C4Q8W8_SCHMA Loading...

GPR-3; GPR-3; GPR-3; Putative biogenic amine receptor; Putative biogenic amine receptor

AlphaFold DB , UniProt , Accession C4Q8W8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 497 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.2	Very low	34.6	Very low	244 Å²	244	161.8 Å²	161.8	100%	1.202	78%	0.779	S	S	*	*				0	95.1	0	-82.8	173.2	170	0	0	107.4
2	N	34.4	Very low	34.4	Very low	154 Å²	154	157.1 Å²	157.1	82%	0.824	76%	0.761	S	S	*	*			trans	-78.8	135.6	-173	-78.5	-19.6	0	0	0	111.6
3	F	31.9	Very low	34.4	Very low	212 Å²	212	154.2 Å²	154.2	93%	0.93	75%	0.75	S	S	*	*			trans	45	88.3	147.3	-95.1	-96.4	0	0	0	117.4
4	I	33.7	Very low	34.1	Very low	148 Å²	148	152.6 Å²	152.6	76%	0.759	75%	0.746	S	S	*	*			trans	-120.5	130.2	159.1	-67.4	177.8	0	0	0	108.8
5	R	33	Very low	33.7	Very low	216 Å²	216	151.9 Å²	151.9	82%	0.815	74%	0.741	S	S	*	*			trans	78.6	86	162.8	-79.3	170.1	-167.8	-179.7	3.1	118
6	N	35.2	Very low	33.6	Very low	156 Å²	156	153.4 Å²	153.4	83%	0.834	75%	0.746	S	S	*	*				-114.6	76.6	125.2	-91.7	-14.9	0	0	0	108.3
7	K	36.5	Very low	33.9	Very low	177 Å²	177	152.1 Å²	152.1	77%	0.77	74%	0.738	S	S	*	*			trans	-94.6	5.5	175.1	-134.3	-179	-174.5	-176.2	0	112.6
8	T	36.3	Very low	34.3	Very low	96 Å²	96	149.7 Å²	149.7	59%	0.589	73%	0.734	S	S	*	*	S	Bend	trans	-89.8	-12.6	-172.9	2	0	0	0	0	114.6
9	N	37.2	Very low	34.7	Very low	122 Å²	122	148.8 Å²	148.8	65%	0.652	74%	0.738	S	S	*	*	H	α-helix	trans	-94.1	-12.6	176.7	-76.5	2.7	0	0	0	114.1
10	Y	31.1	Very low	35.2	Very low	192 Å²	192	145.8 Å²	145.8	75%	0.753	73%	0.728	S	S	*	*	H	α-helix	trans	-83.3	-26.5	179.1	-114.1	-89.6	0	0	0	113.1
11	S	37	Very low	36	Very low	63 Å²	63	144.2 Å²	144.2	44%	0.441	73%	0.731	S	S	.	*	H	α-helix	trans	-77.1	-33.4	177.5	46.1	0	0	0	0	113	L14	S11-L14 PolarHBondContact O-N 3.47Å
12	N	31.8	Very low	37.4	Very low	105 Å²	105	136.1 Å²	136.1	56%	0.561	70%	0.696	S	S	*	*	H	α-helix	trans	-77.1	-27.7	-177.4	-68.4	3.9	0	0	0	112.7	L14	N12-L14 VanDerWaalsContact C-N 3.3Å; N12-L14 PolarHBondContact O-N 3.06Å
13	L	34.5	Very low	39.5	Very low	119 Å²	119	129.9 Å²	129.9	62%	0.623	66%	0.664	S	S	*	*	H	α-helix	trans	-72.3	-21	173.5	-83	160.2	0	0	0	113.4
14	L	30.2	Very low	41.6	Very low	132 Å²	132	124.9 Å²	124.9	69%	0.691	64%	0.639	S	S	*	*	H	α-helix	trans	-83.7	-18.2	178.5	-86.7	157.6	0	0	0	113.3	S11 N12	S11-L14 PolarHBondContact O-N 3.47Å; N12-L14 VanDerWaalsContact C-N 3.3Å; N12-L14 PolarHBondContact O-N 3.06Å
15	Q	29.2	Very low	43.6	Very low	143 Å²	143	122.1 Å²	122.1	67%	0.668	62%	0.622	S	S	*	*	H	α-helix	trans	-93.1	-27.4	-173.4	-133.3	167.7	-1.3	0	0	113.5	T18	Q15-T18 PolarHBondContact O-OG1 3.49Å
16	E	32.2	Very low	45.4	Very low	175 Å²	175	115.3 Å²	115.3	82%	0.818	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-16.1	176.5	-78.4	-173.5	160.3	0	0	114.3	T18	E16-T18 PolarHBondContact O-N 3.23Å
17	H	38	Very low	47.1	Very low	132 Å²	132	110.4 Å²	110.4	61%	0.611	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	10.6	176.4	-89.3	-71.2	0	0	0	114.7	T19	H17-T19 VanDerWaalsContact C-N 3.34Å; H17-T19 PolarHBondContact O-N 3.39Å
18	T	40.2	Very low	48.9	Very low	109 Å²	109	109.4 Å²	109.4	67%	0.669	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	10.8	-171.3	47.7	0	0	0	0	116.5	Q15 E16	Q15-T18 PolarHBondContact O-OG1 3.49Å; E16-T18 PolarHBondContact O-N 3.23Å
19	T	43.3	Very low	51.1	Low	132 Å²	132	108.6 Å²	108.6	81%	0.81	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.4	4.6	178.3	53.7	0	0	0	0	117.7	H17	H17-T19 VanDerWaalsContact C-N 3.34Å; H17-T19 PolarHBondContact O-N 3.39Å
20	T	44.1	Very low	53.5	Low	89 Å²	89	107.8 Å²	107.8	55%	0.546	57%	0.574	S	S	.	*			trans	-118.7	103.5	164.4	51.5	0	0	0	0	108.5	T22	T20-T22 PolarHBondContact O-N 3.47Å
21	S	51.5	Low	56.1	Low	112 Å²	112	101.7 Å²	101.7	78%	0.783	56%	0.559	S	S	*	*			trans	-63.7	88.7	165.7	47.8	0	0	0	0	108.4	C23	S21-C23 PolarHBondContact O-N 3.05Å
22	T	63.5	Low	58.3	Low	75 Å²	75	100.9 Å²	100.9	46%	0.46	55%	0.546	S	S	.	.			trans	-78.4	111.8	179.5	49.4	0	0	0	0	108.6	T20 Y24	T20-T22 PolarHBondContact O-N 3.47Å; T22-Y24 VanDerWaalsContact C-N 3.28Å; T22-Y24 VanDerWaalsContact CB-CD2 3.44Å; T22-Y24 VanDerWaalsContact CB-CE2 3.49Å; T22-Y24 HydrophobicContact CG2-CD2 4.38Å; T22-Y24 HydrophobicContact CG2-CE2 3.95Å; T22-Y24 PolarHBondContact O-N 3.22Å
23	C	79	Confident	60.9	Low	23 Å²	23	98.7 Å²	98.7	16%	0.155	54%	0.537	C	S	.	.			trans	-77.3	69.9	179	-50.6	0	0	0	0	112.2	S21 F25 Y101 C185 Y187	S21-C23 PolarHBondContact O-N 3.05Å; C23-F25 VanDerWaalsContact C-CE2 3.43Å; C23-F25 HydrophobicContact CB-CE2 3.76Å; C23-F25 HydrophobicContact CB-CZ 4.08Å; C23-F25 WeakPolarHBondContact O-CE2 3.24Å; C23-Y101 WeakPolarHBondContact O-CB 3.33Å; C23-C185 HydrophobicContact CB-CB 3.82Å; C23-C185 WeakPolarHBondContact CB-SG 3.34Å; C23-C185 PolarHBondContact N-SG 3.06Å; C23-C185 WeakPolarHBondContact SG-CB 3.27Å; C23-C185 CovalentContact SG-SG 2.03Å; C23-C185 PolarHBondContact SG-SG 2.88Å; C23-Y187 HydrophobicContact CB-CE2 3.93Å
24	Y	76.7	Confident	63.6	Low	106 Å²	106	98 Å²	98	42%	0.416	53%	0.532	S	S	.	.			trans	-109.4	133.1	178.5	-68.8	-113.5	0	0	0	109.6	T22 Y101	T22-Y24 VanDerWaalsContact C-N 3.28Å; T22-Y24 VanDerWaalsContact CB-CD2 3.44Å; T22-Y24 VanDerWaalsContact CB-CE2 3.49Å; T22-Y24 HydrophobicContact CG2-CD2 4.38Å; T22-Y24 HydrophobicContact CG2-CE2 3.95Å; T22-Y24 PolarHBondContact O-N 3.22Å; Y24-Y101 AromaticContact CD1-CD1 3.28Å; Y24-Y101 HydrophobicContact CD1-CD1 3.28Å; Y24-Y101 HydrophobicContact CD1-CD2 4.29Å; Y24-Y101 AromaticContact CD1-CE1 3.89Å; Y24-Y101 HydrophobicContact CD1-CE1 3.89Å; Y24-Y101 AromaticContact CD1-CG 3.56Å; Y24-Y101 HydrophobicContact CD1-CG 3.56Å; Y24-Y101 AromaticContact CE1-CD1 3.32Å; Y24-Y101 HydrophobicContact CE1-CD1 3.32Å; Y24-Y101 AromaticContact CE1-CD2 3.7Å; Y24-Y101 HydrophobicContact CE1-CD2 3.7Å; Y24-Y101 AromaticContact CE1-CE1 3.55Å; Y24-Y101 HydrophobicContact CE1-CE1 3.55Å; Y24-Y101 AromaticContact CE1-CE2 3.87Å; Y24-Y101 HydrophobicContact CE1-CE2 3.87Å; Y24-Y101 AromaticContact CE1-CG 3.43Å; Y24-Y101 HydrophobicContact CE1-CG 3.43Å; Y24-Y101 VanDerWaalsContact CE1-CG 3.43Å; Y24-Y101 AromaticContact CE1-CZ 3.83Å; Y24-Y101 HydrophobicContact CG-CD1 4.27Å; Y24-Y101 HydrophobicContact CG-CG 4.23Å; Y24-Y101 AromaticContact CZ-CD2 3.93Å
25	F	75.2	Confident	66.3	Low	91 Å²	91	96 Å²	96	40%	0.399	53%	0.526	S	S	.	.			trans	-129.3	10.5	-175.8	-52.5	-82.1	0	0	0	113.8	C23 S27 G100 Y187 E455	C23-F25 VanDerWaalsContact C-CE2 3.43Å; C23-F25 HydrophobicContact CB-CE2 3.76Å; C23-F25 HydrophobicContact CB-CZ 4.08Å; C23-F25 WeakPolarHBondContact O-CE2 3.24Å; F25-S27 PolarHBondContact O-N 3.3Å; F25-G100 PolarHBondContact N-O 2.82Å; F25-Y187 WeakPolarHBondContact CD2-OH 3.32Å; F25-Y187 HydrophobicContact CE2-CE2 4.3Å; F25-Y187 AromaticContact CE2-CZ 3.87Å; F25-Y187 WeakPolarHBondContact CE2-OH 3.42Å; F25-E455 HydrophobicContact CD1-CB 4.27Å; F25-E455 HydrophobicContact CD1-CG 3.56Å; F25-E455 HydrophobicContact CD2-CG 4.11Å; F25-E455 HydrophobicContact CE1-CG 3.54Å; F25-E455 HydrophobicContact CE2-CG 4.14Å; F25-E455 HydrophobicContact CG-CB 4.3Å; F25-E455 HydrophobicContact CG-CG 3.82Å; F25-E455 HydrophobicContact CZ-CG 3.83Å
26	I	69.5	Low	69.1	Low	72 Å²	72	89.5 Å²	89.5	37%	0.369	50%	0.496	S	S	.	.			trans	-65.2	120.9	171	-66.9	-165	0	0	0	109.2	W32 L99	I26-W32 HydrophobicContact CB-CH2 4.21Å; I26-W32 HydrophobicContact CB-CZ3 4.17Å; I26-W32 HydrophobicContact CD1-CH2 4.35Å; I26-W32 HydrophobicContact CD1-CZ3 4.34Å; I26-W32 HydrophobicContact CG1-CH2 3.72Å; I26-W32 HydrophobicContact CG1-CZ3 3.97Å; I26-W32 HydrophobicContact CG2-CE3 4.2Å; I26-W32 HydrophobicContact CG2-CH2 4.3Å; I26-W32 HydrophobicContact CG2-CZ3 3.74Å; I26-L99 WeakPolarHBondContact CD1-O 3.25Å; I26-L99 WeakPolarHBondContact CG1-O 3.24Å
27	S	71.6	Confident	71.9	Confident	54 Å²	54	84.9 Å²	84.9	38%	0.378	48%	0.477	S	S	.	.			trans	-83.1	131.2	159.2	179.5	0	0	0	0	109.2	F25 D29	F25-S27 PolarHBondContact O-N 3.3Å; S27-D29 PolarHBondContact O-N 2.8Å; S27-D29 VanDerWaalsContact O-N 3.17Å; S27-D29 WeakPolarHBondContact OG-CB 3.06Å; S27-D29 PolarHBondContact OG-N 3.45Å
28	N	74	Confident	74.5	Confident	156 Å²	156	83.5 Å²	83.5	83%	0.834	47%	0.473	S	S	*	.			trans	-73.4	6.1	171.5	-79.2	-10.2	0	0	0	112.8	T30	N28-T30 PolarHBondContact O-N 2.83Å
29	D	83.4	Confident	76.8	Confident	78 Å²	78	81 Å²	81	42%	0.417	46%	0.455	S	S	.	.			trans	-64.5	126.6	173.6	-174.3	-2.4	0	0	0	110.8	S27 S31 W32 V33	S27-D29 PolarHBondContact O-N 2.8Å; S27-D29 VanDerWaalsContact O-N 3.17Å; S27-D29 WeakPolarHBondContact OG-CB 3.06Å; S27-D29 PolarHBondContact OG-N 3.45Å; D29-S31 PolarHBondContact O-N 3.36Å; D29-S31 VanDerWaalsContact O-N 3.16Å; D29-S31 PolarHBondContact OD1-N 2.85Å; D29-S31 PolarHBondContact OD1-OG 2.88Å; D29-S31 PolarHBondContact OD2-OG 2.88Å; D29-W32 HydrophobicContact CB-CB 4.31Å; D29-W32 WeakPolarHBondContact O-CB 3.49Å; D29-W32 PolarHBondContact O-N 3.16Å; D29-V33 PolarHBondContact O-N 3.31Å
30	T	87.2	Confident	79.2	Confident	106 Å²	106	75.5 Å²	75.5	65%	0.65	42%	0.421	S	S	*	.	H	α-helix	trans	-48.9	-37.1	172.3	56.8	0	0	0	0	113.5	N28 V33 I34	N28-T30 PolarHBondContact O-N 2.83Å; T30-V33 PolarHBondContact O-N 3.09Å; T30-I34 WeakPolarHBondContact O-CG1 3.43Å; T30-I34 PolarHBondContact O-N 2.95Å; T30-I34 VanDerWaalsContact O-N 3.12Å
31	S	86.3	Confident	81.5	Confident	63 Å²	63	74.8 Å²	74.8	44%	0.441	42%	0.42	S	S	.	.	H	α-helix	trans	-66	-40.4	179.2	77.8	0	0	0	0	111.7	D29 T35	D29-S31 PolarHBondContact O-N 3.36Å; D29-S31 VanDerWaalsContact O-N 3.16Å; D29-S31 PolarHBondContact OD1-N 2.85Å; D29-S31 PolarHBondContact OD1-OG 2.88Å; D29-S31 PolarHBondContact OD2-OG 2.88Å; S31-T35 WeakPolarHBondContact O-CB 3.39Å; S31-T35 PolarHBondContact O-N 3.46Å; S31-T35 VanDerWaalsContact O-N 3.1Å; S31-T35 PolarHBondContact O-OG1 3.32Å
32	W	83.6	Confident	83.4	Confident	46 Å²	46	73 Å²	73	17%	0.174	41%	0.407	C	S	.	.	H	α-helix	trans	-67.6	-44.4	177	-173.7	92.7	0	0	0	110.9	I26 D29 I34 T35 N36	I26-W32 HydrophobicContact CB-CH2 4.21Å; I26-W32 HydrophobicContact CB-CZ3 4.17Å; I26-W32 HydrophobicContact CD1-CH2 4.35Å; I26-W32 HydrophobicContact CD1-CZ3 4.34Å; I26-W32 HydrophobicContact CG1-CH2 3.72Å; I26-W32 HydrophobicContact CG1-CZ3 3.97Å; I26-W32 HydrophobicContact CG2-CE3 4.2Å; I26-W32 HydrophobicContact CG2-CH2 4.3Å; I26-W32 HydrophobicContact CG2-CZ3 3.74Å; D29-W32 HydrophobicContact CB-CB 4.31Å; D29-W32 WeakPolarHBondContact O-CB 3.49Å; D29-W32 PolarHBondContact O-N 3.16Å; W32-I34 PolarHBondContact O-N 3.27Å; W32-T35 PolarHBondContact O-N 3.41Å; W32-N36 HydrophobicContact CD2-CB 4.41Å; W32-N36 HydrophobicContact CE3-CB 4.14Å; W32-N36 HydrophobicContact CH2-CB 4.01Å; W32-N36 HydrophobicContact CZ2-CB 4.33Å; W32-N36 HydrophobicContact CZ3-CB 3.93Å; W32-N36 VanDerWaalsContact O-CB 3.25Å; W32-N36 WeakPolarHBondContact O-CB 3.32Å; W32-N36 PolarHBondContact O-N 3.29Å
33	V	86.6	Confident	84.7	Confident	59 Å²	59	69.7 Å²	69.7	36%	0.358	39%	0.386	S	S	.	.	H	α-helix	trans	-58.9	-45.8	178.3	174.5	0	0	0	0	111.5	D29 T30 N36 N37	D29-V33 PolarHBondContact O-N 3.31Å; T30-V33 PolarHBondContact O-N 3.09Å; V33-N36 PolarHBondContact O-N 3.46Å; V33-N37 WeakPolarHBondContact O-CB 3.26Å; V33-N37 PolarHBondContact O-N 3.34Å; V33-N37 PolarHBondContact O-ND2 3.4Å
34	I	89.5	Confident	85.5	Confident	104 Å²	104	71.3 Å²	71.3	53%	0.533	40%	0.395	S	S	.	.	H	α-helix	trans	-62.4	-47.3	177.6	-66.8	167.2	0	0	0	110.3	T30 W32 N36 N37 I38	T30-I34 WeakPolarHBondContact O-CG1 3.43Å; T30-I34 PolarHBondContact O-N 2.95Å; T30-I34 VanDerWaalsContact O-N 3.12Å; W32-I34 PolarHBondContact O-N 3.27Å; I34-N36 PolarHBondContact O-N 2.93Å; I34-N37 PolarHBondContact O-N 3.33Å; I34-I38 HydrophobicContact CG2-CD1 3.88Å; I34-I38 WeakPolarHBondContact O-CG1 3.04Å; I34-I38 PolarHBondContact O-N 3.39Å
35	T	87.8	Confident	86.3	Confident	91 Å²	91	71.2 Å²	71.2	56%	0.558	40%	0.401	S	S	*	.	H	α-helix	trans	-61.2	-44.5	179.7	-57	0	0	0	0	111.6	S31 W32 I38 L39	S31-T35 WeakPolarHBondContact O-CB 3.39Å; S31-T35 PolarHBondContact O-N 3.46Å; S31-T35 VanDerWaalsContact O-N 3.1Å; S31-T35 PolarHBondContact O-OG1 3.32Å; W32-T35 PolarHBondContact O-N 3.41Å; T35-I38 PolarHBondContact O-N 2.72Å; T35-L39 WeakPolarHBondContact O-CB 3.29Å; T35-L39 PolarHBondContact O-N 2.89Å
36	N	88.6	Confident	87.1	Confident	7 Å²	7	67.4 Å²	67.4	4%	0.037	39%	0.387	C	S	.	.	H	α-helix	trans	-63.2	-41.2	177.8	-176.1	56.7	0	0	0	112.2	W32 V33 I34 L39 T40 Q97 N98	W32-N36 HydrophobicContact CD2-CB 4.41Å; W32-N36 HydrophobicContact CE3-CB 4.14Å; W32-N36 HydrophobicContact CH2-CB 4.01Å; W32-N36 HydrophobicContact CZ2-CB 4.33Å; W32-N36 HydrophobicContact CZ3-CB 3.93Å; W32-N36 VanDerWaalsContact O-CB 3.25Å; W32-N36 WeakPolarHBondContact O-CB 3.32Å; W32-N36 PolarHBondContact O-N 3.29Å; V33-N36 PolarHBondContact O-N 3.46Å; I34-N36 PolarHBondContact O-N 2.93Å; N36-L39 PolarHBondContact O-N 3.44Å; N36-T40 VanDerWaalsContact O-CB 3.25Å; N36-T40 WeakPolarHBondContact O-CB 3.42Å; N36-T40 PolarHBondContact O-N 3.11Å; N36-T40 PolarHBondContact O-OG1 3.48Å; N36-Q97 PolarHBondContact OD1-NE2 2.96Å; N36-Q97 PolarHBondContact OD1-O 3.44Å; N36-Q97 VanDerWaalsContact OD1-O 3.05Å; N36-N98 PolarHBondContact ND2-O 3.49Å
37	N	91.3	Very high	88.3	Confident	78 Å²	78	64.9 Å²	64.9	42%	0.417	38%	0.375	S	S	.	.	H	α-helix	trans	-65.2	-42.1	176.9	-73.5	-18.3	0	0	0	112.1	V33 I34 S41	V33-N37 WeakPolarHBondContact O-CB 3.26Å; V33-N37 PolarHBondContact O-N 3.34Å; V33-N37 PolarHBondContact O-ND2 3.4Å; I34-N37 PolarHBondContact O-N 3.33Å; N37-S41 WeakPolarHBondContact O-CB 3.41Å; N37-S41 PolarHBondContact O-N 3.45Å; N37-S41 PolarHBondContact O-OG 3.19Å
38	I	91.7	Very high	89.4	Confident	102 Å²	102	66.7 Å²	66.7	52%	0.523	38%	0.379	S	S	.	.	H	α-helix	trans	-63.1	-48.8	175.3	-67.2	167.5	0	0	0	109.8	I34 T35 T40 S41 C42	I34-I38 HydrophobicContact CG2-CD1 3.88Å; I34-I38 WeakPolarHBondContact O-CG1 3.04Å; I34-I38 PolarHBondContact O-N 3.39Å; T35-I38 PolarHBondContact O-N 2.72Å; I38-T40 PolarHBondContact O-N 2.82Å; I38-S41 PolarHBondContact O-N 3.12Å; I38-C42 PolarHBondContact O-N 2.95Å; I38-C42 PolarHBondContact O-SG 3.47Å; I38-C42 VanDerWaalsContact O-SG 3.37Å
39	L	89.5	Confident	90.3	Very high	56 Å²	56	62 Å²	62	29%	0.293	35%	0.354	S	S	.	.	H	α-helix	trans	-58.5	-51.3	179	-179.7	59.6	0	0	0	110.9	T35 N36 S41 C42 L43 Q97	T35-L39 WeakPolarHBondContact O-CB 3.29Å; T35-L39 PolarHBondContact O-N 2.89Å; N36-L39 PolarHBondContact O-N 3.44Å; L39-S41 VanDerWaalsContact C-N 3.28Å; L39-S41 PolarHBondContact O-N 2.78Å; L39-C42 WeakPolarHBondContact O-CB 3.48Å; L39-C42 PolarHBondContact O-N 3.41Å; L39-C42 VanDerWaalsContact O-N 3.12Å; L39-L43 HydrophobicContact CD1-CD1 3.92Å; L39-L43 HydrophobicContact CD1-CD2 4.49Å; L39-L43 HydrophobicContact CD1-CG 4.05Å; L39-L43 HydrophobicContact CG-CD1 3.75Å; L39-L43 HydrophobicContact CG-CG 4.31Å; L39-L43 WeakPolarHBondContact O-CB 3.48Å; L39-L43 WeakPolarHBondContact O-CG 3.34Å; L39-L43 PolarHBondContact O-N 3.18Å; L39-Q97 HydrophobicContact CD2-CG 4.38Å
40	T	91.9	Very high	90.9	Very high	17 Å²	17	58.4 Å²	58.4	10%	0.104	34%	0.335	C	S	.	.	H	α-helix	trans	-56.6	-41.1	177.3	-60.2	0	0	0	0	111.9	N36 I38 L43 T44 I94 N98	N36-T40 VanDerWaalsContact O-CB 3.25Å; N36-T40 WeakPolarHBondContact O-CB 3.42Å; N36-T40 PolarHBondContact O-N 3.11Å; N36-T40 PolarHBondContact O-OG1 3.48Å; I38-T40 PolarHBondContact O-N 2.82Å; T40-L43 PolarHBondContact O-N 3.43Å; T40-T44 WeakPolarHBondContact O-CB 3.23Å; T40-T44 VanDerWaalsContact O-CG2 3.29Å; T40-T44 WeakPolarHBondContact O-CG2 3.48Å; T40-T44 PolarHBondContact O-N 3.39Å; T40-T44 PolarHBondContact O-OG1 3.19Å; T40-I94 HydrophobicContact CG2-CG2 4.08Å; T40-N98 HydrophobicContact CG2-CB 4.18Å
41	S	93.4	Very high	91.3	Very high	75 Å²	75	56.5 Å²	56.5	52%	0.524	32%	0.317	S	S	.	.	H	α-helix	trans	-65.8	-42.9	176.4	-58.7	0	0	0	0	112.4	N37 I38 L39 L43 T44 L45	N37-S41 WeakPolarHBondContact O-CB 3.41Å; N37-S41 PolarHBondContact O-N 3.45Å; N37-S41 PolarHBondContact O-OG 3.19Å; I38-S41 PolarHBondContact O-N 3.12Å; L39-S41 VanDerWaalsContact C-N 3.28Å; L39-S41 PolarHBondContact O-N 2.78Å; S41-L43 VanDerWaalsContact C-N 3.32Å; S41-L43 PolarHBondContact O-N 3.24Å; S41-T44 WeakPolarHBondContact CA-OG1 3.45Å; S41-T44 PolarHBondContact O-OG1 2.97Å; S41-L45 PolarHBondContact O-N 2.95Å; S41-L45 VanDerWaalsContact O-N 3.15Å
42	C	92.1	Very high	91.6	Very high	74 Å²	74	59 Å²	59	50%	0.5	32%	0.32	S	S	.	.	H	α-helix	trans	-63.6	-39	175	-70.8	0	0	0	0	111.9	I38 L39 L45 A46	I38-C42 PolarHBondContact O-N 2.95Å; I38-C42 PolarHBondContact O-SG 3.47Å; I38-C42 VanDerWaalsContact O-SG 3.37Å; L39-C42 WeakPolarHBondContact O-CB 3.48Å; L39-C42 PolarHBondContact O-N 3.41Å; L39-C42 VanDerWaalsContact O-N 3.12Å; C42-L45 PolarHBondContact O-N 3.19Å; C42-A46 WeakPolarHBondContact O-CB 3.49Å; C42-A46 PolarHBondContact O-N 2.95Å
43	L	90.8	Very high	92	Very high	6 Å²	6	57.3 Å²	57.3	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-73.1	-38.7	-178.5	-68.8	173.3	0	0	0	113.2	L39 T40 S41 L45 A46 T47 I94 Q97 W463	L39-L43 HydrophobicContact CD1-CD1 3.92Å; L39-L43 HydrophobicContact CD1-CD2 4.49Å; L39-L43 HydrophobicContact CD1-CG 4.05Å; L39-L43 HydrophobicContact CG-CD1 3.75Å; L39-L43 HydrophobicContact CG-CG 4.31Å; L39-L43 WeakPolarHBondContact O-CB 3.48Å; L39-L43 WeakPolarHBondContact O-CG 3.34Å; L39-L43 PolarHBondContact O-N 3.18Å; T40-L43 PolarHBondContact O-N 3.43Å; S41-L43 VanDerWaalsContact C-N 3.32Å; S41-L43 PolarHBondContact O-N 3.24Å; L43-L45 VanDerWaalsContact C-N 3.34Å; L43-A46 PolarHBondContact O-N 3.01Å; L43-T47 WeakPolarHBondContact O-CB 3.49Å; L43-T47 PolarHBondContact O-N 3.32Å; L43-T47 PolarHBondContact O-OG1 3.18Å; L43-I94 HydrophobicContact CB-CD1 4.4Å; L43-I94 HydrophobicContact CB-CG1 4.16Å; L43-Q97 HydrophobicContact CD1-CG 4.21Å; L43-W463 HydrophobicContact CB-CZ3 4.41Å; L43-W463 HydrophobicContact CD1-CD2 3.55Å; L43-W463 HydrophobicContact CD1-CE3 3.8Å; L43-W463 HydrophobicContact CD1-CG 4.2Å; L43-W463 HydrophobicContact CD1-CH2 3.75Å; L43-W463 HydrophobicContact CD1-CZ2 3.45Å; L43-W463 VanDerWaalsContact CD1-CZ2 3.45Å; L43-W463 HydrophobicContact CD1-CZ3 3.9Å; L43-W463 HydrophobicContact CD2-CB 4.41Å; L43-W463 HydrophobicContact CD2-CD2 3.5Å; L43-W463 HydrophobicContact CD2-CE3 3.16Å; L43-W463 HydrophobicContact CD2-CG 4Å; L43-W463 HydrophobicContact CD2-CH2 4.4Å; L43-W463 HydrophobicContact CD2-CZ3 3.67Å; L43-W463 HydrophobicContact CG-CD2 4.13Å; L43-W463 HydrophobicContact CG-CE3 4.01Å; L43-W463 HydrophobicContact CG-CH2 4.46Å; L43-W463 HydrophobicContact CG-CZ3 4.18Å
44	T	94.6	Very high	92.3	Very high	56 Å²	56	54.6 Å²	54.6	34%	0.344	30%	0.301	S	S	.	.	H	α-helix	trans	-62.5	-43.8	172.4	48.6	0	0	0	0	110.6	T40 S41 T47 I48 I94	T40-T44 WeakPolarHBondContact O-CB 3.23Å; T40-T44 VanDerWaalsContact O-CG2 3.29Å; T40-T44 WeakPolarHBondContact O-CG2 3.48Å; T40-T44 PolarHBondContact O-N 3.39Å; T40-T44 PolarHBondContact O-OG1 3.19Å; S41-T44 WeakPolarHBondContact CA-OG1 3.45Å; S41-T44 PolarHBondContact O-OG1 2.97Å; T44-T47 PolarHBondContact O-N 3.48Å; T44-I48 WeakPolarHBondContact O-CG1 3.36Å; T44-I48 PolarHBondContact O-N 3.25Å; T44-I48 VanDerWaalsContact O-N 3.09Å; T44-I94 HydrophobicContact CG2-CD1 3.99Å; T44-I94 HydrophobicContact CG2-CG2 3.82Å
45	L	93.6	Very high	92.5	Very high	104 Å²	104	52 Å²	52	55%	0.545	29%	0.288	S	S	.	.	H	α-helix	trans	-61.6	-46	173.6	-179.6	61.9	0	0	0	112.2	S41 C42 L43 T47 I48 I49	S41-L45 PolarHBondContact O-N 2.95Å; S41-L45 VanDerWaalsContact O-N 3.15Å; C42-L45 PolarHBondContact O-N 3.19Å; L43-L45 VanDerWaalsContact C-N 3.34Å; L45-T47 VanDerWaalsContact C-N 3.31Å; L45-T47 PolarHBondContact O-N 3.02Å; L45-I48 PolarHBondContact O-N 3.49Å; L45-I49 HydrophobicContact CD1-CD1 4.43Å; L45-I49 HydrophobicContact CG-CD1 4.16Å; L45-I49 WeakPolarHBondContact O-CG1 3.48Å; L45-I49 PolarHBondContact O-N 3.21Å
46	A	92.3	Very high	92.7	Very high	12 Å²	12	49.3 Å²	49.3	10%	0.099	27%	0.27	C	S	.	.	H	α-helix	trans	-57	-44.4	175.5	0	0	0	0	0	111.9	C42 L43 I48 I49 I50 I470	C42-A46 WeakPolarHBondContact O-CB 3.49Å; C42-A46 PolarHBondContact O-N 2.95Å; L43-A46 PolarHBondContact O-N 3.01Å; A46-I48 VanDerWaalsContact C-N 3.35Å; A46-I48 PolarHBondContact O-N 3.09Å; A46-I49 WeakPolarHBondContact O-CB 3.28Å; A46-I49 PolarHBondContact O-N 2.95Å; A46-I49 VanDerWaalsContact O-N 3.14Å; A46-I50 VanDerWaalsContact O-CG1 3.29Å; A46-I50 WeakPolarHBondContact O-CG1 3.37Å; A46-I50 PolarHBondContact O-N 3.48Å; A46-I470 HydrophobicContact CB-CD1 3.55Å; A46-I470 HydrophobicContact CB-CG1 4.43Å
47	T	94.9	Very high	92.7	Very high	18 Å²	18	49 Å²	49	11%	0.11	27%	0.269	C	S	.	.	H	α-helix	trans	-60.9	-42.8	178.5	-60.8	0	0	0	0	111.9	L43 T44 L45 I49 I50 F51 L90 I94	L43-T47 WeakPolarHBondContact O-CB 3.49Å; L43-T47 PolarHBondContact O-N 3.32Å; L43-T47 PolarHBondContact O-OG1 3.18Å; T44-T47 PolarHBondContact O-N 3.48Å; L45-T47 VanDerWaalsContact C-N 3.31Å; L45-T47 PolarHBondContact O-N 3.02Å; T47-I49 VanDerWaalsContact C-N 3.33Å; T47-I49 PolarHBondContact O-N 3.2Å; T47-I50 PolarHBondContact O-N 2.89Å; T47-F51 WeakPolarHBondContact O-CB 3.29Å; T47-F51 PolarHBondContact O-N 3.24Å; T47-L90 HydrophobicContact CG2-CB 3.8Å; T47-L90 HydrophobicContact CG2-CD1 3.96Å; T47-L90 WeakPolarHBondContact OG1-CD1 3.22Å; T47-I94 VanDerWaalsContact OG1-CD1 3.32Å; T47-I94 WeakPolarHBondContact OG1-CD1 3.44Å
48	I	94.9	Very high	92.7	Very high	92 Å²	92	47.5 Å²	47.5	47%	0.472	26%	0.26	S	S	.	.	H	α-helix	trans	-61.3	-43.2	175.2	-68	167.4	0	0	0	110.6	T44 L45 A46 F51 F52	T44-I48 WeakPolarHBondContact O-CG1 3.36Å; T44-I48 PolarHBondContact O-N 3.25Å; T44-I48 VanDerWaalsContact O-N 3.09Å; L45-I48 PolarHBondContact O-N 3.49Å; A46-I48 VanDerWaalsContact C-N 3.35Å; A46-I48 PolarHBondContact O-N 3.09Å; I48-F51 PolarHBondContact O-N 3.4Å; I48-F52 HydrophobicContact CG2-CD2 3.71Å; I48-F52 HydrophobicContact CG2-CE2 3.92Å; I48-F52 WeakPolarHBondContact O-CD2 3.4Å; I48-F52 PolarHBondContact O-N 3.41Å
49	I	93.1	Very high	92.6	Very high	59 Å²	59	46.1 Å²	46.1	30%	0.303	25%	0.253	S	S	.	.	H	α-helix	trans	-63.4	-44.2	177.2	-67.1	167.2	0	0	0	111.1	L45 A46 T47 G53 I470 F474	L45-I49 HydrophobicContact CD1-CD1 4.43Å; L45-I49 HydrophobicContact CG-CD1 4.16Å; L45-I49 WeakPolarHBondContact O-CG1 3.48Å; L45-I49 PolarHBondContact O-N 3.21Å; A46-I49 WeakPolarHBondContact O-CB 3.28Å; A46-I49 PolarHBondContact O-N 2.95Å; A46-I49 VanDerWaalsContact O-N 3.14Å; T47-I49 VanDerWaalsContact C-N 3.33Å; T47-I49 PolarHBondContact O-N 3.2Å; I49-G53 VanDerWaalsContact O-CA 3.31Å; I49-G53 WeakPolarHBondContact O-CA 3.47Å; I49-G53 PolarHBondContact O-N 2.84Å; I49-I470 HydrophobicContact CG2-CG2 4.24Å; I49-F474 HydrophobicContact CG2-CE2 3.81Å; I49-F474 HydrophobicContact CG2-CZ 3.9Å
50	I	94.6	Very high	92.4	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-62.2	-47.5	178.1	-64.8	164.2	0	0	0	110.1	A46 T47 N54 D82 L90 I470	A46-I50 VanDerWaalsContact O-CG1 3.29Å; A46-I50 WeakPolarHBondContact O-CG1 3.37Å; A46-I50 PolarHBondContact O-N 3.48Å; T47-I50 PolarHBondContact O-N 2.89Å; I50-N54 WeakPolarHBondContact O-CB 3.46Å; I50-N54 PolarHBondContact O-N 2.94Å; I50-N54 VanDerWaalsContact O-N 3.07Å; I50-N54 PolarHBondContact O-ND2 2.87Å; I50-D82 WeakPolarHBondContact CG2-O 3.39Å; I50-L90 HydrophobicContact CD1-CD1 3.53Å; I50-I470 HydrophobicContact CD1-CD1 4.44Å; I50-I470 HydrophobicContact CD1-CG1 3.6Å; I50-I470 HydrophobicContact CG1-CB 4.35Å; I50-I470 HydrophobicContact CG1-CG1 3.54Å
51	F	95.8	Very high	92.1	Very high	66 Å²	66	44 Å²	44	29%	0.289	24%	0.24	S	C	.	.	H	α-helix	trans	-58.4	-59.7	-179.2	179.8	-87.5	0	0	0	111.2	T47 I48 L55 F83 S86 V87	T47-F51 WeakPolarHBondContact O-CB 3.29Å; T47-F51 PolarHBondContact O-N 3.24Å; I48-F51 PolarHBondContact O-N 3.4Å; F51-L55 HydrophobicContact CE1-CD2 4.05Å; F51-L55 HydrophobicContact CZ-CD2 4.49Å; F51-L55 WeakPolarHBondContact O-CB 3.37Å; F51-L55 PolarHBondContact O-N 3.08Å; F51-F83 HydrophobicContact CD2-CD2 4.11Å; F51-F83 AromaticContact CD2-CE2 3.59Å; F51-F83 HydrophobicContact CD2-CE2 3.59Å; F51-F83 HydrophobicContact CD2-CZ 4.41Å; F51-F83 HydrophobicContact CE1-CE2 4.44Å; F51-F83 HydrophobicContact CE2-CD2 4.29Å; F51-F83 AromaticContact CE2-CE2 3.34Å; F51-F83 HydrophobicContact CE2-CE2 3.34Å; F51-F83 AromaticContact CE2-CZ 3.83Å; F51-F83 HydrophobicContact CE2-CZ 3.83Å; F51-F83 HydrophobicContact CG-CE2 4.27Å; F51-F83 AromaticContact CZ-CE2 3.8Å; F51-F83 HydrophobicContact CZ-CE2 3.8Å; F51-F83 HydrophobicContact CZ-CZ 4.33Å; F51-S86 WeakPolarHBondContact CA-OG 3.39Å; F51-V87 HydrophobicContact CD2-CG2 4.01Å; F51-V87 HydrophobicContact CE2-CG2 3.91Å
52	F	93.5	Very high	91.7	Very high	114 Å²	114	43.1 Å²	43.1	50%	0.5	24%	0.238	S	C	.	.	H	α-helix	trans	-71.3	-38.9	-176.4	-75.2	-69.3	0	0	0	112.1	I48 N54 L55 L56	I48-F52 HydrophobicContact CG2-CD2 3.71Å; I48-F52 HydrophobicContact CG2-CE2 3.92Å; I48-F52 WeakPolarHBondContact O-CD2 3.4Å; I48-F52 PolarHBondContact O-N 3.41Å; F52-N54 PolarHBondContact O-N 3.16Å; F52-L55 PolarHBondContact O-N 3.47Å; F52-L56 WeakPolarHBondContact O-CB 3.44Å; F52-L56 WeakPolarHBondContact O-CD1 3.47Å; F52-L56 WeakPolarHBondContact O-CG 3.34Å; F52-L56 PolarHBondContact O-N 2.96Å
53	G	91.7	Very high	91.3	Very high	12 Å²	12	43.4 Å²	43.4	12%	0.124	24%	0.237	C	C	.	.	H	α-helix	trans	-60	-47.6	-179.9	0	0	0	0	0	112.3	I49 I57	I49-G53 VanDerWaalsContact O-CA 3.31Å; I49-G53 WeakPolarHBondContact O-CA 3.47Å; I49-G53 PolarHBondContact O-N 2.84Å; G53-I57 WeakPolarHBondContact O-CG1 2.9Å; G53-I57 PolarHBondContact O-N 3.27Å
54	N	93.7	Very high	90.6	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-76.6	-35.3	179.6	-70.6	-65.7	0	0	0	112.4	I50 F52 L56 I57 I58 A79 F83 S469	I50-N54 WeakPolarHBondContact O-CB 3.46Å; I50-N54 PolarHBondContact O-N 2.94Å; I50-N54 VanDerWaalsContact O-N 3.07Å; I50-N54 PolarHBondContact O-ND2 2.87Å; F52-N54 PolarHBondContact O-N 3.16Å; N54-L56 VanDerWaalsContact C-N 3.31Å; N54-L56 PolarHBondContact O-N 3.4Å; N54-I57 WeakPolarHBondContact O-CB 2.98Å; N54-I57 PolarHBondContact O-N 2.92Å; N54-I58 WeakPolarHBondContact O-CG1 3.49Å; N54-I58 PolarHBondContact O-N 3.33Å; N54-A79 HydrophobicContact CB-CB 4.28Å; N54-A79 WeakPolarHBondContact CB-O 3.11Å; N54-F83 HydrophobicContact CB-CB 4.05Å; N54-S469 PolarHBondContact ND2-O 3.25Å
55	L	93.4	Very high	88.9	Confident	49 Å²	49	50.9 Å²	50.9	26%	0.257	27%	0.271	S	S	.	.	H	α-helix	trans	-58.6	-43.5	172.1	-179.7	61.8	0	0	0	111.5	F51 F52 I57 I58 L59 F83	F51-L55 HydrophobicContact CE1-CD2 4.05Å; F51-L55 HydrophobicContact CZ-CD2 4.49Å; F51-L55 WeakPolarHBondContact O-CB 3.37Å; F51-L55 PolarHBondContact O-N 3.08Å; F52-L55 PolarHBondContact O-N 3.47Å; L55-I57 VanDerWaalsContact C-N 3.34Å; L55-I57 PolarHBondContact O-N 3.33Å; L55-I58 PolarHBondContact O-N 3.19Å; L55-L59 HydrophobicContact CD1-CD1 4.37Å; L55-L59 HydrophobicContact CD1-CG 4.31Å; L55-L59 HydrophobicContact CG-CD1 4.06Å; L55-L59 HydrophobicContact CG-CG 4.41Å; L55-L59 VanDerWaalsContact O-CG 3.3Å; L55-L59 WeakPolarHBondContact O-CG 3.5Å; L55-L59 PolarHBondContact O-N 3.13Å; L55-F83 HydrophobicContact CB-CD2 4.21Å; L55-F83 HydrophobicContact CB-CE2 4.27Å; L55-F83 HydrophobicContact CD1-CE2 4.36Å
56	L	90.8	Very high	87.2	Confident	35 Å²	35	52.8 Å²	52.8	18%	0.183	27%	0.271	C	S	.	.	H	α-helix	trans	-62.9	-37.7	176.6	-73.8	167.4	0	0	0	112.5	F52 N54 L59 W60 F487 I490	F52-L56 WeakPolarHBondContact O-CB 3.44Å; F52-L56 WeakPolarHBondContact O-CD1 3.47Å; F52-L56 WeakPolarHBondContact O-CG 3.34Å; F52-L56 PolarHBondContact O-N 2.96Å; N54-L56 VanDerWaalsContact C-N 3.31Å; N54-L56 PolarHBondContact O-N 3.4Å; L56-L59 PolarHBondContact O-N 3Å; L56-W60 WeakPolarHBondContact O-CB 3.42Å; L56-W60 PolarHBondContact O-N 3.21Å; L56-F487 HydrophobicContact CD1-CD2 4.02Å; L56-F487 HydrophobicContact CD1-CE2 3.69Å; L56-I490 HydrophobicContact CD2-CG2 4.2Å
57	I	89.5	Confident	85.5	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-60.2	-47.2	172.8	-69	164.9	0	0	0	110.9	G53 N54 L55 W60 I61 I75 A79 P473 Y476 Y483	G53-I57 WeakPolarHBondContact O-CG1 2.9Å; G53-I57 PolarHBondContact O-N 3.27Å; N54-I57 WeakPolarHBondContact O-CB 2.98Å; N54-I57 PolarHBondContact O-N 2.92Å; L55-I57 VanDerWaalsContact C-N 3.34Å; L55-I57 PolarHBondContact O-N 3.33Å; I57-W60 PolarHBondContact O-N 3.35Å; I57-I61 HydrophobicContact CG2-CD1 3.84Å; I57-I61 WeakPolarHBondContact O-CG1 3.18Å; I57-I61 PolarHBondContact O-N 3.06Å; I57-I61 VanDerWaalsContact O-N 3.08Å; I57-I75 HydrophobicContact CG2-CG2 3.92Å; I57-A79 HydrophobicContact CB-CB 4.09Å; I57-A79 HydrophobicContact CG2-CB 3.79Å; I57-P473 HydrophobicContact CD1-CB 4.21Å; I57-P473 HydrophobicContact CD1-CG 4.15Å; I57-Y476 HydrophobicContact CD1-CD2 4.39Å; I57-Y483 HydrophobicContact CB-CE2 4.49Å; I57-Y483 HydrophobicContact CG1-CE2 3.83Å
58	I	91.3	Very high	83.9	Confident	46 Å²	46	62.8 Å²	62.8	24%	0.236	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-48.8	179.6	-64.5	165	0	0	0	110.2	N54 L55 W60 I61 A62 A79 L80 F83	N54-I58 WeakPolarHBondContact O-CG1 3.49Å; N54-I58 PolarHBondContact O-N 3.33Å; L55-I58 PolarHBondContact O-N 3.19Å; I58-W60 PolarHBondContact O-N 2.72Å; I58-I61 PolarHBondContact O-N 3.42Å; I58-A62 VanDerWaalsContact O-CB 3.3Å; I58-A62 WeakPolarHBondContact O-CB 3.34Å; I58-A62 PolarHBondContact O-N 3.12Å; I58-A79 HydrophobicContact CD1-CB 4.45Å; I58-A79 HydrophobicContact CG1-CB 3.98Å; I58-L80 HydrophobicContact CD1-CB 4.43Å; I58-L80 HydrophobicContact CD1-CD1 4.48Å; I58-F83 HydrophobicContact CD1-CB 4.3Å
59	L	89.7	Confident	83	Confident	74 Å²	74	63.1 Å²	63.1	39%	0.387	31%	0.313	S	S	.	.	H	α-helix	trans	-62.8	-40	179	-68	176.4	0	0	0	112.2	L55 L56 A62 T63	L55-L59 HydrophobicContact CD1-CD1 4.37Å; L55-L59 HydrophobicContact CD1-CG 4.31Å; L55-L59 HydrophobicContact CG-CD1 4.06Å; L55-L59 HydrophobicContact CG-CG 4.41Å; L55-L59 VanDerWaalsContact O-CG 3.3Å; L55-L59 WeakPolarHBondContact O-CG 3.5Å; L55-L59 PolarHBondContact O-N 3.13Å; L56-L59 PolarHBondContact O-N 3Å; L59-A62 PolarHBondContact O-N 3.4Å; L59-T63 WeakPolarHBondContact O-CB 3.4Å; L59-T63 VanDerWaalsContact O-CG2 3.28Å; L59-T63 WeakPolarHBondContact O-CG2 3.43Å; L59-T63 PolarHBondContact O-N 2.92Å; L59-T63 PolarHBondContact O-OG1 3.44Å
60	W	84.4	Confident	82.5	Confident	18 Å²	18	61.8 Å²	61.8	7%	0.068	31%	0.306	C	S	.	.	H	α-helix	trans	-59.8	-47.4	176	171.6	57.4	0	0	0	112.2	L56 I57 I58 A62 T63 R64 E482 Y483 A486 I490	L56-W60 WeakPolarHBondContact O-CB 3.42Å; L56-W60 PolarHBondContact O-N 3.21Å; I57-W60 PolarHBondContact O-N 3.35Å; I58-W60 PolarHBondContact O-N 2.72Å; W60-A62 VanDerWaalsContact C-N 3.31Å; W60-A62 PolarHBondContact O-N 3.37Å; W60-T63 PolarHBondContact O-N 3.43Å; W60-T63 PolarHBondContact O-OG1 3.01Å; W60-R64 PolarHBondContact O-N 3.39Å; W60-E482 HydrophobicContact CZ2-CB 4.45Å; W60-Y483 HydrophobicContact CB-CD2 4.29Å; W60-Y483 HydrophobicContact CB-CE2 4.11Å; W60-Y483 AromaticContact CD2-CD2 3.57Å; W60-Y483 HydrophobicContact CD2-CD2 3.57Å; W60-Y483 HydrophobicContact CD2-CE2 4.22Å; W60-Y483 HydrophobicContact CD2-CG 4.47Å; W60-Y483 AromaticContact CE3-CD2 3.59Å; W60-Y483 HydrophobicContact CE3-CD2 3.59Å; W60-Y483 HydrophobicContact CE3-CE2 4.18Å; W60-Y483 AromaticContact CG-CD2 3.86Å; W60-Y483 HydrophobicContact CG-CD2 3.86Å; W60-Y483 HydrophobicContact CG-CE2 4.18Å; W60-Y483 HydrophobicContact CZ3-CD2 4.23Å; W60-A486 HydrophobicContact CG-CB 4.19Å; W60-I490 HydrophobicContact CB-CD1 4.34Å
61	I	85.4	Confident	82.2	Confident	10 Å²	10	62.6 Å²	62.6	5%	0.051	31%	0.311	C	S	.	.	H	α-helix	trans	-69.7	-33.4	179	-63	169.2	0	0	0	110.7	I57 I58 K68 D72 I75 A76	I57-I61 HydrophobicContact CG2-CD1 3.84Å; I57-I61 WeakPolarHBondContact O-CG1 3.18Å; I57-I61 PolarHBondContact O-N 3.06Å; I57-I61 VanDerWaalsContact O-N 3.08Å; I58-I61 PolarHBondContact O-N 3.42Å; I61-K68 WeakPolarHBondContact O-CE 3.31Å; I61-K68 PolarHBondContact O-NZ 2.97Å; I61-D72 HydrophobicContact CD1-CB 4.48Å; I61-D72 HydrophobicContact CG2-CB 4.1Å; I61-I75 HydrophobicContact CD1-CB 4.31Å; I61-I75 HydrophobicContact CD1-CG2 4.07Å; I61-A76 HydrophobicContact CD1-CB 3.91Å; I61-A76 HydrophobicContact CG2-CB 4.38Å
62	A	85.6	Confident	81.8	Confident	57 Å²	57	59.6 Å²	59.6	47%	0.471	30%	0.299	S	S	.	.	H	α-helix	trans	-65.2	-43.4	176.9	0	0	0	0	0	112	I58 L59 W60 K68	I58-A62 VanDerWaalsContact O-CB 3.3Å; I58-A62 WeakPolarHBondContact O-CB 3.34Å; I58-A62 PolarHBondContact O-N 3.12Å; L59-A62 PolarHBondContact O-N 3.4Å; W60-A62 VanDerWaalsContact C-N 3.31Å; W60-A62 PolarHBondContact O-N 3.37Å; A62-K68 PolarHBondContact O-NZ 3.49Å
63	T	83.4	Confident	81.7	Confident	79 Å²	79	55.7 Å²	55.7	49%	0.485	28%	0.283	S	S	.	.	H	α-helix	trans	-83.3	-17	-173.9	52.3	0	0	0	0	114.7	L59 W60 N65	L59-T63 WeakPolarHBondContact O-CB 3.4Å; L59-T63 VanDerWaalsContact O-CG2 3.28Å; L59-T63 WeakPolarHBondContact O-CG2 3.43Å; L59-T63 PolarHBondContact O-N 2.92Å; L59-T63 PolarHBondContact O-OG1 3.44Å; W60-T63 PolarHBondContact O-N 3.43Å; W60-T63 PolarHBondContact O-OG1 3.01Å; T63-N65 PolarHBondContact O-N 3.39Å; T63-N65 VanDerWaalsContact O-N 3.08Å
64	R	76.8	Confident	81.8	Confident	52 Å²	52	55.1 Å²	55.1	20%	0.196	28%	0.277	C	S	.	.			trans	-69.3	107.6	178.2	-168.6	177.7	-172.9	171.9	6.3	111.3	W60 R66 E482	W60-R64 PolarHBondContact O-N 3.39Å; R64-R66 HydrophobicContact CG-CB 4.13Å; R64-R66 PolarHBondContact O-N 2.9Å; R64-E482 IonicContact CZ-OE2 2.83Å; R64-E482 VanDerWaalsContact CZ-OE2 3.23Å; R64-E482 IonicContact NH1-OE2 3.33Å; R64-E482 PolarHBondContact NH1-OE2 2.78Å; R64-E482 VanDerWaalsContact NH2-CD 3.28Å; R64-E482 IonicContact NH2-OE1 3.47Å; R64-E482 PolarHBondContact NH2-OE1 3.46Å; R64-E482 IonicContact NH2-OE2 2.79Å; R64-E482 PolarHBondContact NH2-OE2 2.94Å
65	N	59.5	Low	81.7	Confident	167 Å²	167	56 Å²	56	89%	0.893	28%	0.281	S	S	*	.			trans	-68.1	-16.6	175.3	-73.9	-12.3	0	0	0	114.5	T63 L67	T63-N65 PolarHBondContact O-N 3.39Å; T63-N65 VanDerWaalsContact O-N 3.08Å; N65-L67 PolarHBondContact O-N 3.03Å
66	R	57.8	Low	81.7	Confident	144 Å²	144	54.8 Å²	54.8	54%	0.543	28%	0.279	S	S	.	.	S	Bend	trans	-75.2	126.5	179.3	-168.4	175.4	-179.9	131.2	-0.4	109.2	R64 K68 S364	R64-R66 HydrophobicContact CG-CB 4.13Å; R64-R66 PolarHBondContact O-N 2.9Å; R66-K68 PolarHBondContact O-N 2.88Å; R66-S364 PolarHBondContact NH2-O 2.63Å
67	L	56	Low	81.9	Confident	160 Å²	160	53.6 Å²	53.6	84%	0.838	27%	0.273	S	S	*	.			trans	-10.5	90.5	166.7	-77.7	152.5	0	0	0	111.9	N65 R69	N65-L67 PolarHBondContact O-N 3.03Å; L67-R69 PolarHBondContact O-N 3.25Å; L67-R69 VanDerWaalsContact O-N 3.12Å
68	K	61.3	Low	82.2	Confident	81 Å²	81	53.6 Å²	53.6	35%	0.352	27%	0.273	S	S	.	.			trans	-53.4	120.9	-174.4	-64.3	-175.9	-178.2	-169.9	0	108.1	I61 A62 R66	I61-K68 WeakPolarHBondContact O-CE 3.31Å; I61-K68 PolarHBondContact O-NZ 2.97Å; A62-K68 PolarHBondContact O-NZ 3.49Å; R66-K68 PolarHBondContact O-N 2.88Å
69	R	75.5	Confident	82.4	Confident	99 Å²	99	51.6 Å²	51.6	37%	0.374	26%	0.263	S	S	.	.			trans	-67.6	148.6	179.2	-62.3	173.6	-62.7	-175.7	4.8	107.7	L67 C71 D72	L67-R69 PolarHBondContact O-N 3.25Å; L67-R69 VanDerWaalsContact O-N 3.12Å; R69-C71 PolarHBondContact O-N 3.01Å; R69-D72 WeakPolarHBondContact CB-OD2 3.3Å; R69-D72 IonicContact CZ-OD1 2.93Å; R69-D72 PolarHBondContact N-OD2 2.88Å; R69-D72 IonicContact NE-OD1 3.49Å; R69-D72 PolarHBondContact NE-OD1 3.25Å; R69-D72 IonicContact NE-OD2 3.59Å; R69-D72 PolarHBondContact NE-OD2 3.48Å; R69-D72 IonicContact NH2-OD1 3.38Å; R69-D72 PolarHBondContact NH2-OD1 2.9Å; R69-D72 WeakPolarHBondContact O-CB 2.97Å; R69-D72 PolarHBondContact O-N 2.98Å
70	I	83.9	Confident	82.8	Confident	30 Å²	30	51.5 Å²	51.5	15%	0.154	26%	0.263	C	S	.	.	H	α-helix	trans	-58.7	-38.4	-178.6	-63.4	179.8	0	0	0	110.9	D72 L73 Y74 Q149 S154	I70-D72 VanDerWaalsContact C-N 3.25Å; I70-D72 PolarHBondContact O-N 3.02Å; I70-L73 WeakPolarHBondContact O-CB 3.44Å; I70-L73 PolarHBondContact O-N 2.91Å; I70-L73 VanDerWaalsContact O-N 3.11Å; I70-Y74 HydrophobicContact CG2-CE2 4.31Å; I70-Q149 HydrophobicContact CD1-CB 3.9Å; I70-Q149 HydrophobicContact CD1-CG 3.41Å; I70-Q149 VanDerWaalsContact CD1-CG 3.41Å; I70-Q149 VanDerWaalsContact CD1-O 3.3Å; I70-Q149 WeakPolarHBondContact CD1-O 3.47Å; I70-Q149 HydrophobicContact CG2-CG 4.03Å; I70-S154 WeakPolarHBondContact CG2-OG 3.26Å
71	C	86.8	Confident	83.4	Confident	19 Å²	19	50.6 Å²	50.6	13%	0.128	26%	0.259	C	S	.	.	H	α-helix	trans	-56.3	-35	173.1	-170.5	0	0	0	0	113.7	R69 L73 Y74 I75	R69-C71 PolarHBondContact O-N 3.01Å; C71-L73 PolarHBondContact O-N 2.61Å; C71-Y74 PolarHBondContact O-N 3.36Å; C71-I75 PolarHBondContact O-N 3Å
72	D	87.4	Confident	83.9	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-66.2	-24.2	-178.6	-52.7	-34.4	0	0	0	111.1	I61 R69 I70 A76	I61-D72 HydrophobicContact CD1-CB 4.48Å; I61-D72 HydrophobicContact CG2-CB 4.1Å; R69-D72 WeakPolarHBondContact CB-OD2 3.3Å; R69-D72 IonicContact CZ-OD1 2.93Å; R69-D72 PolarHBondContact N-OD2 2.88Å; R69-D72 IonicContact NE-OD1 3.49Å; R69-D72 PolarHBondContact NE-OD1 3.25Å; R69-D72 IonicContact NE-OD2 3.59Å; R69-D72 PolarHBondContact NE-OD2 3.48Å; R69-D72 IonicContact NH2-OD1 3.38Å; R69-D72 PolarHBondContact NH2-OD1 2.9Å; R69-D72 WeakPolarHBondContact O-CB 2.97Å; R69-D72 PolarHBondContact O-N 2.98Å; I70-D72 VanDerWaalsContact C-N 3.25Å; I70-D72 PolarHBondContact O-N 3.02Å; D72-A76 WeakPolarHBondContact O-CB 3.04Å; D72-A76 PolarHBondContact O-N 3.12Å
73	L	91.6	Very high	84.5	Confident	31 Å²	31	49.2 Å²	49.2	16%	0.162	24%	0.242	C	C	.	.	H	α-helix	trans	-67.7	-42	174.9	-63.7	176.8	0	0	0	112.4	I70 C71 A76 S77 I158	I70-L73 WeakPolarHBondContact O-CB 3.44Å; I70-L73 PolarHBondContact O-N 2.91Å; I70-L73 VanDerWaalsContact O-N 3.11Å; C71-L73 PolarHBondContact O-N 2.61Å; L73-A76 PolarHBondContact O-N 3.5Å; L73-S77 WeakPolarHBondContact O-CB 3.37Å; L73-S77 PolarHBondContact O-N 3.15Å; L73-I158 HydrophobicContact CB-CD1 4.08Å
74	Y	94	Very high	85.1	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-67.6	-40.1	177.8	-60.7	-69.2	0	0	0	111.3	I70 C71 A76 S77 L78 C130 I131 D134 S154 M157 I158	I70-Y74 HydrophobicContact CG2-CE2 4.31Å; C71-Y74 PolarHBondContact O-N 3.36Å; Y74-A76 VanDerWaalsContact C-N 3.34Å; Y74-S77 PolarHBondContact O-N 3.03Å; Y74-L78 WeakPolarHBondContact O-CB 3.39Å; Y74-L78 PolarHBondContact O-N 3.35Å; Y74-C130 HydrophobicContact CD1-CB 3.63Å; Y74-C130 HydrophobicContact CE1-CB 3.69Å; Y74-I131 HydrophobicContact CG-CG1 4.31Å; Y74-D134 HydrophobicContact CD2-CB 4.23Å; Y74-D134 HydrophobicContact CE2-CB 3.65Å; Y74-S154 VanDerWaalsContact OH-CA 3.28Å; Y74-S154 WeakPolarHBondContact OH-CA 3.42Å; Y74-S154 VanDerWaalsContact OH-CB 3.28Å; Y74-S154 WeakPolarHBondContact OH-CB 3.39Å; Y74-S154 PolarHBondContact OH-OG 2.98Å; Y74-M157 HydrophobicContact CE1-CB 4.06Å; Y74-M157 HydrophobicContact CE1-CE 4.31Å; Y74-M157 HydrophobicContact CE1-SD 4.45Å; Y74-M157 PolarHBondContact OH-SD 3.2Å; Y74-I158 HydrophobicContact CD1-CD1 4Å; Y74-I158 HydrophobicContact CD1-CG1 3.72Å; Y74-I158 HydrophobicContact CE1-CD1 4.36Å; Y74-I158 HydrophobicContact CE1-CG1 3.98Å
75	I	92.3	Very high	86.1	Confident	20 Å²	20	44.7 Å²	44.7	10%	0.103	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-41.6	176	-63	171.7	0	0	0	110.5	I57 I61 C71 L78 A79 Y476	I57-I75 HydrophobicContact CG2-CG2 3.92Å; I61-I75 HydrophobicContact CD1-CB 4.31Å; I61-I75 HydrophobicContact CD1-CG2 4.07Å; C71-I75 PolarHBondContact O-N 3Å; I75-L78 PolarHBondContact O-N 3.36Å; I75-A79 WeakPolarHBondContact O-CB 3.46Å; I75-A79 PolarHBondContact O-N 3.38Å; I75-Y476 HydrophobicContact CD1-CD1 4.17Å; I75-Y476 HydrophobicContact CD1-CE1 4.26Å; I75-Y476 HydrophobicContact CG1-CD1 4.46Å; I75-Y476 HydrophobicContact CG1-CE1 4.22Å; I75-Y476 HydrophobicContact CG2-CD1 4.39Å; I75-Y476 HydrophobicContact CG2-CD2 4.24Å; I75-Y476 HydrophobicContact CG2-CG 4.18Å
76	A	92.8	Very high	87.9	Confident	24 Å²	24	37 Å²	37	20%	0.198	18%	0.178	C	C	.	.	H	α-helix	trans	-63.8	-41.1	175.7	0	0	0	0	0	112.4	I61 D72 L73 Y74 A79 L80	I61-A76 HydrophobicContact CD1-CB 3.91Å; I61-A76 HydrophobicContact CG2-CB 4.38Å; D72-A76 WeakPolarHBondContact O-CB 3.04Å; D72-A76 PolarHBondContact O-N 3.12Å; L73-A76 PolarHBondContact O-N 3.5Å; Y74-A76 VanDerWaalsContact C-N 3.34Å; A76-A79 PolarHBondContact O-N 2.02Å; A76-L80 WeakPolarHBondContact O-CB 3.28Å; A76-L80 PolarHBondContact O-N 3.25Å
77	S	96.1	Very high	89.8	Confident	10 Å²	10	32.5 Å²	32.5	7%	0.07	17%	0.166	C	C	.	.	H	α-helix	trans	-65.1	-42	176.6	-179.9	0	0	0	0	112.2	L73 Y74 L80 A81 N127 I158 W162	L73-S77 WeakPolarHBondContact O-CB 3.37Å; L73-S77 PolarHBondContact O-N 3.15Å; Y74-S77 PolarHBondContact O-N 3.03Å; S77-L80 WeakPolarHBondContact O-CB 3.2Å; S77-L80 PolarHBondContact O-N 3.41Å; S77-A81 PolarHBondContact O-N 2.75Å; S77-A81 VanDerWaalsContact O-N 3.12Å; S77-N127 WeakPolarHBondContact CB-OD1 3.37Å; S77-N127 VanDerWaalsContact OG-CG 3.3Å; S77-N127 PolarHBondContact OG-ND2 3.38Å; S77-N127 PolarHBondContact OG-OD1 3.2Å; S77-I158 WeakPolarHBondContact OG-CG2 3.37Å; S77-W162 PolarHBondContact OG-NE1 3.4Å
78	L	95.7	Very high	91.8	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-60.6	-50.5	173	179.9	65.9	0	0	0	111.6	Y74 I75 L80 A81 D82 S124 N127 L128 I131 Y476	Y74-L78 WeakPolarHBondContact O-CB 3.39Å; Y74-L78 PolarHBondContact O-N 3.35Å; I75-L78 PolarHBondContact O-N 3.36Å; L78-L80 PolarHBondContact O-N 3.24Å; L78-A81 WeakPolarHBondContact O-CB 3.3Å; L78-A81 PolarHBondContact O-N 2.86Å; L78-A81 VanDerWaalsContact O-N 3.1Å; L78-D82 PolarHBondContact O-N 3.49Å; L78-D82 VanDerWaalsContact O-N 3.09Å; L78-S124 VanDerWaalsContact CD1-O 3.24Å; L78-S124 WeakPolarHBondContact CD1-O 3.36Å; L78-S124 WeakPolarHBondContact CD1-OG 3.33Å; L78-N127 HydrophobicContact CB-CB 4.14Å; L78-N127 HydrophobicContact CD1-CB 4.12Å; L78-L128 HydrophobicContact CD1-CD2 4.21Å; L78-L128 HydrophobicContact CD1-CG 4.22Å; L78-L128 HydrophobicContact CD2-CD2 3.7Å; L78-I131 HydrophobicContact CD2-CD1 4.01Å; L78-Y476 HydrophobicContact CD2-CE2 3.76Å; L78-Y476 VanDerWaalsContact CD2-OH 3.27Å; L78-Y476 WeakPolarHBondContact CD2-OH 3.39Å
79	A	95.1	Very high	93.5	Very high	3 Å²	3	24.9 Å²	24.9	3%	0.025	13%	0.127	C	C	.	.	H	α-helix	trans	-60.9	-33.6	177.9	0	0	0	0	0	112.2	N54 I57 I58 I75 A76 F83	N54-A79 HydrophobicContact CB-CB 4.28Å; N54-A79 WeakPolarHBondContact CB-O 3.11Å; I57-A79 HydrophobicContact CB-CB 4.09Å; I57-A79 HydrophobicContact CG2-CB 3.79Å; I58-A79 HydrophobicContact CD1-CB 4.45Å; I58-A79 HydrophobicContact CG1-CB 3.98Å; I75-A79 WeakPolarHBondContact O-CB 3.46Å; I75-A79 PolarHBondContact O-N 3.38Å; A76-A79 PolarHBondContact O-N 2.02Å; A79-F83 WeakPolarHBondContact O-CB 3.02Å; A79-F83 PolarHBondContact O-N 2.91Å
80	L	97.1	Very high	94.5	Very high	72 Å²	72	20.3 Å²	20.3	38%	0.377	11%	0.11	S	C	.	.	H	α-helix	trans	-64.4	-45.4	174	180	62.4	0	0	0	111.5	I58 A76 S77 L78 D82 F83 L84 W162	I58-L80 HydrophobicContact CD1-CB 4.43Å; I58-L80 HydrophobicContact CD1-CD1 4.48Å; A76-L80 WeakPolarHBondContact O-CB 3.28Å; A76-L80 PolarHBondContact O-N 3.25Å; S77-L80 WeakPolarHBondContact O-CB 3.2Å; S77-L80 PolarHBondContact O-N 3.41Å; L78-L80 PolarHBondContact O-N 3.24Å; L80-D82 PolarHBondContact O-N 3.47Å; L80-F83 HydrophobicContact CD1-CD1 4.48Å; L80-F83 PolarHBondContact O-N 3.27Å; L80-L84 HydrophobicContact CD1-CD1 4.25Å; L80-L84 HydrophobicContact CD1-CG 4.18Å; L80-L84 HydrophobicContact CG-CD1 4.26Å; L80-L84 WeakPolarHBondContact O-CB 3.4Å; L80-L84 VanDerWaalsContact O-CG 3.23Å; L80-L84 WeakPolarHBondContact O-CG 3.41Å; L80-L84 PolarHBondContact O-N 3.23Å; L80-W162 HydrophobicContact CB-CZ2 4.35Å; L80-W162 HydrophobicContact CD2-CH2 4.26Å; L80-W162 HydrophobicContact CD2-CZ2 4.03Å; L80-W162 HydrophobicContact CG-CH2 4.14Å; L80-W162 HydrophobicContact CG-CZ2 4.16Å
81	A	97.5	Very high	95.1	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.1	-48.8	176.4	0	0	0	0	0	111.4	S77 L78 F83 L84 V85 W162	S77-A81 PolarHBondContact O-N 2.75Å; S77-A81 VanDerWaalsContact O-N 3.12Å; L78-A81 WeakPolarHBondContact O-CB 3.3Å; L78-A81 PolarHBondContact O-N 2.86Å; L78-A81 VanDerWaalsContact O-N 3.1Å; A81-F83 PolarHBondContact O-N 3.18Å; A81-L84 PolarHBondContact O-N 3.46Å; A81-V85 WeakPolarHBondContact O-CG2 3.33Å; A81-V85 PolarHBondContact O-N 3.33Å; A81-W162 HydrophobicContact CB-CH2 4.03Å; A81-W162 HydrophobicContact CB-CZ2 4.16Å
82	D	96.4	Very high	95.5	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.4	-38.1	180	-68	-31.5	0	0	0	113.1	I50 L78 L80 L84 V85 S86 S124 S469 N472	I50-D82 WeakPolarHBondContact CG2-O 3.39Å; L78-D82 PolarHBondContact O-N 3.49Å; L78-D82 VanDerWaalsContact O-N 3.09Å; L80-D82 PolarHBondContact O-N 3.47Å; D82-L84 VanDerWaalsContact C-N 3.34Å; D82-V85 WeakPolarHBondContact O-CB 3.45Å; D82-V85 PolarHBondContact O-N 3.2Å; D82-S86 PolarHBondContact O-N 3.31Å; D82-S124 PolarHBondContact OD1-OG 2.88Å; D82-S469 WeakPolarHBondContact OD1-CB 3.02Å; D82-S469 PolarHBondContact OD1-OG 3.29Å; D82-N472 PolarHBondContact OD2-ND2 3.37Å
83	F	96.8	Very high	95.8	Very high	38 Å²	38	22.3 Å²	22.3	17%	0.167	12%	0.121	C	C	.	.	H	α-helix	trans	-59.2	-46.8	172	168.9	-100.5	0	0	0	110.8	F51 N54 L55 I58 A79 L80 A81 V85 S86 V87	F51-F83 HydrophobicContact CD2-CD2 4.11Å; F51-F83 AromaticContact CD2-CE2 3.59Å; F51-F83 HydrophobicContact CD2-CE2 3.59Å; F51-F83 HydrophobicContact CD2-CZ 4.41Å; F51-F83 HydrophobicContact CE1-CE2 4.44Å; F51-F83 HydrophobicContact CE2-CD2 4.29Å; F51-F83 AromaticContact CE2-CE2 3.34Å; F51-F83 HydrophobicContact CE2-CE2 3.34Å; F51-F83 AromaticContact CE2-CZ 3.83Å; F51-F83 HydrophobicContact CE2-CZ 3.83Å; F51-F83 HydrophobicContact CG-CE2 4.27Å; F51-F83 AromaticContact CZ-CE2 3.8Å; F51-F83 HydrophobicContact CZ-CE2 3.8Å; F51-F83 HydrophobicContact CZ-CZ 4.33Å; N54-F83 HydrophobicContact CB-CB 4.05Å; L55-F83 HydrophobicContact CB-CD2 4.21Å; L55-F83 HydrophobicContact CB-CE2 4.27Å; L55-F83 HydrophobicContact CD1-CE2 4.36Å; I58-F83 HydrophobicContact CD1-CB 4.3Å; A79-F83 WeakPolarHBondContact O-CB 3.02Å; A79-F83 PolarHBondContact O-N 2.91Å; L80-F83 HydrophobicContact CD1-CD1 4.48Å; L80-F83 PolarHBondContact O-N 3.27Å; A81-F83 PolarHBondContact O-N 3.18Å; F83-V85 VanDerWaalsContact C-N 3.31Å; F83-V85 PolarHBondContact O-N 3Å; F83-S86 PolarHBondContact O-N 2.97Å; F83-S86 VanDerWaalsContact O-N 3.1Å; F83-S86 PolarHBondContact O-OG 3.08Å; F83-V87 HydrophobicContact CE1-CG2 4.08Å; F83-V87 HydrophobicContact CE2-CG2 4.24Å; F83-V87 HydrophobicContact CZ-CG2 3.9Å; F83-V87 PolarHBondContact O-N 3.12Å
84	L	98	Very high	96	Very high	36 Å²	36	21.8 Å²	21.8	19%	0.188	12%	0.118	C	C	.	.	H	α-helix	trans	-66.3	-30.9	179.4	-68.1	-179	0	0	0	112.7	L80 A81 D82 S86 V87 F88 L120 W162	L80-L84 HydrophobicContact CD1-CD1 4.25Å; L80-L84 HydrophobicContact CD1-CG 4.18Å; L80-L84 HydrophobicContact CG-CD1 4.26Å; L80-L84 WeakPolarHBondContact O-CB 3.4Å; L80-L84 VanDerWaalsContact O-CG 3.23Å; L80-L84 WeakPolarHBondContact O-CG 3.41Å; L80-L84 PolarHBondContact O-N 3.23Å; A81-L84 PolarHBondContact O-N 3.46Å; D82-L84 VanDerWaalsContact C-N 3.34Å; L84-S86 VanDerWaalsContact C-N 3.3Å; L84-S86 PolarHBondContact O-N 3.37Å; L84-V87 PolarHBondContact O-N 3.47Å; L84-V87 VanDerWaalsContact O-N 3.16Å; L84-F88 HydrophobicContact CB-CD2 4.3Å; L84-F88 HydrophobicContact CD2-CD2 4.17Å; L84-F88 HydrophobicContact CD2-CE2 3.79Å; L84-F88 PolarHBondContact O-N 2.79Å; L84-L120 HydrophobicContact CB-CD1 3.8Å; L84-L120 HydrophobicContact CB-CD2 3.65Å; L84-L120 HydrophobicContact CB-CG 4.36Å; L84-L120 HydrophobicContact CD1-CD2 3.9Å; L84-L120 HydrophobicContact CG-CD2 4.45Å; L84-W162 HydrophobicContact CD1-CH2 4.18Å; L84-W162 HydrophobicContact CD1-CZ3 4.44Å
85	V	97.4	Very high	95.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58	-44.9	170.7	170.4	0	0	0	0	110.1	A81 D82 F83 V87 V89 L90 L120 Y466	A81-V85 WeakPolarHBondContact O-CG2 3.33Å; A81-V85 PolarHBondContact O-N 3.33Å; D82-V85 WeakPolarHBondContact O-CB 3.45Å; D82-V85 PolarHBondContact O-N 3.2Å; F83-V85 VanDerWaalsContact C-N 3.31Å; F83-V85 PolarHBondContact O-N 3Å; V85-V87 PolarHBondContact O-N 3.32Å; V85-V89 HydrophobicContact CG1-CB 4.13Å; V85-V89 HydrophobicContact CG1-CG2 4.48Å; V85-V89 WeakPolarHBondContact O-CA 3.48Å; V85-V89 WeakPolarHBondContact O-CB 3.41Å; V85-V89 PolarHBondContact O-N 2.86Å; V85-L90 HydrophobicContact CG1-CD1 4.38Å; V85-L90 HydrophobicContact CG1-CD2 4.17Å; V85-L90 HydrophobicContact CG1-CG 4Å; V85-L90 PolarHBondContact O-N 3.26Å; V85-L120 HydrophobicContact CG2-CB 3.58Å; V85-L120 HydrophobicContact CG2-CD1 4.33Å; V85-Y466 HydrophobicContact CG1-CD1 4.39Å
86	S	96.7	Very high	95.9	Very high	4 Å²	4	26 Å²	26	3%	0.028	14%	0.137	C	C	.	.	H	α-helix	trans	-65.8	-23.3	178.4	75.1	0	0	0	0	114.6	F51 D82 F83 L84 P91	F51-S86 WeakPolarHBondContact CA-OG 3.39Å; D82-S86 PolarHBondContact O-N 3.31Å; F83-S86 PolarHBondContact O-N 2.97Å; F83-S86 VanDerWaalsContact O-N 3.1Å; F83-S86 PolarHBondContact O-OG 3.08Å; L84-S86 VanDerWaalsContact C-N 3.3Å; L84-S86 PolarHBondContact O-N 3.37Å; S86-P91 VanDerWaalsContact O-CD 3.31Å; S86-P91 WeakPolarHBondContact O-CD 3.43Å
87	V	97.7	Very high	95.8	Very high	50 Å²	50	25.6 Å²	25.6	30%	0.303	13%	0.131	S	C	.	.	H	α-helix	trans	-90.2	-45.4	-179.9	176.6	0	0	0	0	111.6	F51 F83 L84 V85	F51-V87 HydrophobicContact CD2-CG2 4.01Å; F51-V87 HydrophobicContact CE2-CG2 3.91Å; F83-V87 HydrophobicContact CE1-CG2 4.08Å; F83-V87 HydrophobicContact CE2-CG2 4.24Å; F83-V87 HydrophobicContact CZ-CG2 3.9Å; F83-V87 PolarHBondContact O-N 3.12Å; L84-V87 PolarHBondContact O-N 3.47Å; L84-V87 VanDerWaalsContact O-N 3.16Å; V85-V87 PolarHBondContact O-N 3.32Å
88	F	97.7	Very high	95.5	Very high	82 Å²	82	28.5 Å²	28.5	36%	0.36	15%	0.146	S	C	.	.	H	α-helix	trans	-106.7	-12.7	-168.2	-65.1	-54	0	0	0	115.1	L84 F92 F112 L120	L84-F88 HydrophobicContact CB-CD2 4.3Å; L84-F88 HydrophobicContact CD2-CD2 4.17Å; L84-F88 HydrophobicContact CD2-CE2 3.79Å; L84-F88 PolarHBondContact O-N 2.79Å; F88-F92 VanDerWaalsContact O-CD2 3.26Å; F88-F92 WeakPolarHBondContact O-CD2 2.9Å; F88-F112 HydrophobicContact CB-CE1 4.34Å; F88-F112 HydrophobicContact CB-CZ 4.33Å; F88-F112 HydrophobicContact CD1-CE1 4.14Å; F88-F112 AromaticContact CD1-CZ 3.85Å; F88-F112 HydrophobicContact CD1-CZ 3.85Å; F88-F112 HydrophobicContact CE1-CZ 4.38Å; F88-F112 HydrophobicContact CG-CZ 4.15Å; F88-L120 HydrophobicContact CB-CD1 4.43Å
89	V	97.4	Very high	95.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-56.7	-175.2	-176.6	0	0	0	0	110.5	V85 F92 A93 H113 D117 L120 Y466	V85-V89 HydrophobicContact CG1-CB 4.13Å; V85-V89 HydrophobicContact CG1-CG2 4.48Å; V85-V89 WeakPolarHBondContact O-CA 3.48Å; V85-V89 WeakPolarHBondContact O-CB 3.41Å; V85-V89 PolarHBondContact O-N 2.86Å; V89-F92 PolarHBondContact O-N 3.01Å; V89-A93 PolarHBondContact O-N 3.32Å; V89-H113 PolarHBondContact O-CE1 3.24Å; V89-D117 HydrophobicContact CG1-CB 3.8Å; V89-D117 HydrophobicContact CG2-CB 4.14Å; V89-L120 HydrophobicContact CG2-CD1 4.14Å; V89-Y466 HydrophobicContact CG1-CE1 3.99Å
90	L	96.1	Very high	94.8	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-62.2	-39	-170.6	-59.7	-176.8	0	0	0	114.7	T47 I50 V85 F92 A93 I94 W463 Y466	T47-L90 HydrophobicContact CG2-CB 3.8Å; T47-L90 HydrophobicContact CG2-CD1 3.96Å; T47-L90 WeakPolarHBondContact OG1-CD1 3.22Å; I50-L90 HydrophobicContact CD1-CD1 3.53Å; V85-L90 HydrophobicContact CG1-CD1 4.38Å; V85-L90 HydrophobicContact CG1-CD2 4.17Å; V85-L90 HydrophobicContact CG1-CG 4Å; V85-L90 PolarHBondContact O-N 3.26Å; L90-F92 VanDerWaalsContact C-N 3.35Å; L90-F92 PolarHBondContact O-N 3.35Å; L90-A93 PolarHBondContact O-N 2.81Å; L90-I94 WeakPolarHBondContact O-CB 3.32Å; L90-I94 VanDerWaalsContact O-CG1 3.25Å; L90-I94 WeakPolarHBondContact O-CG1 3.46Å; L90-I94 PolarHBondContact O-N 3.41Å; L90-W463 HydrophobicContact CD2-CZ3 4.13Å; L90-Y466 HydrophobicContact CD2-CD1 4.14Å; L90-Y466 HydrophobicContact CD2-CD2 3.71Å; L90-Y466 HydrophobicContact CD2-CE2 4.1Å; L90-Y466 HydrophobicContact CD2-CG 3.73Å
91	P	96.2	Very high	94.5	Very high	51 Å²	51	31 Å²	31	33%	0.331	16%	0.157	S	C	.	.	H	α-helix	trans	-60.6	-43.4	178.2	-26	36.8	0	0	0	112.6	S86 I94 I95	S86-P91 VanDerWaalsContact O-CD 3.31Å; S86-P91 WeakPolarHBondContact O-CD 3.43Å; P91-I94 PolarHBondContact O-N 3.37Å; P91-I95 VanDerWaalsContact O-CG1 3.26Å; P91-I95 WeakPolarHBondContact O-CG1 3.39Å; P91-I95 PolarHBondContact O-N 3.23Å
92	F	95.2	Very high	94.2	Very high	39 Å²	39	31.1 Å²	31.1	17%	0.171	16%	0.157	C	C	.	.	H	α-helix	trans	-69.1	-40.2	177.7	-61.2	-74.4	0	0	0	111.9	F88 V89 L90 I94 I95 R96 W102 F104 L109	F88-F92 VanDerWaalsContact O-CD2 3.26Å; F88-F92 WeakPolarHBondContact O-CD2 2.9Å; V89-F92 PolarHBondContact O-N 3.01Å; L90-F92 VanDerWaalsContact C-N 3.35Å; L90-F92 PolarHBondContact O-N 3.35Å; F92-I94 VanDerWaalsContact C-N 3.35Å; F92-I94 PolarHBondContact O-N 3.11Å; F92-I95 PolarHBondContact O-N 3.39Å; F92-R96 WeakPolarHBondContact O-CB 3.15Å; F92-R96 PolarHBondContact O-N 3.36Å; F92-W102 HydrophobicContact CB-CH2 4.2Å; F92-W102 HydrophobicContact CB-CZ3 3.99Å; F92-W102 HydrophobicContact CD1-CH2 4.12Å; F92-W102 HydrophobicContact CG-CH2 4.36Å; F92-F104 AromaticContact CD1-CE2 3.75Å; F92-F104 HydrophobicContact CD1-CE2 3.75Å; F92-F104 AromaticContact CD1-CZ 3.9Å; F92-F104 HydrophobicContact CD1-CZ 3.9Å; F92-F104 HydrophobicContact CE1-CE2 4.39Å; F92-F104 HydrophobicContact CE1-CZ 4.2Å; F92-L109 HydrophobicContact CE1-CD1 3.96Å; F92-L109 HydrophobicContact CE1-CD2 3.96Å; F92-L109 HydrophobicContact CE1-CG 4.17Å; F92-L109 HydrophobicContact CZ-CD1 3.96Å
93	A	94.1	Very high	94	Very high	5 Å²	5	33 Å²	33	4%	0.041	17%	0.17	C	C	.	.	H	α-helix	trans	-63.1	-40	176.4	0	0	0	0	0	112	V89 L90 R96 Q97 W463 Y466	V89-A93 PolarHBondContact O-N 3.32Å; L90-A93 PolarHBondContact O-N 2.81Å; A93-R96 PolarHBondContact O-N 3.02Å; A93-Q97 WeakPolarHBondContact O-CB 3.33Å; A93-Q97 PolarHBondContact O-N 3.49Å; A93-W463 HydrophobicContact CB-CH2 3.49Å; A93-W463 VanDerWaalsContact CB-CH2 3.49Å; A93-W463 HydrophobicContact CB-CZ2 4.01Å; A93-W463 HydrophobicContact CB-CZ3 4.31Å; A93-Y466 HydrophobicContact CB-CE2 4.43Å
94	I	94.8	Very high	93.8	Very high	20 Å²	20	33.9 Å²	33.9	10%	0.103	17%	0.173	C	C	.	.	H	α-helix	trans	-66.4	-43.2	175.9	-72.3	167.6	0	0	0	111.3	T40 L43 T44 T47 L90 P91 F92 R96 Q97 N98 W463	T40-I94 HydrophobicContact CG2-CG2 4.08Å; L43-I94 HydrophobicContact CB-CD1 4.4Å; L43-I94 HydrophobicContact CB-CG1 4.16Å; T44-I94 HydrophobicContact CG2-CD1 3.99Å; T44-I94 HydrophobicContact CG2-CG2 3.82Å; T47-I94 VanDerWaalsContact OG1-CD1 3.32Å; T47-I94 WeakPolarHBondContact OG1-CD1 3.44Å; L90-I94 WeakPolarHBondContact O-CB 3.32Å; L90-I94 VanDerWaalsContact O-CG1 3.25Å; L90-I94 WeakPolarHBondContact O-CG1 3.46Å; L90-I94 PolarHBondContact O-N 3.41Å; P91-I94 PolarHBondContact O-N 3.37Å; F92-I94 VanDerWaalsContact C-N 3.35Å; F92-I94 PolarHBondContact O-N 3.11Å; I94-R96 VanDerWaalsContact C-N 3.34Å; I94-R96 PolarHBondContact O-N 3.02Å; I94-Q97 WeakPolarHBondContact O-CB 3.43Å; I94-Q97 PolarHBondContact O-N 3.08Å; I94-N98 WeakPolarHBondContact O-CB 3.31Å; I94-N98 PolarHBondContact O-N 3.3Å; I94-W463 HydrophobicContact CG1-CH2 3.99Å
95	I	93.7	Very high	93.4	Very high	66 Å²	66	40 Å²	40	34%	0.338	20%	0.201	S	C	.	.	H	α-helix	trans	-60.3	-47	176	-70.8	166.6	0	0	0	110.1	P91 F92 Q97 N98 L99 P103 F104	P91-I95 VanDerWaalsContact O-CG1 3.26Å; P91-I95 WeakPolarHBondContact O-CG1 3.39Å; P91-I95 PolarHBondContact O-N 3.23Å; F92-I95 PolarHBondContact O-N 3.39Å; I95-Q97 VanDerWaalsContact C-N 3.35Å; I95-Q97 PolarHBondContact O-N 3.23Å; I95-N98 PolarHBondContact O-N 2.71Å; I95-L99 HydrophobicContact CG2-CD1 3.84Å; I95-L99 WeakPolarHBondContact O-CB 3.2Å; I95-L99 WeakPolarHBondContact O-CG 3.49Å; I95-L99 PolarHBondContact O-N 2.87Å; I95-P103 HydrophobicContact CG2-CG 3.66Å; I95-F104 HydrophobicContact CD1-CZ 3.99Å; I95-F104 HydrophobicContact CG2-CE2 4.18Å; I95-F104 HydrophobicContact CG2-CZ 4.15Å
96	R	91	Very high	93.1	Very high	42 Å²	42	42.6 Å²	42.6	16%	0.158	22%	0.219	C	C	.	.	H	α-helix	trans	-61.6	-41.4	176.8	-168.8	-171.6	73.9	89.7	2	111.8	F92 A93 I94 G100 E455	F92-R96 WeakPolarHBondContact O-CB 3.15Å; F92-R96 PolarHBondContact O-N 3.36Å; A93-R96 PolarHBondContact O-N 3.02Å; I94-R96 VanDerWaalsContact C-N 3.34Å; I94-R96 PolarHBondContact O-N 3.02Å; R96-G100 VanDerWaalsContact O-CA 3.3Å; R96-G100 WeakPolarHBondContact O-CA 3.34Å; R96-G100 PolarHBondContact O-N 3.42Å; R96-E455 IonicContact NH1-OE2 3.87Å
97	Q	90.3	Very high	92.9	Very high	17 Å²	17	45.4 Å²	45.4	8%	0.079	24%	0.236	C	C	.	.	H	α-helix	trans	-59.3	-50.6	175.6	176.2	65.1	62.6	0	0	111.3	N36 L39 L43 A93 I94 I95 L99 G100 W463	N36-Q97 PolarHBondContact OD1-NE2 2.96Å; N36-Q97 PolarHBondContact OD1-O 3.44Å; N36-Q97 VanDerWaalsContact OD1-O 3.05Å; L39-Q97 HydrophobicContact CD2-CG 4.38Å; L43-Q97 HydrophobicContact CD1-CG 4.21Å; A93-Q97 WeakPolarHBondContact O-CB 3.33Å; A93-Q97 PolarHBondContact O-N 3.49Å; I94-Q97 WeakPolarHBondContact O-CB 3.43Å; I94-Q97 PolarHBondContact O-N 3.08Å; I95-Q97 VanDerWaalsContact C-N 3.35Å; I95-Q97 PolarHBondContact O-N 3.23Å; Q97-L99 PolarHBondContact O-N 2.79Å; Q97-G100 PolarHBondContact O-N 2.78Å; Q97-W463 HydrophobicContact CB-CZ2 4.06Å; Q97-W463 HydrophobicContact CG-CZ2 4.5Å
98	N	90.4	Very high	92.7	Very high	71 Å²	71	49 Å²	49	38%	0.38	25%	0.253	S	S	.	.	H	α-helix	trans	-66.3	-39.8	-175.6	-170.3	44.7	0	0	0	112	N36 T40 I94 I95	N36-N98 PolarHBondContact ND2-O 3.49Å; T40-N98 HydrophobicContact CG2-CB 4.18Å; I94-N98 WeakPolarHBondContact O-CB 3.31Å; I94-N98 PolarHBondContact O-N 3.3Å; I95-N98 PolarHBondContact O-N 2.71Å
99	L	89.3	Confident	92.5	Very high	55 Å²	55	47.3 Å²	47.3	29%	0.288	25%	0.248	S	C	.	.	H	α-helix	trans	-87.9	-13.1	-179.4	-63.9	176.5	0	0	0	113.9	I26 I95 Q97 Y101 P103	I26-L99 WeakPolarHBondContact CD1-O 3.25Å; I26-L99 WeakPolarHBondContact CG1-O 3.24Å; I95-L99 HydrophobicContact CG2-CD1 3.84Å; I95-L99 WeakPolarHBondContact O-CB 3.2Å; I95-L99 WeakPolarHBondContact O-CG 3.49Å; I95-L99 PolarHBondContact O-N 2.87Å; Q97-L99 PolarHBondContact O-N 2.79Å; L99-Y101 HydrophobicContact CB-CD1 4.17Å; L99-Y101 HydrophobicContact CB-CE1 3.98Å; L99-Y101 WeakPolarHBondContact O-CD1 3.35Å; L99-Y101 WeakPolarHBondContact O-CE1 3.34Å; L99-Y101 PolarHBondContact O-N 2.96Å; L99-Y101 VanDerWaalsContact O-N 3.1Å; L99-P103 HydrophobicContact CD1-CB 3.6Å; L99-P103 HydrophobicContact CD1-CG 3.66Å
100	G	87.9	Confident	92.4	Very high	9 Å²	9	47.3 Å²	47.3	9%	0.093	25%	0.248	C	C	.	.	S	Bend	trans	60.5	14.2	-177.3	0	0	0	0	0	115.6	F25 R96 Q97	F25-G100 PolarHBondContact N-O 2.82Å; R96-G100 VanDerWaalsContact O-CA 3.3Å; R96-G100 WeakPolarHBondContact O-CA 3.34Å; R96-G100 PolarHBondContact O-N 3.42Å; Q97-G100 PolarHBondContact O-N 2.78Å
101	Y	89.6	Confident	92.4	Very high	64 Å²	64	49.6 Å²	49.6	25%	0.251	26%	0.258	S	S	.	.	S	Bend	trans	-153.2	165.3	171.2	66.2	-87.8	0	0	0	109.5	C23 Y24 L99 P103	C23-Y101 WeakPolarHBondContact O-CB 3.33Å; Y24-Y101 AromaticContact CD1-CD1 3.28Å; Y24-Y101 HydrophobicContact CD1-CD1 3.28Å; Y24-Y101 HydrophobicContact CD1-CD2 4.29Å; Y24-Y101 AromaticContact CD1-CE1 3.89Å; Y24-Y101 HydrophobicContact CD1-CE1 3.89Å; Y24-Y101 AromaticContact CD1-CG 3.56Å; Y24-Y101 HydrophobicContact CD1-CG 3.56Å; Y24-Y101 AromaticContact CE1-CD1 3.32Å; Y24-Y101 HydrophobicContact CE1-CD1 3.32Å; Y24-Y101 AromaticContact CE1-CD2 3.7Å; Y24-Y101 HydrophobicContact CE1-CD2 3.7Å; Y24-Y101 AromaticContact CE1-CE1 3.55Å; Y24-Y101 HydrophobicContact CE1-CE1 3.55Å; Y24-Y101 AromaticContact CE1-CE2 3.87Å; Y24-Y101 HydrophobicContact CE1-CE2 3.87Å; Y24-Y101 AromaticContact CE1-CG 3.43Å; Y24-Y101 HydrophobicContact CE1-CG 3.43Å; Y24-Y101 VanDerWaalsContact CE1-CG 3.43Å; Y24-Y101 AromaticContact CE1-CZ 3.83Å; Y24-Y101 HydrophobicContact CG-CD1 4.27Å; Y24-Y101 HydrophobicContact CG-CG 4.23Å; Y24-Y101 AromaticContact CZ-CD2 3.93Å; L99-Y101 HydrophobicContact CB-CD1 4.17Å; L99-Y101 HydrophobicContact CB-CE1 3.98Å; L99-Y101 WeakPolarHBondContact O-CD1 3.35Å; L99-Y101 WeakPolarHBondContact O-CE1 3.34Å; L99-Y101 PolarHBondContact O-N 2.96Å; L99-Y101 VanDerWaalsContact O-N 3.1Å; Y101-P103 HydrophobicContact CD2-CB 4.35Å; Y101-P103 HydrophobicContact CE2-CB 3.82Å; Y101-P103 VanDerWaalsContact O-CD 3.28Å; Y101-P103 WeakPolarHBondContact O-CD 3.37Å
102	W	92.4	Very high	92.4	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.008	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-80.8	109.6	172.3	179	-101.8	0	0	0	110.5	F92 F104 L109 C110 H113 G184 C186	F92-W102 HydrophobicContact CB-CH2 4.2Å; F92-W102 HydrophobicContact CB-CZ3 3.99Å; F92-W102 HydrophobicContact CD1-CH2 4.12Å; F92-W102 HydrophobicContact CG-CH2 4.36Å; W102-F104 VanDerWaalsContact C-N 3.32Å; W102-F104 AromaticContact CD2-CD2 3.89Å; W102-F104 HydrophobicContact CD2-CD2 3.89Å; W102-F104 AromaticContact CE2-CD2 3.55Å; W102-F104 HydrophobicContact CE3-CD2 4.11Å; W102-F104 AromaticContact CH2-CD2 3.71Å; W102-F104 HydrophobicContact CH2-CD2 3.71Å; W102-F104 HydrophobicContact CH2-CE2 4.1Å; W102-F104 HydrophobicContact CZ2-CB 4.01Å; W102-F104 AromaticContact CZ2-CD2 3.45Å; W102-F104 HydrophobicContact CZ2-CD2 3.45Å; W102-F104 VanDerWaalsContact CZ2-CD2 3.45Å; W102-F104 HydrophobicContact CZ2-CE2 4.29Å; W102-F104 HydrophobicContact CZ2-CG 4.09Å; W102-F104 HydrophobicContact CZ3-CD2 4.04Å; W102-F104 HydrophobicContact CZ3-CE2 4.23Å; W102-F104 PolarHBondContact NE1-O 2.74Å; W102-F104 PolarHBondContact O-N 3Å; W102-L109 HydrophobicContact CH2-CG 4.37Å; W102-L109 HydrophobicContact CZ2-CB 4.22Å; W102-L109 HydrophobicContact CZ2-CD2 4.23Å; W102-L109 HydrophobicContact CZ2-CG 3.97Å; W102-C110 HydrophobicContact CZ2-CB 3.99Å; W102-H113 HydrophobicContact CH2-CB 3.8Å; W102-H113 HydrophobicContact CZ3-CB 4.28Å; W102-H113 AromaticContact CZ3-CD2 3.63Å; W102-G184 PolarHBondContact N-O 3.08Å; W102-G184 VanDerWaalsContact O-CA 3.24Å; W102-G184 WeakPolarHBondContact O-CA 3.17Å; W102-G184 PolarHBondContact O-N 2.79Å; W102-G184 VanDerWaalsContact O-N 3.11Å; W102-C186 HydrophobicContact CB-CB 3.68Å; W102-C186 HydrophobicContact CD2-CB 3.41Å; W102-C186 VanDerWaalsContact CD2-CB 3.41Å; W102-C186 HydrophobicContact CE3-CB 3.72Å; W102-C186 HydrophobicContact CG-CB 3.4Å
103	P	91.6	Very high	92.4	Very high	41 Å²	41	50.1 Å²	50.1	27%	0.266	26%	0.256	S	S	.	.			trans	-84.3	-5.2	-169.8	37.8	-41.4	0	0	0	114.2	I95 L99 Y101	I95-P103 HydrophobicContact CG2-CG 3.66Å; L99-P103 HydrophobicContact CD1-CB 3.6Å; L99-P103 HydrophobicContact CD1-CG 3.66Å; Y101-P103 HydrophobicContact CD2-CB 4.35Å; Y101-P103 HydrophobicContact CE2-CB 3.82Å; Y101-P103 VanDerWaalsContact O-CD 3.28Å; Y101-P103 WeakPolarHBondContact O-CD 3.37Å
104	F	92.7	Very high	92.5	Very high	56 Å²	56	50.4 Å²	50.4	25%	0.246	26%	0.256	C	S	.	.			trans	-95.5	120.3	-174	-48.9	-84.2	0	0	0	110.1	F92 I95 W102 S106 L109	F92-F104 AromaticContact CD1-CE2 3.75Å; F92-F104 HydrophobicContact CD1-CE2 3.75Å; F92-F104 AromaticContact CD1-CZ 3.9Å; F92-F104 HydrophobicContact CD1-CZ 3.9Å; F92-F104 HydrophobicContact CE1-CE2 4.39Å; F92-F104 HydrophobicContact CE1-CZ 4.2Å; I95-F104 HydrophobicContact CD1-CZ 3.99Å; I95-F104 HydrophobicContact CG2-CE2 4.18Å; I95-F104 HydrophobicContact CG2-CZ 4.15Å; W102-F104 VanDerWaalsContact C-N 3.32Å; W102-F104 AromaticContact CD2-CD2 3.89Å; W102-F104 HydrophobicContact CD2-CD2 3.89Å; W102-F104 AromaticContact CE2-CD2 3.55Å; W102-F104 HydrophobicContact CE3-CD2 4.11Å; W102-F104 AromaticContact CH2-CD2 3.71Å; W102-F104 HydrophobicContact CH2-CD2 3.71Å; W102-F104 HydrophobicContact CH2-CE2 4.1Å; W102-F104 HydrophobicContact CZ2-CB 4.01Å; W102-F104 AromaticContact CZ2-CD2 3.45Å; W102-F104 HydrophobicContact CZ2-CD2 3.45Å; W102-F104 VanDerWaalsContact CZ2-CD2 3.45Å; W102-F104 HydrophobicContact CZ2-CE2 4.29Å; W102-F104 HydrophobicContact CZ2-CG 4.09Å; W102-F104 HydrophobicContact CZ3-CD2 4.04Å; W102-F104 HydrophobicContact CZ3-CE2 4.23Å; W102-F104 PolarHBondContact NE1-O 2.74Å; W102-F104 PolarHBondContact O-N 3Å; F104-S106 PolarHBondContact O-N 3.45Å; F104-S106 VanDerWaalsContact O-N 3.12Å; F104-L109 HydrophobicContact CB-CD2 3.74Å; F104-L109 HydrophobicContact CD1-CD2 3.64Å; F104-L109 HydrophobicContact CD2-CD2 4.01Å; F104-L109 HydrophobicContact CE1-CD2 4.2Å; F104-L109 HydrophobicContact CG-CD2 3.53Å
105	E	88.5	Confident	92.6	Very high	163 Å²	163	50 Å²	50	76%	0.762	26%	0.255	S	S	*	.			trans	-65.7	-14.9	177.7	-59.4	179.9	174.8	0	0	113	T107 V183	E105-T107 PolarHBondContact O-N 2.78Å; E105-V183 HydrophobicContact CG-CG2 4.29Å
106	S	92.5	Very high	92.8	Very high	56 Å²	56	47.6 Å²	47.6	39%	0.392	24%	0.244	S	C	.	.			trans	-75.2	108.7	-178.8	179.7	0	0	0	0	112.5	F104 L108 L109 C110	F104-S106 PolarHBondContact O-N 3.45Å; F104-S106 VanDerWaalsContact O-N 3.12Å; S106-L108 PolarHBondContact O-N 2.74Å; S106-L108 PolarHBondContact OG-N 3.08Å; S106-L109 PolarHBondContact O-N 3.13Å; S106-L109 VanDerWaalsContact O-N 3.16Å; S106-L109 PolarHBondContact OG-N 2.65Å; S106-L109 VanDerWaalsContact OG-N 3.12Å; S106-C110 PolarHBondContact O-N 2.91Å
107	T	91.5	Very high	93.1	Very high	62 Å²	62	47 Å²	47	38%	0.38	24%	0.244	S	C	.	.	H	α-helix	trans	-54.3	-40	166.7	-63.8	0	0	0	0	112	E105 L109 C110 Q111 T181	E105-T107 PolarHBondContact O-N 2.78Å; T107-L109 VanDerWaalsContact C-N 3.31Å; T107-L109 PolarHBondContact O-N 2.96Å; T107-C110 PolarHBondContact O-N 3.23Å; T107-Q111 HydrophobicContact CG2-CG 4.44Å; T107-Q111 WeakPolarHBondContact O-CG 3.49Å; T107-Q111 PolarHBondContact O-N 2.91Å; T107-T181 HydrophobicContact CG2-CG2 4.06Å; T107-T181 WeakPolarHBondContact CG2-OG1 3.35Å
108	L	93.3	Very high	93.4	Very high	127 Å²	127	47.4 Å²	47.4	67%	0.665	25%	0.247	S	C	*	.	H	α-helix	trans	-63.1	-39.2	179.3	-177.9	66.1	0	0	0	111.3	S106 Q111 F112	S106-L108 PolarHBondContact O-N 2.74Å; S106-L108 PolarHBondContact OG-N 3.08Å; L108-Q111 PolarHBondContact O-N 3.32Å; L108-F112 VanDerWaalsContact O-CB 3.31Å; L108-F112 WeakPolarHBondContact O-CB 3.4Å; L108-F112 PolarHBondContact O-N 3.45Å
109	L	94.8	Very high	93.7	Very high	46 Å²	46	46.1 Å²	46.1	24%	0.241	24%	0.238	C	C	.	.	H	α-helix	trans	-68.7	-38.1	178.6	-169.5	64.6	0	0	0	111.6	F92 W102 F104 S106 T107 F112 H113	F92-L109 HydrophobicContact CE1-CD1 3.96Å; F92-L109 HydrophobicContact CE1-CD2 3.96Å; F92-L109 HydrophobicContact CE1-CG 4.17Å; F92-L109 HydrophobicContact CZ-CD1 3.96Å; W102-L109 HydrophobicContact CH2-CG 4.37Å; W102-L109 HydrophobicContact CZ2-CB 4.22Å; W102-L109 HydrophobicContact CZ2-CD2 4.23Å; W102-L109 HydrophobicContact CZ2-CG 3.97Å; F104-L109 HydrophobicContact CB-CD2 3.74Å; F104-L109 HydrophobicContact CD1-CD2 3.64Å; F104-L109 HydrophobicContact CD2-CD2 4.01Å; F104-L109 HydrophobicContact CE1-CD2 4.2Å; F104-L109 HydrophobicContact CG-CD2 3.53Å; S106-L109 PolarHBondContact O-N 3.13Å; S106-L109 VanDerWaalsContact O-N 3.16Å; S106-L109 PolarHBondContact OG-N 2.65Å; S106-L109 VanDerWaalsContact OG-N 3.12Å; T107-L109 VanDerWaalsContact C-N 3.31Å; T107-L109 PolarHBondContact O-N 2.96Å; L109-F112 HydrophobicContact CD1-CD1 4.45Å; L109-F112 PolarHBondContact O-N 2.7Å; L109-H113 WeakPolarHBondContact O-CB 3.44Å; L109-H113 PolarHBondContact O-N 2.88Å
110	C	95.4	Very high	94.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.7	-46.3	172.9	174.4	0	0	0	0	111.7	W102 S106 T107 F112 H113 I114 T181 C186	W102-C110 HydrophobicContact CZ2-CB 3.99Å; S106-C110 PolarHBondContact O-N 2.91Å; T107-C110 PolarHBondContact O-N 3.23Å; C110-F112 VanDerWaalsContact C-N 3.32Å; C110-F112 PolarHBondContact O-N 3.34Å; C110-H113 PolarHBondContact O-N 3.06Å; C110-I114 WeakPolarHBondContact O-CG1 3.28Å; C110-I114 PolarHBondContact O-N 2.85Å; C110-T181 HydrophobicContact CB-CG2 4.16Å; C110-C186 WeakPolarHBondContact CA-SG 2.94Å; C110-C186 HydrophobicContact CB-CB 3.91Å; C110-C186 WeakPolarHBondContact CB-SG 3.4Å; C110-C186 WeakPolarHBondContact SG-CA 3.4Å; C110-C186 WeakPolarHBondContact SG-CB 3.5Å; C110-C186 CovalentContact SG-SG 2.04Å; C110-C186 PolarHBondContact SG-SG 3.45Å
111	Q	94.9	Very high	94.5	Very high	50 Å²	50	44 Å²	44	23%	0.234	23%	0.225	C	C	.	.	H	α-helix	trans	-59.9	-42.8	175.8	-73.9	179.4	-19.4	0	0	111.7	T107 L108 S115 T181	T107-Q111 HydrophobicContact CG2-CG 4.44Å; T107-Q111 WeakPolarHBondContact O-CG 3.49Å; T107-Q111 PolarHBondContact O-N 2.91Å; L108-Q111 PolarHBondContact O-N 3.32Å; Q111-S115 WeakPolarHBondContact O-CB 3.45Å; Q111-S115 PolarHBondContact O-N 3.32Å; Q111-S115 PolarHBondContact O-OG 3.44Å; Q111-T181 HydrophobicContact CG-CG2 4.26Å
112	F	95.8	Very high	94.8	Very high	87 Å²	87	41 Å²	41	38%	0.382	21%	0.214	S	C	.	.	H	α-helix	trans	-61.4	-46	175.2	173.8	-97.8	0	0	0	111.6	F88 L108 L109 C110 S116	F88-F112 HydrophobicContact CB-CE1 4.34Å; F88-F112 HydrophobicContact CB-CZ 4.33Å; F88-F112 HydrophobicContact CD1-CE1 4.14Å; F88-F112 AromaticContact CD1-CZ 3.85Å; F88-F112 HydrophobicContact CD1-CZ 3.85Å; F88-F112 HydrophobicContact CE1-CZ 4.38Å; F88-F112 HydrophobicContact CG-CZ 4.15Å; L108-F112 VanDerWaalsContact O-CB 3.31Å; L108-F112 WeakPolarHBondContact O-CB 3.4Å; L108-F112 PolarHBondContact O-N 3.45Å; L109-F112 HydrophobicContact CD1-CD1 4.45Å; L109-F112 PolarHBondContact O-N 2.7Å; C110-F112 VanDerWaalsContact C-N 3.32Å; C110-F112 PolarHBondContact O-N 3.34Å; F112-S116 WeakPolarHBondContact CE2-OG 3.31Å; F112-S116 WeakPolarHBondContact CZ-OG 3.49Å; F112-S116 WeakPolarHBondContact O-CB 3.4Å; F112-S116 PolarHBondContact O-N 3.3Å; F112-S116 PolarHBondContact O-OG 2.81Å
113	H	96.8	Very high	95.1	Very high	13 Å²	13	40.9 Å²	40.9	6%	0.06	21%	0.213	C	C	.	.	H	α-helix	trans	-60.4	-53.4	179.4	172.6	53.8	0	0	0	111.7	V89 W102 L109 C110 S115 S116 D117	V89-H113 PolarHBondContact O-CE1 3.24Å; W102-H113 HydrophobicContact CH2-CB 3.8Å; W102-H113 HydrophobicContact CZ3-CB 4.28Å; W102-H113 AromaticContact CZ3-CD2 3.63Å; L109-H113 WeakPolarHBondContact O-CB 3.44Å; L109-H113 PolarHBondContact O-N 2.88Å; C110-H113 PolarHBondContact O-N 3.06Å; H113-S115 PolarHBondContact O-N 3.21Å; H113-S116 PolarHBondContact O-N 3.06Å; H113-D117 WeakPolarHBondContact O-CB 3.37Å; H113-D117 PolarHBondContact O-N 2.85Å
114	I	96.3	Very high	95.2	Very high	12 Å²	12	39.1 Å²	39.1	6%	0.062	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-43.8	179.9	-63.6	169.4	0	0	0	110.9	C110 S116 D117 I118 H179 Y187	C110-I114 WeakPolarHBondContact O-CG1 3.28Å; C110-I114 PolarHBondContact O-N 2.85Å; I114-S116 VanDerWaalsContact C-N 3.34Å; I114-S116 PolarHBondContact O-N 2.8Å; I114-D117 PolarHBondContact O-N 3.39Å; I114-I118 HydrophobicContact CG2-CD1 3.77Å; I114-I118 HydrophobicContact CG2-CG1 4.41Å; I114-I118 WeakPolarHBondContact O-CG1 3.45Å; I114-I118 PolarHBondContact O-N 3.12Å; I114-H179 HydrophobicContact CD1-CB 3.9Å; I114-H179 WeakPolarHBondContact CG2-NE2 3.31Å; I114-Y187 VanDerWaalsContact CD1-C 3.5Å; I114-Y187 WeakPolarHBondContact CD1-O 3.32Å
115	S	96.7	Very high	95.3	Very high	11 Å²	11	36.6 Å²	36.6	8%	0.077	19%	0.191	C	C	.	.	H	α-helix	trans	-64.1	-41.6	179.1	-58.4	0	0	0	0	111.3	Q111 H113 F119	Q111-S115 WeakPolarHBondContact O-CB 3.45Å; Q111-S115 PolarHBondContact O-N 3.32Å; Q111-S115 PolarHBondContact O-OG 3.44Å; H113-S115 PolarHBondContact O-N 3.21Å; S115-F119 WeakPolarHBondContact O-CB 3.38Å; S115-F119 PolarHBondContact O-N 2.87Å
116	S	97.6	Very high	95.7	Very high	15 Å²	15	29.8 Å²	29.8	11%	0.105	16%	0.159	C	C	.	.	H	α-helix	trans	-64.1	-42.4	177.2	-62.6	0	0	0	0	111.3	F112 H113 I114 L120	F112-S116 WeakPolarHBondContact CE2-OG 3.31Å; F112-S116 WeakPolarHBondContact CZ-OG 3.49Å; F112-S116 WeakPolarHBondContact O-CB 3.4Å; F112-S116 PolarHBondContact O-N 3.3Å; F112-S116 PolarHBondContact O-OG 2.81Å; H113-S116 PolarHBondContact O-N 3.06Å; I114-S116 VanDerWaalsContact C-N 3.34Å; I114-S116 PolarHBondContact O-N 2.8Å; S116-L120 WeakPolarHBondContact O-CB 3.37Å; S116-L120 WeakPolarHBondContact O-CD1 3.41Å; S116-L120 WeakPolarHBondContact O-CG 3.42Å; S116-L120 PolarHBondContact O-N 3.26Å
117	D	96.9	Very high	95.9	Very high	30 Å²	30	27.1 Å²	27.1	16%	0.16	14%	0.141	C	C	.	.	H	α-helix	trans	-58.4	-58.5	176.5	-172.7	2.2	0	0	0	111.2	V89 H113 I114 F119 L120 C121 Y466	V89-D117 HydrophobicContact CG1-CB 3.8Å; V89-D117 HydrophobicContact CG2-CB 4.14Å; H113-D117 WeakPolarHBondContact O-CB 3.37Å; H113-D117 PolarHBondContact O-N 2.85Å; I114-D117 PolarHBondContact O-N 3.39Å; D117-F119 VanDerWaalsContact C-N 3.32Å; D117-F119 PolarHBondContact O-N 3.45Å; D117-L120 PolarHBondContact O-N 2.94Å; D117-C121 VanDerWaalsContact O-CB 3.25Å; D117-C121 WeakPolarHBondContact O-CB 3.28Å; D117-C121 PolarHBondContact O-N 3.28Å; D117-C121 PolarHBondContact O-SG 3.24Å; D117-C121 VanDerWaalsContact O-SG 3.4Å; D117-C121 PolarHBondContact OD1-SG 3.4Å; D117-Y466 WeakPolarHBondContact OD1-CE1 3.29Å; D117-Y466 PolarHBondContact OD2-OH 3.42Å
118	I	96	Very high	96.1	Very high	25 Å²	25	24.2 Å²	24.2	13%	0.128	12%	0.123	C	C	.	.	H	α-helix	trans	-57.7	-47.1	-179.5	-63.6	172	0	0	0	110.5	I114 M122 I169 I188 Y194	I114-I118 HydrophobicContact CG2-CD1 3.77Å; I114-I118 HydrophobicContact CG2-CG1 4.41Å; I114-I118 WeakPolarHBondContact O-CG1 3.45Å; I114-I118 PolarHBondContact O-N 3.12Å; I118-M122 WeakPolarHBondContact O-CB 3.42Å; I118-M122 PolarHBondContact O-N 3.01Å; I118-I169 HydrophobicContact CB-CG2 4.02Å; I118-I169 HydrophobicContact CG2-CG2 3.87Å; I118-I188 HydrophobicContact CD1-CD1 3.67Å; I118-I188 HydrophobicContact CD1-CG1 4.29Å; I118-I188 HydrophobicContact CG1-CD1 4.34Å; I118-Y194 WeakPolarHBondContact CD1-OH 3.23Å
119	F	97.7	Very high	96.3	Very high	45 Å²	45	18.4 Å²	18.4	20%	0.197	9%	0.093	C	C	.	.	H	α-helix	trans	-63	-48.3	-177.1	-180	-94.3	0	0	0	112.5	S115 D117 S123 W162 P165 I169	S115-F119 WeakPolarHBondContact O-CB 3.38Å; S115-F119 PolarHBondContact O-N 2.87Å; D117-F119 VanDerWaalsContact C-N 3.32Å; D117-F119 PolarHBondContact O-N 3.45Å; F119-S123 VanDerWaalsContact O-CB 3.27Å; F119-S123 WeakPolarHBondContact O-CB 3.43Å; F119-S123 PolarHBondContact O-N 2.92Å; F119-S123 PolarHBondContact O-OG 3.47Å; F119-W162 AromaticContact CE1-CE3 3.66Å; F119-W162 HydrophobicContact CE1-CE3 3.66Å; F119-W162 AromaticContact CE1-CZ3 3.82Å; F119-W162 HydrophobicContact CE1-CZ3 3.82Å; F119-W162 VanDerWaalsContact CE2-O 3.3Å; F119-W162 WeakPolarHBondContact CE2-O 3.46Å; F119-W162 AromaticContact CZ-CE3 3.88Å; F119-W162 HydrophobicContact CZ-CE3 3.88Å; F119-W162 HydrophobicContact CZ-CZ3 4.48Å; F119-W162 WeakPolarHBondContact CZ-O 3.29Å; F119-P165 HydrophobicContact CD2-CB 3.69Å; F119-P165 HydrophobicContact CE2-CB 4.06Å; F119-P165 HydrophobicContact CG-CB 4.32Å; F119-I169 HydrophobicContact CB-CD1 4.5Å; F119-I169 HydrophobicContact CB-CG2 4.35Å; F119-I169 HydrophobicContact CD2-CD1 4.15Å
120	L	97.7	Very high	96.4	Very high	7 Å²	7	16.8 Å²	16.8	4%	0.037	9%	0.085	C	C	.	.	H	α-helix	trans	-76.2	-42.8	-173.8	-66.7	169.8	0	0	0	112	L84 V85 F88 V89 S116 D117 M122 S123 S124 W162	L84-L120 HydrophobicContact CB-CD1 3.8Å; L84-L120 HydrophobicContact CB-CD2 3.65Å; L84-L120 HydrophobicContact CB-CG 4.36Å; L84-L120 HydrophobicContact CD1-CD2 3.9Å; L84-L120 HydrophobicContact CG-CD2 4.45Å; V85-L120 HydrophobicContact CG2-CB 3.58Å; V85-L120 HydrophobicContact CG2-CD1 4.33Å; F88-L120 HydrophobicContact CB-CD1 4.43Å; V89-L120 HydrophobicContact CG2-CD1 4.14Å; S116-L120 WeakPolarHBondContact O-CB 3.37Å; S116-L120 WeakPolarHBondContact O-CD1 3.41Å; S116-L120 WeakPolarHBondContact O-CG 3.42Å; S116-L120 PolarHBondContact O-N 3.26Å; D117-L120 PolarHBondContact O-N 2.94Å; L120-M122 VanDerWaalsContact C-N 3.32Å; L120-M122 PolarHBondContact O-N 3.2Å; L120-S123 WeakPolarHBondContact O-CB 3.15Å; L120-S123 PolarHBondContact O-N 2.93Å; L120-S124 PolarHBondContact O-N 2.92Å; L120-W162 HydrophobicContact CD2-CH2 4.48Å; L120-W162 HydrophobicContact CD2-CZ3 4.12Å
121	C	95.6	Very high	96.3	Very high	11 Å²	11	16.9 Å²	16.9	7%	0.074	9%	0.086	C	C	.	.	H	α-helix	trans	-61.6	-43.1	175.5	-70	0	0	0	0	110.6	D117 S124 I125 W436	D117-C121 VanDerWaalsContact O-CB 3.25Å; D117-C121 WeakPolarHBondContact O-CB 3.28Å; D117-C121 PolarHBondContact O-N 3.28Å; D117-C121 PolarHBondContact O-SG 3.24Å; D117-C121 VanDerWaalsContact O-SG 3.4Å; D117-C121 PolarHBondContact OD1-SG 3.4Å; C121-S124 WeakPolarHBondContact O-CB 3.4Å; C121-S124 PolarHBondContact O-N 2.93Å; C121-I125 VanDerWaalsContact O-CG1 3.3Å; C121-I125 WeakPolarHBondContact O-CG1 3.45Å; C121-I125 PolarHBondContact O-N 3.45Å; C121-I125 VanDerWaalsContact O-N 3.14Å; C121-W436 HydrophobicContact CB-CH2 3.76Å; C121-W436 HydrophobicContact CB-CZ2 3.81Å
122	M	96.1	Very high	96.4	Very high	2 Å²	2	14.5 Å²	14.5	1%	0.01	7%	0.074	C	C	.	.	H	α-helix	trans	-70.1	-36.2	177	-170	176.5	154.8	0	0	112.8	I118 L120 S124 I125 L126 I164 P165 S168 L201 A202	I118-M122 WeakPolarHBondContact O-CB 3.42Å; I118-M122 PolarHBondContact O-N 3.01Å; L120-M122 VanDerWaalsContact C-N 3.32Å; L120-M122 PolarHBondContact O-N 3.2Å; M122-S124 VanDerWaalsContact C-N 3.31Å; M122-S124 PolarHBondContact O-N 3.35Å; M122-I125 PolarHBondContact O-N 3.29Å; M122-L126 HydrophobicContact CE-CD1 3.98Å; M122-L126 HydrophobicContact CG-CD1 4.37Å; M122-L126 WeakPolarHBondContact O-CG 3.19Å; M122-L126 PolarHBondContact O-N 3.48Å; M122-I164 HydrophobicContact CE-CG2 3.62Å; M122-P165 HydrophobicContact CB-CB 4.07Å; M122-P165 HydrophobicContact CB-CG 4.13Å; M122-P165 HydrophobicContact CE-CB 4.35Å; M122-P165 HydrophobicContact CE-CG 4.24Å; M122-P165 HydrophobicContact CG-CB 4.14Å; M122-P165 HydrophobicContact CG-CG 3.97Å; M122-P165 HydrophobicContact SD-CB 4.06Å; M122-P165 HydrophobicContact SD-CG 4.35Å; M122-S168 PolarHBondContact SD-OG 3.27Å; M122-L201 HydrophobicContact CE-CD1 4.17Å; M122-L201 HydrophobicContact CE-CD2 3.99Å; M122-L201 HydrophobicContact CE-CG 3.52Å; M122-A202 HydrophobicContact CG-CB 4.15Å; M122-A202 HydrophobicContact SD-CB 3.92Å
123	S	97.8	Very high	96.4	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-59.1	-42.9	171.3	-64.2	0	0	0	0	111.3	F119 L120 I125 L126 N127	F119-S123 VanDerWaalsContact O-CB 3.27Å; F119-S123 WeakPolarHBondContact O-CB 3.43Å; F119-S123 PolarHBondContact O-N 2.92Å; F119-S123 PolarHBondContact O-OG 3.47Å; L120-S123 WeakPolarHBondContact O-CB 3.15Å; L120-S123 PolarHBondContact O-N 2.93Å; S123-I125 PolarHBondContact O-N 3.41Å; S123-L126 PolarHBondContact O-N 2.99Å; S123-N127 PolarHBondContact O-N 3.38Å; S123-N127 PolarHBondContact O-ND2 3.49Å
124	S	95.6	Very high	96.3	Very high	4 Å²	4	12.6 Å²	12.6	3%	0.028	7%	0.068	C	C	.	.	H	α-helix	trans	-58.1	-48.6	175.9	-174	0	0	0	0	110.9	L78 D82 L120 C121 M122 L126 N127 L128	L78-S124 VanDerWaalsContact CD1-O 3.24Å; L78-S124 WeakPolarHBondContact CD1-O 3.36Å; L78-S124 WeakPolarHBondContact CD1-OG 3.33Å; D82-S124 PolarHBondContact OD1-OG 2.88Å; L120-S124 PolarHBondContact O-N 2.92Å; C121-S124 WeakPolarHBondContact O-CB 3.4Å; C121-S124 PolarHBondContact O-N 2.93Å; M122-S124 VanDerWaalsContact C-N 3.31Å; M122-S124 PolarHBondContact O-N 3.35Å; S124-L126 PolarHBondContact O-N 2.86Å; S124-N127 WeakPolarHBondContact O-CB 3.48Å; S124-N127 PolarHBondContact O-N 2.85Å; S124-L128 PolarHBondContact O-N 2.7Å; S124-L128 VanDerWaalsContact O-N 3.12Å
125	I	94.5	Very high	96.1	Very high	3 Å²	3	12.5 Å²	12.5	2%	0.015	7%	0.067	C	C	.	.	H	α-helix	trans	-62.6	-44.5	179.2	-62.3	165.9	0	0	0	112.3	C121 M122 S123 N127 L128 C129 A202 P206 F432	C121-I125 VanDerWaalsContact O-CG1 3.3Å; C121-I125 WeakPolarHBondContact O-CG1 3.45Å; C121-I125 PolarHBondContact O-N 3.45Å; C121-I125 VanDerWaalsContact O-N 3.14Å; M122-I125 PolarHBondContact O-N 3.29Å; S123-I125 PolarHBondContact O-N 3.41Å; I125-N127 VanDerWaalsContact C-N 3.28Å; I125-N127 PolarHBondContact O-N 3.27Å; I125-L128 WeakPolarHBondContact O-CA 3.4Å; I125-L128 VanDerWaalsContact O-CB 3.29Å; I125-L128 WeakPolarHBondContact O-CB 3.42Å; I125-L128 PolarHBondContact O-N 2.71Å; I125-C129 PolarHBondContact O-N 2.9Å; I125-C129 VanDerWaalsContact O-N 3.07Å; I125-A202 WeakPolarHBondContact CD1-O 3.18Å; I125-P206 HydrophobicContact CG2-CB 3.47Å; I125-P206 VanDerWaalsContact CG2-CB 3.47Å; I125-P206 HydrophobicContact CG2-CG 3.88Å; I125-F432 HydrophobicContact CB-CE2 4.29Å; I125-F432 HydrophobicContact CD1-CD2 4.29Å; I125-F432 HydrophobicContact CD1-CE2 3.41Å; I125-F432 VanDerWaalsContact CD1-CE2 3.41Å; I125-F432 HydrophobicContact CD1-CZ 4.05Å; I125-F432 HydrophobicContact CG1-CD2 3.86Å; I125-F432 HydrophobicContact CG1-CE2 3.38Å; I125-F432 HydrophobicContact CG1-CZ 4.08Å; I125-F432 HydrophobicContact CG2-CE1 4.43Å; I125-F432 HydrophobicContact CG2-CE2 3.96Å; I125-F432 HydrophobicContact CG2-CZ 3.77Å
126	L	97	Very high	96	Very high	19 Å²	19	14.2 Å²	14.2	10%	0.099	7%	0.072	C	C	.	.	H	α-helix	trans	-69.3	-27.9	179	-70.2	174.6	0	0	0	112.7	M122 S123 S124 L128 C129 C130 A161 I164 P165 P206	M122-L126 HydrophobicContact CE-CD1 3.98Å; M122-L126 HydrophobicContact CG-CD1 4.37Å; M122-L126 WeakPolarHBondContact O-CG 3.19Å; M122-L126 PolarHBondContact O-N 3.48Å; S123-L126 PolarHBondContact O-N 2.99Å; S124-L126 PolarHBondContact O-N 2.86Å; L126-L128 VanDerWaalsContact C-N 3.33Å; L126-C129 WeakPolarHBondContact O-CB 3.3Å; L126-C129 PolarHBondContact O-N 3.37Å; L126-C130 PolarHBondContact O-N 3.05Å; L126-C130 PolarHBondContact O-SG 3.5Å; L126-A161 HydrophobicContact CB-CB 3.69Å; L126-I164 HydrophobicContact CD1-CB 3.65Å; L126-I164 HydrophobicContact CD1-CD1 4.46Å; L126-I164 HydrophobicContact CD1-CG2 3.73Å; L126-P165 HydrophobicContact CD1-CG 3.78Å; L126-P206 HydrophobicContact CD2-CG 4.26Å
127	N	96.8	Very high	95.8	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-66.5	-34.2	168.4	-82.3	-79.5	0	0	0	111.6	S77 L78 S123 S124 I125 C129 C130 I131	S77-N127 WeakPolarHBondContact CB-OD1 3.37Å; S77-N127 VanDerWaalsContact OG-CG 3.3Å; S77-N127 PolarHBondContact OG-ND2 3.38Å; S77-N127 PolarHBondContact OG-OD1 3.2Å; L78-N127 HydrophobicContact CB-CB 4.14Å; L78-N127 HydrophobicContact CD1-CB 4.12Å; S123-N127 PolarHBondContact O-N 3.38Å; S123-N127 PolarHBondContact O-ND2 3.49Å; S124-N127 WeakPolarHBondContact O-CB 3.48Å; S124-N127 PolarHBondContact O-N 2.85Å; I125-N127 VanDerWaalsContact C-N 3.28Å; I125-N127 PolarHBondContact O-N 3.27Å; N127-C129 VanDerWaalsContact C-N 3.35Å; N127-C130 WeakPolarHBondContact O-CB 3.49Å; N127-C130 PolarHBondContact O-N 3.37Å; N127-I131 WeakPolarHBondContact O-CG1 3.31Å; N127-I131 PolarHBondContact O-N 3.3Å
128	L	94.7	Very high	95.5	Very high	2 Å²	2	14.2 Å²	14.2	1%	0.01	7%	0.073	C	C	.	.	H	α-helix	trans	-64.2	-37.4	170	-62.9	176.2	0	0	0	112.4	L78 S124 I125 L126 C130 I131 S132 I210 V428 F432	L78-L128 HydrophobicContact CD1-CD2 4.21Å; L78-L128 HydrophobicContact CD1-CG 4.22Å; L78-L128 HydrophobicContact CD2-CD2 3.7Å; S124-L128 PolarHBondContact O-N 2.7Å; S124-L128 VanDerWaalsContact O-N 3.12Å; I125-L128 WeakPolarHBondContact O-CA 3.4Å; I125-L128 VanDerWaalsContact O-CB 3.29Å; I125-L128 WeakPolarHBondContact O-CB 3.42Å; I125-L128 PolarHBondContact O-N 2.71Å; L126-L128 VanDerWaalsContact C-N 3.33Å; L128-C130 VanDerWaalsContact C-N 3.33Å; L128-I131 HydrophobicContact CD2-CD1 4.37Å; L128-I131 PolarHBondContact O-N 2.69Å; L128-S132 WeakPolarHBondContact O-CB 3.26Å; L128-S132 PolarHBondContact O-N 2.95Å; L128-S132 PolarHBondContact O-OG 3.36Å; L128-I210 HydrophobicContact CB-CD1 4.3Å; L128-V428 HydrophobicContact CD1-CG1 4.28Å; L128-V428 HydrophobicContact CD2-CG1 3.41Å; L128-V428 VanDerWaalsContact CD2-CG1 3.41Å; L128-F432 HydrophobicContact CD1-CB 4Å; L128-F432 HydrophobicContact CD1-CG 4.23Å
129	C	97.1	Very high	95.3	Very high	5 Å²	5	13.1 Å²	13.1	3%	0.034	7%	0.067	C	C	.	.	H	α-helix	trans	-59.5	-45.1	170.6	-65.2	0	0	0	0	111.2	I125 L126 N127 I131 S132 I133 L209	I125-C129 PolarHBondContact O-N 2.9Å; I125-C129 VanDerWaalsContact O-N 3.07Å; L126-C129 WeakPolarHBondContact O-CB 3.3Å; L126-C129 PolarHBondContact O-N 3.37Å; N127-C129 VanDerWaalsContact C-N 3.35Å; C129-I131 PolarHBondContact O-N 3.13Å; C129-S132 WeakPolarHBondContact O-CB 3.3Å; C129-S132 PolarHBondContact O-N 3.17Å; C129-I133 WeakPolarHBondContact O-CG1 3.28Å; C129-I133 PolarHBondContact O-N 3.49Å; C129-L209 HydrophobicContact CB-CD2 3.98Å
130	C	97.2	Very high	95	Very high	11 Å²	11	11.2 Å²	11.2	7%	0.074	6%	0.059	C	C	.	.	H	α-helix	trans	-60.4	-46.3	177.7	-66.9	0	0	0	0	112.2	Y74 L126 N127 L128 S132 I133 D134 M157	Y74-C130 HydrophobicContact CD1-CB 3.63Å; Y74-C130 HydrophobicContact CE1-CB 3.69Å; L126-C130 PolarHBondContact O-N 3.05Å; L126-C130 PolarHBondContact O-SG 3.5Å; N127-C130 WeakPolarHBondContact O-CB 3.49Å; N127-C130 PolarHBondContact O-N 3.37Å; L128-C130 VanDerWaalsContact C-N 3.33Å; C130-S132 VanDerWaalsContact C-N 3.31Å; C130-S132 PolarHBondContact O-N 3.15Å; C130-I133 PolarHBondContact O-N 2.95Å; C130-D134 WeakPolarHBondContact O-CB 3.41Å; C130-D134 PolarHBondContact O-N 2.85Å; C130-M157 HydrophobicContact CB-CE 4.01Å
131	I	94.6	Very high	94.6	Very high	2 Å²	2	16.5 Å²	16.5	1%	0.01	8%	0.079	C	C	.	.	H	α-helix	trans	-58.3	-46	175	-67.6	168.9	0	0	0	110.1	Y74 L78 N127 L128 C129 I133 D134 R135 V425	Y74-I131 HydrophobicContact CG-CG1 4.31Å; L78-I131 HydrophobicContact CD2-CD1 4.01Å; N127-I131 WeakPolarHBondContact O-CG1 3.31Å; N127-I131 PolarHBondContact O-N 3.3Å; L128-I131 HydrophobicContact CD2-CD1 4.37Å; L128-I131 PolarHBondContact O-N 2.69Å; C129-I131 PolarHBondContact O-N 3.13Å; I131-I133 PolarHBondContact O-N 3.28Å; I131-D134 PolarHBondContact O-N 3.43Å; I131-R135 HydrophobicContact CG2-CG 4.33Å; I131-R135 VanDerWaalsContact O-CG 3.26Å; I131-R135 WeakPolarHBondContact O-CG 3.25Å; I131-R135 PolarHBondContact O-N 2.9Å; I131-V425 HydrophobicContact CG2-CB 4.36Å; I131-V425 HydrophobicContact CG2-CG1 3.91Å; I131-V425 HydrophobicContact CG2-CG2 3.45Å; I131-V425 VanDerWaalsContact CG2-CG2 3.45Å
132	S	95.4	Very high	94.1	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-59	-46.8	179.9	-58.2	0	0	0	0	112.2	L128 C129 C130 R135 Y136 V213 H214	L128-S132 WeakPolarHBondContact O-CB 3.26Å; L128-S132 PolarHBondContact O-N 2.95Å; L128-S132 PolarHBondContact O-OG 3.36Å; C129-S132 WeakPolarHBondContact O-CB 3.3Å; C129-S132 PolarHBondContact O-N 3.17Å; C130-S132 VanDerWaalsContact C-N 3.31Å; C130-S132 PolarHBondContact O-N 3.15Å; S132-R135 PolarHBondContact O-N 3.48Å; S132-Y136 PolarHBondContact O-N 2.97Å; S132-V213 WeakPolarHBondContact O-CG1 3.49Å; S132-H214 PolarHBondContact OG-CE1 2.94Å
133	I	95.9	Very high	93.5	Very high	57 Å²	57	18 Å²	18	29%	0.292	9%	0.087	S	C	.	.	H	α-helix	trans	-64.5	-46.6	178.2	-68.5	166.7	0	0	0	110.7	C129 C130 I131 R135 Y136 V137 M157 L209 V213	C129-I133 WeakPolarHBondContact O-CG1 3.28Å; C129-I133 PolarHBondContact O-N 3.49Å; C130-I133 PolarHBondContact O-N 2.95Å; I131-I133 PolarHBondContact O-N 3.28Å; I133-R135 VanDerWaalsContact C-N 3.32Å; I133-R135 PolarHBondContact O-N 3.4Å; I133-Y136 WeakPolarHBondContact O-CB 3.3Å; I133-Y136 PolarHBondContact O-N 3.26Å; I133-Y136 VanDerWaalsContact O-N 3.12Å; I133-V137 WeakPolarHBondContact O-CG2 3.37Å; I133-V137 PolarHBondContact O-N 3.15Å; I133-M157 HydrophobicContact CB-CE 3.94Å; I133-M157 HydrophobicContact CD1-CE 4.44Å; I133-M157 HydrophobicContact CG2-CE 3.83Å; I133-L209 HydrophobicContact CD1-CD2 4.47Å; I133-V213 HydrophobicContact CG1-CG2 4.43Å
134	D	94.5	Very high	92.9	Very high	3 Å²	3	22 Å²	22	2%	0.016	11%	0.106	C	C	.	.	H	α-helix	trans	-58	-44.3	177.3	168.3	83.9	0	0	0	111.5	Y74 C130 I131 Y136 V137 A138 Y145	Y74-D134 HydrophobicContact CD2-CB 4.23Å; Y74-D134 HydrophobicContact CE2-CB 3.65Å; C130-D134 WeakPolarHBondContact O-CB 3.41Å; C130-D134 PolarHBondContact O-N 2.85Å; I131-D134 PolarHBondContact O-N 3.43Å; D134-Y136 PolarHBondContact O-N 3.25Å; D134-V137 PolarHBondContact O-N 2.97Å; D134-A138 WeakPolarHBondContact O-CB 3.36Å; D134-A138 PolarHBondContact O-N 2.88Å; D134-Y145 VanDerWaalsContact OD1-CE2 3.29Å; D134-Y145 WeakPolarHBondContact OD1-CE2 3.35Å; D134-Y145 PolarHBondContact OD1-OH 2.85Å; D134-Y145 PolarHBondContact OD2-OH 3.31Å
135	R	92.8	Very high	92.4	Very high	10 Å²	10	23.3 Å²	23.3	4%	0.038	11%	0.11	C	C	.	.	H	α-helix	trans	-63.2	-39.9	174.7	-66.8	-54.7	84.1	-169.4	-6.4	112.6	I131 S132 I133 A138 I139 Y145 I217 E418 V422 V425	I131-R135 HydrophobicContact CG2-CG 4.33Å; I131-R135 VanDerWaalsContact O-CG 3.26Å; I131-R135 WeakPolarHBondContact O-CG 3.25Å; I131-R135 PolarHBondContact O-N 2.9Å; S132-R135 PolarHBondContact O-N 3.48Å; I133-R135 VanDerWaalsContact C-N 3.32Å; I133-R135 PolarHBondContact O-N 3.4Å; R135-A138 PolarHBondContact O-N 3.39Å; R135-I139 WeakPolarHBondContact O-CB 3.4Å; R135-I139 PolarHBondContact O-N 3.47Å; R135-Y145 PolarHBondContact NH2-OH 2.94Å; R135-I217 HydrophobicContact CB-CD1 4.34Å; R135-E418 IonicContact CZ-OE2 2.71Å; R135-E418 IonicContact NH1-OE2 3.23Å; R135-E418 PolarHBondContact NH1-OE2 3.16Å; R135-E418 IonicContact NH2-OE2 2.72Å; R135-V422 HydrophobicContact CB-CG2 3.87Å; R135-V422 HydrophobicContact CG-CG2 4.2Å; R135-V425 HydrophobicContact CG-CG2 3.92Å
136	Y	94.8	Very high	91.9	Very high	47 Å²	47	26 Å²	26	18%	0.184	12%	0.124	C	C	.	.	H	α-helix	trans	-60.4	-46.3	175.4	169.7	-104.8	0	0	0	111.9	S132 I133 D134 I139 S140 V213 R216 I217 I220	S132-Y136 PolarHBondContact O-N 2.97Å; I133-Y136 WeakPolarHBondContact O-CB 3.3Å; I133-Y136 PolarHBondContact O-N 3.26Å; I133-Y136 VanDerWaalsContact O-N 3.12Å; D134-Y136 PolarHBondContact O-N 3.25Å; Y136-I139 PolarHBondContact O-N 3.33Å; Y136-S140 WeakPolarHBondContact CE2-OG 3.29Å; Y136-S140 WeakPolarHBondContact O-CB 3.48Å; Y136-S140 PolarHBondContact O-N 2.97Å; Y136-S140 PolarHBondContact O-OG 3.23Å; Y136-V213 HydrophobicContact CG-CG1 4.3Å; Y136-R216 HydrophobicContact CD2-CB 4.17Å; Y136-R216 HydrophobicContact CE2-CB 3.8Å; Y136-I217 HydrophobicContact CD2-CG1 3.97Å; Y136-I217 HydrophobicContact CG-CG1 4.48Å; Y136-I220 HydrophobicContact CD2-CD1 4.37Å; Y136-I220 HydrophobicContact CE2-CD1 3.65Å
137	V	93.1	Very high	91.1	Very high	46 Å²	46	29.7 Å²	29.7	28%	0.279	15%	0.147	S	C	.	.	H	α-helix	trans	-64.6	-45.6	177.5	178.4	0	0	0	0	110.7	I133 D134 I139 S140 Y141 Y145	I133-V137 WeakPolarHBondContact O-CG2 3.37Å; I133-V137 PolarHBondContact O-N 3.15Å; D134-V137 PolarHBondContact O-N 2.97Å; V137-I139 VanDerWaalsContact C-N 3.34Å; V137-I139 PolarHBondContact O-N 2.92Å; V137-S140 PolarHBondContact O-N 3.43Å; V137-Y141 PolarHBondContact O-N 3.26Å; V137-Y145 HydrophobicContact CG1-CD2 4.1Å
138	A	91.1	Very high	90.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.3	-42	179	0	0	0	0	0	112.7	D134 R135 P142 Y145 E418	D134-A138 WeakPolarHBondContact O-CB 3.36Å; D134-A138 PolarHBondContact O-N 2.88Å; R135-A138 PolarHBondContact O-N 3.39Å; A138-P142 WeakPolarHBondContact O-CA 3.21Å; A138-Y145 HydrophobicContact CB-CD1 4.07Å; A138-Y145 HydrophobicContact CB-CD2 3.93Å; A138-Y145 HydrophobicContact CB-CE1 4.13Å; A138-Y145 HydrophobicContact CB-CE2 3.97Å; A138-Y145 HydrophobicContact CB-CG 3.96Å; A138-E418 HydrophobicContact CB-CG 4.35Å
139	I	91.4	Very high	89.8	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-74.7	-39.6	176.5	-73.5	-167.5	0	0	0	111.9	R135 Y136 V137 I217 I220 I221 R224 F415 E418 V422	R135-I139 WeakPolarHBondContact O-CB 3.4Å; R135-I139 PolarHBondContact O-N 3.47Å; Y136-I139 PolarHBondContact O-N 3.33Å; V137-I139 VanDerWaalsContact C-N 3.34Å; V137-I139 PolarHBondContact O-N 2.92Å; I139-I217 HydrophobicContact CD1-CG2 4Å; I139-I220 HydrophobicContact CG2-CB 4.49Å; I139-I220 HydrophobicContact CG2-CG2 3.84Å; I139-I221 HydrophobicContact CD1-CD1 3.98Å; I139-I221 HydrophobicContact CD1-CG1 4.2Å; I139-I221 HydrophobicContact CG2-CG1 4.3Å; I139-R224 PolarHBondContact O-NH1 2.69Å; I139-F415 HydrophobicContact CG2-CD2 4.2Å; I139-F415 HydrophobicContact CG2-CE2 3.86Å; I139-E418 HydrophobicContact CG1-CB 4.02Å; I139-V422 HydrophobicContact CD1-CB 4.11Å; I139-V422 HydrophobicContact CD1-CG2 3.33Å; I139-V422 HydrophobicContact CG1-CG2 4.25Å
140	S	90.4	Very high	89.4	Confident	5 Å²	5	38.9 Å²	38.9	4%	0.035	19%	0.193	C	C	.	.	H	α-helix	trans	-68.7	-36.7	-177.8	-60.4	0	0	0	0	111.7	Y136 V137 I220 R224	Y136-S140 WeakPolarHBondContact CE2-OG 3.29Å; Y136-S140 WeakPolarHBondContact O-CB 3.48Å; Y136-S140 PolarHBondContact O-N 2.97Å; Y136-S140 PolarHBondContact O-OG 3.23Å; V137-S140 PolarHBondContact O-N 3.43Å; S140-I220 WeakPolarHBondContact OG-CD1 3.27Å; S140-R224 PolarHBondContact O-NH2 2.95Å
141	Y	89.2	Confident	89	Confident	118 Å²	118	44.1 Å²	44.1	46%	0.463	21%	0.211	S	C	.	.			trans	-138.7	67.4	-172.3	-49.4	-77.3	0	0	0	112.3	V137 L143 Q144 Y145	V137-Y141 PolarHBondContact O-N 3.26Å; Y141-L143 PolarHBondContact O-N 3.48Å; Y141-Q144 PolarHBondContact O-N 3.41Å; Y141-Y145 WeakPolarHBondContact O-CB 3.46Å; Y141-Y145 PolarHBondContact O-N 3.43Å
142	P	85.2	Confident	89	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.019	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-45.3	-168.9	21.1	-34	0	0	0	114.1	A138 I146 E411 I414	A138-P142 WeakPolarHBondContact O-CA 3.21Å; P142-I146 WeakPolarHBondContact O-CG1 3.44Å; P142-I146 PolarHBondContact O-N 2.69Å; P142-E411 HydrophobicContact CG-CB 4.17Å; P142-E411 HydrophobicContact CG-CG 4.02Å; P142-I414 HydrophobicContact CB-CB 4.08Å; P142-I414 HydrophobicContact CB-CG2 3.58Å
143	L	84.9	Confident	88.8	Confident	41 Å²	41	57.6 Å²	57.6	22%	0.215	27%	0.267	C	S	.	.	H	α-helix	trans	-71.7	-39	179	-62.6	177.8	0	0	0	112.3	Y141 Y145 I146 T147 R407 E411 I414	Y141-L143 PolarHBondContact O-N 3.48Å; L143-Y145 VanDerWaalsContact C-N 3.34Å; L143-I146 PolarHBondContact O-N 2.97Å; L143-T147 PolarHBondContact O-N 2.84Å; L143-T147 PolarHBondContact O-OG1 3.46Å; L143-R407 HydrophobicContact CD1-CG 3.61Å; L143-E411 HydrophobicContact CD1-CG 3.67Å; L143-E411 WeakPolarHBondContact CD1-OE1 3.45Å; L143-E411 HydrophobicContact CD2-CG 4.37Å; L143-E411 HydrophobicContact CG-CG 3.7Å; L143-I414 HydrophobicContact CD2-CD1 3.7Å
144	Q	84.4	Confident	88.8	Confident	86 Å²	86	54.9 Å²	54.9	40%	0.402	25%	0.253	S	S	.	.	H	α-helix	trans	-72.3	-30.9	178.9	-58.4	-174.4	10.9	0	0	111.8	Y141 I146 T147 K148	Y141-Q144 PolarHBondContact O-N 3.41Å; Q144-I146 VanDerWaalsContact C-N 3.34Å; Q144-T147 WeakPolarHBondContact CA-OG1 3.46Å; Q144-T147 PolarHBondContact O-N 3.12Å; Q144-T147 PolarHBondContact O-OG1 2.91Å; Q144-K148 HydrophobicContact CB-CD 4.34Å; Q144-K148 WeakPolarHBondContact O-CA 3.36Å; Q144-K148 WeakPolarHBondContact O-CB 3.2Å; Q144-K148 PolarHBondContact O-N 3.29Å
145	Y	86	Confident	88.9	Confident	31 Å²	31	58.6 Å²	58.6	12%	0.122	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-44.7	173.7	-179.4	-97	0	0	0	110.5	D134 R135 V137 A138 Y141 L143 T147 Q149	D134-Y145 VanDerWaalsContact OD1-CE2 3.29Å; D134-Y145 WeakPolarHBondContact OD1-CE2 3.35Å; D134-Y145 PolarHBondContact OD1-OH 2.85Å; D134-Y145 PolarHBondContact OD2-OH 3.31Å; R135-Y145 PolarHBondContact NH2-OH 2.94Å; V137-Y145 HydrophobicContact CG1-CD2 4.1Å; A138-Y145 HydrophobicContact CB-CD1 4.07Å; A138-Y145 HydrophobicContact CB-CD2 3.93Å; A138-Y145 HydrophobicContact CB-CE1 4.13Å; A138-Y145 HydrophobicContact CB-CE2 3.97Å; A138-Y145 HydrophobicContact CB-CG 3.96Å; Y141-Y145 WeakPolarHBondContact O-CB 3.46Å; Y141-Y145 PolarHBondContact O-N 3.43Å; L143-Y145 VanDerWaalsContact C-N 3.34Å; Y145-T147 VanDerWaalsContact C-N 3.32Å; Y145-T147 PolarHBondContact O-N 3.32Å; Y145-Q149 HydrophobicContact CD2-CB 3.78Å; Y145-Q149 HydrophobicContact CD2-CG 3.95Å; Y145-Q149 HydrophobicContact CE2-CB 3.88Å; Y145-Q149 HydrophobicContact CE2-CG 3.54Å; Y145-Q149 HydrophobicContact CG-CB 4.18Å; Y145-Q149 WeakPolarHBondContact O-CB 3.4Å; Y145-Q149 PolarHBondContact O-N 3.11Å
146	I	82.9	Confident	89.1	Confident	58 Å²	58	62.8 Å²	62.8	30%	0.297	29%	0.294	S	S	.	.	H	α-helix	trans	-63.8	-37.6	178.2	-64.6	170.5	0	0	0	111.7	P142 L143 Q144 I414	P142-I146 WeakPolarHBondContact O-CG1 3.44Å; P142-I146 PolarHBondContact O-N 2.69Å; L143-I146 PolarHBondContact O-N 2.97Å; Q144-I146 VanDerWaalsContact C-N 3.34Å; I146-I414 HydrophobicContact CD1-CD1 3.47Å; I146-I414 VanDerWaalsContact CD1-CD1 3.47Å; I146-I414 HydrophobicContact CD1-CG1 4.04Å; I146-I414 HydrophobicContact CD1-CG2 4.24Å
147	T	80.9	Confident	89.2	Confident	98 Å²	98	62.1 Å²	62.1	60%	0.601	29%	0.293	S	S	*	.	H	α-helix	trans	-90.3	-33.2	-174.8	57.2	0	0	0	0	114.4	L143 Q144 Y145	L143-T147 PolarHBondContact O-N 2.84Å; L143-T147 PolarHBondContact O-OG1 3.46Å; Q144-T147 WeakPolarHBondContact CA-OG1 3.46Å; Q144-T147 PolarHBondContact O-N 3.12Å; Q144-T147 PolarHBondContact O-OG1 2.91Å; Y145-T147 VanDerWaalsContact C-N 3.32Å; Y145-T147 PolarHBondContact O-N 3.32Å
148	K	82	Confident	89.5	Confident	120 Å²	120	61.1 Å²	61.1	52%	0.522	29%	0.286	S	S	.	.	H	α-helix	trans	-107.3	-25.6	-172.3	-58.2	-173.4	176.4	-176.5	0	113.9	Q144 S150	Q144-K148 HydrophobicContact CB-CD 4.34Å; Q144-K148 WeakPolarHBondContact O-CA 3.36Å; Q144-K148 WeakPolarHBondContact O-CB 3.2Å; Q144-K148 PolarHBondContact O-N 3.29Å; K148-S150 PolarHBondContact O-N 3.47Å; K148-S150 VanDerWaalsContact O-N 3.11Å
149	Q	82.8	Confident	89.8	Confident	37 Å²	37	65.7 Å²	65.7	17%	0.173	31%	0.31	C	S	.	.			trans	-65.4	119.9	-177.7	-172.5	67.7	15.8	0	0	109.1	I70 Y145 S154	I70-Q149 HydrophobicContact CD1-CB 3.9Å; I70-Q149 HydrophobicContact CD1-CG 3.41Å; I70-Q149 VanDerWaalsContact CD1-CG 3.41Å; I70-Q149 VanDerWaalsContact CD1-O 3.3Å; I70-Q149 WeakPolarHBondContact CD1-O 3.47Å; I70-Q149 HydrophobicContact CG2-CG 4.03Å; Y145-Q149 HydrophobicContact CD2-CB 3.78Å; Y145-Q149 HydrophobicContact CD2-CG 3.95Å; Y145-Q149 HydrophobicContact CE2-CB 3.88Å; Y145-Q149 HydrophobicContact CE2-CG 3.54Å; Y145-Q149 HydrophobicContact CG-CB 4.18Å; Y145-Q149 WeakPolarHBondContact O-CB 3.4Å; Y145-Q149 PolarHBondContact O-N 3.11Å; Q149-S154 PolarHBondContact NE2-OG 2.86Å
150	S	87.8	Confident	90.1	Very high	43 Å²	43	69.7 Å²	69.7	30%	0.301	33%	0.33	S	S	.	.			trans	-113.2	151.8	-178.8	74.5	0	0	0	0	111.3	K148 R152 I153	K148-S150 PolarHBondContact O-N 3.47Å; K148-S150 VanDerWaalsContact O-N 3.11Å; S150-R152 PolarHBondContact O-N 3.03Å; S150-I153 PolarHBondContact O-N 3.37Å
151	R	89.7	Confident	90.5	Very high	121 Å²	121	69.6 Å²	69.6	46%	0.457	33%	0.33	S	S	.	.	H	α-helix	trans	-58.9	-30.5	174.5	-67.1	174.4	63.8	86.7	1.4	112.3	S154 I155	R151-S154 PolarHBondContact O-N 2.72Å; R151-I155 VanDerWaalsContact O-CG1 3.31Å; R151-I155 WeakPolarHBondContact O-CG1 3.36Å; R151-I155 PolarHBondContact O-N 3.4Å
152	R	93.2	Very high	90.9	Very high	204 Å²	204	66.2 Å²	66.2	77%	0.77	32%	0.316	S	S	*	.	H	α-helix	trans	-62.3	-46.7	-179.4	-65.7	-178.9	-177.6	166	0.4	111.7	S150 S154 I155 I156	S150-R152 PolarHBondContact O-N 3.03Å; R152-S154 VanDerWaalsContact C-N 3.31Å; R152-S154 PolarHBondContact O-N 3.42Å; R152-I155 PolarHBondContact O-N 3.38Å; R152-I156 WeakPolarHBondContact O-CG1 3.15Å; R152-I156 PolarHBondContact O-N 3.45Å
153	I	92.6	Very high	91.5	Very high	80 Å²	80	70.5 Å²	70.5	41%	0.41	34%	0.338	S	S	.	.	H	α-helix	trans	-61.3	-43.2	178.7	-65.5	169.8	0	0	0	110.3	S150 I155 I156 M157	S150-I153 PolarHBondContact O-N 3.37Å; I153-I155 PolarHBondContact O-N 3.26Å; I153-I156 PolarHBondContact O-N 3.18Å; I153-M157 HydrophobicContact CG2-SD 4.28Å; I153-M157 WeakPolarHBondContact O-CG 3.31Å; I153-M157 PolarHBondContact O-N 3.2Å
154	S	94.4	Very high	92.1	Very high	0 Å²	0	71 Å²	71	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-65.8	-38.3	179.2	-61.8	0	0	0	0	113.3	I70 Y74 Q149 R151 R152 M157 I158	I70-S154 WeakPolarHBondContact CG2-OG 3.26Å; Y74-S154 VanDerWaalsContact OH-CA 3.28Å; Y74-S154 WeakPolarHBondContact OH-CA 3.42Å; Y74-S154 VanDerWaalsContact OH-CB 3.28Å; Y74-S154 WeakPolarHBondContact OH-CB 3.39Å; Y74-S154 PolarHBondContact OH-OG 2.98Å; Q149-S154 PolarHBondContact NE2-OG 2.86Å; R151-S154 PolarHBondContact O-N 2.72Å; R152-S154 VanDerWaalsContact C-N 3.31Å; R152-S154 PolarHBondContact O-N 3.42Å; S154-M157 PolarHBondContact O-N 3.36Å; S154-I158 VanDerWaalsContact O-CG1 3.29Å; S154-I158 WeakPolarHBondContact O-CG1 3.39Å; S154-I158 PolarHBondContact O-N 3.17Å
155	I	96.4	Very high	92.7	Very high	81 Å²	81	67 Å²	67	42%	0.415	32%	0.321	S	S	.	.	H	α-helix	trans	-63.3	-42.7	173.2	-68.8	164.9	0	0	0	110.6	R151 R152 I153 M157 I158 L159	R151-I155 VanDerWaalsContact O-CG1 3.31Å; R151-I155 WeakPolarHBondContact O-CG1 3.36Å; R151-I155 PolarHBondContact O-N 3.4Å; R152-I155 PolarHBondContact O-N 3.38Å; I153-I155 PolarHBondContact O-N 3.26Å; I155-M157 PolarHBondContact O-N 2.79Å; I155-I158 PolarHBondContact O-N 3.42Å; I155-L159 HydrophobicContact CG2-CD1 4.01Å; I155-L159 HydrophobicContact CG2-CG 4.29Å; I155-L159 VanDerWaalsContact O-CG 3.31Å; I155-L159 WeakPolarHBondContact O-CG 3.45Å; I155-L159 PolarHBondContact O-N 2.93Å
156	I	97.9	Very high	93.2	Very high	99 Å²	99	67.3 Å²	67.3	51%	0.508	33%	0.328	S	S	.	.	H	α-helix	trans	-60.3	-46.6	176.6	-68	165.1	0	0	0	110.9	R152 I153 I158 L159 I160	R152-I156 WeakPolarHBondContact O-CG1 3.15Å; R152-I156 PolarHBondContact O-N 3.45Å; I153-I156 PolarHBondContact O-N 3.18Å; I156-I158 VanDerWaalsContact C-N 3.32Å; I156-I158 PolarHBondContact O-N 3.48Å; I156-L159 PolarHBondContact O-N 3.28Å; I156-I160 HydrophobicContact CG2-CD1 3.95Å; I156-I160 VanDerWaalsContact O-CG1 3.32Å; I156-I160 WeakPolarHBondContact O-CG1 3.35Å; I156-I160 PolarHBondContact O-N 2.67Å
157	M	97.6	Very high	93.7	Very high	33 Å²	33	70 Å²	70	16%	0.163	34%	0.338	C	S	.	.	H	α-helix	trans	-59.5	-43.1	176.4	-71.3	175.6	65.5	0	0	112.1	Y74 C130 I133 I153 S154 I155 I160 A161	Y74-M157 HydrophobicContact CE1-CB 4.06Å; Y74-M157 HydrophobicContact CE1-CE 4.31Å; Y74-M157 HydrophobicContact CE1-SD 4.45Å; Y74-M157 PolarHBondContact OH-SD 3.2Å; C130-M157 HydrophobicContact CB-CE 4.01Å; I133-M157 HydrophobicContact CB-CE 3.94Å; I133-M157 HydrophobicContact CD1-CE 4.44Å; I133-M157 HydrophobicContact CG2-CE 3.83Å; I153-M157 HydrophobicContact CG2-SD 4.28Å; I153-M157 WeakPolarHBondContact O-CG 3.31Å; I153-M157 PolarHBondContact O-N 3.2Å; S154-M157 PolarHBondContact O-N 3.36Å; I155-M157 PolarHBondContact O-N 2.79Å; M157-I160 PolarHBondContact O-N 3.11Å; M157-A161 PolarHBondContact O-N 3.35Å
158	I	98.3	Very high	94.3	Very high	25 Å²	25	65.4 Å²	65.4	13%	0.128	31%	0.31	C	S	.	.	H	α-helix	trans	-61.6	-49.6	175.7	-71.9	166	0	0	0	110.1	L73 Y74 S77 S154 I155 I156 I160 A161 W162	L73-I158 HydrophobicContact CB-CD1 4.08Å; Y74-I158 HydrophobicContact CD1-CD1 4Å; Y74-I158 HydrophobicContact CD1-CG1 3.72Å; Y74-I158 HydrophobicContact CE1-CD1 4.36Å; Y74-I158 HydrophobicContact CE1-CG1 3.98Å; S77-I158 WeakPolarHBondContact OG-CG2 3.37Å; S154-I158 VanDerWaalsContact O-CG1 3.29Å; S154-I158 WeakPolarHBondContact O-CG1 3.39Å; S154-I158 PolarHBondContact O-N 3.17Å; I155-I158 PolarHBondContact O-N 3.42Å; I156-I158 VanDerWaalsContact C-N 3.32Å; I156-I158 PolarHBondContact O-N 3.48Å; I158-I160 VanDerWaalsContact C-N 3.27Å; I158-I160 PolarHBondContact O-N 2.8Å; I158-A161 WeakPolarHBondContact O-CA 3.39Å; I158-A161 WeakPolarHBondContact O-CB 3.49Å; I158-A161 PolarHBondContact O-N 2.89Å; I158-W162 PolarHBondContact O-N 2.94Å
159	L	98.3	Very high	95	Very high	96 Å²	96	60.7 Å²	60.7	50%	0.503	29%	0.29	S	S	.	.	H	α-helix	trans	-56.6	-42.3	178.5	-71	172.4	0	0	0	111.8	I155 I156 A161 W162 I163	I155-L159 HydrophobicContact CG2-CD1 4.01Å; I155-L159 HydrophobicContact CG2-CG 4.29Å; I155-L159 VanDerWaalsContact O-CG 3.31Å; I155-L159 WeakPolarHBondContact O-CG 3.45Å; I155-L159 PolarHBondContact O-N 2.93Å; I156-L159 PolarHBondContact O-N 3.28Å; L159-A161 VanDerWaalsContact C-N 3.33Å; L159-A161 PolarHBondContact O-N 3.21Å; L159-W162 PolarHBondContact O-N 3.36Å; L159-I163 HydrophobicContact CB-CD1 4.46Å; L159-I163 WeakPolarHBondContact O-CB 3.29Å; L159-I163 WeakPolarHBondContact O-CD1 3.28Å; L159-I163 WeakPolarHBondContact O-CG1 3.31Å; L159-I163 PolarHBondContact O-N 3.46Å
160	I	98.1	Very high	95.5	Very high	85 Å²	85	62 Å²	62	44%	0.436	30%	0.298	S	S	.	.	H	α-helix	trans	-59.2	-44.7	173.9	-68.4	166.7	0	0	0	110.8	I156 M157 I158 W162 I163 I164	I156-I160 HydrophobicContact CG2-CD1 3.95Å; I156-I160 VanDerWaalsContact O-CG1 3.32Å; I156-I160 WeakPolarHBondContact O-CG1 3.35Å; I156-I160 PolarHBondContact O-N 2.67Å; M157-I160 PolarHBondContact O-N 3.11Å; I158-I160 VanDerWaalsContact C-N 3.27Å; I158-I160 PolarHBondContact O-N 2.8Å; I160-W162 PolarHBondContact O-N 3.16Å; I160-I163 PolarHBondContact O-N 3.49Å; I160-I164 HydrophobicContact CG2-CD1 3.42Å; I160-I164 VanDerWaalsContact CG2-CD1 3.42Å; I160-I164 HydrophobicContact CG2-CG1 3.94Å; I160-I164 VanDerWaalsContact O-CG1 3.31Å; I160-I164 WeakPolarHBondContact O-CG1 3.24Å; I160-I164 PolarHBondContact O-N 2.83Å
161	A	98	Very high	95.8	Very high	2 Å²	2	61.1 Å²	61.1	2%	0.017	29%	0.291	C	S	.	.	H	α-helix	trans	-63.2	-24.8	178.3	0	0	0	0	0	114.1	L126 M157 I158 L159 P165	L126-A161 HydrophobicContact CB-CB 3.69Å; M157-A161 PolarHBondContact O-N 3.35Å; I158-A161 WeakPolarHBondContact O-CA 3.39Å; I158-A161 WeakPolarHBondContact O-CB 3.49Å; I158-A161 PolarHBondContact O-N 2.89Å; L159-A161 VanDerWaalsContact C-N 3.33Å; L159-A161 PolarHBondContact O-N 3.21Å; A161-P165 WeakPolarHBondContact O-CD 3.38Å; A161-P165 VanDerWaalsContact O-CG 3.32Å; A161-P165 WeakPolarHBondContact O-CG 3.47Å
162	W	98.3	Very high	96	Very high	47 Å²	47	55.5 Å²	55.5	18%	0.178	27%	0.27	C	S	.	.	H	α-helix	trans	-92.5	-23.9	174.3	-73.9	92.4	0	0	0	113.4	S77 L80 A81 L84 F119 L120 I158 L159 I160	S77-W162 PolarHBondContact OG-NE1 3.4Å; L80-W162 HydrophobicContact CB-CZ2 4.35Å; L80-W162 HydrophobicContact CD2-CH2 4.26Å; L80-W162 HydrophobicContact CD2-CZ2 4.03Å; L80-W162 HydrophobicContact CG-CH2 4.14Å; L80-W162 HydrophobicContact CG-CZ2 4.16Å; A81-W162 HydrophobicContact CB-CH2 4.03Å; A81-W162 HydrophobicContact CB-CZ2 4.16Å; L84-W162 HydrophobicContact CD1-CH2 4.18Å; L84-W162 HydrophobicContact CD1-CZ3 4.44Å; F119-W162 AromaticContact CE1-CE3 3.66Å; F119-W162 HydrophobicContact CE1-CE3 3.66Å; F119-W162 AromaticContact CE1-CZ3 3.82Å; F119-W162 HydrophobicContact CE1-CZ3 3.82Å; F119-W162 VanDerWaalsContact CE2-O 3.3Å; F119-W162 WeakPolarHBondContact CE2-O 3.46Å; F119-W162 AromaticContact CZ-CE3 3.88Å; F119-W162 HydrophobicContact CZ-CE3 3.88Å; F119-W162 HydrophobicContact CZ-CZ3 4.48Å; F119-W162 WeakPolarHBondContact CZ-O 3.29Å; L120-W162 HydrophobicContact CD2-CH2 4.48Å; L120-W162 HydrophobicContact CD2-CZ3 4.12Å; I158-W162 PolarHBondContact O-N 2.94Å; L159-W162 PolarHBondContact O-N 3.36Å; I160-W162 PolarHBondContact O-N 3.16Å
163	I	97.7	Very high	95.9	Very high	94 Å²	94	49.7 Å²	49.7	48%	0.482	25%	0.254	S	S	.	.	H	α-helix	trans	-82	-44.4	178.6	-70.6	165.3	0	0	0	111.2	L159 I160 P165 S166 F167	L159-I163 HydrophobicContact CB-CD1 4.46Å; L159-I163 WeakPolarHBondContact O-CB 3.29Å; L159-I163 WeakPolarHBondContact O-CD1 3.28Å; L159-I163 WeakPolarHBondContact O-CG1 3.31Å; L159-I163 PolarHBondContact O-N 3.46Å; I160-I163 PolarHBondContact O-N 3.49Å; I163-P165 VanDerWaalsContact C-CD 3.46Å; I163-S166 WeakPolarHBondContact O-CB 3.44Å; I163-S166 PolarHBondContact O-N 2.96Å; I163-S166 PolarHBondContact O-OG 2.89Å; I163-F167 HydrophobicContact CG2-CE2 4.11Å
164	I	96.5	Very high	95.8	Very high	52 Å²	52	53.1 Å²	53.1	27%	0.267	27%	0.266	S	S	.	.	H	α-helix	trans	-54.1	-43	-176.7	-68.5	173.2	0	0	0	113	M122 L126 I160 S166 F167 L201	M122-I164 HydrophobicContact CE-CG2 3.62Å; L126-I164 HydrophobicContact CD1-CB 3.65Å; L126-I164 HydrophobicContact CD1-CD1 4.46Å; L126-I164 HydrophobicContact CD1-CG2 3.73Å; I160-I164 HydrophobicContact CG2-CD1 3.42Å; I160-I164 VanDerWaalsContact CG2-CD1 3.42Å; I160-I164 HydrophobicContact CG2-CG1 3.94Å; I160-I164 VanDerWaalsContact O-CG1 3.31Å; I160-I164 WeakPolarHBondContact O-CG1 3.24Å; I160-I164 PolarHBondContact O-N 2.83Å; I164-S166 PolarHBondContact O-N 2.82Å; I164-S166 VanDerWaalsContact O-N 3.15Å; I164-F167 WeakPolarHBondContact O-CB 3.45Å; I164-F167 WeakPolarHBondContact O-CD2 3.3Å; I164-F167 PolarHBondContact O-N 2.98Å; I164-L201 HydrophobicContact CG2-CD1 3.97Å; I164-L201 HydrophobicContact CG2-CG 4.49Å
165	P	97.7	Very high	95.6	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-58.7	-26.2	177.2	-27.4	37.8	0	0	0	114.6	F119 M122 L126 A161 I163 F167 S168 I169	F119-P165 HydrophobicContact CD2-CB 3.69Å; F119-P165 HydrophobicContact CE2-CB 4.06Å; F119-P165 HydrophobicContact CG-CB 4.32Å; M122-P165 HydrophobicContact CB-CB 4.07Å; M122-P165 HydrophobicContact CB-CG 4.13Å; M122-P165 HydrophobicContact CE-CB 4.35Å; M122-P165 HydrophobicContact CE-CG 4.24Å; M122-P165 HydrophobicContact CG-CB 4.14Å; M122-P165 HydrophobicContact CG-CG 3.97Å; M122-P165 HydrophobicContact SD-CB 4.06Å; M122-P165 HydrophobicContact SD-CG 4.35Å; L126-P165 HydrophobicContact CD1-CG 3.78Å; A161-P165 WeakPolarHBondContact O-CD 3.38Å; A161-P165 VanDerWaalsContact O-CG 3.32Å; A161-P165 WeakPolarHBondContact O-CG 3.47Å; I163-P165 VanDerWaalsContact C-CD 3.46Å; P165-F167 PolarHBondContact O-N 2.79Å; P165-S168 WeakPolarHBondContact O-CB 3.39Å; P165-S168 PolarHBondContact O-N 3.33Å; P165-I169 PolarHBondContact O-N 3.3Å
166	S	95.4	Very high	95.2	Very high	38 Å²	38	56.2 Å²	56.2	27%	0.266	29%	0.289	S	S	.	.	H	α-helix	trans	-58.3	-38.7	175.8	-53.8	0	0	0	0	110.9	I163 I164 S168 I169 L170	I163-S166 WeakPolarHBondContact O-CB 3.44Å; I163-S166 PolarHBondContact O-N 2.96Å; I163-S166 PolarHBondContact O-OG 2.89Å; I164-S166 PolarHBondContact O-N 2.82Å; I164-S166 VanDerWaalsContact O-N 3.15Å; S166-S168 PolarHBondContact O-N 2.93Å; S166-I169 WeakPolarHBondContact O-CG1 3.21Å; S166-I169 PolarHBondContact O-N 3.24Å; S166-I169 VanDerWaalsContact O-N 3.1Å; S166-L170 VanDerWaalsContact O-CG 3.23Å; S166-L170 WeakPolarHBondContact O-CG 3.42Å; S166-L170 PolarHBondContact O-N 3.11Å; S166-L170 VanDerWaalsContact O-N 3.11Å
167	F	94.4	Very high	94.9	Very high	116 Å²	116	53.3 Å²	53.3	51%	0.509	28%	0.278	S	S	.	.	H	α-helix	trans	-64	-24.1	178.6	-65.1	-80	0	0	0	113.7	I163 I164 P165 Y197 L201	I163-F167 HydrophobicContact CG2-CE2 4.11Å; I164-F167 WeakPolarHBondContact O-CB 3.45Å; I164-F167 WeakPolarHBondContact O-CD2 3.3Å; I164-F167 PolarHBondContact O-N 2.98Å; P165-F167 PolarHBondContact O-N 2.79Å; F167-Y197 VanDerWaalsContact C-OH 3.32Å; F167-Y197 PolarHBondContact O-OH 3.47Å; F167-L201 HydrophobicContact CB-CD2 4.36Å
168	S	93.8	Very high	94.5	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-74.4	-36.3	174.4	-62.3	0	0	0	0	112	M122 P165 S166 Y194 L201	M122-S168 PolarHBondContact SD-OG 3.27Å; P165-S168 WeakPolarHBondContact O-CB 3.39Å; P165-S168 PolarHBondContact O-N 3.33Å; S166-S168 PolarHBondContact O-N 2.93Å; S168-Y194 VanDerWaalsContact O-CE2 3.31Å; S168-Y194 WeakPolarHBondContact O-CE2 3.35Å; S168-Y194 PolarHBondContact O-OH 3.38Å; S168-L201 WeakPolarHBondContact OG-CD2 3.27Å
169	I	95.3	Very high	94.3	Very high	22 Å²	22	57.8 Å²	57.8	11%	0.113	30%	0.295	C	S	.	.	H	α-helix	trans	-89.2	-20.2	-174.2	63.9	168.8	0	0	0	113.9	I118 F119 P165 S166 P172 L173	I118-I169 HydrophobicContact CB-CG2 4.02Å; I118-I169 HydrophobicContact CG2-CG2 3.87Å; F119-I169 HydrophobicContact CB-CD1 4.5Å; F119-I169 HydrophobicContact CB-CG2 4.35Å; F119-I169 HydrophobicContact CD2-CD1 4.15Å; P165-I169 PolarHBondContact O-N 3.3Å; S166-I169 WeakPolarHBondContact O-CG1 3.21Å; S166-I169 PolarHBondContact O-N 3.24Å; S166-I169 VanDerWaalsContact O-N 3.1Å; I169-P172 WeakPolarHBondContact O-CD 3.35Å; I169-L173 HydrophobicContact CB-CD1 4.37Å; I169-L173 HydrophobicContact CD1-CD1 4.16Å; I169-L173 HydrophobicContact CG1-CD1 4.2Å; I169-L173 WeakPolarHBondContact O-CD1 3.41Å; I169-L173 VanDerWaalsContact O-CG 3.29Å; I169-L173 WeakPolarHBondContact O-CG 3.42Å
170	L	94.5	Very high	93.9	Very high	64 Å²	64	55.7 Å²	55.7	34%	0.335	29%	0.287	S	S	.	.	H	α-helix	trans	-61.4	-43	-175.5	-71	166.5	0	0	0	114.3	S166 L173 F174	S166-L170 VanDerWaalsContact O-CG 3.23Å; S166-L170 WeakPolarHBondContact O-CG 3.42Å; S166-L170 PolarHBondContact O-N 3.11Å; S166-L170 VanDerWaalsContact O-N 3.11Å; L170-L173 PolarHBondContact O-N 3.44Å; L170-L173 VanDerWaalsContact O-N 3.16Å; L170-F174 HydrophobicContact CB-CD2 4.18Å; L170-F174 HydrophobicContact CB-CE2 4.14Å; L170-F174 HydrophobicContact CD2-CD2 4.4Å; L170-F174 HydrophobicContact CD2-CE2 3.6Å; L170-F174 HydrophobicContact CD2-CZ 4.4Å; L170-F174 HydrophobicContact CG-CE2 4.35Å; L170-F174 WeakPolarHBondContact O-CD2 3.49Å; L170-F174 PolarHBondContact O-N 3.38Å
171	P	94.3	Very high	93.6	Very high	25 Å²	25	53.7 Å²	53.7	16%	0.162	28%	0.279	C	S	.	.	H	α-helix	trans	-58.8	-50.7	-175	-18.2	28.2	0	0	0	113.5	L173 F174 G175 M176 Y194 Y197	P171-L173 VanDerWaalsContact C-N 3.29Å; P171-L173 PolarHBondContact O-N 2.91Å; P171-F174 PolarHBondContact O-N 3.21Å; P171-G175 PolarHBondContact O-N 2.99Å; P171-M176 CarbonylContact C-O 3.05Å; P171-M176 HydrophobicContact CB-CB 4.2Å; P171-M176 HydrophobicContact CB-CE 4.09Å; P171-M176 CarbonylContact O-C 3.5Å; P171-M176 WeakPolarHBondContact O-CB 3.36Å; P171-M176 PolarHBondContact O-N 3.26Å; P171-Y194 HydrophobicContact CB-CD2 4.49Å; P171-Y197 HydrophobicContact CG-CE1 4.49Å
172	P	92.4	Very high	92.9	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.019	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-35.6	174.6	-25.5	35.7	0	0	0	114.3	I169 G175 M176 H179 Y194	I169-P172 WeakPolarHBondContact O-CD 3.35Å; P172-G175 PolarHBondContact O-N 2.97Å; P172-M176 WeakPolarHBondContact CA-O 3.49Å; P172-H179 VanDerWaalsContact CB-NE2 3.27Å; P172-H179 WeakPolarHBondContact CB-NE2 3.5Å; P172-Y194 VanDerWaalsContact CD-CE2 3.45Å; P172-Y194 HydrophobicContact CG-CD2 4.01Å; P172-Y194 HydrophobicContact CG-CE1 4.33Å; P172-Y194 HydrophobicContact CG-CE2 3.37Å
173	L	91.2	Very high	92	Very high	81 Å²	81	56.8 Å²	56.8	42%	0.424	31%	0.307	S	S	.	.	H	α-helix	trans	-68.5	-34	179.2	-69.2	173.4	0	0	0	112.7	I169 L170 P171 G175	I169-L173 HydrophobicContact CB-CD1 4.37Å; I169-L173 HydrophobicContact CD1-CD1 4.16Å; I169-L173 HydrophobicContact CG1-CD1 4.2Å; I169-L173 WeakPolarHBondContact O-CD1 3.41Å; I169-L173 VanDerWaalsContact O-CG 3.29Å; I169-L173 WeakPolarHBondContact O-CG 3.42Å; L170-L173 PolarHBondContact O-N 3.44Å; L170-L173 VanDerWaalsContact O-N 3.16Å; P171-L173 VanDerWaalsContact C-N 3.29Å; P171-L173 PolarHBondContact O-N 2.91Å; L173-G175 VanDerWaalsContact C-N 3.26Å; L173-G175 PolarHBondContact O-N 2.65Å
174	F	92.4	Very high	91.5	Very high	153 Å²	153	52.3 Å²	52.3	67%	0.671	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	10	174.7	-69.9	-68.5	0	0	0	113.7	L170 P171 M176	L170-F174 HydrophobicContact CB-CD2 4.18Å; L170-F174 HydrophobicContact CB-CE2 4.14Å; L170-F174 HydrophobicContact CD2-CD2 4.4Å; L170-F174 HydrophobicContact CD2-CE2 3.6Å; L170-F174 HydrophobicContact CD2-CZ 4.4Å; L170-F174 HydrophobicContact CG-CE2 4.35Å; L170-F174 WeakPolarHBondContact O-CD2 3.49Å; L170-F174 PolarHBondContact O-N 3.38Å; P171-F174 PolarHBondContact O-N 3.21Å; F174-M176 VanDerWaalsContact C-N 3.34Å; F174-M176 HydrophobicContact CB-CE 4.49Å; F174-M176 PolarHBondContact O-N 3.42Å
175	G	88.4	Confident	91.2	Very high	33 Å²	33	50.2 Å²	50.2	34%	0.34	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	5	175.5	0	0	0	0	0	115.2	P171 P172 L173 K178	P171-G175 PolarHBondContact O-N 2.99Å; P172-G175 PolarHBondContact O-N 2.97Å; L173-G175 VanDerWaalsContact C-N 3.26Å; L173-G175 PolarHBondContact O-N 2.65Å; G175-K178 VanDerWaalsContact CA-CE 3.49Å; G175-K178 VanDerWaalsContact O-CE 3.32Å; G175-K178 WeakPolarHBondContact O-CE 3.3Å; G175-K178 WeakPolarHBondContact O-CG 3.44Å
176	M	89.5	Confident	91	Very high	113 Å²	113	50.6 Å²	50.6	56%	0.557	28%	0.277	S	S	*	.	S	Bend	trans	-84.2	139.3	167.8	-60.8	-177.5	-71.6	0	0	108.8	P171 P172 F174 K178	P171-M176 CarbonylContact C-O 3.05Å; P171-M176 HydrophobicContact CB-CB 4.2Å; P171-M176 HydrophobicContact CB-CE 4.09Å; P171-M176 CarbonylContact O-C 3.5Å; P171-M176 WeakPolarHBondContact O-CB 3.36Å; P171-M176 PolarHBondContact O-N 3.26Å; P172-M176 WeakPolarHBondContact CA-O 3.49Å; F174-M176 VanDerWaalsContact C-N 3.34Å; F174-M176 HydrophobicContact CB-CE 4.49Å; F174-M176 PolarHBondContact O-N 3.42Å; M176-K178 VanDerWaalsContact C-N 3.27Å; M176-K178 PolarHBondContact O-N 3.1Å
177	S	90.7	Very high	90.8	Very high	38 Å²	38	50.1 Å²	50.1	27%	0.266	27%	0.269	S	S	.	.	S	Bend	trans	47.7	50.9	177.9	-56.2	0	0	0	0	112.4	S189 S191	S177-S189 WeakPolarHBondContact O-CB 3.43Å; S177-S189 PolarHBondContact O-OG 2.89Å; S177-S191 WeakPolarHBondContact OG-CB 3.45Å; S177-S191 PolarHBondContact OG-OG 3.11Å
178	K	90.4	Very high	90.8	Very high	140 Å²	140	46.4 Å²	46.4	61%	0.609	25%	0.254	S	S	*	.			trans	-54.6	145.2	-174.4	-67.6	-178.5	-179.2	177.3	0	111.3	G175 M176 S189	G175-K178 VanDerWaalsContact CA-CE 3.49Å; G175-K178 VanDerWaalsContact O-CE 3.32Å; G175-K178 WeakPolarHBondContact O-CE 3.3Å; G175-K178 WeakPolarHBondContact O-CG 3.44Å; M176-K178 VanDerWaalsContact C-N 3.27Å; M176-K178 PolarHBondContact O-N 3.1Å; K178-S189 WeakPolarHBondContact O-CB 3.47Å; K178-S189 PolarHBondContact O-OG 3.34Å
179	H	92.3	Very high	90.7	Very high	11 Å²	11	46.6 Å²	46.6	5%	0.051	26%	0.256	C	S	.	.			trans	-65	152.4	164	-63.6	-39.9	0	0	0	110.2	I114 P172 T181 Y187 S189	I114-H179 HydrophobicContact CD1-CB 3.9Å; I114-H179 WeakPolarHBondContact CG2-NE2 3.31Å; P172-H179 VanDerWaalsContact CB-NE2 3.27Å; P172-H179 WeakPolarHBondContact CB-NE2 3.5Å; H179-T181 HydrophobicContact CB-CG2 4.17Å; H179-T181 PolarHBondContact O-N 3.3Å; H179-Y187 WeakPolarHBondContact CA-O 3.29Å; H179-Y187 WeakPolarHBondContact CB-O 3.48Å; H179-S189 PolarHBondContact ND1-N 3.25Å; H179-S189 VanDerWaalsContact ND1-N 3.18Å
180	V	91.3	Very high	90.4	Very high	53 Å²	53	51.4 Å²	51.4	32%	0.321	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	110.6	173.2	179.7	0	0	0	0	107.7	C185 C186 Y187 Y190	V180-C185 HydrophobicContact CG1-CB 4.27Å; V180-C186 WeakPolarHBondContact O-CA 3.48Å; V180-Y187 PolarHBondContact N-O 3.28Å; V180-Y187 PolarHBondContact O-N 2.95Å; V180-Y190 HydrophobicContact CB-CE2 4.3Å; V180-Y190 HydrophobicContact CG2-CD2 3.48Å; V180-Y190 VanDerWaalsContact CG2-CD2 3.48Å; V180-Y190 HydrophobicContact CG2-CE2 3.52Å
181	T	91	Very high	90.4	Very high	43 Å²	43	49.5 Å²	49.5	26%	0.264	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	140.5	-177.1	65.9	0	0	0	0	109.5	T107 C110 Q111 H179 C185	T107-T181 HydrophobicContact CG2-CG2 4.06Å; T107-T181 WeakPolarHBondContact CG2-OG1 3.35Å; C110-T181 HydrophobicContact CB-CG2 4.16Å; Q111-T181 HydrophobicContact CG-CG2 4.26Å; H179-T181 HydrophobicContact CB-CG2 4.17Å; H179-T181 PolarHBondContact O-N 3.3Å; T181-C185 WeakPolarHBondContact CA-O 3.45Å
182	G	84.3	Confident	90.3	Very high	26 Å²	26	52.3 Å²	52.3	27%	0.268	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	168.4	179	174.2	0	0	0	0	0	110.8	G184 C185	G182-G184 PolarHBondContact O-N 3.34Å; G182-C185 PolarHBondContact N-O 3.25Å; G182-C185 PolarHBondContact O-N 3.19Å
183	V	79.4	Confident	90.4	Very high	88 Å²	88	58.5 Å²	58.5	53%	0.533	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	122.8	174.1	-176.4	0	0	0	0	108.9	E105 C185	E105-V183 HydrophobicContact CG-CG2 4.29Å; V183-C185 PolarHBondContact O-N 3.27Å
184	G	86.5	Confident	90.5	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	83	-19.5	-174.6	0	0	0	0	0	115.1	W102 G182	W102-G184 PolarHBondContact N-O 3.08Å; W102-G184 VanDerWaalsContact O-CA 3.24Å; W102-G184 WeakPolarHBondContact O-CA 3.17Å; W102-G184 PolarHBondContact O-N 2.79Å; W102-G184 VanDerWaalsContact O-N 3.11Å; G182-G184 PolarHBondContact O-N 3.34Å
185	C	90	Very high	90.6	Very high	7 Å²	7	48 Å²	48	5%	0.047	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	124.7	-168.9	-53.4	0	0	0	0	112.7	C23 V180 T181 G182 V183	C23-C185 HydrophobicContact CB-CB 3.82Å; C23-C185 WeakPolarHBondContact CB-SG 3.34Å; C23-C185 PolarHBondContact N-SG 3.06Å; C23-C185 WeakPolarHBondContact SG-CB 3.27Å; C23-C185 CovalentContact SG-SG 2.03Å; C23-C185 PolarHBondContact SG-SG 2.88Å; V180-C185 HydrophobicContact CG1-CB 4.27Å; T181-C185 WeakPolarHBondContact CA-O 3.45Å; G182-C185 PolarHBondContact N-O 3.25Å; G182-C185 PolarHBondContact O-N 3.19Å; V183-C185 PolarHBondContact O-N 3.27Å
186	C	93.6	Very high	90.9	Very high	9 Å²	9	49.5 Å²	49.5	6%	0.061	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	94.4	167.5	-171.5	0	0	0	0	110.8	W102 C110 V180	W102-C186 HydrophobicContact CB-CB 3.68Å; W102-C186 HydrophobicContact CD2-CB 3.41Å; W102-C186 VanDerWaalsContact CD2-CB 3.41Å; W102-C186 HydrophobicContact CE3-CB 3.72Å; W102-C186 HydrophobicContact CG-CB 3.4Å; C110-C186 WeakPolarHBondContact CA-SG 2.94Å; C110-C186 HydrophobicContact CB-CB 3.91Å; C110-C186 WeakPolarHBondContact CB-SG 3.4Å; C110-C186 WeakPolarHBondContact SG-CA 3.4Å; C110-C186 WeakPolarHBondContact SG-CB 3.5Å; C110-C186 CovalentContact SG-SG 2.04Å; C110-C186 PolarHBondContact SG-SG 3.45Å; V180-C186 WeakPolarHBondContact O-CA 3.48Å
187	Y	92.1	Very high	91.2	Very high	27 Å²	27	48.6 Å²	48.6	11%	0.106	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	144.9	-174.9	-65.7	-86.2	0	0	0	112.4	C23 F25 I114 H179 V180 E455	C23-Y187 HydrophobicContact CB-CE2 3.93Å; F25-Y187 WeakPolarHBondContact CD2-OH 3.32Å; F25-Y187 HydrophobicContact CE2-CE2 4.3Å; F25-Y187 AromaticContact CE2-CZ 3.87Å; F25-Y187 WeakPolarHBondContact CE2-OH 3.42Å; I114-Y187 VanDerWaalsContact CD1-C 3.5Å; I114-Y187 WeakPolarHBondContact CD1-O 3.32Å; H179-Y187 WeakPolarHBondContact CA-O 3.29Å; H179-Y187 WeakPolarHBondContact CB-O 3.48Å; V180-Y187 PolarHBondContact N-O 3.28Å; V180-Y187 PolarHBondContact O-N 2.95Å; Y187-E455 WeakPolarHBondContact CE1-OE1 3.15Å; Y187-E455 VanDerWaalsContact CE1-OE2 3.23Å; Y187-E455 WeakPolarHBondContact CE1-OE2 3.44Å; Y187-E455 VanDerWaalsContact OH-CD 3.26Å; Y187-E455 PolarHBondContact OH-OE1 3.02Å; Y187-E455 PolarHBondContact OH-OE2 3.47Å
188	I	92.9	Very high	91.4	Very high	38 Å²	38	47.1 Å²	47.1	20%	0.195	24%	0.235	C	C	.	.			trans	-56.5	155	168.9	-165.6	163.9	0	0	0	110.4	I118 Y190 Y194 Y443	I118-I188 HydrophobicContact CD1-CD1 3.67Å; I118-I188 HydrophobicContact CD1-CG1 4.29Å; I118-I188 HydrophobicContact CG1-CD1 4.34Å; I188-Y190 PolarHBondContact O-N 3.38Å; I188-Y194 HydrophobicContact CD1-CE1 4.17Å; I188-Y194 HydrophobicContact CG1-CE1 3.91Å; I188-Y443 HydrophobicContact CD1-CE1 4.48Å; I188-Y443 HydrophobicContact CD1-CE2 4Å; I188-Y443 WeakPolarHBondContact CD1-OH 3.34Å; I188-Y443 HydrophobicContact CG1-CE2 4.34Å; I188-Y443 WeakPolarHBondContact CG1-OH 3.45Å; I188-Y443 HydrophobicContact CG2-CD2 4.45Å; I188-Y443 HydrophobicContact CG2-CE2 3.66Å
189	S	92.1	Very high	91.6	Very high	5 Å²	5	40.5 Å²	40.5	4%	0.035	21%	0.206	C	C	.	.			trans	-60.2	140.5	-174.8	-167.8	0	0	0	0	112.2	S177 K178 H179 S191 R195	S177-S189 WeakPolarHBondContact O-CB 3.43Å; S177-S189 PolarHBondContact O-OG 2.89Å; K178-S189 WeakPolarHBondContact O-CB 3.47Å; K178-S189 PolarHBondContact O-OG 3.34Å; H179-S189 PolarHBondContact ND1-N 3.25Å; H179-S189 VanDerWaalsContact ND1-N 3.18Å; S189-S191 VanDerWaalsContact C-N 3.31Å; S189-S191 PolarHBondContact OG-N 2.95Å; S189-R195 PolarHBondContact O-NE 3.25Å
190	Y	90.2	Very high	91.7	Very high	122 Å²	122	42.7 Å²	42.7	48%	0.478	22%	0.22	S	C	.	.			trans	-83.9	-2.7	170.5	-65.4	-76.5	0	0	0	113.1	V180 I188 K192 R195	V180-Y190 HydrophobicContact CB-CE2 4.3Å; V180-Y190 HydrophobicContact CG2-CD2 3.48Å; V180-Y190 VanDerWaalsContact CG2-CD2 3.48Å; V180-Y190 HydrophobicContact CG2-CE2 3.52Å; I188-Y190 PolarHBondContact O-N 3.38Å; Y190-K192 PolarHBondContact O-N 3.44Å; Y190-R195 VanDerWaalsContact CE1-NH2 3.29Å
191	S	92.7	Very high	91.9	Very high	25 Å²	25	41.7 Å²	41.7	18%	0.175	21%	0.213	C	C	.	.			trans	-59.6	121	176.3	159.1	0	0	0	0	110.7	S177 S189 E193 Y194 R195	S177-S191 WeakPolarHBondContact OG-CB 3.45Å; S177-S191 PolarHBondContact OG-OG 3.11Å; S189-S191 VanDerWaalsContact C-N 3.31Å; S189-S191 PolarHBondContact OG-N 2.95Å; S191-E193 VanDerWaalsContact C-N 3.3Å; S191-E193 PolarHBondContact O-N 2.92Å; S191-E193 PolarHBondContact OG-OE2 3.21Å; S191-Y194 PolarHBondContact O-N 3.45Å; S191-Y194 PolarHBondContact OG-N 2.93Å; S191-R195 VanDerWaalsContact O-CG 3.31Å; S191-R195 WeakPolarHBondContact O-CG 3.21Å; S191-R195 PolarHBondContact O-N 3.37Å
192	K	93.4	Very high	92	Very high	83 Å²	83	40 Å²	40	36%	0.361	20%	0.204	S	C	.	.	H	α-helix	trans	-54.7	-46	179.2	177.4	167.5	-172.9	146.5	0	112	Y190 Y194 R195 I196 A447	Y190-K192 PolarHBondContact O-N 3.44Å; K192-Y194 PolarHBondContact O-N 3.41Å; K192-R195 PolarHBondContact O-N 3.42Å; K192-I196 HydrophobicContact CG-CD1 3.86Å; K192-I196 VanDerWaalsContact O-CG1 3.3Å; K192-I196 WeakPolarHBondContact O-CG1 3.46Å; K192-I196 PolarHBondContact O-N 2.94Å; K192-A447 VanDerWaalsContact CD-O 3.23Å; K192-A447 WeakPolarHBondContact CD-O 3.41Å; K192-A447 WeakPolarHBondContact CE-O 3.4Å; K192-A447 HydrophobicContact CG-CB 4.38Å; K192-A447 WeakPolarHBondContact CG-O 3.22Å; K192-A447 PolarHBondContact NZ-O 2.96Å; K192-A447 VanDerWaalsContact NZ-O 3.1Å
193	E	93.4	Very high	92.5	Very high	133 Å²	133	39.5 Å²	39.5	62%	0.621	19%	0.193	S	C	*	.	H	α-helix	trans	-60.8	-46.9	-179.7	-56.5	72.9	-157.5	0	0	110.5	S191 I196 Y197	S191-E193 VanDerWaalsContact C-N 3.3Å; S191-E193 PolarHBondContact O-N 2.92Å; S191-E193 PolarHBondContact OG-OE2 3.21Å; E193-I196 PolarHBondContact O-N 3.17Å; E193-Y197 VanDerWaalsContact O-CB 3.25Å; E193-Y197 WeakPolarHBondContact O-CB 3.34Å; E193-Y197 PolarHBondContact O-N 2.97Å
194	Y	94.8	Very high	93.3	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.016	18%	0.182	C	C	.	.	H	α-helix	trans	-64.8	-43.2	178.7	178.4	-97	0	0	0	112.3	I118 S168 P171 P172 I188 S191 K192 I196 Y197 S198	I118-Y194 WeakPolarHBondContact CD1-OH 3.23Å; S168-Y194 VanDerWaalsContact O-CE2 3.31Å; S168-Y194 WeakPolarHBondContact O-CE2 3.35Å; S168-Y194 PolarHBondContact O-OH 3.38Å; P171-Y194 HydrophobicContact CB-CD2 4.49Å; P172-Y194 VanDerWaalsContact CD-CE2 3.45Å; P172-Y194 HydrophobicContact CG-CD2 4.01Å; P172-Y194 HydrophobicContact CG-CE1 4.33Å; P172-Y194 HydrophobicContact CG-CE2 3.37Å; I188-Y194 HydrophobicContact CD1-CE1 4.17Å; I188-Y194 HydrophobicContact CG1-CE1 3.91Å; S191-Y194 PolarHBondContact O-N 3.45Å; S191-Y194 PolarHBondContact OG-N 2.93Å; K192-Y194 PolarHBondContact O-N 3.41Å; Y194-I196 PolarHBondContact O-N 3.49Å; Y194-Y197 PolarHBondContact O-N 2.94Å; Y194-S198 VanDerWaalsContact O-CB 3.25Å; Y194-S198 WeakPolarHBondContact O-CB 3.23Å; Y194-S198 PolarHBondContact O-N 2.95Å; Y194-S198 PolarHBondContact O-OG 3.43Å
195	R	94.6	Very high	93.7	Very high	9 Å²	9	42.9 Å²	42.9	3%	0.034	21%	0.205	C	C	.	.	H	α-helix	trans	-61.2	-44.8	178.1	-68.9	-172.5	163.7	-158.1	-6.7	111.7	S189 Y190 S191 K192 S198 S199 Y443 E446 A447	S189-R195 PolarHBondContact O-NE 3.25Å; Y190-R195 VanDerWaalsContact CE1-NH2 3.29Å; S191-R195 VanDerWaalsContact O-CG 3.31Å; S191-R195 WeakPolarHBondContact O-CG 3.21Å; S191-R195 PolarHBondContact O-N 3.37Å; K192-R195 PolarHBondContact O-N 3.42Å; R195-S198 PolarHBondContact O-OG 3.32Å; R195-S199 WeakPolarHBondContact O-CB 3.36Å; R195-S199 PolarHBondContact O-N 3.39Å; R195-S199 PolarHBondContact O-OG 3.24Å; R195-Y443 HydrophobicContact CB-CE1 4.12Å; R195-Y443 HydrophobicContact CB-CE2 4.35Å; R195-Y443 HydrophobicContact CG-CD2 4.46Å; R195-Y443 HydrophobicContact CG-CE1 4.26Å; R195-Y443 HydrophobicContact CG-CE2 3.66Å; R195-Y443 WeakPolarHBondContact CG-OH 3.4Å; R195-E446 IonicContact CZ-OE2 3.58Å; R195-E446 IonicContact NH1-OE2 2.71Å; R195-E446 PolarHBondContact NH1-OE2 2.56Å; R195-E446 IonicContact NH2-OE2 3.33Å; R195-E446 PolarHBondContact NH2-OE2 3.33Å; R195-A447 HydrophobicContact CB-CB 3.7Å; R195-A447 HydrophobicContact CG-CB 4.46Å
196	I	94.9	Very high	94	Very high	65 Å²	65	42.8 Å²	42.8	33%	0.333	20%	0.204	S	C	.	.	H	α-helix	trans	-64	-53.7	177	-66.7	167.2	0	0	0	110.2	K192 E193 Y194 S198 S199 V200 L444 A447	K192-I196 HydrophobicContact CG-CD1 3.86Å; K192-I196 VanDerWaalsContact O-CG1 3.3Å; K192-I196 WeakPolarHBondContact O-CG1 3.46Å; K192-I196 PolarHBondContact O-N 2.94Å; E193-I196 PolarHBondContact O-N 3.17Å; Y194-I196 PolarHBondContact O-N 3.49Å; I196-S198 PolarHBondContact O-N 3.41Å; I196-S199 PolarHBondContact O-N 2.87Å; I196-V200 VanDerWaalsContact O-CG2 3.3Å; I196-V200 WeakPolarHBondContact O-CG2 3.01Å; I196-V200 PolarHBondContact O-N 2.89Å; I196-L444 HydrophobicContact CB-CD1 4.47Å; I196-L444 HydrophobicContact CG1-CD1 3.89Å; I196-A447 HydrophobicContact CG1-CB 4.29Å
197	Y	94.3	Very high	94.1	Very high	95 Å²	95	44 Å²	44	37%	0.373	21%	0.21	S	C	.	.	H	α-helix	trans	-57.4	-52.4	-178.2	162.4	-104.8	0	0	0	112.5	F167 P171 E193 Y194 S199 V200 L201	F167-Y197 VanDerWaalsContact C-OH 3.32Å; F167-Y197 PolarHBondContact O-OH 3.47Å; P171-Y197 HydrophobicContact CG-CE1 4.49Å; E193-Y197 VanDerWaalsContact O-CB 3.25Å; E193-Y197 WeakPolarHBondContact O-CB 3.34Å; E193-Y197 PolarHBondContact O-N 2.97Å; Y194-Y197 PolarHBondContact O-N 2.94Å; Y197-S199 PolarHBondContact O-N 3.2Å; Y197-V200 PolarHBondContact O-N 3Å; Y197-L201 HydrophobicContact CE2-CD2 4.28Å; Y197-L201 WeakPolarHBondContact O-CB 3.2Å; Y197-L201 PolarHBondContact O-N 2.97Å
198	S	94.7	Very high	94.4	Very high	7 Å²	7	48.1 Å²	48.1	5%	0.049	23%	0.233	C	C	.	.	H	α-helix	trans	-66.3	-37.5	-177.8	60.3	0	0	0	0	112	Y194 R195 I196 L201 A202 Y443	Y194-S198 VanDerWaalsContact O-CB 3.25Å; Y194-S198 WeakPolarHBondContact O-CB 3.23Å; Y194-S198 PolarHBondContact O-N 2.95Å; Y194-S198 PolarHBondContact O-OG 3.43Å; R195-S198 PolarHBondContact O-OG 3.32Å; I196-S198 PolarHBondContact O-N 3.41Å; S198-L201 PolarHBondContact O-N 2.88Å; S198-A202 WeakPolarHBondContact O-CB 3.49Å; S198-A202 PolarHBondContact O-N 3.25Å; S198-Y443 PolarHBondContact OG-OH 2.66Å
199	S	94.9	Very high	94.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.6	-44.6	174.9	-61.2	0	0	0	0	112.3	R195 I196 Y197 L201 Y203 F204 Y443	R195-S199 WeakPolarHBondContact O-CB 3.36Å; R195-S199 PolarHBondContact O-N 3.39Å; R195-S199 PolarHBondContact O-OG 3.24Å; I196-S199 PolarHBondContact O-N 2.87Å; Y197-S199 PolarHBondContact O-N 3.2Å; S199-L201 VanDerWaalsContact C-N 3.32Å; S199-L201 PolarHBondContact O-N 3Å; S199-Y203 WeakPolarHBondContact O-CB 3.5Å; S199-Y203 PolarHBondContact O-N 3.47Å; S199-F204 WeakPolarHBondContact O-CD2 3.49Å; S199-F204 PolarHBondContact O-N 3.31Å; S199-Y443 WeakPolarHBondContact OG-CD1 3.34Å; S199-Y443 WeakPolarHBondContact OG-CE1 3.25Å
200	V	94.9	Very high	94.8	Very high	58 Å²	58	49.5 Å²	49.5	35%	0.352	24%	0.24	S	C	.	.	I	π-helix	trans	-60.4	-46.8	178.7	168.7	0	0	0	0	110.3	I196 Y197 F204 L205	I196-V200 VanDerWaalsContact O-CG2 3.3Å; I196-V200 WeakPolarHBondContact O-CG2 3.01Å; I196-V200 PolarHBondContact O-N 2.89Å; Y197-V200 PolarHBondContact O-N 3Å; V200-F204 HydrophobicContact CG2-CD2 4.5Å; V200-F204 PolarHBondContact O-N 3.48Å; V200-L205 HydrophobicContact CG1-CD1 4.05Å; V200-L205 HydrophobicContact CG1-CG 3.9Å; V200-L205 WeakPolarHBondContact O-CB 3.04Å; V200-L205 WeakPolarHBondContact O-CG 3.39Å; V200-L205 PolarHBondContact O-N 3.47Å
201	L	94.6	Very high	95.1	Very high	31 Å²	31	45.1 Å²	45.1	16%	0.162	23%	0.232	C	C	.	.	I	π-helix	trans	-72.9	-40	-176.7	-173.9	57.4	0	0	0	112.9	M122 I164 F167 S168 Y197 S198 S199 L205 P206	M122-L201 HydrophobicContact CE-CD1 4.17Å; M122-L201 HydrophobicContact CE-CD2 3.99Å; M122-L201 HydrophobicContact CE-CG 3.52Å; I164-L201 HydrophobicContact CG2-CD1 3.97Å; I164-L201 HydrophobicContact CG2-CG 4.49Å; F167-L201 HydrophobicContact CB-CD2 4.36Å; S168-L201 WeakPolarHBondContact OG-CD2 3.27Å; Y197-L201 HydrophobicContact CE2-CD2 4.28Å; Y197-L201 WeakPolarHBondContact O-CB 3.2Å; Y197-L201 PolarHBondContact O-N 2.97Å; S198-L201 PolarHBondContact O-N 2.88Å; S199-L201 VanDerWaalsContact C-N 3.32Å; S199-L201 PolarHBondContact O-N 3Å; L201-L205 HydrophobicContact CD1-CD1 4.22Å; L201-P206 WeakPolarHBondContact O-CD 3.36Å
202	A	93.7	Very high	95.3	Very high	9 Å²	9	50.6 Å²	50.6	7%	0.074	25%	0.249	C	C	.	.	I	π-helix	trans	-81.2	-25.3	-176.7	0	0	0	0	0	114	M122 I125 S198 F440	M122-A202 HydrophobicContact CG-CB 4.15Å; M122-A202 HydrophobicContact SD-CB 3.92Å; I125-A202 WeakPolarHBondContact CD1-O 3.18Å; S198-A202 WeakPolarHBondContact O-CB 3.49Å; S198-A202 PolarHBondContact O-N 3.25Å; A202-F440 HydrophobicContact CB-CE1 4.07Å; A202-F440 HydrophobicContact CB-CZ 3.94Å
203	Y	95.1	Very high	95.5	Very high	14 Å²	14	47.1 Å²	47.1	6%	0.055	24%	0.235	C	C	.	.	I	π-helix	trans	-132.5	-57.5	-171.2	-175.4	-107	0	0	0	114.7	S199 P206 I207 F432 W436 T437 F440	S199-Y203 WeakPolarHBondContact O-CB 3.5Å; S199-Y203 PolarHBondContact O-N 3.47Å; Y203-P206 WeakPolarHBondContact O-CD 3.46Å; Y203-I207 HydrophobicContact CE1-CG2 4.45Å; Y203-I207 WeakPolarHBondContact O-CB 3.39Å; Y203-I207 WeakPolarHBondContact O-CG2 3.38Å; Y203-I207 PolarHBondContact O-N 3.33Å; Y203-F432 HydrophobicContact CD2-CE1 4.41Å; Y203-F432 HydrophobicContact CD2-CE2 4.21Å; Y203-F432 AromaticContact CD2-CZ 3.6Å; Y203-F432 HydrophobicContact CD2-CZ 3.6Å; Y203-F432 HydrophobicContact CE2-CE1 4.08Å; Y203-F432 HydrophobicContact CE2-CE2 4.3Å; Y203-F432 AromaticContact CE2-CZ 3.64Å; Y203-F432 HydrophobicContact CE2-CZ 3.64Å; Y203-W436 HydrophobicContact CD2-CB 4.21Å; Y203-W436 HydrophobicContact CE2-CB 4.04Å; Y203-T437 PolarHBondContact OH-OG1 3.45Å; Y203-F440 VanDerWaalsContact CB-CD2 3.43Å; Y203-F440 VanDerWaalsContact CB-CG 3.49Å; Y203-F440 HydrophobicContact CD1-CB 3.72Å; Y203-F440 AromaticContact CD1-CD2 3.95Å; Y203-F440 HydrophobicContact CD1-CD2 3.95Å; Y203-F440 AromaticContact CD1-CG 3.83Å; Y203-F440 HydrophobicContact CD1-CG 3.83Å; Y203-F440 AromaticContact CD2-CD2 3.32Å; Y203-F440 HydrophobicContact CD2-CD2 3.32Å; Y203-F440 AromaticContact CD2-CE2 3.65Å; Y203-F440 HydrophobicContact CD2-CE2 3.65Å; Y203-F440 HydrophobicContact CD2-CG 4.06Å; Y203-F440 HydrophobicContact CE1-CB 4.24Å; Y203-F440 HydrophobicContact CE2-CD2 4.1Å; Y203-F440 HydrophobicContact CG-CB 3.94Å; Y203-F440 HydrophobicContact CG-CD1 4.16Å; Y203-F440 AromaticContact CG-CD2 3.26Å; Y203-F440 HydrophobicContact CG-CD2 3.26Å; Y203-F440 AromaticContact CG-CE2 3.76Å; Y203-F440 HydrophobicContact CG-CE2 3.76Å; Y203-F440 AromaticContact CG-CG 3.51Å; Y203-F440 HydrophobicContact CG-CG 3.51Å; Y203-F440 HydrophobicContact CG-CZ 4.38Å
204	F	95.4	Very high	95.6	Very high	65 Å²	65	42.2 Å²	42.2	29%	0.285	21%	0.212	S	C	.	.	I	π-helix	trans	-69.3	-40.8	-170.4	-65.9	-80.7	0	0	0	112.9	S199 V200 I207 I208 L444	S199-F204 WeakPolarHBondContact O-CD2 3.49Å; S199-F204 PolarHBondContact O-N 3.31Å; V200-F204 HydrophobicContact CG2-CD2 4.5Å; V200-F204 PolarHBondContact O-N 3.48Å; F204-I207 WeakPolarHBondContact O-CG2 3.35Å; F204-I208 WeakPolarHBondContact O-CB 3.14Å; F204-I208 WeakPolarHBondContact O-CD1 3.48Å; F204-I208 WeakPolarHBondContact O-CG1 3.4Å; F204-I208 PolarHBondContact O-N 3.32Å; F204-I208 VanDerWaalsContact O-N 3.09Å; F204-L444 HydrophobicContact CE2-CD2 3.72Å; F204-L444 HydrophobicContact CZ-CD2 3.73Å
205	L	95.9	Very high	95.7	Very high	95 Å²	95	48 Å²	48	50%	0.497	24%	0.243	S	C	.	.	H	α-helix	trans	-64.5	-51.1	174.2	-76.1	176.1	0	0	0	111.7	V200 L201 I207 I208 L209	V200-L205 HydrophobicContact CG1-CD1 4.05Å; V200-L205 HydrophobicContact CG1-CG 3.9Å; V200-L205 WeakPolarHBondContact O-CB 3.04Å; V200-L205 WeakPolarHBondContact O-CG 3.39Å; V200-L205 PolarHBondContact O-N 3.47Å; L201-L205 HydrophobicContact CD1-CD1 4.22Å; L205-I207 PolarHBondContact O-N 2.86Å; L205-I208 PolarHBondContact O-N 2.97Å; L205-L209 WeakPolarHBondContact O-CB 3.49Å; L205-L209 PolarHBondContact O-N 3.37Å
206	P	96.3	Very high	95.8	Very high	4 Å²	4	52.2 Å²	52.2	3%	0.026	26%	0.258	C	S	.	.	H	α-helix	trans	-54.9	-44.5	173.6	-30.7	36.3	0	0	0	114.4	I125 L126 L201 Y203 L209 I210	I125-P206 HydrophobicContact CG2-CB 3.47Å; I125-P206 VanDerWaalsContact CG2-CB 3.47Å; I125-P206 HydrophobicContact CG2-CG 3.88Å; L126-P206 HydrophobicContact CD2-CG 4.26Å; L201-P206 WeakPolarHBondContact O-CD 3.36Å; Y203-P206 WeakPolarHBondContact O-CD 3.46Å; P206-L209 PolarHBondContact O-N 3.4Å; P206-I210 WeakPolarHBondContact O-CB 3.38Å; P206-I210 VanDerWaalsContact O-CG1 3.23Å; P206-I210 WeakPolarHBondContact O-CG1 3.48Å; P206-I210 PolarHBondContact O-N 3.36Å
207	I	95.7	Very high	95.8	Very high	34 Å²	34	49.2 Å²	49.2	17%	0.174	24%	0.243	C	C	.	.	H	α-helix	trans	-70.5	-38.5	-176	-162.6	67.8	0	0	0	112.6	Y203 F204 L205 G211 F432 I433	Y203-I207 HydrophobicContact CE1-CG2 4.45Å; Y203-I207 WeakPolarHBondContact O-CB 3.39Å; Y203-I207 WeakPolarHBondContact O-CG2 3.38Å; Y203-I207 PolarHBondContact O-N 3.33Å; F204-I207 WeakPolarHBondContact O-CG2 3.35Å; L205-I207 PolarHBondContact O-N 2.86Å; I207-G211 PolarHBondContact O-N 3.47Å; I207-F432 HydrophobicContact CD1-CD1 4.07Å; I207-F432 HydrophobicContact CD1-CE1 3.67Å; I207-I433 HydrophobicContact CD1-CD1 3.74Å; I207-I433 HydrophobicContact CD1-CG1 3.29Å; I207-I433 HydrophobicContact CG1-CG1 4.39Å
208	I	97.1	Very high	95.9	Very high	115 Å²	115	49.5 Å²	49.5	59%	0.59	25%	0.247	S	C	*	.	H	α-helix	trans	-62.9	-45.6	174.4	-70.4	167.9	0	0	0	109.8	F204 L205 G211 Y212	F204-I208 WeakPolarHBondContact O-CB 3.14Å; F204-I208 WeakPolarHBondContact O-CD1 3.48Å; F204-I208 WeakPolarHBondContact O-CG1 3.4Å; F204-I208 PolarHBondContact O-N 3.32Å; F204-I208 VanDerWaalsContact O-N 3.09Å; L205-I208 PolarHBondContact O-N 2.97Å; I208-G211 PolarHBondContact O-N 2.99Å; I208-Y212 WeakPolarHBondContact O-CB 3.16Å; I208-Y212 PolarHBondContact O-N 3.07Å
209	L	97.2	Very high	96	Very high	70 Å²	70	55.2 Å²	55.2	37%	0.366	27%	0.268	S	S	.	.	H	α-helix	trans	-60.1	-53.1	177.4	175	62.7	0	0	0	111.4	C129 I133 L205 P206 G211 Y212 V213	C129-L209 HydrophobicContact CB-CD2 3.98Å; I133-L209 HydrophobicContact CD1-CD2 4.47Å; L205-L209 WeakPolarHBondContact O-CB 3.49Å; L205-L209 PolarHBondContact O-N 3.37Å; P206-L209 PolarHBondContact O-N 3.4Å; L209-G211 VanDerWaalsContact C-N 3.32Å; L209-G211 PolarHBondContact O-N 3.36Å; L209-Y212 PolarHBondContact O-N 3Å; L209-V213 HydrophobicContact CD1-CG2 4.16Å; L209-V213 WeakPolarHBondContact O-CB 3.16Å; L209-V213 VanDerWaalsContact O-CG2 3.24Å; L209-V213 WeakPolarHBondContact O-CG2 3.35Å; L209-V213 PolarHBondContact O-N 3Å
210	I	96.4	Very high	96	Very high	2 Å²	2	56.2 Å²	56.2	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-59.6	-45.1	179.7	-71.1	170.1	0	0	0	110.4	L128 P206 V213 H214 I429	L128-I210 HydrophobicContact CB-CD1 4.3Å; P206-I210 WeakPolarHBondContact O-CB 3.38Å; P206-I210 VanDerWaalsContact O-CG1 3.23Å; P206-I210 WeakPolarHBondContact O-CG1 3.48Å; P206-I210 PolarHBondContact O-N 3.36Å; I210-V213 PolarHBondContact O-N 3.45Å; I210-H214 WeakPolarHBondContact O-CB 3.05Å; I210-H214 PolarHBondContact O-N 3.22Å; I210-H214 PolarHBondContact O-ND1 3Å; I210-I429 HydrophobicContact CG2-CB 4.36Å; I210-I429 HydrophobicContact CG2-CD1 3.54Å; I210-I429 HydrophobicContact CG2-CG1 3.86Å; I210-I429 HydrophobicContact CG2-CG2 3.57Å
211	G	96.5	Very high	95.9	Very high	30 Å²	30	54.6 Å²	54.6	31%	0.309	26%	0.262	S	S	.	.	H	α-helix	trans	-59.2	-51.1	178.1	0	0	0	0	0	112.1	I207 I208 L209 V213 H214 L215	I207-G211 PolarHBondContact O-N 3.47Å; I208-G211 PolarHBondContact O-N 2.99Å; L209-G211 VanDerWaalsContact C-N 3.32Å; L209-G211 PolarHBondContact O-N 3.36Å; G211-V213 VanDerWaalsContact C-N 3.35Å; G211-V213 PolarHBondContact O-N 3.29Å; G211-H214 PolarHBondContact O-N 3.11Å; G211-L215 WeakPolarHBondContact O-CB 3.33Å; G211-L215 VanDerWaalsContact O-CG 3.27Å; G211-L215 WeakPolarHBondContact O-CG 3.48Å; G211-L215 PolarHBondContact O-N 2.77Å
212	Y	97.5	Very high	95.9	Very high	140 Å²	140	60.6 Å²	60.6	55%	0.549	28%	0.283	S	S	.	.	H	α-helix	trans	-56.1	-48.7	175.8	170.5	-98.1	0	0	0	111.9	I208 L209 H214 L215 R216	I208-Y212 WeakPolarHBondContact O-CB 3.16Å; I208-Y212 PolarHBondContact O-N 3.07Å; L209-Y212 PolarHBondContact O-N 3Å; Y212-H214 VanDerWaalsContact C-N 3.32Å; Y212-H214 PolarHBondContact O-N 2.78Å; Y212-L215 PolarHBondContact O-N 2.85Å; Y212-R216 HydrophobicContact CD2-CG 4.48Å; Y212-R216 HydrophobicContact CE1-CG 4.04Å; Y212-R216 HydrophobicContact CE2-CG 4.02Å; Y212-R216 WeakPolarHBondContact O-CG 3.05Å; Y212-R216 PolarHBondContact O-N 3.38Å
213	V	97.2	Very high	95.9	Very high	9 Å²	9	68.1 Å²	68.1	6%	0.055	31%	0.309	C	S	.	.	H	α-helix	trans	-60.3	-42.8	180	171.6	0	0	0	0	110.9	S132 I133 Y136 L209 I210 G211 R216 I217	S132-V213 WeakPolarHBondContact O-CG1 3.49Å; I133-V213 HydrophobicContact CG1-CG2 4.43Å; Y136-V213 HydrophobicContact CG-CG1 4.3Å; L209-V213 HydrophobicContact CD1-CG2 4.16Å; L209-V213 WeakPolarHBondContact O-CB 3.16Å; L209-V213 VanDerWaalsContact O-CG2 3.24Å; L209-V213 WeakPolarHBondContact O-CG2 3.35Å; L209-V213 PolarHBondContact O-N 3Å; I210-V213 PolarHBondContact O-N 3.45Å; G211-V213 VanDerWaalsContact C-N 3.35Å; G211-V213 PolarHBondContact O-N 3.29Å; V213-R216 WeakPolarHBondContact O-CB 3.17Å; V213-R216 PolarHBondContact O-N 2.96Å; V213-I217 HydrophobicContact CG1-CD1 3.98Å; V213-I217 HydrophobicContact CG1-CG1 4.49Å; V213-I217 VanDerWaalsContact O-CG1 3.29Å; V213-I217 WeakPolarHBondContact O-CG1 3.23Å; V213-I217 PolarHBondContact O-N 3.47Å
214	H	95.6	Very high	95.7	Very high	30 Å²	30	70 Å²	70	14%	0.139	32%	0.316	C	S	.	.	H	α-helix	trans	-72.2	-36.3	-179.6	-79.2	70.8	0	0	0	113.4	S132 I210 G211 Y212 R216 I217 F218 I429	S132-H214 PolarHBondContact OG-CE1 2.94Å; I210-H214 WeakPolarHBondContact O-CB 3.05Å; I210-H214 PolarHBondContact O-N 3.22Å; I210-H214 PolarHBondContact O-ND1 3Å; G211-H214 PolarHBondContact O-N 3.11Å; Y212-H214 VanDerWaalsContact C-N 3.32Å; Y212-H214 PolarHBondContact O-N 2.78Å; H214-R216 VanDerWaalsContact C-N 3.3Å; H214-R216 PolarHBondContact O-N 3.12Å; H214-I217 PolarHBondContact O-N 3.33Å; H214-F218 WeakPolarHBondContact O-CB 3.47Å; H214-F218 PolarHBondContact O-N 3.06Å; H214-I429 WeakPolarHBondContact CE1-CD1 3.48Å; H214-I429 WeakPolarHBondContact NE2-CD1 3.45Å
215	L	96.7	Very high	95.4	Very high	127 Å²	127	69.3 Å²	69.3	67%	0.665	32%	0.319	S	S	*	.	H	α-helix	trans	-60.4	-42.6	171.2	-70.6	171.9	0	0	0	110.8	G211 Y212 F218 Y219	G211-L215 WeakPolarHBondContact O-CB 3.33Å; G211-L215 VanDerWaalsContact O-CG 3.27Å; G211-L215 WeakPolarHBondContact O-CG 3.48Å; G211-L215 PolarHBondContact O-N 2.77Å; Y212-L215 PolarHBondContact O-N 2.85Å; L215-F218 PolarHBondContact O-N 2.94Å; L215-Y219 WeakPolarHBondContact O-CB 3.47Å; L215-Y219 PolarHBondContact O-N 3.46Å
216	R	97.4	Very high	95.2	Very high	96 Å²	96	72.7 Å²	72.7	36%	0.362	33%	0.33	S	S	.	.	H	α-helix	trans	-64.6	-45.1	174.6	-72.2	-71.3	-67.4	-172.9	-5.9	112.3	Y136 Y212 V213 H214 F218 Y219 I220	Y136-R216 HydrophobicContact CD2-CB 4.17Å; Y136-R216 HydrophobicContact CE2-CB 3.8Å; Y212-R216 HydrophobicContact CD2-CG 4.48Å; Y212-R216 HydrophobicContact CE1-CG 4.04Å; Y212-R216 HydrophobicContact CE2-CG 4.02Å; Y212-R216 WeakPolarHBondContact O-CG 3.05Å; Y212-R216 PolarHBondContact O-N 3.38Å; V213-R216 WeakPolarHBondContact O-CB 3.17Å; V213-R216 PolarHBondContact O-N 2.96Å; H214-R216 VanDerWaalsContact C-N 3.3Å; H214-R216 PolarHBondContact O-N 3.12Å; R216-F218 VanDerWaalsContact C-N 3.31Å; R216-F218 PolarHBondContact O-N 2.91Å; R216-Y219 PolarHBondContact O-N 3.44Å; R216-I220 VanDerWaalsContact O-CG1 3.31Å; R216-I220 WeakPolarHBondContact O-CG1 3.48Å; R216-I220 PolarHBondContact O-N 2.91Å
217	I	95.7	Very high	94.8	Very high	3 Å²	3	76.1 Å²	76.1	2%	0.015	35%	0.351	C	S	.	.	H	α-helix	trans	-55.5	-49.5	174.8	-73.6	169.3	0	0	0	110.1	R135 Y136 I139 V213 H214 Y219 I220 I221 V422	R135-I217 HydrophobicContact CB-CD1 4.34Å; Y136-I217 HydrophobicContact CD2-CG1 3.97Å; Y136-I217 HydrophobicContact CG-CG1 4.48Å; I139-I217 HydrophobicContact CD1-CG2 4Å; V213-I217 HydrophobicContact CG1-CD1 3.98Å; V213-I217 HydrophobicContact CG1-CG1 4.49Å; V213-I217 VanDerWaalsContact O-CG1 3.29Å; V213-I217 WeakPolarHBondContact O-CG1 3.23Å; V213-I217 PolarHBondContact O-N 3.47Å; H214-I217 PolarHBondContact O-N 3.33Å; I217-Y219 PolarHBondContact O-N 3.08Å; I217-I220 PolarHBondContact O-N 3.22Å; I217-I221 HydrophobicContact CG2-CD1 3.61Å; I217-I221 HydrophobicContact CG2-CG1 4.3Å; I217-I221 VanDerWaalsContact O-CG1 3.31Å; I217-I221 WeakPolarHBondContact O-CG1 3.17Å; I217-I221 PolarHBondContact O-N 3.12Å; I217-V422 HydrophobicContact CG2-CG1 3.8Å; I217-V422 HydrophobicContact CG2-CG2 4.25Å
218	F	95.7	Very high	94.4	Very high	101 Å²	101	74.9 Å²	74.9	44%	0.443	34%	0.344	S	S	.	.	H	α-helix	trans	-61.9	-44.6	-178.6	179	-107.8	0	0	0	112.8	H214 L215 R216 I220 I221 R222	H214-F218 WeakPolarHBondContact O-CB 3.47Å; H214-F218 PolarHBondContact O-N 3.06Å; L215-F218 PolarHBondContact O-N 2.94Å; R216-F218 VanDerWaalsContact C-N 3.31Å; R216-F218 PolarHBondContact O-N 2.91Å; F218-I220 PolarHBondContact O-N 3.29Å; F218-I221 PolarHBondContact O-N 3.3Å; F218-R222 VanDerWaalsContact CE1-NH1 3.26Å; F218-R222 VanDerWaalsContact CZ-NH2 3.27Å; F218-R222 PolarHBondContact O-N 3.33Å
219	Y	96.6	Very high	93.9	Very high	126 Å²	126	73 Å²	73	49%	0.494	34%	0.335	S	S	.	.	H	α-helix	trans	-57.8	-47	174.6	173.2	-95.2	0	0	0	111.7	L215 R216 I217 I221 R222 R223	L215-Y219 WeakPolarHBondContact O-CB 3.47Å; L215-Y219 PolarHBondContact O-N 3.46Å; R216-Y219 PolarHBondContact O-N 3.44Å; I217-Y219 PolarHBondContact O-N 3.08Å; Y219-I221 PolarHBondContact O-N 2.91Å; Y219-R222 PolarHBondContact O-N 3.1Å; Y219-R223 PolarHBondContact O-N 3.28Å
220	I	94.5	Very high	93.2	Very high	22 Å²	22	72.9 Å²	72.9	11%	0.113	34%	0.339	C	S	.	.	H	α-helix	trans	-63.6	-42.2	178.8	-68.2	171.2	0	0	0	111	Y136 I139 S140 R216 I217 F218 R222 R223 R224	Y136-I220 HydrophobicContact CD2-CD1 4.37Å; Y136-I220 HydrophobicContact CE2-CD1 3.65Å; I139-I220 HydrophobicContact CG2-CB 4.49Å; I139-I220 HydrophobicContact CG2-CG2 3.84Å; S140-I220 WeakPolarHBondContact OG-CD1 3.27Å; R216-I220 VanDerWaalsContact O-CG1 3.31Å; R216-I220 WeakPolarHBondContact O-CG1 3.48Å; R216-I220 PolarHBondContact O-N 2.91Å; I217-I220 PolarHBondContact O-N 3.22Å; F218-I220 PolarHBondContact O-N 3.29Å; I220-R222 VanDerWaalsContact C-N 3.34Å; I220-R222 PolarHBondContact O-N 3.4Å; I220-R223 PolarHBondContact O-N 2.92Å; I220-R224 HydrophobicContact CG2-CG 4.47Å; I220-R224 WeakPolarHBondContact O-CB 3.46Å; I220-R224 PolarHBondContact O-N 3.44Å
221	I	93.9	Very high	92.4	Very high	23 Å²	23	74.6 Å²	74.6	12%	0.118	35%	0.346	C	S	.	.	H	α-helix	trans	-59.7	-47.2	177.9	-72.6	169	0	0	0	110.5	I139 I217 F218 Y219 R224 S225 F415 Q419 V422	I139-I221 HydrophobicContact CD1-CD1 3.98Å; I139-I221 HydrophobicContact CD1-CG1 4.2Å; I139-I221 HydrophobicContact CG2-CG1 4.3Å; I217-I221 HydrophobicContact CG2-CD1 3.61Å; I217-I221 HydrophobicContact CG2-CG1 4.3Å; I217-I221 VanDerWaalsContact O-CG1 3.31Å; I217-I221 WeakPolarHBondContact O-CG1 3.17Å; I217-I221 PolarHBondContact O-N 3.12Å; F218-I221 PolarHBondContact O-N 3.3Å; Y219-I221 PolarHBondContact O-N 2.91Å; I221-R224 PolarHBondContact O-N 3.36Å; I221-S225 VanDerWaalsContact O-CB 3.28Å; I221-S225 WeakPolarHBondContact O-CB 3.24Å; I221-S225 PolarHBondContact O-N 3.27Å; I221-F415 HydrophobicContact CB-CZ 4.06Å; I221-F415 HydrophobicContact CG1-CE2 3.98Å; I221-F415 HydrophobicContact CG1-CZ 3.81Å; I221-F415 HydrophobicContact CG2-CZ 4.09Å; I221-Q419 HydrophobicContact CD1-CG 4.33Å; I221-V422 HydrophobicContact CD1-CG1 4.4Å
222	R	94.2	Very high	91.5	Very high	158 Å²	158	76.3 Å²	76.3	60%	0.596	35%	0.348	S	S	*	.	H	α-helix	trans	-62.2	-45.1	177.9	-78.9	-174.1	162.9	174.8	-2.5	112	F218 Y219 I220 S225 K226	F218-R222 VanDerWaalsContact CE1-NH1 3.26Å; F218-R222 VanDerWaalsContact CZ-NH2 3.27Å; F218-R222 PolarHBondContact O-N 3.33Å; Y219-R222 PolarHBondContact O-N 3.1Å; I220-R222 VanDerWaalsContact C-N 3.34Å; I220-R222 PolarHBondContact O-N 3.4Å; R222-S225 PolarHBondContact O-N 2.7Å; R222-K226 PolarHBondContact O-N 3.5Å
223	R	93.3	Very high	90.6	Very high	167 Å²	167	74 Å²	74	63%	0.63	34%	0.344	S	S	*	.	H	α-helix	trans	-61.2	-47.4	178.8	-174.4	176.2	176.9	178.2	-0.8	111.6	Y219 I220 K226	Y219-R223 PolarHBondContact O-N 3.28Å; I220-R223 PolarHBondContact O-N 2.92Å; R223-K226 PolarHBondContact O-N 3.21Å
224	R	91	Very high	89.6	Confident	53 Å²	53	77.5 Å²	77.5	20%	0.2	36%	0.363	C	S	.	.	H	α-helix	trans	-72.2	-31.8	179.7	-75.2	-166.2	170.7	165	8.1	113.7	I139 S140 I220 I221 K226 V227 F228 F415	I139-R224 PolarHBondContact O-NH1 2.69Å; S140-R224 PolarHBondContact O-NH2 2.95Å; I220-R224 HydrophobicContact CG2-CG 4.47Å; I220-R224 WeakPolarHBondContact O-CB 3.46Å; I220-R224 PolarHBondContact O-N 3.44Å; I221-R224 PolarHBondContact O-N 3.36Å; R224-K226 PolarHBondContact O-N 3.36Å; R224-V227 PolarHBondContact O-N 3.38Å; R224-V227 VanDerWaalsContact O-N 3.11Å; R224-F228 HydrophobicContact CB-CD2 4.03Å; R224-F228 HydrophobicContact CB-CE2 3.83Å; R224-F228 HydrophobicContact CG-CE2 4.34Å; R224-F228 WeakPolarHBondContact O-CB 3.44Å; R224-F228 VanDerWaalsContact O-CD2 3.29Å; R224-F228 WeakPolarHBondContact O-CD2 3.17Å; R224-F228 WeakPolarHBondContact O-CG 3.04Å; R224-F228 PolarHBondContact O-N 2.78Å; R224-F415 HydrophobicContact CB-CE2 4.17Å; R224-F415 HydrophobicContact CB-CZ 4.16Å
225	S	89.8	Confident	88.5	Confident	51 Å²	51	77.8 Å²	77.8	36%	0.357	37%	0.368	S	S	.	.	H	α-helix	trans	-58.8	-35.9	173.7	-172	0	0	0	0	111.8	I221 R222 F228 N229	I221-S225 VanDerWaalsContact O-CB 3.28Å; I221-S225 WeakPolarHBondContact O-CB 3.24Å; I221-S225 PolarHBondContact O-N 3.27Å; R222-S225 PolarHBondContact O-N 2.7Å; S225-F228 PolarHBondContact O-N 3.49Å; S225-N229 WeakPolarHBondContact O-CB 3.21Å; S225-N229 PolarHBondContact O-N 3Å; S225-N229 PolarHBondContact O-OD1 3.12Å
226	K	90.7	Very high	87.2	Confident	166 Å²	166	79 Å²	79	72%	0.722	37%	0.368	S	S	*	.	H	α-helix	trans	-64.8	-42.9	174.7	-66.1	-178	179.7	-174.2	0	111.9	R222 R223 R224 F228 P230	R222-K226 PolarHBondContact O-N 3.5Å; R223-K226 PolarHBondContact O-N 3.21Å; R224-K226 PolarHBondContact O-N 3.36Å; K226-F228 VanDerWaalsContact C-N 3.35Å; K226-P230 WeakPolarHBondContact O-CD 3.3Å
227	V	88.6	Confident	85.8	Confident	75 Å²	75	80.1 Å²	80.1	46%	0.455	38%	0.375	S	S	.	.	H	α-helix	trans	-67.3	-35.1	177.1	180	0	0	0	0	111.9	R224 P230	R224-V227 PolarHBondContact O-N 3.38Å; R224-V227 VanDerWaalsContact O-N 3.11Å; V227-P230 WeakPolarHBondContact O-CD 3.49Å
228	F	87.8	Confident	84.2	Confident	9 Å²	9	83.1 Å²	83.1	4%	0.039	39%	0.389	C	S	.	.	H	α-helix	trans	-90.5	-10.6	-176	-64.7	-35.2	0	0	0	115.1	R224 S225 K226 F231 N232 Q408 E411 K412 F415	R224-F228 HydrophobicContact CB-CD2 4.03Å; R224-F228 HydrophobicContact CB-CE2 3.83Å; R224-F228 HydrophobicContact CG-CE2 4.34Å; R224-F228 WeakPolarHBondContact O-CB 3.44Å; R224-F228 VanDerWaalsContact O-CD2 3.29Å; R224-F228 WeakPolarHBondContact O-CD2 3.17Å; R224-F228 WeakPolarHBondContact O-CG 3.04Å; R224-F228 PolarHBondContact O-N 2.78Å; S225-F228 PolarHBondContact O-N 3.49Å; K226-F228 VanDerWaalsContact C-N 3.35Å; F228-F231 HydrophobicContact CD1-CD2 4.31Å; F228-F231 HydrophobicContact CD1-CE2 4.37Å; F228-F231 PolarHBondContact O-N 3.42Å; F228-N232 PolarHBondContact O-N 3.2Å; F228-Q408 WeakPolarHBondContact CE1-O 3.41Å; F228-E411 HydrophobicContact CZ-CB 4.22Å; F228-K412 HydrophobicContact CB-CD 3.83Å; F228-K412 HydrophobicContact CB-CG 3.94Å; F228-K412 HydrophobicContact CD1-CB 3.69Å; F228-K412 HydrophobicContact CD1-CD 4.18Å; F228-K412 HydrophobicContact CD1-CG 4.03Å; F228-K412 HydrophobicContact CD2-CB 4.09Å; F228-K412 HydrophobicContact CD2-CG 4.04Å; F228-K412 HydrophobicContact CE1-CB 3.77Å; F228-K412 HydrophobicContact CE2-CB 4.16Å; F228-K412 HydrophobicContact CG-CB 3.86Å; F228-K412 HydrophobicContact CG-CD 4.05Å; F228-K412 HydrophobicContact CG-CG 3.75Å; F228-K412 HydrophobicContact CZ-CB 4.01Å; F228-K412 PolarHBondContact O-NZ 3.12Å; F228-K412 VanDerWaalsContact O-NZ 3.13Å; F228-F415 HydrophobicContact CD2-CD1 4.04Å; F228-F415 HydrophobicContact CD2-CE1 4.42Å; F228-F415 HydrophobicContact CE2-CB 4.15Å; F228-F415 AromaticContact CE2-CD1 3.99Å; F228-F415 HydrophobicContact CE2-CD1 3.99Å; F228-F415 HydrophobicContact CE2-CG 4.01Å
229	N	85.5	Confident	82.4	Confident	76 Å²	76	83.9 Å²	83.9	41%	0.406	40%	0.395	S	S	.	.	H	α-helix	trans	-60.6	-43.9	178	-96.2	1.3	0	0	0	114	S225 F231 N232 I233	S225-N229 WeakPolarHBondContact O-CB 3.21Å; S225-N229 PolarHBondContact O-N 3Å; S225-N229 PolarHBondContact O-OD1 3.12Å; N229-F231 VanDerWaalsContact C-N 3.28Å; N229-F231 PolarHBondContact O-N 3.03Å; N229-N232 WeakPolarHBondContact O-CB 3.35Å; N229-N232 PolarHBondContact O-N 3.21Å; N229-I233 PolarHBondContact O-N 2.73Å; N229-I233 VanDerWaalsContact O-N 3.17Å
230	P	83.1	Confident	80.8	Confident	67 Å²	67	81.1 Å²	81.1	44%	0.435	39%	0.394	S	S	.	.	H	α-helix	trans	-53.9	-44.9	176.2	-27.8	35.6	0	0	0	112.5	K226 V227 N232 I233 D234	K226-P230 WeakPolarHBondContact O-CD 3.3Å; V227-P230 WeakPolarHBondContact O-CD 3.49Å; P230-N232 PolarHBondContact O-N 3.41Å; P230-N232 VanDerWaalsContact O-N 3.15Å; P230-I233 WeakPolarHBondContact O-CA 3.29Å; P230-I233 WeakPolarHBondContact O-CB 3.4Å; P230-I233 PolarHBondContact O-N 2.85Å; P230-D234 PolarHBondContact O-N 2.88Å
231	F	79.8	Confident	79.1	Confident	38 Å²	38	89.2 Å²	89.2	17%	0.167	42%	0.423	C	S	.	.	H	α-helix	trans	-61.1	-25.5	176.2	-63.5	-81.5	0	0	0	113.9	F228 N229 S235 T405 Q408 F409 K412	F228-F231 HydrophobicContact CD1-CD2 4.31Å; F228-F231 HydrophobicContact CD1-CE2 4.37Å; F228-F231 PolarHBondContact O-N 3.42Å; N229-F231 VanDerWaalsContact C-N 3.28Å; N229-F231 PolarHBondContact O-N 3.03Å; F231-S235 PolarHBondContact O-N 3.15Å; F231-S235 PolarHBondContact O-OG 3.31Å; F231-T405 HydrophobicContact CE1-CG2 3.78Å; F231-T405 HydrophobicContact CZ-CG2 4.17Å; F231-Q408 HydrophobicContact CE2-CB 4.28Å; F231-Q408 HydrophobicContact CZ-CB 4Å; F231-F409 HydrophobicContact CD1-CD2 4.47Å; F231-K412 VanDerWaalsContact C-NZ 3.35Å; F231-K412 HydrophobicContact CB-CD 4Å; F231-K412 HydrophobicContact CG-CD 4.46Å
232	N	77.6	Confident	77.2	Confident	66 Å²	66	91.1 Å²	91.1	35%	0.353	44%	0.436	S	S	.	.	H	α-helix	trans	-77.8	-32.9	173.1	-73.9	-24.3	0	0	0	111.8	F228 N229 P230 S235 K236 K412	F228-N232 PolarHBondContact O-N 3.2Å; N229-N232 WeakPolarHBondContact O-CB 3.35Å; N229-N232 PolarHBondContact O-N 3.21Å; P230-N232 PolarHBondContact O-N 3.41Å; P230-N232 VanDerWaalsContact O-N 3.15Å; N232-S235 PolarHBondContact O-OG 3.27Å; N232-K236 WeakPolarHBondContact O-CG 3.49Å; N232-K236 PolarHBondContact O-N 3.07Å; N232-K412 VanDerWaalsContact OD1-CE 3.31Å; N232-K412 WeakPolarHBondContact OD1-CE 3.36Å; N232-K412 PolarHBondContact OD1-NZ 3.16Å
233	I	77.8	Confident	75.4	Confident	91 Å²	91	87.1 Å²	87.1	47%	0.467	43%	0.426	S	S	.	.	H	α-helix	trans	-70.5	-44	177.1	-64.5	170.1	0	0	0	109	N229 P230 K236 K237	N229-I233 PolarHBondContact O-N 2.73Å; N229-I233 VanDerWaalsContact O-N 3.17Å; P230-I233 WeakPolarHBondContact O-CA 3.29Å; P230-I233 WeakPolarHBondContact O-CB 3.4Å; P230-I233 PolarHBondContact O-N 2.85Å; I233-K236 PolarHBondContact O-N 2.96Å; I233-K237 HydrophobicContact CG2-CD 4.03Å; I233-K237 HydrophobicContact CG2-CG 4.33Å; I233-K237 WeakPolarHBondContact O-CB 3.29Å; I233-K237 WeakPolarHBondContact O-CG 3.14Å; I233-K237 PolarHBondContact O-N 3.19Å
234	D	76.2	Confident	73.8	Confident	83 Å²	83	84.1 Å²	84.1	44%	0.444	42%	0.422	S	S	.	.	H	α-helix	trans	-63.2	-42.4	178.4	-64	-26.7	0	0	0	111.4	P230 K236 K237 Q238	P230-D234 PolarHBondContact O-N 2.88Å; D234-K236 PolarHBondContact O-N 3.34Å; D234-K237 PolarHBondContact O-N 2.78Å; D234-Q238 WeakPolarHBondContact O-CB 3.04Å; D234-Q238 PolarHBondContact O-N 3.11Å
235	S	71.6	Confident	72.1	Confident	36 Å²	36	84.8 Å²	84.8	25%	0.252	43%	0.434	S	S	.	.	H	α-helix	trans	-61.2	-43	174.9	68.4	0	0	0	0	112.5	F231 N232 Q238 E239 Y291	F231-S235 PolarHBondContact O-N 3.15Å; F231-S235 PolarHBondContact O-OG 3.31Å; N232-S235 PolarHBondContact O-OG 3.27Å; S235-Q238 PolarHBondContact O-N 3.49Å; S235-E239 WeakPolarHBondContact O-CB 3.47Å; S235-E239 PolarHBondContact O-N 3.07Å; S235-Y291 WeakPolarHBondContact CA-OH 3.45Å; S235-Y291 WeakPolarHBondContact CB-OH 3.25Å
236	K	70	Confident	70.5	Confident	151 Å²	151	90.9 Å²	90.9	66%	0.657	45%	0.45	S	S	*	.	H	α-helix	trans	-68.1	-39	177	-75	-178	177.5	-171.4	0	113.1	N232 I233 D234 Q238 E239 S240	N232-K236 WeakPolarHBondContact O-CG 3.49Å; N232-K236 PolarHBondContact O-N 3.07Å; I233-K236 PolarHBondContact O-N 2.96Å; D234-K236 PolarHBondContact O-N 3.34Å; K236-Q238 VanDerWaalsContact C-N 3.29Å; K236-E239 PolarHBondContact O-N 3.46Å; K236-S240 PolarHBondContact O-N 3.02Å; K236-S240 PolarHBondContact O-OG 2.88Å
237	K	69.3	Low	68.6	Low	120 Å²	120	87.3 Å²	87.3	52%	0.522	44%	0.438	S	S	.	.	H	α-helix	trans	-65.2	-35.5	175	-77.3	178.2	178.7	175.8	0	111.6	I233 D234 S240 R241	I233-K237 HydrophobicContact CG2-CD 4.03Å; I233-K237 HydrophobicContact CG2-CG 4.33Å; I233-K237 WeakPolarHBondContact O-CB 3.29Å; I233-K237 WeakPolarHBondContact O-CG 3.14Å; I233-K237 PolarHBondContact O-N 3.19Å; D234-K237 PolarHBondContact O-N 2.78Å; K237-S240 PolarHBondContact O-OG 3.06Å; K237-R241 WeakPolarHBondContact O-CB 3.4Å; K237-R241 WeakPolarHBondContact O-CG 3.19Å; K237-R241 PolarHBondContact O-N 2.85Å
238	Q	60.4	Low	66.8	Low	66 Å²	66	88 Å²	88	31%	0.308	44%	0.438	S	S	.	.	H	α-helix	trans	-71.9	-42	177.7	-164.2	160.9	0.7	0	0	111	D234 S235 K236 S240 R241 T242	D234-Q238 WeakPolarHBondContact O-CB 3.04Å; D234-Q238 PolarHBondContact O-N 3.11Å; S235-Q238 PolarHBondContact O-N 3.49Å; K236-Q238 VanDerWaalsContact C-N 3.29Å; Q238-S240 VanDerWaalsContact C-N 3.34Å; Q238-S240 PolarHBondContact O-N 3.1Å; Q238-R241 PolarHBondContact O-N 3.4Å; Q238-T242 PolarHBondContact O-N 3.38Å; Q238-T242 PolarHBondContact O-OG1 3.37Å; Q238-T242 VanDerWaalsContact O-OG1 3.06Å
239	E	59.3	Low	64.9	Low	118 Å²	118	91 Å²	91	55%	0.551	46%	0.458	S	S	*	.	H	α-helix	trans	-60.2	-41.5	173.2	-168.3	177.4	-176.2	0	0	112.2	S235 K236 T242 N243	S235-E239 WeakPolarHBondContact O-CB 3.47Å; S235-E239 PolarHBondContact O-N 3.07Å; K236-E239 PolarHBondContact O-N 3.46Å; E239-T242 VanDerWaalsContact C-OG1 3.31Å; E239-T242 VanDerWaalsContact CA-OG1 3.24Å; E239-T242 WeakPolarHBondContact CA-OG1 3.31Å; E239-T242 PolarHBondContact O-N 3.42Å; E239-T242 PolarHBondContact O-OG1 3.24Å; E239-N243 WeakPolarHBondContact O-CB 3.11Å; E239-N243 PolarHBondContact O-N 2.92Å; E239-N243 PolarHBondContact O-ND2 3.36Å
240	S	62.2	Low	63.1	Low	68 Å²	68	93.2 Å²	93.2	48%	0.476	47%	0.47	S	S	.	.	H	α-helix	trans	-68.4	-37.7	175.7	70	0	0	0	0	112.7	K236 K237 Q238 N243 L244	K236-S240 PolarHBondContact O-N 3.02Å; K236-S240 PolarHBondContact O-OG 2.88Å; K237-S240 PolarHBondContact O-OG 3.06Å; Q238-S240 VanDerWaalsContact C-N 3.34Å; Q238-S240 PolarHBondContact O-N 3.1Å; S240-N243 PolarHBondContact O-N 3.42Å; S240-L244 VanDerWaalsContact O-CB 3.25Å; S240-L244 WeakPolarHBondContact O-CB 3.33Å; S240-L244 PolarHBondContact O-N 2.9Å
241	R	58.6	Low	61.2	Low	192 Å²	192	94.3 Å²	94.3	73%	0.725	47%	0.472	S	S	*	.	H	α-helix	trans	-63.9	-42.7	171.6	-79.6	-179.3	-179.8	178.6	-0.1	111.9	K237 Q238 L244 S245	K237-R241 WeakPolarHBondContact O-CB 3.4Å; K237-R241 WeakPolarHBondContact O-CG 3.19Å; K237-R241 PolarHBondContact O-N 2.85Å; Q238-R241 PolarHBondContact O-N 3.4Å; R241-L244 PolarHBondContact O-N 2.97Å; R241-S245 WeakPolarHBondContact O-CB 3.42Å; R241-S245 PolarHBondContact O-N 3.44Å; R241-S245 PolarHBondContact O-OG 3.35Å
242	T	55.3	Low	59.8	Low	63 Å²	63	96.1 Å²	96.1	39%	0.387	49%	0.486	S	S	.	.	H	α-helix	trans	-65.1	-41.7	175.8	45.7	0	0	0	0	111.5	Q238 E239 S245 R246	Q238-T242 PolarHBondContact O-N 3.38Å; Q238-T242 PolarHBondContact O-OG1 3.37Å; Q238-T242 VanDerWaalsContact O-OG1 3.06Å; E239-T242 VanDerWaalsContact C-OG1 3.31Å; E239-T242 VanDerWaalsContact CA-OG1 3.24Å; E239-T242 WeakPolarHBondContact CA-OG1 3.31Å; E239-T242 PolarHBondContact O-N 3.42Å; E239-T242 PolarHBondContact O-OG1 3.24Å; T242-S245 WeakPolarHBondContact CA-OG 3.39Å; T242-S245 PolarHBondContact O-N 2.87Å; T242-S245 PolarHBondContact O-OG 3.26Å; T242-R246 WeakPolarHBondContact O-CG 3.43Å; T242-R246 PolarHBondContact O-N 3.44Å
243	N	56.4	Low	58.4	Low	73 Å²	73	96.4 Å²	96.4	39%	0.39	49%	0.487	S	S	.	.	H	α-helix	trans	-65.7	-41.1	175.8	-71.6	-21	0	0	0	111.9	E239 S240 R246 L247	E239-N243 WeakPolarHBondContact O-CB 3.11Å; E239-N243 PolarHBondContact O-N 2.92Å; E239-N243 PolarHBondContact O-ND2 3.36Å; S240-N243 PolarHBondContact O-N 3.42Å; N243-R246 PolarHBondContact O-N 3.34Å; N243-L247 PolarHBondContact O-N 2.88Å
244	L	58.2	Low	56.8	Low	104 Å²	104	97.5 Å²	97.5	55%	0.545	49%	0.49	S	S	.	.	H	α-helix	trans	-63.2	-42.9	173.3	-175.4	64.7	0	0	0	111.2	S240 R241 R246 L247 I248	S240-L244 VanDerWaalsContact O-CB 3.25Å; S240-L244 WeakPolarHBondContact O-CB 3.33Å; S240-L244 PolarHBondContact O-N 2.9Å; R241-L244 PolarHBondContact O-N 2.97Å; L244-R246 PolarHBondContact O-N 2.98Å; L244-L247 PolarHBondContact O-N 2.92Å; L244-I248 HydrophobicContact CG-CD1 4.1Å; L244-I248 HydrophobicContact CG-CG1 4.42Å; L244-I248 VanDerWaalsContact O-CG1 3.31Å; L244-I248 WeakPolarHBondContact O-CG1 3.39Å; L244-I248 PolarHBondContact O-N 2.83Å
245	S	56.4	Low	55.3	Low	67 Å²	67	99.3 Å²	99.3	47%	0.469	49%	0.494	S	S	.	.	H	α-helix	trans	-64.9	-25.2	175.8	73.8	0	0	0	0	113.4	R241 T242 P249	R241-S245 WeakPolarHBondContact O-CB 3.42Å; R241-S245 PolarHBondContact O-N 3.44Å; R241-S245 PolarHBondContact O-OG 3.35Å; T242-S245 WeakPolarHBondContact CA-OG 3.39Å; T242-S245 PolarHBondContact O-N 2.87Å; T242-S245 PolarHBondContact O-OG 3.26Å; S245-P249 WeakPolarHBondContact O-CD 3.25Å; S245-P249 WeakPolarHBondContact O-CG 3.48Å
246	R	55	Low	54	Low	179 Å²	179	99.6 Å²	99.6	68%	0.675	50%	0.496	S	S	*	.	H	α-helix	trans	-79.1	-31.6	170.1	-72.2	176.2	179.7	173.9	-1	112.4	T242 N243 L244	T242-R246 WeakPolarHBondContact O-CG 3.43Å; T242-R246 PolarHBondContact O-N 3.44Å; N243-R246 PolarHBondContact O-N 3.34Å; L244-R246 PolarHBondContact O-N 2.98Å
247	L	51.3	Low	52.7	Low	92 Å²	92	98.4 Å²	98.4	48%	0.482	49%	0.491	S	S	.	.	H	α-helix	trans	-78.3	-32.8	178.4	-117.8	111.1	0	0	0	113.5	N243 L244 L250 L251	N243-L247 PolarHBondContact O-N 2.88Å; L244-L247 PolarHBondContact O-N 2.92Å; L247-L250 WeakPolarHBondContact O-CB 3.43Å; L247-L250 PolarHBondContact O-N 3.04Å; L247-L250 VanDerWaalsContact O-N 3.11Å; L247-L251 HydrophobicContact CD2-CD1 4.09Å; L247-L251 PolarHBondContact O-N 3.45Å
248	I	51	Low	51.1	Low	89 Å²	89	101 Å²	101	46%	0.456	50%	0.497	S	S	.	.	H	α-helix	trans	-55.9	-49.2	178.6	-71.7	163.3	0	0	0	110.7	L244 L250 L251 T252	L244-I248 HydrophobicContact CG-CD1 4.1Å; L244-I248 HydrophobicContact CG-CG1 4.42Å; L244-I248 VanDerWaalsContact O-CG1 3.31Å; L244-I248 WeakPolarHBondContact O-CG1 3.39Å; L244-I248 PolarHBondContact O-N 2.83Å; I248-L250 VanDerWaalsContact C-N 3.34Å; I248-L250 PolarHBondContact O-N 3.07Å; I248-L251 PolarHBondContact O-N 3.21Å; I248-T252 HydrophobicContact CG2-CG2 4.15Å; I248-T252 WeakPolarHBondContact O-CB 3.19Å; I248-T252 VanDerWaalsContact O-CG2 3.32Å; I248-T252 WeakPolarHBondContact O-CG2 3.15Å; I248-T252 PolarHBondContact O-N 3.49Å; I248-T252 PolarHBondContact O-OG1 3.18Å
249	P	47.4	Very low	49.9	Very low	71 Å²	71	104 Å²	104	46%	0.461	51%	0.51	S	S	.	.	H	α-helix	trans	-54.3	-42.1	172.3	-28.6	34.8	0	0	0	114.3	S245 T252 D253	S245-P249 WeakPolarHBondContact O-CD 3.25Å; S245-P249 WeakPolarHBondContact O-CG 3.48Å; P249-T252 WeakPolarHBondContact CA-OG1 3.49Å; P249-T252 PolarHBondContact O-N 3.33Å; P249-T252 PolarHBondContact O-OG1 2.86Å; P249-D253 VanDerWaalsContact O-CB 3.3Å; P249-D253 WeakPolarHBondContact O-CB 3.41Å; P249-D253 PolarHBondContact O-N 3.36Å
250	L	48.6	Very low	49	Very low	123 Å²	123	102.5 Å²	102.5	64%	0.644	51%	0.505	S	S	*	.	H	α-helix	trans	-68	-40.2	179.7	-82.5	156.3	0	0	0	112.4	L247 I248 D253 H254	L247-L250 WeakPolarHBondContact O-CB 3.43Å; L247-L250 PolarHBondContact O-N 3.04Å; L247-L250 VanDerWaalsContact O-N 3.11Å; I248-L250 VanDerWaalsContact C-N 3.34Å; I248-L250 PolarHBondContact O-N 3.07Å; L250-D253 PolarHBondContact O-N 3.02Å; L250-H254 PolarHBondContact O-N 3.45Å
251	L	44	Very low	47.8	Very low	91 Å²	91	107 Å²	107	48%	0.476	52%	0.519	S	S	.	.	H	α-helix	trans	-70.8	-42	174.3	-77.8	162.6	0	0	0	111	L247 I248 D253 H254 F255	L247-L251 HydrophobicContact CD2-CD1 4.09Å; L247-L251 PolarHBondContact O-N 3.45Å; I248-L251 PolarHBondContact O-N 3.21Å; L251-D253 VanDerWaalsContact C-N 3.27Å; L251-D253 PolarHBondContact O-N 3.45Å; L251-H254 PolarHBondContact O-N 3.19Å; L251-F255 VanDerWaalsContact O-CD2 3.25Å; L251-F255 WeakPolarHBondContact O-CD2 3.38Å; L251-F255 PolarHBondContact O-N 3.18Å
252	T	50.1	Low	46.5	Very low	76 Å²	76	108 Å²	108	47%	0.466	52%	0.522	S	S	.	.	H	α-helix	trans	-66.6	-28.1	174.8	54.6	0	0	0	0	112.1	I248 P249 S256	I248-T252 HydrophobicContact CG2-CG2 4.15Å; I248-T252 WeakPolarHBondContact O-CB 3.19Å; I248-T252 VanDerWaalsContact O-CG2 3.32Å; I248-T252 WeakPolarHBondContact O-CG2 3.15Å; I248-T252 PolarHBondContact O-N 3.49Å; I248-T252 PolarHBondContact O-OG1 3.18Å; P249-T252 WeakPolarHBondContact CA-OG1 3.49Å; P249-T252 PolarHBondContact O-N 3.33Å; P249-T252 PolarHBondContact O-OG1 2.86Å; T252-S256 WeakPolarHBondContact O-CA 3.31Å; T252-S256 WeakPolarHBondContact O-CB 3.41Å; T252-S256 PolarHBondContact O-N 2.79Å; T252-S256 PolarHBondContact O-OG 2.91Å
253	D	48.1	Very low	45.3	Very low	72 Å²	72	108.3 Å²	108.3	39%	0.385	52%	0.521	S	S	.	.	H	α-helix	trans	-70.3	-37.6	172.4	-165.9	49.8	0	0	0	111.2	P249 L250 L251 S256 K257	P249-D253 VanDerWaalsContact O-CB 3.3Å; P249-D253 WeakPolarHBondContact O-CB 3.41Å; P249-D253 PolarHBondContact O-N 3.36Å; L250-D253 PolarHBondContact O-N 3.02Å; L251-D253 VanDerWaalsContact C-N 3.27Å; L251-D253 PolarHBondContact O-N 3.45Å; D253-S256 VanDerWaalsContact CA-OG 3.3Å; D253-S256 WeakPolarHBondContact CA-OG 3.37Å; D253-S256 PolarHBondContact O-OG 3.13Å; D253-S256 VanDerWaalsContact O-OG 3.08Å; D253-K257 VanDerWaalsContact O-CB 3.3Å; D253-K257 WeakPolarHBondContact O-CB 3.37Å; D253-K257 VanDerWaalsContact O-CG 3.26Å; D253-K257 WeakPolarHBondContact O-CG 3.48Å; D253-K257 PolarHBondContact O-N 3.03Å; D253-K257 WeakPolarHBondContact OD2-CE 3.37Å; D253-K257 IonicContact OD2-NZ 3.75Å; D253-K257 PolarHBondContact OD2-NZ 2.99Å
254	H	44.6	Very low	44.1	Very low	113 Å²	113	112.7 Å²	112.7	52%	0.523	54%	0.537	S	S	.	.	H	α-helix	trans	-70.3	-41.6	174.3	-169.1	-78.6	0	0	0	112.7	L250 L251 R258	L250-H254 PolarHBondContact O-N 3.45Å; L251-H254 PolarHBondContact O-N 3.19Å; H254-R258 PolarHBondContact O-N 3.22Å
255	F	43.4	Very low	42.8	Very low	122 Å²	122	117 Å²	117	54%	0.535	55%	0.551	S	S	.	*	H	α-helix	trans	-70.7	-40.2	174.9	-81.6	-73.4	0	0	0	112	L251 R258 F259	L251-F255 VanDerWaalsContact O-CD2 3.25Å; L251-F255 WeakPolarHBondContact O-CD2 3.38Å; L251-F255 PolarHBondContact O-N 3.18Å; F255-R258 PolarHBondContact O-N 2.86Å; F255-F259 WeakPolarHBondContact O-CB 3.35Å; F255-F259 PolarHBondContact O-N 3.44Å
256	S	45.5	Very low	41.7	Very low	41 Å²	41	120.4 Å²	120.4	29%	0.287	56%	0.564	S	S	.	*	H	α-helix	trans	-65.8	-39.1	174.6	67.1	0	0	0	0	110.7	T252 D253 R258 F259 I260	T252-S256 WeakPolarHBondContact O-CA 3.31Å; T252-S256 WeakPolarHBondContact O-CB 3.41Å; T252-S256 PolarHBondContact O-N 2.79Å; T252-S256 PolarHBondContact O-OG 2.91Å; D253-S256 VanDerWaalsContact CA-OG 3.3Å; D253-S256 WeakPolarHBondContact CA-OG 3.37Å; D253-S256 PolarHBondContact O-OG 3.13Å; D253-S256 VanDerWaalsContact O-OG 3.08Å; S256-R258 VanDerWaalsContact C-N 3.34Å; S256-R258 PolarHBondContact O-N 3.5Å; S256-F259 CarbonylContact O-C 3.58Å; S256-F259 PolarHBondContact O-N 3.41Å; S256-I260 WeakPolarHBondContact O-CA 3.26Å; S256-I260 WeakPolarHBondContact O-CB 3.32Å; S256-I260 WeakPolarHBondContact O-CD1 3.47Å; S256-I260 WeakPolarHBondContact O-CG1 3.46Å; S256-I260 PolarHBondContact O-N 3.27Å
257	K	41.2	Very low	40.3	Very low	127 Å²	127	119 Å²	119	55%	0.552	57%	0.565	S	S	*	*	H	α-helix	trans	-59.3	-42.3	171.9	-80.4	168.4	177.9	156.6	0	112.5	D253 Q261	D253-K257 VanDerWaalsContact O-CB 3.3Å; D253-K257 WeakPolarHBondContact O-CB 3.37Å; D253-K257 VanDerWaalsContact O-CG 3.26Å; D253-K257 WeakPolarHBondContact O-CG 3.48Å; D253-K257 PolarHBondContact O-N 3.03Å; D253-K257 WeakPolarHBondContact OD2-CE 3.37Å; D253-K257 IonicContact OD2-NZ 3.75Å; D253-K257 PolarHBondContact OD2-NZ 2.99Å; K257-Q261 WeakPolarHBondContact O-CB 3.26Å; K257-Q261 PolarHBondContact O-N 3.5Å
258	R	35.3	Very low	39.2	Very low	173 Å²	173	122.1 Å²	122.1	65%	0.653	58%	0.582	S	S	*	*	H	α-helix	trans	-67.9	-37.5	174	-92.5	-173.1	171	179.4	-1.8	113.4	H254 F255 S256 R262	H254-R258 PolarHBondContact O-N 3.22Å; F255-R258 PolarHBondContact O-N 2.86Å; S256-R258 VanDerWaalsContact C-N 3.34Å; S256-R258 PolarHBondContact O-N 3.5Å; R258-R262 PolarHBondContact O-N 2.96Å
259	F	36.9	Very low	38.1	Very low	130 Å²	130	123.8 Å²	123.8	57%	0.57	59%	0.591	S	S	*	*	H	α-helix	trans	-73.9	-41.1	177.4	-107.6	-87.8	0	0	0	112.1	F255 S256 Q261 R262 N263	F255-F259 WeakPolarHBondContact O-CB 3.35Å; F255-F259 PolarHBondContact O-N 3.44Å; S256-F259 CarbonylContact O-C 3.58Å; S256-F259 PolarHBondContact O-N 3.41Å; F259-Q261 VanDerWaalsContact C-N 3.26Å; F259-Q261 PolarHBondContact O-N 2.73Å; F259-R262 CarbonylContact O-C 3.5Å; F259-R262 WeakPolarHBondContact O-CA 3.08Å; F259-R262 WeakPolarHBondContact O-CB 3.44Å; F259-R262 PolarHBondContact O-N 2.82Å; F259-N263 WeakPolarHBondContact O-CB 3.41Å; F259-N263 PolarHBondContact O-N 2.92Å
260	I	40	Very low	37.1	Very low	87 Å²	87	128.6 Å²	128.6	45%	0.446	61%	0.612	S	S	.	*	H	α-helix	trans	-61.6	-36.5	173.9	-69.2	163.4	0	0	0	109.5	S256 R262 N263 K264	S256-I260 WeakPolarHBondContact O-CA 3.26Å; S256-I260 WeakPolarHBondContact O-CB 3.32Å; S256-I260 WeakPolarHBondContact O-CD1 3.47Å; S256-I260 WeakPolarHBondContact O-CG1 3.46Å; S256-I260 PolarHBondContact O-N 3.27Å; I260-R262 VanDerWaalsContact C-N 3.27Å; I260-R262 PolarHBondContact O-N 3.22Å; I260-N263 PolarHBondContact O-N 3.26Å; I260-K264 HydrophobicContact CG2-CD 4.25Å; I260-K264 HydrophobicContact CG2-CG 4.07Å; I260-K264 WeakPolarHBondContact O-CB 3.31Å; I260-K264 VanDerWaalsContact O-CG 3.28Å; I260-K264 WeakPolarHBondContact O-CG 3.16Å; I260-K264 PolarHBondContact O-N 3.09Å
261	Q	37.7	Very low	35.9	Very low	163 Å²	163	127.4 Å²	127.4	76%	0.762	61%	0.614	S	S	*	*	H	α-helix	trans	-69	-27	174.6	-144.4	167.8	11.9	0	0	112.7	K257 F259	K257-Q261 WeakPolarHBondContact O-CB 3.26Å; K257-Q261 PolarHBondContact O-N 3.5Å; F259-Q261 VanDerWaalsContact C-N 3.26Å; F259-Q261 PolarHBondContact O-N 2.73Å
262	R	29.5	Very low	35	Very low	212 Å²	212	130.7 Å²	130.7	80%	0.8	63%	0.631	S	S	*	*	H	α-helix	trans	-82.5	-37.2	172.6	-110	177.6	173.1	140.7	-1.6	113.1	R258 F259 I260	R258-R262 PolarHBondContact O-N 2.96Å; F259-R262 CarbonylContact O-C 3.5Å; F259-R262 WeakPolarHBondContact O-CA 3.08Å; F259-R262 WeakPolarHBondContact O-CB 3.44Å; F259-R262 PolarHBondContact O-N 2.82Å; I260-R262 VanDerWaalsContact C-N 3.27Å; I260-R262 PolarHBondContact O-N 3.22Å
263	N	30.8	Very low	33.8	Very low	69 Å²	69	135 Å²	135	37%	0.369	65%	0.65	S	S	.	*	H	α-helix	trans	-95.4	-8.8	-174.8	-76	7.4	0	0	0	114.4	F259 I260 K265 L266 E267	F259-N263 WeakPolarHBondContact O-CB 3.41Å; F259-N263 PolarHBondContact O-N 2.92Å; I260-N263 PolarHBondContact O-N 3.26Å; N263-K265 PolarHBondContact O-N 3.02Å; N263-L266 PolarHBondContact O-N 3.1Å; N263-E267 PolarHBondContact O-N 2.72Å
264	K	30.3	Very low	32.7	Very low	165 Å²	165	139 Å²	139	72%	0.717	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	-11.8	162.6	-94.4	-177.8	176.3	-175.8	0	113	I260	I260-K264 HydrophobicContact CG2-CD 4.25Å; I260-K264 HydrophobicContact CG2-CG 4.07Å; I260-K264 WeakPolarHBondContact O-CB 3.31Å; I260-K264 VanDerWaalsContact O-CG 3.28Å; I260-K264 WeakPolarHBondContact O-CG 3.16Å; I260-K264 PolarHBondContact O-N 3.09Å
265	K	32	Very low	31.7	Very low	196 Å²	196	144 Å²	144	85%	0.852	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-7.9	172.1	-148.2	175.1	-176.6	-178.9	0	113.9	N263	N263-K265 PolarHBondContact O-N 3.02Å
266	L	32.5	Very low	30.7	Very low	138 Å²	138	144.4 Å²	144.4	72%	0.723	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.5	-22.6	-169.8	-152.3	72	0	0	0	115.8	N263	N263-L266 PolarHBondContact O-N 3.1Å
267	E	26.5	Very low	29.7	Very low	150 Å²	150	148.2 Å²	148.2	70%	0.701	71%	0.711	S	S	*	*			trans	-120.7	63.1	-175.6	-77.4	175.4	151.4	0	0	113.1	N263	N263-E267 PolarHBondContact O-N 2.72Å
268	N	29	Very low	29	Very low	156 Å²	156	150.7 Å²	150.7	83%	0.834	73%	0.729	S	S	*	*	S	Bend	trans	-74.4	-7.4	150.9	-90.3	-8.9	0	0	0	111.7
269	D	27	Very low	28.4	Very low	124 Å²	124	149.3 Å²	149.3	66%	0.663	73%	0.73	S	S	*	*	S	Bend	trans	-103.9	124.7	-179.7	-62.7	-34.6	0	0	0	109.8
270	I	25.6	Very low	27.7	Very low	173 Å²	173	149 Å²	149	89%	0.887	73%	0.734	S	S	*	*	S	Bend	trans	87.6	76.1	170	-44.9	171.1	0	0	0	114.6
271	S	25	Very low	27	Very low	98 Å²	98	151.1 Å²	151.1	69%	0.685	75%	0.746	S	S	*	*			trans	-73.4	134.6	174.3	-29.2	0	0	0	0	112.8
272	L	23.4	Very low	26.3	Very low	160 Å²	160	150.7 Å²	150.7	84%	0.838	75%	0.749	S	S	*	*			trans	56.7	108.8	130.8	-82	145.5	0	0	0	120.1
273	L	24.7	Very low	26.2	Very low	166 Å²	166	147.6 Å²	147.6	87%	0.869	75%	0.747	S	S	*	*			trans	178	131	139.7	-89.8	146.7	0	0	0	105.7
274	H	25.1	Very low	25.8	Very low	155 Å²	155	151 Å²	151	72%	0.718	77%	0.765	S	S	*	*			cis	-178.3	97.1	-0.7	-153.8	-103.3	0	0	0	105.4
275	F	23.3	Very low	25.7	Very low	220 Å²	220	151.5 Å²	151.5	97%	0.965	77%	0.774	S	S	*	*			trans	-134.1	88.5	166.7	-97.9	-77.8	0	0	0	107.9
276	N	23.4	Very low	25.3	Very low	130 Å²	130	146.5 Å²	146.5	70%	0.695	76%	0.76	S	S	*	*			trans	-122.4	131.2	177.3	-102.1	-11.9	0	0	0	110.5
277	N	24	Very low	25	Very low	120 Å²	120	145 Å²	145	64%	0.642	75%	0.752	S	S	*	*			trans	70.9	107.2	145.9	-61.5	-22	0	0	0	119.1
278	I	27.1	Very low	25	Very low	180 Å²	180	140.6 Å²	140.6	92%	0.923	74%	0.742	S	S	*	*				-136.4	121.3	121.5	-61.1	-172.1	0	0	0	109.1
279	H	23.4	Very low	24.9	Very low	144 Å²	144	138.3 Å²	138.3	67%	0.667	73%	0.729	S	S	*	*			trans	-89.5	151.9	-177.1	-115.5	-82.5	0	0	0	111.6
280	N	22.5	Very low	24.9	Very low	122 Å²	122	134.6 Å²	134.6	65%	0.652	71%	0.713	S	S	*	*			trans	44.2	114.9	136.9	-71.8	3	0	0	0	121
281	N	24.5	Very low	25.1	Very low	132 Å²	132	129.6 Å²	129.6	71%	0.706	68%	0.683	S	S	*	*				159.9	137.3	104.9	-86.2	-19.1	0	0	0	112.4
282	D	23.8	Very low	25.2	Very low	155 Å²	155	127.2 Å²	127.2	83%	0.829	67%	0.665	S	S	*	*			trans	28.5	103.8	150	-57.2	-32.6	0	0	0	119
283	I	26	Very low	25.4	Very low	146 Å²	146	128 Å²	128	75%	0.749	66%	0.658	S	S	*	*			trans	-128.8	110.1	162.8	-59.5	180	0	0	0	110
284	D	23.4	Very low	25.3	Very low	140 Å²	140	125.8 Å²	125.8	75%	0.749	64%	0.643	S	S	*	*			trans	-49.4	155.6	169.3	-91.3	-46.4	0	0	0	113.7	T286	D284-T286 PolarHBondContact O-N 3.11Å; D284-T286 PolarHBondContact O-OG1 3.39Å; D284-T286 VanDerWaalsContact O-OG1 3.13Å
285	I	27.1	Very low	25.3	Very low	177 Å²	177	125.7 Å²	125.7	91%	0.908	64%	0.637	S	S	*	*	S	Bend	trans	-59.3	57.9	-174.3	-56.1	166	0	0	0	113.6
286	T	24.1	Very low	25.4	Very low	90 Å²	90	116.4 Å²	116.4	55%	0.552	60%	0.598	S	S	*	*			trans	-117.3	15.4	178.4	40	0	0	0	0	113.8	D284 A288	D284-T286 PolarHBondContact O-N 3.11Å; D284-T286 PolarHBondContact O-OG1 3.39Å; D284-T286 VanDerWaalsContact O-OG1 3.13Å; T286-A288 PolarHBondContact O-N 3.17Å
287	D	25.2	Very low	25.5	Very low	106 Å²	106	113.7 Å²	113.7	57%	0.567	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	45.4	179.7	-90.4	-6.1	0	0	0	115.1	L289 S290	D287-L289 VanDerWaalsContact C-N 3.29Å; D287-S290 WeakPolarHBondContact CB-OG 3.49Å; D287-S290 PolarHBondContact O-OG 3.47Å
288	A	26.9	Very low	25.5	Very low	59 Å²	59	113 Å²	113	49%	0.488	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.8	-15	158.5	0	0	0	0	0	112	T286	T286-A288 PolarHBondContact O-N 3.17Å
289	L	28.1	Very low	25.4	Very low	107 Å²	107	108 Å²	108	56%	0.56	56%	0.56	S	S	*	*	S	Bend	trans	-96.8	-13.3	179.1	-76.4	163.7	0	0	0	114.2	D287 Y291 T292 T363	D287-L289 VanDerWaalsContact C-N 3.29Å; L289-Y291 PolarHBondContact O-N 2.96Å; L289-T292 WeakPolarHBondContact CA-OG1 3.48Å; L289-T292 PolarHBondContact O-N 3.37Å; L289-T292 VanDerWaalsContact O-N 3.15Å; L289-T292 PolarHBondContact O-OG1 2.88Å; L289-T363 HydrophobicContact CD1-CG2 4.37Å
290	S	26.6	Very low	25.5	Very low	47 Å²	47	106.2 Å²	106.2	33%	0.329	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.7	-22.2	170.7	63	0	0	0	0	112.2	D287 T292 Y293	D287-S290 WeakPolarHBondContact CB-OG 3.49Å; D287-S290 PolarHBondContact O-OG 3.47Å; S290-T292 VanDerWaalsContact C-N 3.26Å; S290-T292 PolarHBondContact O-N 2.91Å; S290-Y293 PolarHBondContact O-N 3.3Å
291	Y	30.2	Very low	25.6	Very low	67 Å²	67	105.2 Å²	105.2	26%	0.263	55%	0.549	S	S	.	.	H	α-helix	trans	-63.9	-27.8	170.4	-79.6	-76.8	0	0	0	113.5	S235 L289 Y293 F409	S235-Y291 WeakPolarHBondContact CA-OH 3.45Å; S235-Y291 WeakPolarHBondContact CB-OH 3.25Å; L289-Y291 PolarHBondContact O-N 2.96Å; Y291-Y293 VanDerWaalsContact C-N 3.34Å; Y291-Y293 PolarHBondContact O-N 2.92Å; Y291-F409 HydrophobicContact CD2-CZ 4.18Å; Y291-F409 HydrophobicContact CE2-CZ 4.43Å
292	T	27.4	Very low	25.6	Very low	49 Å²	49	103.1 Å²	103.1	30%	0.301	55%	0.545	S	S	.	.	H	α-helix	trans	-74.7	-21.3	-179.7	5.5	0	0	0	0	113.8	L289 S290 T296	L289-T292 WeakPolarHBondContact CA-OG1 3.48Å; L289-T292 PolarHBondContact O-N 3.37Å; L289-T292 VanDerWaalsContact O-N 3.15Å; L289-T292 PolarHBondContact O-OG1 2.88Å; S290-T292 VanDerWaalsContact C-N 3.26Å; S290-T292 PolarHBondContact O-N 2.91Å; T292-T296 PolarHBondContact O-OG1 3.46Å
293	Y	26.8	Very low	25.7	Very low	176 Å²	176	104.3 Å²	104.3	69%	0.69	54%	0.543	S	S	*	.	H	α-helix	trans	-91	-27.3	-174.9	-143.8	-92.7	0	0	0	113.6	S290 Y291 T296	S290-Y293 PolarHBondContact O-N 3.3Å; Y291-Y293 VanDerWaalsContact C-N 3.34Å; Y291-Y293 PolarHBondContact O-N 2.92Å; Y293-T296 VanDerWaalsContact C-OG1 3.27Å; Y293-T296 WeakPolarHBondContact CA-OG1 3.45Å; Y293-T296 PolarHBondContact O-OG1 3.28Å
294	H	23.4	Very low	25.6	Very low	120 Å²	120	103.5 Å²	103.5	56%	0.556	54%	0.54	S	S	*	.	H	α-helix	trans	-79.5	-30.7	-176.7	-118.8	-68.7	0	0	0	113.6
295	W	24.6	Very low	25.7	Very low	153 Å²	153	103.8 Å²	103.8	58%	0.58	54%	0.54	S	S	*	.	H	α-helix	trans	-81.4	-15.9	176.3	-83.3	76.5	0	0	0	113.8	N297	W295-N297 VanDerWaalsContact C-N 3.33Å
296	T	25.5	Very low	25.5	Very low	25 Å²	25	105.2 Å²	105.2	15%	0.153	54%	0.535	C	S	.	.	H	α-helix	trans	-69.6	-31.4	170.4	29.9	0	0	0	0	112.7	T292 Y293 C299	T292-T296 PolarHBondContact O-OG1 3.46Å; Y293-T296 VanDerWaalsContact C-OG1 3.27Å; Y293-T296 WeakPolarHBondContact CA-OG1 3.45Å; Y293-T296 PolarHBondContact O-OG1 3.28Å; T296-C299 PolarHBondContact O-N 3.45Å
297	N	24.4	Very low	25.6	Very low	72 Å²	72	109.7 Å²	109.7	39%	0.385	55%	0.549	S	S	.	.	H	α-helix	trans	-77.5	-28.4	-176.9	-73	-8.6	0	0	0	112.9	W295 C299 I300 D301	W295-N297 VanDerWaalsContact C-N 3.33Å; N297-C299 PolarHBondContact O-N 3.29Å; N297-I300 PolarHBondContact O-N 3.45Å; N297-D301 PolarHBondContact O-N 3.14Å
298	D	24.9	Very low	25.6	Very low	105 Å²	105	115 Å²	115	56%	0.561	56%	0.562	S	S	*	*	H	α-helix	trans	-69.2	-15.1	175.2	-76.6	-6.9	0	0	0	114
299	C	24.5	Very low	25.4	Very low	77 Å²	77	118.4 Å²	118.4	52%	0.52	57%	0.571	S	S	.	*	H	α-helix	trans	-91.6	-18.9	168	-73.4	0	0	0	0	113.1	T296 N297 S302	T296-C299 PolarHBondContact O-N 3.45Å; N297-C299 PolarHBondContact O-N 3.29Å; C299-S302 PolarHBondContact O-OG 3.35Å
300	I	26.2	Very low	25.1	Very low	106 Å²	106	123.1 Å²	123.1	54%	0.544	59%	0.587	S	S	.	*	H	α-helix	trans	-86.3	-28.8	176.7	-64.5	172.4	0	0	0	110.8	N297 S302 K303	N297-I300 PolarHBondContact O-N 3.45Å; I300-S302 PolarHBondContact O-N 2.98Å; I300-K303 PolarHBondContact O-N 3.27Å
301	D	23.9	Very low	24.9	Very low	100 Å²	100	126.2 Å²	126.2	54%	0.535	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.7	15.6	178.4	-121.7	-8.8	0	0	0	114.8	N297 K303	N297-D301 PolarHBondContact O-N 3.14Å; D301-K303 VanDerWaalsContact C-N 3.25Å
302	S	25.3	Very low	24.4	Very low	89 Å²	89	129.9 Å²	129.9	62%	0.622	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	1.9	165.2	66.6	0	0	0	0	113.7	C299 I300	C299-S302 PolarHBondContact O-OG 3.35Å; I300-S302 PolarHBondContact O-N 2.98Å
303	K	25.3	Very low	24.2	Very low	180 Å²	180	136.3 Å²	136.3	78%	0.783	65%	0.647	S	S	*	*	S	Bend	trans	-94.9	-19.5	174.1	-84.8	-171.3	172.9	-176.1	0	115.5	I300 D301	I300-K303 PolarHBondContact O-N 3.27Å; D301-K303 VanDerWaalsContact C-N 3.25Å
304	D	24.2	Very low	23.8	Very low	129 Å²	129	138.6 Å²	138.6	69%	0.69	66%	0.656	S	S	*	*	S	Bend	trans	-101.2	2.6	-175.9	-78.8	-8.8	0	0	0	115.6
305	I	24.6	Very low	23.7	Very low	146 Å²	146	142.1 Å²	142.1	75%	0.749	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-4.3	174.2	-59.8	178.5	0	0	0	112.9	H307	I305-H307 VanDerWaalsContact C-N 3.34Å; I305-H307 PolarHBondContact O-N 3.4Å
306	Y	24.1	Very low	23.5	Very low	207 Å²	207	141.4 Å²	141.4	81%	0.812	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-3.3	177.6	-105.1	-80	0	0	0	115.8
307	H	25.5	Very low	23.5	Very low	183 Å²	183	146.3 Å²	146.3	85%	0.847	71%	0.708	S	S	*	*	S	Bend	trans	-135.5	12.5	-176.7	-91.6	-62.5	0	0	0	118.4	I305	I305-H307 VanDerWaalsContact C-N 3.34Å; I305-H307 PolarHBondContact O-N 3.4Å
308	R	24.4	Very low	23.5	Very low	219 Å²	219	146.6 Å²	146.6	83%	0.826	72%	0.715	S	S	*	*	S	Bend	trans	-145.9	72.4	175.1	-134.1	-179	-82.2	-158.7	-1.5	113.5
309	N	24.3	Very low	23.5	Very low	129 Å²	129	148.8 Å²	148.8	69%	0.69	73%	0.727	S	S	*	*			trans	162.2	98.1	131.6	-80.1	-17.6	0	0	0	108.9	I311	N309-I311 HydrophobicContact CB-CD1 4.11Å; N309-I311 HydrophobicContact CB-CG1 4.14Å; N309-I311 PolarHBondContact O-N 3.15Å
310	K	20.8	Very low	23.4	Very low	206 Å²	206	154.7 Å²	154.7	90%	0.896	75%	0.747	S	S	*	*			trans	-63.6	84	159	-167.1	-177.8	-173.6	-175.9	0	106.7
311	I	23	Very low	23.4	Very low	113 Å²	113	157.5 Å²	157.5	58%	0.579	76%	0.762	S	S	*	*			trans	-121	106	167.8	-63.6	174.1	0	0	0	105	N309 F313	N309-I311 HydrophobicContact CB-CD1 4.11Å; N309-I311 HydrophobicContact CB-CG1 4.14Å; N309-I311 PolarHBondContact O-N 3.15Å; I311-F313 HydrophobicContact CG2-CD2 4.06Å; I311-F313 HydrophobicContact CG2-CE2 4.35Å; I311-F313 PolarHBondContact O-N 2.98Å
312	D	20.1	Very low	23.2	Very low	144 Å²	144	160.7 Å²	160.7	77%	0.77	77%	0.774	S	S	*	*			trans	-55.9	114.4	173.7	-63.1	-49.5	0	0	0	108.8
313	F	21.7	Very low	23.3	Very low	184 Å²	184	164 Å²	164	81%	0.807	78%	0.783	S	S	*	*			trans	-119.4	107.4	165	-111.5	-86.8	0	0	0	108.5	I311 F315	I311-F313 HydrophobicContact CG2-CD2 4.06Å; I311-F313 HydrophobicContact CG2-CE2 4.35Å; I311-F313 PolarHBondContact O-N 2.98Å; F313-F315 PolarHBondContact O-N 3.32Å
314	Y	19.5	Very low	23.2	Very low	223 Å²	223	162.3 Å²	162.3	88%	0.875	78%	0.783	S	S	*	*			trans	-47.1	127.1	169.6	-110.1	-106.6	0	0	0	110.4	D316	Y314-D316 PolarHBondContact O-N 3.07Å
315	F	21.6	Very low	23.2	Very low	194 Å²	194	164.6 Å²	164.6	85%	0.851	79%	0.789	S	S	*	*			trans	-76.2	100.3	166	-93.1	-94.8	0	0	0	108	F313 T317	F313-F315 PolarHBondContact O-N 3.32Å; F315-T317 PolarHBondContact O-N 2.89Å
316	D	20.9	Very low	23.4	Very low	138 Å²	138	163.4 Å²	163.4	74%	0.738	79%	0.791	S	S	*	*			trans	-80.5	105	163.4	-161.5	1.1	0	0	0	108.3	Y314 S318	Y314-D316 PolarHBondContact O-N 3.07Å; D316-S318 VanDerWaalsContact C-N 3.3Å; D316-S318 PolarHBondContact O-N 3.21Å
317	T	25.3	Very low	23.5	Very low	129 Å²	129	162.1 Å²	162.1	79%	0.791	79%	0.792	S	S	*	*			trans	-85.7	69.4	178.3	48.7	0	0	0	0	110	F315	F315-T317 PolarHBondContact O-N 2.89Å
318	S	23.8	Very low	23.5	Very low	77 Å²	77	159.5 Å²	159.5	54%	0.538	79%	0.792	S	S	.	*			trans	-160.6	91.4	162.8	55.9	0	0	0	0	109.6	D316	D316-S318 VanDerWaalsContact C-N 3.3Å; D316-S318 PolarHBondContact O-N 3.21Å
319	N	25	Very low	23.9	Very low	151 Å²	151	155.1 Å²	155.1	81%	0.807	79%	0.789	S	S	*	*			trans	-174.5	96.2	145.1	-88.9	-21.2	0	0	0	107.4	L321	N319-L321 PolarHBondContact O-N 3.05Å
320	E	22.6	Very low	24.1	Very low	201 Å²	201	154.4 Å²	154.4	94%	0.939	79%	0.785	S	S	*	*			trans	-55.3	99.3	164	-66.9	175.7	150.9	0	0	108.2	E322	E320-E322 PolarHBondContact O-N 3.46Å
321	L	24.7	Very low	24.6	Very low	165 Å²	165	152.3 Å²	152.3	86%	0.864	78%	0.779	S	S	*	*			trans	-81.2	102.7	174	-101.9	146.7	0	0	0	108.1	N319 I323	N319-L321 PolarHBondContact O-N 3.05Å; L321-I323 PolarHBondContact O-N 3.16Å
322	E	21.6	Very low	24.9	Very low	168 Å²	168	153.3 Å²	153.3	79%	0.785	79%	0.785	S	S	*	*			trans	-39.8	123.7	171.8	-83.6	175.2	135.3	0	0	111.9	E320 N324	E320-E322 PolarHBondContact O-N 3.46Å; E322-N324 VanDerWaalsContact C-N 3.34Å; E322-N324 PolarHBondContact O-N 3.31Å
323	I	25.7	Very low	25.6	Very low	157 Å²	157	153.6 Å²	153.6	81%	0.805	79%	0.786	S	S	*	*			trans	-68.9	95.6	167.6	-61.3	170.7	0	0	0	106	L321 E325	L321-I323 PolarHBondContact O-N 3.16Å; I323-E325 PolarHBondContact O-N 3.3Å
324	N	24.3	Very low	25.8	Very low	146 Å²	146	152.4 Å²	152.4	78%	0.781	78%	0.781	S	S	*	*			trans	-59	110.7	167.6	-78.2	-41.3	0	0	0	108.5	E322	E322-N324 VanDerWaalsContact C-N 3.34Å; E322-N324 PolarHBondContact O-N 3.31Å
325	E	23.8	Very low	26.1	Very low	176 Å²	176	147.6 Å²	147.6	82%	0.822	77%	0.774	S	S	*	*			trans	-57.2	139.8	172.4	-73	-174	151.9	0	0	110.1	I323	I323-E325 PolarHBondContact O-N 3.3Å
326	P	28	Very low	26.2	Very low	121 Å²	121	145.3 Å²	145.3	79%	0.786	77%	0.77	S	S	*	*			trans	-64.1	138.6	178.5	25	-31.5	0	0	0	111.4
327	E	27.7	Very low	26.2	Very low	180 Å²	180	148.1 Å²	148.1	84%	0.841	77%	0.772	S	S	*	*			trans	-44.9	138	176.6	-79.4	-176.9	154.8	0	0	112.6	V329	E327-V329 PolarHBondContact O-N 3.17Å
328	P	25.8	Very low	26.3	Very low	129 Å²	129	146.9 Å²	146.9	84%	0.838	76%	0.76	S	S	*	*			trans	-67.2	125.1	-173.4	26.9	-33	0	0	0	110.9	D330	P328-D330 PolarHBondContact O-N 2.97Å
329	V	31.3	Very low	26.5	Very low	127 Å²	127	150.8 Å²	150.8	77%	0.77	77%	0.767	S	S	*	*			trans	-76.9	117.3	168.5	179.3	0	0	0	0	107.5	E327 E331	E327-V329 PolarHBondContact O-N 3.17Å; V329-E331 PolarHBondContact O-N 3.44Å; V329-E331 VanDerWaalsContact O-N 3.12Å
330	D	28.8	Very low	26.3	Very low	113 Å²	113	151.4 Å²	151.4	60%	0.604	77%	0.765	S	S	*	*			trans	-39.4	112.3	175.2	-172.2	-10.3	0	0	0	112	P328 N332 L333	P328-D330 PolarHBondContact O-N 2.97Å; D330-N332 PolarHBondContact O-N 2.9Å; D330-N332 VanDerWaalsContact O-N 3.08Å; D330-N332 PolarHBondContact OD1-N 3.09Å; D330-N332 PolarHBondContact OD1-ND2 2.84Å; D330-L333 PolarHBondContact O-N 3.5Å
331	E	30.8	Very low	26.3	Very low	162 Å²	162	148.3 Å²	148.3	76%	0.757	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-60.8	-18.2	-173.2	-82.4	-170.5	134.4	0	0	113.6	V329 L333 K334	V329-E331 PolarHBondContact O-N 3.44Å; V329-E331 VanDerWaalsContact O-N 3.12Å; E331-L333 PolarHBondContact O-N 3Å; E331-K334 PolarHBondContact O-N 3.34Å
332	N	29.5	Very low	26.1	Very low	135 Å²	135	145.1 Å²	145.1	72%	0.722	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-75.4	-3.1	-179.3	-66.6	-44.6	0	0	0	114.2	D330	D330-N332 PolarHBondContact O-N 2.9Å; D330-N332 VanDerWaalsContact O-N 3.08Å; D330-N332 PolarHBondContact OD1-N 3.09Å; D330-N332 PolarHBondContact OD1-ND2 2.84Å
333	L	34.6	Very low	26.2	Very low	150 Å²	150	145 Å²	145	79%	0.785	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-94.3	4.1	176.6	-137.4	83.6	0	0	0	114.4	D330 E331 T335	D330-L333 PolarHBondContact O-N 3.5Å; E331-L333 PolarHBondContact O-N 3Å; L333-T335 PolarHBondContact O-N 2.86Å
334	K	26.6	Very low	26.1	Very low	159 Å²	159	142.9 Å²	142.9	69%	0.691	74%	0.74	S	S	*	*	S	Bend	trans	-71.9	-1.7	176.8	-98	-178.1	179.6	172.3	0	114.9	E331	E331-K334 PolarHBondContact O-N 3.34Å
335	T	25.3	Very low	26.2	Very low	121 Å²	121	144.6 Å²	144.6	74%	0.742	74%	0.743	S	S	*	*			trans	-123.7	73.2	-171.3	22.2	0	0	0	0	112.9	L333	L333-T335 PolarHBondContact O-N 2.86Å
336	L	23.2	Very low	26.1	Very low	147 Å²	147	144.4 Å²	144.4	77%	0.77	74%	0.742	S	S	*	*			trans	-160.2	64.2	134.5	-141.6	74.8	0	0	0	111.1	I338	L336-I338 HydrophobicContact CD1-CD1 4.16Å; L336-I338 HydrophobicContact CD2-CD1 4.38Å; L336-I338 HydrophobicContact CG-CD1 4.02Å; L336-I338 HydrophobicContact CG-CG1 4.17Å; L336-I338 PolarHBondContact O-N 3.5Å
337	Y	22.8	Very low	25.9	Very low	196 Å²	196	146 Å²	146	77%	0.769	74%	0.744	S	S	*	*			trans	-73.7	77.4	162.3	-82.6	-89.8	0	0	0	109.1
338	I	26.8	Very low	25.7	Very low	104 Å²	104	142.9 Å²	142.9	53%	0.533	74%	0.737	S	S	.	*			trans	-109.2	127.9	162.2	-54.9	175.8	0	0	0	105.5	L336	L336-I338 HydrophobicContact CD1-CD1 4.16Å; L336-I338 HydrophobicContact CD2-CD1 4.38Å; L336-I338 HydrophobicContact CG-CD1 4.02Å; L336-I338 HydrophobicContact CG-CG1 4.17Å; L336-I338 PolarHBondContact O-N 3.5Å
339	F	26.7	Very low	25.7	Very low	159 Å²	159	143.9 Å²	143.9	70%	0.697	73%	0.734	S	S	*	*			trans	88	63.7	-175.6	-43.8	-67.7	0	0	0	116.1	I341	F339-I341 PolarHBondContact O-N 3.48Å
340	H	20.8	Very low	25.2	Very low	163 Å²	163	144.6 Å²	144.6	76%	0.755	73%	0.733	S	S	*	*			trans	-67.4	111.4	136.8	-103.1	-83.2	0	0	0	107.6
341	I	23.6	Very low	25.2	Very low	137 Å²	137	147.7 Å²	147.7	70%	0.703	74%	0.744	S	S	*	*			trans	-115.8	113.2	154.7	-62.6	174.3	0	0	0	104.9	F339 I343	F339-I341 PolarHBondContact O-N 3.48Å; I341-I343 PolarHBondContact O-N 3.34Å
342	P	20.7	Very low	24.8	Very low	97 Å²	97	144.4 Å²	144.4	63%	0.63	74%	0.739	S	S	*	*			trans	-67.2	131.6	178.1	25.9	-29.5	0	0	0	109.3	T344	P342-T344 PolarHBondContact O-N 3.07Å; P342-T344 VanDerWaalsContact O-N 3.11Å
343	I	24.3	Very low	24.5	Very low	167 Å²	167	148.8 Å²	148.8	86%	0.856	75%	0.747	S	S	*	*			trans	-70.7	101.7	165.7	-58.5	169.5	0	0	0	104.8	I341	I341-I343 PolarHBondContact O-N 3.34Å
344	T	21.9	Very low	24	Very low	112 Å²	112	148.5 Å²	148.5	69%	0.687	75%	0.745	S	S	*	*			trans	-66.2	136.6	169.2	34.5	0	0	0	0	108.7	P342 H346	P342-T344 PolarHBondContact O-N 3.07Å; P342-T344 VanDerWaalsContact O-N 3.11Å; T344-H346 PolarHBondContact O-N 3.47Å
345	E	26.8	Very low	23.9	Very low	181 Å²	181	145.7 Å²	145.7	85%	0.846	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	16.6	-170.9	-70.5	176.9	142	0	0	115.8
346	H	23	Very low	24	Very low	173 Å²	173	148.3 Å²	148.3	80%	0.801	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	2.1	-169.1	-106	-68.4	0	0	0	117.2	T344 V348	T344-H346 PolarHBondContact O-N 3.47Å; H346-V348 VanDerWaalsContact C-N 3.28Å; H346-V348 PolarHBondContact O-N 2.86Å
347	D	23	Very low	24.1	Very low	153 Å²	153	144.9 Å²	144.9	82%	0.818	73%	0.73	S	S	*	*			trans	-97.2	47.8	168	-67.1	-22.6	0	0	0	111.1	I349	D347-I349 PolarHBondContact O-N 3.01Å; D347-I349 VanDerWaalsContact O-N 3.09Å
348	V	23.5	Very low	24.2	Very low	116 Å²	116	140.5 Å²	140.5	70%	0.703	72%	0.72	S	S	*	*			trans	-75.5	85.5	158.1	-179.2	0	0	0	0	105.9	H346 D350	H346-V348 VanDerWaalsContact C-N 3.28Å; H346-V348 PolarHBondContact O-N 2.86Å; V348-D350 PolarHBondContact O-N 3.33Å
349	I	24.8	Very low	24.4	Very low	150 Å²	150	141.7 Å²	141.7	77%	0.769	73%	0.726	S	S	*	*			trans	-66.5	116.4	168.8	-64.6	174.5	0	0	0	106.8	D347 E351	D347-I349 PolarHBondContact O-N 3.01Å; D347-I349 VanDerWaalsContact O-N 3.09Å; I349-E351 PolarHBondContact O-N 3.3Å
350	D	22	Very low	24.4	Very low	142 Å²	142	140.5 Å²	140.5	76%	0.759	73%	0.727	S	S	*	*			trans	-47.2	131.2	179	-90.6	-44.5	0	0	0	112.6	V348 S352	V348-D350 PolarHBondContact O-N 3.33Å; D350-S352 VanDerWaalsContact C-N 3.25Å; D350-S352 PolarHBondContact O-N 2.94Å
351	E	28.5	Very low	24.6	Very low	177 Å²	177	141 Å²	141	83%	0.827	73%	0.727	S	S	*	*	S	Bend	trans	-84.7	33.6	-162.4	-145	178	-161.7	0	0	113.8	I349	I349-E351 PolarHBondContact O-N 3.3Å
352	S	23.3	Very low	24.7	Very low	93 Å²	93	140.5 Å²	140.5	65%	0.65	72%	0.722	S	S	*	*	S	Bend	trans	-127.4	121.2	-179.8	67.5	0	0	0	0	111.2	D350	D350-S352 VanDerWaalsContact C-N 3.25Å; D350-S352 PolarHBondContact O-N 2.94Å
353	Y	21.4	Very low	25.1	Very low	227 Å²	227	140.3 Å²	140.3	89%	0.89	72%	0.719	S	S	*	*			trans	80.4	66.7	-175.8	-79.6	-96.4	0	0	0	116.6
354	L	25.9	Very low	25.5	Very low	144 Å²	144	136.6 Å²	136.6	75%	0.754	71%	0.708	S	S	*	*			trans	-105.2	95.4	148.8	-148.2	79.9	0	0	0	108.4
355	D	23	Very low	26.1	Very low	101 Å²	101	134 Å²	134	54%	0.54	69%	0.694	S	S	.	*			trans	-65.5	130.9	-179.6	-165.5	8.9	0	0	0	110.8	S357 L358	D355-S357 PolarHBondContact O-N 2.81Å; D355-S357 PolarHBondContact OD2-OG 3.49Å; D355-L358 PolarHBondContact O-N 3.02Å
356	E	28.2	Very low	26.8	Very low	175 Å²	175	128.9 Å²	128.9	82%	0.818	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-56.9	-15.3	-179.9	-88.2	178.7	153.3	0	0	113.1	L358 L359	E356-L358 VanDerWaalsContact C-N 3.32Å; E356-L358 PolarHBondContact O-N 3.29Å; E356-L359 WeakPolarHBondContact O-CB 3.33Å; E356-L359 PolarHBondContact O-N 3.16Å
357	S	25.3	Very low	27.6	Very low	76 Å²	76	124.1 Å²	124.1	53%	0.531	66%	0.659	S	S	.	*	G	3₁₀ helix	trans	-71.2	-19.5	179.4	72.3	0	0	0	0	114.7	D355 L359	D355-S357 PolarHBondContact O-N 2.81Å; D355-S357 PolarHBondContact OD2-OG 3.49Å; S357-L359 VanDerWaalsContact C-N 3.33Å
358	L	25.6	Very low	28.6	Very low	104 Å²	104	118 Å²	118	55%	0.545	63%	0.632	S	S	.	*	G	3₁₀ helix	trans	-78.9	-13.7	174.3	-82.2	163.2	0	0	0	113.8	D355 E356 N360	D355-L358 PolarHBondContact O-N 3.02Å; E356-L358 VanDerWaalsContact C-N 3.32Å; E356-L358 PolarHBondContact O-N 3.29Å; L358-N360 PolarHBondContact O-N 3.26Å
359	L	30	Very low	29.7	Very low	128 Å²	128	114.6 Å²	114.6	67%	0.67	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-61.1	-26.4	-178.6	-164.8	69.7	0	0	0	112.9	E356 S357	E356-L359 WeakPolarHBondContact O-CB 3.33Å; E356-L359 PolarHBondContact O-N 3.16Å; S357-L359 VanDerWaalsContact C-N 3.33Å
360	N	26.3	Very low	30.8	Very low	134 Å²	134	113.1 Å²	113.1	72%	0.717	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-101.5	-7.7	-171.2	-74.9	-16.5	0	0	0	115.7	L358	L358-N360 PolarHBondContact O-N 3.26Å
361	K	25.3	Very low	31.9	Very low	173 Å²	173	110.1 Å²	110.1	75%	0.752	59%	0.585	S	S	*	*	S	Bend	trans	-106.7	2	-167.7	-85.1	-175.1	178.2	175.5	0	118
362	H	26.6	Very low	32.7	Very low	128 Å²	128	103.3 Å²	103.3	59%	0.593	56%	0.562	S	S	*	*			trans	-124.5	60.9	179	-77.7	-62.2	0	0	0	114.8
363	T	29.2	Very low	33.8	Very low	92 Å²	92	101.1 Å²	101.1	56%	0.564	54%	0.542	S	S	*	.	S	Bend	trans	-94.2	12.4	173.5	49.8	0	0	0	0	114.6	L289	L289-T363 HydrophobicContact CD1-CG2 4.37Å
364	S	32.8	Very low	35	Very low	90 Å²	90	93.4 Å²	93.4	63%	0.629	52%	0.518	S	S	*	.	S	Bend	trans	-129.6	7.7	-172.6	-39.6	0	0	0	0	117.1	R66	R66-S364 PolarHBondContact NH2-O 2.63Å
365	S	34.6	Very low	36	Very low	56 Å²	56	89.3 Å²	89.3	39%	0.392	50%	0.502	S	S	.	.	S	Bend	trans	-108.6	151.9	178.9	175	0	0	0	0	111.6	N367 G368	S365-N367 PolarHBondContact O-N 3.1Å; S365-N367 PolarHBondContact OG-N 3.4Å; S365-G368 PolarHBondContact O-N 3.4Å
366	S	41.2	Very low	37	Very low	74 Å²	74	86.8 Å²	86.8	52%	0.517	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-19.6	172.6	53.9	0	0	0	0	113.7
367	N	40	Very low	37.5	Very low	74 Å²	74	80.9 Å²	80.9	40%	0.396	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-7.6	-176.3	-61	3	0	0	0	113.8	S365 C369 F370 N371	S365-N367 PolarHBondContact O-N 3.1Å; S365-N367 PolarHBondContact OG-N 3.4Å; N367-C369 VanDerWaalsContact C-N 3.27Å; N367-C369 PolarHBondContact O-N 2.91Å; N367-F370 PolarHBondContact O-N 2.91Å; N367-F370 VanDerWaalsContact O-N 3.12Å; N367-N371 PolarHBondContact O-N 3.07Å
368	G	43.8	Very low	38.4	Very low	24 Å²	24	82.2 Å²	82.2	25%	0.247	46%	0.461	C	S	.	.	H	α-helix	trans	-60	-36.4	-175.2	0	0	0	0	0	113.5	S365 G372	S365-G368 PolarHBondContact O-N 3.4Å; G368-G372 PolarHBondContact O-N 2.96Å
369	C	46	Very low	39.2	Very low	44 Å²	44	82.3 Å²	82.3	30%	0.297	46%	0.455	S	S	.	.	H	α-helix	trans	-71.7	-36.7	177.6	-165.3	0	0	0	0	112.8	N367 M373 C410	N367-C369 VanDerWaalsContact C-N 3.27Å; N367-C369 PolarHBondContact O-N 2.91Å; C369-M373 PolarHBondContact O-N 3.45Å; C369-M373 VanDerWaalsContact O-N 3.12Å; C369-C410 HydrophobicContact CB-CB 4.43Å; C369-C410 WeakPolarHBondContact CB-SG 3.16Å; C369-C410 WeakPolarHBondContact SG-CA 3.26Å; C369-C410 WeakPolarHBondContact SG-CB 3.46Å; C369-C410 CovalentContact SG-SG 2.02Å; C369-C410 PolarHBondContact SG-SG 2.89Å
370	F	47.7	Very low	39.9	Very low	120 Å²	120	78.6 Å²	78.6	53%	0.526	44%	0.436	S	S	.	.	H	α-helix	trans	-68.3	-47.1	175.3	-179.1	-97.4	0	0	0	111	N367 G372 M373 V374	N367-F370 PolarHBondContact O-N 2.91Å; N367-F370 VanDerWaalsContact O-N 3.12Å; F370-G372 VanDerWaalsContact C-N 3.32Å; F370-G372 PolarHBondContact O-N 2.87Å; F370-M373 WeakPolarHBondContact O-CB 3.42Å; F370-M373 PolarHBondContact O-N 3.29Å; F370-V374 HydrophobicContact CD1-CG2 4.26Å; F370-V374 HydrophobicContact CE1-CG2 3.89Å; F370-V374 HydrophobicContact CZ-CG2 4.13Å; F370-V374 WeakPolarHBondContact O-CG2 3.47Å; F370-V374 PolarHBondContact O-N 3.33Å
371	N	45.1	Very low	40.6	Very low	79 Å²	79	79.5 Å²	79.5	42%	0.422	43%	0.43	S	S	.	.	H	α-helix	trans	-59.7	-43	176.4	-68.6	-0.4	0	0	0	111.3	N367 M373 V374 S375	N367-N371 PolarHBondContact O-N 3.07Å; N371-M373 VanDerWaalsContact C-N 3.28Å; N371-M373 PolarHBondContact O-N 3Å; N371-V374 PolarHBondContact O-N 3.38Å; N371-S375 PolarHBondContact O-N 3.21Å; N371-S375 PolarHBondContact O-OG 3.49Å; N371-S375 VanDerWaalsContact O-OG 3.13Å
372	G	46.1	Very low	41.6	Very low	34 Å²	34	79.7 Å²	79.7	35%	0.351	43%	0.431	S	S	.	.	H	α-helix	trans	-61.4	-34	174.7	0	0	0	0	0	113.6	G368 F370 K376	G368-G372 PolarHBondContact O-N 2.96Å; F370-G372 VanDerWaalsContact C-N 3.32Å; F370-G372 PolarHBondContact O-N 2.87Å; G372-K376 WeakPolarHBondContact O-CB 3.35Å; G372-K376 PolarHBondContact O-N 3.39Å
373	M	46.7	Very low	42.6	Very low	47 Å²	47	79.4 Å²	79.4	23%	0.232	43%	0.43	C	S	.	.	H	α-helix	trans	-68.4	-43.2	174.6	-167.5	176.6	-179.6	0	0	111.6	C369 F370 N371 K376 C377 I403 R407	C369-M373 PolarHBondContact O-N 3.45Å; C369-M373 VanDerWaalsContact O-N 3.12Å; F370-M373 WeakPolarHBondContact O-CB 3.42Å; F370-M373 PolarHBondContact O-N 3.29Å; N371-M373 VanDerWaalsContact C-N 3.28Å; N371-M373 PolarHBondContact O-N 3Å; M373-K376 PolarHBondContact O-N 2.84Å; M373-C377 PolarHBondContact O-N 2.88Å; M373-C377 VanDerWaalsContact O-N 3.09Å; M373-C377 PolarHBondContact O-SG 3.05Å; M373-I403 HydrophobicContact CE-CG2 3.48Å; M373-I403 VanDerWaalsContact CE-CG2 3.48Å; M373-R407 HydrophobicContact CE-CB 4.05Å
374	V	45	Very low	43.6	Very low	65 Å²	65	80.4 Å²	80.4	39%	0.394	42%	0.423	S	S	.	.	H	α-helix	trans	-63.6	-49.5	177.7	175.4	0	0	0	0	111.2	F370 N371 K376 C377 Q378	F370-V374 HydrophobicContact CD1-CG2 4.26Å; F370-V374 HydrophobicContact CE1-CG2 3.89Å; F370-V374 HydrophobicContact CZ-CG2 4.13Å; F370-V374 WeakPolarHBondContact O-CG2 3.47Å; F370-V374 PolarHBondContact O-N 3.33Å; N371-V374 PolarHBondContact O-N 3.38Å; V374-K376 PolarHBondContact O-N 3.2Å; V374-C377 PolarHBondContact O-N 3.1Å; V374-Q378 PolarHBondContact O-N 3.36Å
375	S	46.9	Very low	44.3	Very low	58 Å²	58	83.2 Å²	83.2	41%	0.406	43%	0.431	S	S	.	.	H	α-helix	trans	-58.7	-36	178.3	-58	0	0	0	0	112.3	N371 Q378 Y379	N371-S375 PolarHBondContact O-N 3.21Å; N371-S375 PolarHBondContact O-OG 3.49Å; N371-S375 VanDerWaalsContact O-OG 3.13Å; S375-Q378 PolarHBondContact O-N 3.2Å; S375-Y379 PolarHBondContact O-N 2.94Å
376	K	45.5	Very low	45.2	Very low	47 Å²	47	92.4 Å²	92.4	20%	0.204	46%	0.457	C	S	.	.	H	α-helix	trans	-72	-40.3	178.1	-171.2	59	176.4	-178.4	0	112.8	G372 M373 V374 Q378 Y379 L380	G372-K376 WeakPolarHBondContact O-CB 3.35Å; G372-K376 PolarHBondContact O-N 3.39Å; M373-K376 PolarHBondContact O-N 2.84Å; V374-K376 PolarHBondContact O-N 3.2Å; K376-Q378 VanDerWaalsContact C-N 3.31Å; K376-Q378 PolarHBondContact O-N 2.72Å; K376-Y379 PolarHBondContact O-N 3.34Å; K376-L380 HydrophobicContact CD-CD1 4.49Å; K376-L380 HydrophobicContact CD-CG 4.38Å; K376-L380 HydrophobicContact CG-CD1 4.11Å; K376-L380 HydrophobicContact CG-CG 4.44Å; K376-L380 WeakPolarHBondContact O-CG 3.49Å; K376-L380 PolarHBondContact O-N 3.15Å
377	C	38.4	Very low	45.7	Very low	51 Å²	51	90.9 Å²	90.9	35%	0.345	45%	0.446	S	S	.	.	H	α-helix	trans	-59.6	-43	173.1	-75.3	0	0	0	0	111.1	M373 V374 L380 Y381	M373-C377 PolarHBondContact O-N 2.88Å; M373-C377 VanDerWaalsContact O-N 3.09Å; M373-C377 PolarHBondContact O-SG 3.05Å; V374-C377 PolarHBondContact O-N 3.1Å; C377-L380 PolarHBondContact O-N 3.23Å; C377-Y381 WeakPolarHBondContact O-CB 3.35Å; C377-Y381 PolarHBondContact O-N 3.32Å
378	Q	43.4	Very low	46.5	Very low	104 Å²	104	90.7 Å²	90.7	49%	0.486	45%	0.451	S	S	.	.	H	α-helix	trans	-60.9	-46.7	174.1	-94	176.4	-35.3	0	0	112.6	V374 S375 K376 L380 Y381 K382	V374-Q378 PolarHBondContact O-N 3.36Å; S375-Q378 PolarHBondContact O-N 3.2Å; K376-Q378 VanDerWaalsContact C-N 3.31Å; K376-Q378 PolarHBondContact O-N 2.72Å; Q378-L380 PolarHBondContact O-N 2.82Å; Q378-Y381 PolarHBondContact O-N 3.43Å; Q378-K382 PolarHBondContact O-N 3.42Å
379	Y	43	Very low	47.2	Very low	107 Å²	107	96.7 Å²	96.7	42%	0.42	48%	0.477	S	S	.	.	H	α-helix	trans	-59.2	-47	177.1	177.1	-90.3	0	0	0	112.3	S375 K376 Y381 K382 H383	S375-Y379 PolarHBondContact O-N 2.94Å; K376-Y379 PolarHBondContact O-N 3.34Å; Y379-Y381 VanDerWaalsContact C-N 3.31Å; Y379-Y381 PolarHBondContact O-N 3.33Å; Y379-K382 PolarHBondContact O-N 3.48Å; Y379-H383 AromaticContact CE1-CD2 3.83Å; Y379-H383 AromaticContact CE2-CD2 3.79Å; Y379-H383 AromaticContact CE2-NE2 3.58Å; Y379-H383 AromaticContact CZ-CD2 3.57Å; Y379-H383 AromaticContact CZ-NE2 3.54Å; Y379-H383 PolarHBondContact O-CD2 2.95Å; Y379-H383 PolarHBondContact O-N 3.48Å
380	L	43.9	Very low	47.7	Very low	50 Å²	50	104.4 Å²	104.4	26%	0.262	50%	0.5	S	S	.	.	H	α-helix	trans	-66.7	-34.6	179.8	-67.8	173.7	0	0	0	111.8	K376 C377 Q378 H383 R384 T399	K376-L380 HydrophobicContact CD-CD1 4.49Å; K376-L380 HydrophobicContact CD-CG 4.38Å; K376-L380 HydrophobicContact CG-CD1 4.11Å; K376-L380 HydrophobicContact CG-CG 4.44Å; K376-L380 WeakPolarHBondContact O-CG 3.49Å; K376-L380 PolarHBondContact O-N 3.15Å; C377-L380 PolarHBondContact O-N 3.23Å; Q378-L380 PolarHBondContact O-N 2.82Å; L380-H383 PolarHBondContact O-N 3.33Å; L380-R384 PolarHBondContact O-N 3.2Å; L380-T399 HydrophobicContact CD1-CG2 4Å
381	Y	41.4	Very low	48.1	Very low	152 Å²	152	103.1 Å²	103.1	60%	0.596	50%	0.498	S	S	*	.	H	α-helix	trans	-64.6	-43.3	173.3	-171.7	-93.2	0	0	0	111.9	C377 Q378 Y379 H383 R384	C377-Y381 WeakPolarHBondContact O-CB 3.35Å; C377-Y381 PolarHBondContact O-N 3.32Å; Q378-Y381 PolarHBondContact O-N 3.43Å; Y379-Y381 VanDerWaalsContact C-N 3.31Å; Y379-Y381 PolarHBondContact O-N 3.33Å; Y381-H383 PolarHBondContact O-N 3.4Å; Y381-R384 WeakPolarHBondContact O-CB 3.42Å; Y381-R384 PolarHBondContact O-N 3.47Å
382	K	45.3	Very low	48.7	Very low	177 Å²	177	103.3 Å²	103.3	77%	0.77	50%	0.495	S	S	*	.	H	α-helix	trans	-60.1	-31.2	178.2	-163.4	171.7	-175.9	173	0	113	Q378 Y379	Q378-K382 PolarHBondContact O-N 3.42Å; Y379-K382 PolarHBondContact O-N 3.48Å
383	H	49.5	Very low	49.6	Very low	122 Å²	122	104 Å²	104	57%	0.565	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	4.1	177.6	-76.3	-80.9	0	0	0	114.9	Y379 L380 Y381 N385	Y379-H383 AromaticContact CE1-CD2 3.83Å; Y379-H383 AromaticContact CE2-CD2 3.79Å; Y379-H383 AromaticContact CE2-NE2 3.58Å; Y379-H383 AromaticContact CZ-CD2 3.57Å; Y379-H383 AromaticContact CZ-NE2 3.54Å; Y379-H383 PolarHBondContact O-CD2 2.95Å; Y379-H383 PolarHBondContact O-N 3.48Å; L380-H383 PolarHBondContact O-N 3.33Å; Y381-H383 PolarHBondContact O-N 3.4Å; H383-N385 PolarHBondContact O-N 2.91Å
384	R	48.7	Very low	50.4	Low	113 Å²	113	104.6 Å²	104.6	43%	0.426	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-71.4	-25.3	-175.7	-168.7	177.7	-178.6	173.4	1.4	115.1	L380 Y381 R386 E396	L380-R384 PolarHBondContact O-N 3.2Å; Y381-R384 WeakPolarHBondContact O-CB 3.42Å; Y381-R384 PolarHBondContact O-N 3.47Å; R384-R386 PolarHBondContact O-N 3.38Å; R384-E396 IonicContact CZ-OE1 3.76Å; R384-E396 IonicContact NE-OE1 3.99Å; R384-E396 IonicContact NH2-OE1 2.83Å; R384-E396 PolarHBondContact NH2-OE1 3.07Å
385	N	47.1	Very low	51.2	Low	149 Å²	149	104.5 Å²	104.5	80%	0.797	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-84.3	8.1	-165.2	-81	-13.9	0	0	0	117	H383	H383-N385 PolarHBondContact O-N 2.91Å
386	R	53.6	Low	52	Low	250 Å²	250	105.5 Å²	105.5	94%	0.943	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-113.5	4.5	-175.8	-87.7	-175	177.8	169.4	-0.1	117	R384	R384-R386 PolarHBondContact O-N 3.38Å
387	S	52.6	Low	53	Low	41 Å²	41	109.8 Å²	109.8	29%	0.287	52%	0.516	S	S	.	.	S	Bend	trans	-113.2	147.9	-173.1	64.1	0	0	0	0	114.8	K392	S387-K392 VanDerWaalsContact O-CE 3.24Å; S387-K392 WeakPolarHBondContact O-CE 3.37Å
388	S	56.4	Low	54.3	Low	71 Å²	71	112.6 Å²	112.6	50%	0.497	52%	0.522	S	S	.	.			trans	-63.5	157.7	175.8	75.3	0	0	0	0	112.2	R390 N391 K392	S388-R390 VanDerWaalsContact C-N 3.29Å; S388-R390 PolarHBondContact O-N 3.48Å; S388-R390 VanDerWaalsContact O-N 3.16Å; S388-N391 CarbonylContact O-C 3.58Å; S388-N391 WeakPolarHBondContact O-CA 3.36Å; S388-N391 WeakPolarHBondContact O-CB 3.27Å; S388-N391 PolarHBondContact O-N 3.31Å; S388-K392 PolarHBondContact O-N 3.5Å
389	L	59.6	Low	55.5	Low	150 Å²	150	109.4 Å²	109.4	79%	0.785	51%	0.509	S	S	*	.	H	α-helix	trans	-51.1	-39.5	-176.5	-78.1	153.8	0	0	0	114.3	K392 S393	L389-K392 WeakPolarHBondContact O-CB 3.14Å; L389-K392 PolarHBondContact O-N 3.11Å; L389-S393 PolarHBondContact O-N 2.69Å
390	R	56.1	Low	56.7	Low	206 Å²	206	109.4 Å²	109.4	78%	0.777	51%	0.513	S	S	*	.	H	α-helix	trans	-69	-36.7	175.4	-171.8	176.8	-178.4	178.9	0.8	112.3	S388 K392 S393	S388-R390 VanDerWaalsContact C-N 3.29Å; S388-R390 PolarHBondContact O-N 3.48Å; S388-R390 VanDerWaalsContact O-N 3.16Å; R390-K392 VanDerWaalsContact C-N 3.35Å; R390-S393 PolarHBondContact O-OG 3.49Å
391	N	56.1	Low	58	Low	93 Å²	93	115.1 Å²	115.1	50%	0.497	53%	0.531	S	S	.	.	H	α-helix	trans	-73.4	-28.1	175.6	-72	-14.4	0	0	0	111.8	S388 C395	S388-N391 CarbonylContact O-C 3.58Å; S388-N391 WeakPolarHBondContact O-CA 3.36Å; S388-N391 WeakPolarHBondContact O-CB 3.27Å; S388-N391 PolarHBondContact O-N 3.31Å; N391-C395 WeakPolarHBondContact O-CB 3.32Å; N391-C395 PolarHBondContact O-N 2.98Å
392	K	57.5	Low	59.4	Low	82 Å²	82	109.8 Å²	109.8	36%	0.357	52%	0.515	S	S	.	.	H	α-helix	trans	-60.9	-51.5	174.1	-72.2	-177.3	-179.3	-178.5	0	111.9	S387 S388 L389 R390 V394 C395 E396	S387-K392 VanDerWaalsContact O-CE 3.24Å; S387-K392 WeakPolarHBondContact O-CE 3.37Å; S388-K392 PolarHBondContact O-N 3.5Å; L389-K392 WeakPolarHBondContact O-CB 3.14Å; L389-K392 PolarHBondContact O-N 3.11Å; R390-K392 VanDerWaalsContact C-N 3.35Å; K392-V394 PolarHBondContact O-N 3.03Å; K392-C395 CarbonylContact O-C 3.57Å; K392-C395 PolarHBondContact O-N 2.94Å; K392-E396 WeakPolarHBondContact O-CB 3.42Å; K392-E396 VanDerWaalsContact O-CG 3.29Å; K392-E396 WeakPolarHBondContact O-CG 3.08Å; K392-E396 PolarHBondContact O-N 2.98Å
393	S	64.3	Low	60.8	Low	50 Å²	50	103.9 Å²	103.9	35%	0.35	49%	0.491	S	S	.	.	H	α-helix	trans	-67.5	-34	-177.4	70.4	0	0	0	0	113.8	L389 R390 R397	L389-S393 PolarHBondContact O-N 2.69Å; R390-S393 PolarHBondContact O-OG 3.49Å; S393-R397 PolarHBondContact O-N 3.23Å; S393-R397 VanDerWaalsContact O-N 3.12Å; S393-R397 PolarHBondContact O-NE 2.89Å
394	V	64.2	Low	62.2	Low	59 Å²	59	104.2 Å²	104.2	36%	0.358	49%	0.491	S	S	.	.	H	α-helix	trans	-69.3	-43.1	172.7	176	0	0	0	0	110.3	K392 R397 K398	K392-V394 PolarHBondContact O-N 3.03Å; V394-R397 PolarHBondContact O-N 3.18Å; V394-K398 HydrophobicContact CG1-CD 4.46Å; V394-K398 WeakPolarHBondContact O-CB 3.31Å; V394-K398 WeakPolarHBondContact O-CG 3.43Å; V394-K398 PolarHBondContact O-N 2.97Å
395	C	62.8	Low	63.6	Low	63 Å²	63	101.3 Å²	101.3	43%	0.426	49%	0.486	S	S	.	.	H	α-helix	trans	-64	-39.5	176.7	-170.7	0	0	0	0	111.7	N391 K392 K398 T399	N391-C395 WeakPolarHBondContact O-CB 3.32Å; N391-C395 PolarHBondContact O-N 2.98Å; K392-C395 CarbonylContact O-C 3.57Å; K392-C395 PolarHBondContact O-N 2.94Å; C395-K398 PolarHBondContact O-N 3.35Å; C395-T399 VanDerWaalsContact O-CB 3.26Å; C395-T399 WeakPolarHBondContact O-CB 3.37Å; C395-T399 PolarHBondContact O-N 3.34Å; C395-T399 PolarHBondContact O-OG1 3.46Å
396	E	63.3	Low	65	Low	78 Å²	78	97.2 Å²	97.2	36%	0.364	46%	0.462	S	S	.	.	H	α-helix	trans	-62.4	-49.6	175.1	-76.8	170.5	172.9	0	0	111.3	R384 K392 K398 T399 E400	R384-E396 IonicContact CZ-OE1 3.76Å; R384-E396 IonicContact NE-OE1 3.99Å; R384-E396 IonicContact NH2-OE1 2.83Å; R384-E396 PolarHBondContact NH2-OE1 3.07Å; K392-E396 WeakPolarHBondContact O-CB 3.42Å; K392-E396 VanDerWaalsContact O-CG 3.29Å; K392-E396 WeakPolarHBondContact O-CG 3.08Å; K392-E396 PolarHBondContact O-N 2.98Å; E396-K398 VanDerWaalsContact C-N 3.35Å; E396-K398 PolarHBondContact O-N 3.05Å; E396-T399 WeakPolarHBondContact O-CB 3.25Å; E396-T399 PolarHBondContact O-N 2.91Å; E396-T399 VanDerWaalsContact O-N 3.16Å; E396-E400 WeakPolarHBondContact O-CG 3.1Å; E396-E400 PolarHBondContact O-N 2.65Å
397	R	65.6	Low	66.3	Low	138 Å²	138	91 Å²	91	52%	0.521	44%	0.438	S	S	.	.	H	α-helix	trans	-61.8	-39.6	175.7	-78	-175.8	-74.1	162.6	-7	113	S393 V394 R401	S393-R397 PolarHBondContact O-N 3.23Å; S393-R397 VanDerWaalsContact O-N 3.12Å; S393-R397 PolarHBondContact O-NE 2.89Å; V394-R397 PolarHBondContact O-N 3.18Å; R397-R401 WeakPolarHBondContact O-CB 3.44Å; R397-R401 VanDerWaalsContact O-CG 3.28Å; R397-R401 WeakPolarHBondContact O-CG 3.37Å; R397-R401 PolarHBondContact O-N 2.71Å; R397-R401 VanDerWaalsContact O-N 3.08Å
398	K	65.8	Low	67.7	Low	109 Å²	109	92.8 Å²	92.8	47%	0.474	44%	0.442	S	S	.	.	H	α-helix	trans	-62.8	-46.2	173.8	-77.5	-175	177.2	-172	0	110.7	V394 C395 E396 R401 T402	V394-K398 HydrophobicContact CG1-CD 4.46Å; V394-K398 WeakPolarHBondContact O-CB 3.31Å; V394-K398 WeakPolarHBondContact O-CG 3.43Å; V394-K398 PolarHBondContact O-N 2.97Å; C395-K398 PolarHBondContact O-N 3.35Å; E396-K398 VanDerWaalsContact C-N 3.35Å; E396-K398 PolarHBondContact O-N 3.05Å; K398-R401 PolarHBondContact O-N 3.18Å; K398-T402 PolarHBondContact O-N 2.94Å; K398-T402 PolarHBondContact O-OG1 3.46Å
399	T	68.6	Low	69	Low	37 Å²	37	91.2 Å²	91.2	23%	0.227	43%	0.427	C	S	.	.	H	α-helix	trans	-59.8	-48.2	178.5	-60.8	0	0	0	0	111.4	L380 C395 E396 R401 T402 I403	L380-T399 HydrophobicContact CD1-CG2 4Å; C395-T399 VanDerWaalsContact O-CB 3.26Å; C395-T399 WeakPolarHBondContact O-CB 3.37Å; C395-T399 PolarHBondContact O-N 3.34Å; C395-T399 PolarHBondContact O-OG1 3.46Å; E396-T399 WeakPolarHBondContact O-CB 3.25Å; E396-T399 PolarHBondContact O-N 2.91Å; E396-T399 VanDerWaalsContact O-N 3.16Å; T399-R401 VanDerWaalsContact C-N 3.35Å; T399-R401 PolarHBondContact O-N 3.5Å; T399-T402 PolarHBondContact O-N 3.41Å; T399-I403 HydrophobicContact CG2-CD1 3.72Å; T399-I403 HydrophobicContact CG2-CG1 4.39Å; T399-I403 WeakPolarHBondContact O-CB 3.19Å; T399-I403 VanDerWaalsContact O-CG1 3.23Å; T399-I403 WeakPolarHBondContact O-CG1 3.35Å; T399-I403 PolarHBondContact O-N 2.67Å
400	E	69	Low	70.1	Confident	107 Å²	107	84.4 Å²	84.4	50%	0.5	39%	0.391	S	S	.	.	H	α-helix	trans	-59.9	-42.4	176.1	-75.9	-177	-171.4	0	0	112.8	E396 I403 K404	E396-E400 WeakPolarHBondContact O-CG 3.1Å; E396-E400 PolarHBondContact O-N 2.65Å; E400-I403 PolarHBondContact O-N 3.4Å; E400-K404 WeakPolarHBondContact O-CB 3.38Å; E400-K404 VanDerWaalsContact O-CG 3.29Å; E400-K404 WeakPolarHBondContact O-CG 3.31Å; E400-K404 PolarHBondContact O-N 2.85Å
401	R	70.9	Confident	71.4	Confident	170 Å²	170	76.1 Å²	76.1	64%	0.642	36%	0.361	S	S	*	.	H	α-helix	trans	-62.2	-46.8	175.9	-74.8	175.2	-176.5	-177	0.1	110.7	R397 K398 T399 I403 K404 T405	R397-R401 WeakPolarHBondContact O-CB 3.44Å; R397-R401 VanDerWaalsContact O-CG 3.28Å; R397-R401 WeakPolarHBondContact O-CG 3.37Å; R397-R401 PolarHBondContact O-N 2.71Å; R397-R401 VanDerWaalsContact O-N 3.08Å; K398-R401 PolarHBondContact O-N 3.18Å; T399-R401 VanDerWaalsContact C-N 3.35Å; T399-R401 PolarHBondContact O-N 3.5Å; R401-I403 VanDerWaalsContact C-N 3.34Å; R401-I403 PolarHBondContact O-N 3.33Å; R401-K404 PolarHBondContact O-N 3.35Å; R401-T405 WeakPolarHBondContact O-CB 3.29Å; R401-T405 PolarHBondContact O-N 3.07Å; R401-T405 PolarHBondContact O-OG1 3.34Å
402	T	71.7	Confident	72.8	Confident	40 Å²	40	72.2 Å²	72.2	25%	0.245	34%	0.34	C	S	.	.	H	α-helix	trans	-59.8	-43.8	176.5	-56.7	0	0	0	0	111.7	K398 T399 T405 Q406	K398-T402 PolarHBondContact O-N 2.94Å; K398-T402 PolarHBondContact O-OG1 3.46Å; T399-T402 PolarHBondContact O-N 3.41Å; T402-T405 PolarHBondContact O-N 2.94Å; T402-Q406 WeakPolarHBondContact O-CB 3.3Å; T402-Q406 PolarHBondContact O-N 3.5Å
403	I	74.6	Confident	74	Confident	53 Å²	53	72 Å²	72	27%	0.272	35%	0.345	S	S	.	.	H	α-helix	trans	-62.4	-44.2	176.6	-69.2	169.1	0	0	0	111	M373 T399 E400 R401 Q406 R407	M373-I403 HydrophobicContact CE-CG2 3.48Å; M373-I403 VanDerWaalsContact CE-CG2 3.48Å; T399-I403 HydrophobicContact CG2-CD1 3.72Å; T399-I403 HydrophobicContact CG2-CG1 4.39Å; T399-I403 WeakPolarHBondContact O-CB 3.19Å; T399-I403 VanDerWaalsContact O-CG1 3.23Å; T399-I403 WeakPolarHBondContact O-CG1 3.35Å; T399-I403 PolarHBondContact O-N 2.67Å; E400-I403 PolarHBondContact O-N 3.4Å; R401-I403 VanDerWaalsContact C-N 3.34Å; R401-I403 PolarHBondContact O-N 3.33Å; I403-Q406 PolarHBondContact O-N 3.2Å; I403-R407 WeakPolarHBondContact O-CB 3.3Å; I403-R407 PolarHBondContact O-N 3.47Å
404	K	77.3	Confident	74.8	Confident	130 Å²	130	70.7 Å²	70.7	57%	0.565	33%	0.334	S	S	*	.	H	α-helix	trans	-62.2	-46.3	176.5	-76.5	173.6	-179.1	172.5	0	111.6	E400 R401 R407 Q408	E400-K404 WeakPolarHBondContact O-CB 3.38Å; E400-K404 VanDerWaalsContact O-CG 3.29Å; E400-K404 WeakPolarHBondContact O-CG 3.31Å; E400-K404 PolarHBondContact O-N 2.85Å; R401-K404 PolarHBondContact O-N 3.35Å; K404-R407 PolarHBondContact O-N 3.14Å; K404-Q408 WeakPolarHBondContact O-CG 3.35Å; K404-Q408 PolarHBondContact O-N 3.26Å
405	T	78.9	Confident	75.7	Confident	52 Å²	52	68.1 Å²	68.1	32%	0.319	32%	0.318	S	S	.	.	H	α-helix	trans	-62.2	-43.7	177.5	-56.6	0	0	0	0	111.3	F231 R401 T402 R407 Q408 F409	F231-T405 HydrophobicContact CE1-CG2 3.78Å; F231-T405 HydrophobicContact CZ-CG2 4.17Å; R401-T405 WeakPolarHBondContact O-CB 3.29Å; R401-T405 PolarHBondContact O-N 3.07Å; R401-T405 PolarHBondContact O-OG1 3.34Å; T402-T405 PolarHBondContact O-N 2.94Å; T405-R407 PolarHBondContact O-N 3.44Å; T405-Q408 PolarHBondContact O-N 3.47Å; T405-F409 PolarHBondContact O-N 3Å
406	Q	76.6	Confident	76.7	Confident	62 Å²	62	68.3 Å²	68.3	29%	0.29	32%	0.315	S	S	.	.	H	α-helix	trans	-64.5	-41.1	177.4	-172.4	63.4	15.2	0	0	111.9	T402 I403 F409 C410	T402-Q406 WeakPolarHBondContact O-CB 3.3Å; T402-Q406 PolarHBondContact O-N 3.5Å; I403-Q406 PolarHBondContact O-N 3.2Å; Q406-F409 PolarHBondContact O-N 3.04Å; Q406-C410 WeakPolarHBondContact O-CB 3.35Å; Q406-C410 PolarHBondContact O-N 3.47Å
407	R	79.9	Confident	77.6	Confident	120 Å²	120	70.5 Å²	70.5	45%	0.453	32%	0.323	S	S	.	.	H	α-helix	trans	-59.8	-46.1	174	-176.5	-177.9	166.3	165.8	-0.6	111.3	L143 M373 I403 K404 T405 F409 C410 E411	L143-R407 HydrophobicContact CD1-CG 3.61Å; M373-R407 HydrophobicContact CE-CB 4.05Å; I403-R407 WeakPolarHBondContact O-CB 3.3Å; I403-R407 PolarHBondContact O-N 3.47Å; K404-R407 PolarHBondContact O-N 3.14Å; T405-R407 PolarHBondContact O-N 3.44Å; R407-F409 VanDerWaalsContact C-N 3.34Å; R407-F409 PolarHBondContact O-N 3.31Å; R407-C410 WeakPolarHBondContact O-CB 3.41Å; R407-C410 PolarHBondContact O-N 2.89Å; R407-E411 IonicContact CZ-OE1 3Å; R407-E411 IonicContact NE-OE1 3.74Å; R407-E411 PolarHBondContact NE-OE1 3.05Å; R407-E411 IonicContact NH2-OE1 3.51Å; R407-E411 WeakPolarHBondContact O-CB 3.44Å; R407-E411 WeakPolarHBondContact O-CG 3.32Å; R407-E411 PolarHBondContact O-N 3.43Å
408	Q	83.4	Confident	78.6	Confident	78 Å²	78	65.3 Å²	65.3	36%	0.364	31%	0.305	S	S	.	.	H	α-helix	trans	-62.9	-39.4	176.7	-73.7	178	-10.4	0	0	112.3	F228 F231 K404 T405 E411 K412	F228-Q408 WeakPolarHBondContact CE1-O 3.41Å; F231-Q408 HydrophobicContact CE2-CB 4.28Å; F231-Q408 HydrophobicContact CZ-CB 4Å; K404-Q408 WeakPolarHBondContact O-CG 3.35Å; K404-Q408 PolarHBondContact O-N 3.26Å; T405-Q408 PolarHBondContact O-N 3.47Å; Q408-E411 PolarHBondContact O-N 2.88Å; Q408-K412 WeakPolarHBondContact O-CB 3.47Å; Q408-K412 PolarHBondContact O-N 3.4Å
409	F	82.3	Confident	79.5	Confident	39 Å²	39	62.4 Å²	62.4	17%	0.171	29%	0.293	C	S	.	.	H	α-helix	trans	-62.2	-44.8	173.9	-177	-95.9	0	0	0	111.4	F231 Y291 T405 Q406 R407 K412 V413	F231-F409 HydrophobicContact CD1-CD2 4.47Å; Y291-F409 HydrophobicContact CD2-CZ 4.18Å; Y291-F409 HydrophobicContact CE2-CZ 4.43Å; T405-F409 PolarHBondContact O-N 3Å; Q406-F409 PolarHBondContact O-N 3.04Å; R407-F409 VanDerWaalsContact C-N 3.34Å; R407-F409 PolarHBondContact O-N 3.31Å; F409-K412 WeakPolarHBondContact O-CB 3.14Å; F409-K412 PolarHBondContact O-N 3.14Å; F409-V413 HydrophobicContact CD1-CG2 4.35Å; F409-V413 HydrophobicContact CE1-CG2 4Å; F409-V413 HydrophobicContact CZ-CG2 4.27Å; F409-V413 WeakPolarHBondContact O-CG2 3.04Å; F409-V413 PolarHBondContact O-N 3.09Å
410	C	82.7	Confident	80.2	Confident	7 Å²	7	67.8 Å²	67.8	5%	0.047	31%	0.313	C	S	.	.	H	α-helix	trans	-59.7	-47.9	175	-162.6	0	0	0	0	112.3	C369 Q406 R407 K412 V413 I414	C369-C410 HydrophobicContact CB-CB 4.43Å; C369-C410 WeakPolarHBondContact CB-SG 3.16Å; C369-C410 WeakPolarHBondContact SG-CA 3.26Å; C369-C410 WeakPolarHBondContact SG-CB 3.46Å; C369-C410 CovalentContact SG-SG 2.02Å; C369-C410 PolarHBondContact SG-SG 2.89Å; Q406-C410 WeakPolarHBondContact O-CB 3.35Å; Q406-C410 PolarHBondContact O-N 3.47Å; R407-C410 WeakPolarHBondContact O-CB 3.41Å; R407-C410 PolarHBondContact O-N 2.89Å; C410-K412 VanDerWaalsContact C-N 3.29Å; C410-K412 PolarHBondContact O-N 2.83Å; C410-V413 PolarHBondContact O-N 3.41Å; C410-I414 WeakPolarHBondContact O-CG1 3.33Å; C410-I414 PolarHBondContact O-N 3.31Å; C410-I414 VanDerWaalsContact O-N 3.08Å
411	E	84.8	Confident	80.9	Confident	31 Å²	31	64.1 Å²	64.1	15%	0.145	30%	0.301	C	S	.	.	H	α-helix	trans	-58.7	-40.5	175.9	-75.1	-179.4	-173.2	0	0	111.4	P142 L143 F228 R407 Q408 I414 F415	P142-E411 HydrophobicContact CG-CB 4.17Å; P142-E411 HydrophobicContact CG-CG 4.02Å; L143-E411 HydrophobicContact CD1-CG 3.67Å; L143-E411 WeakPolarHBondContact CD1-OE1 3.45Å; L143-E411 HydrophobicContact CD2-CG 4.37Å; L143-E411 HydrophobicContact CG-CG 3.7Å; F228-E411 HydrophobicContact CZ-CB 4.22Å; R407-E411 IonicContact CZ-OE1 3Å; R407-E411 IonicContact NE-OE1 3.74Å; R407-E411 PolarHBondContact NE-OE1 3.05Å; R407-E411 IonicContact NH2-OE1 3.51Å; R407-E411 WeakPolarHBondContact O-CB 3.44Å; R407-E411 WeakPolarHBondContact O-CG 3.32Å; R407-E411 PolarHBondContact O-N 3.43Å; Q408-E411 PolarHBondContact O-N 2.88Å; E411-I414 PolarHBondContact O-N 3.29Å; E411-F415 WeakPolarHBondContact O-CB 3.46Å; E411-F415 PolarHBondContact O-N 3.4Å
412	K	85.2	Confident	81.8	Confident	11 Å²	11	56.5 Å²	56.5	5%	0.048	27%	0.273	C	S	.	.	H	α-helix	trans	-61.7	-46.6	175.5	-180	-177.5	174.2	178.9	0	112.2	F228 F231 N232 Q408 F409 C410 I414 F415 N416	F228-K412 HydrophobicContact CB-CD 3.83Å; F228-K412 HydrophobicContact CB-CG 3.94Å; F228-K412 HydrophobicContact CD1-CB 3.69Å; F228-K412 HydrophobicContact CD1-CD 4.18Å; F228-K412 HydrophobicContact CD1-CG 4.03Å; F228-K412 HydrophobicContact CD2-CB 4.09Å; F228-K412 HydrophobicContact CD2-CG 4.04Å; F228-K412 HydrophobicContact CE1-CB 3.77Å; F228-K412 HydrophobicContact CE2-CB 4.16Å; F228-K412 HydrophobicContact CG-CB 3.86Å; F228-K412 HydrophobicContact CG-CD 4.05Å; F228-K412 HydrophobicContact CG-CG 3.75Å; F228-K412 HydrophobicContact CZ-CB 4.01Å; F228-K412 PolarHBondContact O-NZ 3.12Å; F228-K412 VanDerWaalsContact O-NZ 3.13Å; F231-K412 VanDerWaalsContact C-NZ 3.35Å; F231-K412 HydrophobicContact CB-CD 4Å; F231-K412 HydrophobicContact CG-CD 4.46Å; N232-K412 VanDerWaalsContact OD1-CE 3.31Å; N232-K412 WeakPolarHBondContact OD1-CE 3.36Å; N232-K412 PolarHBondContact OD1-NZ 3.16Å; Q408-K412 WeakPolarHBondContact O-CB 3.47Å; Q408-K412 PolarHBondContact O-N 3.4Å; F409-K412 WeakPolarHBondContact O-CB 3.14Å; F409-K412 PolarHBondContact O-N 3.14Å; C410-K412 VanDerWaalsContact C-N 3.29Å; C410-K412 PolarHBondContact O-N 2.83Å; K412-I414 PolarHBondContact O-N 3.45Å; K412-F415 PolarHBondContact O-N 3.28Å; K412-N416 WeakPolarHBondContact O-CB 3.23Å; K412-N416 VanDerWaalsContact O-CG 3.22Å; K412-N416 PolarHBondContact O-N 2.65Å
413	V	82.3	Confident	82.6	Confident	78 Å²	78	62 Å²	62	47%	0.473	29%	0.29	S	S	.	.	H	α-helix	trans	-60.7	-46.7	179.7	172.1	0	0	0	0	110.6	F409 C410 K417	F409-V413 HydrophobicContact CD1-CG2 4.35Å; F409-V413 HydrophobicContact CE1-CG2 4Å; F409-V413 HydrophobicContact CZ-CG2 4.27Å; F409-V413 WeakPolarHBondContact O-CG2 3.04Å; F409-V413 PolarHBondContact O-N 3.09Å; C410-V413 PolarHBondContact O-N 3.41Å; V413-K417 PolarHBondContact O-N 3.43Å
414	I	82.2	Confident	83.2	Confident	23 Å²	23	61.4 Å²	61.4	12%	0.118	29%	0.289	C	S	.	.	H	α-helix	trans	-65.2	-47	177.3	-63.9	158.7	0	0	0	110.4	P142 L143 I146 C410 E411 K412 N416 K417 E418	P142-I414 HydrophobicContact CB-CB 4.08Å; P142-I414 HydrophobicContact CB-CG2 3.58Å; L143-I414 HydrophobicContact CD2-CD1 3.7Å; I146-I414 HydrophobicContact CD1-CD1 3.47Å; I146-I414 VanDerWaalsContact CD1-CD1 3.47Å; I146-I414 HydrophobicContact CD1-CG1 4.04Å; I146-I414 HydrophobicContact CD1-CG2 4.24Å; C410-I414 WeakPolarHBondContact O-CG1 3.33Å; C410-I414 PolarHBondContact O-N 3.31Å; C410-I414 VanDerWaalsContact O-N 3.08Å; E411-I414 PolarHBondContact O-N 3.29Å; K412-I414 PolarHBondContact O-N 3.45Å; I414-N416 VanDerWaalsContact C-N 3.34Å; I414-N416 PolarHBondContact O-N 3.21Å; I414-K417 WeakPolarHBondContact O-CA 2.98Å; I414-K417 WeakPolarHBondContact O-CB 3.48Å; I414-K417 PolarHBondContact O-N 3.35Å; I414-E418 HydrophobicContact CG2-CG 4.26Å; I414-E418 WeakPolarHBondContact O-CG 3.45Å; I414-E418 PolarHBondContact O-N 3.19Å
415	F	83.1	Confident	83.7	Confident	5 Å²	5	55.7 Å²	55.7	2%	0.022	27%	0.265	C	S	.	.	H	α-helix	trans	-57.2	-44.7	179.4	171.3	-91.6	0	0	0	112.3	I139 I221 R224 F228 E411 K412 K417 E418 Q419	I139-F415 HydrophobicContact CG2-CD2 4.2Å; I139-F415 HydrophobicContact CG2-CE2 3.86Å; I221-F415 HydrophobicContact CB-CZ 4.06Å; I221-F415 HydrophobicContact CG1-CE2 3.98Å; I221-F415 HydrophobicContact CG1-CZ 3.81Å; I221-F415 HydrophobicContact CG2-CZ 4.09Å; R224-F415 HydrophobicContact CB-CE2 4.17Å; R224-F415 HydrophobicContact CB-CZ 4.16Å; F228-F415 HydrophobicContact CD2-CD1 4.04Å; F228-F415 HydrophobicContact CD2-CE1 4.42Å; F228-F415 HydrophobicContact CE2-CB 4.15Å; F228-F415 AromaticContact CE2-CD1 3.99Å; F228-F415 HydrophobicContact CE2-CD1 3.99Å; F228-F415 HydrophobicContact CE2-CG 4.01Å; E411-F415 WeakPolarHBondContact O-CB 3.46Å; E411-F415 PolarHBondContact O-N 3.4Å; K412-F415 PolarHBondContact O-N 3.28Å; F415-K417 VanDerWaalsContact C-N 3.26Å; F415-K417 PolarHBondContact O-N 3.02Å; F415-E418 PolarHBondContact O-N 3.07Å; F415-Q419 WeakPolarHBondContact O-CB 3.38Å; F415-Q419 PolarHBondContact O-N 3.4Å
416	N	82.6	Confident	84.3	Confident	66 Å²	66	56.5 Å²	56.5	35%	0.353	27%	0.27	S	S	.	.	H	α-helix	trans	-62.6	-33.4	177.2	-74.3	-13.5	0	0	0	112.4	K412 I414	K412-N416 WeakPolarHBondContact O-CB 3.23Å; K412-N416 VanDerWaalsContact O-CG 3.22Å; K412-N416 PolarHBondContact O-N 2.65Å; I414-N416 VanDerWaalsContact C-N 3.34Å; I414-N416 PolarHBondContact O-N 3.21Å
417	K	82.6	Confident	85	Confident	124 Å²	124	57.8 Å²	57.8	54%	0.539	28%	0.278	S	S	.	.	H	α-helix	trans	-69.7	-47.4	174.3	-178.2	-177.5	175.2	-177	0	111.2	V413 I414 F415 Q419 K420	V413-K417 PolarHBondContact O-N 3.43Å; I414-K417 WeakPolarHBondContact O-CA 2.98Å; I414-K417 WeakPolarHBondContact O-CB 3.48Å; I414-K417 PolarHBondContact O-N 3.35Å; F415-K417 VanDerWaalsContact C-N 3.26Å; F415-K417 PolarHBondContact O-N 3.02Å; K417-Q419 VanDerWaalsContact C-N 3.3Å; K417-Q419 PolarHBondContact O-N 3.27Å; K417-K420 PolarHBondContact O-N 3.43Å
418	E	85.7	Confident	85.6	Confident	29 Å²	29	52.1 Å²	52.1	14%	0.136	26%	0.256	C	S	.	.	H	α-helix	trans	-66.9	-30.6	179.9	-63.6	-50.2	129.6	0	0	112.6	R135 A138 I139 I414 F415 K420 A421 V422	R135-E418 IonicContact CZ-OE2 2.71Å; R135-E418 IonicContact NH1-OE2 3.23Å; R135-E418 PolarHBondContact NH1-OE2 3.16Å; R135-E418 IonicContact NH2-OE2 2.72Å; A138-E418 HydrophobicContact CB-CG 4.35Å; I139-E418 HydrophobicContact CG1-CB 4.02Å; I414-E418 HydrophobicContact CG2-CG 4.26Å; I414-E418 WeakPolarHBondContact O-CG 3.45Å; I414-E418 PolarHBondContact O-N 3.19Å; F415-E418 PolarHBondContact O-N 3.07Å; E418-K420 VanDerWaalsContact C-N 3.26Å; E418-K420 PolarHBondContact O-N 3.08Å; E418-A421 WeakPolarHBondContact O-CB 3.18Å; E418-A421 PolarHBondContact O-N 3.27Å; E418-A421 VanDerWaalsContact O-N 3.1Å; E418-V422 PolarHBondContact O-N 3.31Å; E418-V422 VanDerWaalsContact O-N 3.11Å
419	Q	85.5	Confident	85.9	Confident	49 Å²	49	49 Å²	49	23%	0.229	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-34.6	175.2	-169.5	-177.3	12.7	0	0	112.5	I221 F415 K417 A421 V422 R423	I221-Q419 HydrophobicContact CD1-CG 4.33Å; F415-Q419 WeakPolarHBondContact O-CB 3.38Å; F415-Q419 PolarHBondContact O-N 3.4Å; K417-Q419 VanDerWaalsContact C-N 3.3Å; K417-Q419 PolarHBondContact O-N 3.27Å; Q419-A421 VanDerWaalsContact C-N 3.33Å; Q419-V422 PolarHBondContact O-N 3.49Å; Q419-R423 PolarHBondContact O-N 3.35Å
420	K	83.7	Confident	86.4	Confident	150 Å²	150	48.5 Å²	48.5	65%	0.652	25%	0.248	S	C	*	.	H	α-helix	trans	-63.8	-40.8	175.8	-65.8	-179.8	-178.2	178.9	0	111.1	K417 E418 R423	K417-K420 PolarHBondContact O-N 3.43Å; E418-K420 VanDerWaalsContact C-N 3.26Å; E418-K420 PolarHBondContact O-N 3.08Å; K420-R423 PolarHBondContact O-N 3.14Å
421	A	83.2	Confident	86.9	Confident	30 Å²	30	49.4 Å²	49.4	25%	0.248	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-39.3	177	0	0	0	0	0	112.1	E418 Q419 R423 T424 V425	E418-A421 WeakPolarHBondContact O-CB 3.18Å; E418-A421 PolarHBondContact O-N 3.27Å; E418-A421 VanDerWaalsContact O-N 3.1Å; Q419-A421 VanDerWaalsContact C-N 3.33Å; A421-R423 VanDerWaalsContact C-N 3.29Å; A421-R423 PolarHBondContact O-N 2.93Å; A421-T424 WeakPolarHBondContact O-CB 3.36Å; A421-T424 PolarHBondContact O-N 2.04Å; A421-V425 WeakPolarHBondContact O-CG2 3.49Å; A421-V425 PolarHBondContact O-N 2.84Å; A421-V425 VanDerWaalsContact O-N 3.1Å
422	V	89.2	Confident	87.2	Confident	9 Å²	9	48 Å²	48	6%	0.055	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-35.4	176.9	162.3	0	0	0	0	113.2	R135 I139 I217 I221 E418 Q419 T424 V425 T426	R135-V422 HydrophobicContact CB-CG2 3.87Å; R135-V422 HydrophobicContact CG-CG2 4.2Å; I139-V422 HydrophobicContact CD1-CB 4.11Å; I139-V422 HydrophobicContact CD1-CG2 3.33Å; I139-V422 HydrophobicContact CG1-CG2 4.25Å; I217-V422 HydrophobicContact CG2-CG1 3.8Å; I217-V422 HydrophobicContact CG2-CG2 4.25Å; I221-V422 HydrophobicContact CD1-CG1 4.4Å; E418-V422 PolarHBondContact O-N 3.31Å; E418-V422 VanDerWaalsContact O-N 3.11Å; Q419-V422 PolarHBondContact O-N 3.49Å; V422-T424 VanDerWaalsContact C-N 3.34Å; V422-T424 PolarHBondContact O-N 2.95Å; V422-V425 PolarHBondContact O-N 3.27Å; V422-T426 WeakPolarHBondContact O-CB 3.5Å; V422-T426 PolarHBondContact O-N 3.37Å; V422-T426 PolarHBondContact O-OG1 2.58Å
423	R	88.6	Confident	87.6	Confident	155 Å²	155	50.4 Å²	50.4	59%	0.585	26%	0.26	S	S	*	.	H	α-helix	trans	-59.6	-46.4	175.4	-68.4	177.2	-176.6	179.8	0.5	111.3	Q419 K420 A421 V425 T426 I427	Q419-R423 PolarHBondContact O-N 3.35Å; K420-R423 PolarHBondContact O-N 3.14Å; A421-R423 VanDerWaalsContact C-N 3.29Å; A421-R423 PolarHBondContact O-N 2.93Å; R423-V425 PolarHBondContact O-N 3.38Å; R423-T426 PolarHBondContact O-N 3.33Å; R423-I427 WeakPolarHBondContact O-CG1 3.33Å; R423-I427 PolarHBondContact O-N 3.45Å; R423-I427 VanDerWaalsContact O-N 3.15Å
424	T	87	Confident	88.2	Confident	41 Å²	41	51.3 Å²	51.3	25%	0.252	27%	0.266	S	S	.	.	H	α-helix	trans	-59.3	-47.4	176	-55.4	0	0	0	0	111.1	A421 V422 T426 I427 V428 I475 Y476	A421-T424 WeakPolarHBondContact O-CB 3.36Å; A421-T424 PolarHBondContact O-N 2.04Å; V422-T424 VanDerWaalsContact C-N 3.34Å; V422-T424 PolarHBondContact O-N 2.95Å; T424-T426 VanDerWaalsContact C-N 3.32Å; T424-T426 PolarHBondContact O-N 2.92Å; T424-I427 PolarHBondContact O-N 3.36Å; T424-I427 VanDerWaalsContact O-N 3.17Å; T424-V428 WeakPolarHBondContact O-CG2 3.33Å; T424-V428 PolarHBondContact O-N 3.47Å; T424-V428 VanDerWaalsContact O-N 3.11Å; T424-I475 HydrophobicContact CG2-CG2 3.44Å; T424-I475 VanDerWaalsContact CG2-CG2 3.44Å; T424-Y476 HydrophobicContact CG2-CD1 4.33Å; T424-Y476 HydrophobicContact CG2-CE1 4.39Å
425	V	89.3	Confident	88.8	Confident	10 Å²	10	50.4 Å²	50.4	6%	0.061	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-39.9	179.2	173.9	0	0	0	0	112	I131 R135 A421 V422 R423 I427 V428 I429	I131-V425 HydrophobicContact CG2-CB 4.36Å; I131-V425 HydrophobicContact CG2-CG1 3.91Å; I131-V425 HydrophobicContact CG2-CG2 3.45Å; I131-V425 VanDerWaalsContact CG2-CG2 3.45Å; R135-V425 HydrophobicContact CG-CG2 3.92Å; A421-V425 WeakPolarHBondContact O-CG2 3.49Å; A421-V425 PolarHBondContact O-N 2.84Å; A421-V425 VanDerWaalsContact O-N 3.1Å; V422-V425 PolarHBondContact O-N 3.27Å; R423-V425 PolarHBondContact O-N 3.38Å; V425-I427 VanDerWaalsContact C-N 3.31Å; V425-I427 PolarHBondContact O-N 3.42Å; V425-V428 PolarHBondContact O-N 2.99Å; V425-I429 HydrophobicContact CG1-CD1 3.63Å; V425-I429 HydrophobicContact CG1-CG1 4.45Å; V425-I429 WeakPolarHBondContact O-CD1 3.21Å; V425-I429 VanDerWaalsContact O-CG1 3.29Å; V425-I429 WeakPolarHBondContact O-CG1 3.18Å; V425-I429 PolarHBondContact O-N 3.22Å
426	T	91.8	Very high	89.4	Confident	69 Å²	69	50.9 Å²	50.9	42%	0.423	26%	0.264	S	S	.	.	H	α-helix	trans	-62.5	-37.9	176.8	-56.3	0	0	0	0	111.9	V422 R423 T424 G430	V422-T426 WeakPolarHBondContact O-CB 3.5Å; V422-T426 PolarHBondContact O-N 3.37Å; V422-T426 PolarHBondContact O-OG1 2.58Å; R423-T426 PolarHBondContact O-N 3.33Å; T424-T426 VanDerWaalsContact C-N 3.32Å; T424-T426 PolarHBondContact O-N 2.92Å; T426-G430 PolarHBondContact O-N 3.19Å
427	I	91.3	Very high	90.1	Very high	90 Å²	90	49.5 Å²	49.5	46%	0.462	26%	0.257	S	S	.	.	H	α-helix	trans	-65.6	-47.3	175.9	-65.3	165.6	0	0	0	110.5	R423 T424 V425 I429 G430 C431 I475	R423-I427 WeakPolarHBondContact O-CG1 3.33Å; R423-I427 PolarHBondContact O-N 3.45Å; R423-I427 VanDerWaalsContact O-N 3.15Å; T424-I427 PolarHBondContact O-N 3.36Å; T424-I427 VanDerWaalsContact O-N 3.17Å; V425-I427 VanDerWaalsContact C-N 3.31Å; V425-I427 PolarHBondContact O-N 3.42Å; I427-I429 VanDerWaalsContact C-N 3.28Å; I427-I429 PolarHBondContact O-N 2.98Å; I427-G430 PolarHBondContact O-N 3.25Å; I427-G430 VanDerWaalsContact O-N 3.11Å; I427-C431 PolarHBondContact O-N 3.38Å; I427-C431 PolarHBondContact O-SG 3.1Å; I427-I475 HydrophobicContact CG2-CD1 3.99Å; I427-I475 HydrophobicContact CG2-CG1 4.24Å
428	V	90.4	Very high	90.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.8	-43.1	177.9	179.1	0	0	0	0	111.2	L128 T424 V425 C431 F432 N472 I475 Y476	L128-V428 HydrophobicContact CD1-CG1 4.28Å; L128-V428 HydrophobicContact CD2-CG1 3.41Å; L128-V428 VanDerWaalsContact CD2-CG1 3.41Å; T424-V428 WeakPolarHBondContact O-CG2 3.33Å; T424-V428 PolarHBondContact O-N 3.47Å; T424-V428 VanDerWaalsContact O-N 3.11Å; V425-V428 PolarHBondContact O-N 2.99Å; V428-C431 WeakPolarHBondContact O-CB 3.17Å; V428-C431 PolarHBondContact O-N 2.91Å; V428-F432 PolarHBondContact O-N 3.06Å; V428-N472 WeakPolarHBondContact CG1-OD1 3.24Å; V428-I475 HydrophobicContact CB-CD1 4.42Å; V428-I475 HydrophobicContact CG2-CB 4.11Å; V428-I475 HydrophobicContact CG2-CD1 3.77Å; V428-I475 HydrophobicContact CG2-CG2 3.49Å; V428-I475 VanDerWaalsContact CG2-CG2 3.49Å; V428-Y476 HydrophobicContact CG2-CE1 4.23Å; V428-Y476 HydrophobicContact CG2-CE2 4.45Å
429	I	91.4	Very high	91.2	Very high	12 Å²	12	45.3 Å²	45.3	6%	0.062	24%	0.242	C	C	.	.	H	α-helix	trans	-65.4	-40.1	177.3	-69.5	159.5	0	0	0	111.7	I210 H214 V425 I427 C431 F432 I433	I210-I429 HydrophobicContact CG2-CB 4.36Å; I210-I429 HydrophobicContact CG2-CD1 3.54Å; I210-I429 HydrophobicContact CG2-CG1 3.86Å; I210-I429 HydrophobicContact CG2-CG2 3.57Å; H214-I429 WeakPolarHBondContact CE1-CD1 3.48Å; H214-I429 WeakPolarHBondContact NE2-CD1 3.45Å; V425-I429 HydrophobicContact CG1-CD1 3.63Å; V425-I429 HydrophobicContact CG1-CG1 4.45Å; V425-I429 WeakPolarHBondContact O-CD1 3.21Å; V425-I429 VanDerWaalsContact O-CG1 3.29Å; V425-I429 WeakPolarHBondContact O-CG1 3.18Å; V425-I429 PolarHBondContact O-N 3.22Å; I427-I429 VanDerWaalsContact C-N 3.28Å; I427-I429 PolarHBondContact O-N 2.98Å; I429-C431 VanDerWaalsContact C-N 3.34Å; I429-C431 PolarHBondContact O-N 3.15Å; I429-F432 WeakPolarHBondContact O-CB 3.01Å; I429-F432 PolarHBondContact O-N 3.03Å; I429-I433 HydrophobicContact CG2-CD1 3.94Å; I429-I433 HydrophobicContact CG2-CG1 4.49Å; I429-I433 WeakPolarHBondContact O-CG1 3.35Å; I429-I433 PolarHBondContact O-N 3.15Å
430	G	92.8	Very high	91.6	Very high	30 Å²	30	43.5 Å²	43.5	31%	0.309	23%	0.234	S	C	.	.	H	α-helix	trans	-58.5	-46	173.9	0	0	0	0	0	111.9	T426 I427 F432 I433 V434	T426-G430 PolarHBondContact O-N 3.19Å; I427-G430 PolarHBondContact O-N 3.25Å; I427-G430 VanDerWaalsContact O-N 3.11Å; G430-F432 VanDerWaalsContact C-N 3.34Å; G430-F432 PolarHBondContact O-N 3.48Å; G430-I433 PolarHBondContact O-N 2.91Å; G430-V434 WeakPolarHBondContact O-CG2 3.31Å; G430-V434 PolarHBondContact O-N 3.07Å
431	C	92.6	Very high	92.1	Very high	26 Å²	26	41 Å²	41	18%	0.176	23%	0.226	C	C	.	.	H	α-helix	trans	-59.1	-44.6	173.6	-67.5	0	0	0	0	111.5	I427 V428 I429 I433 V434 C435 F471	I427-C431 PolarHBondContact O-N 3.38Å; I427-C431 PolarHBondContact O-SG 3.1Å; V428-C431 WeakPolarHBondContact O-CB 3.17Å; V428-C431 PolarHBondContact O-N 2.91Å; I429-C431 VanDerWaalsContact C-N 3.34Å; I429-C431 PolarHBondContact O-N 3.15Å; C431-I433 PolarHBondContact O-N 2.89Å; C431-V434 PolarHBondContact O-N 3.18Å; C431-C435 VanDerWaalsContact O-CB 3.26Å; C431-C435 WeakPolarHBondContact O-CB 3.26Å; C431-C435 PolarHBondContact O-N 3.1Å; C431-C435 PolarHBondContact O-SG 3.23Å; C431-F471 HydrophobicContact CB-CD2 4.2Å
432	F	91.2	Very high	92.6	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.5	-50.8	176.1	161.5	-106.6	0	0	0	112.7	I125 L128 Y203 I207 V428 I429 G430 V434 C435 W436 N468	I125-F432 HydrophobicContact CB-CE2 4.29Å; I125-F432 HydrophobicContact CD1-CD2 4.29Å; I125-F432 HydrophobicContact CD1-CE2 3.41Å; I125-F432 VanDerWaalsContact CD1-CE2 3.41Å; I125-F432 HydrophobicContact CD1-CZ 4.05Å; I125-F432 HydrophobicContact CG1-CD2 3.86Å; I125-F432 HydrophobicContact CG1-CE2 3.38Å; I125-F432 HydrophobicContact CG1-CZ 4.08Å; I125-F432 HydrophobicContact CG2-CE1 4.43Å; I125-F432 HydrophobicContact CG2-CE2 3.96Å; I125-F432 HydrophobicContact CG2-CZ 3.77Å; L128-F432 HydrophobicContact CD1-CB 4Å; L128-F432 HydrophobicContact CD1-CG 4.23Å; Y203-F432 HydrophobicContact CD2-CE1 4.41Å; Y203-F432 HydrophobicContact CD2-CE2 4.21Å; Y203-F432 AromaticContact CD2-CZ 3.6Å; Y203-F432 HydrophobicContact CD2-CZ 3.6Å; Y203-F432 HydrophobicContact CE2-CE1 4.08Å; Y203-F432 HydrophobicContact CE2-CE2 4.3Å; Y203-F432 AromaticContact CE2-CZ 3.64Å; Y203-F432 HydrophobicContact CE2-CZ 3.64Å; I207-F432 HydrophobicContact CD1-CD1 4.07Å; I207-F432 HydrophobicContact CD1-CE1 3.67Å; V428-F432 PolarHBondContact O-N 3.06Å; I429-F432 WeakPolarHBondContact O-CB 3.01Å; I429-F432 PolarHBondContact O-N 3.03Å; G430-F432 VanDerWaalsContact C-N 3.34Å; G430-F432 PolarHBondContact O-N 3.48Å; F432-V434 PolarHBondContact O-N 3.36Å; F432-C435 PolarHBondContact O-N 2.89Å; F432-W436 HydrophobicContact CD2-CB 4.29Å; F432-W436 AromaticContact CD2-CD1 3.35Å; F432-W436 HydrophobicContact CD2-CG 4.04Å; F432-W436 HydrophobicContact CE2-CB 3.9Å; F432-W436 AromaticContact CE2-CD1 3.59Å; F432-W436 AromaticContact CE2-CG 3.83Å; F432-W436 HydrophobicContact CE2-CG 3.83Å; F432-W436 WeakPolarHBondContact O-CB 3.41Å; F432-W436 PolarHBondContact O-N 3.48Å; F432-N468 VanDerWaalsContact CA-ND2 3.33Å; F432-N468 WeakPolarHBondContact CA-ND2 3.3Å; F432-N468 WeakPolarHBondContact CB-ND2 3.36Å; F432-N468 WeakPolarHBondContact CD2-ND2 3.23Å
433	I	94.5	Very high	92.8	Very high	62 Å²	62	41.7 Å²	41.7	32%	0.318	22%	0.223	S	C	.	.	H	α-helix	trans	-56.9	-52.8	179.1	-68.8	162.9	0	0	0	109.8	I207 I429 G430 C431 C435 W436 T437	I207-I433 HydrophobicContact CD1-CD1 3.74Å; I207-I433 HydrophobicContact CD1-CG1 3.29Å; I207-I433 HydrophobicContact CG1-CG1 4.39Å; I429-I433 HydrophobicContact CG2-CD1 3.94Å; I429-I433 HydrophobicContact CG2-CG1 4.49Å; I429-I433 WeakPolarHBondContact O-CG1 3.35Å; I429-I433 PolarHBondContact O-N 3.15Å; G430-I433 PolarHBondContact O-N 2.91Å; C431-I433 PolarHBondContact O-N 2.89Å; I433-C435 VanDerWaalsContact C-N 3.3Å; I433-C435 PolarHBondContact O-N 3.29Å; I433-W436 PolarHBondContact O-N 2.94Å; I433-T437 WeakPolarHBondContact O-CB 3.23Å; I433-T437 PolarHBondContact O-N 3.35Å; I433-T437 PolarHBondContact O-OG1 3.04Å
434	V	94.7	Very high	93	Very high	98 Å²	98	35.8 Å²	35.8	59%	0.594	20%	0.203	S	C	*	.	H	α-helix	trans	-62.5	-39.7	-176.3	172.2	0	0	0	0	111.6	G430 C431 F432 P438	G430-V434 WeakPolarHBondContact O-CG2 3.31Å; G430-V434 PolarHBondContact O-N 3.07Å; C431-V434 PolarHBondContact O-N 3.18Å; F432-V434 PolarHBondContact O-N 3.36Å; V434-P438 WeakPolarHBondContact O-CD 3.43Å
435	C	94.7	Very high	93.3	Very high	4 Å²	4	35.3 Å²	35.3	3%	0.027	20%	0.201	C	C	.	.	H	α-helix	trans	-72.8	-41.9	-177	-67	0	0	0	0	112.7	C431 F432 I433 L464 G465 N468	C431-C435 VanDerWaalsContact O-CB 3.26Å; C431-C435 WeakPolarHBondContact O-CB 3.26Å; C431-C435 PolarHBondContact O-N 3.1Å; C431-C435 PolarHBondContact O-SG 3.23Å; F432-C435 PolarHBondContact O-N 2.89Å; I433-C435 VanDerWaalsContact C-N 3.3Å; I433-C435 PolarHBondContact O-N 3.29Å; C435-L464 VanDerWaalsContact CB-O 3.23Å; C435-L464 WeakPolarHBondContact CB-O 3.36Å; C435-L464 CarbonylContact O-C 3.49Å; C435-G465 PolarHBondContact O-N 3.1Å; C435-N468 HydrophobicContact CB-CB 4.07Å
436	W	95.5	Very high	93.3	Very high	15 Å²	15	35.6 Å²	35.6	6%	0.057	20%	0.202	C	C	.	.	H	α-helix	trans	-98.6	-25.2	-170.4	-74.4	98.2	0	0	0	114.9	C121 Y203 F432 I433 P438 F439 F440 G465 N468	C121-W436 HydrophobicContact CB-CH2 3.76Å; C121-W436 HydrophobicContact CB-CZ2 3.81Å; Y203-W436 HydrophobicContact CD2-CB 4.21Å; Y203-W436 HydrophobicContact CE2-CB 4.04Å; F432-W436 HydrophobicContact CD2-CB 4.29Å; F432-W436 AromaticContact CD2-CD1 3.35Å; F432-W436 HydrophobicContact CD2-CG 4.04Å; F432-W436 HydrophobicContact CE2-CB 3.9Å; F432-W436 AromaticContact CE2-CD1 3.59Å; F432-W436 AromaticContact CE2-CG 3.83Å; F432-W436 HydrophobicContact CE2-CG 3.83Å; F432-W436 WeakPolarHBondContact O-CB 3.41Å; F432-W436 PolarHBondContact O-N 3.48Å; I433-W436 PolarHBondContact O-N 2.94Å; W436-P438 VanDerWaalsContact C-N 3.34Å; W436-F439 HydrophobicContact CE3-CB 4.49Å; W436-F439 HydrophobicContact CE3-CD1 4.37Å; W436-F439 HydrophobicContact CZ3-CD1 4.42Å; W436-F439 PolarHBondContact O-N 3.25Å; W436-F440 HydrophobicContact CB-CD2 4.1Å; W436-F440 HydrophobicContact CB-CE2 4.09Å; W436-F440 HydrophobicContact CD2-CE2 4.23Å; W436-F440 HydrophobicContact CE3-CD2 4.36Å; W436-F440 AromaticContact CE3-CE2 3.66Å; W436-F440 HydrophobicContact CE3-CE2 3.66Å; W436-F440 HydrophobicContact CE3-CZ 4.41Å; W436-F440 HydrophobicContact CG-CE2 4.45Å; W436-F440 HydrophobicContact CZ3-CE2 4.47Å; W436-F440 VanDerWaalsContact O-CD2 3.31Å; W436-F440 WeakPolarHBondContact O-CD2 3.37Å; W436-F440 PolarHBondContact O-N 2.94Å; W436-G465 PolarHBondContact NE1-O 3.31Å; W436-N468 PolarHBondContact NE1-ND2 3.41Å
437	T	96.1	Very high	93.2	Very high	36 Å²	36	32.4 Å²	32.4	22%	0.221	18%	0.183	C	C	.	.	H	α-helix	trans	-52.1	-47.4	-179.3	-59.4	0	0	0	0	112.4	Y203 I433 F439 F440 I441	Y203-T437 PolarHBondContact OH-OG1 3.45Å; I433-T437 WeakPolarHBondContact O-CB 3.23Å; I433-T437 PolarHBondContact O-N 3.35Å; I433-T437 PolarHBondContact O-OG1 3.04Å; T437-F439 PolarHBondContact O-N 3.12Å; T437-F440 PolarHBondContact O-N 3.45Å; T437-I441 HydrophobicContact CG2-CD1 3.52Å; T437-I441 HydrophobicContact CG2-CG1 4.07Å; T437-I441 WeakPolarHBondContact O-CG1 3.35Å; T437-I441 PolarHBondContact O-N 3.48Å
438	P	96.3	Very high	93.3	Very high	36 Å²	36	33.2 Å²	33.2	23%	0.234	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-44.9	-176.8	-27.2	40.5	0	0	0	112.5	V434 W436 F440 I441 F442 V461 L464	V434-P438 WeakPolarHBondContact O-CD 3.43Å; W436-P438 VanDerWaalsContact C-N 3.34Å; P438-F440 PolarHBondContact O-N 2.93Å; P438-I441 PolarHBondContact O-N 3.47Å; P438-F442 WeakPolarHBondContact O-CD2 3.46Å; P438-F442 PolarHBondContact O-N 2.88Å; P438-F442 VanDerWaalsContact O-N 3.13Å; P438-V461 HydrophobicContact CB-CB 4.35Å; P438-V461 HydrophobicContact CB-CG1 3.98Å; P438-L464 HydrophobicContact CB-CD2 4.21Å; P438-L464 HydrophobicContact CG-CD2 3.69Å
439	F	95.1	Very high	93.2	Very high	29 Å²	29	36.3 Å²	36.3	13%	0.127	21%	0.208	C	C	.	.	H	α-helix	trans	-56.3	-51.7	177	175.6	-90.2	0	0	0	111.5	W436 T437 I441 F442 Y443 V461	W436-F439 HydrophobicContact CE3-CB 4.49Å; W436-F439 HydrophobicContact CE3-CD1 4.37Å; W436-F439 HydrophobicContact CZ3-CD1 4.42Å; W436-F439 PolarHBondContact O-N 3.25Å; T437-F439 PolarHBondContact O-N 3.12Å; F439-I441 VanDerWaalsContact C-N 3.32Å; F439-I441 PolarHBondContact O-N 2.89Å; F439-F442 PolarHBondContact O-N 3.41Å; F439-Y443 HydrophobicContact CE1-CD1 4.23Å; F439-Y443 HydrophobicContact CE1-CG 4.14Å; F439-Y443 HydrophobicContact CZ-CD2 4.47Å; F439-Y443 HydrophobicContact CZ-CG 4.26Å; F439-Y443 WeakPolarHBondContact O-CB 3.5Å; F439-Y443 PolarHBondContact O-N 2.86Å; F439-V461 HydrophobicContact CB-CB 4.35Å; F439-V461 HydrophobicContact CB-CG2 4.31Å; F439-V461 HydrophobicContact CD2-CG2 4.14Å
440	F	95.1	Very high	92.7	Very high	11 Å²	11	41.6 Å²	41.6	5%	0.048	24%	0.236	C	C	.	.	H	α-helix	trans	-69.1	-28.3	-176.9	-75.3	-73.5	0	0	0	113.4	A202 Y203 W436 T437 P438 L444	A202-F440 HydrophobicContact CB-CE1 4.07Å; A202-F440 HydrophobicContact CB-CZ 3.94Å; Y203-F440 VanDerWaalsContact CB-CD2 3.43Å; Y203-F440 VanDerWaalsContact CB-CG 3.49Å; Y203-F440 HydrophobicContact CD1-CB 3.72Å; Y203-F440 AromaticContact CD1-CD2 3.95Å; Y203-F440 HydrophobicContact CD1-CD2 3.95Å; Y203-F440 AromaticContact CD1-CG 3.83Å; Y203-F440 HydrophobicContact CD1-CG 3.83Å; Y203-F440 AromaticContact CD2-CD2 3.32Å; Y203-F440 HydrophobicContact CD2-CD2 3.32Å; Y203-F440 AromaticContact CD2-CE2 3.65Å; Y203-F440 HydrophobicContact CD2-CE2 3.65Å; Y203-F440 HydrophobicContact CD2-CG 4.06Å; Y203-F440 HydrophobicContact CE1-CB 4.24Å; Y203-F440 HydrophobicContact CE2-CD2 4.1Å; Y203-F440 HydrophobicContact CG-CB 3.94Å; Y203-F440 HydrophobicContact CG-CD1 4.16Å; Y203-F440 AromaticContact CG-CD2 3.26Å; Y203-F440 HydrophobicContact CG-CD2 3.26Å; Y203-F440 AromaticContact CG-CE2 3.76Å; Y203-F440 HydrophobicContact CG-CE2 3.76Å; Y203-F440 AromaticContact CG-CG 3.51Å; Y203-F440 HydrophobicContact CG-CG 3.51Å; Y203-F440 HydrophobicContact CG-CZ 4.38Å; W436-F440 HydrophobicContact CB-CD2 4.1Å; W436-F440 HydrophobicContact CB-CE2 4.09Å; W436-F440 HydrophobicContact CD2-CE2 4.23Å; W436-F440 HydrophobicContact CE3-CD2 4.36Å; W436-F440 AromaticContact CE3-CE2 3.66Å; W436-F440 HydrophobicContact CE3-CE2 3.66Å; W436-F440 HydrophobicContact CE3-CZ 4.41Å; W436-F440 HydrophobicContact CG-CE2 4.45Å; W436-F440 HydrophobicContact CZ3-CE2 4.47Å; W436-F440 VanDerWaalsContact O-CD2 3.31Å; W436-F440 WeakPolarHBondContact O-CD2 3.37Å; W436-F440 PolarHBondContact O-N 2.94Å; T437-F440 PolarHBondContact O-N 3.45Å; P438-F440 PolarHBondContact O-N 2.93Å; F440-L444 WeakPolarHBondContact O-CB 3.16Å; F440-L444 PolarHBondContact O-N 3.36Å; F440-L444 VanDerWaalsContact O-N 3.07Å
441	I	94.3	Very high	92.5	Very high	97 Å²	97	42.5 Å²	42.5	50%	0.497	24%	0.238	S	C	.	.	H	α-helix	trans	-63.7	-51.1	171.7	-72.4	174.3	0	0	0	110.4	T437 P438 F439 S445	T437-I441 HydrophobicContact CG2-CD1 3.52Å; T437-I441 HydrophobicContact CG2-CG1 4.07Å; T437-I441 WeakPolarHBondContact O-CG1 3.35Å; T437-I441 PolarHBondContact O-N 3.48Å; P438-I441 PolarHBondContact O-N 3.47Å; F439-I441 VanDerWaalsContact C-N 3.32Å; F439-I441 PolarHBondContact O-N 2.89Å; I441-S445 VanDerWaalsContact O-CB 3.26Å; I441-S445 WeakPolarHBondContact O-CB 3.26Å; I441-S445 PolarHBondContact O-N 3.18Å; I441-S445 PolarHBondContact O-OG 2.94Å
442	F	93.5	Very high	92.1	Very high	51 Å²	51	47.5 Å²	47.5	22%	0.224	27%	0.267	C	S	.	.	H	α-helix	trans	-68.9	-42.2	-179	-70.5	-66.7	0	0	0	112.3	P438 F439 L444 S445 E446 F453 L457 V461	P438-F442 WeakPolarHBondContact O-CD2 3.46Å; P438-F442 PolarHBondContact O-N 2.88Å; P438-F442 VanDerWaalsContact O-N 3.13Å; F439-F442 PolarHBondContact O-N 3.41Å; F442-L444 VanDerWaalsContact C-N 3.31Å; F442-L444 PolarHBondContact O-N 2.9Å; F442-S445 WeakPolarHBondContact CA-OG 3.43Å; F442-S445 PolarHBondContact O-N 3.02Å; F442-S445 PolarHBondContact O-OG 2.98Å; F442-E446 PolarHBondContact O-N 2.91Å; F442-E446 VanDerWaalsContact O-N 3.1Å; F442-F453 HydrophobicContact CB-CD2 4.45Å; F442-F453 AromaticContact CD1-CD1 3.9Å; F442-F453 HydrophobicContact CD1-CD1 3.9Å; F442-F453 AromaticContact CD1-CD2 3.99Å; F442-F453 HydrophobicContact CD1-CD2 3.99Å; F442-F453 AromaticContact CD1-CE1 3.74Å; F442-F453 HydrophobicContact CD1-CE1 3.74Å; F442-F453 AromaticContact CD1-CE2 3.86Å; F442-F453 HydrophobicContact CD1-CE2 3.86Å; F442-F453 HydrophobicContact CD1-CG 4.04Å; F442-F453 AromaticContact CD1-CZ 3.73Å; F442-F453 HydrophobicContact CD1-CZ 3.73Å; F442-F453 HydrophobicContact CE1-CD1 4.08Å; F442-F453 AromaticContact CE1-CE1 3.83Å; F442-F453 HydrophobicContact CE1-CE1 3.83Å; F442-F453 HydrophobicContact CE1-CZ 4.19Å; F442-L457 HydrophobicContact CD1-CD2 3.9Å; F442-L457 HydrophobicContact CE1-CD2 3.57Å; F442-L457 HydrophobicContact CE2-CD1 4.33Å; F442-L457 HydrophobicContact CE2-CD2 4.24Å; F442-L457 HydrophobicContact CE2-CG 4.38Å; F442-L457 HydrophobicContact CG-CD2 4.38Å; F442-L457 HydrophobicContact CZ-CD1 4.29Å; F442-L457 HydrophobicContact CZ-CD2 3.76Å; F442-L457 HydrophobicContact CZ-CG 4.35Å; F442-V461 HydrophobicContact CD2-CG1 3.8Å; F442-V461 HydrophobicContact CD2-CG2 4.41Å; F442-V461 HydrophobicContact CE2-CG1 3.89Å
443	Y	93.4	Very high	92	Very high	3 Å²	3	50.6 Å²	50.6	1%	0.012	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-39.7	179.3	-176	-121.7	0	0	0	112.2	I188 R195 S198 S199 F439	I188-Y443 HydrophobicContact CD1-CE1 4.48Å; I188-Y443 HydrophobicContact CD1-CE2 4Å; I188-Y443 WeakPolarHBondContact CD1-OH 3.34Å; I188-Y443 HydrophobicContact CG1-CE2 4.34Å; I188-Y443 WeakPolarHBondContact CG1-OH 3.45Å; I188-Y443 HydrophobicContact CG2-CD2 4.45Å; I188-Y443 HydrophobicContact CG2-CE2 3.66Å; R195-Y443 HydrophobicContact CB-CE1 4.12Å; R195-Y443 HydrophobicContact CB-CE2 4.35Å; R195-Y443 HydrophobicContact CG-CD2 4.46Å; R195-Y443 HydrophobicContact CG-CE1 4.26Å; R195-Y443 HydrophobicContact CG-CE2 3.66Å; R195-Y443 WeakPolarHBondContact CG-OH 3.4Å; S198-Y443 PolarHBondContact OG-OH 2.66Å; S199-Y443 WeakPolarHBondContact OG-CD1 3.34Å; S199-Y443 WeakPolarHBondContact OG-CE1 3.25Å; F439-Y443 HydrophobicContact CE1-CD1 4.23Å; F439-Y443 HydrophobicContact CE1-CG 4.14Å; F439-Y443 HydrophobicContact CZ-CD2 4.47Å; F439-Y443 HydrophobicContact CZ-CG 4.26Å; F439-Y443 WeakPolarHBondContact O-CB 3.5Å; F439-Y443 PolarHBondContact O-N 2.86Å
444	L	92.7	Very high	91.7	Very high	32 Å²	32	50.8 Å²	50.8	17%	0.168	29%	0.288	C	S	.	.	H	α-helix	trans	-78.2	-36.1	176.4	-173.8	63.3	0	0	0	112.5	I196 F204 F440 F442 E446 A447 I448	I196-L444 HydrophobicContact CB-CD1 4.47Å; I196-L444 HydrophobicContact CG1-CD1 3.89Å; F204-L444 HydrophobicContact CE2-CD2 3.72Å; F204-L444 HydrophobicContact CZ-CD2 3.73Å; F440-L444 WeakPolarHBondContact O-CB 3.16Å; F440-L444 PolarHBondContact O-N 3.36Å; F440-L444 VanDerWaalsContact O-N 3.07Å; F442-L444 VanDerWaalsContact C-N 3.31Å; F442-L444 PolarHBondContact O-N 2.9Å; L444-E446 PolarHBondContact O-N 3.43Å; L444-A447 WeakPolarHBondContact O-CB 3.49Å; L444-A447 PolarHBondContact O-N 2.71Å; L444-A447 VanDerWaalsContact O-N 3.1Å; L444-I448 HydrophobicContact CD1-CD1 4.13Å; L444-I448 HydrophobicContact CD1-CG1 4.35Å; L444-I448 HydrophobicContact CD2-CD1 4.11Å; L444-I448 HydrophobicContact CG-CD1 3.71Å; L444-I448 HydrophobicContact CG-CG1 4.3Å; L444-I448 WeakPolarHBondContact O-CG1 3.05Å; L444-I448 PolarHBondContact O-N 3.1Å
445	S	92.7	Very high	91.1	Very high	30 Å²	30	48 Å²	48	21%	0.21	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-42.4	179.7	65.4	0	0	0	0	111.3	I441 F442 A447 I448 C449 F453	I441-S445 VanDerWaalsContact O-CB 3.26Å; I441-S445 WeakPolarHBondContact O-CB 3.26Å; I441-S445 PolarHBondContact O-N 3.18Å; I441-S445 PolarHBondContact O-OG 2.94Å; F442-S445 WeakPolarHBondContact CA-OG 3.43Å; F442-S445 PolarHBondContact O-N 3.02Å; F442-S445 PolarHBondContact O-OG 2.98Å; S445-A447 PolarHBondContact O-N 2.91Å; S445-I448 PolarHBondContact O-N 3.31Å; S445-C449 PolarHBondContact O-N 3.48Å; S445-C449 PolarHBondContact O-SG 3.06Å; S445-F453 WeakPolarHBondContact OG-CE2 3.28Å
446	E	89.5	Confident	90.6	Very high	16 Å²	16	53.6 Å²	53.6	8%	0.075	29%	0.294	C	S	.	.	H	α-helix	trans	-58.8	-32.5	173.3	-71.2	-156.7	153.9	0	0	113.2	R195 F442 L444 D450 C451 T452 F453 Y458	R195-E446 IonicContact CZ-OE2 3.58Å; R195-E446 IonicContact NH1-OE2 2.71Å; R195-E446 PolarHBondContact NH1-OE2 2.56Å; R195-E446 IonicContact NH2-OE2 3.33Å; R195-E446 PolarHBondContact NH2-OE2 3.33Å; F442-E446 PolarHBondContact O-N 2.91Å; F442-E446 VanDerWaalsContact O-N 3.1Å; L444-E446 PolarHBondContact O-N 3.43Å; E446-D450 WeakPolarHBondContact O-CA 3.48Å; E446-D450 PolarHBondContact O-N 3.13Å; E446-C451 VanDerWaalsContact CG-O 3.23Å; E446-C451 WeakPolarHBondContact CG-O 3.1Å; E446-T452 WeakPolarHBondContact OE1-CA 3.36Å; E446-F453 HydrophobicContact CG-CD2 3.41Å; E446-F453 VanDerWaalsContact CG-CD2 3.41Å; E446-F453 HydrophobicContact CG-CE2 3.61Å; E446-F453 PolarHBondContact OE1-N 3.3Å; E446-Y458 WeakPolarHBondContact CG-OH 3.29Å; E446-Y458 VanDerWaalsContact OE1-CE2 3.28Å; E446-Y458 WeakPolarHBondContact OE1-CE2 3.35Å; E446-Y458 WeakPolarHBondContact OE2-CE2 3.03Å; E446-Y458 PolarHBondContact OE2-OH 2.93Å
447	A	90.6	Very high	90.2	Very high	3 Å²	3	55.2 Å²	55.2	3%	0.025	30%	0.303	C	S	.	.	H	α-helix	trans	-73.9	-30.7	176	0	0	0	0	0	112.7	K192 R195 I196 L444 S445	K192-A447 VanDerWaalsContact CD-O 3.23Å; K192-A447 WeakPolarHBondContact CD-O 3.41Å; K192-A447 WeakPolarHBondContact CE-O 3.4Å; K192-A447 HydrophobicContact CG-CB 4.38Å; K192-A447 WeakPolarHBondContact CG-O 3.22Å; K192-A447 PolarHBondContact NZ-O 2.96Å; K192-A447 VanDerWaalsContact NZ-O 3.1Å; R195-A447 HydrophobicContact CB-CB 3.7Å; R195-A447 HydrophobicContact CG-CB 4.46Å; I196-A447 HydrophobicContact CG1-CB 4.29Å; L444-A447 WeakPolarHBondContact O-CB 3.49Å; L444-A447 PolarHBondContact O-N 2.71Å; L444-A447 VanDerWaalsContact O-N 3.1Å; S445-A447 PolarHBondContact O-N 2.91Å
448	I	91.5	Very high	89.8	Confident	106 Å²	106	55 Å²	55	54%	0.544	30%	0.299	S	S	.	.	H	α-helix	trans	-87.7	-48.7	-175.3	-66	173.4	0	0	0	111.5	L444 S445	L444-I448 HydrophobicContact CD1-CD1 4.13Å; L444-I448 HydrophobicContact CD1-CG1 4.35Å; L444-I448 HydrophobicContact CD2-CD1 4.11Å; L444-I448 HydrophobicContact CG-CD1 3.71Å; L444-I448 HydrophobicContact CG-CG1 4.3Å; L444-I448 WeakPolarHBondContact O-CG1 3.05Å; L444-I448 PolarHBondContact O-N 3.1Å; S445-I448 PolarHBondContact O-N 3.31Å
449	C	90	Very high	89.4	Confident	65 Å²	65	54 Å²	54	44%	0.439	29%	0.292	S	S	.	.	H	α-helix	trans	-97.8	-1.1	-173.9	64	0	0	0	0	114.4	S445 C451	S445-C449 PolarHBondContact O-N 3.48Å; S445-C449 PolarHBondContact O-SG 3.06Å; C449-C451 HydrophobicContact CB-CB 4.4Å; C449-C451 WeakPolarHBondContact CB-SG 3.5Å; C449-C451 PolarHBondContact O-N 2.99Å; C449-C451 WeakPolarHBondContact SG-CB 3.19Å; C449-C451 CovalentContact SG-SG 2.03Å; C449-C451 PolarHBondContact SG-SG 3.27Å
450	D	81	Confident	89.2	Confident	123 Å²	123	57.7 Å²	57.7	66%	0.658	31%	0.312	S	S	*	.			trans	51.9	28.4	-171.9	-56.5	-44.4	0	0	0	112.1	E446	E446-D450 WeakPolarHBondContact O-CA 3.48Å; E446-D450 PolarHBondContact O-N 3.13Å
451	C	87.1	Confident	89.2	Confident	50 Å²	50	57.5 Å²	57.5	34%	0.338	31%	0.312	S	S	.	.			trans	-72.4	156.5	175.2	-55.8	0	0	0	0	110.2	E446 C449 F453	E446-C451 VanDerWaalsContact CG-O 3.23Å; E446-C451 WeakPolarHBondContact CG-O 3.1Å; C449-C451 HydrophobicContact CB-CB 4.4Å; C449-C451 WeakPolarHBondContact CB-SG 3.5Å; C449-C451 PolarHBondContact O-N 2.99Å; C449-C451 WeakPolarHBondContact SG-CB 3.19Å; C449-C451 CovalentContact SG-SG 2.03Å; C449-C451 PolarHBondContact SG-SG 3.27Å; C451-F453 HydrophobicContact CB-CE2 4.2Å; C451-F453 HydrophobicContact CB-CZ 4.28Å
452	T	85.2	Confident	89.1	Confident	130 Å²	130	54.1 Å²	54.1	80%	0.798	30%	0.296	S	S	*	.			trans	-120.3	128	171.1	50.6	0	0	0	0	109.2	E446	E446-T452 WeakPolarHBondContact OE1-CA 3.36Å
453	F	88.1	Confident	89	Confident	66 Å²	66	52.2 Å²	52.2	29%	0.289	29%	0.287	S	S	.	.			trans	-102.6	159.1	173	-62.5	-77.6	0	0	0	111.1	F442 S445 E446 C451 L457 Y458	F442-F453 HydrophobicContact CB-CD2 4.45Å; F442-F453 AromaticContact CD1-CD1 3.9Å; F442-F453 HydrophobicContact CD1-CD1 3.9Å; F442-F453 AromaticContact CD1-CD2 3.99Å; F442-F453 HydrophobicContact CD1-CD2 3.99Å; F442-F453 AromaticContact CD1-CE1 3.74Å; F442-F453 HydrophobicContact CD1-CE1 3.74Å; F442-F453 AromaticContact CD1-CE2 3.86Å; F442-F453 HydrophobicContact CD1-CE2 3.86Å; F442-F453 HydrophobicContact CD1-CG 4.04Å; F442-F453 AromaticContact CD1-CZ 3.73Å; F442-F453 HydrophobicContact CD1-CZ 3.73Å; F442-F453 HydrophobicContact CE1-CD1 4.08Å; F442-F453 AromaticContact CE1-CE1 3.83Å; F442-F453 HydrophobicContact CE1-CE1 3.83Å; F442-F453 HydrophobicContact CE1-CZ 4.19Å; S445-F453 WeakPolarHBondContact OG-CE2 3.28Å; E446-F453 HydrophobicContact CG-CD2 3.41Å; E446-F453 VanDerWaalsContact CG-CD2 3.41Å; E446-F453 HydrophobicContact CG-CE2 3.61Å; E446-F453 PolarHBondContact OE1-N 3.3Å; C451-F453 HydrophobicContact CB-CE2 4.2Å; C451-F453 HydrophobicContact CB-CZ 4.28Å; F453-L457 HydrophobicContact CB-CD2 3.96Å; F453-L457 HydrophobicContact CD1-CD2 3.7Å; F453-L457 HydrophobicContact CG-CD2 4.03Å; F453-Y458 HydrophobicContact CB-CD2 4.37Å; F453-Y458 HydrophobicContact CB-CE2 4.2Å
454	S	88	Confident	89	Confident	66 Å²	66	55 Å²	55	46%	0.462	30%	0.302	S	S	.	.			trans	-66.6	147.8	176.8	64.7	0	0	0	0	111.6	E456 L457 Y458	S454-E456 PolarHBondContact O-N 3.36Å; S454-L457 WeakPolarHBondContact O-CB 3.08Å; S454-L457 PolarHBondContact O-N 2.03Å; S454-L457 WeakPolarHBondContact OG-CB 3.23Å; S454-L457 PolarHBondContact OG-N 2.88Å; S454-Y458 PolarHBondContact O-N 2.85Å; S454-Y458 VanDerWaalsContact O-N 3.12Å
455	E	82.9	Confident	89.1	Confident	39 Å²	39	53.4 Å²	53.4	18%	0.182	29%	0.294	C	S	.	.	H	α-helix	trans	-57.9	-32.9	172.7	-76.3	-70.8	138.2	0	0	112.4	F25 R96 Y187 Y458 T459	F25-E455 HydrophobicContact CD1-CB 4.27Å; F25-E455 HydrophobicContact CD1-CG 3.56Å; F25-E455 HydrophobicContact CD2-CG 4.11Å; F25-E455 HydrophobicContact CE1-CG 3.54Å; F25-E455 HydrophobicContact CE2-CG 4.14Å; F25-E455 HydrophobicContact CG-CB 4.3Å; F25-E455 HydrophobicContact CG-CG 3.82Å; F25-E455 HydrophobicContact CZ-CG 3.83Å; R96-E455 IonicContact NH1-OE2 3.87Å; Y187-E455 WeakPolarHBondContact CE1-OE1 3.15Å; Y187-E455 VanDerWaalsContact CE1-OE2 3.23Å; Y187-E455 WeakPolarHBondContact CE1-OE2 3.44Å; Y187-E455 VanDerWaalsContact OH-CD 3.26Å; Y187-E455 PolarHBondContact OH-OE1 3.02Å; Y187-E455 PolarHBondContact OH-OE2 3.47Å; E455-Y458 PolarHBondContact O-N 2.85Å; E455-T459 WeakPolarHBondContact O-CB 3.41Å; E455-T459 PolarHBondContact O-N 2.96Å; E455-T459 PolarHBondContact O-OG1 2.99Å
456	E	83.5	Confident	89	Confident	121 Å²	121	52.6 Å²	52.6	57%	0.565	29%	0.286	S	S	*	.	H	α-helix	trans	-60.6	-45.5	174.4	-63.4	179.5	173.6	0	0	111.2	S454 T459 I460	S454-E456 PolarHBondContact O-N 3.36Å; E456-T459 WeakPolarHBondContact O-CB 3.38Å; E456-T459 PolarHBondContact O-N 3.12Å; E456-I460 WeakPolarHBondContact O-CD1 3.47Å; E456-I460 VanDerWaalsContact O-CG1 3.24Å; E456-I460 WeakPolarHBondContact O-CG1 3.49Å; E456-I460 PolarHBondContact O-N 3.29Å
457	L	87.9	Confident	89	Confident	49 Å²	49	55.7 Å²	55.7	26%	0.257	30%	0.299	S	S	.	.	H	α-helix	trans	-64.2	-46.4	178.5	-173.9	64.1	0	0	0	110.8	F442 F453 S454 T459 I460 V461	F442-L457 HydrophobicContact CD1-CD2 3.9Å; F442-L457 HydrophobicContact CE1-CD2 3.57Å; F442-L457 HydrophobicContact CE2-CD1 4.33Å; F442-L457 HydrophobicContact CE2-CD2 4.24Å; F442-L457 HydrophobicContact CE2-CG 4.38Å; F442-L457 HydrophobicContact CG-CD2 4.38Å; F442-L457 HydrophobicContact CZ-CD1 4.29Å; F442-L457 HydrophobicContact CZ-CD2 3.76Å; F442-L457 HydrophobicContact CZ-CG 4.35Å; F453-L457 HydrophobicContact CB-CD2 3.96Å; F453-L457 HydrophobicContact CD1-CD2 3.7Å; F453-L457 HydrophobicContact CG-CD2 4.03Å; S454-L457 WeakPolarHBondContact O-CB 3.08Å; S454-L457 PolarHBondContact O-N 2.03Å; S454-L457 WeakPolarHBondContact OG-CB 3.23Å; S454-L457 PolarHBondContact OG-N 2.88Å; L457-T459 VanDerWaalsContact C-N 3.28Å; L457-T459 PolarHBondContact O-N 3.23Å; L457-I460 PolarHBondContact O-N 3.37Å; L457-V461 HydrophobicContact CD1-CG1 4.46Å; L457-V461 WeakPolarHBondContact O-CG2 3.17Å; L457-V461 PolarHBondContact O-N 3.33Å
458	Y	88.5	Confident	88.9	Confident	31 Å²	31	55.6 Å²	55.6	12%	0.122	30%	0.298	C	S	.	.	H	α-helix	trans	-58.2	-42.5	176.2	-98.3	-64.3	0	0	0	112.7	E446 F453 S454 E455 V461 T462	E446-Y458 WeakPolarHBondContact CG-OH 3.29Å; E446-Y458 VanDerWaalsContact OE1-CE2 3.28Å; E446-Y458 WeakPolarHBondContact OE1-CE2 3.35Å; E446-Y458 WeakPolarHBondContact OE2-CE2 3.03Å; E446-Y458 PolarHBondContact OE2-OH 2.93Å; F453-Y458 HydrophobicContact CB-CD2 4.37Å; F453-Y458 HydrophobicContact CB-CE2 4.2Å; S454-Y458 PolarHBondContact O-N 2.85Å; S454-Y458 VanDerWaalsContact O-N 3.12Å; E455-Y458 PolarHBondContact O-N 2.85Å; Y458-V461 HydrophobicContact CD1-CG2 4.45Å; Y458-V461 WeakPolarHBondContact O-CG2 3.39Å; Y458-V461 PolarHBondContact O-N 2.92Å; Y458-T462 VanDerWaalsContact O-CB 3.22Å; Y458-T462 WeakPolarHBondContact O-CB 3.45Å; Y458-T462 PolarHBondContact O-N 3.44Å; Y458-T462 PolarHBondContact O-OG1 2.78Å
459	T	87.9	Confident	88.8	Confident	16 Å²	16	50.8 Å²	50.8	10%	0.098	27%	0.274	C	S	.	.	H	α-helix	trans	-60.7	-50.4	176.8	-66.2	0	0	0	0	110.2	E455 E456 L457 V461 T462 W463	E455-T459 WeakPolarHBondContact O-CB 3.41Å; E455-T459 PolarHBondContact O-N 2.96Å; E455-T459 PolarHBondContact O-OG1 2.99Å; E456-T459 WeakPolarHBondContact O-CB 3.38Å; E456-T459 PolarHBondContact O-N 3.12Å; L457-T459 VanDerWaalsContact C-N 3.28Å; L457-T459 PolarHBondContact O-N 3.23Å; T459-V461 PolarHBondContact O-N 3.49Å; T459-T462 PolarHBondContact O-N 2.99Å; T459-W463 VanDerWaalsContact CG2-CD1 3.45Å; T459-W463 VanDerWaalsContact CG2-NE1 3.33Å; T459-W463 WeakPolarHBondContact O-CB 3.44Å; T459-W463 PolarHBondContact O-N 2.83Å
460	I	90.4	Very high	88.7	Confident	107 Å²	107	48.6 Å²	48.6	55%	0.549	26%	0.258	S	S	.	.	H	α-helix	trans	-58.2	-48.1	178.6	-68.8	163.1	0	0	0	111.6	E456 L457 W463 L464	E456-I460 WeakPolarHBondContact O-CD1 3.47Å; E456-I460 VanDerWaalsContact O-CG1 3.24Å; E456-I460 WeakPolarHBondContact O-CG1 3.49Å; E456-I460 PolarHBondContact O-N 3.29Å; L457-I460 PolarHBondContact O-N 3.37Å; I460-W463 PolarHBondContact O-N 3.11Å; I460-L464 WeakPolarHBondContact O-CB 3.46Å; I460-L464 PolarHBondContact O-N 2.97Å
461	V	94.2	Very high	88.9	Confident	6 Å²	6	46.6 Å²	46.6	4%	0.036	24%	0.244	C	C	.	.	H	α-helix	trans	-73.7	-29.9	-176.8	-58.5	0	0	0	0	113	P438 F439 F442 L457 Y458 T459 G465	P438-V461 HydrophobicContact CB-CB 4.35Å; P438-V461 HydrophobicContact CB-CG1 3.98Å; F439-V461 HydrophobicContact CB-CB 4.35Å; F439-V461 HydrophobicContact CB-CG2 4.31Å; F439-V461 HydrophobicContact CD2-CG2 4.14Å; F442-V461 HydrophobicContact CD2-CG1 3.8Å; F442-V461 HydrophobicContact CD2-CG2 4.41Å; F442-V461 HydrophobicContact CE2-CG1 3.89Å; L457-V461 HydrophobicContact CD1-CG1 4.46Å; L457-V461 WeakPolarHBondContact O-CG2 3.17Å; L457-V461 PolarHBondContact O-N 3.33Å; Y458-V461 HydrophobicContact CD1-CG2 4.45Å; Y458-V461 WeakPolarHBondContact O-CG2 3.39Å; Y458-V461 PolarHBondContact O-N 2.92Å; T459-V461 PolarHBondContact O-N 3.49Å; V461-G465 PolarHBondContact O-N 2.8Å; V461-G465 VanDerWaalsContact O-N 3.14Å
462	T	92.7	Very high	88.6	Confident	26 Å²	26	44.3 Å²	44.3	16%	0.16	23%	0.228	C	C	.	.	H	α-helix	trans	-68	-46.2	173	-56.8	0	0	0	0	110.4	Y458 T459 L464 G465 Y466	Y458-T462 VanDerWaalsContact O-CB 3.22Å; Y458-T462 WeakPolarHBondContact O-CB 3.45Å; Y458-T462 PolarHBondContact O-N 3.44Å; Y458-T462 PolarHBondContact O-OG1 2.78Å; T459-T462 PolarHBondContact O-N 2.99Å; T462-L464 VanDerWaalsContact C-N 3.33Å; T462-L464 PolarHBondContact O-N 3.47Å; T462-G465 WeakPolarHBondContact O-CA 3.43Å; T462-G465 PolarHBondContact O-N 3.29Å; T462-G465 VanDerWaalsContact O-N 3.07Å; T462-Y466 HydrophobicContact CG2-CD2 4.43Å; T462-Y466 HydrophobicContact CG2-CE2 3.66Å; T462-Y466 PolarHBondContact O-N 2.79Å
463	W	91.9	Very high	88.4	Confident	12 Å²	12	38.5 Å²	38.5	5%	0.045	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-43.3	175.1	-71.9	123.6	0	0	0	111.7	L43 L90 A93 I94 Q97 T459 I460 G465 Y466 F467	L43-W463 HydrophobicContact CB-CZ3 4.41Å; L43-W463 HydrophobicContact CD1-CD2 3.55Å; L43-W463 HydrophobicContact CD1-CE3 3.8Å; L43-W463 HydrophobicContact CD1-CG 4.2Å; L43-W463 HydrophobicContact CD1-CH2 3.75Å; L43-W463 HydrophobicContact CD1-CZ2 3.45Å; L43-W463 VanDerWaalsContact CD1-CZ2 3.45Å; L43-W463 HydrophobicContact CD1-CZ3 3.9Å; L43-W463 HydrophobicContact CD2-CB 4.41Å; L43-W463 HydrophobicContact CD2-CD2 3.5Å; L43-W463 HydrophobicContact CD2-CE3 3.16Å; L43-W463 HydrophobicContact CD2-CG 4Å; L43-W463 HydrophobicContact CD2-CH2 4.4Å; L43-W463 HydrophobicContact CD2-CZ3 3.67Å; L43-W463 HydrophobicContact CG-CD2 4.13Å; L43-W463 HydrophobicContact CG-CE3 4.01Å; L43-W463 HydrophobicContact CG-CH2 4.46Å; L43-W463 HydrophobicContact CG-CZ3 4.18Å; L90-W463 HydrophobicContact CD2-CZ3 4.13Å; A93-W463 HydrophobicContact CB-CH2 3.49Å; A93-W463 VanDerWaalsContact CB-CH2 3.49Å; A93-W463 HydrophobicContact CB-CZ2 4.01Å; A93-W463 HydrophobicContact CB-CZ3 4.31Å; I94-W463 HydrophobicContact CG1-CH2 3.99Å; Q97-W463 HydrophobicContact CB-CZ2 4.06Å; Q97-W463 HydrophobicContact CG-CZ2 4.5Å; T459-W463 VanDerWaalsContact CG2-CD1 3.45Å; T459-W463 VanDerWaalsContact CG2-NE1 3.33Å; T459-W463 WeakPolarHBondContact O-CB 3.44Å; T459-W463 PolarHBondContact O-N 2.83Å; I460-W463 PolarHBondContact O-N 3.11Å; W463-G465 PolarHBondContact O-N 3.44Å; W463-Y466 HydrophobicContact CD2-CD2 4.21Å; W463-Y466 AromaticContact CE3-CD2 3.42Å; W463-Y466 HydrophobicContact CE3-CD2 3.42Å; W463-Y466 VanDerWaalsContact CE3-CD2 3.42Å; W463-Y466 HydrophobicContact CE3-CE2 4.02Å; W463-Y466 HydrophobicContact CE3-CG 4.49Å; W463-Y466 HydrophobicContact CH2-CE2 4.49Å; W463-Y466 AromaticContact CZ3-CD2 3.63Å; W463-Y466 HydrophobicContact CZ3-CD2 3.63Å; W463-Y466 AromaticContact CZ3-CE2 3.98Å; W463-Y466 HydrophobicContact CZ3-CE2 3.98Å; W463-Y466 PolarHBondContact O-N 3.48Å; W463-F467 WeakPolarHBondContact O-CD2 3.24Å; W463-F467 PolarHBondContact O-N 2.87Å; W463-F467 VanDerWaalsContact O-N 3.16Å
464	L	93.6	Very high	88	Confident	60 Å²	60	39.3 Å²	39.3	31%	0.314	20%	0.196	S	C	.	.	H	α-helix	trans	-53.2	-40.3	173.4	-173.9	62.5	0	0	0	111.9	C435 P438 I460 T462 F467	C435-L464 VanDerWaalsContact CB-O 3.23Å; C435-L464 WeakPolarHBondContact CB-O 3.36Å; C435-L464 CarbonylContact O-C 3.49Å; P438-L464 HydrophobicContact CB-CD2 4.21Å; P438-L464 HydrophobicContact CG-CD2 3.69Å; I460-L464 WeakPolarHBondContact O-CB 3.46Å; I460-L464 PolarHBondContact O-N 2.97Å; T462-L464 VanDerWaalsContact C-N 3.33Å; T462-L464 PolarHBondContact O-N 3.47Å; L464-F467 WeakPolarHBondContact O-CB 3.25Å; L464-F467 PolarHBondContact O-N 3.22Å
465	G	93.3	Very high	87.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-58.5	-48	172.9	0	0	0	0	0	113	C435 W436 V461 T462 W463 F467 N468	C435-G465 PolarHBondContact O-N 3.1Å; W436-G465 PolarHBondContact NE1-O 3.31Å; V461-G465 PolarHBondContact O-N 2.8Å; V461-G465 VanDerWaalsContact O-N 3.14Å; T462-G465 WeakPolarHBondContact O-CA 3.43Å; T462-G465 PolarHBondContact O-N 3.29Å; T462-G465 VanDerWaalsContact O-N 3.07Å; W463-G465 PolarHBondContact O-N 3.44Å; G465-F467 PolarHBondContact O-N 2.93Å; G465-N468 WeakPolarHBondContact O-CB 3.45Å; G465-N468 PolarHBondContact O-N 3.38Å; G465-N468 VanDerWaalsContact O-N 3.08Å
466	Y	92.3	Very high	87.1	Confident	12 Å²	12	36.1 Å²	36.1	5%	0.047	17%	0.173	C	C	.	.	H	α-helix	trans	-65.5	-22.5	179.2	-58.5	-42	0	0	0	114	V85 V89 L90 A93 D117 T462 W463 N468 S469	V85-Y466 HydrophobicContact CG1-CD1 4.39Å; V89-Y466 HydrophobicContact CG1-CE1 3.99Å; L90-Y466 HydrophobicContact CD2-CD1 4.14Å; L90-Y466 HydrophobicContact CD2-CD2 3.71Å; L90-Y466 HydrophobicContact CD2-CE2 4.1Å; L90-Y466 HydrophobicContact CD2-CG 3.73Å; A93-Y466 HydrophobicContact CB-CE2 4.43Å; D117-Y466 WeakPolarHBondContact OD1-CE1 3.29Å; D117-Y466 PolarHBondContact OD2-OH 3.42Å; T462-Y466 HydrophobicContact CG2-CD2 4.43Å; T462-Y466 HydrophobicContact CG2-CE2 3.66Å; T462-Y466 PolarHBondContact O-N 2.79Å; W463-Y466 HydrophobicContact CD2-CD2 4.21Å; W463-Y466 AromaticContact CE3-CD2 3.42Å; W463-Y466 HydrophobicContact CE3-CD2 3.42Å; W463-Y466 VanDerWaalsContact CE3-CD2 3.42Å; W463-Y466 HydrophobicContact CE3-CE2 4.02Å; W463-Y466 HydrophobicContact CE3-CG 4.49Å; W463-Y466 HydrophobicContact CH2-CE2 4.49Å; W463-Y466 AromaticContact CZ3-CD2 3.63Å; W463-Y466 HydrophobicContact CZ3-CD2 3.63Å; W463-Y466 AromaticContact CZ3-CE2 3.98Å; W463-Y466 HydrophobicContact CZ3-CE2 3.98Å; W463-Y466 PolarHBondContact O-N 3.48Å; Y466-N468 PolarHBondContact O-N 2.72Å; Y466-N468 VanDerWaalsContact O-N 3.14Å; Y466-S469 PolarHBondContact O-N 2.03Å
467	F	88.7	Confident	86.3	Confident	82 Å²	82	30.3 Å²	30.3	36%	0.36	15%	0.146	S	C	.	.	H	α-helix	trans	-60.2	-21	172	-79.4	-89.2	0	0	0	112.7	W463 L464 G465 S469 I470 F471	W463-F467 WeakPolarHBondContact O-CD2 3.24Å; W463-F467 PolarHBondContact O-N 2.87Å; W463-F467 VanDerWaalsContact O-N 3.16Å; L464-F467 WeakPolarHBondContact O-CB 3.25Å; L464-F467 PolarHBondContact O-N 3.22Å; G465-F467 PolarHBondContact O-N 2.93Å; F467-S469 VanDerWaalsContact C-N 3.3Å; F467-S469 PolarHBondContact O-N 3.48Å; F467-I470 HydrophobicContact CB-CD1 4.42Å; F467-I470 HydrophobicContact CD1-CD1 3.38Å; F467-I470 HydrophobicContact CE1-CD1 3.77Å; F467-I470 HydrophobicContact CG-CD1 4.04Å; F467-I470 WeakPolarHBondContact O-CB 2.86Å; F467-I470 PolarHBondContact O-N 3.12Å; F467-I470 VanDerWaalsContact O-N 3.1Å; F467-F471 HydrophobicContact CB-CE2 4.19Å; F467-F471 WeakPolarHBondContact O-CD2 3.28Å; F467-F471 PolarHBondContact O-N 2.78Å
468	N	88.7	Confident	84.9	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-52.2	-49.7	173.3	-178.4	-44.4	0	0	0	111.7	F432 C435 W436 G465 Y466 I470 F471	F432-N468 VanDerWaalsContact CA-ND2 3.33Å; F432-N468 WeakPolarHBondContact CA-ND2 3.3Å; F432-N468 WeakPolarHBondContact CB-ND2 3.36Å; F432-N468 WeakPolarHBondContact CD2-ND2 3.23Å; C435-N468 HydrophobicContact CB-CB 4.07Å; W436-N468 PolarHBondContact NE1-ND2 3.41Å; G465-N468 WeakPolarHBondContact O-CB 3.45Å; G465-N468 PolarHBondContact O-N 3.38Å; G465-N468 VanDerWaalsContact O-N 3.08Å; Y466-N468 PolarHBondContact O-N 2.72Å; Y466-N468 VanDerWaalsContact O-N 3.14Å; N468-I470 PolarHBondContact O-N 3.06Å; N468-F471 PolarHBondContact O-N 3.34Å
469	S	88.8	Confident	83.5	Confident	5 Å²	5	41.7 Å²	41.7	4%	0.035	19%	0.19	C	C	.	.	H	α-helix	trans	-68.2	-17.5	-177.2	-57.9	0	0	0	0	113.1	N54 D82 Y466 F467 P473	N54-S469 PolarHBondContact ND2-O 3.25Å; D82-S469 WeakPolarHBondContact OD1-CB 3.02Å; D82-S469 PolarHBondContact OD1-OG 3.29Å; Y466-S469 PolarHBondContact O-N 2.03Å; F467-S469 VanDerWaalsContact C-N 3.3Å; F467-S469 PolarHBondContact O-N 3.48Å; S469-P473 WeakPolarHBondContact O-CD 3.41Å
470	I	87.7	Confident	82.5	Confident	18 Å²	18	43.4 Å²	43.4	9%	0.092	20%	0.199	C	C	.	.	H	α-helix	trans	-72	-45.1	174.6	-59.6	179.4	0	0	0	110.3	A46 I49 I50 F467 N468 N472 P473 F474	A46-I470 HydrophobicContact CB-CD1 3.55Å; A46-I470 HydrophobicContact CB-CG1 4.43Å; I49-I470 HydrophobicContact CG2-CG2 4.24Å; I50-I470 HydrophobicContact CD1-CD1 4.44Å; I50-I470 HydrophobicContact CD1-CG1 3.6Å; I50-I470 HydrophobicContact CG1-CB 4.35Å; I50-I470 HydrophobicContact CG1-CG1 3.54Å; F467-I470 HydrophobicContact CB-CD1 4.42Å; F467-I470 HydrophobicContact CD1-CD1 3.38Å; F467-I470 HydrophobicContact CE1-CD1 3.77Å; F467-I470 HydrophobicContact CG-CD1 4.04Å; F467-I470 WeakPolarHBondContact O-CB 2.86Å; F467-I470 PolarHBondContact O-N 3.12Å; F467-I470 VanDerWaalsContact O-N 3.1Å; N468-I470 PolarHBondContact O-N 3.06Å; I470-N472 VanDerWaalsContact C-N 3.32Å; I470-N472 PolarHBondContact O-N 3.28Å; I470-P473 WeakPolarHBondContact O-CD 3.48Å; I470-F474 HydrophobicContact CG2-CD2 4.32Å; I470-F474 HydrophobicContact CG2-CE2 3.72Å; I470-F474 WeakPolarHBondContact O-CD2 3.49Å; I470-F474 WeakPolarHBondContact O-CE2 3.18Å
471	F	85	Confident	81.4	Confident	82 Å²	82	46.8 Å²	46.8	36%	0.36	21%	0.209	S	C	.	.	H	α-helix	trans	-71.2	-25.7	-170.9	-66.2	-63.1	0	0	0	113.4	C431 F467 N468 F474 I475	C431-F471 HydrophobicContact CB-CD2 4.2Å; F467-F471 HydrophobicContact CB-CE2 4.19Å; F467-F471 WeakPolarHBondContact O-CD2 3.28Å; F467-F471 PolarHBondContact O-N 2.78Å; N468-F471 PolarHBondContact O-N 3.34Å; F471-F474 PolarHBondContact O-N 3.47Å; F471-I475 HydrophobicContact CB-CD1 3.88Å; F471-I475 VanDerWaalsContact O-CG1 3.26Å; F471-I475 WeakPolarHBondContact O-CG1 3.45Å; F471-I475 PolarHBondContact O-N 3.4Å
472	N	82.2	Confident	80.1	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-57.3	-52.2	-175.8	-69.4	-20	0	0	0	112.9	D82 V428 I470 F474 I475 Y476	D82-N472 PolarHBondContact OD2-ND2 3.37Å; V428-N472 WeakPolarHBondContact CG1-OD1 3.24Å; I470-N472 VanDerWaalsContact C-N 3.32Å; I470-N472 PolarHBondContact O-N 3.28Å; N472-F474 VanDerWaalsContact C-N 3.27Å; N472-F474 PolarHBondContact O-N 3.5Å; N472-I475 PolarHBondContact O-N 3.04Å; N472-Y476 HydrophobicContact CB-CD2 4.14Å; N472-Y476 HydrophobicContact CB-CE2 3.94Å; N472-Y476 WeakPolarHBondContact O-CD2 2.99Å; N472-Y476 PolarHBondContact O-N 2.97Å
473	P	79.8	Confident	78.8	Confident	8 Å²	8	49.8 Å²	49.8	5%	0.052	22%	0.221	C	C	.	.	H	α-helix	trans	-51.8	-40.1	169.7	-28.9	32.7	0	0	0	114.5	I57 S469 I470 G477	I57-P473 HydrophobicContact CD1-CB 4.21Å; I57-P473 HydrophobicContact CD1-CG 4.15Å; S469-P473 WeakPolarHBondContact O-CD 3.41Å; I470-P473 WeakPolarHBondContact O-CD 3.48Å; P473-G477 WeakPolarHBondContact O-CA 3.46Å; P473-G477 PolarHBondContact O-N 3.31Å
474	F	80.3	Confident	77.6	Confident	83 Å²	83	50.6 Å²	50.6	36%	0.364	23%	0.23	S	C	.	.	I	π-helix	trans	-71.2	-39.7	-178.9	-62.9	-87.7	0	0	0	112.3	I49 I470 F471 N472 F478	I49-F474 HydrophobicContact CG2-CE2 3.81Å; I49-F474 HydrophobicContact CG2-CZ 3.9Å; I470-F474 HydrophobicContact CG2-CD2 4.32Å; I470-F474 HydrophobicContact CG2-CE2 3.72Å; I470-F474 WeakPolarHBondContact O-CD2 3.49Å; I470-F474 WeakPolarHBondContact O-CE2 3.18Å; F471-F474 PolarHBondContact O-N 3.47Å; N472-F474 VanDerWaalsContact C-N 3.27Å; N472-F474 PolarHBondContact O-N 3.5Å; F474-F478 HydrophobicContact CB-CD2 4.08Å; F474-F478 AromaticContact CD1-CD2 3.46Å; F474-F478 HydrophobicContact CD1-CD2 3.46Å; F474-F478 VanDerWaalsContact CD1-CD2 3.46Å; F474-F478 AromaticContact CD1-CE2 3.33Å; F474-F478 HydrophobicContact CD1-CE2 3.33Å; F474-F478 HydrophobicContact CE1-CD2 4.27Å; F474-F478 AromaticContact CE1-CE2 3.69Å; F474-F478 HydrophobicContact CE1-CE2 3.69Å; F474-F478 HydrophobicContact CG-CD2 4.12Å; F474-F478 HydrophobicContact CG-CE2 4.17Å; F474-F478 PolarHBondContact O-N 2.84Å; F474-F478 VanDerWaalsContact O-N 3.13Å
475	I	79	Confident	76.5	Confident	14 Å²	14	52 Å²	52	7%	0.072	24%	0.238	C	C	.	.	I	π-helix	trans	-73.1	-45.9	-177.5	-64.1	164.7	0	0	0	111	T424 I427 V428 F471 N472	T424-I475 HydrophobicContact CG2-CG2 3.44Å; T424-I475 VanDerWaalsContact CG2-CG2 3.44Å; I427-I475 HydrophobicContact CG2-CD1 3.99Å; I427-I475 HydrophobicContact CG2-CG1 4.24Å; V428-I475 HydrophobicContact CB-CD1 4.42Å; V428-I475 HydrophobicContact CG2-CB 4.11Å; V428-I475 HydrophobicContact CG2-CD1 3.77Å; V428-I475 HydrophobicContact CG2-CG2 3.49Å; V428-I475 VanDerWaalsContact CG2-CG2 3.49Å; F471-I475 HydrophobicContact CB-CD1 3.88Å; F471-I475 VanDerWaalsContact O-CG1 3.26Å; F471-I475 WeakPolarHBondContact O-CG1 3.45Å; F471-I475 PolarHBondContact O-N 3.4Å; N472-I475 PolarHBondContact O-N 3.04Å
476	Y	74	Confident	75.2	Confident	24 Å²	24	53 Å²	53	9%	0.094	25%	0.246	C	C	.	.	I	π-helix	trans	-78.7	-34.1	178.9	-60.7	-58.1	0	0	0	112.5	I57 I75 L78 T424 V428 N472 N480	I57-Y476 HydrophobicContact CD1-CD2 4.39Å; I75-Y476 HydrophobicContact CD1-CD1 4.17Å; I75-Y476 HydrophobicContact CD1-CE1 4.26Å; I75-Y476 HydrophobicContact CG1-CD1 4.46Å; I75-Y476 HydrophobicContact CG1-CE1 4.22Å; I75-Y476 HydrophobicContact CG2-CD1 4.39Å; I75-Y476 HydrophobicContact CG2-CD2 4.24Å; I75-Y476 HydrophobicContact CG2-CG 4.18Å; L78-Y476 HydrophobicContact CD2-CE2 3.76Å; L78-Y476 VanDerWaalsContact CD2-OH 3.27Å; L78-Y476 WeakPolarHBondContact CD2-OH 3.39Å; T424-Y476 HydrophobicContact CG2-CD1 4.33Å; T424-Y476 HydrophobicContact CG2-CE1 4.39Å; V428-Y476 HydrophobicContact CG2-CE1 4.23Å; V428-Y476 HydrophobicContact CG2-CE2 4.45Å; N472-Y476 HydrophobicContact CB-CD2 4.14Å; N472-Y476 HydrophobicContact CB-CE2 3.94Å; N472-Y476 WeakPolarHBondContact O-CD2 2.99Å; N472-Y476 PolarHBondContact O-N 2.97Å; Y476-N480 WeakPolarHBondContact O-CB 3.47Å
477	G	64.8	Low	74	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.259	C	S	.	.	I	π-helix	trans	-85.9	-55.1	-170.8	0	0	0	0	0	114.6	P473 Y483	P473-G477 WeakPolarHBondContact O-CA 3.46Å; P473-G477 PolarHBondContact O-N 3.31Å; G477-Y483 VanDerWaalsContact CA-CG 3.45Å; G477-Y483 WeakPolarHBondContact O-CB 3.43Å; G477-Y483 WeakPolarHBondContact O-CD1 3.25Å
478	F	59.8	Low	73.2	Confident	129 Å²	129	57.9 Å²	57.9	57%	0.566	27%	0.268	S	S	*	.	I	π-helix	trans	-82.4	-28	-171.4	-66.7	-66.7	0	0	0	113.8	F474	F474-F478 HydrophobicContact CB-CD2 4.08Å; F474-F478 AromaticContact CD1-CD2 3.46Å; F474-F478 HydrophobicContact CD1-CD2 3.46Å; F474-F478 VanDerWaalsContact CD1-CD2 3.46Å; F474-F478 AromaticContact CD1-CE2 3.33Å; F474-F478 HydrophobicContact CD1-CE2 3.33Å; F474-F478 HydrophobicContact CE1-CD2 4.27Å; F474-F478 AromaticContact CE1-CE2 3.69Å; F474-F478 HydrophobicContact CE1-CE2 3.69Å; F474-F478 HydrophobicContact CG-CD2 4.12Å; F474-F478 HydrophobicContact CG-CE2 4.17Å; F474-F478 PolarHBondContact O-N 2.84Å; F474-F478 VanDerWaalsContact O-N 3.13Å
479	Y	57.7	Low	72.3	Confident	190 Å²	190	63.1 Å²	63.1	75%	0.745	29%	0.292	S	S	*	.	S	Bend	trans	-81.3	-17.8	178.3	-79.7	-84.5	0	0	0	113.8
480	N	68.1	Low	71.5	Confident	51 Å²	51	65.3 Å²	65.3	27%	0.273	30%	0.303	S	S	.	.			trans	-98	109.1	177.7	-169.6	-15.7	0	0	0	111.1	Y476 E482 Y483 A484	Y476-N480 WeakPolarHBondContact O-CB 3.47Å; N480-E482 PolarHBondContact O-N 2.89Å; N480-E482 VanDerWaalsContact O-N 3.11Å; N480-E482 WeakPolarHBondContact OD1-CB 3.08Å; N480-E482 PolarHBondContact OD1-N 3.47Å; N480-Y483 WeakPolarHBondContact O-CB 3.34Å; N480-Y483 PolarHBondContact O-N 2.98Å; N480-A484 PolarHBondContact O-N 3.26Å
481	K	66.9	Low	70.8	Confident	178 Å²	178	68.2 Å²	68.2	77%	0.774	32%	0.321	S	S	*	.	H	α-helix	trans	-53.3	-33.5	176.6	-67.1	-174.7	178	-176.3	0	113.1	Y483 N485	K481-Y483 VanDerWaalsContact C-N 3.34Å; K481-N485 VanDerWaalsContact O-CG 3.27Å; K481-N485 PolarHBondContact O-N 3.05Å; K481-N485 VanDerWaalsContact O-N 3.12Å; K481-N485 PolarHBondContact O-ND2 3.41Å
482	E	66.5	Low	70.2	Confident	82 Å²	82	69.3 Å²	69.3	38%	0.383	33%	0.33	S	S	.	.	H	α-helix	trans	-65.2	-39.5	177.1	-60.3	-173.4	159.9	0	0	111.8	W60 R64 N480 A486	W60-E482 HydrophobicContact CZ2-CB 4.45Å; R64-E482 IonicContact CZ-OE2 2.83Å; R64-E482 VanDerWaalsContact CZ-OE2 3.23Å; R64-E482 IonicContact NH1-OE2 3.33Å; R64-E482 PolarHBondContact NH1-OE2 2.78Å; R64-E482 VanDerWaalsContact NH2-CD 3.28Å; R64-E482 IonicContact NH2-OE1 3.47Å; R64-E482 PolarHBondContact NH2-OE1 3.46Å; R64-E482 IonicContact NH2-OE2 2.79Å; R64-E482 PolarHBondContact NH2-OE2 2.94Å; N480-E482 PolarHBondContact O-N 2.89Å; N480-E482 VanDerWaalsContact O-N 3.11Å; N480-E482 WeakPolarHBondContact OD1-CB 3.08Å; N480-E482 PolarHBondContact OD1-N 3.47Å; E482-A486 PolarHBondContact O-N 3.34Å
483	Y	65.4	Low	69.4	Low	13 Å²	13	76.6 Å²	76.6	5%	0.051	37%	0.368	C	S	.	.	H	α-helix	trans	-70.1	-48.5	176.6	179.6	-81.6	0	0	0	110.9	I57 W60 G477 N480 K481 N485 A486 F487	I57-Y483 HydrophobicContact CB-CE2 4.49Å; I57-Y483 HydrophobicContact CG1-CE2 3.83Å; W60-Y483 HydrophobicContact CB-CD2 4.29Å; W60-Y483 HydrophobicContact CB-CE2 4.11Å; W60-Y483 AromaticContact CD2-CD2 3.57Å; W60-Y483 HydrophobicContact CD2-CD2 3.57Å; W60-Y483 HydrophobicContact CD2-CE2 4.22Å; W60-Y483 HydrophobicContact CD2-CG 4.47Å; W60-Y483 AromaticContact CE3-CD2 3.59Å; W60-Y483 HydrophobicContact CE3-CD2 3.59Å; W60-Y483 HydrophobicContact CE3-CE2 4.18Å; W60-Y483 AromaticContact CG-CD2 3.86Å; W60-Y483 HydrophobicContact CG-CD2 3.86Å; W60-Y483 HydrophobicContact CG-CE2 4.18Å; W60-Y483 HydrophobicContact CZ3-CD2 4.23Å; G477-Y483 VanDerWaalsContact CA-CG 3.45Å; G477-Y483 WeakPolarHBondContact O-CB 3.43Å; G477-Y483 WeakPolarHBondContact O-CD1 3.25Å; N480-Y483 WeakPolarHBondContact O-CB 3.34Å; N480-Y483 PolarHBondContact O-N 2.98Å; K481-Y483 VanDerWaalsContact C-N 3.34Å; Y483-N485 PolarHBondContact O-N 3.21Å; Y483-A486 CarbonylContact O-C 3.6Å; Y483-A486 PolarHBondContact O-N 3.44Å; Y483-F487 HydrophobicContact CD1-CB 4.39Å; Y483-F487 HydrophobicContact CE1-CB 4.21Å; Y483-F487 PolarHBondContact O-N 3.05Å
484	A	68.2	Low	68.2	Low	30 Å²	30	83 Å²	83	25%	0.248	40%	0.395	C	S	.	.	H	α-helix	trans	-56	-37.3	-179.7	0	0	0	0	0	112	N480 K488	N480-A484 PolarHBondContact O-N 3.26Å; A484-K488 WeakPolarHBondContact O-CG 2.94Å; A484-K488 PolarHBondContact O-N 3.1Å
485	N	69	Low	66.7	Low	89 Å²	89	81.8 Å²	81.8	48%	0.476	41%	0.406	S	S	.	.	H	α-helix	trans	-67.2	-44.9	173.9	-72.9	-13.6	0	0	0	112.1	K481 Y483 F487 K488 H489	K481-N485 VanDerWaalsContact O-CG 3.27Å; K481-N485 PolarHBondContact O-N 3.05Å; K481-N485 VanDerWaalsContact O-N 3.12Å; K481-N485 PolarHBondContact O-ND2 3.41Å; Y483-N485 PolarHBondContact O-N 3.21Å; N485-F487 VanDerWaalsContact C-N 3.34Å; N485-F487 PolarHBondContact O-N 2.82Å; N485-K488 WeakPolarHBondContact O-CB 3.36Å; N485-K488 PolarHBondContact O-N 3.22Å; N485-H489 PolarHBondContact O-CD2 3.02Å; N485-H489 PolarHBondContact O-N 3.4Å; N485-H489 VanDerWaalsContact O-N 3.07Å
486	A	65.8	Low	65.1	Low	20 Å²	20	87.7 Å²	87.7	17%	0.165	45%	0.448	C	S	.	.	H	α-helix	trans	-69.1	-32.9	179.3	0	0	0	0	0	113.3	W60 E482 Y483 K488 H489 I490	W60-A486 HydrophobicContact CG-CB 4.19Å; E482-A486 PolarHBondContact O-N 3.34Å; Y483-A486 CarbonylContact O-C 3.6Å; Y483-A486 PolarHBondContact O-N 3.44Å; A486-K488 VanDerWaalsContact C-N 3.3Å; A486-K488 PolarHBondContact O-N 3.12Å; A486-H489 WeakPolarHBondContact O-CA 2.91Å; A486-H489 WeakPolarHBondContact O-CB 3.19Å; A486-H489 PolarHBondContact O-N 3.17Å; A486-I490 WeakPolarHBondContact O-CG1 3.41Å; A486-I490 PolarHBondContact O-N 3.25Å
487	F	68.9	Low	63.2	Low	73 Å²	73	101.8 Å²	101.8	32%	0.32	50%	0.501	S	S	.	.	H	α-helix	trans	-57	-45.4	168.9	175.4	-98.1	0	0	0	110.9	L56 Y483 N485 H489 I490 V491	L56-F487 HydrophobicContact CD1-CD2 4.02Å; L56-F487 HydrophobicContact CD1-CE2 3.69Å; Y483-F487 HydrophobicContact CD1-CB 4.39Å; Y483-F487 HydrophobicContact CE1-CB 4.21Å; Y483-F487 PolarHBondContact O-N 3.05Å; N485-F487 VanDerWaalsContact C-N 3.34Å; N485-F487 PolarHBondContact O-N 2.82Å; F487-H489 VanDerWaalsContact C-N 3.28Å; F487-H489 PolarHBondContact O-N 2.81Å; F487-I490 PolarHBondContact O-N 3.22Å; F487-V491 HydrophobicContact CD1-CG2 4.48Å; F487-V491 HydrophobicContact CD2-CG2 3.8Å; F487-V491 HydrophobicContact CE1-CG2 4.14Å; F487-V491 HydrophobicContact CE2-CG2 3.41Å; F487-V491 VanDerWaalsContact CE2-CG2 3.41Å; F487-V491 HydrophobicContact CG-CG2 4.33Å; F487-V491 HydrophobicContact CZ-CB 4.39Å; F487-V491 HydrophobicContact CZ-CG2 3.61Å; F487-V491 WeakPolarHBondContact O-CB 3.33Å; F487-V491 PolarHBondContact O-N 2.79Å
488	K	70.9	Confident	63.1	Low	125 Å²	125	106.9 Å²	106.9	54%	0.543	53%	0.526	S	S	.	.	H	α-helix	trans	-58.5	-39.7	172.7	-69.9	175.5	-179.1	179.8	0	111.6	A484 N485 A486 L492	A484-K488 WeakPolarHBondContact O-CG 2.94Å; A484-K488 PolarHBondContact O-N 3.1Å; N485-K488 WeakPolarHBondContact O-CB 3.36Å; N485-K488 PolarHBondContact O-N 3.22Å; A486-K488 VanDerWaalsContact C-N 3.3Å; A486-K488 PolarHBondContact O-N 3.12Å; K488-L492 HydrophobicContact CB-CD1 4.08Å; K488-L492 WeakPolarHBondContact O-CB 3.45Å; K488-L492 WeakPolarHBondContact O-CD1 3.37Å; K488-L492 WeakPolarHBondContact O-CG 3.35Å; K488-L492 PolarHBondContact O-N 3.36Å
489	H	70.8	Confident	63.3	Low	111 Å²	111	105.7 Å²	105.7	51%	0.514	52%	0.523	S	S	.	.	H	α-helix	trans	-67.3	-44.9	177.7	-74.7	-73.5	0	0	0	113.2	N485 A486 F487 L493 K494	N485-H489 PolarHBondContact O-CD2 3.02Å; N485-H489 PolarHBondContact O-N 3.4Å; N485-H489 VanDerWaalsContact O-N 3.07Å; A486-H489 WeakPolarHBondContact O-CA 2.91Å; A486-H489 WeakPolarHBondContact O-CB 3.19Å; A486-H489 PolarHBondContact O-N 3.17Å; F487-H489 VanDerWaalsContact C-N 3.28Å; F487-H489 PolarHBondContact O-N 2.81Å; H489-L493 PolarHBondContact O-N 3.39Å; H489-K494 PolarHBondContact O-N 3.23Å
490	I	71.2	Confident	63.6	Low	51 Å²	51	101.1 Å²	101.1	26%	0.262	51%	0.511	S	S	.	.	H	α-helix	trans	-67.6	-51	-179.2	-65.9	168.6	0	0	0	110.5	L56 W60 A486 F487 L493	L56-I490 HydrophobicContact CD2-CG2 4.2Å; W60-I490 HydrophobicContact CB-CD1 4.34Å; A486-I490 WeakPolarHBondContact O-CG1 3.41Å; A486-I490 PolarHBondContact O-N 3.25Å; F487-I490 PolarHBondContact O-N 3.22Å; I490-L493 PolarHBondContact O-N 2.97Å
491	V	72.5	Confident	63.4	Low	79 Å²	79	104 Å²	104	48%	0.479	53%	0.525	S	S	.	.	H	α-helix	trans	-74.2	-39.4	-175.5	174.7	0	0	0	0	112.4	F487 L493	F487-V491 HydrophobicContact CD1-CG2 4.48Å; F487-V491 HydrophobicContact CD2-CG2 3.8Å; F487-V491 HydrophobicContact CE1-CG2 4.14Å; F487-V491 HydrophobicContact CE2-CG2 3.41Å; F487-V491 VanDerWaalsContact CE2-CG2 3.41Å; F487-V491 HydrophobicContact CG-CG2 4.33Å; F487-V491 HydrophobicContact CZ-CB 4.39Å; F487-V491 HydrophobicContact CZ-CG2 3.61Å; F487-V491 WeakPolarHBondContact O-CB 3.33Å; F487-V491 PolarHBondContact O-N 2.79Å; V491-L493 PolarHBondContact O-N 3.16Å
492	L	73.5	Confident	63.1	Low	105 Å²	105	99.4 Å²	99.4	55%	0.55	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	3.3	178.7	-57	172.1	0	0	0	112.9	K488 K494	K488-L492 HydrophobicContact CB-CD1 4.08Å; K488-L492 WeakPolarHBondContact O-CB 3.45Å; K488-L492 WeakPolarHBondContact O-CD1 3.37Å; K488-L492 WeakPolarHBondContact O-CG 3.35Å; K488-L492 PolarHBondContact O-N 3.36Å; L492-K494 HydrophobicContact CB-CG 4.18Å; L492-K494 PolarHBondContact O-N 2.69Å
493	L	64.1	Low	62.9	Low	153 Å²	153	100.5 Å²	100.5	80%	0.801	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.7	31.2	-175.1	-66.7	169	0	0	0	112.3	H489 I490 V491 G495	H489-L493 PolarHBondContact O-N 3.39Å; I490-L493 PolarHBondContact O-N 2.97Å; V491-L493 PolarHBondContact O-N 3.16Å; L493-G495 PolarHBondContact O-N 3.47Å
494	K	54.1	Low	62.7	Low	142 Å²	142	106.8 Å²	106.8	62%	0.617	55%	0.551	S	S	*	*			trans	-74.5	85.4	172.4	-77.2	-167.3	176.2	-174.2	0	105.3	H489 L492	H489-K494 PolarHBondContact O-N 3.23Å; L492-K494 HydrophobicContact CB-CG 4.18Å; L492-K494 PolarHBondContact O-N 2.69Å
495	G	49.5	Very low	62.3	Low	58 Å²	58	112.7 Å²	112.7	60%	0.598	58%	0.575	S	S	*	*			trans	-46.3	147.9	-167.4	0	0	0	0	0	112.8	L493 R497	L493-G495 PolarHBondContact O-N 3.47Å; G495-R497 PolarHBondContact O-N 3.41Å
496	C	45	Very low	61.8	Low	139 Å²	139	114.7 Å²	114.7	94%	0.939	58%	0.583	S	S	*	*			trans	-46.9	110.5	163.1	-65.2	0	0	0	0	108.1
497	R	34.9	Very low	61.4	Low	320 Å²	320	123.3 Å²	123.3	100%	1.208	62%	0.621	S	S	*	*			trans	-115.1	0	164.9	-140.8	-176.3	-169.7	-175.5	3.4	107.7	G495	G495-R497 PolarHBondContact O-N 3.41Å

Retrieved 497 of 497 residues in 126.8 ms (Link to these results)

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