WeakPolarHBondContact O-CG 3.49Å; D318-L322 PolarHBondContact O-N 3.17Å; C319-L322 PolarHBondContact O-N 3.47Å; V320-L322 VanDerWaalsContact C-N 3.35Å; V320-L322 PolarHBondContact O-N 2.95Å; L322-L325 PolarHBondContact O-N 3.28Å; L322-N326 WeakPolarHBondContact O-CB 3.44Å; L322-N326 PolarHBondContact O-N 2.72Å
323	C	97.9	Very high	96.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61	-46.7	175.7	-69.2	0	0	0	0	111.4	F82 I87 F295 C319 V320 N326 S327	F82-C323 HydrophobicContact CE2-CB 4.1Å; F82-C323 WeakPolarHBondContact CE2-O 3.33Å; F82-C323 HydrophobicContact CZ-CB 4.23Å; I87-C323 HydrophobicContact CD1-CB 4.47Å; I87-C323 HydrophobicContact CG1-CB 3.66Å; F295-C323 HydrophobicContact CE2-CB 3.63Å; F295-C323 WeakPolarHBondContact CE2-SG 3.21Å; F295-C323 HydrophobicContact CZ-CB 4.19Å; C319-C323 WeakPolarHBondContact O-CB 3.47Å; C319-C323 PolarHBondContact O-N 3.29Å; C319-C323 PolarHBondContact O-SG 3.13Å; V320-C323 PolarHBondContact O-N 2.88Å; C323-N326 PolarHBondContact O-N 2.93Å; C323-S327 PolarHBondContact O-N 3.08Å
324	F	98.1	Very high	96.8	Very high	104 Å²	104	32.6 Å²	32.6	46%	0.456	18%	0.176	S	C	.	.	H	α-helix	trans	-64.4	-41.6	176.1	-85.7	-76.1	0	0	0	112.2	F82 F83 I87 V320 A321 N326 S327 A328	F82-F324 HydrophobicContact CE1-CD1 4.32Å; F82-F324 AromaticContact CE1-CE1 3.93Å; F82-F324 HydrophobicContact CE1-CE1 3.93Å; F82-F324 HydrophobicContact CE1-CE2 4.3Å; F82-F324 AromaticContact CE1-CZ 3.91Å; F82-F324 HydrophobicContact CE1-CZ 3.91Å; F82-F324 AromaticContact CZ-CD1 3.95Å; F82-F324 HydrophobicContact CZ-CD1 3.95Å; F82-F324 HydrophobicContact CZ-CD2 4.26Å; F82-F324 HydrophobicContact CZ-CE1 4.03Å; F82-F324 HydrophobicContact CZ-CE2 4.32Å; F82-F324 HydrophobicContact CZ-CG 4.06Å; F82-F324 HydrophobicContact CZ-CZ 4.21Å; F83-F324 AromaticContact CE1-CZ 4Å; F83-F324 HydrophobicContact CE1-CZ 4Å; F83-F324 HydrophobicContact CZ-CZ 4.21Å; I87-F324 HydrophobicContact CD1-CE2 4.28Å; V320-F324 HydrophobicContact CG1-CD2 3.84Å; V320-F324 HydrophobicContact CG1-CE2 3.86Å; V320-F324 VanDerWaalsContact O-CD2 3.29Å; V320-F324 WeakPolarHBondContact O-CD2 3.36Å; V320-F324 PolarHBondContact O-N 3.42Å; V320-F324 VanDerWaalsContact O-N 3.11Å; A321-F324 PolarHBondContact O-N 3.22Å; F324-N326 VanDerWaalsContact C-N 3.32Å; F324-N326 PolarHBondContact O-N 2.92Å; F324-S327 PolarHBondContact O-N 3.28Å; F324-A328 WeakPolarHBondContact O-CB 3.46Å; F324-A328 PolarHBondContact O-N 3.44Å
325	L	97.1	Very high	96.8	Very high	66 Å²	66	33.2 Å²	33.2	35%	0.346	18%	0.178	S	C	.	.	H	α-helix	trans	-58.4	-46.6	175.9	-179.5	64.4	0	0	0	110.7	A50 I54 Y247 A321 L322 A328 T329	A50-L325 HydrophobicContact CB-CD2 4.31Å; I54-L325 HydrophobicContact CD1-CD2 4.15Å; I54-L325 HydrophobicContact CD1-CG 3.89Å; Y247-L325 HydrophobicContact CE1-CD1 4.15Å; Y247-L325 WeakPolarHBondContact OH-CD1 3.26Å; Y247-L325 WeakPolarHBondContact OH-CD2 3.38Å; Y247-L325 WeakPolarHBondContact OH-CG 3.32Å; A321-L325 WeakPolarHBondContact O-CB 3.35Å; A321-L325 PolarHBondContact O-N 2.79Å; L322-L325 PolarHBondContact O-N 3.28Å; L325-A328 PolarHBondContact O-N 3.49Å; L325-T329 WeakPolarHBondContact O-CB 3.19Å; L325-T329 PolarHBondContact O-N 3.16Å; L325-T329 PolarHBondContact O-OG1 3.35Å
326	N	97.1	Very high	96.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-56.7	-55.3	178.6	-176.2	39.5	0	0	0	112.6	I53 I54 N58 S294 F295 L322 C323 F324 A328 T329 S330	I53-N326 HydrophobicContact CD1-CB 3.87Å; I53-N326 HydrophobicContact CG1-CB 4.03Å; I53-N326 PolarHBondContact O-OD1 3.3Å; I54-N326 HydrophobicContact CG1-CB 4.41Å; N58-N326 PolarHBondContact ND2-OD1 2.99Å; S294-N326 PolarHBondContact O-ND2 3.1Å; S294-N326 PolarHBondContact OG-ND2 3.46Å; S294-N326 PolarHBondContact OG-OD1 3.48Å; F295-N326 WeakPolarHBondContact CD1-ND2 3.35Å; F295-N326 HydrophobicContact CE1-CB 4.43Å; F295-N326 WeakPolarHBondContact CE1-ND2 3.5Å; L322-N326 WeakPolarHBondContact O-CB 3.44Å; L322-N326 PolarHBondContact O-N 2.72Å; C323-N326 PolarHBondContact O-N 2.93Å; F324-N326 VanDerWaalsContact C-N 3.32Å; F324-N326 PolarHBondContact O-N 2.92Å; N326-A328 PolarHBondContact O-N 2.95Å; N326-T329 PolarHBondContact O-N 3.48Å; N326-S330 PolarHBondContact O-N 3.15Å; N326-S330 PolarHBondContact O-OG 3.25Å
327	S	96.8	Very high	96.4	Very high	11 Å²	11	31.7 Å²	31.7	8%	0.077	17%	0.172	C	C	.	.	H	α-helix	trans	-65.8	-35.6	179.9	-67.2	0	0	0	0	113	Y78 F82 C323 F324 S330 F331	Y78-S327 WeakPolarHBondContact OH-CB 3.21Å; Y78-S327 PolarHBondContact OH-OG 3.43Å; F82-S327 VanDerWaalsContact CD2-OG 3.3Å; F82-S327 WeakPolarHBondContact CD2-OG 3.36Å; F82-S327 VanDerWaalsContact CE2-OG 3.22Å; F82-S327 WeakPolarHBondContact CE2-OG 3.2Å; C323-S327 PolarHBondContact O-N 3.08Å; F324-S327 PolarHBondContact O-N 3.28Å; S327-S330 PolarHBondContact O-N 3.21Å; S327-F331 WeakPolarHBondContact O-CB 3.25Å; S327-F331 PolarHBondContact O-N 2.85Å
328	A	96.4	Very high	96.3	Very high	51 Å²	51	25.5 Å²	25.5	42%	0.421	15%	0.145	S	C	.	.	H	α-helix	trans	-64.6	-42.2	174.8	0	0	0	0	0	111.3	F324 L325 N326 F331 V332	F324-A328 WeakPolarHBondContact O-CB 3.46Å; F324-A328 PolarHBondContact O-N 3.44Å; L325-A328 PolarHBondContact O-N 3.49Å; N326-A328 PolarHBondContact O-N 2.95Å; A328-F331 WeakPolarHBondContact O-CB 3.39Å; A328-F331 PolarHBondContact O-N 3.03Å; A328-V332 WeakPolarHBondContact O-CG2 3.29Å; A328-V332 PolarHBondContact O-N 3.21Å
329	T	95.7	Very high	96.2	Very high	9 Å²	9	25 Å²	25	6%	0.055	14%	0.142	C	C	.	.	H	α-helix	trans	-63.1	-43.7	175.9	-58.7	0	0	0	0	111.4	I54 Y247 L250 L325 N326 F331 V332 A333	I54-T329 HydrophobicContact CG2-CG2 3.6Å; Y247-T329 HydrophobicContact CE1-CG2 4.19Å; Y247-T329 VanDerWaalsContact CE1-OG1 3.3Å; Y247-T329 WeakPolarHBondContact CE1-OG1 3.14Å; Y247-T329 PolarHBondContact OH-OG1 2.93Å; L250-T329 HydrophobicContact CD1-CG2 3.77Å; L325-T329 WeakPolarHBondContact O-CB 3.19Å; L325-T329 PolarHBondContact O-N 3.16Å; L325-T329 PolarHBondContact O-OG1 3.35Å; N326-T329 PolarHBondContact O-N 3.48Å; T329-F331 VanDerWaalsContact C-N 3.31Å; T329-F331 PolarHBondContact O-N 3.34Å; T329-V332 PolarHBondContact O-N 2.96Å; T329-A333 VanDerWaalsContact O-CB 3.28Å; T329-A333 WeakPolarHBondContact O-CB 3.42Å; T329-A333 PolarHBondContact O-N 3.03Å
330	S	96	Very high	95.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58.7	-42.4	173.8	-59.6	0	0	0	0	112.6	N58 F62 N326 S327 G334	N58-S330 PolarHBondContact ND2-OG 3.2Å; F62-S330 VanDerWaalsContact CD1-CB 3.46Å; F62-S330 VanDerWaalsContact CD1-O 3.26Å; F62-S330 WeakPolarHBondContact CD1-O 3.3Å; N326-S330 PolarHBondContact O-N 3.15Å; N326-S330 PolarHBondContact O-OG 3.25Å; S327-S330 PolarHBondContact O-N 3.21Å; S330-G334 PolarHBondContact O-N 3.39Å
331	F	96.1	Very high	95.5	Very high	78 Å²	78	23.9 Å²	23.9	34%	0.342	14%	0.135	S	C	.	.	H	α-helix	trans	-62.2	-48.9	177.3	-178.5	-115.6	0	0	0	111.9	F75 Y270 L271 S327 A328 T329 G334 F335	F75-F331 AromaticContact CE1-CD2 3.74Å; F75-F331 HydrophobicContact CE1-CD2 3.74Å; F75-F331 HydrophobicContact CE1-CE2 4.18Å; F75-F331 HydrophobicContact CE2-CE2 4.38Å; F75-F331 AromaticContact CZ-CD2 3.51Å; F75-F331 HydrophobicContact CZ-CD2 3.51Å; F75-F331 AromaticContact CZ-CE2 3.72Å; F75-F331 HydrophobicContact CZ-CE2 3.72Å; Y270-F331 HydrophobicContact CE1-CD2 4.46Å; Y270-F331 HydrophobicContact CE1-CE2 4.47Å; Y270-F331 PolarHBondContact OH-O 3.28Å; L271-F331 HydrophobicContact CD2-CE2 4.02Å; S327-F331 WeakPolarHBondContact O-CB 3.25Å; S327-F331 PolarHBondContact O-N 2.85Å; A328-F331 WeakPolarHBondContact O-CB 3.39Å; A328-F331 PolarHBondContact O-N 3.03Å; T329-F331 VanDerWaalsContact C-N 3.31Å; T329-F331 PolarHBondContact O-N 3.34Å; F331-G334 PolarHBondContact O-N 2.81Å; F331-G334 VanDerWaalsContact O-N 3.14Å; F331-F335 HydrophobicContact CD1-CE2 4.01Å; F331-F335 HydrophobicContact CD2-CE2 4.32Å; F331-F335 AromaticContact CE1-CE2 3.53Å; F331-F335 HydrophobicContact CE1-CE2 3.53Å; F331-F335 HydrophobicContact CE1-CZ 4.22Å; F331-F335 AromaticContact CE2-CE2 3.87Å; F331-F335 HydrophobicContact CE2-CE2 3.87Å; F331-F335 HydrophobicContact CE2-CZ 4.45Å; F331-F335 HydrophobicContact CG-CE2 4.4Å; F331-F335 AromaticContact CZ-CE2 3.46Å; F331-F335 HydrophobicContact CZ-CE2 3.46Å; F331-F335 VanDerWaalsContact CZ-CE2 3.46Å; F331-F335 AromaticContact CZ-CZ 3.88Å; F331-F335 HydrophobicContact CZ-CZ 3.88Å; F331-F335 WeakPolarHBondContact O-CD2 3.09Å; F331-F335 PolarHBondContact O-N 3.44Å
332	V	95.9	Very high	95.3	Very high	54 Å²	54	21 Å²	21	33%	0.327	11%	0.112	S	C	.	.	H	α-helix	trans	-63.8	-43.2	177.9	173.2	0	0	0	0	111.4	L254 A328 T329 G334 F335 V336	L254-V332 HydrophobicContact CD2-CG1 4.13Å; A328-V332 WeakPolarHBondContact O-CG2 3.29Å; A328-V332 PolarHBondContact O-N 3.21Å; T329-V332 PolarHBondContact O-N 2.96Å; V332-G334 PolarHBondContact O-N 3.05Å; V332-F335 WeakPolarHBondContact O-CB 3.46Å; V332-F335 PolarHBondContact O-N 3.24Å; V332-V336 PolarHBondContact O-N 3.17Å
333	A	94.4	Very high	94.9	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60	-31.1	175.4	0	0	0	0	0	112	V59 L250 T329 F335 V336 V337	V59-A333 HydrophobicContact CG2-CB 4.26Å; L250-A333 HydrophobicContact CD2-CB 4.17Å; T329-A333 VanDerWaalsContact O-CB 3.28Å; T329-A333 WeakPolarHBondContact O-CB 3.42Å; T329-A333 PolarHBondContact O-N 3.03Å; A333-F335 PolarHBondContact O-N 3.07Å; A333-V336 WeakPolarHBondContact O-CB 3.44Å; A333-V336 PolarHBondContact O-N 3.2Å; A333-V337 VanDerWaalsContact O-CG2 3.26Å; A333-V337 WeakPolarHBondContact O-CG2 3.44Å; A333-V337 PolarHBondContact O-N 2.71Å
334	G	95.1	Very high	94.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-59.3	-42.5	171.5	0	0	0	0	0	113.9	S330 F331 V332 F338	S330-G334 PolarHBondContact O-N 3.39Å; F331-G334 PolarHBondContact O-N 2.81Å; F331-G334 VanDerWaalsContact O-N 3.14Å; V332-G334 PolarHBondContact O-N 3.05Å; G334-F338 WeakPolarHBondContact O-CB 3.36Å; G334-F338 PolarHBondContact O-N 2.93Å
335	F	95.9	Very high	93.9	Very high	47 Å²	47	17.5 Å²	17.5	21%	0.206	10%	0.099	C	C	.	.	H	α-helix	trans	-63.9	-42.1	173	-73.5	-91.3	0	0	0	112	L254 I267 Y270 L271 F331 V332 A333 S339	L254-F335 HydrophobicContact CD1-CB 3.54Å; I267-F335 HydrophobicContact CD1-CD1 4.14Å; I267-F335 HydrophobicContact CG1-CD1 4.12Å; I267-F335 HydrophobicContact CG2-CD1 4.14Å; I267-F335 HydrophobicContact CG2-CE1 3.87Å; Y270-F335 HydrophobicContact CE1-CD2 4.09Å; Y270-F335 HydrophobicContact CE1-CE2 4.15Å; L271-F335 HydrophobicContact CD1-CE1 3.89Å; L271-F335 HydrophobicContact CD1-CZ 3.65Å; F331-F335 HydrophobicContact CD1-CE2 4.01Å; F331-F335 HydrophobicContact CD2-CE2 4.32Å; F331-F335 AromaticContact CE1-CE2 3.53Å; F331-F335 HydrophobicContact CE1-CE2 3.53Å; F331-F335 HydrophobicContact CE1-CZ 4.22Å; F331-F335 AromaticContact CE2-CE2 3.87Å; F331-F335 HydrophobicContact CE2-CE2 3.87Å; F331-F335 HydrophobicContact CE2-CZ 4.45Å; F331-F335 HydrophobicContact CG-CE2 4.4Å; F331-F335 AromaticContact CZ-CE2 3.46Å; F331-F335 HydrophobicContact CZ-CE2 3.46Å; F331-F335 VanDerWaalsContact CZ-CE2 3.46Å; F331-F335 AromaticContact CZ-CZ 3.88Å; F331-F335 HydrophobicContact CZ-CZ 3.88Å; F331-F335 WeakPolarHBondContact O-CD2 3.09Å; F331-F335 PolarHBondContact O-N 3.44Å; V332-F335 WeakPolarHBondContact O-CB 3.46Å; V332-F335 PolarHBondContact O-N 3.24Å; A333-F335 PolarHBondContact O-N 3.07Å; F335-S339 WeakPolarHBondContact O-CB 3.44Å; F335-S339 PolarHBondContact O-N 3.43Å; F335-S339 PolarHBondContact O-OG 3.22Å
336	V	93.8	Very high	93.4	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.006	11%	0.106	C	C	.	.	H	α-helix	trans	-58	-54	177.6	176.7	0	0	0	0	110.4	L250 L253 L254 V332 A333 S339 I340	L250-V336 HydrophobicContact CD2-CG2 4.24Å; L253-V336 HydrophobicContact CB-CG1 3.59Å; L253-V336 HydrophobicContact CD1-CG1 4.36Å; L254-V336 HydrophobicContact CB-CG2 3.81Å; L254-V336 HydrophobicContact CD1-CG2 4.17Å; V332-V336 PolarHBondContact O-N 3.17Å; A333-V336 WeakPolarHBondContact O-CB 3.44Å; A333-V336 PolarHBondContact O-N 3.2Å; V336-S339 PolarHBondContact O-OG 3.38Å; V336-I340 HydrophobicContact CG1-CD1 4.11Å; V336-I340 WeakPolarHBondContact O-CD1 2.9Å; V336-I340 WeakPolarHBondContact O-CG1 2.8Å; V336-I340 PolarHBondContact O-N 3.41Å
337	V	92.9	Very high	92.7	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.012	13%	0.127	C	C	.	.	H	α-helix	trans	-62	-53.2	-177.5	173.2	0	0	0	0	110.9	V59 P63 A333 S339 I340 L341 L362 F367	V59-V337 HydrophobicContact CG1-CG2 4.18Å; V59-V337 VanDerWaalsContact O-CG2 3.25Å; V59-V337 WeakPolarHBondContact O-CG2 3.49Å; P63-V337 HydrophobicContact CB-CB 4.25Å; P63-V337 HydrophobicContact CB-CG1 4.31Å; P63-V337 HydrophobicContact CB-CG2 4.45Å; P63-V337 HydrophobicContact CG-CB 4.46Å; P63-V337 HydrophobicContact CG-CG2 4.19Å; A333-V337 VanDerWaalsContact O-CG2 3.26Å; A333-V337 WeakPolarHBondContact O-CG2 3.44Å; A333-V337 PolarHBondContact O-N 2.71Å; V337-S339 PolarHBondContact O-N 2.97Å; V337-I340 PolarHBondContact O-N 2.93Å; V337-L341 HydrophobicContact CG1-CD1 3.81Å; V337-L341 HydrophobicContact CG1-CG 4.27Å; V337-L341 WeakPolarHBondContact O-CG 3.32Å; V337-L341 PolarHBondContact O-N 3.01Å; V337-L362 HydrophobicContact CG1-CD1 4.12Å; V337-L362 HydrophobicContact CG1-CD2 3.97Å; V337-F367 HydrophobicContact CB-CZ 4.22Å; V337-F367 HydrophobicContact CG1-CE2 4.5Å; V337-F367 HydrophobicContact CG1-CZ 4.5Å; V337-F367 HydrophobicContact CG2-CE2 3.89Å; V337-F367 HydrophobicContact CG2-CZ 3.6Å
338	F	94.1	Very high	91.9	Very high	2 Å²	2	25 Å²	25	1%	0.009	13%	0.131	C	C	.	.	H	α-helix	trans	-73.5	-30.3	-172.7	-85.8	-93.6	0	0	0	113.2	P63 Y67 G266 Y270 G334 I340 L341 G342 I352	P63-F338 HydrophobicContact CB-CD2 3.9Å; P63-F338 HydrophobicContact CB-CE2 3.58Å; P63-F338 VanDerWaalsContact O-CE2 3.28Å; P63-F338 WeakPolarHBondContact O-CE2 3.16Å; Y67-F338 HydrophobicContact CD1-CE1 4.47Å; Y67-F338 HydrophobicContact CD1-CZ 4.26Å; Y67-F338 AromaticContact CD2-CE1 3.97Å; Y67-F338 HydrophobicContact CD2-CE1 3.97Å; Y67-F338 HydrophobicContact CD2-CZ 4.36Å; Y67-F338 AromaticContact CG-CE1 3.78Å; Y67-F338 HydrophobicContact CG-CE1 3.78Å; Y67-F338 AromaticContact CG-CZ 3.72Å; Y67-F338 HydrophobicContact CG-CZ 3.72Å; G266-F338 WeakPolarHBondContact CA-O 3.5Å; G266-F338 WeakPolarHBondContact O-CD1 3.25Å; Y270-F338 AromaticContact CD2-CD2 3.83Å; Y270-F338 HydrophobicContact CD2-CD2 3.83Å; Y270-F338 HydrophobicContact CD2-CE2 4.08Å; Y270-F338 HydrophobicContact CD2-CG 4.35Å; Y270-F338 HydrophobicContact CG-CB 4.32Å; Y270-F338 AromaticContact CG-CD2 3.98Å; Y270-F338 HydrophobicContact CG-CD2 3.98Å; Y270-F338 HydrophobicContact CG-CG 4.1Å; G334-F338 WeakPolarHBondContact O-CB 3.36Å; G334-F338 PolarHBondContact O-N 2.93Å; F338-I340 VanDerWaalsContact C-N 3.32Å; F338-I340 PolarHBondContact O-N 3.3Å; F338-L341 HydrophobicContact CE1-CD1 4.46Å; F338-L341 HydrophobicContact CZ-CD1 4.5Å; F338-L341 PolarHBondContact O-N 3.21Å; F338-G342 PolarHBondContact O-N 3.48Å; F338-I352 HydrophobicContact CE1-CG2 4.45Å
339	S	94.9	Very high	91.1	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.4	-41.8	171.8	59.7	0	0	0	0	111.7	G257 A263 F335 V336 V337 G342 F343	G257-S339 WeakPolarHBondContact CA-OG 3.32Å; G257-S339 WeakPolarHBondContact O-CB 3.08Å; A263-S339 WeakPolarHBondContact CA-O 3.26Å; F335-S339 WeakPolarHBondContact O-CB 3.44Å; F335-S339 PolarHBondContact O-N 3.43Å; F335-S339 PolarHBondContact O-OG 3.22Å; V336-S339 PolarHBondContact O-OG 3.38Å; V337-S339 PolarHBondContact O-N 2.97Å; S339-G342 PolarHBondContact O-N 3.32Å; S339-F343 PolarHBondContact O-N 3.3Å
340	I	91.1	Very high	90.4	Very high	7 Å²	7	27.5 Å²	27.5	4%	0.036	16%	0.155	C	C	.	.	H	α-helix	trans	-69.1	-41.9	176.6	-67.8	169.3	0	0	0	111.6	L260 V336 V337 F338 G342 F343 M344 F367 A370 M374	L260-I340 HydrophobicContact CD1-CG1 4.37Å; V336-I340 HydrophobicContact CG1-CD1 4.11Å; V336-I340 WeakPolarHBondContact O-CD1 2.9Å; V336-I340 WeakPolarHBondContact O-CG1 2.8Å; V336-I340 PolarHBondContact O-N 3.41Å; V337-I340 PolarHBondContact O-N 2.93Å; F338-I340 VanDerWaalsContact C-N 3.32Å; F338-I340 PolarHBondContact O-N 3.3Å; I340-G342 VanDerWaalsContact C-N 3.31Å; I340-G342 PolarHBondContact O-N 3.35Å; I340-F343 WeakPolarHBondContact O-CB 3.48Å; I340-F343 PolarHBondContact O-N 3.38Å; I340-M344 PolarHBondContact O-N 2.83Å; I340-F367 HydrophobicContact CD1-CD1 4.36Å; I340-F367 HydrophobicContact CD1-CE1 3.73Å; I340-F367 HydrophobicContact CG2-CD1 4.47Å; I340-F367 HydrophobicContact CG2-CE1 4.48Å; I340-A370 HydrophobicContact CG2-CB 3.28Å; I340-M374 HydrophobicContact CG1-CE 4.34Å; I340-M374 HydrophobicContact CG2-CE 4.21Å
341	L	90.8	Very high	89.9	Confident	6 Å²	6	30.3 Å²	30.3	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-36	174.5	-70.3	178.6	0	0	0	112.3	V337 F338 M344 S345 A356 L362 A366	V337-L341 HydrophobicContact CG1-CD1 3.81Å; V337-L341 HydrophobicContact CG1-CG 4.27Å; V337-L341 WeakPolarHBondContact O-CG 3.32Å; V337-L341 PolarHBondContact O-N 3.01Å; F338-L341 HydrophobicContact CE1-CD1 4.46Å; F338-L341 HydrophobicContact CZ-CD1 4.5Å; F338-L341 PolarHBondContact O-N 3.21Å; L341-M344 HydrophobicContact CD2-CE 4Å; L341-M344 PolarHBondContact O-N 3.16Å; L341-S345 WeakPolarHBondContact O-CB 3.5Å; L341-S345 PolarHBondContact O-N 3.41Å; L341-A356 HydrophobicContact CD1-CB 4.2Å; L341-L362 HydrophobicContact CD1-CD1 4.23Å; L341-L362 HydrophobicContact CD2-CD1 4.25Å; L341-A366 HydrophobicContact CD2-CB 4.06Å
342	G	92.6	Very high	89.4	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-65.2	-42.8	175.3	0	0	0	0	0	112.6	G262 F338 S339 I340 S345 Q346	G262-G342 CarbonylContact O-C 3.58Å; F338-G342 PolarHBondContact O-N 3.48Å; S339-G342 PolarHBondContact O-N 3.32Å; I340-G342 VanDerWaalsContact C-N 3.31Å; I340-G342 PolarHBondContact O-N 3.35Å; G342-S345 PolarHBondContact O-N 3.42Å; G342-Q346 PolarHBondContact O-N 3.27Å
343	F	90.1	Very high	88.7	Confident	9 Å²	9	27.3 Å²	27.3	4%	0.039	16%	0.164	C	C	.	.	H	α-helix	trans	-57.2	-50.1	169.5	164.6	-111	0	0	0	111.9	L260 P261 S339 I340 S345 Q346 E347 M373 M374	L260-F343 HydrophobicContact CB-CB 3.8Å; L260-F343 HydrophobicContact CB-CD2 3.88Å; L260-F343 HydrophobicContact CB-CG 3.84Å; L260-F343 HydrophobicContact CD1-CB 4.04Å; L260-F343 HydrophobicContact CD1-CD1 3.79Å; L260-F343 HydrophobicContact CD1-CE1 4.35Å; L260-F343 HydrophobicContact CD1-CG 3.85Å; L260-F343 HydrophobicContact CD2-CD1 4.38Å; L260-F343 HydrophobicContact CD2-CD2 4.13Å; L260-F343 HydrophobicContact CD2-CE1 4.32Å; L260-F343 HydrophobicContact CD2-CE2 4.07Å; L260-F343 HydrophobicContact CD2-CG 4.26Å; L260-F343 HydrophobicContact CD2-CZ 4.17Å; L260-F343 HydrophobicContact CG-CB 4.48Å; L260-F343 HydrophobicContact CG-CD1 4.48Å; L260-F343 HydrophobicContact CG-CD2 4.39Å; L260-F343 HydrophobicContact CG-CG 4.2Å; P261-F343 HydrophobicContact CG-CD2 3.75Å; P261-F343 HydrophobicContact CG-CE2 3.86Å; P261-F343 WeakPolarHBondContact O-CA 3.29Å; P261-F343 VanDerWaalsContact O-CB 3.31Å; P261-F343 WeakPolarHBondContact O-CB 3.42Å; P261-F343 WeakPolarHBondContact O-CD2 3.25Å; S339-F343 PolarHBondContact O-N 3.3Å; I340-F343 WeakPolarHBondContact O-CB 3.48Å; I340-F343 PolarHBondContact O-N 3.38Å; F343-S345 VanDerWaalsContact C-N 3.33Å; F343-S345 PolarHBondContact O-N 3.32Å; F343-Q346 PolarHBondContact O-N 2.93Å; F343-Q346 VanDerWaalsContact O-N 3.13Å; F343-E347 HydrophobicContact CD2-CG 3.72Å; F343-E347 HydrophobicContact CE1-CG 4.43Å; F343-E347 HydrophobicContact CE2-CG 3.29Å; F343-E347 HydrophobicContact CG-CG 4.46Å; F343-E347 HydrophobicContact CZ-CG 3.71Å; F343-E347 WeakPolarHBondContact O-CG 3.22Å; F343-E347 PolarHBondContact O-N 3.47Å; F343-M373 HydrophobicContact CE1-CB 3.72Å; F343-M373 HydrophobicContact CE1-SD 4.31Å; F343-M373 HydrophobicContact CZ-CB 3.77Å; F343-M374 HydrophobicContact CE1-CE 4.48Å; F343-M374 HydrophobicContact CE1-CG 4.45Å
344	M	86.6	Confident	87.9	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.015	19%	0.194	C	C	.	.	H	α-helix	trans	-61.6	-40.5	-179.4	-171.6	164.9	78.7	0	0	112.8	I340 L341 Q348 V355 A366 K369 A370 M373	I340-M344 PolarHBondContact O-N 2.83Å; L341-M344 HydrophobicContact CD2-CE 4Å; L341-M344 PolarHBondContact O-N 3.16Å; M344-Q348 WeakPolarHBondContact O-CB 3.36Å; M344-Q348 WeakPolarHBondContact O-CG 3.44Å; M344-Q348 PolarHBondContact O-N 3.48Å; M344-V355 HydrophobicContact CE-CB 3.36Å; M344-V355 HydrophobicContact CE-CG1 3.57Å; M344-V355 HydrophobicContact CE-CG2 4.25Å; M344-A366 HydrophobicContact CE-CB 4.13Å; M344-K369 HydrophobicContact CE-CD 4.36Å; M344-K369 HydrophobicContact SD-CB 3.85Å; M344-K369 HydrophobicContact SD-CD 3.72Å; M344-K369 HydrophobicContact SD-CG 3.79Å; M344-A370 HydrophobicContact SD-CB 4.22Å; M344-M373 HydrophobicContact CG-CE 4.28Å; M344-M373 HydrophobicContact CG-SD 4.41Å
345	S	88	Confident	87.1	Confident	20 Å²	20	34 Å²	34	14%	0.14	20%	0.196	C	C	.	.	H	α-helix	trans	-61.8	-42.2	174.7	169.5	0	0	0	0	112	L341 G342 F343 G349 V350 I352	L341-S345 WeakPolarHBondContact O-CB 3.5Å; L341-S345 PolarHBondContact O-N 3.41Å; G342-S345 PolarHBondContact O-N 3.42Å; F343-S345 VanDerWaalsContact C-N 3.33Å; F343-S345 PolarHBondContact O-N 3.32Å; S345-G349 WeakPolarHBondContact O-CA 3.31Å; S345-G349 PolarHBondContact O-N 3.39Å; S345-V350 WeakPolarHBondContact CA-O 3.2Å; S345-V350 WeakPolarHBondContact CB-O 3.44Å; S345-V350 PolarHBondContact O-N 2.77Å; S345-V350 PolarHBondContact OG-O 2.99Å; S345-I352 VanDerWaalsContact CB-CG1 3.4Å; S345-I352 WeakPolarHBondContact OG-CG1 3.21Å
346	Q	87.2	Confident	86.3	Confident	105 Å²	105	32.3 Å²	32.3	49%	0.491	19%	0.191	S	C	.	.	H	α-helix	trans	-67.8	-46.2	178.3	177.8	167.3	-28.5	0	0	112.2	G342 F343 Q348 G349	G342-Q346 PolarHBondContact O-N 3.27Å; F343-Q346 PolarHBondContact O-N 2.93Å; F343-Q346 VanDerWaalsContact O-N 3.13Å; Q346-Q348 VanDerWaalsContact C-N 3.33Å; Q346-Q348 PolarHBondContact O-N 3.39Å; Q346-G349 PolarHBondContact O-N 2.91Å
347	E	83.1	Confident	85.4	Confident	95 Å²	95	34.8 Å²	34.8	44%	0.444	20%	0.202	S	C	.	.	H	α-helix	trans	-65.6	-35.6	-179.3	-68.4	-60.8	130.7	0	0	112.5	F343 M373	F343-E347 HydrophobicContact CD2-CG 3.72Å; F343-E347 HydrophobicContact CE1-CG 4.43Å; F343-E347 HydrophobicContact CE2-CG 3.29Å; F343-E347 HydrophobicContact CG-CG 4.46Å; F343-E347 HydrophobicContact CZ-CG 3.71Å; F343-E347 WeakPolarHBondContact O-CG 3.22Å; F343-E347 PolarHBondContact O-N 3.47Å; E347-M373 HydrophobicContact CB-SD 4.18Å
348	Q	78.9	Confident	84.5	Confident	36 Å²	36	37.8 Å²	37.8	17%	0.168	22%	0.223	C	C	.	.	H	α-helix	trans	-87.4	-13.8	178.8	-71.6	171.1	25.1	0	0	113.7	M344 Q346 V350 K369 M373	M344-Q348 WeakPolarHBondContact O-CB 3.36Å; M344-Q348 WeakPolarHBondContact O-CG 3.44Å; M344-Q348 PolarHBondContact O-N 3.48Å; Q346-Q348 VanDerWaalsContact C-N 3.33Å; Q346-Q348 PolarHBondContact O-N 3.39Å; Q348-V350 HydrophobicContact CB-CG1 4.32Å; Q348-V350 HydrophobicContact CB-CG2 3.79Å; Q348-V350 PolarHBondContact O-N 3.24Å; Q348-K369 VanDerWaalsContact CD-NZ 3.32Å; Q348-K369 VanDerWaalsContact NE2-NZ 3.19Å; Q348-M373 HydrophobicContact CG-CE 4.22Å
349	G	79.4	Confident	84	Confident	70 Å²	70	38.5 Å²	38.5	72%	0.722	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.9	19.6	-172.9	0	0	0	0	0	114.3	S345 Q346	S345-G349 WeakPolarHBondContact O-CA 3.31Å; S345-G349 PolarHBondContact O-N 3.39Å; Q346-G349 PolarHBondContact O-N 2.91Å
350	V	82.1	Confident	83.6	Confident	41 Å²	41	39 Å²	39	25%	0.248	24%	0.235	C	C	.	.			trans	-105.4	149.7	179.6	-60	0	0	0	0	111.4	S345 Q348 V355	S345-V350 WeakPolarHBondContact CA-O 3.2Å; S345-V350 WeakPolarHBondContact CB-O 3.44Å; S345-V350 PolarHBondContact O-N 2.77Å; S345-V350 PolarHBondContact OG-O 2.99Å; Q348-V350 HydrophobicContact CB-CG1 4.32Å; Q348-V350 HydrophobicContact CB-CG2 3.79Å; Q348-V350 PolarHBondContact O-N 3.24Å; V350-V355 HydrophobicContact CG2-CG1 3.61Å
351	P	85.3	Confident	83.4	Confident	60 Å²	60	39.1 Å²	39.1	39%	0.39	24%	0.238	S	C	.	.			trans	-60	145.1	177.2	-22.7	33.6	0	0	0	113.3	S353 E354	P351-S353 PolarHBondContact O-N 3.47Å; P351-S353 VanDerWaalsContact O-N 3.07Å; P351-E354 PolarHBondContact O-N 2.84Å
352	I	84.9	Confident	83.2	Confident	1 Å²	1	39 Å²	39	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-55.2	-30.8	177	-74	164.4	0	0	0	112.3	Y269 F338 S345 E354 V355 A356	Y269-I352 HydrophobicContact CD2-CB 4.21Å; Y269-I352 HydrophobicContact CD2-CD1 3.19Å; Y269-I352 HydrophobicContact CD2-CG1 4.2Å; Y269-I352 HydrophobicContact CE2-CB 4.34Å; Y269-I352 HydrophobicContact CE2-CD1 3.61Å; Y269-I352 HydrophobicContact CE2-CG1 4.37Å; Y269-I352 HydrophobicContact CG-CB 4.36Å; Y269-I352 HydrophobicContact CG-CD1 3.94Å; Y269-I352 HydrophobicContact CG-CG2 4.35Å; F338-I352 HydrophobicContact CE1-CG2 4.45Å; S345-I352 VanDerWaalsContact CB-CG1 3.4Å; S345-I352 WeakPolarHBondContact OG-CG1 3.21Å; I352-E354 PolarHBondContact O-N 2.94Å; I352-V355 HydrophobicContact CB-CG2 4.44Å; I352-V355 WeakPolarHBondContact O-CG2 3.4Å; I352-V355 PolarHBondContact O-N 3.48Å; I352-A356 HydrophobicContact CG2-CB 4.41Å; I352-A356 VanDerWaalsContact O-CB 3.23Å; I352-A356 WeakPolarHBondContact O-CB 3.18Å; I352-A356 PolarHBondContact O-N 2.82Å
353	S	82.3	Confident	83.1	Confident	68 Å²	68	39 Å²	39	48%	0.476	24%	0.237	S	C	.	.	H	α-helix	trans	-62.1	-26.7	178	52.7	0	0	0	0	114.4	Y67 P351	Y67-S353 VanDerWaalsContact OH-CA 3.29Å; Y67-S353 WeakPolarHBondContact OH-CA 3.35Å; Y67-S353 VanDerWaalsContact OH-CB 3.25Å; Y67-S353 WeakPolarHBondContact OH-CB 3.47Å; P351-S353 PolarHBondContact O-N 3.47Å; P351-S353 VanDerWaalsContact O-N 3.07Å
354	E	77.6	Confident	83.2	Confident	132 Å²	132	38.6 Å²	38.6	62%	0.617	24%	0.235	S	C	*	.	H	α-helix	trans	-86.8	-18.7	179.9	-66.3	-179.9	-163	0	0	112.3	P351 I352	P351-E354 PolarHBondContact O-N 2.84Å; I352-E354 PolarHBondContact O-N 2.94Å
355	V	78.4	Confident	83.4	Confident	8 Å²	8	38.8 Å²	38.8	5%	0.048	24%	0.236	C	C	.	.	H	α-helix	trans	-103.5	-16.4	179.5	-69.1	0	0	0	0	113.8	M344 V350 I352 E357	M344-V355 HydrophobicContact CE-CB 3.36Å; M344-V355 HydrophobicContact CE-CG1 3.57Å; M344-V355 HydrophobicContact CE-CG2 4.25Å; V350-V355 HydrophobicContact CG2-CG1 3.61Å; I352-V355 HydrophobicContact CB-CG2 4.44Å; I352-V355 WeakPolarHBondContact O-CG2 3.4Å; I352-V355 PolarHBondContact O-N 3.48Å; V355-E357 PolarHBondContact O-N 2.97Å; V355-E357 VanDerWaalsContact O-N 3.1Å
356	A	78.9	Confident	83.4	Confident	12 Å²	12	38 Å²	38	10%	0.099	23%	0.231	C	C	.	.			trans	-81.3	84	178	0	0	0	0	0	110.9	Y64 Y67 L341 I352	Y64-A356 WeakPolarHBondContact CE2-O 3.48Å; Y67-A356 HydrophobicContact CD1-CB 4.31Å; Y67-A356 HydrophobicContact CE1-CB 4Å; L341-A356 HydrophobicContact CD1-CB 4.2Å; I352-A356 HydrophobicContact CG2-CB 4.41Å; I352-A356 VanDerWaalsContact O-CB 3.23Å; I352-A356 WeakPolarHBondContact O-CB 3.18Å; I352-A356 PolarHBondContact O-N 2.82Å
357	E	74.4	Confident	83.5	Confident	52 Å²	52	33.4 Å²	33.4	24%	0.243	21%	0.209	C	C	.	.			trans	-80.8	158.8	172.5	-66.3	-174.1	-166.7	0	0	112.3	Y64 V355 G361 I365	Y64-E357 WeakPolarHBondContact CD2-O 2.86Å; V355-E357 PolarHBondContact O-N 2.97Å; V355-E357 VanDerWaalsContact O-N 3.1Å; E357-G361 VanDerWaalsContact OE2-C 3.24Å; E357-G361 WeakPolarHBondContact OE2-CA 3.33Å; E357-I365 WeakPolarHBondContact OE2-CD1 3.46Å
358	S	74.6	Confident	83.9	Confident	65 Å²	65	29 Å²	29	46%	0.455	19%	0.189	S	C	.	.			trans	-106.9	148	176.9	65.9	0	0	0	0	112.2
359	G	82.9	Confident	84.4	Confident	18 Å²	18	28.8 Å²	28.8	19%	0.186	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	-139.4	171.7	0	0	0	0	0	112.2	G361 L362	G359-G361 PolarHBondContact O-N 3.42Å; G359-L362 WeakPolarHBondContact O-CB 3.45Å; G359-L362 PolarHBondContact O-N 3.1Å; G359-L362 VanDerWaalsContact O-N 3.1Å
360	P	86.1	Confident	84.8	Confident	11 Å²	11	25.5 Å²	25.5	7%	0.071	15%	0.153	C	C	.	.	H	α-helix	trans	-55.1	-33.8	-177.9	-28.6	36.8	0	0	0	114.4	W60 W139 W192 L362 A363 F364 M445 F448	W60-P360 HydrophobicContact CH2-CG 4.3Å; W60-P360 HydrophobicContact CZ3-CB 4.37Å; W60-P360 HydrophobicContact CZ3-CG 4.43Å; W139-P360 HydrophobicContact CZ3-CB 4.19Å; W139-P360 HydrophobicContact CZ3-CG 4.11Å; W192-P360 HydrophobicContact CZ2-CB 4.29Å; P360-L362 VanDerWaalsContact C-N 3.27Å; P360-L362 PolarHBondContact O-N 3.28Å; P360-A363 PolarHBondContact O-N 3.42Å; P360-A363 VanDerWaalsContact O-N 3.16Å; P360-F364 HydrophobicContact CB-CD2 4.03Å; P360-F364 HydrophobicContact CB-CE2 4.49Å; P360-F364 WeakPolarHBondContact O-CB 3.42Å; P360-F364 VanDerWaalsContact O-CD2 3.28Å; P360-F364 WeakPolarHBondContact O-CD2 3.48Å; P360-F364 PolarHBondContact O-N 3.27Å; P360-M445 HydrophobicContact CB-CE 4.38Å; P360-M445 HydrophobicContact CG-CE 4.24Å; P360-F448 HydrophobicContact CG-CE1 4.01Å; P360-F448 HydrophobicContact CG-CZ 4.47Å
361	G	87	Confident	85.2	Confident	9 Å²	9	24 Å²	24	9%	0.093	14%	0.144	C	C	.	.	H	α-helix	trans	-60	-36	178.7	0	0	0	0	0	113.3	E357 G359 A363 I365 A366	E357-G361 VanDerWaalsContact OE2-C 3.24Å; E357-G361 WeakPolarHBondContact OE2-CA 3.33Å; G359-G361 PolarHBondContact O-N 3.42Å; G361-A363 PolarHBondContact O-N 3.33Å; G361-I365 WeakPolarHBondContact O-CA 3.26Å; G361-I365 WeakPolarHBondContact O-CB 3.3Å; G361-I365 PolarHBondContact O-N 3.39Å; G361-A366 PolarHBondContact O-N 2.99Å
362	L	86.6	Confident	85.4	Confident	3 Å²	3	22.2 Å²	22.2	2%	0.016	13%	0.132	C	C	.	.	I	π-helix	trans	-61.2	-47.2	175.9	-173.9	54.3	0	0	0	111.6	W60 V337 L341 G359 P360 A366 F367	W60-L362 HydrophobicContact CB-CB 4.28Å; W60-L362 HydrophobicContact CB-CD2 3.93Å; W60-L362 HydrophobicContact CB-CG 4.38Å; W60-L362 WeakPolarHBondContact O-CD2 3.34Å; V337-L362 HydrophobicContact CG1-CD1 4.12Å; V337-L362 HydrophobicContact CG1-CD2 3.97Å; L341-L362 HydrophobicContact CD1-CD1 4.23Å; L341-L362 HydrophobicContact CD2-CD1 4.25Å; G359-L362 WeakPolarHBondContact O-CB 3.45Å; G359-L362 PolarHBondContact O-N 3.1Å; G359-L362 VanDerWaalsContact O-N 3.1Å; P360-L362 VanDerWaalsContact C-N 3.27Å; P360-L362 PolarHBondContact O-N 3.28Å; L362-A366 HydrophobicContact CD1-CB 3.93Å; L362-A366 PolarHBondContact O-N 3.36Å; L362-F367 HydrophobicContact CD1-CD2 4.37Å; L362-F367 HydrophobicContact CD1-CE2 4.34Å; L362-F367 HydrophobicContact CG-CD2 4.2Å; L362-F367 HydrophobicContact CG-CE2 4.1Å; L362-F367 VanDerWaalsContact O-CD2 3.23Å; L362-F367 WeakPolarHBondContact O-CD2 3.2Å; L362-F367 PolarHBondContact O-N 3.48Å
363	A	90.2	Very high	85.3	Confident	2 Å²	2	23.9 Å²	23.9	2%	0.017	14%	0.14	C	C	.	.	I	π-helix	trans	-79.8	-32.1	-177.2	0	0	0	0	0	114.5	W60 P360 G361 P368 F384 L388	W60-A363 HydrophobicContact CE3-CB 3.49Å; W60-A363 VanDerWaalsContact CE3-CB 3.49Å; W60-A363 HydrophobicContact CZ3-CB 3.83Å; P360-A363 PolarHBondContact O-N 3.42Å; P360-A363 VanDerWaalsContact O-N 3.16Å; G361-A363 PolarHBondContact O-N 3.33Å; A363-P368 WeakPolarHBondContact O-CD 3.21Å; A363-F384 HydrophobicContact CB-CZ 4.32Å; A363-F384 WeakPolarHBondContact O-CE1 3.33Å; A363-L388 HydrophobicContact CB-CD1 4.01Å
364	F	93.4	Very high	85.5	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.12	C	C	.	.	I	π-helix	trans	-106.9	-7.5	-173.3	-62.3	-68.8	0	0	0	113.7	W60 I136 W139 A140 Y143 W192 P360 F385	W60-F364 HydrophobicContact CZ3-CE2 4.06Å; I136-F364 HydrophobicContact CG2-CE2 4Å; I136-F364 HydrophobicContact CG2-CZ 3.99Å; W139-F364 HydrophobicContact CB-CD1 4.43Å; W139-F364 HydrophobicContact CB-CE1 3.77Å; W139-F364 HydrophobicContact CB-CE2 4.13Å; W139-F364 HydrophobicContact CB-CZ 3.6Å; W139-F364 HydrophobicContact CE3-CD2 4.33Å; W139-F364 AromaticContact CE3-CE2 3.76Å; W139-F364 HydrophobicContact CE3-CE2 3.76Å; W139-F364 HydrophobicContact CE3-CZ 4.31Å; A140-F364 HydrophobicContact CB-CE1 4.37Å; A140-F364 HydrophobicContact CB-CZ 4.4Å; Y143-F364 AromaticContact CD2-CD1 3.5Å; Y143-F364 HydrophobicContact CD2-CD1 3.5Å; Y143-F364 VanDerWaalsContact CD2-CD1 3.5Å; Y143-F364 AromaticContact CD2-CE1 3.94Å; Y143-F364 HydrophobicContact CD2-CE1 3.94Å; Y143-F364 HydrophobicContact CE2-CB 4.05Å; Y143-F364 AromaticContact CE2-CD1 3.46Å; Y143-F364 HydrophobicContact CE2-CD1 3.46Å; Y143-F364 VanDerWaalsContact CE2-CD1 3.46Å; Y143-F364 HydrophobicContact CE2-CE1 4.3Å; Y143-F364 HydrophobicContact CE2-CG 4.1Å; Y143-F364 HydrophobicContact CG-CD1 4.18Å; Y143-F364 PolarHBondContact OH-O 3.25Å; W192-F364 HydrophobicContact CD2-CB 4.1Å; W192-F364 HydrophobicContact CE3-CB 3.66Å; W192-F364 HydrophobicContact CE3-CG 4.21Å; W192-F364 HydrophobicContact CH2-CB 4.03Å; W192-F364 AromaticContact CH2-CD2 3.77Å; W192-F364 HydrophobicContact CH2-CD2 3.77Å; W192-F364 HydrophobicContact CH2-CE2 4.46Å; W192-F364 AromaticContact CH2-CG 3.94Å; W192-F364 HydrophobicContact CH2-CG 3.94Å; W192-F364 HydrophobicContact CZ2-CB 4.47Å; W192-F364 HydrophobicContact CZ2-CD2 4.49Å; W192-F364 HydrophobicContact CZ3-CB 3.61Å; W192-F364 HydrophobicContact CZ3-CD1 4.15Å; W192-F364 AromaticContact CZ3-CD2 3.96Å; W192-F364 HydrophobicContact CZ3-CD2 3.96Å; W192-F364 AromaticContact CZ3-CG 3.64Å; W192-F364 HydrophobicContact CZ3-CG 3.64Å; P360-F364 HydrophobicContact CB-CD2 4.03Å; P360-F364 HydrophobicContact CB-CE2 4.49Å; P360-F364 WeakPolarHBondContact O-CB 3.42Å; P360-F364 VanDerWaalsContact O-CD2 3.28Å; P360-F364 WeakPolarHBondContact O-CD2 3.48Å; P360-F364 PolarHBondContact O-N 3.27Å; F364-F385 AromaticContact CD1-CE1 3.83Å; F364-F385 HydrophobicContact CD1-CE1 3.83Å; F364-F385 HydrophobicContact CE1-CD1 4.37Å; F364-F385 AromaticContact CE1-CE1 3.83Å; F364-F385 HydrophobicContact CE1-CE1 3.83Å
365	I	90.5	Very high	85.9	Confident	6 Å²	6	19 Å²	19	3%	0.031	12%	0.118	C	C	.	.	I	π-helix	trans	-122	-65.1	175.2	-60.4	161.7	0	0	0	110	V188 M189 W192 E357 G361 F367 P368 K369	V188-I365 HydrophobicContact CG1-CG2 4.39Å; V188-I365 WeakPolarHBondContact CG1-O 3.28Å; M189-I365 HydrophobicContact CE-CD1 4.13Å; M189-I365 HydrophobicContact CG-CG2 4.02Å; M189-I365 HydrophobicContact SD-CB 4.2Å; M189-I365 HydrophobicContact SD-CD1 3.34Å; M189-I365 WeakPolarHBondContact SD-CD1 3.47Å; M189-I365 HydrophobicContact SD-CG1 3.88Å; M189-I365 HydrophobicContact SD-CG2 3.36Å; M189-I365 WeakPolarHBondContact SD-CG2 3.29Å; W192-I365 HydrophobicContact CB-CD1 4.41Å; W192-I365 HydrophobicContact CB-CG1 3.98Å; W192-I365 HydrophobicContact CG-CD1 4.07Å; W192-I365 HydrophobicContact CG-CG1 3.97Å; E357-I365 WeakPolarHBondContact OE2-CD1 3.46Å; G361-I365 WeakPolarHBondContact O-CA 3.26Å; G361-I365 WeakPolarHBondContact O-CB 3.3Å; G361-I365 PolarHBondContact O-N 3.39Å; I365-F367 PolarHBondContact O-N 3.26Å; I365-P368 WeakPolarHBondContact O-CD 3.14Å; I365-K369 WeakPolarHBondContact O-CB 3.43Å; I365-K369 PolarHBondContact O-N 2.82Å
366	A	88.6	Confident	86.4	Confident	3 Å²	3	24.5 Å²	24.5	3%	0.025	15%	0.146	C	C	.	.	I	π-helix	trans	-65.9	-45.1	-170.7	0	0	0	0	0	113.1	L341 M344 G361 L362 K369 A370	L341-A366 HydrophobicContact CD2-CB 4.06Å; M344-A366 HydrophobicContact CE-CB 4.13Å; G361-A366 PolarHBondContact O-N 2.99Å; L362-A366 HydrophobicContact CD1-CB 3.93Å; L362-A366 PolarHBondContact O-N 3.36Å; A366-K369 PolarHBondContact O-N 3.23Å; A366-A370 PolarHBondContact O-N 2.94Å
367	F	89	Confident	87	Confident	10 Å²	10	24.8 Å²	24.8	4%	0.044	15%	0.147	C	C	.	.	H	α-helix	trans	-63.9	-51.4	177	-91.5	-73.6	0	0	0	113.2	V337 I340 L362 I365 K369 A370 V371 F384	V337-F367 HydrophobicContact CB-CZ 4.22Å; V337-F367 HydrophobicContact CG1-CE2 4.5Å; V337-F367 HydrophobicContact CG1-CZ 4.5Å; V337-F367 HydrophobicContact CG2-CE2 3.89Å; V337-F367 HydrophobicContact CG2-CZ 3.6Å; I340-F367 HydrophobicContact CD1-CD1 4.36Å; I340-F367 HydrophobicContact CD1-CE1 3.73Å; I340-F367 HydrophobicContact CG2-CD1 4.47Å; I340-F367 HydrophobicContact CG2-CE1 4.48Å; L362-F367 HydrophobicContact CD1-CD2 4.37Å; L362-F367 HydrophobicContact CD1-CE2 4.34Å; L362-F367 HydrophobicContact CG-CD2 4.2Å; L362-F367 HydrophobicContact CG-CE2 4.1Å; L362-F367 VanDerWaalsContact O-CD2 3.23Å; L362-F367 WeakPolarHBondContact O-CD2 3.2Å; L362-F367 PolarHBondContact O-N 3.48Å; I365-F367 PolarHBondContact O-N 3.26Å; F367-K369 PolarHBondContact O-N 3.44Å; F367-A370 PolarHBondContact O-N 3.32Å; F367-A370 VanDerWaalsContact O-N 3.08Å; F367-V371 WeakPolarHBondContact O-CG2 3.11Å; F367-V371 PolarHBondContact O-N 2.98Å; F367-F384 HydrophobicContact CB-CE1 3.79Å; F367-F384 HydrophobicContact CB-CE2 4.11Å; F367-F384 HydrophobicContact CB-CZ 3.53Å; F367-F384 HydrophobicContact CD1-CD2 4.32Å; F367-F384 AromaticContact CD1-CE2 3.74Å; F367-F384 HydrophobicContact CD1-CE2 3.74Å; F367-F384 HydrophobicContact CD1-CZ 4.04Å; F367-F384 AromaticContact CD2-CE2 3.95Å; F367-F384 HydrophobicContact CD2-CE2 3.95Å; F367-F384 AromaticContact CD2-CZ 3.68Å; F367-F384 HydrophobicContact CD2-CZ 3.68Å; F367-F384 HydrophobicContact CE1-CE2 4.05Å; F367-F384 HydrophobicContact CE2-CE2 4.27Å; F367-F384 HydrophobicContact CE2-CZ 4.37Å; F367-F384 HydrophobicContact CG-CE1 4.26Å; F367-F384 AromaticContact CG-CE2 3.68Å; F367-F384 HydrophobicContact CG-CE2 3.68Å; F367-F384 AromaticContact CG-CZ 3.49Å; F367-F384 HydrophobicContact CG-CZ 3.49Å; F367-F384 VanDerWaalsContact CG-CZ 3.49Å; F367-F384 HydrophobicContact CZ-CE2 4.31Å
368	P	91.6	Very high	87.9	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-57.6	-37.5	176.5	-30.4	39.1	0	0	0	112.6	Y143 W154 V188 A363 I365 V371 T372 F385	Y143-P368 HydrophobicContact CE1-CG 4.25Å; W154-P368 HydrophobicContact CZ2-CB 4.47Å; W154-P368 PolarHBondContact NE1-O 3.4Å; V188-P368 HydrophobicContact CG1-CB 4.05Å; A363-P368 WeakPolarHBondContact O-CD 3.21Å; I365-P368 WeakPolarHBondContact O-CD 3.14Å; P368-V371 PolarHBondContact O-N 3.37Å; P368-T372 WeakPolarHBondContact O-CG2 3.48Å; P368-T372 PolarHBondContact O-N 2.66Å; P368-T372 VanDerWaalsContact O-N 3.16Å; P368-F385 HydrophobicContact CG-CE2 4.44Å; P368-F385 HydrophobicContact CG-CZ 3.77Å
369	K	88.5	Confident	88.7	Confident	33 Å²	33	26.5 Å²	26.5	14%	0.143	15%	0.151	C	C	.	.	H	α-helix	trans	-62.2	-42.5	174.2	-166.6	-179.6	-166.6	-162.2	0	112.5	V188 M344 Q348 I365 A366 F367 V371 T372 M373	V188-K369 HydrophobicContact CB-CB 4.38Å; V188-K369 HydrophobicContact CG1-CB 4.47Å; V188-K369 HydrophobicContact CG2-CB 3.85Å; V188-K369 HydrophobicContact CG2-CG 4.04Å; M344-K369 HydrophobicContact CE-CD 4.36Å; M344-K369 HydrophobicContact SD-CB 3.85Å; M344-K369 HydrophobicContact SD-CD 3.72Å; M344-K369 HydrophobicContact SD-CG 3.79Å; Q348-K369 VanDerWaalsContact CD-NZ 3.32Å; Q348-K369 VanDerWaalsContact NE2-NZ 3.19Å; I365-K369 WeakPolarHBondContact O-CB 3.43Å; I365-K369 PolarHBondContact O-N 2.82Å; A366-K369 PolarHBondContact O-N 3.23Å; F367-K369 PolarHBondContact O-N 3.44Å; K369-V371 VanDerWaalsContact C-N 3.34Å; K369-T372 PolarHBondContact O-OG1 2.7Å; K369-M373 HydrophobicContact CG-CE 4.08Å; K369-M373 WeakPolarHBondContact O-CE 3.41Å
370	A	87.8	Confident	89.2	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-69.8	-33.9	176	0	0	0	0	0	112.4	I340 M344 A366 F367 T372 M373 M374	I340-A370 HydrophobicContact CG2-CB 3.28Å; M344-A370 HydrophobicContact SD-CB 4.22Å; A366-A370 PolarHBondContact O-N 2.94Å; F367-A370 PolarHBondContact O-N 3.32Å; F367-A370 VanDerWaalsContact O-N 3.08Å; A370-T372 VanDerWaalsContact C-N 3.35Å; A370-T372 PolarHBondContact O-N 3.35Å; A370-M373 PolarHBondContact O-N 2.78Å; A370-M374 HydrophobicContact CB-CE 4.38Å
371	V	89.7	Confident	89.6	Confident	9 Å²	9	27.2 Å²	27.2	6%	0.055	15%	0.147	C	C	.	.	H	α-helix	trans	-64.7	-35.7	178.4	164.5	0	0	0	0	112.3	L152 F367 P368 K369 M373 M374 S377 W380	L152-V371 HydrophobicContact CD1-CG1 4.12Å; F367-V371 WeakPolarHBondContact O-CG2 3.11Å; F367-V371 PolarHBondContact O-N 2.98Å; P368-V371 PolarHBondContact O-N 3.37Å; K369-V371 VanDerWaalsContact C-N 3.34Å; V371-M373 PolarHBondContact O-N 3.03Å; V371-M374 PolarHBondContact O-N 3.23Å; V371-M374 VanDerWaalsContact O-N 3.1Å; V371-S377 WeakPolarHBondContact CG1-O 3.34Å; V371-S377 WeakPolarHBondContact O-CB 3.43Å; V371-W380 HydrophobicContact CG1-CB 3.91Å; V371-W380 HydrophobicContact CG2-CB 4.22Å
372	T	89.4	Confident	89.9	Confident	23 Å²	23	27.6 Å²	27.6	14%	0.141	15%	0.148	C	C	.	.	H	α-helix	trans	-64	-21	177.9	65.1	0	0	0	0	113.2	L152 W154 P368 K369 A370	L152-T372 HydrophobicContact CD1-CG2 4.37Å; W154-T372 VanDerWaalsContact CD1-CG2 3.4Å; P368-T372 WeakPolarHBondContact O-CG2 3.48Å; P368-T372 PolarHBondContact O-N 2.66Å; P368-T372 VanDerWaalsContact O-N 3.16Å; K369-T372 PolarHBondContact O-OG1 2.7Å; A370-T372 VanDerWaalsContact C-N 3.35Å; A370-T372 PolarHBondContact O-N 3.35Å
373	M	84.6	Confident	90.3	Very high	35 Å²	35	29.5 Å²	29.5	17%	0.172	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-6	179.3	-55.8	173.5	-169.6	0	0	113	L170 F343 M344 E347 Q348 K369 A370 V371	L170-M373 HydrophobicContact CD1-CE 4.33Å; L170-M373 HydrophobicContact CD1-CG 3.92Å; L170-M373 HydrophobicContact CD2-CE 3.88Å; L170-M373 HydrophobicContact CD2-CG 3.79Å; L170-M373 HydrophobicContact CD2-SD 4.11Å; L170-M373 HydrophobicContact CG-CE 4.35Å; L170-M373 HydrophobicContact CG-CG 4.48Å; F343-M373 HydrophobicContact CE1-CB 3.72Å; F343-M373 HydrophobicContact CE1-SD 4.31Å; F343-M373 HydrophobicContact CZ-CB 3.77Å; M344-M373 HydrophobicContact CG-CE 4.28Å; M344-M373 HydrophobicContact CG-SD 4.41Å; E347-M373 HydrophobicContact CB-SD 4.18Å; Q348-M373 HydrophobicContact CG-CE 4.22Å; K369-M373 HydrophobicContact CG-CE 4.08Å; K369-M373 WeakPolarHBondContact O-CE 3.41Å; A370-M373 PolarHBondContact O-N 2.78Å; V371-M373 PolarHBondContact O-N 3.03Å
374	M	84.9	Confident	90.4	Very high	11 Å²	11	29.6 Å²	29.6	5%	0.054	16%	0.158	C	C	.	.	S	Bend	trans	-96.4	145.7	-179.8	-57.9	-168.8	-158.4	0	0	111	R256 L260 I340 F343 A370 V371 S377	R256-M374 HydrophobicContact CG-SD 4.25Å; L260-M374 HydrophobicContact CD1-CE 3.61Å; L260-M374 HydrophobicContact CD1-SD 4.25Å; I340-M374 HydrophobicContact CG1-CE 4.34Å; I340-M374 HydrophobicContact CG2-CE 4.21Å; F343-M374 HydrophobicContact CE1-CE 4.48Å; F343-M374 HydrophobicContact CE1-CG 4.45Å; A370-M374 HydrophobicContact CB-CE 4.38Å; V371-M374 PolarHBondContact O-N 3.23Å; V371-M374 VanDerWaalsContact O-N 3.1Å; M374-S377 PolarHBondContact O-N 2.63Å
375	P	86.6	Confident	90.5	Very high	87 Å²	87	29.7 Å²	29.7	57%	0.565	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	144.3	170.3	28.1	-34.6	0	0	0	110	W380	P375-W380 VanDerWaalsContact O-CD1 3.24Å; P375-W380 PolarHBondContact O-NE1 3.37Å
376	L	89.8	Confident	90.7	Very high	124 Å²	124	31.6 Å²	31.6	65%	0.649	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.7	43.2	-175.1	-52.6	172	0	0	0	112.6	Q378 L379 W380	L376-Q378 PolarHBondContact O-N 3.02Å; L376-Q378 VanDerWaalsContact O-N 3.09Å; L376-L379 HydrophobicContact CB-CB 4.4Å; L376-L379 WeakPolarHBondContact O-CB 3.41Å; L376-L379 PolarHBondContact O-N 3.04Å; L376-W380 VanDerWaalsContact O-CD1 3.23Å; L376-W380 PolarHBondContact O-N 3.26Å
377	S	91.4	Very high	91	Very high	17 Å²	17	31.5 Å²	31.5	12%	0.119	17%	0.167	C	C	.	.	H	α-helix	trans	-51	-34.9	-175.3	57.5	0	0	0	0	113.9	V371 M374 L379 W380 S381	V371-S377 WeakPolarHBondContact CG1-O 3.34Å; V371-S377 WeakPolarHBondContact O-CB 3.43Å; M374-S377 PolarHBondContact O-N 2.63Å; S377-L379 PolarHBondContact O-N 3.03Å; S377-W380 PolarHBondContact O-N 2.99Å; S377-S381 WeakPolarHBondContact O-CB 3.38Å; S377-S381 PolarHBondContact O-N 2.97Å
378	Q	93.1	Very high	91.2	Very high	59 Å²	59	31.3 Å²	31.3	28%	0.276	17%	0.167	S	C	.	.	H	α-helix	trans	-61.4	-43.3	177.5	-58.3	77.3	4.9	0	0	112	T149 S150 L152 L376 S381 C382	T149-Q378 WeakPolarHBondContact O-CG 3.16Å; S150-Q378 PolarHBondContact O-NE2 3.39Å; L152-Q378 HydrophobicContact CD2-CG 4.23Å; L152-Q378 HydrophobicContact CG-CG 4.39Å; L376-Q378 PolarHBondContact O-N 3.02Å; L376-Q378 VanDerWaalsContact O-N 3.09Å; Q378-S381 PolarHBondContact O-N 3.41Å; Q378-C382 WeakPolarHBondContact O-CB 3.41Å; Q378-C382 PolarHBondContact O-N 3.39Å; Q378-C382 PolarHBondContact O-SG 2.85Å; Q378-C382 VanDerWaalsContact O-SG 3.36Å
379	L	91.8	Very high	91.4	Very high	95 Å²	95	32 Å²	32	50%	0.497	17%	0.17	S	C	.	.	H	α-helix	trans	-63.5	-47.5	178.4	177.3	63.5	0	0	0	110.4	L376 S377 S381 C382 L383	L376-L379 HydrophobicContact CB-CB 4.4Å; L376-L379 WeakPolarHBondContact O-CB 3.41Å; L376-L379 PolarHBondContact O-N 3.04Å; S377-L379 PolarHBondContact O-N 3.03Å; L379-S381 VanDerWaalsContact C-N 3.33Å; L379-S381 PolarHBondContact O-N 3.3Å; L379-C382 PolarHBondContact O-N 3.14Å; L379-L383 HydrophobicContact CD1-CD1 3.94Å; L379-L383 HydrophobicContact CD1-CG 4.11Å; L379-L383 HydrophobicContact CG-CD1 3.95Å; L379-L383 HydrophobicContact CG-CG 4.47Å; L379-L383 WeakPolarHBondContact O-CB 3.48Å; L379-L383 VanDerWaalsContact O-CG 3.27Å; L379-L383 WeakPolarHBondContact O-CG 3.34Å; L379-L383 PolarHBondContact O-N 3.25Å
380	W	91.9	Very high	91.8	Very high	42 Å²	42	32.1 Å²	32.1	16%	0.159	17%	0.171	C	C	.	.	H	α-helix	trans	-62.1	-41.3	178.4	-63.6	111.5	0	0	0	111.9	I252 L253 R256 V371 P375 L376 S377 F384	I252-W380 HydrophobicContact CG2-CH2 4.19Å; I252-W380 HydrophobicContact CG2-CZ3 3.82Å; L253-W380 HydrophobicContact CD2-CE3 4.07Å; L253-W380 HydrophobicContact CD2-CZ3 4.2Å; R256-W380 HydrophobicContact CB-CH2 3.98Å; R256-W380 HydrophobicContact CB-CZ3 4.27Å; R256-W380 HydrophobicContact CG-CH2 3.81Å; R256-W380 HydrophobicContact CG-CZ2 4.04Å; R256-W380 HydrophobicContact CG-CZ3 4.2Å; V371-W380 HydrophobicContact CG1-CB 3.91Å; V371-W380 HydrophobicContact CG2-CB 4.22Å; P375-W380 VanDerWaalsContact O-CD1 3.24Å; P375-W380 PolarHBondContact O-NE1 3.37Å; L376-W380 VanDerWaalsContact O-CD1 3.23Å; L376-W380 PolarHBondContact O-N 3.26Å; S377-W380 PolarHBondContact O-N 2.99Å; W380-F384 WeakPolarHBondContact O-CB 3.19Å; W380-F384 PolarHBondContact O-N 3.04Å
381	S	94.3	Very high	92.1	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.007	17%	0.171	C	C	.	.	H	α-helix	trans	-60.4	-53.4	175.9	-171	0	0	0	0	111.4	S147 W154 S377 Q378 L379 L383 F384 F385	S147-S381 PolarHBondContact OG-OG 3.35Å; W154-S381 VanDerWaalsContact CZ2-OG 3.27Å; W154-S381 WeakPolarHBondContact CZ2-OG 3.45Å; S377-S381 WeakPolarHBondContact O-CB 3.38Å; S377-S381 PolarHBondContact O-N 2.97Å; Q378-S381 PolarHBondContact O-N 3.41Å; L379-S381 VanDerWaalsContact C-N 3.33Å; L379-S381 PolarHBondContact O-N 3.3Å; S381-L383 PolarHBondContact O-N 3.14Å; S381-F384 PolarHBondContact O-N 3.31Å; S381-F385 WeakPolarHBondContact O-CD2 3.18Å; S381-F385 PolarHBondContact O-N 3.47Å; S381-F385 WeakPolarHBondContact OG-CD2 3.23Å; S381-F385 WeakPolarHBondContact OG-CE2 3.47Å
382	C	94.8	Very high	92.3	Very high	18 Å²	18	31.9 Å²	31.9	12%	0.122	17%	0.169	C	C	.	.	H	α-helix	trans	-57.7	-48	179	-73	0	0	0	0	111.9	L144 S147 Q378 L379 F384 F385 I386	L144-C382 HydrophobicContact CD1-CB 4.28Å; S147-C382 VanDerWaalsContact CB-SG 3.52Å; Q378-C382 WeakPolarHBondContact O-CB 3.41Å; Q378-C382 PolarHBondContact O-N 3.39Å; Q378-C382 PolarHBondContact O-SG 2.85Å; Q378-C382 VanDerWaalsContact O-SG 3.36Å; L379-C382 PolarHBondContact O-N 3.14Å; C382-F384 VanDerWaalsContact C-N 3.34Å; C382-F384 PolarHBondContact O-N 3.39Å; C382-F385 PolarHBondContact O-N 3.21Å; C382-I386 WeakPolarHBondContact O-CB 3.44Å; C382-I386 WeakPolarHBondContact O-CD1 3.35Å; C382-I386 WeakPolarHBondContact O-CG1 3.21Å; C382-I386 PolarHBondContact O-N 3.31Å
383	L	93.4	Very high	92.6	Very high	42 Å²	42	31.2 Å²	31.2	22%	0.22	16%	0.164	C	C	.	.	H	α-helix	trans	-63.8	-39.7	-179.9	-70.2	175.7	0	0	0	112.4	F245 M249 L379 S381 M387	F245-L383 HydrophobicContact CZ-CD2 4.37Å; M249-L383 HydrophobicContact CE-CB 3.54Å; M249-L383 HydrophobicContact CE-CD1 4.15Å; M249-L383 HydrophobicContact CE-CG 4.35Å; M249-L383 HydrophobicContact SD-CB 3.91Å; M249-L383 HydrophobicContact SD-CD1 4.23Å; M249-L383 HydrophobicContact SD-CD2 4.05Å; M249-L383 HydrophobicContact SD-CG 4.3Å; L379-L383 HydrophobicContact CD1-CD1 3.94Å; L379-L383 HydrophobicContact CD1-CG 4.11Å; L379-L383 HydrophobicContact CG-CD1 3.95Å; L379-L383 HydrophobicContact CG-CG 4.47Å; L379-L383 WeakPolarHBondContact O-CB 3.48Å; L379-L383 VanDerWaalsContact O-CG 3.27Å; L379-L383 WeakPolarHBondContact O-CG 3.34Å; L379-L383 PolarHBondContact O-N 3.25Å; S381-L383 PolarHBondContact O-N 3.14Å; L383-M387 WeakPolarHBondContact O-CB 3.21Å; L383-M387 PolarHBondContact O-N 2.99Å
384	F	92.8	Very high	93	Very high	5 Å²	5	29.7 Å²	29.7	2%	0.022	16%	0.157	C	C	.	.	H	α-helix	trans	-65.5	-47.8	177.4	176.3	-103.4	0	0	0	111.9	L253 A363 F367 W380 S381 C382 M387 L388	L253-F384 HydrophobicContact CD1-CD2 4.39Å; A363-F384 HydrophobicContact CB-CZ 4.32Å; A363-F384 WeakPolarHBondContact O-CE1 3.33Å; F367-F384 HydrophobicContact CB-CE1 3.79Å; F367-F384 HydrophobicContact CB-CE2 4.11Å; F367-F384 HydrophobicContact CB-CZ 3.53Å; F367-F384 HydrophobicContact CD1-CD2 4.32Å; F367-F384 AromaticContact CD1-CE2 3.74Å; F367-F384 HydrophobicContact CD1-CE2 3.74Å; F367-F384 HydrophobicContact CD1-CZ 4.04Å; F367-F384 AromaticContact CD2-CE2 3.95Å; F367-F384 HydrophobicContact CD2-CE2 3.95Å; F367-F384 AromaticContact CD2-CZ 3.68Å; F367-F384 HydrophobicContact CD2-CZ 3.68Å; F367-F384 HydrophobicContact CE1-CE2 4.05Å; F367-F384 HydrophobicContact CE2-CE2 4.27Å; F367-F384 HydrophobicContact CE2-CZ 4.37Å; F367-F384 HydrophobicContact CG-CE1 4.26Å; F367-F384 AromaticContact CG-CE2 3.68Å; F367-F384 HydrophobicContact CG-CE2 3.68Å; F367-F384 AromaticContact CG-CZ 3.49Å; F367-F384 HydrophobicContact CG-CZ 3.49Å; F367-F384 VanDerWaalsContact CG-CZ 3.49Å; F367-F384 HydrophobicContact CZ-CE2 4.31Å; W380-F384 WeakPolarHBondContact O-CB 3.19Å; W380-F384 PolarHBondContact O-N 3.04Å; S381-F384 PolarHBondContact O-N 3.31Å; C382-F384 VanDerWaalsContact C-N 3.34Å; C382-F384 PolarHBondContact O-N 3.39Å; F384-M387 HydrophobicContact CD2-CE 3.73Å; F384-M387 HydrophobicContact CE2-CE 3.88Å; F384-M387 WeakPolarHBondContact O-CB 3.28Å; F384-M387 PolarHBondContact O-N 3.02Å; F384-L388 HydrophobicContact CD1-CD1 3.98Å; F384-L388 HydrophobicContact CD1-CG 4.42Å; F384-L388 HydrophobicContact CE1-CD1 3.34Å; F384-L388 HydrophobicContact CE1-CG 4.03Å; F384-L388 HydrophobicContact CE2-CD1 4.47Å; F384-L388 HydrophobicContact CE2-CD2 4.43Å; F384-L388 HydrophobicContact CE2-CG 4.39Å; F384-L388 HydrophobicContact CZ-CD1 3.63Å; F384-L388 HydrophobicContact CZ-CD2 4.14Å; F384-L388 HydrophobicContact CZ-CG 4Å; F384-L388 WeakPolarHBondContact O-CG 3.32Å; F384-L388 PolarHBondContact O-N 3.22Å
385	F	95.6	Very high	93.5	Very high	1 Å²	1	29.6 Å²	29.6	0%	0.004	16%	0.157	C	C	.	.	H	α-helix	trans	-70.9	-31.4	179.4	-71.5	-64.7	0	0	0	113	A140 Y143 L144 W154 F364 P368 S381 C382 L388 I389	A140-F385 HydrophobicContact CB-CD1 4.44Å; Y143-F385 VanDerWaalsContact CB-CE1 3.4Å; Y143-F385 AromaticContact CD1-CE1 3.94Å; Y143-F385 HydrophobicContact CD1-CE1 3.94Å; Y143-F385 AromaticContact CD1-CE2 3.67Å; Y143-F385 HydrophobicContact CD1-CE2 3.67Å; Y143-F385 AromaticContact CD1-CZ 3.22Å; Y143-F385 HydrophobicContact CD1-CZ 3.22Å; Y143-F385 HydrophobicContact CD2-CE1 4.29Å; Y143-F385 HydrophobicContact CD2-CZ 4.37Å; Y143-F385 HydrophobicContact CE1-CZ 4.06Å; Y143-F385 HydrophobicContact CG-CD1 4.33Å; Y143-F385 AromaticContact CG-CE1 3.63Å; Y143-F385 HydrophobicContact CG-CE1 3.63Å; Y143-F385 AromaticContact CG-CE2 3.97Å; Y143-F385 HydrophobicContact CG-CE2 3.97Å; Y143-F385 AromaticContact CG-CZ 3.41Å; Y143-F385 HydrophobicContact CG-CZ 3.41Å; Y143-F385 VanDerWaalsContact CG-CZ 3.41Å; L144-F385 HydrophobicContact CB-CB 4.08Å; W154-F385 HydrophobicContact CH2-CE2 4.18Å; W154-F385 HydrophobicContact CZ2-CE2 4.26Å; F364-F385 AromaticContact CD1-CE1 3.83Å; F364-F385 HydrophobicContact CD1-CE1 3.83Å; F364-F385 HydrophobicContact CE1-CD1 4.37Å; F364-F385 AromaticContact CE1-CE1 3.83Å; F364-F385 HydrophobicContact CE1-CE1 3.83Å; P368-F385 HydrophobicContact CG-CE2 4.44Å; P368-F385 HydrophobicContact CG-CZ 3.77Å; S381-F385 WeakPolarHBondContact O-CD2 3.18Å; S381-F385 PolarHBondContact O-N 3.47Å; S381-F385 WeakPolarHBondContact OG-CD2 3.23Å; S381-F385 WeakPolarHBondContact OG-CE2 3.47Å; C382-F385 PolarHBondContact O-N 3.21Å; F385-L388 HydrophobicContact CD1-CD1 3.82Å; F385-L388 HydrophobicContact CE1-CD1 4.01Å; F385-L388 PolarHBondContact O-N 2.89Å; F385-I389 WeakPolarHBondContact O-CD1 3.37Å; F385-I389 VanDerWaalsContact O-CG1 3.23Å; F385-I389 WeakPolarHBondContact O-CG1 3.46Å; F385-I389 PolarHBondContact O-N 3.04Å
386	I	95.5	Very high	93.9	Very high	47 Å²	47	25.5 Å²	25.5	24%	0.241	13%	0.13	C	C	.	.	H	α-helix	trans	-62.5	-44.1	168.9	-70.2	166.9	0	0	0	110.6	L144 F245 C382 L388 I389 F390	L144-I386 HydrophobicContact CD1-CD1 4.35Å; L144-I386 HydrophobicContact CD1-CG1 3.92Å; L144-I386 HydrophobicContact CD2-CG1 4.07Å; F245-I386 HydrophobicContact CD1-CG2 4.3Å; F245-I386 HydrophobicContact CE1-CB 4.36Å; F245-I386 HydrophobicContact CE1-CG2 3.61Å; F245-I386 HydrophobicContact CZ-CG2 3.93Å; C382-I386 WeakPolarHBondContact O-CB 3.44Å; C382-I386 WeakPolarHBondContact O-CD1 3.35Å; C382-I386 WeakPolarHBondContact O-CG1 3.21Å; C382-I386 PolarHBondContact O-N 3.31Å; I386-L388 PolarHBondContact O-N 2.84Å; I386-I389 PolarHBondContact O-N 3.26Å; I386-F390 HydrophobicContact CG2-CD2 3.97Å; I386-F390 HydrophobicContact CG2-CE2 3.43Å; I386-F390 VanDerWaalsContact CG2-CE2 3.43Å; I386-F390 HydrophobicContact CG2-CZ 3.77Å; I386-F390 PolarHBondContact O-N 2.89Å
387	M	94.1	Very high	94	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-59	-46.3	174.7	177.7	-172.4	76.8	0	0	111.5	F245 P246 M249 L250 L253 L383 F384 I389 F390 L391	F245-M387 HydrophobicContact CE1-CB 4.43Å; P246-M387 HydrophobicContact CB-CG 4.05Å; M249-M387 HydrophobicContact CB-CB 4.16Å; M249-M387 HydrophobicContact CB-CG 4.03Å; M249-M387 HydrophobicContact CB-SD 3.62Å; M249-M387 HydrophobicContact CG-CB 4.21Å; L250-M387 HydrophobicContact CD2-SD 4.46Å; L250-M387 HydrophobicContact CG-SD 4.44Å; L253-M387 HydrophobicContact CD1-CE 4.08Å; L253-M387 HydrophobicContact CD1-SD 4.17Å; L383-M387 WeakPolarHBondContact O-CB 3.21Å; L383-M387 PolarHBondContact O-N 2.99Å; F384-M387 HydrophobicContact CD2-CE 3.73Å; F384-M387 HydrophobicContact CE2-CE 3.88Å; F384-M387 WeakPolarHBondContact O-CB 3.28Å; F384-M387 PolarHBondContact O-N 3.02Å; M387-I389 VanDerWaalsContact C-N 3.33Å; M387-I389 PolarHBondContact O-N 3.15Å; M387-F390 PolarHBondContact O-N 3.21Å; M387-L391 HydrophobicContact CG-CD1 4.03Å; M387-L391 HydrophobicContact CG-CG 4.46Å; M387-L391 WeakPolarHBondContact O-CG 3.38Å; M387-L391 PolarHBondContact O-N 3.1Å
388	L	94.2	Very high	94.1	Very high	6 Å²	6	18.9 Å²	18.9	3%	0.031	10%	0.095	C	C	.	.	H	α-helix	trans	-61.9	-40	177.1	-70.1	-178.1	0	0	0	112.3	L56 A140 A363 F384 F385 I386 G392	L56-L388 HydrophobicContact CD2-CB 4.34Å; L56-L388 HydrophobicContact CD2-CD2 3.54Å; A140-L388 HydrophobicContact CB-CB 4.29Å; A363-L388 HydrophobicContact CB-CD1 4.01Å; F384-L388 HydrophobicContact CD1-CD1 3.98Å; F384-L388 HydrophobicContact CD1-CG 4.42Å; F384-L388 HydrophobicContact CE1-CD1 3.34Å; F384-L388 HydrophobicContact CE1-CG 4.03Å; F384-L388 HydrophobicContact CE2-CD1 4.47Å; F384-L388 HydrophobicContact CE2-CD2 4.43Å; F384-L388 HydrophobicContact CE2-CG 4.39Å; F384-L388 HydrophobicContact CZ-CD1 3.63Å; F384-L388 HydrophobicContact CZ-CD2 4.14Å; F384-L388 HydrophobicContact CZ-CG 4Å; F384-L388 WeakPolarHBondContact O-CG 3.32Å; F384-L388 PolarHBondContact O-N 3.22Å; F385-L388 HydrophobicContact CD1-CD1 3.82Å; F385-L388 HydrophobicContact CE1-CD1 4.01Å; F385-L388 PolarHBondContact O-N 2.89Å; I386-L388 PolarHBondContact O-N 2.84Å; L388-G392 PolarHBondContact O-N 3.44Å
389	I	96.2	Very high	94.2	Very high	15 Å²	15	16.3 Å²	16.3	8%	0.077	8%	0.083	C	C	.	.	H	α-helix	trans	-61.7	-46.1	176.2	-71.3	160.4	0	0	0	110.3	A140 L141 L144 F385 I386 M387 G392 L393	A140-I389 HydrophobicContact CB-CD1 4.47Å; A140-I389 HydrophobicContact CB-CG1 3.71Å; L141-I389 HydrophobicContact CD2-CD1 3.72Å; L141-I389 HydrophobicContact CD2-CG1 4.46Å; L141-I389 HydrophobicContact CG-CD1 4.09Å; L141-I389 HydrophobicContact CG-CG1 4.42Å; L144-I389 HydrophobicContact CB-CD1 4.27Å; L144-I389 HydrophobicContact CD2-CD1 3.6Å; F385-I389 WeakPolarHBondContact O-CD1 3.37Å; F385-I389 VanDerWaalsContact O-CG1 3.23Å; F385-I389 WeakPolarHBondContact O-CG1 3.46Å; F385-I389 PolarHBondContact O-N 3.04Å; I386-I389 PolarHBondContact O-N 3.26Å; M387-I389 VanDerWaalsContact C-N 3.33Å; M387-I389 PolarHBondContact O-N 3.15Å; I389-G392 PolarHBondContact O-N 2.87Å; I389-L393 WeakPolarHBondContact O-CB 3.23Å; I389-L393 PolarHBondContact O-N 2.92Å
390	F	95.8	Very high	94.3	Very high	36 Å²	36	11.8 Å²	11.8	16%	0.158	6%	0.059	C	C	.	.	H	α-helix	trans	-69	-41.9	180	-64.7	-24.5	0	0	0	113.1	F241 T242 F245 P246 I386 M387 G392 L393 D394	F241-F390 HydrophobicContact CD1-CE2 4.1Å; F241-F390 HydrophobicContact CD1-CZ 4.13Å; F241-F390 HydrophobicContact CE1-CD2 4.39Å; F241-F390 HydrophobicContact CE1-CE1 4.46Å; F241-F390 AromaticContact CE1-CE2 3.4Å; F241-F390 HydrophobicContact CE1-CE2 3.4Å; F241-F390 VanDerWaalsContact CE1-CE2 3.4Å; F241-F390 AromaticContact CE1-CZ 3.47Å; F241-F390 HydrophobicContact CE1-CZ 3.47Å; F241-F390 VanDerWaalsContact CE1-CZ 3.47Å; F241-F390 HydrophobicContact CZ-CE2 4.06Å; F241-F390 HydrophobicContact CZ-CZ 4.41Å; T242-F390 HydrophobicContact CG2-CD1 3.89Å; T242-F390 HydrophobicContact CG2-CE1 4.29Å; T242-F390 HydrophobicContact CG2-CG 4.27Å; F245-F390 HydrophobicContact CB-CD2 3.89Å; F245-F390 HydrophobicContact CB-CE2 4.21Å; F245-F390 AromaticContact CD1-CD2 3.5Å; F245-F390 HydrophobicContact CD1-CD2 3.5Å; F245-F390 VanDerWaalsContact CD1-CD2 3.5Å; F245-F390 AromaticContact CD1-CE2 3.79Å; F245-F390 HydrophobicContact CD1-CE2 3.79Å; F245-F390 HydrophobicContact CD2-CE2 4.49Å; F245-F390 HydrophobicContact CE1-CD2 4.23Å; F245-F390 HydrophobicContact CE1-CE2 4.26Å; F245-F390 AromaticContact CG-CD2 3.83Å; F245-F390 HydrophobicContact CG-CD2 3.83Å; F245-F390 AromaticContact CG-CE2 3.91Å; F245-F390 HydrophobicContact CG-CE2 3.91Å; P246-F390 HydrophobicContact CG-CB 4.16Å; I386-F390 HydrophobicContact CG2-CD2 3.97Å; I386-F390 HydrophobicContact CG2-CE2 3.43Å; I386-F390 VanDerWaalsContact CG2-CE2 3.43Å; I386-F390 HydrophobicContact CG2-CZ 3.77Å; I386-F390 PolarHBondContact O-N 2.89Å; M387-F390 PolarHBondContact O-N 3.21Å; F390-G392 VanDerWaalsContact C-N 3.26Å; F390-G392 PolarHBondContact O-N 3.39Å; F390-L393 PolarHBondContact O-N 2.64Å; F390-D394 WeakPolarHBondContact O-CB 3.13Å; F390-D394 PolarHBondContact O-N 3.3Å
391	L	93.8	Very high	94.4	Very high	5 Å²	5	9.9 Å²	9.9	3%	0.026	5%	0.052	C	C	.	.	H	α-helix	trans	-58.7	-38.5	172.7	-73.3	173.1	0	0	0	112.2	I54 L56 V59 P246 M387 S395	I54-L391 HydrophobicContact CG2-CD2 4.47Å; I54-L391 WeakPolarHBondContact O-CD2 3.43Å; L56-L391 HydrophobicContact CD2-CB 4.21Å; V59-L391 HydrophobicContact CG2-CD1 3.9Å; P246-L391 HydrophobicContact CB-CD1 4.41Å; P246-L391 HydrophobicContact CB-CD2 3.58Å; P246-L391 HydrophobicContact CB-CG 3.83Å; P246-L391 HydrophobicContact CG-CD2 3.78Å; P246-L391 HydrophobicContact CG-CG 3.85Å; M387-L391 HydrophobicContact CG-CD1 4.03Å; M387-L391 HydrophobicContact CG-CG 4.46Å; M387-L391 WeakPolarHBondContact O-CG 3.38Å; M387-L391 PolarHBondContact O-N 3.1Å; L391-S395 PolarHBondContact O-OG 3.26Å
392	G	95	Very high	94.3	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-75.1	-40.9	177.3	0	0	0	0	0	113	Y133 L388 I389 F390 D394 S395 Q396	Y133-G392 WeakPolarHBondContact CE1-O 3.43Å; L388-G392 PolarHBondContact O-N 3.44Å; I389-G392 PolarHBondContact O-N 2.87Å; F390-G392 VanDerWaalsContact C-N 3.26Å; F390-G392 PolarHBondContact O-N 3.39Å; G392-D394 VanDerWaalsContact C-N 3.27Å; G392-D394 PolarHBondContact O-N 2.84Å; G392-S395 PolarHBondContact O-N 3.36Å; G392-Q396 WeakPolarHBondContact O-CB 3.45Å; G392-Q396 PolarHBondContact O-N 3.48Å
393	L	95	Very high	94.3	Very high	9 Å²	9	10 Å²	10	5%	0.047	5%	0.052	C	C	.	.	H	α-helix	trans	-64.1	-37.5	-178.9	-169	73.7	0	0	0	111	L137 I223 C224 T242 I389 F390 Q396 F397	L137-L393 HydrophobicContact CD2-CB 4.19Å; L137-L393 HydrophobicContact CD2-CD1 4.01Å; I223-L393 HydrophobicContact CG2-CD1 3.84Å; I223-L393 HydrophobicContact CG2-CD2 3.94Å; C224-L393 HydrophobicContact CB-CD1 4.45Å; T242-L393 HydrophobicContact CG2-CD2 4.31Å; I389-L393 WeakPolarHBondContact O-CB 3.23Å; I389-L393 PolarHBondContact O-N 2.92Å; F390-L393 PolarHBondContact O-N 2.64Å; L393-Q396 PolarHBondContact O-N 2.9Å; L393-F397 WeakPolarHBondContact O-CB 3.44Å; L393-F397 WeakPolarHBondContact O-CD1 3.17Å; L393-F397 PolarHBondContact O-N 3.16Å
394	D	94	Very high	94.3	Very high	3 Å²	3	8 Å²	8	2%	0.016	4%	0.041	C	C	.	.	H	α-helix	trans	-70.8	-30.3	179.2	-74.8	-11.1	0	0	0	113.7	G51 T242 A243 F390 G392 F397	G51-D394 CarbonylContact O-C 3.24Å; G51-D394 WeakPolarHBondContact O-CB 3.3Å; T242-D394 WeakPolarHBondContact CB-OD1 2.98Å; T242-D394 PolarHBondContact OG1-OD1 3.42Å; T242-D394 PolarHBondContact OG1-OD2 3.19Å; A243-D394 WeakPolarHBondContact CA-OD2 3.43Å; A243-D394 WeakPolarHBondContact CB-OD2 3.4Å; A243-D394 PolarHBondContact N-OD2 2.87Å; F390-D394 WeakPolarHBondContact O-CB 3.13Å; F390-D394 PolarHBondContact O-N 3.3Å; G392-D394 VanDerWaalsContact C-N 3.27Å; G392-D394 PolarHBondContact O-N 2.84Å; D394-F397 VanDerWaalsContact C-CE1 3.41Å; D394-F397 HydrophobicContact CB-CD1 4.43Å; D394-F397 HydrophobicContact CB-CE1 3.91Å; D394-F397 WeakPolarHBondContact O-CD1 3.48Å; D394-F397 WeakPolarHBondContact O-CE1 3.38Å
395	S	94.3	Very high	94.4	Very high	9 Å²	9	7.9 Å²	7.9	6%	0.063	4%	0.041	C	C	.	.	H	α-helix	trans	-76.3	-41.3	168.9	-43.3	0	0	0	0	110.7	E52 Y133 L391 G392 F397 V398 C399	E52-S395 PolarHBondContact O-OG 3.22Å; E52-S395 VanDerWaalsContact OE2-CA 3.27Å; E52-S395 WeakPolarHBondContact OE2-CA 3.31Å; Y133-S395 PolarHBondContact OH-OG 3Å; L391-S395 PolarHBondContact O-OG 3.26Å; G392-S395 PolarHBondContact O-N 3.36Å; S395-F397 PolarHBondContact O-N 2.92Å; S395-V398 PolarHBondContact O-N 3.46Å; S395-C399 PolarHBondContact O-N 3.49Å; S395-C399 PolarHBondContact O-SG 3.26Å
396	Q	95.8	Very high	94.3	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-62.3	-45.2	-173.7	-173.7	64.6	23.7	0	0	112.9	N130 I134 G392 L393 V398 C399 V400	N130-Q396 PolarHBondContact O-NE2 3.38Å; N130-Q396 PolarHBondContact OD1-NE2 3.49Å; I134-Q396 HydrophobicContact CB-CG 4.26Å; I134-Q396 HydrophobicContact CD1-CG 4.03Å; I134-Q396 HydrophobicContact CG1-CG 4.1Å; G392-Q396 WeakPolarHBondContact O-CB 3.45Å; G392-Q396 PolarHBondContact O-N 3.48Å; L393-Q396 PolarHBondContact O-N 2.9Å; Q396-V398 VanDerWaalsContact C-N 3.3Å; Q396-V398 PolarHBondContact O-N 3.32Å; Q396-C399 WeakPolarHBondContact O-CB 3.38Å; Q396-C399 PolarHBondContact O-N 2.91Å; Q396-V400 WeakPolarHBondContact O-CG2 3.42Å; Q396-V400 PolarHBondContact O-N 2.99Å
397	F	91.1	Very high	94.2	Very high	1 Å²	1	7.1 Å²	7.1	0%	0.004	4%	0.04	C	C	.	.	H	α-helix	trans	-68.7	-29.6	-176.2	86.8	-53.5	0	0	0	112.4	I228 T235 V239 L393 D394 S395 E401	I228-F397 HydrophobicContact CG2-CB 3.5Å; I228-F397 VanDerWaalsContact CG2-CB 3.5Å; I228-F397 HydrophobicContact CG2-CD2 3.98Å; I228-F397 HydrophobicContact CG2-CG 4.2Å; T235-F397 HydrophobicContact CG2-CD2 3.6Å; T235-F397 HydrophobicContact CG2-CE2 3.09Å; T235-F397 HydrophobicContact CG2-CZ 3.88Å; V239-F397 HydrophobicContact CG1-CE1 4.14Å; V239-F397 HydrophobicContact CG1-CE2 3.49Å; V239-F397 VanDerWaalsContact CG1-CE2 3.49Å; V239-F397 HydrophobicContact CG1-CZ 3.09Å; L393-F397 WeakPolarHBondContact O-CB 3.44Å; L393-F397 WeakPolarHBondContact O-CD1 3.17Å; L393-F397 PolarHBondContact O-N 3.16Å; D394-F397 VanDerWaalsContact C-CE1 3.41Å; D394-F397 HydrophobicContact CB-CD1 4.43Å; D394-F397 HydrophobicContact CB-CE1 3.91Å; D394-F397 WeakPolarHBondContact O-CD1 3.48Å; D394-F397 WeakPolarHBondContact O-CE1 3.38Å; S395-F397 PolarHBondContact O-N 2.92Å; F397-E401 WeakPolarHBondContact O-CB 3.47Å; F397-E401 PolarHBondContact O-N 3.07Å
398	V	93.7	Very high	94.1	Very high	2 Å²	2	7.8 Å²	7.8	1%	0.012	4%	0.044	C	C	.	.	H	α-helix	trans	-73.8	-41.6	172.1	169.9	0	0	0	0	111.3	E52 C301 L305 S395 Q396 V400 E401 C402	E52-V398 HydrophobicContact CB-CB 4.16Å; E52-V398 HydrophobicContact CB-CG1 3.97Å; E52-V398 HydrophobicContact CB-CG2 4.13Å; E52-V398 HydrophobicContact CG-CB 4.39Å; E52-V398 HydrophobicContact CG-CG1 3.83Å; E52-V398 WeakPolarHBondContact OE2-CB 3.1Å; C301-V398 HydrophobicContact CB-CG1 3.89Å; L305-V398 HydrophobicContact CD1-CG1 3.76Å; L305-V398 HydrophobicContact CD1-CG2 4.28Å; L305-V398 HydrophobicContact CD2-CG1 4.26Å; L305-V398 HydrophobicContact CD2-CG2 4.32Å; L305-V398 HydrophobicContact CG-CG1 4.12Å; S395-V398 PolarHBondContact O-N 3.46Å; Q396-V398 VanDerWaalsContact C-N 3.3Å; Q396-V398 PolarHBondContact O-N 3.32Å; V398-V400 VanDerWaalsContact C-N 3.3Å; V398-V400 PolarHBondContact O-N 2.95Å; V398-E401 PolarHBondContact O-N 3Å; V398-E401 VanDerWaalsContact O-N 3.16Å; V398-C402 WeakPolarHBondContact O-CB 3.37Å; V398-C402 PolarHBondContact O-N 3.16Å
399	C	94.5	Very high	93.9	Very high	4 Å²	4	7.8 Å²	7.8	3%	0.027	4%	0.044	C	C	.	.	H	α-helix	trans	-56	-44.7	173.3	-66.8	0	0	0	0	111.4	E126 N130 S395 Q396 C402 L403	E126-C399 WeakPolarHBondContact OE2-CA 3.23Å; E126-C399 WeakPolarHBondContact OE2-CB 3.5Å; N130-C399 PolarHBondContact ND2-O 2.9Å; N130-C399 VanDerWaalsContact ND2-O 3.11Å; S395-C399 PolarHBondContact O-N 3.49Å; S395-C399 PolarHBondContact O-SG 3.26Å; Q396-C399 WeakPolarHBondContact O-CB 3.38Å; Q396-C399 PolarHBondContact O-N 2.91Å; C399-C402 PolarHBondContact O-N 2.58Å; C399-L403 PolarHBondContact O-N 3.27Å
400	V	95.3	Very high	93.6	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-67.8	-43	176.6	-175.7	0	0	0	0	110.8	N130 W221 I228 Q396 V398 C402 L403 V404 I428	N130-V400 WeakPolarHBondContact OD1-CA 3.31Å; N130-V400 WeakPolarHBondContact OD1-CG2 3.44Å; N130-V400 PolarHBondContact OD1-N 3.18Å; W221-V400 HydrophobicContact CH2-CG2 4.31Å; W221-V400 HydrophobicContact CZ3-CG2 3.95Å; I228-V400 HydrophobicContact CD1-CB 3.61Å; I228-V400 HydrophobicContact CD1-CG1 3.25Å; I228-V400 HydrophobicContact CD1-CG2 4.34Å; Q396-V400 WeakPolarHBondContact O-CG2 3.42Å; Q396-V400 PolarHBondContact O-N 2.99Å; V398-V400 VanDerWaalsContact C-N 3.3Å; V398-V400 PolarHBondContact O-N 2.95Å; V400-C402 VanDerWaalsContact C-N 3.29Å; V400-C402 PolarHBondContact O-N 2.91Å; V400-L403 PolarHBondContact O-N 3.08Å; V400-V404 HydrophobicContact CG1-CG2 4.09Å; V400-V404 WeakPolarHBondContact O-CB 3.2Å; V400-V404 WeakPolarHBondContact O-CG2 3.48Å; V400-V404 PolarHBondContact O-N 3.2Å; V400-I428 HydrophobicContact CG1-CG2 4.34Å
401	E	92.8	Very high	93.3	Very high	2 Å²	2	13.1 Å²	13.1	1%	0.009	7%	0.068	C	C	.	.	H	α-helix	trans	-58.1	-42.9	177.4	-171.4	67.7	-151.6	0	0	110.9	F397 V398 L403 V404 T405 R421	F397-E401 WeakPolarHBondContact O-CB 3.47Å; F397-E401 PolarHBondContact O-N 3.07Å; V398-E401 PolarHBondContact O-N 3Å; V398-E401 VanDerWaalsContact O-N 3.16Å; E401-L403 PolarHBondContact O-N 3.38Å; E401-V404 PolarHBondContact O-N 2.91Å; E401-T405 WeakPolarHBondContact O-CB 3.44Å; E401-T405 PolarHBondContact O-N 3.38Å; E401-T405 PolarHBondContact O-OG1 2.93Å; E401-R421 IonicContact OE1-CZ 3.16Å; E401-R421 IonicContact OE1-NH2 2.95Å; E401-R421 PolarHBondContact OE1-NH2 3.17Å; E401-R421 IonicContact OE2-CZ 3.65Å; E401-R421 IonicContact OE2-NH2 3.95Å; E401-R421 PolarHBondContact OE2-NH2 3.2Å
402	C	93.3	Very high	93	Very high	2 Å²	2	15 Å²	15	1%	0.014	8%	0.081	C	C	.	.	H	α-helix	trans	-56.3	-49.5	177.3	-176	0	0	0	0	111.9	E126 G300 A304 V398 C399 V400 V404 T405 A406	E126-C402 HydrophobicContact CG-CB 4.43Å; G300-C402 PolarHBondContact O-SG 3.17Å; A304-C402 HydrophobicContact CB-CB 4.34Å; V398-C402 WeakPolarHBondContact O-CB 3.37Å; V398-C402 PolarHBondContact O-N 3.16Å; C399-C402 PolarHBondContact O-N 2.58Å; V400-C402 VanDerWaalsContact C-N 3.29Å; V400-C402 PolarHBondContact O-N 2.91Å; C402-V404 VanDerWaalsContact C-N 3.35Å; C402-V404 PolarHBondContact O-N 3.19Å; C402-T405 PolarHBondContact O-N 3.1Å; C402-A406 WeakPolarHBondContact O-CB 3.39Å; C402-A406 PolarHBondContact O-N 3.1Å
403	L	94.3	Very high	92.5	Very high	20 Å²	20	21.6 Å²	21.6	11%	0.105	11%	0.106	C	C	.	.	H	α-helix	trans	-64.4	-40.3	179.4	-172.7	62.3	0	0	0	112	V123 C399 V400 E401 S407 I428	V123-L403 HydrophobicContact CG1-CD1 3.71Å; C399-L403 PolarHBondContact O-N 3.27Å; V400-L403 PolarHBondContact O-N 3.08Å; E401-L403 PolarHBondContact O-N 3.38Å; L403-S407 WeakPolarHBondContact O-CB 3.37Å; L403-S407 PolarHBondContact O-N 2.89Å; L403-S407 PolarHBondContact O-OG 3.05Å; L403-I428 HydrophobicContact CD2-CD1 4Å; L403-I428 HydrophobicContact CD2-CG1 4.25Å; L403-I428 HydrophobicContact CD2-CG2 3.86Å; L403-I428 HydrophobicContact CG-CD1 4.1Å
404	V	94	Very high	92.2	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-65	-48.9	176.4	170.9	0	0	0	0	110.4	V400 E401 C402 A406 S407 V408 R421 L424 I425 I428	V400-V404 HydrophobicContact CG1-CG2 4.09Å; V400-V404 WeakPolarHBondContact O-CB 3.2Å; V400-V404 WeakPolarHBondContact O-CG2 3.48Å; V400-V404 PolarHBondContact O-N 3.2Å; E401-V404 PolarHBondContact O-N 2.91Å; C402-V404 VanDerWaalsContact C-N 3.35Å; C402-V404 PolarHBondContact O-N 3.19Å; V404-A406 PolarHBondContact O-N 3.44Å; V404-S407 PolarHBondContact O-N 2.94Å; V404-V408 HydrophobicContact CG1-CG2 4.04Å; V404-V408 VanDerWaalsContact O-CB 3.32Å; V404-V408 WeakPolarHBondContact O-CB 3.32Å; V404-V408 WeakPolarHBondContact O-CG2 3.34Å; V404-V408 PolarHBondContact O-N 3.35Å; V404-R421 HydrophobicContact CG1-CG 4.1Å; V404-L424 HydrophobicContact CG1-CD2 4.24Å; V404-I425 HydrophobicContact CG1-CG1 4.23Å; V404-I425 HydrophobicContact CG2-CD1 4.46Å; V404-I425 HydrophobicContact CG2-CG1 3.53Å; V404-I428 HydrophobicContact CG2-CD1 3.74Å
405	T	93.5	Very high	91.9	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-59.6	-46.3	178.7	-59.8	0	0	0	0	111	A304 Y308 E401 C402 S407 V408 D409	A304-T405 HydrophobicContact CB-CG2 4.28Å; Y308-T405 HydrophobicContact CE2-CG2 4.1Å; Y308-T405 PolarHBondContact OH-OG1 3.13Å; E401-T405 WeakPolarHBondContact O-CB 3.44Å; E401-T405 PolarHBondContact O-N 3.38Å; E401-T405 PolarHBondContact O-OG1 2.93Å; C402-T405 PolarHBondContact O-N 3.1Å; T405-S407 VanDerWaalsContact C-N 3.34Å; T405-S407 PolarHBondContact O-N 3.34Å; T405-V408 PolarHBondContact O-N 3.44Å; T405-D409 VanDerWaalsContact O-CB 3.3Å; T405-D409 WeakPolarHBondContact O-CB 3.14Å; T405-D409 VanDerWaalsContact O-CG 3.27Å; T405-D409 PolarHBondContact O-N 3.03Å
406	A	93.7	Very high	91.4	Very high	2 Å²	2	29.8 Å²	29.8	2%	0.017	14%	0.142	C	C	.	.	H	α-helix	trans	-59.3	-45.1	176.7	0	0	0	0	0	111.8	V105 V123 C402 V404 M410	V105-A406 HydrophobicContact CG2-CB 4.39Å; V123-A406 HydrophobicContact CG2-CB 3.76Å; C402-A406 WeakPolarHBondContact O-CB 3.39Å; C402-A406 PolarHBondContact O-N 3.1Å; V404-A406 PolarHBondContact O-N 3.44Å; A406-M410 WeakPolarHBondContact O-CB 3.08Å; A406-M410 VanDerWaalsContact O-CG 3.27Å; A406-M410 WeakPolarHBondContact O-CG 3.5Å; A406-M410 PolarHBondContact O-N 3.36Å
407	S	93.7	Very high	91	Very high	31 Å²	31	32.2 Å²	32.2	22%	0.217	15%	0.152	C	C	.	.	H	α-helix	trans	-66.6	-48	179.7	-59.5	0	0	0	0	112.2	L403 V404 T405 D409 M410 F411 L415	L403-S407 WeakPolarHBondContact O-CB 3.37Å; L403-S407 PolarHBondContact O-N 2.89Å; L403-S407 PolarHBondContact O-OG 3.05Å; V404-S407 PolarHBondContact O-N 2.94Å; T405-S407 VanDerWaalsContact C-N 3.34Å; T405-S407 PolarHBondContact O-N 3.34Å; S407-D409 VanDerWaalsContact C-N 3.31Å; S407-D409 PolarHBondContact O-N 3.46Å; S407-M410 PolarHBondContact O-N 3.22Å; S407-F411 PolarHBondContact O-N 3.36Å; S407-F411 VanDerWaalsContact O-N 3.1Å; S407-L415 WeakPolarHBondContact O-CD1 3.36Å
408	V	92.3	Very high	90.6	Very high	14 Å²	14	36.2 Å²	36.2	9%	0.085	18%	0.18	C	C	.	.	H	α-helix	trans	-62.4	-38.3	179.8	170.3	0	0	0	0	111.4	V404 T405 F411 P412 L415 R416 L424	V404-V408 HydrophobicContact CG1-CG2 4.04Å; V404-V408 VanDerWaalsContact O-CB 3.32Å; V404-V408 WeakPolarHBondContact O-CB 3.32Å; V404-V408 WeakPolarHBondContact O-CG2 3.34Å; V404-V408 PolarHBondContact O-N 3.35Å; T405-V408 PolarHBondContact O-N 3.44Å; V408-F411 CarbonylContact O-C 3.54Å; V408-P412 VanDerWaalsContact O-CA 3.26Å; V408-P412 WeakPolarHBondContact O-CA 3.41Å; V408-L415 HydrophobicContact CB-CB 4.48Å; V408-L415 HydrophobicContact CG2-CB 4.09Å; V408-R416 HydrophobicContact CG1-CG 3.47Å; V408-R416 VanDerWaalsContact CG1-CG 3.47Å; V408-L424 HydrophobicContact CG2-CD2 3.89Å
409	D	90.8	Very high	90.1	Very high	7 Å²	7	37.9 Å²	37.9	4%	0.037	20%	0.198	C	C	.	.	H	α-helix	trans	-76.7	-27	178.6	-70.7	-17	0	0	0	112.7	R36 G103 T106 T405 S407 R416	R36-D409 IonicContact CZ-OD2 3.1Å; R36-D409 VanDerWaalsContact CZ-OD2 3.26Å; R36-D409 IonicContact NE-OD1 3.84Å; R36-D409 PolarHBondContact NE-OD1 3.41Å; R36-D409 VanDerWaalsContact NE-OD1 3.1Å; R36-D409 IonicContact NE-OD2 2.73Å; R36-D409 PolarHBondContact NE-OD2 3.28Å; R36-D409 IonicContact NH2-OD2 2.87Å; R36-D409 PolarHBondContact NH2-OD2 3.49Å; G103-D409 PolarHBondContact N-OD2 3.48Å; T106-D409 HydrophobicContact CG2-CB 4.18Å; T106-D409 WeakPolarHBondContact OG1-CB 3.37Å; T405-D409 VanDerWaalsContact O-CB 3.3Å; T405-D409 WeakPolarHBondContact O-CB 3.14Å; T405-D409 VanDerWaalsContact O-CG 3.27Å; T405-D409 PolarHBondContact O-N 3.03Å; S407-D409 VanDerWaalsContact C-N 3.31Å; S407-D409 PolarHBondContact O-N 3.46Å; D409-R416 IonicContact OD1-CZ 2.95Å; D409-R416 IonicContact OD1-NE 2.66Å; D409-R416 IonicContact OD1-NH2 3.89Å; D409-R416 PolarHBondContact OD1-NH2 2.89Å
410	M	89.8	Confident	89.9	Confident	56 Å²	56	44 Å²	44	28%	0.276	22%	0.22	S	C	.	.	H	α-helix	trans	-72.1	-34.2	172.7	-78.1	-179.7	61.7	0	0	113.1	V105 T106 A406 S407 P412	V105-M410 HydrophobicContact CB-CG 4.29Å; V105-M410 HydrophobicContact CB-SD 3.99Å; V105-M410 HydrophobicContact CG1-CG 4.19Å; V105-M410 HydrophobicContact CG1-SD 3.75Å; V105-M410 HydrophobicContact CG2-SD 4.07Å; T106-M410 HydrophobicContact CG2-CG 4.18Å; A406-M410 WeakPolarHBondContact O-CB 3.08Å; A406-M410 VanDerWaalsContact O-CG 3.27Å; A406-M410 WeakPolarHBondContact O-CG 3.5Å; A406-M410 PolarHBondContact O-N 3.36Å; S407-M410 PolarHBondContact O-N 3.22Å; M410-P412 VanDerWaalsContact C-CD 3.44Å
411	F	89.8	Confident	89.7	Confident	106 Å²	106	46 Å²	46	47%	0.465	23%	0.228	S	C	.	.	S	Bend	trans	-128.5	61.8	-177.2	-53.8	-75.9	0	0	0	111.9	S407 V408 R413 Q414 L415	S407-F411 PolarHBondContact O-N 3.36Å; S407-F411 VanDerWaalsContact O-N 3.1Å; V408-F411 CarbonylContact O-C 3.54Å; F411-R413 PolarHBondContact O-N 3.11Å; F411-Q414 PolarHBondContact O-N 2.9Å; F411-Q414 PolarHBondContact O-OE1 2.94Å; F411-L415 HydrophobicContact CB-CD1 3.94Å; F411-L415 HydrophobicContact CB-CG 4.25Å; F411-L415 HydrophobicContact CD2-CD1 4.4Å; F411-L415 WeakPolarHBondContact O-CB 3.16Å; F411-L415 PolarHBondContact O-N 2.81Å
412	P	86.3	Confident	89.7	Confident	45 Å²	45	48.8 Å²	48.8	29%	0.292	24%	0.241	S	C	.	.	H	α-helix	trans	-64.8	-39.3	-169.7	24.5	-33.6	0	0	0	112.7	V408 M410 Q414 R416	V408-P412 VanDerWaalsContact O-CA 3.26Å; V408-P412 WeakPolarHBondContact O-CA 3.41Å; M410-P412 VanDerWaalsContact C-CD 3.44Å; P412-Q414 VanDerWaalsContact C-N 3.27Å; P412-Q414 PolarHBondContact O-N 2.94Å; P412-R416 HydrophobicContact CB-CG 4.35Å; P412-R416 VanDerWaalsContact O-CB 3.25Å; P412-R416 WeakPolarHBondContact O-CB 3.32Å; P412-R416 PolarHBondContact O-N 3.34Å
413	R	84.6	Confident	89.7	Confident	138 Å²	138	52.9 Å²	52.9	52%	0.521	26%	0.262	S	S	.	.	H	α-helix	trans	-61.2	-35.8	179.6	-66.5	-176	179.4	176.1	-4.5	112.3	F411 K417	F411-R413 PolarHBondContact O-N 3.11Å; R413-K417 WeakPolarHBondContact O-CE 3.45Å
414	Q	88.3	Confident	89.8	Confident	110 Å²	110	53.3 Å²	53.3	51%	0.514	26%	0.264	S	S	.	.	H	α-helix	trans	-87.5	-39.6	-177.2	-61.8	79.9	8.4	0	0	112.6	F411 P412	F411-Q414 PolarHBondContact O-N 2.9Å; F411-Q414 PolarHBondContact O-OE1 2.94Å; P412-Q414 VanDerWaalsContact C-N 3.27Å; P412-Q414 PolarHBondContact O-N 2.94Å
415	L	88.1	Confident	89.8	Confident	33 Å²	33	53.3 Å²	53.3	17%	0.173	26%	0.264	C	S	.	.	H	α-helix	trans	-102.9	-17.6	-166.1	-64	175.2	0	0	0	114.8	S407 V408 F411 K417 L424	S407-L415 WeakPolarHBondContact O-CD1 3.36Å; V408-L415 HydrophobicContact CB-CB 4.48Å; V408-L415 HydrophobicContact CG2-CB 4.09Å; F411-L415 HydrophobicContact CB-CD1 3.94Å; F411-L415 HydrophobicContact CB-CG 4.25Å; F411-L415 HydrophobicContact CD2-CD1 4.4Å; F411-L415 WeakPolarHBondContact O-CB 3.16Å; F411-L415 PolarHBondContact O-N 2.81Å; L415-K417 VanDerWaalsContact C-N 3.26Å; L415-K417 PolarHBondContact O-N 3.36Å; L415-L424 HydrophobicContact CD1-CD2 4.15Å
416	R	83.6	Confident	90	Very high	51 Å²	51	56.9 Å²	56.9	19%	0.192	28%	0.283	C	S	.	.	S	Bend	trans	-84.2	4.1	175.4	-66.1	-175.8	179.5	176.6	0.8	114.1	V33 K34 V408 D409 P412	V33-R416 HydrophobicContact CG1-CB 4.02Å; K34-R416 WeakPolarHBondContact CB-O 3.42Å; K34-R416 PolarHBondContact N-O 3.01Å; V408-R416 HydrophobicContact CG1-CG 3.47Å; V408-R416 VanDerWaalsContact CG1-CG 3.47Å; D409-R416 IonicContact OD1-CZ 2.95Å; D409-R416 IonicContact OD1-NE 2.66Å; D409-R416 IonicContact OD1-NH2 3.89Å; D409-R416 PolarHBondContact OD1-NH2 2.89Å; P412-R416 HydrophobicContact CB-CG 4.35Å; P412-R416 VanDerWaalsContact O-CB 3.25Å; P412-R416 WeakPolarHBondContact O-CB 3.32Å; P412-R416 PolarHBondContact O-N 3.34Å
417	K	86.7	Confident	90.1	Very high	50 Å²	50	60.2 Å²	60.2	22%	0.217	30%	0.303	C	S	.	.	S	Bend	trans	-71.7	153.4	173.1	-59.3	-170.7	177	-153.9	0	111	D29 Q32 R413 L415 G419 R420	D29-K417 WeakPolarHBondContact OD1-CE 3.44Å; D29-K417 IonicContact OD1-NZ 2.76Å; D29-K417 PolarHBondContact OD1-NZ 3.43Å; Q32-K417 VanDerWaalsContact OE1-NZ 3.11Å; R413-K417 WeakPolarHBondContact O-CE 3.45Å; L415-K417 VanDerWaalsContact C-N 3.26Å; L415-K417 PolarHBondContact O-N 3.36Å; K417-G419 PolarHBondContact O-N 3.32Å; K417-R420 HydrophobicContact CB-CG 3.87Å; K417-R420 WeakPolarHBondContact O-CB 3.49Å; K417-R420 PolarHBondContact O-N 3.3Å
418	S	82.7	Confident	90.2	Very high	86 Å²	86	59.6 Å²	59.6	60%	0.601	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	131.2	-179.7	-158	0	0	0	0	111.9	K34 R420	K34-S418 PolarHBondContact NZ-OG 2.78Å; S418-R420 PolarHBondContact O-N 3.42Å
419	G	84.9	Confident	90.4	Very high	37 Å²	37	59.3 Å²	59.3	38%	0.381	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	-16.2	178.8	0	0	0	0	0	115.4	K417 E422 L423	K417-G419 PolarHBondContact O-N 3.32Å; G419-E422 WeakPolarHBondContact CA-OE2 3.4Å; G419-E422 PolarHBondContact N-OE2 3.37Å; G419-L423 PolarHBondContact O-N 2.74Å
420	R	90.2	Very high	90.8	Very high	133 Å²	133	62.4 Å²	62.4	50%	0.502	32%	0.316	S	S	.	.	H	α-helix	trans	-76.3	-32.8	-176.7	-67.1	-65.6	-173.1	166.5	0.7	112.7	K417 S418 L423 L424	K417-R420 HydrophobicContact CB-CG 3.87Å; K417-R420 WeakPolarHBondContact O-CB 3.49Å; K417-R420 PolarHBondContact O-N 3.3Å; S418-R420 PolarHBondContact O-N 3.42Å; R420-L423 PolarHBondContact O-N 2.85Å; R420-L424 WeakPolarHBondContact O-CB 2.91Å; R420-L424 PolarHBondContact O-N 3.3Å
421	R	90.1	Very high	91.1	Very high	42 Å²	42	63.1 Å²	63.1	16%	0.158	32%	0.323	C	S	.	.	H	α-helix	trans	-64.8	-45.3	175.1	-174.9	-175.5	-179	-73.8	-10.6	110.9	I228 W229 E401 V404 L423 L424 I425	I228-R421 PolarHBondContact O-NH1 3.24Å; W229-R421 PolarHBondContact O-NH1 2.99Å; W229-R421 VanDerWaalsContact O-NH1 3.14Å; E401-R421 IonicContact OE1-CZ 3.16Å; E401-R421 IonicContact OE1-NH2 2.95Å; E401-R421 PolarHBondContact OE1-NH2 3.17Å; E401-R421 IonicContact OE2-CZ 3.65Å; E401-R421 IonicContact OE2-NH2 3.95Å; E401-R421 PolarHBondContact OE2-NH2 3.2Å; V404-R421 HydrophobicContact CG1-CG 4.1Å; R421-L423 VanDerWaalsContact C-N 3.33Å; R421-L423 PolarHBondContact O-N 3.01Å; R421-L424 WeakPolarHBondContact O-CB 3.43Å; R421-L424 PolarHBondContact O-N 2.96Å; R421-I425 HydrophobicContact CG-CD1 4.31Å; R421-I425 WeakPolarHBondContact O-CG1 3.34Å; R421-I425 PolarHBondContact O-N 2.99Å
422	E	93	Very high	91.5	Very high	60 Å²	60	58.5 Å²	58.5	28%	0.28	30%	0.304	S	S	.	.	H	α-helix	trans	-61.2	-43.8	177.3	-61.6	86.1	164.4	0	0	110.8	G419 I425 L426	G419-E422 WeakPolarHBondContact CA-OE2 3.4Å; G419-E422 PolarHBondContact N-OE2 3.37Å; E422-I425 PolarHBondContact O-N 2.56Å; E422-L426 PolarHBondContact O-N 2.77Å
423	L	94.2	Very high	92.1	Very high	87 Å²	87	58.5 Å²	58.5	46%	0.455	30%	0.298	S	S	.	.	H	α-helix	trans	-64.5	-38.5	175.1	-176.6	64.9	0	0	0	113	G419 R420 R421 L426 T427	G419-L423 PolarHBondContact O-N 2.74Å; R420-L423 PolarHBondContact O-N 2.85Å; R421-L423 VanDerWaalsContact C-N 3.33Å; R421-L423 PolarHBondContact O-N 3.01Å; L423-L426 PolarHBondContact O-N 3.1Å; L423-T427 WeakPolarHBondContact O-CB 3.27Å; L423-T427 PolarHBondContact O-N 3.14Å; L423-T427 PolarHBondContact O-OG1 3.46Å
424	L	94.7	Very high	92.7	Very high	29 Å²	29	56.5 Å²	56.5	15%	0.152	30%	0.298	C	S	.	.	H	α-helix	trans	-62.2	-46.9	174.9	174.6	65	0	0	0	110.9	V404 V408 L415 R420 R421 L426 T427 I428	V404-L424 HydrophobicContact CG1-CD2 4.24Å; V408-L424 HydrophobicContact CG2-CD2 3.89Å; L415-L424 HydrophobicContact CD1-CD2 4.15Å; R420-L424 WeakPolarHBondContact O-CB 2.91Å; R420-L424 PolarHBondContact O-N 3.3Å; R421-L424 WeakPolarHBondContact O-CB 3.43Å; R421-L424 PolarHBondContact O-N 2.96Å; L424-L426 VanDerWaalsContact C-N 3.33Å; L424-L426 PolarHBondContact O-N 2.95Å; L424-T427 WeakPolarHBondContact O-CB 3.47Å; L424-T427 PolarHBondContact O-N 3.49Å; L424-I428 HydrophobicContact CD1-CD1 4.05Å; L424-I428 HydrophobicContact CD1-CG1 4.34Å; L424-I428 HydrophobicContact CG-CD1 3.97Å; L424-I428 WeakPolarHBondContact O-CG1 3.34Å; L424-I428 PolarHBondContact O-N 3.35Å
425	I	95.3	Very high	93.1	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-59.2	-46.5	176.5	-70.3	161.8	0	0	0	110.7	Y225 I228 V404 R421 E422 T427 I428 A429	Y225-I425 HydrophobicContact CD2-CB 4.5Å; Y225-I425 HydrophobicContact CD2-CG2 3.69Å; Y225-I425 HydrophobicContact CE2-CB 4.4Å; Y225-I425 HydrophobicContact CE2-CG2 4.06Å; I228-I425 HydrophobicContact CD1-CD1 4.38Å; I228-I425 HydrophobicContact CD1-CG1 4.33Å; I228-I425 HydrophobicContact CD1-CG2 3.63Å; I228-I425 HydrophobicContact CG1-CD1 4.06Å; I228-I425 HydrophobicContact CG1-CG1 4.49Å; I228-I425 HydrophobicContact CG1-CG2 3.79Å; V404-I425 HydrophobicContact CG1-CG1 4.23Å; V404-I425 HydrophobicContact CG2-CD1 4.46Å; V404-I425 HydrophobicContact CG2-CG1 3.53Å; R421-I425 HydrophobicContact CG-CD1 4.31Å; R421-I425 WeakPolarHBondContact O-CG1 3.34Å; R421-I425 PolarHBondContact O-N 2.99Å; E422-I425 PolarHBondContact O-N 2.56Å; I425-T427 VanDerWaalsContact C-N 3.27Å; I425-T427 PolarHBondContact O-N 3.46Å; I425-I428 PolarHBondContact O-N 3.25Å; I425-A429 WeakPolarHBondContact O-CB 3.42Å; I425-A429 PolarHBondContact O-N 3.29Å
426	L	96.4	Very high	93.6	Very high	76 Å²	76	52.9 Å²	52.9	40%	0.398	28%	0.281	S	S	.	.	H	α-helix	trans	-58.6	-42.5	177.2	-176.6	62.6	0	0	0	111.2	Y225 E422 L423 L424 A429 V430	Y225-L426 HydrophobicContact CD2-CB 4.35Å; Y225-L426 HydrophobicContact CD2-CD1 4.29Å; Y225-L426 HydrophobicContact CE2-CB 3.74Å; Y225-L426 HydrophobicContact CE2-CD1 4.16Å; E422-L426 PolarHBondContact O-N 2.77Å; L423-L426 PolarHBondContact O-N 3.1Å; L424-L426 VanDerWaalsContact C-N 3.33Å; L424-L426 PolarHBondContact O-N 2.95Å; L426-A429 PolarHBondContact O-N 3.1Å; L426-V430 HydrophobicContact CD1-CG2 4.18Å; L426-V430 HydrophobicContact CG-CG2 4.4Å; L426-V430 WeakPolarHBondContact O-CB 3.41Å; L426-V430 VanDerWaalsContact O-CG2 3.26Å; L426-V430 WeakPolarHBondContact O-CG2 3.48Å; L426-V430 PolarHBondContact O-N 2.92Å
427	T	96.1	Very high	94.3	Very high	73 Å²	73	52.3 Å²	52.3	45%	0.448	28%	0.282	S	S	.	.	H	α-helix	trans	-63.3	-47.7	178.8	-56.5	0	0	0	0	110.9	L423 L424 I425 A429 V430 T431	L423-T427 WeakPolarHBondContact O-CB 3.27Å; L423-T427 PolarHBondContact O-N 3.14Å; L423-T427 PolarHBondContact O-OG1 3.46Å; L424-T427 WeakPolarHBondContact O-CB 3.47Å; L424-T427 PolarHBondContact O-N 3.49Å; I425-T427 VanDerWaalsContact C-N 3.27Å; I425-T427 PolarHBondContact O-N 3.46Å; T427-A429 PolarHBondContact O-N 2.91Å; T427-V430 PolarHBondContact O-N 2.81Å; T427-T431 WeakPolarHBondContact O-CB 3.41Å; T427-T431 PolarHBondContact O-N 2.98Å; T427-T431 PolarHBondContact O-OG1 3.15Å
428	I	96.1	Very high	94.7	Very high	17 Å²	17	55.7 Å²	55.7	9%	0.087	30%	0.297	C	S	.	.	H	α-helix	trans	-58.4	-48.2	175.8	-69.2	166.5	0	0	0	110.5	V400 L403 V404 L424 I425 T431 C432	V400-I428 HydrophobicContact CG1-CG2 4.34Å; L403-I428 HydrophobicContact CD2-CD1 4Å; L403-I428 HydrophobicContact CD2-CG1 4.25Å; L403-I428 HydrophobicContact CD2-CG2 3.86Å; L403-I428 HydrophobicContact CG-CD1 4.1Å; V404-I428 HydrophobicContact CG2-CD1 3.74Å; L424-I428 HydrophobicContact CD1-CD1 4.05Å; L424-I428 HydrophobicContact CD1-CG1 4.34Å; L424-I428 HydrophobicContact CG-CD1 3.97Å; L424-I428 WeakPolarHBondContact O-CG1 3.34Å; L424-I428 PolarHBondContact O-N 3.35Å; I425-I428 PolarHBondContact O-N 3.25Å; I428-T431 PolarHBondContact O-N 3.09Å; I428-C432 WeakPolarHBondContact O-CB 3.48Å; I428-C432 PolarHBondContact O-N 3.04Å; I428-C432 PolarHBondContact O-SG 3.12Å
429	A	97.2	Very high	95.4	Very high	8 Å²	8	51.9 Å²	51.9	7%	0.066	27%	0.269	C	S	.	.	H	α-helix	trans	-61.3	-46	-179.9	0	0	0	0	0	112.3	W221 I425 L426 T427 C432 Y433	W221-A429 HydrophobicContact CD2-CB 4.12Å; W221-A429 HydrophobicContact CE3-CB 3.43Å; W221-A429 VanDerWaalsContact CE3-CB 3.43Å; W221-A429 HydrophobicContact CZ3-CB 3.88Å; I425-A429 WeakPolarHBondContact O-CB 3.42Å; I425-A429 PolarHBondContact O-N 3.29Å; L426-A429 PolarHBondContact O-N 3.1Å; T427-A429 PolarHBondContact O-N 2.91Å; A429-C432 PolarHBondContact O-N 3.37Å; A429-Y433 VanDerWaalsContact O-CB 3.24Å; A429-Y433 WeakPolarHBondContact O-CB 3.42Å; A429-Y433 PolarHBondContact O-N 3.26Å
430	V	98	Very high	96	Very high	73 Å²	73	50.1 Å²	50.1	44%	0.442	25%	0.251	S	S	.	.	H	α-helix	trans	-65	-43.8	177.8	170.8	0	0	0	0	111	L426 T427 Y433 L434	L426-V430 HydrophobicContact CD1-CG2 4.18Å; L426-V430 HydrophobicContact CG-CG2 4.4Å; L426-V430 WeakPolarHBondContact O-CB 3.41Å; L426-V430 VanDerWaalsContact O-CG2 3.26Å; L426-V430 WeakPolarHBondContact O-CG2 3.48Å; L426-V430 PolarHBondContact O-N 2.92Å; T427-V430 PolarHBondContact O-N 2.81Å; V430-Y433 PolarHBondContact O-N 3.39Å; V430-L434 HydrophobicContact CG1-CD1 4.12Å; V430-L434 HydrophobicContact CG1-CG 4.49Å; V430-L434 VanDerWaalsContact O-CG 3.28Å; V430-L434 WeakPolarHBondContact O-CG 3.41Å; V430-L434 PolarHBondContact O-N 3.03Å
431	T	97.6	Very high	96.4	Very high	70 Å²	70	44.7 Å²	44.7	43%	0.429	23%	0.233	S	C	.	.	H	α-helix	trans	-62.6	-46.6	176.9	-61.1	0	0	0	0	111.5	T427 I428 Y433 L434 I435	T427-T431 WeakPolarHBondContact O-CB 3.41Å; T427-T431 PolarHBondContact O-N 2.98Å; T427-T431 PolarHBondContact O-OG1 3.15Å; I428-T431 PolarHBondContact O-N 3.09Å; T431-Y433 PolarHBondContact O-N 2.74Å; T431-L434 PolarHBondContact O-N 2.91Å; T431-I435 HydrophobicContact CG2-CD1 3.97Å; T431-I435 WeakPolarHBondContact O-CG1 3.5Å; T431-I435 PolarHBondContact O-N 3.33Å; T431-I435 VanDerWaalsContact O-N 3.08Å
432	C	97.3	Very high	96.7	Very high	9 Å²	9	44.9 Å²	44.9	6%	0.061	24%	0.236	C	C	.	.	H	α-helix	trans	-67.3	-35.6	178.8	-63.6	0	0	0	0	112	I131 W221 I428 A429 I435 G436	I131-C432 HydrophobicContact CG1-CB 4.39Å; W221-C432 HydrophobicContact CH2-CB 3.52Å; W221-C432 HydrophobicContact CZ2-CB 3.15Å; I428-C432 WeakPolarHBondContact O-CB 3.48Å; I428-C432 PolarHBondContact O-N 3.04Å; I428-C432 PolarHBondContact O-SG 3.12Å; A429-C432 PolarHBondContact O-N 3.37Å; C432-I435 PolarHBondContact O-N 2.83Å; C432-G436 WeakPolarHBondContact O-CA 3.42Å; C432-G436 PolarHBondContact O-N 3.11Å
433	Y	98.2	Very high	96.8	Very high	45 Å²	45	42 Å²	42	18%	0.176	22%	0.222	C	C	.	.	H	α-helix	trans	-59	-50.9	171.7	171.9	-101.5	0	0	0	111.6	L217 L218 W221 A429 V430 T431 I435 G436 L437	L217-Y433 HydrophobicContact CB-CE2 4.41Å; L217-Y433 HydrophobicContact CD2-CD2 4.1Å; L217-Y433 HydrophobicContact CD2-CE2 4.31Å; L217-Y433 HydrophobicContact CG-CD2 3.9Å; L217-Y433 HydrophobicContact CG-CE2 4.16Å; L218-Y433 HydrophobicContact CB-CD2 4.38Å; L218-Y433 HydrophobicContact CB-CE2 3.66Å; L218-Y433 HydrophobicContact CD1-CD2 4.39Å; L218-Y433 HydrophobicContact CD1-CE2 4.13Å; L218-Y433 HydrophobicContact CG-CE2 4.48Å; W221-Y433 AromaticContact CD1-CD2 3.95Å; A429-Y433 VanDerWaalsContact O-CB 3.24Å; A429-Y433 WeakPolarHBondContact O-CB 3.42Å; A429-Y433 PolarHBondContact O-N 3.26Å; V430-Y433 PolarHBondContact O-N 3.39Å; T431-Y433 PolarHBondContact O-N 2.74Å; Y433-I435 VanDerWaalsContact C-N 3.32Å; Y433-I435 PolarHBondContact O-N 2.96Å; Y433-G436 CarbonylContact O-C 3.58Å; Y433-G436 PolarHBondContact O-N 3.03Å; Y433-G436 VanDerWaalsContact O-N 3.12Å; Y433-L437 HydrophobicContact CE1-CD1 4.21Å; Y433-L437 HydrophobicContact CE1-CD2 4.25Å; Y433-L437 HydrophobicContact CE1-CG 4.38Å; Y433-L437 HydrophobicContact CE2-CD2 4.08Å; Y433-L437 WeakPolarHBondContact O-CG 3.09Å; Y433-L437 PolarHBondContact O-N 2.86Å
434	L	98.3	Very high	96.9	Very high	97 Å²	97	37.9 Å²	37.9	51%	0.508	20%	0.201	S	C	.	.	H	α-helix	trans	-62	-39	-178.8	-69.8	173.4	0	0	0	112.3	V430 T431 L437	V430-L434 HydrophobicContact CG1-CD1 4.12Å; V430-L434 HydrophobicContact CG1-CG 4.49Å; V430-L434 VanDerWaalsContact O-CG 3.28Å; V430-L434 WeakPolarHBondContact O-CG 3.41Å; V430-L434 PolarHBondContact O-N 3.03Å; T431-L434 PolarHBondContact O-N 2.91Å; L434-L437 HydrophobicContact CD2-CD1 4.35Å; L434-L437 WeakPolarHBondContact O-CB 3.34Å
435	I	97.4	Very high	96.9	Very high	67 Å²	67	36.8 Å²	36.8	34%	0.344	19%	0.194	S	C	.	.	H	α-helix	trans	-71.3	-39.8	174.3	-60.7	168.3	0	0	0	110.5	I131 T431 C432 Y433 L437 F438	I131-I435 HydrophobicContact CD1-CD1 4.14Å; I131-I435 HydrophobicContact CD1-CG2 4.2Å; I131-I435 HydrophobicContact CG1-CG2 4.47Å; I131-I435 HydrophobicContact CG2-CB 4.32Å; I131-I435 HydrophobicContact CG2-CG2 3.7Å; T431-I435 HydrophobicContact CG2-CD1 3.97Å; T431-I435 WeakPolarHBondContact O-CG1 3.5Å; T431-I435 PolarHBondContact O-N 3.33Å; T431-I435 VanDerWaalsContact O-N 3.08Å; C432-I435 PolarHBondContact O-N 2.83Å; Y433-I435 VanDerWaalsContact C-N 3.32Å; Y433-I435 PolarHBondContact O-N 2.96Å; I435-L437 PolarHBondContact O-N 3.3Å; I435-F438 WeakPolarHBondContact O-CD2 3.2Å; I435-F438 PolarHBondContact O-N 2.88Å
436	G	97.1	Very high	96.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.9	-22.2	177.3	0	0	0	0	0	113.9	C432 Y433 F438 M439 V440	C432-G436 WeakPolarHBondContact O-CA 3.42Å; C432-G436 PolarHBondContact O-N 3.11Å; Y433-G436 CarbonylContact O-C 3.58Å; Y433-G436 PolarHBondContact O-N 3.03Å; Y433-G436 VanDerWaalsContact O-N 3.12Å; G436-F438 PolarHBondContact O-N 2.98Å; G436-M439 PolarHBondContact O-N 3.06Å; G436-V440 PolarHBondContact O-N 3.43Å
437	L	98	Very high	96.9	Very high	38 Å²	38	35.1 Å²	35.1	20%	0.199	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-56.5	-32.1	173.6	-68.2	-179.1	0	0	0	112.9	L209 A214 Y433 L434 I435 M439 V440 T441	L209-L437 HydrophobicContact CD1-CB 4.32Å; L209-L437 HydrophobicContact CD1-CD2 4.27Å; L209-L437 WeakPolarHBondContact CD1-O 3.34Å; A214-L437 HydrophobicContact CB-CD2 3.86Å; Y433-L437 HydrophobicContact CE1-CD1 4.21Å; Y433-L437 HydrophobicContact CE1-CD2 4.25Å; Y433-L437 HydrophobicContact CE1-CG 4.38Å; Y433-L437 HydrophobicContact CE2-CD2 4.08Å; Y433-L437 WeakPolarHBondContact O-CG 3.09Å; Y433-L437 PolarHBondContact O-N 2.86Å; L434-L437 HydrophobicContact CD2-CD1 4.35Å; L434-L437 WeakPolarHBondContact O-CB 3.34Å; I435-L437 PolarHBondContact O-N 3.3Å; L437-M439 VanDerWaalsContact C-N 3.26Å; L437-M439 PolarHBondContact O-N 3.05Å; L437-V440 HydrophobicContact CD2-CG2 4.12Å; L437-V440 WeakPolarHBondContact O-CG2 3.28Å; L437-V440 PolarHBondContact O-N 3.28Å; L437-T441 WeakPolarHBondContact O-CG2 3.47Å; L437-T441 PolarHBondContact O-N 2.91Å
438	F	96.8	Very high	96.9	Very high	122 Å²	122	31.7 Å²	31.7	54%	0.535	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-67.5	-25.1	175.2	-67.8	-78.9	0	0	0	113	I435 G436 T441 G444 I447	I435-F438 WeakPolarHBondContact O-CD2 3.2Å; I435-F438 PolarHBondContact O-N 2.88Å; G436-F438 PolarHBondContact O-N 2.98Å; F438-T441 PolarHBondContact O-OG1 3.43Å; F438-G444 WeakPolarHBondContact O-CA 3.44Å; F438-I447 HydrophobicContact CB-CD1 4.32Å
439	M	96.6	Very high	96.7	Very high	5 Å²	5	32.5 Å²	32.5	3%	0.025	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-89.5	-10	178.4	-64.9	177.4	-177.8	0	0	113.2	I131 I135 G436 L437 G444 I447 F451	I131-M439 HydrophobicContact CG2-CE 3.92Å; I131-M439 HydrophobicContact CG2-SD 4.32Å; I135-M439 HydrophobicContact CD1-CB 3.95Å; I135-M439 HydrophobicContact CD1-SD 4.49Å; I135-M439 HydrophobicContact CG1-CB 3.92Å; I135-M439 HydrophobicContact CG1-SD 3.9Å; I135-M439 HydrophobicContact CG2-CB 4.44Å; G436-M439 PolarHBondContact O-N 3.06Å; L437-M439 VanDerWaalsContact C-N 3.26Å; L437-M439 PolarHBondContact O-N 3.05Å; M439-G444 CarbonylContact O-C 3.47Å; M439-G444 WeakPolarHBondContact O-CA 3.17Å; M439-I447 HydrophobicContact CE-CG2 3.92Å; M439-I447 HydrophobicContact CG-CB 4.31Å; M439-I447 HydrophobicContact CG-CG2 3.89Å; M439-F451 HydrophobicContact CE-CB 4.03Å; M439-F451 HydrophobicContact CE-CD1 3.73Å; M439-F451 HydrophobicContact CE-CD2 3.3Å; M439-F451 HydrophobicContact CE-CE1 3.94Å; M439-F451 HydrophobicContact CE-CE2 3.53Å; M439-F451 HydrophobicContact CE-CG 3.41Å; M439-F451 VanDerWaalsContact CE-CG 3.41Å; M439-F451 HydrophobicContact CE-CZ 3.84Å
440	V	97.5	Very high	96.5	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.006	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-106.9	18.7	172.8	-61.1	0	0	0	0	112.8	I135 L209 R210 L213 A214 L217 G436 L437	I135-V440 HydrophobicContact CD1-CG1 4.18Å; I135-V440 HydrophobicContact CG2-CG1 4.22Å; L209-V440 HydrophobicContact CD1-CG2 3.82Å; R210-V440 VanDerWaalsContact CB-O 3.23Å; R210-V440 WeakPolarHBondContact CB-O 3.32Å; R210-V440 WeakPolarHBondContact CG-O 3.47Å; R210-V440 PolarHBondContact N-O 3.44Å; L213-V440 HydrophobicContact CB-CB 3.97Å; L213-V440 HydrophobicContact CB-CG1 4.11Å; A214-V440 HydrophobicContact CB-CG2 4.32Å; L217-V440 HydrophobicContact CD2-CG1 4.12Å; L217-V440 HydrophobicContact CD2-CG2 4.27Å; G436-V440 PolarHBondContact O-N 3.43Å; L437-V440 HydrophobicContact CD2-CG2 4.12Å; L437-V440 WeakPolarHBondContact O-CG2 3.28Å; L437-V440 PolarHBondContact O-N 3.28Å
441	T	98	Very high	96.3	Very high	18 Å²	18	30.2 Å²	30.2	11%	0.11	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-81.9	171.2	163	72.8	0	0	0	0	110.6	L206 A208 L209 L437 F438 G443 G444	L206-T441 VanDerWaalsContact O-CB 3.24Å; L206-T441 WeakPolarHBondContact O-CB 3.23Å; L206-T441 PolarHBondContact O-OG1 3.29Å; A208-T441 WeakPolarHBondContact O-CA 3.37Å; A208-T441 WeakPolarHBondContact O-CB 3.23Å; L209-T441 HydrophobicContact CD1-CG2 4.14Å; L437-T441 WeakPolarHBondContact O-CG2 3.47Å; L437-T441 PolarHBondContact O-N 2.91Å; F438-T441 PolarHBondContact O-OG1 3.43Å; T441-G443 VanDerWaalsContact C-N 3.28Å; T441-G443 PolarHBondContact O-N 2.85Å; T441-G444 WeakPolarHBondContact O-CA 3.39Å; T441-G444 PolarHBondContact O-N 3.4Å; T441-G444 PolarHBondContact OG1-N 3.03Å
442	E	97.4	Very high	96	Very high	47 Å²	47	29.3 Å²	29.3	22%	0.22	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-38.6	175.8	-71.5	173.4	167.8	0	0	112.6	S198 I199 T200 L206 G207 A208 R210 G444	S198-E442 WeakPolarHBondContact O-CB 3.41Å; S198-E442 VanDerWaalsContact O-CG 3.29Å; S198-E442 WeakPolarHBondContact O-CG 3.36Å; I199-E442 WeakPolarHBondContact CA-O 3.24Å; T200-E442 HydrophobicContact CG2-CB 3.55Å; T200-E442 PolarHBondContact N-O 2.98Å; L206-E442 PolarHBondContact O-N 3.25Å; G207-E442 WeakPolarHBondContact CA-OE2 3.22Å; A208-E442 PolarHBondContact N-OE2 2.95Å; A208-E442 WeakPolarHBondContact O-CG 3.45Å; A208-E442 PolarHBondContact O-N 3.35Å; R210-E442 HydrophobicContact CG-CG 4.32Å; R210-E442 IonicContact NH1-OE1 2.66Å; E442-G444 VanDerWaalsContact C-N 3.31Å
443	G	95.6	Very high	95.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	2.4	171.9	0	0	0	0	0	114.8	T200 L206 T441 M445 Y446	T200-G443 VanDerWaalsContact OG1-CA 3.3Å; T200-G443 WeakPolarHBondContact OG1-CA 3.21Å; L206-G443 PolarHBondContact O-N 3.3Å; T441-G443 VanDerWaalsContact C-N 3.28Å; T441-G443 PolarHBondContact O-N 2.85Å; G443-M445 VanDerWaalsContact C-N 3.31Å; G443-M445 PolarHBondContact O-N 3.16Å; G443-Y446 WeakPolarHBondContact O-CD2 3.39Å; G443-Y446 PolarHBondContact O-N 3.36Å
444	G	96.3	Very high	95.2	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.1	-28.9	-169.5	0	0	0	0	0	114.5	F438 M439 T441 E442 Y446 I447 F448	F438-G444 WeakPolarHBondContact O-CA 3.44Å; M439-G444 CarbonylContact O-C 3.47Å; M439-G444 WeakPolarHBondContact O-CA 3.17Å; T441-G444 WeakPolarHBondContact O-CA 3.39Å; T441-G444 PolarHBondContact O-N 3.4Å; T441-G444 PolarHBondContact OG1-N 3.03Å; E442-G444 VanDerWaalsContact C-N 3.31Å; G444-Y446 VanDerWaalsContact C-N 3.26Å; G444-Y446 PolarHBondContact O-N 3.4Å; G444-I447 PolarHBondContact O-N 2.85Å; G444-I447 VanDerWaalsContact O-N 3.12Å; G444-F448 PolarHBondContact O-N 3.46Å
445	M	94.5	Very high	94.7	Very high	5 Å²	5	26.4 Å²	26.4	3%	0.025	12%	0.124	C	C	.	.	H	α-helix	trans	-59.2	-36.6	177	-173.6	59.9	-174	0	0	112.2	W139 W192 L197 I199 P360 G443 I447 F448 Q449 Y525	W139-M445 HydrophobicContact CH2-SD 3.69Å; W139-M445 HydrophobicContact CZ2-SD 3.95Å; W192-M445 HydrophobicContact CZ2-SD 4.46Å; L197-M445 HydrophobicContact CD1-CB 4.14Å; L197-M445 HydrophobicContact CD1-CG 4.08Å; L197-M445 HydrophobicContact CD1-SD 4.4Å; I199-M445 HydrophobicContact CD1-CB 4.02Å; I199-M445 HydrophobicContact CD1-CG 4.24Å; P360-M445 HydrophobicContact CB-CE 4.38Å; P360-M445 HydrophobicContact CG-CE 4.24Å; G443-M445 VanDerWaalsContact C-N 3.31Å; G443-M445 PolarHBondContact O-N 3.16Å; M445-I447 VanDerWaalsContact C-N 3.35Å; M445-I447 PolarHBondContact O-N 3.13Å; M445-F448 HydrophobicContact CE-CD1 4.37Å; M445-F448 PolarHBondContact O-N 3.06Å; M445-F448 HydrophobicContact SD-CD1 4.13Å; M445-Q449 HydrophobicContact CE-CG 4.07Å; M445-Q449 WeakPolarHBondContact O-CG 3.36Å; M445-Q449 PolarHBondContact O-N 3.48Å; M445-Y525 HydrophobicContact CE-CE2 3.93Å; M445-Y525 HydrophobicContact CG-CE2 3.94Å
446	Y	95.2	Very high	93.7	Very high	12 Å²	12	23.3 Å²	23.3	5%	0.047	11%	0.108	C	C	.	.	H	α-helix	trans	-67.7	-36	177.9	-60.2	-66.7	0	0	0	112.4	I199 T200 I203 G443 G444 L450 Y525 Y529 Y531	I199-Y446 HydrophobicContact CD1-CE2 4.29Å; I199-Y446 HydrophobicContact CG1-CE2 4.02Å; T200-Y446 WeakPolarHBondContact O-CE2 3.43Å; T200-Y446 PolarHBondContact O-OH 2.93Å; I203-Y446 HydrophobicContact CB-CG 4.29Å; G443-Y446 WeakPolarHBondContact O-CD2 3.39Å; G443-Y446 PolarHBondContact O-N 3.36Å; G444-Y446 VanDerWaalsContact C-N 3.26Å; G444-Y446 PolarHBondContact O-N 3.4Å; Y446-L450 PolarHBondContact O-N 3.2Å; Y446-Y525 HydrophobicContact CD1-CD1 4.46Å; Y446-Y525 HydrophobicContact CD1-CG 4.4Å; Y446-Y525 AromaticContact CE1-CD1 3.68Å; Y446-Y525 HydrophobicContact CE1-CD1 3.68Å; Y446-Y525 HydrophobicContact CE1-CE1 4.4Å; Y446-Y525 HydrophobicContact CE1-CG 4.03Å; Y446-Y529 AromaticContact CD1-CD1 3.79Å; Y446-Y529 HydrophobicContact CD1-CD1 3.79Å; Y446-Y529 AromaticContact CD1-CE1 3.64Å; Y446-Y529 HydrophobicContact CD1-CE1 3.64Å; Y446-Y529 HydrophobicContact CD1-CG 4.48Å; Y446-Y529 AromaticContact CE1-CD1 3.54Å; Y446-Y529 HydrophobicContact CE1-CD1 3.54Å; Y446-Y529 HydrophobicContact CE1-CD2 4.21Å; Y446-Y529 AromaticContact CE1-CE1 3.74Å; Y446-Y529 HydrophobicContact CE1-CE1 3.74Å; Y446-Y529 HydrophobicContact CE1-CE2 4.39Å; Y446-Y529 AromaticContact CE1-CG 3.79Å; Y446-Y529 HydrophobicContact CE1-CG 3.79Å; Y446-Y529 HydrophobicContact CG-CE1 4.43Å; Y446-Y531 WeakPolarHBondContact CA-OH 3.34Å; Y446-Y531 WeakPolarHBondContact O-CE1 3.3Å; Y446-Y531 PolarHBondContact O-OH 3.05Å
447	I	95.8	Very high	92.9	Very high	30 Å²	30	24 Å²	24	15%	0.154	11%	0.113	C	C	.	.	H	α-helix	trans	-70.4	-46.7	175.8	-62	175.2	0	0	0	109.8	I203 L206 F438 M439 G444 M445 Q449 L450 F451	I203-I447 HydrophobicContact CD1-CG1 4.26Å; I203-I447 HydrophobicContact CG1-CG1 4.23Å; L206-I447 HydrophobicContact CD2-CD1 3.59Å; L206-I447 HydrophobicContact CD2-CG1 4.43Å; F438-I447 HydrophobicContact CB-CD1 4.32Å; M439-I447 HydrophobicContact CE-CG2 3.92Å; M439-I447 HydrophobicContact CG-CB 4.31Å; M439-I447 HydrophobicContact CG-CG2 3.89Å; G444-I447 PolarHBondContact O-N 2.85Å; G444-I447 VanDerWaalsContact O-N 3.12Å; M445-I447 VanDerWaalsContact C-N 3.35Å; M445-I447 PolarHBondContact O-N 3.13Å; I447-Q449 PolarHBondContact O-N 2.96Å; I447-L450 WeakPolarHBondContact O-CB 3.4Å; I447-L450 PolarHBondContact O-N 3.02Å; I447-F451 HydrophobicContact CG2-CD2 4.14Å; I447-F451 HydrophobicContact CG2-CE2 4.08Å; I447-F451 WeakPolarHBondContact O-CD2 3.4Å; I447-F451 PolarHBondContact O-N 3.47Å
448	F	95.1	Very high	92	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.009	11%	0.108	C	C	.	.	H	α-helix	trans	-50.7	-47.4	175.6	171.7	-87.3	0	0	0	111	Y132 I135 I136 W139 P360 G444 M445 L450 F451 D452	Y132-F448 HydrophobicContact CD2-CD2 4.16Å; Y132-F448 AromaticContact CD2-CE2 3.71Å; Y132-F448 HydrophobicContact CD2-CE2 3.71Å; Y132-F448 HydrophobicContact CD2-CZ 4.14Å; Y132-F448 WeakPolarHBondContact O-CE2 3.43Å; I135-F448 HydrophobicContact CB-CD2 4.06Å; I135-F448 HydrophobicContact CB-CE2 4.24Å; I135-F448 HydrophobicContact CG1-CD2 4.46Å; I135-F448 HydrophobicContact CG2-CD2 4.22Å; I136-F448 HydrophobicContact CD1-CE2 4.33Å; I136-F448 HydrophobicContact CD1-CZ 4.04Å; I136-F448 HydrophobicContact CG1-CE2 3.85Å; I136-F448 HydrophobicContact CG1-CZ 3.79Å; W139-F448 HydrophobicContact CH2-CB 4.49Å; W139-F448 AromaticContact CH2-CD1 3.71Å; W139-F448 HydrophobicContact CH2-CD1 3.71Å; W139-F448 AromaticContact CH2-CD2 3.69Å; W139-F448 HydrophobicContact CH2-CD2 3.69Å; W139-F448 AromaticContact CH2-CE1 3.77Å; W139-F448 HydrophobicContact CH2-CE1 3.77Å; W139-F448 AromaticContact CH2-CE2 3.72Å; W139-F448 HydrophobicContact CH2-CE2 3.72Å; W139-F448 AromaticContact CH2-CG 3.69Å; W139-F448 HydrophobicContact CH2-CG 3.69Å; W139-F448 AromaticContact CH2-CZ 3.77Å; W139-F448 HydrophobicContact CH2-CZ 3.77Å; W139-F448 HydrophobicContact CZ2-CD2 4.34Å; W139-F448 HydrophobicContact CZ2-CG 4.36Å; W139-F448 HydrophobicContact CZ3-CD1 4.42Å; W139-F448 HydrophobicContact CZ3-CD2 4.38Å; W139-F448 HydrophobicContact CZ3-CE1 4.02Å; W139-F448 AromaticContact CZ3-CE2 3.94Å; W139-F448 HydrophobicContact CZ3-CE2 3.94Å; W139-F448 AromaticContact CZ3-CZ 3.76Å; W139-F448 HydrophobicContact CZ3-CZ 3.76Å; P360-F448 HydrophobicContact CG-CE1 4.01Å; P360-F448 HydrophobicContact CG-CZ 4.47Å; G444-F448 PolarHBondContact O-N 3.46Å; M445-F448 HydrophobicContact CE-CD1 4.37Å; M445-F448 PolarHBondContact O-N 3.06Å; M445-F448 HydrophobicContact SD-CD1 4.13Å; F448-L450 PolarHBondContact O-N 3.48Å; F448-F451 PolarHBondContact O-N 2.9Å; F448-D452 HydrophobicContact CE1-CB 4.31Å; F448-D452 PolarHBondContact O-N 3.25Å
449	Q	92.6	Very high	91.4	Very high	33 Å²	33	18.4 Å²	18.4	15%	0.154	9%	0.091	C	C	.	.	H	α-helix	trans	-67.2	-31.3	179.3	-74	-159.1	-27	0	0	114.7	M445 I447 F451 Y453 L523 Y525 Y531	M445-Q449 HydrophobicContact CE-CG 4.07Å; M445-Q449 WeakPolarHBondContact O-CG 3.36Å; M445-Q449 PolarHBondContact O-N 3.48Å; I447-Q449 PolarHBondContact O-N 2.96Å; Q449-F451 VanDerWaalsContact C-N 3.31Å; Q449-Y453 WeakPolarHBondContact O-CB 3.48Å; Q449-Y453 PolarHBondContact O-N 3.06Å; Q449-L523 HydrophobicContact CB-CD2 4.27Å; Q449-Y525 VanDerWaalsContact CD-CD2 3.4Å; Q449-Y525 VanDerWaalsContact NE2-CD2 3.26Å; Q449-Y531 WeakPolarHBondContact CB-OH 3.46Å; Q449-Y531 PolarHBondContact OE1-OH 3.45Å
450	L	93.3	Very high	91.2	Very high	5 Å²	5	18.1 Å²	18.1	3%	0.026	9%	0.09	C	C	.	.	H	α-helix	trans	-64.2	-40.6	173	-76.5	174.4	0	0	0	111.1	I203 Y446 I447 F448 Y454 L523 Y531	I203-L450 HydrophobicContact CD1-CD1 3.38Å; I203-L450 HydrophobicContact CD1-CG 4.46Å; Y446-L450 PolarHBondContact O-N 3.2Å; I447-L450 WeakPolarHBondContact O-CB 3.4Å; I447-L450 PolarHBondContact O-N 3.02Å; F448-L450 PolarHBondContact O-N 3.48Å; L450-Y454 HydrophobicContact CD2-CD2 4Å; L450-Y454 HydrophobicContact CD2-CE2 3.92Å; L450-Y454 WeakPolarHBondContact O-CB 3.46Å; L450-Y454 PolarHBondContact O-N 3.28Å; L450-L523 HydrophobicContact CD2-CD2 3.98Å; L450-Y531 HydrophobicContact CD1-CD1 4.29Å; L450-Y531 HydrophobicContact CD1-CE1 4.03Å; L450-Y531 HydrophobicContact CD2-CD1 4.02Å; L450-Y531 HydrophobicContact CD2-CE1 3.92Å; L450-Y531 HydrophobicContact CG-CD1 4.2Å; L450-Y531 HydrophobicContact CG-CE1 3.69Å
451	F	93.7	Very high	90.9	Very high	29 Å²	29	18.1 Å²	18.1	13%	0.127	9%	0.089	C	C	.	.	I	π-helix	trans	-66.4	-50.5	176.1	-86.6	-111	0	0	0	111.6	Y128 I131 Y132 M439 I447 F448 Q449 Y453 A455 L542	Y128-F451 HydrophobicContact CD1-CD1 4.42Å; Y128-F451 AromaticContact CD1-CE1 3.82Å; Y128-F451 HydrophobicContact CD1-CE1 3.82Å; Y128-F451 HydrophobicContact CG-CE1 4.38Å; I131-F451 HydrophobicContact CG2-CE1 4.37Å; Y132-F451 HydrophobicContact CD1-CB 3.81Å; Y132-F451 HydrophobicContact CD1-CD1 4.25Å; Y132-F451 HydrophobicContact CG-CB 3.82Å; M439-F451 HydrophobicContact CE-CB 4.03Å; M439-F451 HydrophobicContact CE-CD1 3.73Å; M439-F451 HydrophobicContact CE-CD2 3.3Å; M439-F451 HydrophobicContact CE-CE1 3.94Å; M439-F451 HydrophobicContact CE-CE2 3.53Å; M439-F451 HydrophobicContact CE-CG 3.41Å; M439-F451 VanDerWaalsContact CE-CG 3.41Å; M439-F451 HydrophobicContact CE-CZ 3.84Å; I447-F451 HydrophobicContact CG2-CD2 4.14Å; I447-F451 HydrophobicContact CG2-CE2 4.08Å; I447-F451 WeakPolarHBondContact O-CD2 3.4Å; I447-F451 PolarHBondContact O-N 3.47Å; F448-F451 PolarHBondContact O-N 2.9Å; Q449-F451 VanDerWaalsContact C-N 3.31Å; F451-Y453 VanDerWaalsContact C-N 3.31Å; F451-Y453 PolarHBondContact O-N 3.14Å; F451-A455 HydrophobicContact CB-CB 4.44Å; F451-A455 HydrophobicContact CD1-CB 4.23Å; F451-A455 HydrophobicContact CG-CB 4.49Å; F451-A455 WeakPolarHBondContact O-CB 3.41Å; F451-A455 PolarHBondContact O-N 3.25Å; F451-L542 HydrophobicContact CD2-CD1 3.96Å; F451-L542 HydrophobicContact CE1-CD2 4.44Å; F451-L542 HydrophobicContact CE2-CD1 4.01Å; F451-L542 HydrophobicContact CG-CD1 4.37Å; F451-L542 HydrophobicContact CZ-CD1 4.45Å; F451-L542 HydrophobicContact CZ-CD2 4.19Å
452	D	90.4	Very high	90.6	Very high	50 Å²	50	17.3 Å²	17.3	27%	0.267	8%	0.084	S	C	.	.	I	π-helix	trans	-59.8	-40.6	179.7	-175.7	53.3	0	0	0	112.1	Y132 F448	Y132-D452 HydrophobicContact CD2-CB 4.3Å; Y132-D452 HydrophobicContact CE2-CB 3.91Å; F448-D452 HydrophobicContact CE1-CB 4.31Å; F448-D452 PolarHBondContact O-N 3.25Å
453	Y	89.4	Confident	90.4	Very high	84 Å²	84	16.8 Å²	16.8	33%	0.329	8%	0.082	S	C	.	.	I	π-helix	trans	-80.7	-39.8	-177.3	-167.9	-91.9	0	0	0	114.1	Q449 F451 S457 T521 L523	Q449-Y453 WeakPolarHBondContact O-CB 3.48Å; Q449-Y453 PolarHBondContact O-N 3.06Å; F451-Y453 VanDerWaalsContact C-N 3.31Å; F451-Y453 PolarHBondContact O-N 3.14Å; Y453-S457 WeakPolarHBondContact O-CB 3.36Å; Y453-T521 PolarHBondContact OH-O 2.92Å; Y453-L523 HydrophobicContact CD1-CB 4.02Å; Y453-L523 HydrophobicContact CD1-CD1 4.47Å; Y453-L523 HydrophobicContact CD2-CD1 3.68Å; Y453-L523 HydrophobicContact CE1-CB 4.22Å; Y453-L523 HydrophobicContact CE2-CD1 4.28Å; Y453-L523 HydrophobicContact CG-CB 4.19Å; Y453-L523 HydrophobicContact CG-CD1 3.79Å; Y453-L523 HydrophobicContact CG-CD2 4.33Å; Y453-L523 HydrophobicContact CG-CG 4.31Å
454	Y	90.8	Very high	90.4	Very high	7 Å²	7	16.8 Å²	16.8	3%	0.027	8%	0.082	C	C	.	.	I	π-helix	trans	-107.9	-40.8	-172.2	-68.9	-83.2	0	0	0	115	L450 S457 Y520 L523 G539	L450-Y454 HydrophobicContact CD2-CD2 4Å; L450-Y454 HydrophobicContact CD2-CE2 3.92Å; L450-Y454 WeakPolarHBondContact O-CB 3.46Å; L450-Y454 PolarHBondContact O-N 3.28Å; Y454-S457 WeakPolarHBondContact O-CB 3.41Å; Y454-S457 PolarHBondContact O-N 3.07Å; Y454-S457 PolarHBondContact O-OG 3.18Å; Y454-Y520 HydrophobicContact CE1-CE2 4.02Å; Y454-Y520 PolarHBondContact OH-OH 2.7Å; Y454-L523 HydrophobicContact CE2-CB 4.06Å; Y454-L523 HydrophobicContact CE2-CD2 4.2Å; Y454-G539 WeakPolarHBondContact CB-O 3.42Å; Y454-G539 VanDerWaalsContact CD2-CA 3.49Å; Y454-G539 VanDerWaalsContact CG-CA 3.45Å
455	A	87.4	Confident	90.4	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.082	C	C	.	.	I	π-helix	trans	-71.2	-47.8	-166.3	0	0	0	0	0	112.4	Y128 F451 L542	Y128-A455 HydrophobicContact CD2-CB 3.69Å; Y128-A455 HydrophobicContact CE2-CB 4.42Å; Y128-A455 HydrophobicContact CG-CB 3.88Å; F451-A455 HydrophobicContact CB-CB 4.44Å; F451-A455 HydrophobicContact CD1-CB 4.23Å; F451-A455 HydrophobicContact CG-CB 4.49Å; F451-A455 WeakPolarHBondContact O-CB 3.41Å; F451-A455 PolarHBondContact O-N 3.25Å; A455-L542 HydrophobicContact CB-CB 4.01Å; A455-L542 HydrophobicContact CB-CD1 4.35Å
456	S	77	Confident	90.4	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.014	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	47.8	170.5	-164	0	0	0	0	110.3	I125	I125-S456 WeakPolarHBondContact CG2-OG 3.2Å
457	S	78.4	Confident	90.5	Very high	14 Å²	14	19.9 Å²	19.9	10%	0.098	10%	0.097	C	C	.	.			trans	-73.1	152.5	-179.2	78.4	0	0	0	0	111.3	Y453 Y454 I459 C460 L461	Y453-S457 WeakPolarHBondContact O-CB 3.36Å; Y454-S457 WeakPolarHBondContact O-CB 3.41Å; Y454-S457 PolarHBondContact O-N 3.07Å; Y454-S457 PolarHBondContact O-OG 3.18Å; S457-I459 PolarHBondContact O-N 3.02Å; S457-I459 VanDerWaalsContact O-N 3.11Å; S457-I459 PolarHBondContact OG-N 3.16Å; S457-C460 WeakPolarHBondContact O-CB 3.23Å; S457-C460 PolarHBondContact O-N 3.41Å; S457-C460 VanDerWaalsContact O-N 3.09Å; S457-C460 PolarHBondContact OG-N 2.87Å; S457-C460 PolarHBondContact OG-SG 3.37Å; S457-L461 PolarHBondContact O-N 3.47Å
458	G	80	Confident	90.5	Very high	10 Å²	10	18.5 Å²	18.5	10%	0.103	9%	0.09	C	C	.	.	H	α-helix	trans	-58.6	-24.2	172.4	0	0	0	0	0	113.4	L462	G458-L462 VanDerWaalsContact O-CB 3.31Å; G458-L462 WeakPolarHBondContact O-CB 3.35Å; G458-L462 WeakPolarHBondContact O-CD1 3.3Å; G458-L462 WeakPolarHBondContact O-CG 3.37Å; G458-L462 PolarHBondContact O-N 3.26Å
459	I	85	Confident	90.6	Very high	32 Å²	32	18.4 Å²	18.4	16%	0.164	9%	0.09	C	C	.	.	H	α-helix	trans	-66.2	-45.3	175.6	-58.5	-178.3	0	0	0	110.6	S457 F463 F513 S516	S457-I459 PolarHBondContact O-N 3.02Å; S457-I459 VanDerWaalsContact O-N 3.11Å; S457-I459 PolarHBondContact OG-N 3.16Å; I459-F463 WeakPolarHBondContact O-CB 3.27Å; I459-F463 PolarHBondContact O-N 2.91Å; I459-F513 HydrophobicContact CG2-CD2 3.74Å; I459-F513 HydrophobicContact CG2-CE2 3.54Å; I459-S516 WeakPolarHBondContact CG1-OG 3.33Å
460	C	91.2	Very high	90.8	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-61.6	-45.9	177.2	-58.3	0	0	0	0	110.8	I125 S457 F463 L464	I125-C460 HydrophobicContact CD1-CB 4.34Å; S457-C460 WeakPolarHBondContact O-CB 3.23Å; S457-C460 PolarHBondContact O-N 3.41Å; S457-C460 VanDerWaalsContact O-N 3.09Å; S457-C460 PolarHBondContact OG-N 2.87Å; S457-C460 PolarHBondContact OG-SG 3.37Å; C460-F463 PolarHBondContact O-N 3.48Å; C460-L464 WeakPolarHBondContact O-CG 2.98Å; C460-L464 PolarHBondContact O-N 3.39Å
461	L	92.1	Very high	90.9	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-66	-44	-179.4	-57.4	179.6	0	0	0	112	I125 F292 F293 C298 Q299 S457 F463 L464 S465	I125-L461 HydrophobicContact CD1-CD2 4Å; I125-L461 HydrophobicContact CG2-CD2 4.43Å; F292-L461 HydrophobicContact CB-CB 4.19Å; F292-L461 HydrophobicContact CB-CD1 4.19Å; F292-L461 HydrophobicContact CD1-CB 4.16Å; F293-L461 HydrophobicContact CB-CD1 4.49Å; C298-L461 HydrophobicContact CB-CD2 4.26Å; Q299-L461 HydrophobicContact CG-CD2 3.94Å; S457-L461 PolarHBondContact O-N 3.47Å; L461-F463 VanDerWaalsContact C-N 3.32Å; L461-F463 PolarHBondContact O-N 3.08Å; L461-L464 PolarHBondContact O-N 3.28Å; L461-S465 WeakPolarHBondContact O-CB 3.29Å; L461-S465 PolarHBondContact O-N 2.93Å
462	L	91.8	Very high	91.1	Very high	1 Å²	1	17.5 Å²	17.5	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-60.9	-41.7	175.6	-72.9	170	0	0	0	111.6	T289 F292 G458 V466 C509 T512	T289-L462 HydrophobicContact CG2-CD1 4.09Å; F292-L462 HydrophobicContact CD2-CD2 3.87Å; F292-L462 HydrophobicContact CE2-CD2 3.73Å; F292-L462 HydrophobicContact CG-CD2 4.46Å; F292-L462 HydrophobicContact CZ-CD2 4.26Å; G458-L462 VanDerWaalsContact O-CB 3.31Å; G458-L462 WeakPolarHBondContact O-CB 3.35Å; G458-L462 WeakPolarHBondContact O-CD1 3.3Å; G458-L462 WeakPolarHBondContact O-CG 3.37Å; G458-L462 PolarHBondContact O-N 3.26Å; L462-V466 PolarHBondContact O-N 3.17Å; L462-C509 HydrophobicContact CD2-CB 4.14Å; L462-T512 HydrophobicContact CD1-CG2 3.63Å
463	F	93.1	Very high	91.3	Very high	37 Å²	37	15.4 Å²	15.4	16%	0.162	8%	0.078	C	C	.	.	H	α-helix	trans	-62.2	-50.4	176.4	176.3	-94.4	0	0	0	111.5	I459 C460 L461 S465 V466 F467 F513 M547	I459-F463 WeakPolarHBondContact O-CB 3.27Å; I459-F463 PolarHBondContact O-N 2.91Å; C460-F463 PolarHBondContact O-N 3.48Å; L461-F463 VanDerWaalsContact C-N 3.32Å; L461-F463 PolarHBondContact O-N 3.08Å; F463-S465 VanDerWaalsContact C-N 3.31Å; F463-S465 PolarHBondContact O-N 3.3Å; F463-V466 PolarHBondContact O-N 2.9Å; F463-F467 HydrophobicContact CD1-CD2 4.16Å; F463-F467 HydrophobicContact CD1-CE2 4.03Å; F463-F467 HydrophobicContact CD2-CE2 4.01Å; F463-F467 AromaticContact CE1-CD2 3.88Å; F463-F467 HydrophobicContact CE1-CD2 3.88Å; F463-F467 AromaticContact CE1-CE2 3.49Å; F463-F467 HydrophobicContact CE1-CE2 3.49Å; F463-F467 VanDerWaalsContact CE1-CE2 3.49Å; F463-F467 HydrophobicContact CE1-CZ 4.44Å; F463-F467 AromaticContact CE2-CE2 3.51Å; F463-F467 HydrophobicContact CE2-CE2 3.51Å; F463-F467 HydrophobicContact CE2-CZ 4.19Å; F463-F467 HydrophobicContact CG-CE2 4.27Å; F463-F467 HydrophobicContact CZ-CD2 4.09Å; F463-F467 AromaticContact CZ-CE2 3.23Å; F463-F467 HydrophobicContact CZ-CE2 3.23Å; F463-F467 AromaticContact CZ-CZ 3.88Å; F463-F467 HydrophobicContact CZ-CZ 3.88Å; F463-F467 VanDerWaalsContact O-CD2 3.31Å; F463-F467 WeakPolarHBondContact O-CD2 3.36Å; F463-F513 HydrophobicContact CB-CD2 4.03Å; F463-F513 HydrophobicContact CB-CE2 3.83Å; F463-F513 HydrophobicContact CD2-CE1 4.29Å; F463-F513 AromaticContact CD2-CE2 3.98Å; F463-F513 HydrophobicContact CD2-CE2 3.98Å; F463-F513 AromaticContact CD2-CZ 3.79Å; F463-F513 HydrophobicContact CD2-CZ 3.79Å; F463-F513 HydrophobicContact CG-CE2 4.33Å; F463-M547 HydrophobicContact CB-CE 3.98Å; F463-M547 HydrophobicContact CB-CG 4.48Å; F463-M547 HydrophobicContact CD1-CB 3.92Å; F463-M547 HydrophobicContact CD1-CE 4.07Å; F463-M547 HydrophobicContact CD1-CG 3.81Å; F463-M547 HydrophobicContact CD2-CE 3.6Å; F463-M547 HydrophobicContact CE1-CB 3.81Å; F463-M547 HydrophobicContact CE1-CE 4.44Å; F463-M547 HydrophobicContact CE1-CG 4.23Å; F463-M547 WeakPolarHBondContact CE1-O 3.43Å; F463-M547 HydrophobicContact CE2-CE 3.98Å; F463-M547 HydrophobicContact CG-CE 3.62Å; F463-M547 HydrophobicContact CG-CG 4.21Å; F463-M547 HydrophobicContact CZ-CB 4.38Å; F463-M547 HydrophobicContact CZ-CE 4.38Å
464	L	95.2	Very high	91.6	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.6	-38.7	179.7	-70.9	-178.3	0	0	0	112.4	A121 I125 C298 C460 L461 V466 F467 E468 V550	A121-L464 HydrophobicContact CB-CD1 3.76Å; A121-L464 HydrophobicContact CB-CD2 3.5Å; A121-L464 HydrophobicContact CB-CG 4.29Å; I125-L464 HydrophobicContact CD1-CD1 3.36Å; C298-L464 HydrophobicContact CB-CB 3.96Å; C460-L464 WeakPolarHBondContact O-CG 2.98Å; C460-L464 PolarHBondContact O-N 3.39Å; L461-L464 PolarHBondContact O-N 3.28Å; L464-V466 VanDerWaalsContact C-N 3.25Å; L464-V466 PolarHBondContact O-N 3.45Å; L464-F467 PolarHBondContact O-N 3.41Å; L464-E468 PolarHBondContact O-N 3.36Å; L464-V550 HydrophobicContact CD2-CG2 3.55Å
465	S	95.5	Very high	91.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-57.1	-38.7	177.9	-168.3	0	0	0	0	113.1	F292 C298 L461 F463 F467 E468 V469	F292-S465 VanDerWaalsContact CE1-OG 3.25Å; F292-S465 WeakPolarHBondContact CE1-OG 3.41Å; F292-S465 WeakPolarHBondContact CZ-OG 3.44Å; C298-S465 WeakPolarHBondContact SG-CA 3.48Å; C298-S465 VanDerWaalsContact SG-CB 3.59Å; C298-S465 PolarHBondContact SG-N 2.87Å; C298-S465 VanDerWaalsContact SG-N 3.42Å; L461-S465 WeakPolarHBondContact O-CB 3.29Å; L461-S465 PolarHBondContact O-N 2.93Å; F463-S465 VanDerWaalsContact C-N 3.31Å; F463-S465 PolarHBondContact O-N 3.3Å; S465-F467 VanDerWaalsContact C-N 3.33Å; S465-F467 PolarHBondContact O-N 2.97Å; S465-E468 PolarHBondContact O-N 2.91Å; S465-V469 WeakPolarHBondContact O-CB 3.39Å; S465-V469 VanDerWaalsContact O-CG2 3.29Å; S465-V469 WeakPolarHBondContact O-CG2 3.48Å; S465-V469 PolarHBondContact O-N 3.38Å
466	V	96.1	Very high	92.3	Very high	23 Å²	23	20.8 Å²	20.8	14%	0.139	10%	0.103	C	C	.	.	H	α-helix	trans	-59.7	-46	175.5	175.4	0	0	0	0	110.2	L462 F463 L464 V470 C509 L510	L462-V466 PolarHBondContact O-N 3.17Å; F463-V466 PolarHBondContact O-N 2.9Å; L464-V466 VanDerWaalsContact C-N 3.25Å; L464-V466 PolarHBondContact O-N 3.45Å; V466-V470 HydrophobicContact CG1-CG2 4.28Å; V466-V470 WeakPolarHBondContact O-CB 3.29Å; V466-V470 WeakPolarHBondContact O-CG2 3.36Å; V466-V470 PolarHBondContact O-N 2.74Å; V466-C509 HydrophobicContact CG2-CB 3.74Å; V466-L510 HydrophobicContact CG2-CB 4.29Å
467	F	96.4	Very high	93.1	Very high	59 Å²	59	21.8 Å²	21.8	26%	0.259	11%	0.113	S	C	.	.	H	α-helix	trans	-70	-40.8	-179.8	-71.5	-81.1	0	0	0	113	F115 I118 F463 L464 S465 C471 V550	F115-F467 HydrophobicContact CE1-CD1 4.16Å; I118-F467 HydrophobicContact CD1-CB 3.97Å; I118-F467 HydrophobicContact CG1-CB 4.17Å; F463-F467 HydrophobicContact CD1-CD2 4.16Å; F463-F467 HydrophobicContact CD1-CE2 4.03Å; F463-F467 HydrophobicContact CD2-CE2 4.01Å; F463-F467 AromaticContact CE1-CD2 3.88Å; F463-F467 HydrophobicContact CE1-CD2 3.88Å; F463-F467 AromaticContact CE1-CE2 3.49Å; F463-F467 HydrophobicContact CE1-CE2 3.49Å; F463-F467 VanDerWaalsContact CE1-CE2 3.49Å; F463-F467 HydrophobicContact CE1-CZ 4.44Å; F463-F467 AromaticContact CE2-CE2 3.51Å; F463-F467 HydrophobicContact CE2-CE2 3.51Å; F463-F467 HydrophobicContact CE2-CZ 4.19Å; F463-F467 HydrophobicContact CG-CE2 4.27Å; F463-F467 HydrophobicContact CZ-CD2 4.09Å; F463-F467 AromaticContact CZ-CE2 3.23Å; F463-F467 HydrophobicContact CZ-CE2 3.23Å; F463-F467 AromaticContact CZ-CZ 3.88Å; F463-F467 HydrophobicContact CZ-CZ 3.88Å; F463-F467 VanDerWaalsContact O-CD2 3.31Å; F463-F467 WeakPolarHBondContact O-CD2 3.36Å; L464-F467 PolarHBondContact O-N 3.41Å; S465-F467 VanDerWaalsContact C-N 3.33Å; S465-F467 PolarHBondContact O-N 2.97Å; F467-C471 WeakPolarHBondContact O-CB 3.45Å; F467-C471 PolarHBondContact O-N 3.25Å; F467-V550 HydrophobicContact CB-CG1 4.23Å; F467-V550 HydrophobicContact CD1-CG1 3.72Å; F467-V550 HydrophobicContact CD2-CG1 4.31Å; F467-V550 HydrophobicContact CE1-CG1 4.14Å; F467-V550 HydrophobicContact CG-CG1 3.81Å
468	E	96.1	Very high	93.9	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-57.9	-53.2	176.5	-74.4	-169.1	159.5	0	0	111.5	W108 I118 C298 L464 S465 C471 I472	W108-E468 HydrophobicContact CH2-CB 3.92Å; W108-E468 HydrophobicContact CH2-CG 3.98Å; W108-E468 HydrophobicContact CZ2-CB 3.96Å; W108-E468 HydrophobicContact CZ2-CG 3.55Å; I118-E468 HydrophobicContact CD1-CG 4.38Å; I118-E468 HydrophobicContact CG2-CG 3.42Å; I118-E468 VanDerWaalsContact CG2-CG 3.42Å; C298-E468 PolarHBondContact SG-OE2 3Å; L464-E468 PolarHBondContact O-N 3.36Å; S465-E468 PolarHBondContact O-N 2.91Å; E468-C471 PolarHBondContact O-N 2.93Å; E468-I472 PolarHBondContact O-N 3.46Å
469	V	96.8	Very high	94.6	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-69.4	-41.2	-175.5	174.6	0	0	0	0	110.6	V89 L92 S465 I472 S473 W501 T505 P506	V89-V469 HydrophobicContact CG2-CG2 3.86Å; L92-V469 HydrophobicContact CD1-CG2 4.26Å; S465-V469 WeakPolarHBondContact O-CB 3.39Å; S465-V469 VanDerWaalsContact O-CG2 3.29Å; S465-V469 WeakPolarHBondContact O-CG2 3.48Å; S465-V469 PolarHBondContact O-N 3.38Å; V469-I472 PolarHBondContact O-N 2.94Å; V469-S473 VanDerWaalsContact O-CB 3.23Å; V469-S473 WeakPolarHBondContact O-CB 3.34Å; V469-S473 PolarHBondContact O-N 2.92Å; V469-S473 PolarHBondContact O-OG 3.21Å; V469-W501 HydrophobicContact CG1-CB 4.04Å; V469-W501 WeakPolarHBondContact CG1-O 3.37Å; V469-T505 HydrophobicContact CG2-CG2 4.03Å; V469-P506 HydrophobicContact CG1-CG 4.47Å
470	V	96.7	Very high	95.1	Very high	48 Å²	48	27 Å²	27	29%	0.291	13%	0.133	S	C	.	.	H	α-helix	trans	-64.4	-40.9	175.5	169.3	0	0	0	0	111.4	V466 W474 V475 P506	V466-V470 HydrophobicContact CG1-CG2 4.28Å; V466-V470 WeakPolarHBondContact O-CB 3.29Å; V466-V470 WeakPolarHBondContact O-CG2 3.36Å; V466-V470 PolarHBondContact O-N 2.74Å; V470-W474 HydrophobicContact CG1-CB 4.47Å; V470-W474 WeakPolarHBondContact O-CB 3.49Å; V470-W474 PolarHBondContact O-N 2.91Å; V470-V475 PolarHBondContact O-N 3.46Å; V470-P506 HydrophobicContact CG2-CB 4.26Å
471	C	96.4	Very high	95.3	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.133	C	C	.	.	I	π-helix	trans	-60.1	-48.3	177	-178.1	0	0	0	0	111.1	W108 C112 F115 I118 F467 E468 V475 Y476	W108-C471 HydrophobicContact CZ3-CB 3.97Å; C112-C471 VanDerWaalsContact CB-SG 3.52Å; F115-C471 HydrophobicContact CB-CB 4.4Å; F115-C471 HydrophobicContact CD2-CB 4.18Å; F115-C471 HydrophobicContact CG-CB 4.24Å; I118-C471 HydrophobicContact CD1-CB 4.16Å; F467-C471 WeakPolarHBondContact O-CB 3.45Å; F467-C471 PolarHBondContact O-N 3.25Å; E468-C471 PolarHBondContact O-N 2.93Å; C471-V475 WeakPolarHBondContact O-CB 3.36Å; C471-V475 PolarHBondContact O-N 3.26Å; C471-Y476 WeakPolarHBondContact O-CB 3.44Å; C471-Y476 PolarHBondContact O-N 2.99Å
472	I	96.8	Very high	95.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.135	C	C	.	.	I	π-helix	trans	-71.2	-47.2	-179.5	-65.9	-63.4	0	0	0	111.9	L92 L96 W108 I111 E468 V469 G477 F481	L92-I472 HydrophobicContact CD1-CB 4.06Å; L92-I472 HydrophobicContact CD1-CG1 4.15Å; L92-I472 HydrophobicContact CD1-CG2 4.11Å; L92-I472 HydrophobicContact CD2-CG1 4.16Å; L92-I472 HydrophobicContact CG-CG1 4.36Å; L96-I472 HydrophobicContact CD1-CD1 4.07Å; W108-I472 HydrophobicContact CH2-CD1 4.12Å; W108-I472 HydrophobicContact CH2-CG1 3.78Å; W108-I472 HydrophobicContact CZ3-CD1 3.88Å; W108-I472 HydrophobicContact CZ3-CG1 3.92Å; I111-I472 HydrophobicContact CG2-CD1 3.77Å; E468-I472 PolarHBondContact O-N 3.46Å; V469-I472 PolarHBondContact O-N 2.94Å; I472-G477 CarbonylContact O-C 3.37Å; I472-G477 VanDerWaalsContact O-C 3.29Å; I472-G477 PolarHBondContact O-N 3.49Å; I472-F481 HydrophobicContact CG2-CB 3.98Å; I472-F481 HydrophobicContact CG2-CD1 3.54Å; I472-F481 HydrophobicContact CG2-CD2 4.28Å; I472-F481 HydrophobicContact CG2-CE1 4.05Å; I472-F481 HydrophobicContact CG2-CG 3.68Å
473	S	95.7	Very high	95.6	Very high	5 Å²	5	28.7 Å²	28.7	4%	0.035	14%	0.142	C	C	.	.	I	π-helix	trans	-78.3	-37	-170.3	62.4	0	0	0	0	113.9	V469 A478 W501	V469-S473 VanDerWaalsContact O-CB 3.23Å; V469-S473 WeakPolarHBondContact O-CB 3.34Å; V469-S473 PolarHBondContact O-N 2.92Å; V469-S473 PolarHBondContact O-OG 3.21Å; S473-A478 PolarHBondContact O-N 3.36Å; S473-W501 PolarHBondContact OG-O 3.14Å
474	W	95.9	Very high	95.7	Very high	144 Å²	144	27 Å²	27	55%	0.545	13%	0.134	S	C	.	.	I	π-helix	trans	-108.9	-34	-173.7	-67.5	95.2	0	0	0	114.2	V470 L502 F503	V470-W474 HydrophobicContact CG1-CB 4.47Å; V470-W474 WeakPolarHBondContact O-CB 3.49Å; V470-W474 PolarHBondContact O-N 2.91Å; W474-L502 HydrophobicContact CD2-CD2 4.45Å; W474-L502 HydrophobicContact CZ2-CD2 4.13Å; W474-L502 PolarHBondContact NE1-O 3.4Å; W474-F503 AromaticContact CH2-CE1 3.88Å; W474-F503 HydrophobicContact CH2-CE1 3.88Å; W474-F503 HydrophobicContact CH2-CZ 4.21Å; W474-F503 HydrophobicContact CZ2-CD1 4.14Å; W474-F503 AromaticContact CZ2-CE1 3.52Å; W474-F503 HydrophobicContact CZ2-CE1 3.52Å; W474-F503 HydrophobicContact CZ2-CZ 4.07Å
475	V	95.6	Very high	95.8	Very high	48 Å²	48	27 Å²	27	29%	0.291	13%	0.134	S	C	.	.	I	π-helix	trans	-91.1	-53.4	-176.5	-175.6	0	0	0	0	111.2	F115 V470 C471 I573	F115-V475 HydrophobicContact CE2-CB 4.48Å; F115-V475 HydrophobicContact CE2-CG1 4.29Å; F115-V475 HydrophobicContact CE2-CG2 3.88Å; V470-V475 PolarHBondContact O-N 3.46Å; C471-V475 WeakPolarHBondContact O-CB 3.36Å; C471-V475 PolarHBondContact O-N 3.26Å; V475-I573 HydrophobicContact CG1-CB 4Å; V475-I573 HydrophobicContact CG1-CG2 3.84Å
476	Y	95.6	Very high	95.8	Very high	13 Å²	13	30 Å²	30	5%	0.051	15%	0.148	C	C	.	.	I	π-helix	trans	-73.8	-35.9	174.4	-175.7	-100	0	0	0	111.8	Y99 I111 C471 R480 F481 N484 P575	Y99-Y476 PolarHBondContact OH-OH 3.28Å; I111-Y476 HydrophobicContact CD1-CD2 4.44Å; I111-Y476 HydrophobicContact CD1-CE2 3.91Å; I111-Y476 HydrophobicContact CG2-CD2 3.76Å; I111-Y476 HydrophobicContact CG2-CE2 4.24Å; I111-Y476 HydrophobicContact CG2-CG 4.08Å; C471-Y476 WeakPolarHBondContact O-CB 3.44Å; C471-Y476 PolarHBondContact O-N 2.99Å; Y476-R480 HydrophobicContact CD1-CB 4.5Å; Y476-R480 HydrophobicContact CD1-CG 4.46Å; Y476-R480 HydrophobicContact CE1-CB 4.18Å; Y476-R480 HydrophobicContact CE1-CG 3.75Å; Y476-R480 PolarHBondContact OH-NE 3.48Å; Y476-F481 HydrophobicContact CD1-CB 4.09Å; Y476-F481 HydrophobicContact CD1-CD2 4.49Å; Y476-F481 HydrophobicContact CE1-CB 4.1Å; Y476-F481 HydrophobicContact CE1-CD2 4.16Å; Y476-N484 PolarHBondContact OH-ND2 2.92Å; Y476-P575 HydrophobicContact CD2-CB 4.26Å; Y476-P575 HydrophobicContact CD2-CG 4.25Å; Y476-P575 HydrophobicContact CE2-CB 3.74Å; Y476-P575 HydrophobicContact CE2-CG 3.76Å
477	G	95.7	Very high	95.8	Very high	22 Å²	22	30.5 Å²	30.5	23%	0.227	15%	0.15	C	C	.	.	I	π-helix	trans	103.4	119.9	177	0	0	0	0	0	112.2	I472 D479 R480 F481	I472-G477 CarbonylContact O-C 3.37Å; I472-G477 VanDerWaalsContact O-C 3.29Å; I472-G477 PolarHBondContact O-N 3.49Å; G477-D479 VanDerWaalsContact C-N 3.3Å; G477-D479 PolarHBondContact O-N 2.94Å; G477-R480 PolarHBondContact O-N 3.26Å; G477-F481 PolarHBondContact O-N 3.25Å
478	A	95.1	Very high	95.8	Very high	5 Å²	5	27.8 Å²	27.8	4%	0.041	14%	0.138	C	C	.	.	H	α-helix	trans	-59.9	-37.8	-179.7	0	0	0	0	0	113	S473 F481 Y482 K498 L502	S473-A478 PolarHBondContact O-N 3.36Å; A478-F481 PolarHBondContact O-N 3.41Å; A478-Y482 WeakPolarHBondContact O-CB 3.21Å; A478-Y482 WeakPolarHBondContact O-CD2 3.36Å; A478-Y482 PolarHBondContact O-N 3.01Å; A478-K498 HydrophobicContact CB-CG 4.23Å; A478-L502 HydrophobicContact CB-CD1 4.33Å; A478-L502 HydrophobicContact CB-CD2 3.97Å; A478-L502 HydrophobicContact CB-CG 4.09Å
479	D	95	Very high	95.8	Very high	87 Å²	87	28.7 Å²	28.7	47%	0.465	14%	0.143	S	C	.	.	H	α-helix	trans	-63.3	-48.6	176.1	-76.8	-67.3	0	0	0	111.7	G477 F481 Y482 D483 K498	G477-D479 VanDerWaalsContact C-N 3.3Å; G477-D479 PolarHBondContact O-N 2.94Å; D479-F481 VanDerWaalsContact C-N 3.3Å; D479-F481 PolarHBondContact O-N 3.33Å; D479-Y482 CarbonylContact O-C 3.59Å; D479-Y482 WeakPolarHBondContact O-CA 3.45Å; D479-Y482 WeakPolarHBondContact O-CB 3.33Å; D479-Y482 PolarHBondContact O-N 3.42Å; D479-Y482 VanDerWaalsContact O-N 3.09Å; D479-D483 PolarHBondContact O-N 2.85Å; D479-K498 IonicContact OD1-NZ 2.56Å; D479-K498 PolarHBondContact OD1-NZ 2.79Å; D479-K498 IonicContact OD2-NZ 2.91Å; D479-K498 PolarHBondContact OD2-NZ 3.17Å
480	R	94.4	Very high	95.7	Very high	75 Å²	75	31.7 Å²	31.7	28%	0.283	17%	0.174	S	C	.	.	H	α-helix	trans	-58	-43.7	176.5	-175.7	-178.6	-178.1	161.7	4.1	112	Y476 G477 D483 N484 P575	Y476-R480 HydrophobicContact CD1-CB 4.5Å; Y476-R480 HydrophobicContact CD1-CG 4.46Å; Y476-R480 HydrophobicContact CE1-CB 4.18Å; Y476-R480 HydrophobicContact CE1-CG 3.75Å; Y476-R480 PolarHBondContact OH-NE 3.48Å; G477-R480 PolarHBondContact O-N 3.26Å; R480-D483 PolarHBondContact O-N 3.25Å; R480-N484 PolarHBondContact O-N 2.91Å; R480-N484 PolarHBondContact O-OD1 3.41Å; R480-P575 VanDerWaalsContact NH2-CG 3.27Å
481	F	95.6	Very high	95.7	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.7	-36.9	177.6	-165.7	-118.7	0	0	0	112.1	L92 A95 L96 I472 Y476 G477 A478 D479 D483 N484 I485 W501	L92-F481 HydrophobicContact CG-CE1 4.28Å; A95-F481 HydrophobicContact CB-CE1 4.5Å; A95-F481 HydrophobicContact CB-CZ 4.06Å; L96-F481 HydrophobicContact CB-CZ 4.43Å; L96-F481 HydrophobicContact CD1-CE2 4.4Å; I472-F481 HydrophobicContact CG2-CB 3.98Å; I472-F481 HydrophobicContact CG2-CD1 3.54Å; I472-F481 HydrophobicContact CG2-CD2 4.28Å; I472-F481 HydrophobicContact CG2-CE1 4.05Å; I472-F481 HydrophobicContact CG2-CG 3.68Å; Y476-F481 HydrophobicContact CD1-CB 4.09Å; Y476-F481 HydrophobicContact CD1-CD2 4.49Å; Y476-F481 HydrophobicContact CE1-CB 4.1Å; Y476-F481 HydrophobicContact CE1-CD2 4.16Å; G477-F481 PolarHBondContact O-N 3.25Å; A478-F481 PolarHBondContact O-N 3.41Å; D479-F481 VanDerWaalsContact C-N 3.3Å; D479-F481 PolarHBondContact O-N 3.33Å; F481-D483 VanDerWaalsContact C-N 3.35Å; F481-N484 PolarHBondContact O-N 2.92Å; F481-I485 HydrophobicContact CD1-CD1 3.75Å; F481-I485 HydrophobicContact CE1-CD1 3.69Å; F481-I485 HydrophobicContact CE1-CG1 4.45Å; F481-I485 HydrophobicContact CG-CD1 4.45Å; F481-I485 HydrophobicContact CZ-CD1 4.33Å; F481-I485 VanDerWaalsContact O-CG1 3.29Å; F481-I485 WeakPolarHBondContact O-CG1 3.49Å; F481-I485 PolarHBondContact O-N 3.46Å; F481-W501 HydrophobicContact CD1-CE3 4.39Å; F481-W501 AromaticContact CD1-CH2 3.89Å; F481-W501 HydrophobicContact CD1-CH2 3.89Å; F481-W501 AromaticContact CD1-CZ3 3.62Å; F481-W501 HydrophobicContact CD1-CZ3 3.62Å; F481-W501 AromaticContact CE1-CH2 3.78Å; F481-W501 HydrophobicContact CE1-CH2 3.78Å; F481-W501 HydrophobicContact CE1-CZ2 4.44Å; F481-W501 HydrophobicContact CE1-CZ3 4.01Å
482	Y	94.5	Very high	95.5	Very high	7 Å²	7	38.1 Å²	38.1	3%	0.027	19%	0.194	C	C	.	.	H	α-helix	trans	-61.2	-41.5	171.2	-103.3	-113.5	0	0	0	112.6	A478 D479 I485 E486 P493 W494 V497 K498 W501	A478-Y482 WeakPolarHBondContact O-CB 3.21Å; A478-Y482 WeakPolarHBondContact O-CD2 3.36Å; A478-Y482 PolarHBondContact O-N 3.01Å; D479-Y482 CarbonylContact O-C 3.59Å; D479-Y482 WeakPolarHBondContact O-CA 3.45Å; D479-Y482 WeakPolarHBondContact O-CB 3.33Å; D479-Y482 PolarHBondContact O-N 3.42Å; D479-Y482 VanDerWaalsContact O-N 3.09Å; Y482-I485 PolarHBondContact O-N 3.18Å; Y482-E486 PolarHBondContact O-N 3.23Å; Y482-P493 HydrophobicContact CE1-CB 4.45Å; Y482-W494 PolarHBondContact OH-O 3.03Å; Y482-V497 WeakPolarHBondContact OH-CB 3.46Å; Y482-K498 HydrophobicContact CD2-CB 4.29Å; Y482-K498 HydrophobicContact CD2-CD 4.24Å; Y482-K498 HydrophobicContact CD2-CG 3.99Å; Y482-K498 HydrophobicContact CE1-CB 4.18Å; Y482-K498 HydrophobicContact CE2-CB 3.47Å; Y482-K498 VanDerWaalsContact CE2-CB 3.47Å; Y482-K498 HydrophobicContact CE2-CD 4.23Å; Y482-K498 HydrophobicContact CE2-CG 3.64Å; Y482-K498 HydrophobicContact CG-CD 4.42Å; Y482-K498 VanDerWaalsContact CZ-CB 3.43Å; Y482-K498 WeakPolarHBondContact OH-CB 3.3Å; Y482-K498 PolarHBondContact OH-N 3.02Å; Y482-W501 HydrophobicContact CD2-CE3 4.23Å; Y482-W501 AromaticContact CD2-CZ3 3.69Å; Y482-W501 HydrophobicContact CD2-CZ3 3.69Å; Y482-W501 AromaticContact CE2-CE3 3.71Å; Y482-W501 HydrophobicContact CE2-CE3 3.71Å; Y482-W501 HydrophobicContact CE2-CH2 4.18Å; Y482-W501 AromaticContact CE2-CZ3 3.3Å; Y482-W501 HydrophobicContact CE2-CZ3 3.3Å
483	D	95.3	Very high	95.4	Very high	28 Å²	28	38.4 Å²	38.4	15%	0.15	20%	0.195	C	C	.	.	H	α-helix	trans	-65.5	-40.5	177.4	-59.8	-22.5	0	0	0	111	D479 R480 F481 I485 E486 D487 R492 P582	D479-D483 PolarHBondContact O-N 2.85Å; R480-D483 PolarHBondContact O-N 3.25Å; F481-D483 VanDerWaalsContact C-N 3.35Å; D483-I485 VanDerWaalsContact C-N 3.32Å; D483-I485 PolarHBondContact O-N 3.26Å; D483-E486 PolarHBondContact O-N 2.95Å; D483-D487 PolarHBondContact O-N 3.24Å; D483-R492 IonicContact OD1-CZ 3.36Å; D483-R492 IonicContact OD1-NH1 3.52Å; D483-R492 IonicContact OD1-NH2 2.64Å; D483-R492 PolarHBondContact OD1-NH2 3.36Å; D483-P582 HydrophobicContact CB-CB 4.42Å; D483-P582 HydrophobicContact CB-CG 4.05Å
484	N	95.6	Very high	95.3	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-61.8	-40.6	172.6	-63.3	-17.1	0	0	0	111.8	Y99 Y476 R480 F481 D487 M488 P582	Y99-N484 HydrophobicContact CD2-CB 4.07Å; Y99-N484 WeakPolarHBondContact CE1-ND2 3.28Å; Y99-N484 HydrophobicContact CE2-CB 3.9Å; Y99-N484 VanDerWaalsContact CZ-ND2 3.3Å; Y99-N484 PolarHBondContact OH-ND2 3.25Å; Y476-N484 PolarHBondContact OH-ND2 2.92Å; R480-N484 PolarHBondContact O-N 2.91Å; R480-N484 PolarHBondContact O-OD1 3.41Å; F481-N484 PolarHBondContact O-N 2.92Å; N484-D487 PolarHBondContact O-N 3.28Å; N484-M488 WeakPolarHBondContact O-CG 3.33Å; N484-M488 PolarHBondContact O-N 3.3Å; N484-P582 WeakPolarHBondContact OD1-CD 3.24Å; N484-P582 VanDerWaalsContact OD1-CG 3.26Å; N484-P582 WeakPolarHBondContact OD1-CG 3.28Å
485	I	96.3	Very high	95.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.3	-44.3	177.1	-70.8	163.1	0	0	0	110.5	F91 A95 F481 Y482 D483 D487 M488 I489 P493 W501	F91-I485 HydrophobicContact CE1-CD1 3.85Å; F91-I485 HydrophobicContact CZ-CD1 3.91Å; F91-I485 HydrophobicContact CZ-CG1 4.33Å; F91-I485 HydrophobicContact CZ-CG2 3.85Å; A95-I485 HydrophobicContact CB-CD1 4.44Å; A95-I485 HydrophobicContact CB-CG1 4.3Å; F481-I485 HydrophobicContact CD1-CD1 3.75Å; F481-I485 HydrophobicContact CE1-CD1 3.69Å; F481-I485 HydrophobicContact CE1-CG1 4.45Å; F481-I485 HydrophobicContact CG-CD1 4.45Å; F481-I485 HydrophobicContact CZ-CD1 4.33Å; F481-I485 VanDerWaalsContact O-CG1 3.29Å; F481-I485 WeakPolarHBondContact O-CG1 3.49Å; F481-I485 PolarHBondContact O-N 3.46Å; Y482-I485 PolarHBondContact O-N 3.18Å; D483-I485 VanDerWaalsContact C-N 3.32Å; D483-I485 PolarHBondContact O-N 3.26Å; I485-D487 VanDerWaalsContact C-N 3.28Å; I485-D487 PolarHBondContact O-N 3.03Å; I485-M488 HydrophobicContact CB-CE 4.34Å; I485-M488 HydrophobicContact CG1-CE 3.84Å; I485-M488 WeakPolarHBondContact O-CB 3.28Å; I485-M488 PolarHBondContact O-N 3.25Å; I485-M488 VanDerWaalsContact O-N 3.13Å; I485-I489 HydrophobicContact CG2-CD1 3.73Å; I485-I489 HydrophobicContact CG2-CG1 4.14Å; I485-I489 WeakPolarHBondContact O-CG1 3.49Å; I485-I489 PolarHBondContact O-N 3.18Å; I485-P493 HydrophobicContact CG2-CG 3.59Å; I485-W501 HydrophobicContact CD1-CH2 3.73Å; I485-W501 HydrophobicContact CD1-CZ3 4.12Å
486	E	96.1	Very high	95	Very high	63 Å²	63	42.9 Å²	42.9	29%	0.294	22%	0.221	S	C	.	.	H	α-helix	trans	-59.4	-39.7	175.9	-177.6	170.4	-155.6	0	0	111.5	Y482 D483 G490 R492	Y482-E486 PolarHBondContact O-N 3.23Å; D483-E486 PolarHBondContact O-N 2.95Å; E486-G490 WeakPolarHBondContact O-CA 3.42Å; E486-G490 PolarHBondContact O-N 2.98Å; E486-R492 HydrophobicContact CB-CG 4.15Å; E486-R492 HydrophobicContact CG-CG 4.2Å; E486-R492 IonicContact OE1-NE 3.93Å; E486-R492 WeakPolarHBondContact OE2-CG 3.38Å; E486-R492 IonicContact OE2-CZ 3.25Å; E486-R492 VanDerWaalsContact OE2-CZ 3.25Å; E486-R492 IonicContact OE2-NE 2.73Å; E486-R492 PolarHBondContact OE2-NE 3.35Å; E486-R492 IonicContact OE2-NH2 2.92Å; E486-R492 PolarHBondContact OE2-NH2 2.91Å
487	D	96	Very high	95	Very high	35 Å²	35	42.5 Å²	42.5	19%	0.187	22%	0.22	C	C	.	.	H	α-helix	trans	-64.9	-38.1	173.5	-174.9	78	0	0	0	112.8	Y311 H312 D483 N484 I485 P582	Y311-D487 VanDerWaalsContact CE1-OD2 3.29Å; Y311-D487 WeakPolarHBondContact CE1-OD2 3.36Å; Y311-D487 PolarHBondContact OH-OD2 3.21Å; H312-D487 PolarHBondContact CE1-O 2.83Å; D483-D487 PolarHBondContact O-N 3.24Å; N484-D487 PolarHBondContact O-N 3.28Å; I485-D487 VanDerWaalsContact C-N 3.28Å; I485-D487 PolarHBondContact O-N 3.03Å; D487-P582 HydrophobicContact CB-CB 4.41Å
488	M	96.3	Very high	95	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-67.6	-57.5	174.9	-73.9	-171.6	-66.8	0	0	112.3	A95 Q98 Y99 Y311 H312 N484 I485	A95-M488 HydrophobicContact CB-CE 4.24Å; Q98-M488 HydrophobicContact CB-SD 4.34Å; Q98-M488 HydrophobicContact CG-SD 4.11Å; Y99-M488 VanDerWaalsContact CA-SD 3.58Å; Y99-M488 HydrophobicContact CD2-SD 4.4Å; Y311-M488 HydrophobicContact CD1-CG 4.31Å; Y311-M488 HydrophobicContact CD2-CG 4.19Å; Y311-M488 HydrophobicContact CE1-CG 3.89Å; Y311-M488 HydrophobicContact CE2-CG 3.76Å; Y311-M488 HydrophobicContact CE2-SD 4.38Å; Y311-M488 HydrophobicContact CG-CG 4.45Å; H312-M488 VanDerWaalsContact CA-O 3.3Å; H312-M488 WeakPolarHBondContact CA-O 3.42Å; H312-M488 PolarHBondContact ND1-O 3.49Å; N484-M488 WeakPolarHBondContact O-CG 3.33Å; N484-M488 PolarHBondContact O-N 3.3Å; I485-M488 HydrophobicContact CB-CE 4.34Å; I485-M488 HydrophobicContact CG1-CE 3.84Å; I485-M488 WeakPolarHBondContact O-CB 3.28Å; I485-M488 PolarHBondContact O-N 3.25Å; I485-M488 VanDerWaalsContact O-N 3.13Å
489	I	96.6	Very high	95.1	Very high	19 Å²	19	47.2 Å²	47.2	10%	0.097	24%	0.236	C	C	.	.	H	α-helix	trans	-99.9	-9.2	-166.8	75.9	-177	0	0	0	114.3	I485 Y491 P493	I485-I489 HydrophobicContact CG2-CD1 3.73Å; I485-I489 HydrophobicContact CG2-CG1 4.14Å; I485-I489 WeakPolarHBondContact O-CG1 3.49Å; I485-I489 PolarHBondContact O-N 3.18Å; I489-Y491 HydrophobicContact CB-CD1 4.4Å; I489-Y491 HydrophobicContact CB-CE1 4.02Å; I489-Y491 HydrophobicContact CD1-CD1 4.19Å; I489-Y491 HydrophobicContact CD1-CD2 4.26Å; I489-Y491 HydrophobicContact CD1-CE1 3.73Å; I489-Y491 HydrophobicContact CD1-CE2 3.85Å; I489-Y491 HydrophobicContact CD1-CG 4.42Å; I489-Y491 HydrophobicContact CG1-CD1 3.8Å; I489-Y491 HydrophobicContact CG1-CE1 3.66Å; I489-Y491 HydrophobicContact CG1-CG 4.26Å; I489-Y491 VanDerWaalsContact CG1-O 3.26Å; I489-Y491 WeakPolarHBondContact CG1-O 3.17Å; I489-Y491 VanDerWaalsContact O-CD1 3.29Å; I489-Y491 WeakPolarHBondContact O-CD1 3.35Å; I489-P493 HydrophobicContact CD1-CG 4.38Å
490	G	95.4	Very high	95.1	Very high	64 Å²	64	43 Å²	43	66%	0.66	21%	0.214	S	C	*	.	S	Bend	trans	84.8	4.5	177.7	0	0	0	0	0	115.6	E486	E486-G490 WeakPolarHBondContact O-CA 3.42Å; E486-G490 PolarHBondContact O-N 2.98Å
491	Y	95.1	Very high	95.3	Very high	75 Å²	75	39.5 Å²	39.5	29%	0.294	20%	0.2	S	C	.	.	S	Bend	trans	-156.4	158	178	64.3	-81.5	0	0	0	111.3	N314 Y316 I489	N314-Y491 VanDerWaalsContact CG-OH 3.31Å; N314-Y491 WeakPolarHBondContact ND2-CE1 3.37Å; N314-Y491 PolarHBondContact ND2-OH 3.29Å; N314-Y491 VanDerWaalsContact ND2-OH 3.09Å; N314-Y491 PolarHBondContact OD1-OH 3.12Å; Y316-Y491 HydrophobicContact CD1-CE2 4.01Å; I489-Y491 HydrophobicContact CB-CD1 4.4Å; I489-Y491 HydrophobicContact CB-CE1 4.02Å; I489-Y491 HydrophobicContact CD1-CD1 4.19Å; I489-Y491 HydrophobicContact CD1-CD2 4.26Å; I489-Y491 HydrophobicContact CD1-CE1 3.73Å; I489-Y491 HydrophobicContact CD1-CE2 3.85Å; I489-Y491 HydrophobicContact CD1-CG 4.42Å; I489-Y491 HydrophobicContact CG1-CD1 3.8Å; I489-Y491 HydrophobicContact CG1-CE1 3.66Å; I489-Y491 HydrophobicContact CG1-CG 4.26Å; I489-Y491 VanDerWaalsContact CG1-O 3.26Å; I489-Y491 WeakPolarHBondContact CG1-O 3.17Å; I489-Y491 VanDerWaalsContact O-CD1 3.29Å; I489-Y491 WeakPolarHBondContact O-CD1 3.35Å
492	R	93.7	Very high	95.3	Very high	108 Å²	108	41 Å²	41	41%	0.408	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-79.7	134	174.5	-67	-170.2	-177	-133.2	-12.9	111.9	D483 E486	D483-R492 IonicContact OD1-CZ 3.36Å; D483-R492 IonicContact OD1-NH1 3.52Å; D483-R492 IonicContact OD1-NH2 2.64Å; D483-R492 PolarHBondContact OD1-NH2 3.36Å; E486-R492 HydrophobicContact CB-CG 4.15Å; E486-R492 HydrophobicContact CG-CG 4.2Å; E486-R492 IonicContact OE1-NE 3.93Å; E486-R492 WeakPolarHBondContact OE2-CG 3.38Å; E486-R492 IonicContact OE2-CZ 3.25Å; E486-R492 VanDerWaalsContact OE2-CZ 3.25Å; E486-R492 IonicContact OE2-NE 2.73Å; E486-R492 PolarHBondContact OE2-NE 3.35Å; E486-R492 IonicContact OE2-NH2 2.92Å; E486-R492 PolarHBondContact OE2-NH2 2.91Å
493	P	94.4	Very high	95.4	Very high	5 Å²	5	46.4 Å²	46.4	3%	0.032	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-61.6	170.3	171.6	-22.8	33.3	0	0	0	113.4	F91 Y316 Y482 I485 I489	F91-P493 HydrophobicContact CE1-CB 4.24Å; F91-P493 HydrophobicContact CE1-CG 3.78Å; F91-P493 HydrophobicContact CZ-CG 3.89Å; Y316-P493 HydrophobicContact CD2-CB 3.95Å; Y316-P493 HydrophobicContact CD2-CG 4.37Å; Y316-P493 HydrophobicContact CE2-CB 3.87Å; Y316-P493 HydrophobicContact CG-CB 4.35Å; Y482-P493 HydrophobicContact CE1-CB 4.45Å; I485-P493 HydrophobicContact CG2-CG 3.59Å; I489-P493 HydrophobicContact CD1-CG 4.38Å
494	W	93.1	Very high	95.5	Very high	158 Å²	158	48.3 Å²	48.3	60%	0.598	24%	0.242	S	C	*	.	P	Polyproline II helix	trans	-60.8	130.9	178.6	-172.2	39.4	0	0	0	111.2	Y316 Y482 L496 V497	Y316-W494 WeakPolarHBondContact OH-CB 3.37Å; Y482-W494 PolarHBondContact OH-O 3.03Å; W494-L496 HydrophobicContact CD2-CB 3.87Å; W494-L496 HydrophobicContact CE3-CB 3.8Å; W494-L496 HydrophobicContact CE3-CD2 4.04Å; W494-L496 HydrophobicContact CH2-CB 4.26Å; W494-L496 HydrophobicContact CH2-CD2 3.59Å; W494-L496 HydrophobicContact CZ2-CB 4.31Å; W494-L496 HydrophobicContact CZ2-CD2 4.35Å; W494-L496 HydrophobicContact CZ3-CB 4.01Å; W494-L496 HydrophobicContact CZ3-CD2 3.41Å; W494-L496 VanDerWaalsContact CZ3-CD2 3.41Å; W494-L496 HydrophobicContact CZ3-CG 4.35Å; W494-L496 PolarHBondContact O-N 3.2Å; W494-V497 WeakPolarHBondContact O-CB 3.3Å; W494-V497 PolarHBondContact O-N 3.2Å
495	P	93.1	Very high	95.5	Very high	81 Å²	81	48.3 Å²	48.3	53%	0.526	24%	0.242	S	C	.	.	H	α-helix	trans	-58.1	-23.3	-172.4	-29.9	37.5	0	0	0	115.5	V497 K498 I499	P495-V497 PolarHBondContact O-N 3.38Å; P495-K498 WeakPolarHBondContact O-CB 3.36Å; P495-K498 PolarHBondContact O-N 3.33Å; P495-I499 WeakPolarHBondContact O-CG1 3.26Å; P495-I499 PolarHBondContact O-N 3.08Å; P495-I499 VanDerWaalsContact O-N 3.09Å
496	L	92.6	Very high	95.5	Very high	53 Å²	53	49.1 Å²	49.1	28%	0.277	25%	0.247	S	C	.	.	H	α-helix	trans	-56.5	-35.8	175.1	-173.6	65.4	0	0	0	111.5	W494 K498 I499 S500 L504	W494-L496 HydrophobicContact CD2-CB 3.87Å; W494-L496 HydrophobicContact CE3-CB 3.8Å; W494-L496 HydrophobicContact CE3-CD2 4.04Å; W494-L496 HydrophobicContact CH2-CB 4.26Å; W494-L496 HydrophobicContact CH2-CD2 3.59Å; W494-L496 HydrophobicContact CZ2-CB 4.31Å; W494-L496 HydrophobicContact CZ2-CD2 4.35Å; W494-L496 HydrophobicContact CZ3-CB 4.01Å; W494-L496 HydrophobicContact CZ3-CD2 3.41Å; W494-L496 VanDerWaalsContact CZ3-CD2 3.41Å; W494-L496 HydrophobicContact CZ3-CG 4.35Å; W494-L496 PolarHBondContact O-N 3.2Å; L496-K498 VanDerWaalsContact C-N 3.31Å; L496-K498 PolarHBondContact O-N 3.12Å; L496-I499 PolarHBondContact O-N 3.39Å; L496-S500 WeakPolarHBondContact O-CB 3.16Å; L496-S500 PolarHBondContact O-N 3.34Å; L496-S500 PolarHBondContact O-OG 3.29Å; L496-L504 HydrophobicContact CD1-CD1 4.41Å
497	V	95.3	Very high	95.4	Very high	5 Å²	5	48 Å²	48	3%	0.03	25%	0.253	C	S	.	.	H	α-helix	trans	-60.7	-42.2	176.6	172.9	0	0	0	0	110.9	P88 F91 Y316 Y482 W494 P495 S500 W501	P88-V497 HydrophobicContact CB-CG1 4.45Å; F91-V497 HydrophobicContact CD1-CG1 3.88Å; F91-V497 HydrophobicContact CE1-CG1 4.3Å; Y316-V497 HydrophobicContact CE2-CG2 4.17Å; Y482-V497 WeakPolarHBondContact OH-CB 3.46Å; W494-V497 WeakPolarHBondContact O-CB 3.3Å; W494-V497 PolarHBondContact O-N 3.2Å; P495-V497 PolarHBondContact O-N 3.38Å; V497-S500 PolarHBondContact O-N 3.49Å; V497-W501 HydrophobicContact CG1-CD2 4.09Å; V497-W501 HydrophobicContact CG1-CE3 4.37Å; V497-W501 HydrophobicContact CG1-CH2 3.71Å; V497-W501 HydrophobicContact CG1-CZ2 3.36Å; V497-W501 HydrophobicContact CG1-CZ3 4.2Å; V497-W501 PolarHBondContact O-N 2.92Å; V497-W501 VanDerWaalsContact O-N 3.07Å
498	K	95.3	Very high	95.3	Very high	44 Å²	44	48.2 Å²	48.2	19%	0.191	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-45.9	177.5	-161.1	180	171.3	-169.6	0	111.2	A478 D479 Y482 P495 L496 S500 W501 L502	A478-K498 HydrophobicContact CB-CG 4.23Å; D479-K498 IonicContact OD1-NZ 2.56Å; D479-K498 PolarHBondContact OD1-NZ 2.79Å; D479-K498 IonicContact OD2-NZ 2.91Å; D479-K498 PolarHBondContact OD2-NZ 3.17Å; Y482-K498 HydrophobicContact CD2-CB 4.29Å; Y482-K498 HydrophobicContact CD2-CD 4.24Å; Y482-K498 HydrophobicContact CD2-CG 3.99Å; Y482-K498 HydrophobicContact CE1-CB 4.18Å; Y482-K498 HydrophobicContact CE2-CB 3.47Å; Y482-K498 VanDerWaalsContact CE2-CB 3.47Å; Y482-K498 HydrophobicContact CE2-CD 4.23Å; Y482-K498 HydrophobicContact CE2-CG 3.64Å; Y482-K498 HydrophobicContact CG-CD 4.42Å; Y482-K498 VanDerWaalsContact CZ-CB 3.43Å; Y482-K498 WeakPolarHBondContact OH-CB 3.3Å; Y482-K498 PolarHBondContact OH-N 3.02Å; P495-K498 WeakPolarHBondContact O-CB 3.36Å; P495-K498 PolarHBondContact O-N 3.33Å; L496-K498 VanDerWaalsContact C-N 3.31Å; L496-K498 PolarHBondContact O-N 3.12Å; K498-S500 VanDerWaalsContact C-N 3.29Å; K498-S500 PolarHBondContact O-N 3.02Å; K498-W501 PolarHBondContact O-N 3.1Å; K498-L502 HydrophobicContact CG-CD1 4.08Å; K498-L502 PolarHBondContact O-N 3.43Å
499	I	96.6	Very high	95.2	Very high	81 Å²	81	48.1 Å²	48.1	42%	0.415	25%	0.253	S	S	.	.	H	α-helix	trans	-63.8	-39.5	-179.8	-64.6	168.9	0	0	0	110.1	P495 L496 L502 F503 L504	P495-I499 WeakPolarHBondContact O-CG1 3.26Å; P495-I499 PolarHBondContact O-N 3.08Å; P495-I499 VanDerWaalsContact O-N 3.09Å; L496-I499 PolarHBondContact O-N 3.39Å; I499-L502 PolarHBondContact O-N 3.5Å; I499-F503 PolarHBondContact O-N 2.84Å; I499-L504 HydrophobicContact CG2-CD1 4.07Å; I499-L504 HydrophobicContact CG2-CG 4.16Å; I499-L504 PolarHBondContact O-N 3.18Å
500	S	96.6	Very high	95	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.267	C	S	.	.	I	π-helix	trans	-58.9	-50.2	174.3	-68.5	0	0	0	0	111.3	V84 L496 V497 K498 L502 L504 T505	V84-S500 WeakPolarHBondContact O-CB 3.34Å; L496-S500 WeakPolarHBondContact O-CB 3.16Å; L496-S500 PolarHBondContact O-N 3.34Å; L496-S500 PolarHBondContact O-OG 3.29Å; V497-S500 PolarHBondContact O-N 3.49Å; K498-S500 VanDerWaalsContact C-N 3.29Å; K498-S500 PolarHBondContact O-N 3.02Å; S500-L502 PolarHBondContact O-N 3Å; S500-L504 PolarHBondContact O-N 2.93Å; S500-T505 WeakPolarHBondContact O-CB 3.14Å; S500-T505 PolarHBondContact O-N 3.16Å; S500-T505 PolarHBondContact O-OG1 3.28Å
501	W	96.9	Very high	94.8	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.259	C	S	.	.	I	π-helix	trans	-61.1	-43.5	176.8	-62.3	-25	0	0	0	113	P88 F91 L92 V469 S473 F481 Y482 I485 V497 K498	P88-W501 VanDerWaalsContact C-NE1 3.27Å; P88-W501 PolarHBondContact O-NE1 2.81Å; F91-W501 AromaticContact CD1-CH2 3.85Å; F91-W501 HydrophobicContact CD1-CH2 3.85Å; F91-W501 AromaticContact CD1-CZ2 3.65Å; F91-W501 HydrophobicContact CD1-CZ2 3.65Å; F91-W501 AromaticContact CE1-CH2 3.81Å; F91-W501 HydrophobicContact CE1-CH2 3.81Å; F91-W501 HydrophobicContact CE1-CZ2 4.11Å; L92-W501 HydrophobicContact CB-CZ2 3.78Å; L92-W501 HydrophobicContact CD1-CD2 4.31Å; L92-W501 HydrophobicContact CD1-CG 4.32Å; L92-W501 HydrophobicContact CG-CZ2 4.47Å; V469-W501 HydrophobicContact CG1-CB 4.04Å; V469-W501 WeakPolarHBondContact CG1-O 3.37Å; S473-W501 PolarHBondContact OG-O 3.14Å; F481-W501 HydrophobicContact CD1-CE3 4.39Å; F481-W501 AromaticContact CD1-CH2 3.89Å; F481-W501 HydrophobicContact CD1-CH2 3.89Å; F481-W501 AromaticContact CD1-CZ3 3.62Å; F481-W501 HydrophobicContact CD1-CZ3 3.62Å; F481-W501 AromaticContact CE1-CH2 3.78Å; F481-W501 HydrophobicContact CE1-CH2 3.78Å; F481-W501 HydrophobicContact CE1-CZ2 4.44Å; F481-W501 HydrophobicContact CE1-CZ3 4.01Å; Y482-W501 HydrophobicContact CD2-CE3 4.23Å; Y482-W501 AromaticContact CD2-CZ3 3.69Å; Y482-W501 HydrophobicContact CD2-CZ3 3.69Å; Y482-W501 AromaticContact CE2-CE3 3.71Å; Y482-W501 HydrophobicContact CE2-CE3 3.71Å; Y482-W501 HydrophobicContact CE2-CH2 4.18Å; Y482-W501 AromaticContact CE2-CZ3 3.3Å; Y482-W501 HydrophobicContact CE2-CZ3 3.3Å; I485-W501 HydrophobicContact CD1-CH2 3.73Å; I485-W501 HydrophobicContact CD1-CZ3 4.12Å; V497-W501 HydrophobicContact CG1-CD2 4.09Å; V497-W501 HydrophobicContact CG1-CE3 4.37Å; V497-W501 HydrophobicContact CG1-CH2 3.71Å; V497-W501 HydrophobicContact CG1-CZ2 3.36Å; V497-W501 HydrophobicContact CG1-CZ3 4.2Å; V497-W501 PolarHBondContact O-N 2.92Å; V497-W501 VanDerWaalsContact O-N 3.07Å; K498-W501 PolarHBondContact O-N 3.1Å
502	L	96.4	Very high	94.6	Very high	32 Å²	32	47.4 Å²	47.4	17%	0.168	25%	0.248	C	C	.	.	I	π-helix	trans	-69.3	-40.2	-176	-77.6	164.6	0	0	0	113.3	W474 A478 K498 I499 S500	W474-L502 HydrophobicContact CD2-CD2 4.45Å; W474-L502 HydrophobicContact CZ2-CD2 4.13Å; W474-L502 PolarHBondContact NE1-O 3.4Å; A478-L502 HydrophobicContact CB-CD1 4.33Å; A478-L502 HydrophobicContact CB-CD2 3.97Å; A478-L502 HydrophobicContact CB-CG 4.09Å; K498-L502 HydrophobicContact CG-CD1 4.08Å; K498-L502 PolarHBondContact O-N 3.43Å; I499-L502 PolarHBondContact O-N 3.5Å; S500-L502 PolarHBondContact O-N 3Å
503	F	96.2	Very high	94.3	Very high	120 Å²	120	43.2 Å²	43.2	53%	0.526	23%	0.233	S	C	.	.	I	π-helix	trans	-135.3	-49.6	-165.7	-55.6	-67.4	0	0	0	114.4	W474 I499 G507	W474-F503 AromaticContact CH2-CE1 3.88Å; W474-F503 HydrophobicContact CH2-CE1 3.88Å; W474-F503 HydrophobicContact CH2-CZ 4.21Å; W474-F503 HydrophobicContact CZ2-CD1 4.14Å; W474-F503 AromaticContact CZ2-CE1 3.52Å; W474-F503 HydrophobicContact CZ2-CE1 3.52Å; W474-F503 HydrophobicContact CZ2-CZ 4.07Å; I499-F503 PolarHBondContact O-N 2.84Å; F503-G507 PolarHBondContact O-N 3.46Å; F503-G507 VanDerWaalsContact O-N 3.11Å
504	L	96.8	Very high	94.1	Very high	69 Å²	69	48.7 Å²	48.7	36%	0.361	26%	0.256	S	S	.	.	I	π-helix	trans	-74.9	-47.7	-165.7	-51.2	175.1	0	0	0	112.2	V84 L496 I499 S500 L508	V84-L504 HydrophobicContact CG1-CB 3.36Å; V84-L504 HydrophobicContact CG1-CD1 4.41Å; V84-L504 HydrophobicContact CG2-CD1 4.39Å; L496-L504 HydrophobicContact CD1-CD1 4.41Å; I499-L504 HydrophobicContact CG2-CD1 4.07Å; I499-L504 HydrophobicContact CG2-CG 4.16Å; I499-L504 PolarHBondContact O-N 3.18Å; S500-L504 PolarHBondContact O-N 2.93Å; L504-L508 WeakPolarHBondContact O-CB 3.31Å; L504-L508 PolarHBondContact O-N 3.17Å
505	T	96.3	Very high	93.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-54.1	177.3	-48.5	0	0	0	0	112.2	V84 C85 V89 V469 S500 G507 L508 C509	V84-T505 PolarHBondContact O-OG1 2.82Å; C85-T505 HydrophobicContact CB-CG2 4.25Å; V89-T505 HydrophobicContact CG2-CG2 3.51Å; V469-T505 HydrophobicContact CG2-CG2 4.03Å; S500-T505 WeakPolarHBondContact O-CB 3.14Å; S500-T505 PolarHBondContact O-N 3.16Å; S500-T505 PolarHBondContact O-OG1 3.28Å; T505-G507 VanDerWaalsContact C-N 3.32Å; T505-G507 PolarHBondContact O-N 3.3Å; T505-L508 PolarHBondContact O-N 3.42Å; T505-C509 VanDerWaalsContact O-CB 3.3Å; T505-C509 WeakPolarHBondContact O-CB 3.45Å; T505-C509 PolarHBondContact O-N 3.49Å; T505-C509 PolarHBondContact O-SG 2.87Å
506	P	96	Very high	93.4	Very high	17 Å²	17	39.9 Å²	39.9	11%	0.11	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-38.6	-179	24.2	-33.2	0	0	0	111.6	V469 V470 L510	V469-P506 HydrophobicContact CG1-CG 4.47Å; V470-P506 HydrophobicContact CG2-CB 4.26Å; P506-L510 WeakPolarHBondContact O-CB 3.18Å; P506-L510 PolarHBondContact O-N 3.43Å
507	G	95.4	Very high	93	Very high	41 Å²	41	40.8 Å²	40.8	42%	0.423	22%	0.22	S	C	.	.	H	α-helix	trans	-63.2	-49.1	176.8	0	0	0	0	0	112.8	F503 T505 A511	F503-G507 PolarHBondContact O-N 3.46Å; F503-G507 VanDerWaalsContact O-N 3.11Å; T505-G507 VanDerWaalsContact C-N 3.32Å; T505-G507 PolarHBondContact O-N 3.3Å; G507-A511 VanDerWaalsContact O-CB 3.29Å; G507-A511 WeakPolarHBondContact O-CB 3.39Å; G507-A511 PolarHBondContact O-N 2.98Å
508	L	94	Very high	92.6	Very high	39 Å²	39	44.4 Å²	44.4	20%	0.204	25%	0.246	C	C	.	.	H	α-helix	trans	-68.1	-41.7	-179	-173.8	60.1	0	0	0	111.8	I80 F81 V84 L504 T505 T512	I80-L508 HydrophobicContact CG2-CD2 4.23Å; F81-L508 HydrophobicContact CD1-CD2 3.63Å; F81-L508 HydrophobicContact CD1-CG 4.15Å; F81-L508 HydrophobicContact CD2-CD2 4.28Å; F81-L508 HydrophobicContact CE1-CD1 4.25Å; F81-L508 HydrophobicContact CE1-CD2 3.53Å; F81-L508 HydrophobicContact CE1-CG 3.52Å; F81-L508 HydrophobicContact CE2-CD1 4.34Å; F81-L508 HydrophobicContact CE2-CD2 4.17Å; F81-L508 HydrophobicContact CE2-CG 4.39Å; F81-L508 HydrophobicContact CG-CD2 4.02Å; F81-L508 HydrophobicContact CZ-CD1 3.85Å; F81-L508 HydrophobicContact CZ-CD2 3.81Å; F81-L508 HydrophobicContact CZ-CG 3.65Å; V84-L508 HydrophobicContact CB-CD2 4.44Å; V84-L508 HydrophobicContact CG1-CD2 4.11Å; L504-L508 WeakPolarHBondContact O-CB 3.31Å; L504-L508 PolarHBondContact O-N 3.17Å; T505-L508 PolarHBondContact O-N 3.42Å; L508-T512 WeakPolarHBondContact O-CB 3.45Å; L508-T512 PolarHBondContact O-N 2.9Å; L508-T512 PolarHBondContact O-OG1 3.31Å
509	C	93.3	Very high	92.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66	-43.4	177.6	-63.6	0	0	0	0	111.5	F292 L462 V466 T505 T512 F513	F292-C509 VanDerWaalsContact CZ-SG 3.5Å; L462-C509 HydrophobicContact CD2-CB 4.14Å; V466-C509 HydrophobicContact CG2-CB 3.74Å; T505-C509 VanDerWaalsContact O-CB 3.3Å; T505-C509 WeakPolarHBondContact O-CB 3.45Å; T505-C509 PolarHBondContact O-N 3.49Å; T505-C509 PolarHBondContact O-SG 2.87Å; C509-T512 PolarHBondContact O-N 3.47Å; C509-F513 WeakPolarHBondContact O-CB 3.19Å; C509-F513 PolarHBondContact O-N 2.84Å
510	L	92.9	Very high	91.5	Very high	73 Å²	73	47.9 Å²	47.9	38%	0.382	26%	0.256	S	S	.	.	H	α-helix	trans	-65.7	-42.8	178.6	-171.7	65.8	0	0	0	112	V466 P506 F513 F514	V466-L510 HydrophobicContact CG2-CB 4.29Å; P506-L510 WeakPolarHBondContact O-CB 3.18Å; P506-L510 PolarHBondContact O-N 3.43Å; L510-F513 PolarHBondContact O-N 3Å; L510-F514 HydrophobicContact CD1-CD2 3.94Å; L510-F514 HydrophobicContact CD1-CE2 3.35Å; L510-F514 HydrophobicContact CD1-CZ 3.91Å; L510-F514 HydrophobicContact CD2-CE2 3.98Å; L510-F514 HydrophobicContact CG-CD2 3.79Å; L510-F514 HydrophobicContact CG-CE2 3.45Å; L510-F514 VanDerWaalsContact CG-CE2 3.45Å; L510-F514 HydrophobicContact CG-CZ 4.45Å; L510-F514 WeakPolarHBondContact O-CD2 3.25Å; L510-F514 PolarHBondContact O-N 3.27Å
511	A	91.6	Very high	90.7	Very high	60 Å²	60	51.4 Å²	51.4	50%	0.496	28%	0.278	S	S	.	.	H	α-helix	trans	-60.6	-45.7	175.5	0	0	0	0	0	111.6	G507 F515	G507-A511 VanDerWaalsContact O-CB 3.29Å; G507-A511 WeakPolarHBondContact O-CB 3.39Å; G507-A511 PolarHBondContact O-N 2.98Å; A511-F515 VanDerWaalsContact O-CB 3.32Å; A511-F515 WeakPolarHBondContact O-CB 3.31Å; A511-F515 PolarHBondContact O-N 3.05Å
512	T	89.2	Confident	90.2	Very high	10 Å²	10	54.5 Å²	54.5	6%	0.061	30%	0.298	C	S	.	.	H	α-helix	trans	-66.8	-40.4	179	-51.5	0	0	0	0	111.5	F81 M285 L462 L508 C509 F515 S516	F81-T512 HydrophobicContact CZ-CG2 4.35Å; F81-T512 WeakPolarHBondContact CZ-OG1 3.49Å; M285-T512 HydrophobicContact CB-CG2 4.29Å; M285-T512 HydrophobicContact CG-CG2 3.91Å; L462-T512 HydrophobicContact CD1-CG2 3.63Å; L508-T512 WeakPolarHBondContact O-CB 3.45Å; L508-T512 PolarHBondContact O-N 2.9Å; L508-T512 PolarHBondContact O-OG1 3.31Å; C509-T512 PolarHBondContact O-N 3.47Å; T512-F515 PolarHBondContact O-N 3.45Å; T512-S516 WeakPolarHBondContact O-CB 3.48Å; T512-S516 PolarHBondContact O-N 2.89Å
513	F	89.2	Confident	89.8	Confident	19 Å²	19	53.7 Å²	53.7	8%	0.083	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-53.8	176.3	173.8	-99.6	0	0	0	111.5	I459 F463 C509 L510 F515 S516 L517 M547	I459-F513 HydrophobicContact CG2-CD2 3.74Å; I459-F513 HydrophobicContact CG2-CE2 3.54Å; F463-F513 HydrophobicContact CB-CD2 4.03Å; F463-F513 HydrophobicContact CB-CE2 3.83Å; F463-F513 HydrophobicContact CD2-CE1 4.29Å; F463-F513 AromaticContact CD2-CE2 3.98Å; F463-F513 HydrophobicContact CD2-CE2 3.98Å; F463-F513 AromaticContact CD2-CZ 3.79Å; F463-F513 HydrophobicContact CD2-CZ 3.79Å; F463-F513 HydrophobicContact CG-CE2 4.33Å; C509-F513 WeakPolarHBondContact O-CB 3.19Å; C509-F513 PolarHBondContact O-N 2.84Å; L510-F513 PolarHBondContact O-N 3Å; F513-F515 VanDerWaalsContact C-N 3.27Å; F513-F515 PolarHBondContact O-N 2.93Å; F513-S516 WeakPolarHBondContact O-CB 3.28Å; F513-S516 PolarHBondContact O-N 3.4Å; F513-S516 VanDerWaalsContact O-N 3.12Å; F513-S516 PolarHBondContact O-OG 3.35Å; F513-L517 HydrophobicContact CD1-CD1 4.17Å; F513-L517 HydrophobicContact CE1-CD1 3.51Å; F513-L517 HydrophobicContact CE1-CG 4.36Å; F513-L517 HydrophobicContact CE2-CD1 4.38Å; F513-L517 HydrophobicContact CZ-CD1 3.64Å; F513-L517 HydrophobicContact CZ-CG 4.27Å; F513-L517 PolarHBondContact O-N 3.1Å; F513-L517 VanDerWaalsContact O-N 3.11Å; F513-M547 HydrophobicContact CE2-CE 3.62Å; F513-M547 HydrophobicContact CZ-CE 3.69Å
514	F	90	Very high	89.4	Confident	120 Å²	120	53 Å²	53	53%	0.526	29%	0.291	S	S	.	.	H	α-helix	trans	-61.7	-37.8	178.2	-76	-54.8	0	0	0	112.3	L510 S516 L517 S518	L510-F514 HydrophobicContact CD1-CD2 3.94Å; L510-F514 HydrophobicContact CD1-CE2 3.35Å; L510-F514 HydrophobicContact CD1-CZ 3.91Å; L510-F514 HydrophobicContact CD2-CE2 3.98Å; L510-F514 HydrophobicContact CG-CD2 3.79Å; L510-F514 HydrophobicContact CG-CE2 3.45Å; L510-F514 VanDerWaalsContact CG-CE2 3.45Å; L510-F514 HydrophobicContact CG-CZ 4.45Å; L510-F514 WeakPolarHBondContact O-CD2 3.25Å; L510-F514 PolarHBondContact O-N 3.27Å; F514-S516 VanDerWaalsContact C-N 3.35Å; F514-L517 PolarHBondContact O-N 2.88Å; F514-S518 PolarHBondContact O-N 3.4Å
515	F	86	Confident	88.9	Confident	45 Å²	45	50.4 Å²	50.4	20%	0.197	28%	0.276	C	S	.	.	H	α-helix	trans	-63.7	-41.6	175.8	-176.5	-102.8	0	0	0	111.6	P281 M285 A511 T512 F513 L517 S518 K519	P281-F515 HydrophobicContact CB-CD1 3.94Å; P281-F515 HydrophobicContact CB-CD2 4.21Å; P281-F515 HydrophobicContact CB-CE1 3.4Å; P281-F515 HydrophobicContact CB-CE2 3.65Å; P281-F515 HydrophobicContact CB-CG 4.36Å; P281-F515 HydrophobicContact CB-CZ 3.23Å; P281-F515 HydrophobicContact CG-CD2 4.46Å; P281-F515 HydrophobicContact CG-CE1 4.03Å; P281-F515 HydrophobicContact CG-CE2 3.54Å; P281-F515 HydrophobicContact CG-CZ 3.31Å; P281-F515 WeakPolarHBondContact O-CE1 3.49Å; M285-F515 HydrophobicContact CE-CD1 3.88Å; M285-F515 HydrophobicContact CE-CE1 3.62Å; M285-F515 HydrophobicContact CG-CD1 3.5Å; M285-F515 HydrophobicContact CG-CE1 3.94Å; M285-F515 HydrophobicContact SD-CD1 3.31Å; M285-F515 WeakPolarHBondContact SD-CD1 3.3Å; M285-F515 HydrophobicContact SD-CE1 3.73Å; M285-F515 HydrophobicContact SD-CG 4.36Å; A511-F515 VanDerWaalsContact O-CB 3.32Å; A511-F515 WeakPolarHBondContact O-CB 3.31Å; A511-F515 PolarHBondContact O-N 3.05Å; T512-F515 PolarHBondContact O-N 3.45Å; F513-F515 VanDerWaalsContact C-N 3.27Å; F513-F515 PolarHBondContact O-N 2.93Å; F515-L517 VanDerWaalsContact C-N 3.31Å; F515-L517 PolarHBondContact O-N 3.46Å; F515-S518 PolarHBondContact O-N 3.09Å; F515-S518 VanDerWaalsContact O-N 3.09Å; F515-S518 PolarHBondContact O-OG 3.35Å; F515-K519 HydrophobicContact CD2-CG 4.35Å; F515-K519 HydrophobicContact CE1-CB 4.28Å; F515-K519 HydrophobicContact CE1-CG 4.2Å; F515-K519 HydrophobicContact CE2-CB 4.44Å; F515-K519 HydrophobicContact CE2-CG 3.56Å; F515-K519 HydrophobicContact CZ-CB 4Å; F515-K519 HydrophobicContact CZ-CG 3.44Å; F515-K519 VanDerWaalsContact CZ-CG 3.44Å; F515-K519 PolarHBondContact O-N 3.46Å
516	S	84.1	Confident	88	Confident	9 Å²	9	54.3 Å²	54.3	6%	0.063	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-36.9	176.3	81.8	0	0	0	0	113.6	M285 I459 T512 F513 F514 Y520	M285-S516 WeakPolarHBondContact SD-CA 3.46Å; M285-S516 WeakPolarHBondContact SD-CB 3.39Å; M285-S516 PolarHBondContact SD-N 3.49Å; M285-S516 VanDerWaalsContact SD-N 3.4Å; I459-S516 WeakPolarHBondContact CG1-OG 3.33Å; T512-S516 WeakPolarHBondContact O-CB 3.48Å; T512-S516 PolarHBondContact O-N 2.89Å; F513-S516 WeakPolarHBondContact O-CB 3.28Å; F513-S516 PolarHBondContact O-N 3.4Å; F513-S516 VanDerWaalsContact O-N 3.12Å; F513-S516 PolarHBondContact O-OG 3.35Å; F514-S516 VanDerWaalsContact C-N 3.35Å; S516-Y520 WeakPolarHBondContact O-CA 3.16Å; S516-Y520 PolarHBondContact O-N 2.96Å; S516-Y520 VanDerWaalsContact O-N 3.11Å
517	L	85.9	Confident	87	Confident	73 Å²	73	60.5 Å²	60.5	38%	0.382	33%	0.329	S	S	.	.	H	α-helix	trans	-68.4	-39.2	174.4	-64.6	-179.5	0	0	0	111.3	F513 F514 F515 W540	F513-L517 HydrophobicContact CD1-CD1 4.17Å; F513-L517 HydrophobicContact CE1-CD1 3.51Å; F513-L517 HydrophobicContact CE1-CG 4.36Å; F513-L517 HydrophobicContact CE2-CD1 4.38Å; F513-L517 HydrophobicContact CZ-CD1 3.64Å; F513-L517 HydrophobicContact CZ-CG 4.27Å; F513-L517 PolarHBondContact O-N 3.1Å; F513-L517 VanDerWaalsContact O-N 3.11Å; F514-L517 PolarHBondContact O-N 2.88Å; F515-L517 VanDerWaalsContact C-N 3.31Å; F515-L517 PolarHBondContact O-N 3.46Å; L517-W540 HydrophobicContact CD2-CH2 3.99Å; L517-W540 HydrophobicContact CD2-CZ3 4.47Å
518	S	86.6	Confident	86.5	Confident	81 Å²	81	64.6 Å²	64.6	57%	0.566	35%	0.346	S	S	*	.	H	α-helix	trans	-71.9	-31.5	-178.4	76.3	0	0	0	0	113.9	F514 F515	F514-S518 PolarHBondContact O-N 3.4Å; F515-S518 PolarHBondContact O-N 3.09Å; F515-S518 VanDerWaalsContact O-N 3.09Å; F515-S518 PolarHBondContact O-OG 3.35Å
519	K	83.8	Confident	86.2	Confident	128 Å²	128	64.2 Å²	64.2	56%	0.557	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	31.2	-178.6	-67.7	-60.1	-170.5	178.4	0	112.3	F515 T521	F515-K519 HydrophobicContact CD2-CG 4.35Å; F515-K519 HydrophobicContact CE1-CB 4.28Å; F515-K519 HydrophobicContact CE1-CG 4.2Å; F515-K519 HydrophobicContact CE2-CB 4.44Å; F515-K519 HydrophobicContact CE2-CG 3.56Å; F515-K519 HydrophobicContact CZ-CB 4Å; F515-K519 HydrophobicContact CZ-CG 3.44Å; F515-K519 VanDerWaalsContact CZ-CG 3.44Å; F515-K519 PolarHBondContact O-N 3.46Å; K519-T521 PolarHBondContact O-N 3.41Å
520	Y	83.7	Confident	86.2	Confident	69 Å²	69	68.2 Å²	68.2	27%	0.271	37%	0.366	S	S	.	.			trans	-55	124.5	177.9	168.5	-104	0	0	0	111.3	Y454 S516 P522 W540	Y454-Y520 HydrophobicContact CE1-CE2 4.02Å; Y454-Y520 PolarHBondContact OH-OH 2.7Å; S516-Y520 WeakPolarHBondContact O-CA 3.16Å; S516-Y520 PolarHBondContact O-N 2.96Å; S516-Y520 VanDerWaalsContact O-N 3.11Å; Y520-P522 HydrophobicContact CE1-CB 4.45Å; Y520-P522 HydrophobicContact CE1-CG 4.03Å; Y520-W540 AromaticContact CD2-CZ2 3.73Å; Y520-W540 HydrophobicContact CD2-CZ2 3.73Å; Y520-W540 AromaticContact CE2-CZ2 3.7Å; Y520-W540 HydrophobicContact CE2-CZ2 3.7Å; Y520-W540 AromaticContact CE2-NE1 4Å; Y520-W540 HydrophobicContact CG-CZ2 4.18Å; Y520-W540 AromaticContact CZ-NE1 3.63Å; Y520-W540 PolarHBondContact OH-NE1 3.4Å
521	T	81.4	Confident	86.3	Confident	74 Å²	74	64.9 Å²	64.9	45%	0.454	35%	0.348	S	S	.	.			trans	-107.1	122.4	174	53.2	0	0	0	0	109.3	Y453 K519	Y453-T521 PolarHBondContact OH-O 2.92Å; K519-T521 PolarHBondContact O-N 3.41Å
522	P	85.7	Confident	86.5	Confident	65 Å²	65	63.2 Å²	63.2	42%	0.422	33%	0.332	S	S	.	.			trans	-60.6	139.2	176.9	-22.6	32.3	0	0	0	112.1	Y520 Y536	Y520-P522 HydrophobicContact CE1-CB 4.45Å; Y520-P522 HydrophobicContact CE1-CG 4.03Å; P522-Y536 HydrophobicContact CB-CE1 3.84Å; P522-Y536 HydrophobicContact CB-CE2 4.44Å
523	L	88	Confident	86.7	Confident	15 Å²	15	67.7 Å²	67.7	8%	0.079	36%	0.362	C	S	.	.			trans	-57.5	138.7	172.4	176	67.4	0	0	0	110.9	Q449 L450 Y453 Y454 Y531 Y536	Q449-L523 HydrophobicContact CB-CD2 4.27Å; L450-L523 HydrophobicContact CD2-CD2 3.98Å; Y453-L523 HydrophobicContact CD1-CB 4.02Å; Y453-L523 HydrophobicContact CD1-CD1 4.47Å; Y453-L523 HydrophobicContact CD2-CD1 3.68Å; Y453-L523 HydrophobicContact CE1-CB 4.22Å; Y453-L523 HydrophobicContact CE2-CD1 4.28Å; Y453-L523 HydrophobicContact CG-CB 4.19Å; Y453-L523 HydrophobicContact CG-CD1 3.79Å; Y453-L523 HydrophobicContact CG-CD2 4.33Å; Y453-L523 HydrophobicContact CG-CG 4.31Å; Y454-L523 HydrophobicContact CE2-CB 4.06Å; Y454-L523 HydrophobicContact CE2-CD2 4.2Å; L523-Y531 HydrophobicContact CD2-CD2 4.21Å; L523-Y531 HydrophobicContact CD2-CE1 4.5Å; L523-Y531 HydrophobicContact CD2-CE2 3.61Å; L523-Y531 HydrophobicContact CG-CD2 4.15Å; L523-Y531 HydrophobicContact CG-CE2 3.71Å; L523-Y536 HydrophobicContact CB-CE1 4.37Å; L523-Y536 WeakPolarHBondContact O-CE1 3.42Å; L523-Y536 PolarHBondContact O-OH 3.23Å
524	K	88	Confident	87	Confident	107 Å²	107	72.3 Å²	72.3	47%	0.465	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	147.4	172.4	-63.9	-176.9	-179.7	-176.9	0	109.7	Y529	K524-Y529 WeakPolarHBondContact CA-O 3.47Å
525	Y	85.4	Confident	87.2	Confident	14 Å²	14	66.6 Å²	66.6	6%	0.055	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.1	172.6	178.9	-110.8	0	0	0	110.7	I199 M445 Y446 Q449 N527 V528 Y529	I199-Y525 HydrophobicContact CD1-CD1 4.37Å; I199-Y525 HydrophobicContact CD1-CE1 3.49Å; I199-Y525 VanDerWaalsContact CD1-CE1 3.49Å; M445-Y525 HydrophobicContact CE-CE2 3.93Å; M445-Y525 HydrophobicContact CG-CE2 3.94Å; Y446-Y525 HydrophobicContact CD1-CD1 4.46Å; Y446-Y525 HydrophobicContact CD1-CG 4.4Å; Y446-Y525 AromaticContact CE1-CD1 3.68Å; Y446-Y525 HydrophobicContact CE1-CD1 3.68Å; Y446-Y525 HydrophobicContact CE1-CE1 4.4Å; Y446-Y525 HydrophobicContact CE1-CG 4.03Å; Q449-Y525 VanDerWaalsContact CD-CD2 3.4Å; Q449-Y525 VanDerWaalsContact NE2-CD2 3.26Å; Y525-N527 PolarHBondContact O-N 3.21Å; Y525-V528 PolarHBondContact O-N 3.42Å; Y525-V528 VanDerWaalsContact O-N 3.11Å; Y525-Y529 PolarHBondContact N-O 2.85Å; Y525-Y529 PolarHBondContact O-N 3.36Å
526	N	77.5	Confident	87.6	Confident	82 Å²	82	66.3 Å²	66.3	44%	0.439	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	27.7	-175.2	-83	-0.6	0	0	0	114.7	E193 V528	E193-N526 PolarHBondContact OE1-ND2 3.41Å; N526-V528 WeakPolarHBondContact O-CG2 3.24Å; N526-V528 PolarHBondContact O-N 2.98Å
527	N	75.9	Confident	88.1	Confident	146 Å²	146	69.6 Å²	69.6	78%	0.781	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	-2	-172.7	-62.7	-47.9	0	0	0	116.4	Y525	Y525-N527 PolarHBondContact O-N 3.21Å
528	V	83.4	Confident	88.5	Confident	128 Å²	128	69.6 Å²	69.6	78%	0.776	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-47.7	-177.5	177.3	0	0	0	0	111	Y525 N526	Y525-V528 PolarHBondContact O-N 3.42Å; Y525-V528 VanDerWaalsContact O-N 3.11Å; N526-V528 WeakPolarHBondContact O-CG2 3.24Å; N526-V528 PolarHBondContact O-N 2.98Å
529	Y	89	Confident	88.8	Confident	31 Å²	31	65.7 Å²	65.7	12%	0.122	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	129	-176.2	174.4	-91.5	0	0	0	111.3	G202 I203 Y446 K524 Y525 Y531	G202-Y529 VanDerWaalsContact CA-CE2 3.45Å; I203-Y529 VanDerWaalsContact CG2-OH 3.29Å; I203-Y529 WeakPolarHBondContact CG2-OH 3.34Å; I203-Y529 PolarHBondContact N-OH 3.24Å; Y446-Y529 AromaticContact CD1-CD1 3.79Å; Y446-Y529 HydrophobicContact CD1-CD1 3.79Å; Y446-Y529 AromaticContact CD1-CE1 3.64Å; Y446-Y529 HydrophobicContact CD1-CE1 3.64Å; Y446-Y529 HydrophobicContact CD1-CG 4.48Å; Y446-Y529 AromaticContact CE1-CD1 3.54Å; Y446-Y529 HydrophobicContact CE1-CD1 3.54Å; Y446-Y529 HydrophobicContact CE1-CD2 4.21Å; Y446-Y529 AromaticContact CE1-CE1 3.74Å; Y446-Y529 HydrophobicContact CE1-CE1 3.74Å; Y446-Y529 HydrophobicContact CE1-CE2 4.39Å; Y446-Y529 AromaticContact CE1-CG 3.79Å; Y446-Y529 HydrophobicContact CE1-CG 3.79Å; Y446-Y529 HydrophobicContact CG-CE1 4.43Å; K524-Y529 WeakPolarHBondContact CA-O 3.47Å; Y525-Y529 PolarHBondContact N-O 2.85Å; Y525-Y529 PolarHBondContact O-N 3.36Å; Y529-Y531 HydrophobicContact CD1-CD2 4.13Å; Y529-Y531 HydrophobicContact CD1-CE2 4.09Å; Y529-Y531 HydrophobicContact CE1-CD1 4.1Å; Y529-Y531 AromaticContact CE1-CD2 3.87Å; Y529-Y531 HydrophobicContact CE1-CD2 3.87Å; Y529-Y531 HydrophobicContact CE1-CE1 4.24Å; Y529-Y531 AromaticContact CE1-CE2 3.99Å; Y529-Y531 HydrophobicContact CE1-CE2 3.99Å; Y529-Y531 AromaticContact CE1-CG 3.92Å; Y529-Y531 HydrophobicContact CE1-CG 3.92Å
530	V	93.6	Very high	89.3	Confident	83 Å²	83	62.9 Å²	62.9	50%	0.503	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	129.6	177.9	-178.6	0	0	0	0	108.4	Y536	V530-Y536 WeakPolarHBondContact CG1-OH 3.49Å
531	Y	94.5	Very high	89.9	Confident	4 Å²	4	66.2 Å²	66.2	2%	0.016	35%	0.349	C	S	.	.			trans	-69.3	145.7	-179.6	-76	-103.9	0	0	0	111.1	I203 Y446 Q449 L450 L523 Y529 Y536	I203-Y531 HydrophobicContact CD1-CD1 4.29Å; I203-Y531 HydrophobicContact CD1-CE1 4.08Å; I203-Y531 HydrophobicContact CG2-CD1 4.48Å; Y446-Y531 WeakPolarHBondContact CA-OH 3.34Å; Y446-Y531 WeakPolarHBondContact O-CE1 3.3Å; Y446-Y531 PolarHBondContact O-OH 3.05Å; Q449-Y531 WeakPolarHBondContact CB-OH 3.46Å; Q449-Y531 PolarHBondContact OE1-OH 3.45Å; L450-Y531 HydrophobicContact CD1-CD1 4.29Å; L450-Y531 HydrophobicContact CD1-CE1 4.03Å; L450-Y531 HydrophobicContact CD2-CD1 4.02Å; L450-Y531 HydrophobicContact CD2-CE1 3.92Å; L450-Y531 HydrophobicContact CG-CD1 4.2Å; L450-Y531 HydrophobicContact CG-CE1 3.69Å; L523-Y531 HydrophobicContact CD2-CD2 4.21Å; L523-Y531 HydrophobicContact CD2-CE1 4.5Å; L523-Y531 HydrophobicContact CD2-CE2 3.61Å; L523-Y531 HydrophobicContact CG-CD2 4.15Å; L523-Y531 HydrophobicContact CG-CE2 3.71Å; Y529-Y531 HydrophobicContact CD1-CD2 4.13Å; Y529-Y531 HydrophobicContact CD1-CE2 4.09Å; Y529-Y531 HydrophobicContact CE1-CD1 4.1Å; Y529-Y531 AromaticContact CE1-CD2 3.87Å; Y529-Y531 HydrophobicContact CE1-CD2 3.87Å; Y529-Y531 HydrophobicContact CE1-CE1 4.24Å; Y529-Y531 AromaticContact CE1-CE2 3.99Å; Y529-Y531 HydrophobicContact CE1-CE2 3.99Å; Y529-Y531 AromaticContact CE1-CG 3.92Å; Y529-Y531 HydrophobicContact CE1-CG 3.92Å; Y531-Y536 HydrophobicContact CG-CE1 4.41Å; Y531-Y536 PolarHBondContact N-OH 3.36Å; Y531-Y536 WeakPolarHBondContact O-CE2 3.4Å
532	P	94.9	Very high	90.5	Very high	24 Å²	24	63.1 Å²	63.1	16%	0.156	33%	0.33	C	S	.	.			trans	-65.8	156.3	172.2	29.4	-35.4	0	0	0	110.5	I203 W534 G535 Y536	I203-P532 HydrophobicContact CG2-CG 3.78Å; P532-W534 HydrophobicContact CB-CG 4.43Å; P532-W534 HydrophobicContact CG-CD2 4.06Å; P532-W534 VanDerWaalsContact CG-CE2 3.41Å; P532-W534 HydrophobicContact CG-CG 4.32Å; P532-W534 HydrophobicContact CG-CZ2 3.76Å; P532-W534 VanDerWaalsContact CG-NE1 3.3Å; P532-W534 PolarHBondContact O-N 3.43Å; P532-W534 VanDerWaalsContact O-N 3.12Å; P532-G535 WeakPolarHBondContact O-CA 3.33Å; P532-G535 PolarHBondContact O-N 3.1Å; P532-Y536 PolarHBondContact O-N 3.46Å
533	P	94.8	Very high	90.9	Very high	105 Å²	105	60.1 Å²	60.1	68%	0.682	31%	0.31	S	S	*	.	H	α-helix	trans	-52.9	-38.6	-177.7	-29.5	35.8	0	0	0	114.5	G535 Y536 S537	P533-G535 VanDerWaalsContact C-N 3.28Å; P533-G535 PolarHBondContact O-N 2.91Å; P533-Y536 PolarHBondContact O-N 3.31Å; P533-S537 PolarHBondContact O-N 2.63Å; P533-S537 PolarHBondContact O-OG 2.86Å
534	W	95.2	Very high	91.2	Very high	116 Å²	116	63.2 Å²	63.2	44%	0.439	33%	0.326	S	S	.	.	H	α-helix	trans	-65.9	-29.6	176.6	66.3	-102.2	0	0	0	112.9	I203 H204 P532 S537 I538	I203-W534 HydrophobicContact CB-CH2 4.36Å; I203-W534 HydrophobicContact CD1-CH2 4.11Å; I203-W534 HydrophobicContact CD1-CZ3 4.29Å; I203-W534 HydrophobicContact CG1-CH2 3.99Å; I203-W534 HydrophobicContact CG2-CH2 3.6Å; I203-W534 HydrophobicContact CG2-CZ2 3.64Å; H204-W534 HydrophobicContact CB-CZ2 4.49Å; P532-W534 HydrophobicContact CB-CG 4.43Å; P532-W534 HydrophobicContact CG-CD2 4.06Å; P532-W534 VanDerWaalsContact CG-CE2 3.41Å; P532-W534 HydrophobicContact CG-CG 4.32Å; P532-W534 HydrophobicContact CG-CZ2 3.76Å; P532-W534 VanDerWaalsContact CG-NE1 3.3Å; P532-W534 PolarHBondContact O-N 3.43Å; P532-W534 VanDerWaalsContact O-N 3.12Å; W534-S537 WeakPolarHBondContact O-CB 3.44Å; W534-S537 PolarHBondContact O-N 2.76Å; W534-I538 HydrophobicContact CE3-CD1 3.51Å; W534-I538 HydrophobicContact CE3-CG1 4.37Å; W534-I538 HydrophobicContact CZ3-CD1 3.51Å; W534-I538 WeakPolarHBondContact O-CG1 3.25Å; W534-I538 PolarHBondContact O-N 3.02Å
535	G	94.4	Very high	91.6	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.8	-40.7	174.9	0	0	0	0	0	111.4	P532 P533 S537 I538 G539	P532-G535 WeakPolarHBondContact O-CA 3.33Å; P532-G535 PolarHBondContact O-N 3.1Å; P533-G535 VanDerWaalsContact C-N 3.28Å; P533-G535 PolarHBondContact O-N 2.91Å; G535-S537 VanDerWaalsContact C-N 3.34Å; G535-I538 PolarHBondContact O-N 2.83Å; G535-G539 PolarHBondContact O-N 2.93Å
536	Y	93.6	Very high	92	Very high	39 Å²	39	58.8 Å²	58.8	15%	0.153	31%	0.311	C	S	.	.	H	α-helix	trans	-64.3	-38.5	170.8	-63.1	-51.4	0	0	0	112.2	P522 L523 V530 Y531 P532 P533 I538 G539 W540	P522-Y536 HydrophobicContact CB-CE1 3.84Å; P522-Y536 HydrophobicContact CB-CE2 4.44Å; L523-Y536 HydrophobicContact CB-CE1 4.37Å; L523-Y536 WeakPolarHBondContact O-CE1 3.42Å; L523-Y536 PolarHBondContact O-OH 3.23Å; V530-Y536 WeakPolarHBondContact CG1-OH 3.49Å; Y531-Y536 HydrophobicContact CG-CE1 4.41Å; Y531-Y536 PolarHBondContact N-OH 3.36Å; Y531-Y536 WeakPolarHBondContact O-CE2 3.4Å; P532-Y536 PolarHBondContact O-N 3.46Å; P533-Y536 PolarHBondContact O-N 3.31Å; Y536-I538 VanDerWaalsContact C-N 3.34Å; Y536-I538 PolarHBondContact O-N 3.24Å; Y536-G539 PolarHBondContact O-N 2.9Å; Y536-W540 PolarHBondContact O-N 3.33Å
537	S	94.8	Very high	92.8	Very high	78 Å²	78	55.7 Å²	55.7	55%	0.545	29%	0.294	S	S	.	.	H	α-helix	trans	-61.4	-40.6	174.3	-58.2	0	0	0	0	112.5	P533 W534 G535 W540 F541	P533-S537 PolarHBondContact O-N 2.63Å; P533-S537 PolarHBondContact O-OG 2.86Å; W534-S537 WeakPolarHBondContact O-CB 3.44Å; W534-S537 PolarHBondContact O-N 2.76Å; G535-S537 VanDerWaalsContact C-N 3.34Å; S537-W540 PolarHBondContact O-N 3.35Å; S537-F541 WeakPolarHBondContact O-CB 3.19Å; S537-F541 PolarHBondContact O-N 2.97Å
538	I	94.8	Very high	93.8	Very high	72 Å²	72	52 Å²	52	37%	0.369	28%	0.277	S	S	.	.	H	α-helix	trans	-63.4	-45.2	173.4	-68.5	174.1	0	0	0	110.5	W534 G535 Y536 W540 F541 L542	W534-I538 HydrophobicContact CE3-CD1 3.51Å; W534-I538 HydrophobicContact CE3-CG1 4.37Å; W534-I538 HydrophobicContact CZ3-CD1 3.51Å; W534-I538 WeakPolarHBondContact O-CG1 3.25Å; W534-I538 PolarHBondContact O-N 3.02Å; G535-I538 PolarHBondContact O-N 2.83Å; Y536-I538 VanDerWaalsContact C-N 3.34Å; Y536-I538 PolarHBondContact O-N 3.24Å; I538-W540 PolarHBondContact O-N 2.88Å; I538-F541 WeakPolarHBondContact O-CB 3.36Å; I538-F541 PolarHBondContact O-N 3.33Å; I538-F541 VanDerWaalsContact O-N 3.16Å; I538-L542 HydrophobicContact CG2-CD1 4.24Å; I538-L542 HydrophobicContact CG2-CG 4.45Å; I538-L542 WeakPolarHBondContact O-CG 3.45Å; I538-L542 PolarHBondContact O-N 3.04Å
539	G	93.4	Very high	94.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-55	-51.5	175.6	0	0	0	0	0	112.2	Y454 G535 Y536 F541 L542 A543	Y454-G539 WeakPolarHBondContact CB-O 3.42Å; Y454-G539 VanDerWaalsContact CD2-CA 3.49Å; Y454-G539 VanDerWaalsContact CG-CA 3.45Å; G535-G539 PolarHBondContact O-N 2.93Å; Y536-G539 PolarHBondContact O-N 2.9Å; G539-F541 VanDerWaalsContact C-N 3.31Å; G539-F541 PolarHBondContact O-N 3.19Å; G539-L542 WeakPolarHBondContact O-CB 3.46Å; G539-L542 PolarHBondContact O-N 3.1Å; G539-L542 VanDerWaalsContact O-N 3.16Å; G539-A543 PolarHBondContact O-N 3.33Å
540	W	93.6	Very high	94.6	Very high	68 Å²	68	45.3 Å²	45.3	26%	0.258	24%	0.24	S	C	.	.	H	α-helix	trans	-64.7	-33.3	176.7	-82.1	107.2	0	0	0	113.5	L517 Y520 Y536 S537 I538 A543 L544	L517-W540 HydrophobicContact CD2-CH2 3.99Å; L517-W540 HydrophobicContact CD2-CZ3 4.47Å; Y520-W540 AromaticContact CD2-CZ2 3.73Å; Y520-W540 HydrophobicContact CD2-CZ2 3.73Å; Y520-W540 AromaticContact CE2-CZ2 3.7Å; Y520-W540 HydrophobicContact CE2-CZ2 3.7Å; Y520-W540 AromaticContact CE2-NE1 4Å; Y520-W540 HydrophobicContact CG-CZ2 4.18Å; Y520-W540 AromaticContact CZ-NE1 3.63Å; Y520-W540 PolarHBondContact OH-NE1 3.4Å; Y536-W540 PolarHBondContact O-N 3.33Å; S537-W540 PolarHBondContact O-N 3.35Å; I538-W540 PolarHBondContact O-N 2.88Å; W540-A543 HydrophobicContact CE3-CB 4.4Å; W540-A543 PolarHBondContact O-N 3Å; W540-L544 VanDerWaalsContact O-CB 3.27Å; W540-L544 WeakPolarHBondContact O-CB 3.44Å; W540-L544 WeakPolarHBondContact O-CG 3.37Å; W540-L544 PolarHBondContact O-N 3.34Å
541	F	95.4	Very high	94.7	Very high	139 Å²	139	44.4 Å²	44.4	61%	0.61	24%	0.236	S	C	*	.	H	α-helix	trans	-62.3	-43.5	172.1	175.8	-96.1	0	0	0	111.8	S537 I538 G539 A543 L544 S545	S537-F541 WeakPolarHBondContact O-CB 3.19Å; S537-F541 PolarHBondContact O-N 2.97Å; I538-F541 WeakPolarHBondContact O-CB 3.36Å; I538-F541 PolarHBondContact O-N 3.33Å; I538-F541 VanDerWaalsContact O-N 3.16Å; G539-F541 VanDerWaalsContact C-N 3.31Å; G539-F541 PolarHBondContact O-N 3.19Å; F541-A543 VanDerWaalsContact C-N 3.34Å; F541-A543 PolarHBondContact O-N 2.88Å; F541-L544 PolarHBondContact O-N 2.86Å; F541-S545 WeakPolarHBondContact O-CB 3.45Å; F541-S545 PolarHBondContact O-N 3.43Å
542	L	94.8	Very high	94.8	Very high	10 Å²	10	48.2 Å²	48.2	5%	0.052	26%	0.256	C	S	.	.	H	α-helix	trans	-62.2	-40.1	175.4	-67.4	170	0	0	0	112.1	Y128 F451 A455 I538 G539 S545	Y128-L542 HydrophobicContact CD1-CD2 4.38Å; Y128-L542 HydrophobicContact CE1-CD2 3.81Å; Y128-L542 HydrophobicContact CE2-CD2 4.27Å; F451-L542 HydrophobicContact CD2-CD1 3.96Å; F451-L542 HydrophobicContact CE1-CD2 4.44Å; F451-L542 HydrophobicContact CE2-CD1 4.01Å; F451-L542 HydrophobicContact CG-CD1 4.37Å; F451-L542 HydrophobicContact CZ-CD1 4.45Å; F451-L542 HydrophobicContact CZ-CD2 4.19Å; A455-L542 HydrophobicContact CB-CB 4.01Å; A455-L542 HydrophobicContact CB-CD1 4.35Å; I538-L542 HydrophobicContact CG2-CD1 4.24Å; I538-L542 HydrophobicContact CG2-CG 4.45Å; I538-L542 WeakPolarHBondContact O-CG 3.45Å; I538-L542 PolarHBondContact O-N 3.04Å; G539-L542 WeakPolarHBondContact O-CB 3.46Å; G539-L542 PolarHBondContact O-N 3.1Å; G539-L542 VanDerWaalsContact O-N 3.16Å; L542-S545 PolarHBondContact O-OG 2.98Å
543	A	93.4	Very high	94.7	Very high	2 Å²	2	50.1 Å²	50.1	2%	0.017	26%	0.262	C	S	.	.	H	α-helix	trans	-67.8	-48.9	176.5	0	0	0	0	0	111.6	G539 W540 F541 S545 S546 M547	G539-A543 PolarHBondContact O-N 3.33Å; W540-A543 HydrophobicContact CE3-CB 4.4Å; W540-A543 PolarHBondContact O-N 3Å; F541-A543 VanDerWaalsContact C-N 3.34Å; F541-A543 PolarHBondContact O-N 2.88Å; A543-S545 VanDerWaalsContact C-N 3.33Å; A543-S545 PolarHBondContact O-N 3.18Å; A543-S546 PolarHBondContact O-OG 2.84Å; A543-S546 VanDerWaalsContact O-OG 3.06Å; A543-M547 WeakPolarHBondContact O-CG 3.47Å; A543-M547 PolarHBondContact O-N 3.49Å
544	L	94.6	Very high	94.7	Very high	79 Å²	79	46.3 Å²	46.3	41%	0.414	24%	0.237	S	C	.	.	H	α-helix	trans	-70.1	-27.1	-176.3	-70	171.7	0	0	0	113.1	W540 F541 S546 M547 V548	W540-L544 VanDerWaalsContact O-CB 3.27Å; W540-L544 WeakPolarHBondContact O-CB 3.44Å; W540-L544 WeakPolarHBondContact O-CG 3.37Å; W540-L544 PolarHBondContact O-N 3.34Å; F541-L544 PolarHBondContact O-N 2.86Å; L544-S546 VanDerWaalsContact C-N 3.26Å; L544-S546 PolarHBondContact O-N 2.89Å; L544-M547 HydrophobicContact CD2-SD 4.46Å; L544-M547 PolarHBondContact O-N 3.39Å; L544-V548 HydrophobicContact CB-CG2 4.45Å; L544-V548 VanDerWaalsContact O-CB 3.26Å; L544-V548 WeakPolarHBondContact O-CB 3.5Å; L544-V548 VanDerWaalsContact O-CG2 3.23Å; L544-V548 WeakPolarHBondContact O-CG2 3.45Å; L544-V548 PolarHBondContact O-N 3.49Å
545	S	95.7	Very high	94.6	Very high	29 Å²	29	44.6 Å²	44.6	20%	0.203	24%	0.239	C	C	.	.	H	α-helix	trans	-58.5	-38.5	-179.2	67	0	0	0	0	112.2	Y128 F541 L542 A543 C549	Y128-S545 WeakPolarHBondContact CE2-OG 3.45Å; Y128-S545 PolarHBondContact OH-OG 3.06Å; F541-S545 WeakPolarHBondContact O-CB 3.45Å; F541-S545 PolarHBondContact O-N 3.43Å; L542-S545 PolarHBondContact O-OG 2.98Å; A543-S545 VanDerWaalsContact C-N 3.33Å; A543-S545 PolarHBondContact O-N 3.18Å; S545-C549 PolarHBondContact O-SG 3.27Å
546	S	94.9	Very high	94.6	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-78.9	-46	174.4	62.9	0	0	0	0	112.2	A121 A543 L544 V548 C549	A121-S546 VanDerWaalsContact CB-O 3.24Å; A121-S546 WeakPolarHBondContact CB-O 3.23Å; A543-S546 PolarHBondContact O-OG 2.84Å; A543-S546 VanDerWaalsContact O-OG 3.06Å; L544-S546 VanDerWaalsContact C-N 3.26Å; L544-S546 PolarHBondContact O-N 2.89Å; S546-V548 VanDerWaalsContact C-N 3.32Å; S546-V548 PolarHBondContact O-N 3.02Å; S546-C549 VanDerWaalsContact O-CB 3.29Å; S546-C549 WeakPolarHBondContact O-CB 3.46Å; S546-C549 PolarHBondContact O-N 3.31Å; S546-C549 VanDerWaalsContact O-N 3.14Å
547	M	94.5	Very high	94.5	Very high	16 Å²	16	46 Å²	46	8%	0.079	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-38.1	-177.4	-66	172.7	65.8	0	0	112.8	F463 F513 A543 L544 C549 P551	F463-M547 HydrophobicContact CB-CE 3.98Å; F463-M547 HydrophobicContact CB-CG 4.48Å; F463-M547 HydrophobicContact CD1-CB 3.92Å; F463-M547 HydrophobicContact CD1-CE 4.07Å; F463-M547 HydrophobicContact CD1-CG 3.81Å; F463-M547 HydrophobicContact CD2-CE 3.6Å; F463-M547 HydrophobicContact CE1-CB 3.81Å; F463-M547 HydrophobicContact CE1-CE 4.44Å; F463-M547 HydrophobicContact CE1-CG 4.23Å; F463-M547 WeakPolarHBondContact CE1-O 3.43Å; F463-M547 HydrophobicContact CE2-CE 3.98Å; F463-M547 HydrophobicContact CG-CE 3.62Å; F463-M547 HydrophobicContact CG-CG 4.21Å; F463-M547 HydrophobicContact CZ-CB 4.38Å; F463-M547 HydrophobicContact CZ-CE 4.38Å; F513-M547 HydrophobicContact CE2-CE 3.62Å; F513-M547 HydrophobicContact CZ-CE 3.69Å; A543-M547 WeakPolarHBondContact O-CG 3.47Å; A543-M547 PolarHBondContact O-N 3.49Å; L544-M547 HydrophobicContact CD2-SD 4.46Å; L544-M547 PolarHBondContact O-N 3.39Å; M547-C549 VanDerWaalsContact C-N 3.27Å; M547-C549 PolarHBondContact O-N 2.98Å; M547-P551 VanDerWaalsContact O-CD 3.25Å; M547-P551 WeakPolarHBondContact O-CD 3.47Å
548	V	95.6	Very high	94.4	Very high	70 Å²	70	43.9 Å²	43.9	42%	0.424	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-22.8	-179.7	169.9	0	0	0	0	112.1	L544 S546 V550 P551 L552	L544-V548 HydrophobicContact CB-CG2 4.45Å; L544-V548 VanDerWaalsContact O-CB 3.26Å; L544-V548 WeakPolarHBondContact O-CB 3.5Å; L544-V548 VanDerWaalsContact O-CG2 3.23Å; L544-V548 WeakPolarHBondContact O-CG2 3.45Å; L544-V548 PolarHBondContact O-N 3.49Å; S546-V548 VanDerWaalsContact C-N 3.32Å; S546-V548 PolarHBondContact O-N 3.02Å; V548-V550 PolarHBondContact O-N 3Å; V548-P551 VanDerWaalsContact O-CD 3.24Å; V548-P551 WeakPolarHBondContact O-CD 3.25Å; V548-P551 WeakPolarHBondContact O-CG 3.46Å; V548-L552 HydrophobicContact CG1-CB 4.03Å; V548-L552 HydrophobicContact CG1-CD2 4.4Å; V548-L552 WeakPolarHBondContact O-CB 3.27Å; V548-L552 PolarHBondContact O-N 2.92Å
549	C	95.7	Very high	94.2	Very high	16 Å²	16	46.4 Å²	46.4	11%	0.108	25%	0.245	C	C	.	.	H	α-helix	trans	-54.8	-39.8	178.5	-68.6	0	0	0	0	112.3	A121 S545 S546 M547 F553	A121-C549 HydrophobicContact CB-CB 3.92Å; S545-C549 PolarHBondContact O-SG 3.27Å; S546-C549 VanDerWaalsContact O-CB 3.29Å; S546-C549 WeakPolarHBondContact O-CB 3.46Å; S546-C549 PolarHBondContact O-N 3.31Å; S546-C549 VanDerWaalsContact O-N 3.14Å; M547-C549 VanDerWaalsContact C-N 3.27Å; M547-C549 PolarHBondContact O-N 2.98Å; C549-F553 WeakPolarHBondContact O-CB 3.32Å; C549-F553 WeakPolarHBondContact O-CD2 3.44Å; C549-F553 PolarHBondContact O-N 3.05Å
550	V	95.3	Very high	94.2	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.006	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-64.2	-179.2	-176.2	0	0	0	0	111.8	F115 I118 A121 L464 F467 V548 L552 F553 T554	F115-V550 HydrophobicContact CD1-CG1 4.35Å; I118-V550 HydrophobicContact CG1-CG1 4.27Å; I118-V550 HydrophobicContact CG1-CG2 4.11Å; A121-V550 HydrophobicContact CB-CG2 4.3Å; L464-V550 HydrophobicContact CD2-CG2 3.55Å; F467-V550 HydrophobicContact CB-CG1 4.23Å; F467-V550 HydrophobicContact CD1-CG1 3.72Å; F467-V550 HydrophobicContact CD2-CG1 4.31Å; F467-V550 HydrophobicContact CE1-CG1 4.14Å; F467-V550 HydrophobicContact CG-CG1 3.81Å; V548-V550 PolarHBondContact O-N 3Å; V550-L552 VanDerWaalsContact C-N 3.34Å; V550-L552 PolarHBondContact O-N 2.8Å; V550-F553 PolarHBondContact O-N 3.02Å; V550-T554 PolarHBondContact O-N 3.44Å; V550-T554 PolarHBondContact O-OG1 3.01Å; V550-T554 VanDerWaalsContact O-OG1 3.05Å
551	P	95.8	Very high	94.1	Very high	64 Å²	64	52.2 Å²	52.2	42%	0.416	27%	0.274	S	S	.	.	H	α-helix	trans	-63.7	-37.4	-179.6	25.7	-35	0	0	0	112.7	M547 V548 T554 V555	M547-P551 VanDerWaalsContact O-CD 3.25Å; M547-P551 WeakPolarHBondContact O-CD 3.47Å; V548-P551 VanDerWaalsContact O-CD 3.24Å; V548-P551 WeakPolarHBondContact O-CD 3.25Å; V548-P551 WeakPolarHBondContact O-CG 3.46Å; P551-T554 PolarHBondContact O-N 2.9Å; P551-V555 WeakPolarHBondContact O-CG2 3.37Å; P551-V555 PolarHBondContact O-N 3.29Å
552	L	94.9	Very high	93.7	Very high	85 Å²	85	53 Å²	53	45%	0.445	28%	0.28	S	S	.	.	H	α-helix	trans	-61.5	-49.4	-179.6	179.5	63	0	0	0	111.3	V548 V550 V555 I556	V548-L552 HydrophobicContact CG1-CB 4.03Å; V548-L552 HydrophobicContact CG1-CD2 4.4Å; V548-L552 WeakPolarHBondContact O-CB 3.27Å; V548-L552 PolarHBondContact O-N 2.92Å; V550-L552 VanDerWaalsContact C-N 3.34Å; V550-L552 PolarHBondContact O-N 2.8Å; L552-V555 PolarHBondContact O-N 2.72Å; L552-I556 HydrophobicContact CD1-CD1 3.92Å; L552-I556 HydrophobicContact CD1-CG1 4.3Å; L552-I556 HydrophobicContact CD2-CD1 4.43Å; L552-I556 HydrophobicContact CG-CD1 3.76Å; L552-I556 HydrophobicContact CG-CG1 4.48Å; L552-I556 VanDerWaalsContact O-CG1 3.29Å; L552-I556 WeakPolarHBondContact O-CG1 3.33Å; L552-I556 PolarHBondContact O-N 2.95Å
553	F	93.9	Very high	93.5	Very high	63 Å²	63	54.3 Å²	54.3	28%	0.276	30%	0.296	S	S	.	.	H	α-helix	trans	-72.3	-29.3	179.7	-84.6	-94.7	0	0	0	112.8	L120 C549 V550 V555 T557	L120-F553 HydrophobicContact CD1-CD1 3.48Å; L120-F553 VanDerWaalsContact CD1-CD1 3.48Å; L120-F553 HydrophobicContact CD1-CD2 3.7Å; L120-F553 HydrophobicContact CD1-CE1 3.3Å; L120-F553 HydrophobicContact CD1-CE2 3.53Å; L120-F553 HydrophobicContact CD1-CG 3.68Å; L120-F553 HydrophobicContact CD1-CZ 3.33Å; C549-F553 WeakPolarHBondContact O-CB 3.32Å; C549-F553 WeakPolarHBondContact O-CD2 3.44Å; C549-F553 PolarHBondContact O-N 3.05Å; V550-F553 PolarHBondContact O-N 3.02Å; F553-V555 VanDerWaalsContact C-N 3.35Å; F553-T557 WeakPolarHBondContact O-CB 3.37Å; F553-T557 PolarHBondContact O-N 3.24Å; F553-T557 PolarHBondContact O-OG1 3.45Å
554	T	93.8	Very high	93.4	Very high	26 Å²	26	57.9 Å²	57.9	16%	0.16	32%	0.32	C	S	.	.	H	α-helix	trans	-58.4	-48.1	168.4	-65.1	0	0	0	0	110.9	L114 V550 P551 L558	L114-T554 HydrophobicContact CD1-CG2 3.79Å; L114-T554 HydrophobicContact CG-CG2 4.04Å; L114-T554 WeakPolarHBondContact O-CA 3.15Å; L114-T554 PolarHBondContact O-OG1 2.94Å; V550-T554 PolarHBondContact O-N 3.44Å; V550-T554 PolarHBondContact O-OG1 3.01Å; V550-T554 VanDerWaalsContact O-OG1 3.05Å; P551-T554 PolarHBondContact O-N 2.9Å; T554-L558 HydrophobicContact CG2-CD1 4.06Å; T554-L558 WeakPolarHBondContact O-CB 3.38Å; T554-L558 WeakPolarHBondContact O-CD1 3.4Å; T554-L558 VanDerWaalsContact O-CG 3.3Å; T554-L558 WeakPolarHBondContact O-CG 3.45Å; T554-L558 PolarHBondContact O-N 2.74Å
555	V	94.1	Very high	93.2	Very high	80 Å²	80	60.9 Å²	60.9	49%	0.485	33%	0.33	S	S	.	.	H	α-helix	trans	-65.2	-49.2	177.6	173.8	0	0	0	0	111.5	P551 L552 F553 T557 L558 L559	P551-V555 WeakPolarHBondContact O-CG2 3.37Å; P551-V555 PolarHBondContact O-N 3.29Å; L552-V555 PolarHBondContact O-N 2.72Å; F553-V555 VanDerWaalsContact C-N 3.35Å; V555-T557 VanDerWaalsContact C-N 3.29Å; V555-T557 PolarHBondContact O-N 2.82Å; V555-L558 PolarHBondContact O-N 3.21Å; V555-L559 HydrophobicContact CG1-CD1 3.83Å; V555-L559 HydrophobicContact CG1-CG 4.29Å; V555-L559 VanDerWaalsContact O-CG 3.31Å; V555-L559 WeakPolarHBondContact O-CG 3.49Å; V555-L559 PolarHBondContact O-N 2.99Å
556	I	93.3	Very high	93	Very high	55 Å²	55	67.1 Å²	67.1	28%	0.282	35%	0.354	S	S	.	.	H	α-helix	trans	-57.8	-44.5	-180	-70.3	169.5	0	0	0	110.8	L552 L559 K560	L552-I556 HydrophobicContact CD1-CD1 3.92Å; L552-I556 HydrophobicContact CD1-CG1 4.3Å; L552-I556 HydrophobicContact CD2-CD1 4.43Å; L552-I556 HydrophobicContact CG-CD1 3.76Å; L552-I556 HydrophobicContact CG-CG1 4.48Å; L552-I556 VanDerWaalsContact O-CG1 3.29Å; L552-I556 WeakPolarHBondContact O-CG1 3.33Å; L552-I556 PolarHBondContact O-N 2.95Å; I556-L559 PolarHBondContact O-N 3.35Å; I556-K560 HydrophobicContact CG2-CD 4.05Å; I556-K560 HydrophobicContact CG2-CG 4.46Å; I556-K560 WeakPolarHBondContact O-CB 3.44Å; I556-K560 WeakPolarHBondContact O-CG 3.42Å; I556-K560 PolarHBondContact O-N 3.27Å
557	T	91.8	Very high	92.8	Very high	14 Å²	14	72.8 Å²	72.8	9%	0.086	38%	0.379	C	S	.	.	H	α-helix	trans	-67.6	-42.5	-177.8	-50.3	0	0	0	0	110.6	Q116 F553 V555 L559 K560 T561 L572	Q116-T557 PolarHBondContact NE2-OG1 2.92Å; F553-T557 WeakPolarHBondContact O-CB 3.37Å; F553-T557 PolarHBondContact O-N 3.24Å; F553-T557 PolarHBondContact O-OG1 3.45Å; V555-T557 VanDerWaalsContact C-N 3.29Å; V555-T557 PolarHBondContact O-N 2.82Å; T557-L559 VanDerWaalsContact C-N 3.3Å; T557-L559 PolarHBondContact O-N 2.9Å; T557-K560 PolarHBondContact O-N 3.47Å; T557-T561 PolarHBondContact O-N 2.97Å; T557-T561 PolarHBondContact O-OG1 3.44Å; T557-L572 HydrophobicContact CG2-CD1 3.89Å; T557-L572 HydrophobicContact CG2-CD2 3.44Å; T557-L572 VanDerWaalsContact CG2-CD2 3.44Å; T557-L572 HydrophobicContact CG2-CG 4.3Å
558	L	92.2	Very high	92.7	Very high	33 Å²	33	74.8 Å²	74.8	17%	0.173	39%	0.385	C	S	.	.	H	α-helix	trans	-60.7	-36.4	174	-77.9	166.8	0	0	0	113.3	L114 T554 V555 R568 L572	L114-L558 HydrophobicContact CD1-CD1 4.01Å; L114-L558 HydrophobicContact CD1-CD2 3.93Å; L114-L558 HydrophobicContact CD1-CG 3.69Å; T554-L558 HydrophobicContact CG2-CD1 4.06Å; T554-L558 WeakPolarHBondContact O-CB 3.38Å; T554-L558 WeakPolarHBondContact O-CD1 3.4Å; T554-L558 VanDerWaalsContact O-CG 3.3Å; T554-L558 WeakPolarHBondContact O-CG 3.45Å; T554-L558 PolarHBondContact O-N 2.74Å; V555-L558 PolarHBondContact O-N 3.21Å; L558-R568 WeakPolarHBondContact O-CD 3.25Å; L558-R568 PolarHBondContact O-NH1 3.22Å; L558-L572 HydrophobicContact CD2-CD1 3.8Å; L558-L572 HydrophobicContact CG-CD1 4.12Å
559	L	92.1	Very high	92.5	Very high	125 Å²	125	74.3 Å²	74.3	65%	0.654	38%	0.38	S	S	*	.	H	α-helix	trans	-74.4	-35.9	178.8	-69.1	177	0	0	0	112.3	V555 I556 T557	V555-L559 HydrophobicContact CG1-CD1 3.83Å; V555-L559 HydrophobicContact CG1-CG 4.29Å; V555-L559 VanDerWaalsContact O-CG 3.31Å; V555-L559 WeakPolarHBondContact O-CG 3.49Å; V555-L559 PolarHBondContact O-N 2.99Å; I556-L559 PolarHBondContact O-N 3.35Å; T557-L559 VanDerWaalsContact C-N 3.3Å; T557-L559 PolarHBondContact O-N 2.9Å
560	K	91.9	Very high	92.4	Very high	162 Å²	162	81.5 Å²	81.5	70%	0.704	41%	0.405	S	S	*	.	H	α-helix	trans	-75.6	-31.3	179.7	-75.2	-174.4	175.8	-175.7	0	113.8	I556 T557 Q562	I556-K560 HydrophobicContact CG2-CD 4.05Å; I556-K560 HydrophobicContact CG2-CG 4.46Å; I556-K560 WeakPolarHBondContact O-CB 3.44Å; I556-K560 WeakPolarHBondContact O-CG 3.42Å; I556-K560 PolarHBondContact O-N 3.27Å; T557-K560 PolarHBondContact O-N 3.47Å; K560-Q562 PolarHBondContact O-N 3.49Å
561	T	91.4	Very high	92.2	Very high	27 Å²	27	85.7 Å²	85.7	17%	0.166	42%	0.424	C	S	.	.	S	Bend	trans	-70.7	129.8	179.2	-53.3	0	0	0	0	110.9	T557 R568	T557-T561 PolarHBondContact O-N 2.97Å; T557-T561 PolarHBondContact O-OG1 3.44Å; T561-R568 HydrophobicContact CG2-CB 4.22Å; T561-R568 HydrophobicContact CG2-CG 4.07Å; T561-R568 WeakPolarHBondContact O-CD 3.36Å; T561-R568 WeakPolarHBondContact O-CG 3.3Å; T561-R568 PolarHBondContact O-NE 3.4Å; T561-R568 PolarHBondContact O-NH1 2.92Å
562	Q	88.3	Confident	92	Very high	157 Å²	157	83.1 Å²	83.1	73%	0.734	41%	0.407	S	S	*	.			trans	-79.9	149.3	-179.2	-64.7	-65.9	-13	0	0	112.3	K560	K560-Q562 PolarHBondContact O-N 3.49Å
563	G	90.6	Very high	92	Very high	37 Å²	37	82 Å²	82	38%	0.381	40%	0.401	S	S	.	.	S	Bend	trans	117	-169.8	175.6	0	0	0	0	0	114.3	R568	G563-R568 VanDerWaalsContact O-CZ 3.32Å; G563-R568 PolarHBondContact O-NE 3.32Å; G563-R568 PolarHBondContact O-NH2 3.1Å
564	S	92.1	Very high	91.9	Very high	76 Å²	76	82.7 Å²	82.7	53%	0.531	41%	0.41	S	S	.	.			trans	-75.3	155.2	174.8	65.8	0	0	0	0	111.4	K566 K567 R568	S564-K566 VanDerWaalsContact C-N 3.28Å; S564-K566 PolarHBondContact O-N 3.38Å; S564-K567 WeakPolarHBondContact O-CA 3.18Å; S564-K567 WeakPolarHBondContact O-CB 3.46Å; S564-K567 PolarHBondContact O-N 3.31Å; S564-R568 WeakPolarHBondContact O-CG 3.34Å; S564-R568 PolarHBondContact O-N 3.08Å
565	F	90.5	Very high	91.9	Very high	143 Å²	143	82.2 Å²	82.2	63%	0.627	41%	0.408	S	S	*	.	H	α-helix	trans	-50.8	-45.1	-177.8	-177.7	-99.3	0	0	0	113.2	K567 R568 L569	F565-K567 PolarHBondContact O-N 3.08Å; F565-R568 PolarHBondContact O-N 2.78Å; F565-L569 HydrophobicContact CE1-CD2 4.48Å; F565-L569 WeakPolarHBondContact O-CB 3.05Å; F565-L569 PolarHBondContact O-N 3.46Å
566	K	90.4	Very high	91.7	Very high	159 Å²	159	81.5 Å²	81.5	69%	0.691	40%	0.401	S	S	*	.	H	α-helix	trans	-63.2	-38.4	177.8	-170.1	175.5	-177.1	176.4	0	112.8	S564 R570	S564-K566 VanDerWaalsContact C-N 3.28Å; S564-K566 PolarHBondContact O-N 3.38Å; K566-R570 WeakPolarHBondContact O-CB 3.29Å; K566-R570 PolarHBondContact O-N 3Å; K566-R570 VanDerWaalsContact O-N 3.1Å
567	K	91.4	Very high	91.5	Very high	120 Å²	120	84.2 Å²	84.2	52%	0.522	43%	0.425	S	S	.	.	H	α-helix	trans	-69.5	-44.2	177.1	-172.9	177.8	180	-179.4	0	110.9	S564 F565 R570 Q571	S564-K567 WeakPolarHBondContact O-CA 3.18Å; S564-K567 WeakPolarHBondContact O-CB 3.46Å; S564-K567 PolarHBondContact O-N 3.31Å; F565-K567 PolarHBondContact O-N 3.08Å; K567-R570 PolarHBondContact O-N 3.18Å; K567-Q571 WeakPolarHBondContact O-CG 3.22Å; K567-Q571 PolarHBondContact O-N 2.86Å
568	R	91.9	Very high	91.4	Very high	57 Å²	57	87 Å²	87	22%	0.215	45%	0.445	C	S	.	.	H	α-helix	trans	-58.6	-50.6	176.2	-64	178.5	-165.4	-151.9	-3.3	111.1	L558 T561 G563 S564 F565 R570 Q571 L572	L558-R568 WeakPolarHBondContact O-CD 3.25Å; L558-R568 PolarHBondContact O-NH1 3.22Å; T561-R568 HydrophobicContact CG2-CB 4.22Å; T561-R568 HydrophobicContact CG2-CG 4.07Å; T561-R568 WeakPolarHBondContact O-CD 3.36Å; T561-R568 WeakPolarHBondContact O-CG 3.3Å; T561-R568 PolarHBondContact O-NE 3.4Å; T561-R568 PolarHBondContact O-NH1 2.92Å; G563-R568 VanDerWaalsContact O-CZ 3.32Å; G563-R568 PolarHBondContact O-NE 3.32Å; G563-R568 PolarHBondContact O-NH2 3.1Å; S564-R568 WeakPolarHBondContact O-CG 3.34Å; S564-R568 PolarHBondContact O-N 3.08Å; F565-R568 PolarHBondContact O-N 2.78Å; R568-R570 PolarHBondContact O-N 3.23Å; R568-Q571 PolarHBondContact O-N 3.42Å; R568-L572 WeakPolarHBondContact O-CB 3.02Å; R568-L572 VanDerWaalsContact O-CG 3.31Å; R568-L572 WeakPolarHBondContact O-CG 3.08Å; R568-L572 PolarHBondContact O-N 2.04Å
569	L	91.8	Very high	91.3	Very high	61 Å²	61	85.8 Å²	85.8	32%	0.319	44%	0.439	S	S	.	.	H	α-helix	trans	-59.7	-47.3	179.9	-175.4	62.3	0	0	0	111.1	L114 F565 Q571 L572 I573	L114-L569 HydrophobicContact CD2-CD1 3.79Å; F565-L569 HydrophobicContact CE1-CD2 4.48Å; F565-L569 WeakPolarHBondContact O-CB 3.05Å; F565-L569 PolarHBondContact O-N 3.46Å; L569-Q571 VanDerWaalsContact C-N 3.34Å; L569-Q571 PolarHBondContact O-N 3.47Å; L569-L572 PolarHBondContact O-N 3.42Å; L569-I573 HydrophobicContact CD1-CG2 4.06Å; L569-I573 WeakPolarHBondContact O-CG1 3.37Å; L569-I573 WeakPolarHBondContact O-CG2 3.26Å; L569-I573 PolarHBondContact O-N 2.98Å
570	R	92.1	Very high	91	Very high	167 Å²	167	82.3 Å²	82.3	63%	0.63	42%	0.424	S	S	*	.	H	α-helix	trans	-58.3	-44	177.1	-176.5	178.2	-73	-169.3	-6.2	112.2	K566 K567 R568 I573 T574	K566-R570 WeakPolarHBondContact O-CB 3.29Å; K566-R570 PolarHBondContact O-N 3Å; K566-R570 VanDerWaalsContact O-N 3.1Å; K567-R570 PolarHBondContact O-N 3.18Å; R568-R570 PolarHBondContact O-N 3.23Å; R570-I573 WeakPolarHBondContact O-CG1 3.44Å; R570-T574 PolarHBondContact O-N 2.64Å; R570-T574 PolarHBondContact O-OG1 2.94Å
571	Q	91.3	Very high	90.4	Very high	88 Å²	88	79.4 Å²	79.4	41%	0.411	41%	0.412	S	S	.	.	H	α-helix	trans	-63.8	-41.7	177.9	-74.2	175.8	-27.4	0	0	112	K567 R568 L569 T574	K567-Q571 WeakPolarHBondContact O-CG 3.22Å; K567-Q571 PolarHBondContact O-N 2.86Å; R568-Q571 PolarHBondContact O-N 3.42Å; L569-Q571 VanDerWaalsContact C-N 3.34Å; L569-Q571 PolarHBondContact O-N 3.47Å; Q571-T574 PolarHBondContact O-N 3.2Å
572	L	92.9	Very high	89.6	Confident	11 Å²	11	78.5 Å²	78.5	6%	0.058	41%	0.407	C	S	.	.	H	α-helix	trans	-79.2	-18	-175.2	-66.4	176.6	0	0	0	114.7	P113 L114 T557 L558 R568 L569	P113-L572 HydrophobicContact CB-CD2 3.87Å; P113-L572 WeakPolarHBondContact CD-O 3.49Å; L114-L572 HydrophobicContact CB-CB 3.92Å; L114-L572 HydrophobicContact CD1-CB 4.14Å; L114-L572 HydrophobicContact CD1-CD1 3.94Å; L114-L572 PolarHBondContact N-O 2.83Å; T557-L572 HydrophobicContact CG2-CD1 3.89Å; T557-L572 HydrophobicContact CG2-CD2 3.44Å; T557-L572 VanDerWaalsContact CG2-CD2 3.44Å; T557-L572 HydrophobicContact CG2-CG 4.3Å; L558-L572 HydrophobicContact CD2-CD1 3.8Å; L558-L572 HydrophobicContact CG-CD1 4.12Å; R568-L572 WeakPolarHBondContact O-CB 3.02Å; R568-L572 VanDerWaalsContact O-CG 3.31Å; R568-L572 WeakPolarHBondContact O-CG 3.08Å; R568-L572 PolarHBondContact O-N 2.04Å; L569-L572 PolarHBondContact O-N 3.42Å
573	I	93.5	Very high	88.3	Confident	61 Å²	61	78.1 Å²	78.1	31%	0.313	40%	0.403	S	S	.	.	H	α-helix	trans	-93.4	-8.2	171	69.5	-175.2	0	0	0	112.8	L114 V475 L569 R570	L114-I573 HydrophobicContact CD2-CG2 3.93Å; V475-I573 HydrophobicContact CG1-CB 4Å; V475-I573 HydrophobicContact CG1-CG2 3.84Å; L569-I573 HydrophobicContact CD1-CG2 4.06Å; L569-I573 WeakPolarHBondContact O-CG1 3.37Å; L569-I573 WeakPolarHBondContact O-CG2 3.26Å; L569-I573 PolarHBondContact O-N 2.98Å; R570-I573 WeakPolarHBondContact O-CG1 3.44Å
574	T	92.4	Very high	86.5	Confident	77 Å²	77	82.4 Å²	82.4	47%	0.472	41%	0.413	S	S	.	.	S	Bend	trans	-83	124.8	177.5	-58.9	0	0	0	0	108.8	R570 Q571	R570-T574 PolarHBondContact O-N 2.64Å; R570-T574 PolarHBondContact O-OG1 2.94Å; Q571-T574 PolarHBondContact O-N 3.2Å
575	P	93.3	Very high	84.4	Confident	16 Å²	16	82.6 Å²	82.6	10%	0.104	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-69	158.8	176	26	-31.8	0	0	0	112	K110 I111 Y476 R480 L579	K110-P575 CarbonylContact O-C 3.41Å; K110-P575 WeakPolarHBondContact O-CA 3.32Å; I111-P575 WeakPolarHBondContact O-CB 3.43Å; Y476-P575 HydrophobicContact CD2-CB 4.26Å; Y476-P575 HydrophobicContact CD2-CG 4.25Å; Y476-P575 HydrophobicContact CE2-CB 3.74Å; Y476-P575 HydrophobicContact CE2-CG 3.76Å; R480-P575 VanDerWaalsContact NH2-CG 3.27Å; P575-L579 HydrophobicContact CB-CD1 4.19Å
576	D	91.4	Very high	82.3	Confident	66 Å²	66	81.5 Å²	81.5	35%	0.353	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-60.6	133.5	178.5	-166.8	-54.9	0	0	0	111.3	K110 S578 L579	K110-D576 HydrophobicContact CB-CB 4.03Å; K110-D576 HydrophobicContact CG-CB 4.1Å; K110-D576 PolarHBondContact O-N 3.35Å; D576-S578 VanDerWaalsContact CG-OG 3.3Å; D576-S578 PolarHBondContact O-N 3.36Å; D576-S578 WeakPolarHBondContact OD1-CB 3.45Å; D576-S578 PolarHBondContact OD1-N 2.87Å; D576-S578 PolarHBondContact OD1-OG 2.99Å; D576-L579 HydrophobicContact CB-CG 4.45Å; D576-L579 PolarHBondContact O-N 3.02Å
577	S	88.5	Confident	79.9	Confident	111 Å²	111	83.1 Å²	83.1	78%	0.776	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-16.5	-179.1	52.3	0	0	0	0	113.8	L579	S577-L579 VanDerWaalsContact C-N 3.26Å; S577-L579 PolarHBondContact O-N 2.99Å
578	S	88.8	Confident	77.5	Confident	72 Å²	72	83.2 Å²	83.2	50%	0.503	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-12.1	176	65.8	0	0	0	0	113.8	K110 D576	K110-S578 PolarHBondContact NZ-OG 2.65Å; K110-S578 VanDerWaalsContact NZ-OG 3.12Å; D576-S578 VanDerWaalsContact CG-OG 3.3Å; D576-S578 PolarHBondContact O-N 3.36Å; D576-S578 WeakPolarHBondContact OD1-CB 3.45Å; D576-S578 PolarHBondContact OD1-N 2.87Å; D576-S578 PolarHBondContact OD1-OG 2.99Å
579	L	90	Very high	75.1	Confident	9 Å²	9	84.2 Å²	84.2	5%	0.047	43%	0.434	C	S	.	.	S	Bend	trans	-69.3	143.9	178.7	-71.5	173.4	0	0	0	111.1	Y99 T100 K110 I111 P575 D576 S577 Q581	Y99-L579 HydrophobicContact CE1-CB 4.44Å; Y99-L579 HydrophobicContact CE1-CD1 4.17Å; Y99-L579 HydrophobicContact CE1-CD2 4.28Å; T100-L579 HydrophobicContact CG2-CD2 3.94Å; K110-L579 HydrophobicContact CB-CD1 4.14Å; K110-L579 HydrophobicContact CB-CD2 4.18Å; K110-L579 HydrophobicContact CB-CG 4.3Å; K110-L579 HydrophobicContact CD-CD2 4.02Å; K110-L579 HydrophobicContact CD-CG 4.49Å; K110-L579 WeakPolarHBondContact O-CD1 3.12Å; I111-L579 HydrophobicContact CD1-CD1 3.93Å; I111-L579 HydrophobicContact CG1-CD1 4.42Å; P575-L579 HydrophobicContact CB-CD1 4.19Å; D576-L579 HydrophobicContact CB-CG 4.45Å; D576-L579 PolarHBondContact O-N 3.02Å; S577-L579 VanDerWaalsContact C-N 3.26Å; S577-L579 PolarHBondContact O-N 2.99Å; L579-Q581 PolarHBondContact O-N 2.79Å
580	P	85.4	Confident	72.4	Confident	52 Å²	52	84.5 Å²	84.5	34%	0.338	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-55.4	132.8	175.7	-23.7	34.1	0	0	0	110.9	Y99 Y311	Y99-P580 HydrophobicContact CE2-CB 4.08Å; Y99-P580 HydrophobicContact CE2-CG 4.31Å; Y99-P580 WeakPolarHBondContact CE2-O 3.36Å; Y99-P580 PolarHBondContact OH-O 3.29Å; Y311-P580 HydrophobicContact CE2-CB 4Å; Y311-P580 HydrophobicContact CE2-CG 3.83Å
581	Q	80.1	Confident	69.6	Low	100 Å²	100	80.6 Å²	80.6	47%	0.467	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-103.7	136.5	176.3	-63.2	-145.2	5.4	0	0	110.7	L579 K583	L579-Q581 PolarHBondContact O-N 2.79Å; Q581-K583 PolarHBondContact O-N 3.44Å
582	P	73.9	Confident	67.1	Low	8 Å²	8	83.2 Å²	83.2	5%	0.052	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-57.2	139.6	176.4	-21.5	30.5	0	0	0	111.3	D483 N484 D487 Q584 H585	D483-P582 HydrophobicContact CB-CB 4.42Å; D483-P582 HydrophobicContact CB-CG 4.05Å; N484-P582 WeakPolarHBondContact OD1-CD 3.24Å; N484-P582 VanDerWaalsContact OD1-CG 3.26Å; N484-P582 WeakPolarHBondContact OD1-CG 3.28Å; D487-P582 HydrophobicContact CB-CB 4.41Å; P582-Q584 PolarHBondContact O-N 3.02Å; P582-H585 PolarHBondContact O-N 3.17Å
583	K	61.8	Low	64.4	Low	149 Å²	149	85.7 Å²	85.7	65%	0.648	50%	0.496	S	S	*	.	H	α-helix	trans	-54.8	-27.6	-178.4	-69.5	178.7	-178.8	173.7	0	114.3	Q581 H585 L586 Y587	Q581-K583 PolarHBondContact O-N 3.44Å; K583-H585 VanDerWaalsContact C-N 3.33Å; K583-H585 PolarHBondContact O-N 2.95Å; K583-L586 PolarHBondContact O-N 2.76Å; K583-Y587 WeakPolarHBondContact O-CD2 3.44Å
584	Q	52.3	Low	61.2	Low	128 Å²	128	93.6 Å²	93.6	60%	0.598	52%	0.522	S	S	*	.	H	α-helix	trans	-65.9	-29.4	177	-96.4	171	-16.2	0	0	114	P582 L586 Y587	P582-Q584 PolarHBondContact O-N 3.02Å; Q584-L586 VanDerWaalsContact C-N 3.35Å; Q584-Y587 PolarHBondContact O-N 2.66Å
585	H	48.8	Very low	58.3	Low	80 Å²	80	98 Å²	98	37%	0.37	54%	0.542	S	S	.	.	H	α-helix	trans	-73.7	-25.7	177.2	-85.6	-65.4	0	0	0	113.2	P582 K583 Y587 L588 A589	P582-H585 PolarHBondContact O-N 3.17Å; K583-H585 VanDerWaalsContact C-N 3.33Å; K583-H585 PolarHBondContact O-N 2.95Å; H585-Y587 VanDerWaalsContact C-N 3.35Å; H585-L588 PolarHBondContact O-N 3.18Å; H585-A589 WeakPolarHBondContact O-CB 3.28Å; H585-A589 PolarHBondContact O-N 2.96Å
586	L	46.5	Very low	55.4	Low	119 Å²	119	106.3 Å²	106.3	62%	0.623	58%	0.577	S	S	*	*	H	α-helix	trans	-68.9	-32.9	175.7	-79.1	155.5	0	0	0	112.2	K583 Q584 G590	K583-L586 PolarHBondContact O-N 2.76Å; Q584-L586 VanDerWaalsContact C-N 3.35Å; L586-G590 PolarHBondContact O-N 3Å; L586-G590 VanDerWaalsContact O-N 3.09Å
587	Y	39.9	Very low	52.4	Low	193 Å²	193	106 Å²	106	76%	0.757	59%	0.59	S	S	*	*	H	α-helix	trans	-73.7	-34.7	176.6	-76.5	-78.9	0	0	0	113.1	K583 Q584 H585	K583-Y587 WeakPolarHBondContact O-CD2 3.44Å; Q584-Y587 PolarHBondContact O-N 2.66Å; H585-Y587 VanDerWaalsContact C-N 3.35Å
588	L	41.3	Very low	49.6	Very low	122 Å²	122	107.3 Å²	107.3	64%	0.639	60%	0.596	S	S	*	*	H	α-helix	trans	-78.3	-33.6	177.2	-73	164.7	0	0	0	112.6	H585 G590 S591	H585-L588 PolarHBondContact O-N 3.18Å; L588-G590 VanDerWaalsContact C-N 3.33Å; L588-S591 PolarHBondContact O-OG 3.42Å
589	A	40.4	Very low	46.7	Very low	78 Å²	78	109.3 Å²	109.3	65%	0.645	61%	0.61	S	S	*	*	H	α-helix	trans	-75.7	-22.5	173.8	0	0	0	0	0	112.9	H585 S591	H585-A589 WeakPolarHBondContact O-CB 3.28Å; H585-A589 PolarHBondContact O-N 2.96Å; A589-S591 VanDerWaalsContact C-N 3.34Å
590	G	35.9	Very low	44	Very low	67 Å²	67	114.5 Å²	114.5	69%	0.691	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-8.6	175.7	0	0	0	0	0	115	L586 L588	L586-G590 PolarHBondContact O-N 3Å; L586-G590 VanDerWaalsContact O-N 3.09Å; L588-G590 VanDerWaalsContact C-N 3.33Å
591	S	33.4	Very low	41.3	Very low	85 Å²	85	116.1 Å²	116.1	59%	0.594	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-8.2	179.6	74.3	0	0	0	0	114.7	L588 A589	L588-S591 PolarHBondContact O-OG 3.42Å; A589-S591 VanDerWaalsContact C-N 3.34Å
592	D	37.8	Very low	38.9	Very low	143 Å²	143	121.8 Å²	121.8	77%	0.765	69%	0.685	S	S	*	*	S	Bend	trans	-110.2	84.8	177.5	-82.1	-17.9	0	0	0	111.3
593	G	36.3	Very low	36.7	Very low	64 Å²	64	130.5 Å²	130.5	66%	0.66	73%	0.725	S	S	*	*	S	Bend	trans	76.9	90.1	149	0	0	0	0	0	117.9
594	R	27.9	Very low	35	Very low	227 Å²	227	126.7 Å²	126.7	86%	0.857	73%	0.728	S	S	*	*			trans	-168.6	113.2	130.6	-109	176	-99.6	-168.1	-4.5	111.5	F596	R594-F596 PolarHBondContact O-N 2.99Å
595	D	31.2	Very low	33.8	Very low	169 Å²	169	129.1 Å²	129.1	90%	0.904	74%	0.744	S	S	*	*			trans	-52.5	117.3	162.4	-81.3	-41.6	0	0	0	109.9
596	F	31.4	Very low	32.8	Very low	190 Å²	190	133 Å²	133	83%	0.833	77%	0.765	S	S	*	*			trans	-112.4	114.9	156.5	-91.9	-83.1	0	0	0	107.7	R594	R594-F596 PolarHBondContact O-N 2.99Å
597	G	28.7	Very low	31.9	Very low	61 Å²	61	132 Å²	132	63%	0.629	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-60.4	163.1	170.9	0	0	0	0	0	112.4	S599	G597-S599 PolarHBondContact O-N 3.09Å
598	P	29.7	Very low	31.3	Very low	137 Å²	137	126.2 Å²	126.2	89%	0.89	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-70.8	129.9	-167.3	28	-32.7	0	0	0	111.8
599	S	27.4	Very low	30.6	Very low	115 Å²	115	130 Å²	130	80%	0.804	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-84.6	144.8	168.1	-163	0	0	0	0	110	G597	G597-S599 PolarHBondContact O-N 3.09Å
600	P	33.1	Very low	30.2	Very low	117 Å²	117	135.2 Å²	135.2	76%	0.76	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-83.1	141.5	-166.7	30.4	-28.6	0	0	0	113.6
601	A	29.1	Very low	29.9	Very low	86 Å²	86	139.7 Å²	139.7	71%	0.711	80%	0.799	S	S	*	*			trans	9.9	120.5	153.5	0	0	0	0	0	119
602	K	30.1	Very low	29.7	Very low	219 Å²	219	140.6 Å²	140.6	95%	0.952	80%	0.801	S	S	*	*			trans	-111.7	91.8	139	-85.1	-172.9	175.2	-178.3	0	108.5
603	E	27.4	Very low	29.3	Very low	192 Å²	192	141.7 Å²	141.7	90%	0.897	80%	0.802	S	S	*	*			trans	-70.9	141.3	155.2	-85.5	176.5	148.7	0	0	109.1
604	G	26.4	Very low	29.2	Very low	68 Å²	68	150.1 Å²	150.1	70%	0.701	83%	0.83	S	S	*	*			trans	136	78.1	163.6	0	0	0	0	0	114.5
605	L	27	Very low	29.3	Very low	179 Å²	179	146.3 Å²	146.3	94%	0.937	83%	0.829	S	S	*	*				153.2	111.7	117.2	-88.7	145.2	0	0	0	110.8
606	I	29.2	Very low	29.2	Very low	161 Å²	161	145.1 Å²	145.1	83%	0.826	83%	0.825	S	S	*	*			trans	-90.3	151.7	172.7	-74.6	169.3	0	0	0	108.9
607	A	27.6	Very low	29.1	Very low	99 Å²	99	142.6 Å²	142.6	82%	0.818	82%	0.824	S	S	*	*			trans	70.4	131.7	162.7	0	0	0	0	0	115.3
608	G	25.9	Very low	29.1	Very low	71 Å²	71	147.4 Å²	147.4	73%	0.732	84%	0.836	S	S	*	*			cis	137.3	118.8	15.6	0	0	0	0	0	105.6
609	E	27.5	Very low	29.1	Very low	203 Å²	203	148 Å²	148	95%	0.949	83%	0.832	S	S	*	*			trans	-154.8	126.2	163	-120.8	168.2	-169.7	0	0	110
610	K	30.8	Very low	29.2	Very low	187 Å²	187	150.2 Å²	150.2	81%	0.813	83%	0.834	S	S	*	*			trans	-88.1	160	170.9	-105.8	-178.8	174.9	-175.7	0	108
611	E	29.8	Very low	28.9	Very low	160 Å²	160	152.6 Å²	152.6	75%	0.748	84%	0.839	S	S	*	*			trans	92.3	112.9	151.3	-78.2	173.1	-177.3	0	0	120.4
612	T	29.7	Very low	28.9	Very low	105 Å²	105	157.7 Å²	157.7	64%	0.644	85%	0.849	S	S	*	*				68.7	119.6	129.6	59.9	0	0	0	0	120.3
613	H	30.2	Very low	28.8	Very low	166 Å²	166	152.6 Å²	152.6	77%	0.769	84%	0.841	S	S	*	*				169.3	142.7	90.9	-97.6	-71.8	0	0	0	111.5
614	L	34.3	Very low	28.9	Very low	240 Å²	240	149 Å²	149	100%	1.257	84%	0.836	S	S	*	*			trans	74.8	0	161.6	-84.6	139	0	0	0	119.5

Retrieved 614 of 614 residues in 315.9 ms (Link to these results)

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