A0A077ZDU0_TRITR Loading...

TATA box-binding protein-associated factor RNA polymerase I subunit B

AlphaFold DB , UniProt , Accession A0A077ZDU0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 585 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	38.3	Very low	75.7	Confident	228 Å²	228	90 Å²	90	100%	1.123	53%	0.527	S	S	*	.				0	112.2	0	-75.1	179.2	163.8	0	0	105.9	R3	M1-R3 PolarHBondContact O-N 2.98Å
2	T	48.4	Very low	76.4	Confident	112 Å²	112	93.3 Å²	93.3	69%	0.687	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-69.8	123.2	175	45.9	0	0	0	0	107.6	E11	T2-E11 WeakPolarHBondContact CB-OE1 3.03Å; T2-E11 PolarHBondContact OG1-OE1 2.69Å
3	R	64.3	Low	77.1	Confident	147 Å²	147	91.1 Å²	91.1	56%	0.555	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-100.8	125.6	-178.5	-76.8	-169.8	178.4	170.5	3.9	109.2	M1	M1-R3 PolarHBondContact O-N 2.98Å
4	S	84.5	Confident	77.5	Confident	57 Å²	57	90.6 Å²	90.6	40%	0.399	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-91.3	156.2	176.3	49.3	0	0	0	0	111.4	A6 G9 S10	S4-A6 PolarHBondContact O-N 2.76Å; S4-G9 VanDerWaalsContact CB-C 3.42Å; S4-G9 WeakPolarHBondContact CB-O 3.48Å; S4-S10 CarbonylContact C-O 3.39Å; S4-S10 WeakPolarHBondContact CA-O 3.37Å
5	C	82	Confident	77.5	Confident	8 Å²	8	89.3 Å²	89.3	5%	0.054	51%	0.505	C	S	.	.	P	Polyproline II helix	trans	-53.3	125.5	173.3	177.3	0	0	0	0	110	V7 C8 G9 S10 F13 C22 C25	C5-V7 PolarHBondContact O-N 3.27Å; C5-V7 PolarHBondContact SG-N 2.84Å; C5-V7 VanDerWaalsContact SG-N 3.44Å; C5-C8 PolarHBondContact O-N 2.88Å; C5-C8 VanDerWaalsContact SG-SG 3.68Å; C5-G9 VanDerWaalsContact O-CA 3.27Å; C5-G9 WeakPolarHBondContact O-CA 3.22Å; C5-G9 PolarHBondContact O-N 2.66Å; C5-S10 WeakPolarHBondContact CB-O 3.4Å; C5-S10 PolarHBondContact N-O 2.81Å; C5-F13 HydrophobicContact CB-CE1 4.36Å; C5-F13 HydrophobicContact CB-CZ 3.92Å; C5-C22 HydrophobicContact CB-CB 3.96Å; C5-C25 PolarHBondContact SG-SG 3.25Å
6	A	79.7	Confident	77.1	Confident	106 Å²	106	88.1 Å²	88.1	88%	0.876	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-20.4	179.3	0	0	0	0	0	113.5	S4	S4-A6 PolarHBondContact O-N 2.76Å
7	V	84.4	Confident	76.6	Confident	100 Å²	100	90.4 Å²	90.4	61%	0.606	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-48.7	-178.5	-178.3	0	0	0	0	112.1	C5 V27	C5-V7 PolarHBondContact O-N 3.27Å; C5-V7 PolarHBondContact SG-N 2.84Å; C5-V7 VanDerWaalsContact SG-N 3.44Å; V7-V27 HydrophobicContact CB-CG2 4.47Å; V7-V27 HydrophobicContact CG1-CG2 4.49Å; V7-V27 HydrophobicContact CG2-CB 4.25Å; V7-V27 HydrophobicContact CG2-CG1 4.01Å; V7-V27 HydrophobicContact CG2-CG2 4.1Å
8	C	89.2	Confident	76	Confident	55 Å²	55	86.4 Å²	86.4	37%	0.372	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-5.5	-172.8	68.7	0	0	0	0	114.9	C5 S10 C22 V24 C25	C5-C8 PolarHBondContact O-N 2.88Å; C5-C8 VanDerWaalsContact SG-SG 3.68Å; C8-S10 PolarHBondContact O-N 3.28Å; C8-S10 VanDerWaalsContact SG-CB 3.54Å; C8-C22 PolarHBondContact SG-SG 3.17Å; C8-V24 HydrophobicContact CB-CG1 4.47Å; C8-C25 HydrophobicContact CB-CB 4.15Å
9	G	86.4	Confident	75.8	Confident	44 Å²	44	86.1 Å²	86.1	45%	0.454	48%	0.482	S	S	.	.			trans	73.7	5.6	-177.6	0	0	0	0	0	114.8	S4 C5	S4-G9 VanDerWaalsContact CB-C 3.42Å; S4-G9 WeakPolarHBondContact CB-O 3.48Å; C5-G9 VanDerWaalsContact O-CA 3.27Å; C5-G9 WeakPolarHBondContact O-CA 3.22Å; C5-G9 PolarHBondContact O-N 2.66Å
10	S	87	Confident	76.1	Confident	20 Å²	20	84.9 Å²	84.9	14%	0.14	47%	0.47	C	S	.	.			trans	-72.6	137	175.7	-179.3	0	0	0	0	111.9	S4 C5 C8 E12 V24	S4-S10 CarbonylContact C-O 3.39Å; S4-S10 WeakPolarHBondContact CA-O 3.37Å; C5-S10 WeakPolarHBondContact CB-O 3.4Å; C5-S10 PolarHBondContact N-O 2.81Å; C8-S10 PolarHBondContact O-N 3.28Å; C8-S10 VanDerWaalsContact SG-CB 3.54Å; S10-E12 VanDerWaalsContact C-N 3.3Å; S10-E12 PolarHBondContact OG-N 2.78Å; S10-E12 VanDerWaalsContact OG-N 3.11Å; S10-V24 WeakPolarHBondContact OG-CG2 3.43Å
11	E	88.7	Confident	76.5	Confident	113 Å²	113	83.6 Å²	83.6	53%	0.528	46%	0.459	S	S	.	.			trans	-86.6	-3.6	172.4	-60.8	-172.3	160.2	0	0	112.5	T2 F13	T2-E11 WeakPolarHBondContact CB-OE1 3.03Å; T2-E11 PolarHBondContact OG1-OE1 2.69Å; E11-F13 WeakPolarHBondContact O-CD2 3.44Å
12	E	84	Confident	78.9	Confident	130 Å²	130	72.8 Å²	72.8	61%	0.607	41%	0.405	S	S	*	.			trans	-90.1	124.1	-178.7	-68.7	-177.9	179.6	0	0	111.6	S10 S23	S10-E12 VanDerWaalsContact C-N 3.3Å; S10-E12 PolarHBondContact OG-N 2.78Å; S10-E12 VanDerWaalsContact OG-N 3.11Å; E12-S23 WeakPolarHBondContact CB-OG 3.19Å; E12-S23 PolarHBondContact O-N 3.44Å; E12-S23 PolarHBondContact O-OG 3.28Å; E12-S23 PolarHBondContact OE2-OG 2.98Å
13	F	86.2	Confident	80.8	Confident	64 Å²	64	69.5 Å²	69.5	28%	0.281	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	145.6	175.7	-65.7	-95.1	0	0	0	110.4	C5 E11 Y21 C22	C5-F13 HydrophobicContact CB-CE1 4.36Å; C5-F13 HydrophobicContact CB-CZ 3.92Å; E11-F13 WeakPolarHBondContact O-CD2 3.44Å; F13-Y21 CarbonylContact C-O 3.59Å; F13-Y21 WeakPolarHBondContact CA-O 2.99Å; F13-C22 HydrophobicContact CD1-CB 4.08Å; F13-C22 HydrophobicContact CE1-CB 3.87Å
14	M	82.3	Confident	82	Confident	84 Å²	84	67.1 Å²	67.1	41%	0.414	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	135.9	173.7	59.4	-171.1	-57.9	0	0	109.5	I16 Y21	M14-I16 HydrophobicContact CE-CD1 3.77Å; M14-I16 HydrophobicContact CE-CG1 4.06Å; M14-I16 HydrophobicContact CG-CD1 4.34Å; M14-I16 HydrophobicContact CG-CG1 4.37Å; M14-I16 HydrophobicContact SD-CD1 4.29Å; M14-Y21 PolarHBondContact N-O 2.81Å; M14-Y21 PolarHBondContact O-N 2.84Å
15	C	77.9	Confident	82.2	Confident	72 Å²	72	66.4 Å²	66.4	49%	0.486	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	119.1	176	-173.9	0	0	0	0	108.9	F19 Y20	C15-F19 WeakPolarHBondContact CA-O 3.28Å; C15-Y20 HydrophobicContact CB-CD1 4.04Å; C15-Y20 HydrophobicContact CB-CE1 3.78Å
16	I	70.9	Confident	82.3	Confident	69 Å²	69	71 Å²	71	35%	0.354	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	121.4	174.1	-51.5	174.9	0	0	0	106.5	M14 G18 F19 Y21	M14-I16 HydrophobicContact CE-CD1 3.77Å; M14-I16 HydrophobicContact CE-CG1 4.06Å; M14-I16 HydrophobicContact CG-CD1 4.34Å; M14-I16 HydrophobicContact CG-CG1 4.37Å; M14-I16 HydrophobicContact SD-CD1 4.29Å; I16-G18 PolarHBondContact O-N 2.87Å; I16-G18 VanDerWaalsContact O-N 3.14Å; I16-F19 PolarHBondContact N-O 2.91Å; I16-F19 WeakPolarHBondContact O-CB 3.5Å; I16-F19 PolarHBondContact O-N 2.95Å; I16-F19 VanDerWaalsContact O-O 3.09Å; I16-Y21 HydrophobicContact CB-CD2 3.9Å; I16-Y21 HydrophobicContact CB-CE2 3.84Å; I16-Y21 HydrophobicContact CD1-CD2 4.06Å; I16-Y21 HydrophobicContact CG1-CD2 4.06Å; I16-Y21 HydrophobicContact CG1-CE2 4.49Å
17	D	68.7	Low	82.6	Confident	128 Å²	128	69 Å²	69	68%	0.684	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	37.8	179.4	-56.8	-32.4	0	0	0	113.7	F19 I95	D17-F19 HydrophobicContact CB-CD2 4.42Å; D17-F19 WeakPolarHBondContact O-CD2 3.28Å; D17-F19 PolarHBondContact O-N 3.29Å; D17-I95 WeakPolarHBondContact O-CD1 3.46Å
18	G	65.8	Low	82.4	Confident	18 Å²	18	68 Å²	68	19%	0.186	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	3.5	179.1	0	0	0	0	0	115.9	I16 K98	I16-G18 PolarHBondContact O-N 2.87Å; I16-G18 VanDerWaalsContact O-N 3.14Å; G18-K98 PolarHBondContact O-NZ 3.2Å
19	F	71.8	Confident	81.7	Confident	81 Å²	81	66.3 Å²	66.3	36%	0.355	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.5	172.9	-60.8	-71.7	0	0	0	109.2	C15 I16 D17 Y21 Q28 E33	C15-F19 WeakPolarHBondContact CA-O 3.28Å; I16-F19 PolarHBondContact N-O 2.91Å; I16-F19 WeakPolarHBondContact O-CB 3.5Å; I16-F19 PolarHBondContact O-N 2.95Å; I16-F19 VanDerWaalsContact O-O 3.09Å; D17-F19 HydrophobicContact CB-CD2 4.42Å; D17-F19 WeakPolarHBondContact O-CD2 3.28Å; D17-F19 PolarHBondContact O-N 3.29Å; F19-Y21 HydrophobicContact CB-CD2 4.34Å; F19-Y21 HydrophobicContact CB-CE2 3.46Å; F19-Y21 VanDerWaalsContact CB-CE2 3.46Å; F19-Y21 WeakPolarHBondContact O-CD2 3.4Å; F19-Y21 WeakPolarHBondContact O-CE2 3.33Å; F19-Q28 HydrophobicContact CB-CG 4.47Å; F19-E33 WeakPolarHBondContact CD1-OE1 3.38Å; F19-E33 WeakPolarHBondContact CE1-OE1 3.28Å
20	Y	81.3	Confident	80.7	Confident	61 Å²	61	68.6 Å²	68.6	24%	0.239	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	121.4	-179.8	-72.3	-93.3	0	0	0	109.5	C15 Q28 S29 H32 I36	C15-Y20 HydrophobicContact CB-CD1 4.04Å; C15-Y20 HydrophobicContact CB-CE1 3.78Å; Y20-Q28 CarbonylContact O-C 3.58Å; Y20-Q28 WeakPolarHBondContact O-CA 3.26Å; Y20-S29 PolarHBondContact O-N 2.77Å; Y20-H32 AromaticContact CD1-CD2 3.48Å; Y20-H32 VanDerWaalsContact CD1-CD2 3.48Å; Y20-H32 WeakPolarHBondContact CD1-CD2 3.41Å; Y20-H32 HydrophobicContact CD2-CB 3.87Å; Y20-H32 AromaticContact CD2-CD2 3.51Å; Y20-H32 AromaticContact CE1-CD2 3.56Å; Y20-H32 AromaticContact CE1-NE2 3.98Å; Y20-H32 AromaticContact CE2-CD2 3.59Å; Y20-H32 HydrophobicContact CG-CB 4Å; Y20-H32 AromaticContact CG-CD2 3.44Å; Y20-H32 VanDerWaalsContact CG-CD2 3.44Å; Y20-H32 AromaticContact CZ-CD2 3.61Å; Y20-I36 HydrophobicContact CE2-CD1 4.15Å
21	Y	85.6	Confident	79.3	Confident	59 Å²	59	71.9 Å²	71.9	23%	0.231	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	139.3	178	-61	-89	0	0	0	109	F13 M14 I16 F19 S23 Q28	F13-Y21 CarbonylContact C-O 3.59Å; F13-Y21 WeakPolarHBondContact CA-O 2.99Å; M14-Y21 PolarHBondContact N-O 2.81Å; M14-Y21 PolarHBondContact O-N 2.84Å; I16-Y21 HydrophobicContact CB-CD2 3.9Å; I16-Y21 HydrophobicContact CB-CE2 3.84Å; I16-Y21 HydrophobicContact CD1-CD2 4.06Å; I16-Y21 HydrophobicContact CG1-CD2 4.06Å; I16-Y21 HydrophobicContact CG1-CE2 4.49Å; F19-Y21 HydrophobicContact CB-CD2 4.34Å; F19-Y21 HydrophobicContact CB-CE2 3.46Å; F19-Y21 VanDerWaalsContact CB-CE2 3.46Å; F19-Y21 WeakPolarHBondContact O-CD2 3.4Å; F19-Y21 WeakPolarHBondContact O-CE2 3.33Å; Y21-S23 PolarHBondContact O-N 3.48Å; Y21-Q28 HydrophobicContact CD1-CB 3.97Å; Y21-Q28 HydrophobicContact CE1-CB 3.77Å; Y21-Q28 HydrophobicContact CE1-CG 4.17Å
22	C	88.4	Confident	77.7	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	128.9	171.7	176.4	0	0	0	0	109.7	C5 C8 F13 V24 N26 V27	C5-C22 HydrophobicContact CB-CB 3.96Å; C8-C22 PolarHBondContact SG-SG 3.17Å; F13-C22 HydrophobicContact CD1-CB 4.08Å; F13-C22 HydrophobicContact CE1-CB 3.87Å; C22-V24 PolarHBondContact O-N 3.17Å; C22-V24 VanDerWaalsContact O-N 3.12Å; C22-N26 VanDerWaalsContact O-CA 3.23Å; C22-N26 WeakPolarHBondContact O-CA 3.33Å; C22-N26 PolarHBondContact O-N 3.17Å; C22-N26 PolarHBondContact O-OD1 3.28Å; C22-V27 PolarHBondContact N-O 3.33Å
23	S	88.1	Confident	76.2	Confident	44 Å²	44	66 Å²	66	31%	0.308	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-24.3	-178.3	64.9	0	0	0	0	113.2	E12 Y21	E12-S23 WeakPolarHBondContact CB-OG 3.19Å; E12-S23 PolarHBondContact O-N 3.44Å; E12-S23 PolarHBondContact O-OG 3.28Å; E12-S23 PolarHBondContact OE2-OG 2.98Å; Y21-S23 PolarHBondContact O-N 3.48Å
24	V	88.7	Confident	74.5	Confident	97 Å²	97	68.1 Å²	68.1	59%	0.588	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-45.2	-174.8	178.6	0	0	0	0	111.8	C8 S10 C22	C8-V24 HydrophobicContact CB-CG1 4.47Å; S10-V24 WeakPolarHBondContact OG-CG2 3.43Å; C22-V24 PolarHBondContact O-N 3.17Å; C22-V24 VanDerWaalsContact O-N 3.12Å
25	C	90.3	Very high	73	Confident	41 Å²	41	68 Å²	68	28%	0.277	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-1.6	-173.8	73.7	0	0	0	0	114.5	C5 C8 V27	C5-C25 PolarHBondContact SG-SG 3.25Å; C8-C25 HydrophobicContact CB-CB 4.15Å; C25-V27 HydrophobicContact CB-CG2 4.4Å; C25-V27 PolarHBondContact O-N 3.39Å
26	N	84.1	Confident	71.8	Confident	105 Å²	105	65.9 Å²	65.9	56%	0.561	34%	0.344	S	S	*	.			trans	53.1	24	-177.5	-77.6	-13.8	0	0	0	115.1	C22	C22-N26 VanDerWaalsContact O-CA 3.23Å; C22-N26 WeakPolarHBondContact O-CA 3.33Å; C22-N26 PolarHBondContact O-N 3.17Å; C22-N26 PolarHBondContact O-OD1 3.28Å
27	V	84.6	Confident	70.9	Confident	64 Å²	64	69.2 Å²	69.2	39%	0.388	36%	0.358	S	S	.	.			trans	-84.8	130.2	174.4	177	0	0	0	0	108.8	V7 C22 C25	V7-V27 HydrophobicContact CB-CG2 4.47Å; V7-V27 HydrophobicContact CG1-CG2 4.49Å; V7-V27 HydrophobicContact CG2-CB 4.25Å; V7-V27 HydrophobicContact CG2-CG1 4.01Å; V7-V27 HydrophobicContact CG2-CG2 4.1Å; C22-V27 PolarHBondContact N-O 3.33Å; C25-V27 HydrophobicContact CB-CG2 4.4Å; C25-V27 PolarHBondContact O-N 3.39Å
28	Q	81.5	Confident	70	Confident	80 Å²	80	68.8 Å²	68.8	37%	0.374	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-65.1	129.4	178.2	-172.7	179.3	-8.6	0	0	110.7	F19 Y20 Y21 V30 E33	F19-Q28 HydrophobicContact CB-CG 4.47Å; Y20-Q28 CarbonylContact O-C 3.58Å; Y20-Q28 WeakPolarHBondContact O-CA 3.26Å; Y21-Q28 HydrophobicContact CD1-CB 3.97Å; Y21-Q28 HydrophobicContact CE1-CB 3.77Å; Y21-Q28 HydrophobicContact CE1-CG 4.17Å; Q28-V30 PolarHBondContact O-N 3.31Å; Q28-E33 PolarHBondContact NE2-OE1 3.48Å
29	S	74.5	Confident	69.3	Low	18 Å²	18	72 Å²	72	13%	0.126	36%	0.363	C	S	.	.			trans	-84.2	105.1	177.3	179.7	0	0	0	0	110.2	Y20 Q31 H32	Y20-S29 PolarHBondContact O-N 2.77Å; S29-Q31 PolarHBondContact O-N 3.03Å; S29-H32 PolarHBondContact OG-N 3.11Å
30	V	65.1	Low	67.9	Low	93 Å²	93	71.7 Å²	71.7	56%	0.564	36%	0.363	S	S	*	.	H	α-helix	trans	-65.5	-30.8	171.3	-175	0	0	0	0	111.1	Q28 H32 E33 Q34	Q28-V30 PolarHBondContact O-N 3.31Å; V30-H32 PolarHBondContact O-N 3.46Å; V30-E33 PolarHBondContact O-N 2.91Å; V30-Q34 PolarHBondContact O-N 3.29Å
31	Q	57.5	Low	66.5	Low	88 Å²	88	76.3 Å²	76.3	41%	0.411	39%	0.387	S	S	.	.	H	α-helix	trans	-68.6	-33.5	-176.1	-69.5	-174.5	-8.5	0	0	112.8	S29 E33 Q34 E35	S29-Q31 PolarHBondContact O-N 3.03Å; Q31-E33 VanDerWaalsContact C-N 3.3Å; Q31-E33 PolarHBondContact O-N 3.25Å; Q31-Q34 PolarHBondContact O-N 3.01Å; Q31-E35 PolarHBondContact O-N 2.63Å
32	H	54.7	Low	64.7	Low	65 Å²	65	77.4 Å²	77.4	30%	0.301	40%	0.397	S	S	.	.	H	α-helix	trans	-74.5	-19.6	178.2	-120.9	53	0	0	0	113.1	Y20 S29 V30 E35	Y20-H32 AromaticContact CD1-CD2 3.48Å; Y20-H32 VanDerWaalsContact CD1-CD2 3.48Å; Y20-H32 WeakPolarHBondContact CD1-CD2 3.41Å; Y20-H32 HydrophobicContact CD2-CB 3.87Å; Y20-H32 AromaticContact CD2-CD2 3.51Å; Y20-H32 AromaticContact CE1-CD2 3.56Å; Y20-H32 AromaticContact CE1-NE2 3.98Å; Y20-H32 AromaticContact CE2-CD2 3.59Å; Y20-H32 HydrophobicContact CG-CB 4Å; Y20-H32 AromaticContact CG-CD2 3.44Å; Y20-H32 VanDerWaalsContact CG-CD2 3.44Å; Y20-H32 AromaticContact CZ-CD2 3.61Å; S29-H32 PolarHBondContact OG-N 3.11Å; V30-H32 PolarHBondContact O-N 3.46Å; H32-E35 IonicContact CE1-OE2 2.74Å; H32-E35 IonicContact ND1-OE2 2.75Å
33	E	52.7	Low	63	Low	55 Å²	55	79.5 Å²	79.5	26%	0.257	41%	0.408	S	S	.	.	H	α-helix	trans	-72.6	-45	171	-77.3	173.9	-168.6	0	0	111.6	F19 Q28 V30 Q31 E35 I36 E37	F19-E33 WeakPolarHBondContact CD1-OE1 3.38Å; F19-E33 WeakPolarHBondContact CE1-OE1 3.28Å; Q28-E33 PolarHBondContact NE2-OE1 3.48Å; V30-E33 PolarHBondContact O-N 2.91Å; Q31-E33 VanDerWaalsContact C-N 3.3Å; Q31-E33 PolarHBondContact O-N 3.25Å; E33-E35 PolarHBondContact O-N 3.34Å; E33-I36 PolarHBondContact O-N 2.87Å; E33-E37 PolarHBondContact O-N 3.44Å
34	Q	49.8	Very low	61.2	Low	109 Å²	109	82.2 Å²	82.2	51%	0.509	42%	0.419	S	S	.	.	H	α-helix	trans	-63.5	-37.7	-179.2	-71.7	-179.4	-23.9	0	0	112.7	V30 Q31 I36 E37 E38	V30-Q34 PolarHBondContact O-N 3.29Å; Q31-Q34 PolarHBondContact O-N 3.01Å; Q34-I36 VanDerWaalsContact C-N 3.31Å; Q34-I36 PolarHBondContact O-N 2.75Å; Q34-E37 PolarHBondContact O-N 3.45Å; Q34-E38 PolarHBondContact O-N 3.48Å
35	E	51.9	Low	59.2	Low	80 Å²	80	83.9 Å²	83.9	37%	0.374	42%	0.424	S	S	.	.	H	α-helix	trans	-62.1	-36.4	177.5	-78.8	176.6	174.1	0	0	112.4	Q31 H32 E33 E37 E38 E39	Q31-E35 PolarHBondContact O-N 2.63Å; H32-E35 IonicContact CE1-OE2 2.74Å; H32-E35 IonicContact ND1-OE2 2.75Å; E33-E35 PolarHBondContact O-N 3.34Å; E35-E37 VanDerWaalsContact C-N 3.34Å; E35-E37 PolarHBondContact O-N 2.93Å; E35-E38 PolarHBondContact O-N 2.82Å; E35-E39 VanDerWaalsContact O-CB 3.23Å; E35-E39 WeakPolarHBondContact O-CB 3.36Å; E35-E39 VanDerWaalsContact O-CG 3.26Å; E35-E39 WeakPolarHBondContact O-CG 3.22Å; E35-E39 PolarHBondContact O-N 3.11Å
36	I	52.4	Low	57.1	Low	28 Å²	28	83 Å²	83	14%	0.144	42%	0.419	C	S	.	.	H	α-helix	trans	-71.8	-31.7	179.8	-64.2	170.1	0	0	0	111.3	Y20 E33 Q34 M40 K98	Y20-I36 HydrophobicContact CE2-CD1 4.15Å; E33-I36 PolarHBondContact O-N 2.87Å; Q34-I36 VanDerWaalsContact C-N 3.31Å; Q34-I36 PolarHBondContact O-N 2.75Å; I36-M40 PolarHBondContact O-N 2.99Å; I36-K98 HydrophobicContact CG2-CG 4.06Å
37	E	52.3	Low	55.2	Low	139 Å²	139	79.6 Å²	79.6	65%	0.65	40%	0.401	S	S	*	.	H	α-helix	trans	-72.7	-45.3	173.7	-69.1	-175.1	166.3	0	0	111.6	E33 Q34 E35 E39 M40 E41	E33-E37 PolarHBondContact O-N 3.44Å; Q34-E37 PolarHBondContact O-N 3.45Å; E35-E37 VanDerWaalsContact C-N 3.34Å; E35-E37 PolarHBondContact O-N 2.93Å; E37-E39 PolarHBondContact O-N 2.91Å; E37-M40 WeakPolarHBondContact O-CB 3.28Å; E37-M40 PolarHBondContact O-N 2.81Å; E37-E41 PolarHBondContact O-N 2.88Å
38	E	49.7	Very low	53.2	Low	120 Å²	120	79.2 Å²	79.2	56%	0.561	40%	0.398	S	S	*	.	H	α-helix	trans	-65	-37.9	175.4	-73.4	-175.7	-179.6	0	0	111.9	Q34 E35 M40 E41 N42	Q34-E38 PolarHBondContact O-N 3.48Å; E35-E38 PolarHBondContact O-N 2.82Å; E38-M40 PolarHBondContact O-N 3Å; E38-E41 PolarHBondContact O-N 3.26Å; E38-N42 WeakPolarHBondContact O-CB 3.47Å; E38-N42 VanDerWaalsContact O-CG 3.23Å; E38-N42 PolarHBondContact O-N 3.14Å; E38-N42 PolarHBondContact O-ND2 3.28Å
39	E	50.2	Low	51.3	Low	85 Å²	85	78.3 Å²	78.3	40%	0.397	40%	0.401	S	S	.	.	H	α-helix	trans	-61.6	-28.7	174.8	-83.4	-168.2	166.4	0	0	112.5	E35 E37 N42 L43	E35-E39 VanDerWaalsContact O-CB 3.23Å; E35-E39 WeakPolarHBondContact O-CB 3.36Å; E35-E39 VanDerWaalsContact O-CG 3.26Å; E35-E39 WeakPolarHBondContact O-CG 3.22Å; E35-E39 PolarHBondContact O-N 3.11Å; E37-E39 PolarHBondContact O-N 2.91Å; E39-N42 CarbonylContact O-C 3.47Å; E39-L43 WeakPolarHBondContact O-CA 3.27Å; E39-L43 VanDerWaalsContact O-CB 3.31Å; E39-L43 WeakPolarHBondContact O-CB 3.22Å; E39-L43 PolarHBondContact O-N 3.47Å
40	M	42.5	Very low	49.8	Very low	75 Å²	75	85.3 Å²	85.3	37%	0.369	43%	0.432	S	S	.	.	H	α-helix	trans	-72.4	-49.8	175.6	-86.4	-178	59.9	0	0	113.3	I36 E37 E38 N42 L43 K101	I36-M40 PolarHBondContact O-N 2.99Å; E37-M40 WeakPolarHBondContact O-CB 3.28Å; E37-M40 PolarHBondContact O-N 2.81Å; E38-M40 PolarHBondContact O-N 3Å; M40-N42 PolarHBondContact O-N 3.15Å; M40-L43 WeakPolarHBondContact O-CB 3.3Å; M40-L43 PolarHBondContact O-N 2.91Å; M40-K101 HydrophobicContact CE-CD 4.17Å; M40-K101 VanDerWaalsContact CE-CE 3.44Å; M40-K101 HydrophobicContact CG-CD 3.99Å; M40-K101 HydrophobicContact SD-CD 3.43Å; M40-K101 WeakPolarHBondContact SD-CD 3.31Å; M40-K101 WeakPolarHBondContact SD-CE 3.42Å; M40-K101 PolarHBondContact SD-NZ 3.33Å
41	E	51.8	Low	48.6	Very low	157 Å²	157	85.8 Å²	85.8	73%	0.734	43%	0.43	S	S	*	.	H	α-helix	trans	-62.2	-34.1	177.2	-69	-170	167.8	0	0	109.9	E37 E38	E37-E41 PolarHBondContact O-N 2.88Å; E38-E41 PolarHBondContact O-N 3.26Å
42	N	48.7	Very low	47.7	Very low	83 Å²	83	90.1 Å²	90.1	44%	0.444	44%	0.442	S	S	.	.	H	α-helix	trans	-77.8	-19	172.6	-69.2	-39.7	0	0	0	113.4	E38 E39 M40 D44 L45 A46	E38-N42 WeakPolarHBondContact O-CB 3.47Å; E38-N42 VanDerWaalsContact O-CG 3.23Å; E38-N42 PolarHBondContact O-N 3.14Å; E38-N42 PolarHBondContact O-ND2 3.28Å; E39-N42 CarbonylContact O-C 3.47Å; M40-N42 PolarHBondContact O-N 3.15Å; N42-D44 VanDerWaalsContact C-N 3.27Å; N42-D44 PolarHBondContact O-N 3.46Å; N42-L45 PolarHBondContact O-N 3.46Å; N42-A46 HydrophobicContact CB-CB 3.81Å; N42-A46 WeakPolarHBondContact O-CA 3.35Å; N42-A46 WeakPolarHBondContact O-CB 3.42Å; N42-A46 PolarHBondContact O-N 3.19Å
43	L	51.7	Low	46.7	Very low	44 Å²	44	89.9 Å²	89.9	23%	0.23	46%	0.458	C	S	.	.	H	α-helix	trans	-66.9	-33.5	179	-143.7	86.5	0	0	0	111.6	E39 M40 L45 I105	E39-L43 WeakPolarHBondContact O-CA 3.27Å; E39-L43 VanDerWaalsContact O-CB 3.31Å; E39-L43 WeakPolarHBondContact O-CB 3.22Å; E39-L43 PolarHBondContact O-N 3.47Å; M40-L43 WeakPolarHBondContact O-CB 3.3Å; M40-L43 PolarHBondContact O-N 2.91Å; L43-L45 VanDerWaalsContact C-N 3.27Å; L43-L45 PolarHBondContact O-N 3.25Å; L43-I105 HydrophobicContact CD1-CD1 3.7Å; L43-I105 HydrophobicContact CD1-CG1 3.68Å; L43-I105 HydrophobicContact CD1-CG2 4.19Å; L43-I105 HydrophobicContact CD2-CD1 4.1Å; L43-I105 HydrophobicContact CD2-CG1 3.61Å; L43-I105 HydrophobicContact CG-CG1 4.3Å
44	D	51.2	Low	45.7	Very low	101 Å²	101	92.5 Å²	92.5	54%	0.54	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-18.9	177	-96	-16.2	0	0	0	113.2	N42	N42-D44 VanDerWaalsContact C-N 3.27Å; N42-D44 PolarHBondContact O-N 3.46Å
45	L	47.2	Very low	44.9	Very low	132 Å²	132	96.9 Å²	96.9	69%	0.691	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.3	-37.1	-171	-73.8	165.5	0	0	0	115.5	N42 L43	N42-L45 PolarHBondContact O-N 3.46Å; L43-L45 VanDerWaalsContact C-N 3.27Å; L43-L45 PolarHBondContact O-N 3.25Å
46	A	44.5	Very low	44	Very low	22 Å²	22	99.1 Å²	99.1	18%	0.182	52%	0.524	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-29.1	-168.4	0	0	0	0	0	114.8	N42 V48 S49 E50	N42-A46 HydrophobicContact CB-CB 3.81Å; N42-A46 WeakPolarHBondContact O-CA 3.35Å; N42-A46 WeakPolarHBondContact O-CB 3.42Å; N42-A46 PolarHBondContact O-N 3.19Å; A46-V48 PolarHBondContact O-N 3.49Å; A46-S49 VanDerWaalsContact CA-OG 3.32Å; A46-S49 WeakPolarHBondContact CA-OG 3.5Å; A46-S49 CarbonylContact O-C 3.52Å; A46-S49 PolarHBondContact O-N 3.23Å; A46-S49 PolarHBondContact O-OG 2.83Å; A46-E50 PolarHBondContact O-N 3.47Å
47	M	44.1	Very low	43.1	Very low	34 Å²	34	107.1 Å²	107.1	17%	0.167	56%	0.557	C	S	.	*	H	α-helix	trans	-65.9	-23.4	176.3	-142.8	-175.9	80.2	0	0	111.9	L73 V108 I112	M47-L73 HydrophobicContact CE-CD2 4.45Å; M47-V108 HydrophobicContact CE-CG1 3.84Å; M47-V108 HydrophobicContact SD-CG1 4.46Å; M47-I112 HydrophobicContact CE-CD1 3.17Å; M47-I112 HydrophobicContact SD-CD1 4.48Å
48	V	42.9	Very low	42.5	Very low	55 Å²	55	106.6 Å²	106.6	33%	0.333	57%	0.566	S	S	.	*	H	α-helix	trans	-76	-26.7	171.4	-177.9	0	0	0	0	111.7	A46 E70	A46-V48 PolarHBondContact O-N 3.49Å; V48-E70 WeakPolarHBondContact CG1-OE1 3.46Å; V48-E70 HydrophobicContact CG2-CG 4.32Å; V48-E70 WeakPolarHBondContact CG2-OE1 3.35Å
49	S	42.9	Very low	41.6	Very low	62 Å²	62	108.9 Å²	108.9	43%	0.434	58%	0.577	S	S	.	*	H	α-helix	trans	-95.7	-33.8	-177.6	64.6	0	0	0	0	113.9	A46 I51 R52	A46-S49 VanDerWaalsContact CA-OG 3.32Å; A46-S49 WeakPolarHBondContact CA-OG 3.5Å; A46-S49 CarbonylContact O-C 3.52Å; A46-S49 PolarHBondContact O-N 3.23Å; A46-S49 PolarHBondContact O-OG 2.83Å; S49-I51 VanDerWaalsContact C-N 3.31Å; S49-I51 PolarHBondContact O-N 2.9Å; S49-R52 VanDerWaalsContact O-CB 3.26Å; S49-R52 WeakPolarHBondContact O-CB 3.27Å; S49-R52 PolarHBondContact O-N 3.11Å
50	E	42	Very low	40.8	Very low	165 Å²	165	113.4 Å²	113.4	77%	0.771	60%	0.595	S	S	*	*	H	α-helix	trans	-71.8	-22.8	178.8	-78.9	-168.1	147.7	0	0	113.5	A46 R52	A46-E50 PolarHBondContact O-N 3.47Å; E50-R52 PolarHBondContact O-N 3.11Å
51	I	40.8	Very low	40.5	Very low	103 Å²	103	119.5 Å²	119.5	53%	0.528	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.2	-11.5	170.7	-58.3	173.8	0	0	0	111.4	S49 G53 I112	S49-I51 VanDerWaalsContact C-N 3.31Å; S49-I51 PolarHBondContact O-N 2.9Å; I51-G53 PolarHBondContact O-N 3.44Å; I51-I112 HydrophobicContact CD1-CG2 4.3Å
52	R	37.3	Very low	39.7	Very low	178 Å²	178	117.1 Å²	117.1	67%	0.672	62%	0.619	S	S	*	*	S	Bend	trans	-74.1	73.7	161.5	-62.9	-177.9	179.2	-175	-0.8	108.1	S49 E50 S54	S49-R52 VanDerWaalsContact O-CB 3.26Å; S49-R52 WeakPolarHBondContact O-CB 3.27Å; S49-R52 PolarHBondContact O-N 3.11Å; E50-R52 PolarHBondContact O-N 3.11Å; R52-S54 PolarHBondContact O-N 3.21Å
53	G	34.2	Very low	39	Very low	61 Å²	61	121.4 Å²	121.4	63%	0.629	64%	0.641	S	S	*	*			trans	-37.3	116.3	172.3	0	0	0	0	0	110.1	I51	I51-G53 PolarHBondContact O-N 3.44Å
54	S	32.7	Very low	38.4	Very low	109 Å²	109	126 Å²	126	76%	0.762	66%	0.661	S	S	*	*	S	Bend	trans	-19.3	134.8	164.2	43.2	0	0	0	0	115	R52	R52-S54 PolarHBondContact O-N 3.21Å
55	K	31.6	Very low	38	Very low	202 Å²	202	126.5 Å²	126.5	88%	0.878	67%	0.67	S	S	*	*			trans	98	80.9	170.6	-56.1	175.2	-179.8	176.7	0	116.4
56	S	33.3	Very low	38.1	Very low	126 Å²	126	126.7 Å²	126.7	88%	0.881	67%	0.667	S	S	*	*				-174.2	147.2	123.4	49.4	0	0	0	0	111.8
57	K	32.8	Very low	38.7	Very low	196 Å²	196	129.8 Å²	129.8	85%	0.852	68%	0.68	S	S	*	*			trans	-43.3	155	-173.3	-79.5	168.2	169.6	175.6	0	116.6	E59	K57-E59 PolarHBondContact O-N 2.85Å
58	P	40.2	Very low	39.7	Very low	129 Å²	129	133.4 Å²	133.4	84%	0.838	71%	0.706	S	S	*	*			trans	-79.5	106.4	-178.4	33.3	-29.8	0	0	0	109.4
59	E	31.2	Very low	41.1	Very low	168 Å²	168	133.2 Å²	133.2	79%	0.785	70%	0.7	S	S	*	*			trans	-139	112.4	163.2	-122.5	178.8	163.1	0	0	110.9	K57	K57-E59 PolarHBondContact O-N 2.85Å
60	K	34.2	Very low	42.6	Very low	179 Å²	179	131.2 Å²	131.2	78%	0.778	68%	0.684	S	S	*	*			trans	60.6	113.6	161.1	-70.1	172.6	179.6	168.7	0	117	V62	K60-V62 VanDerWaalsContact C-N 3.31Å; K60-V62 PolarHBondContact O-N 3.34Å
61	Q	35.1	Very low	44.2	Very low	203 Å²	203	129.7 Å²	129.7	95%	0.949	67%	0.674	S	S	*	*			trans	-45.2	86.2	166.3	-70.4	166.4	-9.7	0	0	111.8
62	V	34.3	Very low	46	Very low	108 Å²	108	128.1 Å²	128.1	66%	0.655	67%	0.667	S	S	*	*			trans	-90.8	109.7	154.7	-178.1	0	0	0	0	105	K60 H64	K60-V62 VanDerWaalsContact C-N 3.31Å; K60-V62 PolarHBondContact O-N 3.34Å; V62-H64 PolarHBondContact O-N 3.49Å
63	L	35.7	Very low	48.2	Very low	173 Å²	173	120.9 Å²	120.9	91%	0.906	64%	0.641	S	S	*	*			trans	-55	86.9	174.2	-160.5	85.8	0	0	0	108.1
64	H	38.2	Very low	50.5	Low	139 Å²	139	123.7 Å²	123.7	64%	0.644	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-65.1	137.8	-177.9	-97.8	-81.1	0	0	0	109.3	V62 Q66	V62-H64 PolarHBondContact O-N 3.49Å; H64-Q66 PolarHBondContact O-N 3.4Å
65	P	42.4	Very low	53	Low	112 Å²	112	119.2 Å²	119.2	73%	0.727	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-63.2	127.8	-175	-14.8	28.3	0	0	0	109.7	L67	P65-L67 PolarHBondContact O-N 3.06Å
66	Q	50.1	Low	55.6	Low	136 Å²	136	112 Å²	112	64%	0.636	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-47.3	124.6	170.8	-71.1	176	-13	0	0	108.8	H64	H64-Q66 PolarHBondContact O-N 3.4Å
67	L	57.4	Low	58.3	Low	87 Å²	87	107.3 Å²	107.3	46%	0.455	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-58.6	136.5	175.7	-77.8	150.6	0	0	0	108	P65 Y69 E70	P65-L67 PolarHBondContact O-N 3.06Å; L67-Y69 HydrophobicContact CB-CD1 3.76Å; L67-Y69 HydrophobicContact CB-CE1 3.49Å; L67-Y69 VanDerWaalsContact CB-CE1 3.49Å; L67-Y69 HydrophobicContact CD1-CE1 3.72Å; L67-Y69 HydrophobicContact CD2-CE1 4.18Å; L67-Y69 HydrophobicContact CG-CE1 3.98Å; L67-Y69 PolarHBondContact O-N 3.02Å; L67-E70 HydrophobicContact CB-CG 4.19Å; L67-E70 WeakPolarHBondContact O-CB 3.46Å; L67-E70 PolarHBondContact O-N 3.32Å
68	P	63.3	Low	61.1	Low	110 Å²	110	99.2 Å²	99.2	71%	0.714	50%	0.504	S	S	*	.	H	α-helix	trans	-51.7	-33.4	-174.9	-29.4	34.5	0	0	0	114.1	E70	P68-E70 PolarHBondContact O-N 3.34Å
69	Y	72.5	Confident	63.5	Low	52 Å²	52	93.2 Å²	93.2	20%	0.204	47%	0.465	C	S	.	.	H	α-helix	trans	-73.8	-20.7	-179.6	75.1	-99	0	0	0	114.1	L67 K71 D72 L73	L67-Y69 HydrophobicContact CB-CD1 3.76Å; L67-Y69 HydrophobicContact CB-CE1 3.49Å; L67-Y69 VanDerWaalsContact CB-CE1 3.49Å; L67-Y69 HydrophobicContact CD1-CE1 3.72Å; L67-Y69 HydrophobicContact CD2-CE1 4.18Å; L67-Y69 HydrophobicContact CG-CE1 3.98Å; L67-Y69 PolarHBondContact O-N 3.02Å; Y69-K71 VanDerWaalsContact C-N 3.29Å; Y69-K71 PolarHBondContact O-N 3.19Å; Y69-D72 PolarHBondContact O-N 2.94Å; Y69-L73 WeakPolarHBondContact O-CB 3.41Å; Y69-L73 PolarHBondContact O-N 2.9Å
70	E	75.2	Confident	66.4	Low	20 Å²	20	85.4 Å²	85.4	9%	0.093	43%	0.428	C	S	.	.	H	α-helix	trans	-63.5	-39.2	-178.9	-75.3	177.4	-171.2	0	0	111.3	V48 L67 P68 L73 R74	V48-E70 WeakPolarHBondContact CG1-OE1 3.46Å; V48-E70 HydrophobicContact CG2-CG 4.32Å; V48-E70 WeakPolarHBondContact CG2-OE1 3.35Å; L67-E70 HydrophobicContact CB-CG 4.19Å; L67-E70 WeakPolarHBondContact O-CB 3.46Å; L67-E70 PolarHBondContact O-N 3.32Å; P68-E70 PolarHBondContact O-N 3.34Å; E70-L73 PolarHBondContact O-N 3.18Å; E70-R74 WeakPolarHBondContact O-CG 3.42Å; E70-R74 PolarHBondContact O-N 3.29Å; E70-R74 VanDerWaalsContact O-N 3.08Å
71	K	75	Confident	69.3	Low	132 Å²	132	79.1 Å²	79.1	57%	0.574	40%	0.403	S	S	*	.	H	α-helix	trans	-64.3	-45.4	176	-175.3	-179.1	176.4	-175.3	0	110.9	Y69 L73 R74 N75	Y69-K71 VanDerWaalsContact C-N 3.29Å; Y69-K71 PolarHBondContact O-N 3.19Å; K71-L73 VanDerWaalsContact C-N 3.34Å; K71-L73 PolarHBondContact O-N 2.73Å; K71-R74 PolarHBondContact O-N 3.32Å; K71-N75 WeakPolarHBondContact O-CB 3.03Å; K71-N75 PolarHBondContact O-N 3.33Å; K71-N75 PolarHBondContact O-ND2 3.16Å
72	D	79.1	Confident	72.1	Confident	70 Å²	70	70.5 Å²	70.5	37%	0.374	37%	0.366	S	S	.	.	H	α-helix	trans	-63	-42.9	178	-68.3	-21.3	0	0	0	110.8	Y69 R74 N75 Y76 F165	Y69-D72 PolarHBondContact O-N 2.94Å; D72-R74 PolarHBondContact O-N 3.12Å; D72-N75 WeakPolarHBondContact O-CB 3.36Å; D72-N75 PolarHBondContact O-N 2.61Å; D72-Y76 HydrophobicContact CB-CD2 4.4Å; D72-Y76 WeakPolarHBondContact O-CD2 3Å; D72-Y76 PolarHBondContact O-N 2.89Å; D72-F165 HydrophobicContact CB-CD1 4.5Å; D72-F165 HydrophobicContact CB-CD2 4.5Å; D72-F165 HydrophobicContact CB-CG 4.28Å
73	L	82.6	Confident	75	Confident	26 Å²	26	65.4 Å²	65.4	14%	0.136	33%	0.334	C	S	.	.	H	α-helix	trans	-58.1	-47	177	-179.5	62.9	0	0	0	112.1	M47 Y69 E70 K71 N75 Y76 T77 W104 V108 F165	M47-L73 HydrophobicContact CE-CD2 4.45Å; Y69-L73 WeakPolarHBondContact O-CB 3.41Å; Y69-L73 PolarHBondContact O-N 2.9Å; E70-L73 PolarHBondContact O-N 3.18Å; K71-L73 VanDerWaalsContact C-N 3.34Å; K71-L73 PolarHBondContact O-N 2.73Å; L73-N75 VanDerWaalsContact C-N 3.34Å; L73-N75 PolarHBondContact O-N 2.78Å; L73-Y76 PolarHBondContact O-N 3.06Å; L73-T77 VanDerWaalsContact O-CB 3.29Å; L73-T77 WeakPolarHBondContact O-CB 3.41Å; L73-T77 PolarHBondContact O-N 2.9Å; L73-T77 PolarHBondContact O-OG1 3.49Å; L73-W104 HydrophobicContact CD1-CZ2 4.1Å; L73-V108 HydrophobicContact CD1-CB 4.35Å; L73-V108 HydrophobicContact CD1-CG1 3.9Å; L73-V108 HydrophobicContact CD1-CG2 3.51Å; L73-V108 HydrophobicContact CD2-CG1 4.14Å; L73-F165 HydrophobicContact CB-CE1 4.1Å; L73-F165 HydrophobicContact CB-CZ 4.21Å; L73-F165 HydrophobicContact CD1-CE1 3.85Å; L73-F165 HydrophobicContact CD1-CZ 4.21Å
74	R	84.3	Confident	77.9	Confident	121 Å²	121	57.2 Å²	57.2	46%	0.457	29%	0.292	S	S	.	.	H	α-helix	trans	-60.5	-44.9	176	-70.8	-177.8	-161.2	-159.3	1.1	111.6	E70 K71 D72 T77 A78	E70-R74 WeakPolarHBondContact O-CG 3.42Å; E70-R74 PolarHBondContact O-N 3.29Å; E70-R74 VanDerWaalsContact O-N 3.08Å; K71-R74 PolarHBondContact O-N 3.32Å; D72-R74 PolarHBondContact O-N 3.12Å; R74-T77 PolarHBondContact O-N 2.78Å; R74-A78 WeakPolarHBondContact O-CB 3.32Å; R74-A78 PolarHBondContact O-N 3.47Å
75	N	84.4	Confident	80.6	Confident	15 Å²	15	54 Å²	54	8%	0.08	28%	0.279	C	S	.	.	H	α-helix	trans	-61.8	-46.7	-179.9	-73.7	-15	0	0	0	112.4	K71 D72 L73 A78 I79 S213 A214	K71-N75 WeakPolarHBondContact O-CB 3.03Å; K71-N75 PolarHBondContact O-N 3.33Å; K71-N75 PolarHBondContact O-ND2 3.16Å; D72-N75 WeakPolarHBondContact O-CB 3.36Å; D72-N75 PolarHBondContact O-N 2.61Å; L73-N75 VanDerWaalsContact C-N 3.34Å; L73-N75 PolarHBondContact O-N 2.78Å; N75-A78 PolarHBondContact O-N 3.34Å; N75-I79 WeakPolarHBondContact O-CG1 3.37Å; N75-I79 PolarHBondContact O-N 3.42Å; N75-S213 VanDerWaalsContact CG-O 3.3Å; N75-S213 PolarHBondContact ND2-O 3.28Å; N75-S213 VanDerWaalsContact OD1-C 3.26Å; N75-S213 WeakPolarHBondContact OD1-CB 3.41Å; N75-S213 PolarHBondContact OD1-O 3Å; N75-A214 HydrophobicContact CB-CB 3.88Å
76	Y	86.4	Confident	83	Confident	50 Å²	50	49.2 Å²	49.2	20%	0.196	25%	0.249	C	C	.	.	H	α-helix	trans	-71.9	-31	178.6	-77.9	-71.2	0	0	0	112.9	D72 L73 I79 L80 F165 R166 T170	D72-Y76 HydrophobicContact CB-CD2 4.4Å; D72-Y76 WeakPolarHBondContact O-CD2 3Å; D72-Y76 PolarHBondContact O-N 2.89Å; L73-Y76 PolarHBondContact O-N 3.06Å; Y76-I79 HydrophobicContact CD1-CD1 4Å; Y76-I79 HydrophobicContact CE1-CD1 4.14Å; Y76-I79 PolarHBondContact O-N 3.06Å; Y76-L80 WeakPolarHBondContact O-CB 3.16Å; Y76-L80 PolarHBondContact O-N 3.21Å; Y76-F165 HydrophobicContact CD2-CB 3.64Å; Y76-F165 AromaticContact CD2-CD1 3.58Å; Y76-F165 HydrophobicContact CD2-CD1 3.58Å; Y76-F165 HydrophobicContact CD2-CG 4Å; Y76-F165 HydrophobicContact CE2-CB 3.45Å; Y76-F165 VanDerWaalsContact CE2-CB 3.45Å; Y76-F165 HydrophobicContact CE2-CD1 4.3Å; Y76-F165 HydrophobicContact CE2-CG 4.28Å; Y76-F165 WeakPolarHBondContact CE2-O 3.4Å; Y76-F165 HydrophobicContact CG-CD1 4.14Å; Y76-F165 PolarHBondContact OH-O 3.32Å; Y76-R166 VanDerWaalsContact CE1-C 3.41Å; Y76-T170 HydrophobicContact CD1-CG2 4.02Å
77	T	90.8	Very high	84.9	Confident	28 Å²	28	42.8 Å²	42.8	17%	0.172	22%	0.219	C	C	.	.	H	α-helix	trans	-65.3	-40.6	171.5	-55.7	0	0	0	0	110.9	L73 R74 L80 N81 W104	L73-T77 VanDerWaalsContact O-CB 3.29Å; L73-T77 WeakPolarHBondContact O-CB 3.41Å; L73-T77 PolarHBondContact O-N 2.9Å; L73-T77 PolarHBondContact O-OG1 3.49Å; R74-T77 PolarHBondContact O-N 2.78Å; T77-L80 PolarHBondContact O-N 2.83Å; T77-N81 PolarHBondContact O-N 2.86Å; T77-N81 PolarHBondContact O-ND2 2.83Å; T77-W104 PolarHBondContact OG1-NE1 3.16Å
78	A	89.8	Confident	86.5	Confident	26 Å²	26	40.9 Å²	40.9	22%	0.215	21%	0.209	C	C	.	.	H	α-helix	trans	-63.4	-43.9	173.5	0	0	0	0	0	112.2	R74 N75 L80 N81 C82 V210	R74-A78 WeakPolarHBondContact O-CB 3.32Å; R74-A78 PolarHBondContact O-N 3.47Å; N75-A78 PolarHBondContact O-N 3.34Å; A78-L80 PolarHBondContact O-N 3.14Å; A78-N81 PolarHBondContact O-N 2.96Å; A78-C82 PolarHBondContact O-N 3.25Å; A78-C82 PolarHBondContact O-SG 3.11Å; A78-V210 HydrophobicContact CB-CG1 4.14Å; A78-V210 HydrophobicContact CB-CG2 4.19Å
79	I	90.4	Very high	87.7	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-57.5	-48.5	173.4	-73.2	168.6	0	0	0	111	N75 Y76 N81 C82 Q83 T170 F206 V210 A214 F215	N75-I79 WeakPolarHBondContact O-CG1 3.37Å; N75-I79 PolarHBondContact O-N 3.42Å; Y76-I79 HydrophobicContact CD1-CD1 4Å; Y76-I79 HydrophobicContact CE1-CD1 4.14Å; Y76-I79 PolarHBondContact O-N 3.06Å; I79-N81 VanDerWaalsContact C-N 3.33Å; I79-N81 PolarHBondContact O-N 2.8Å; I79-C82 PolarHBondContact O-N 2.84Å; I79-Q83 WeakPolarHBondContact O-CG 3.06Å; I79-Q83 PolarHBondContact O-N 3.4Å; I79-T170 HydrophobicContact CG2-CG2 4.19Å; I79-T170 WeakPolarHBondContact CG2-OG1 3.31Å; I79-F206 HydrophobicContact CB-CE1 4.17Å; I79-F206 HydrophobicContact CB-CZ 4.38Å; I79-F206 HydrophobicContact CG1-CE1 4.05Å; I79-F206 HydrophobicContact CG1-CZ 4.14Å; I79-F206 HydrophobicContact CG2-CE1 3.84Å; I79-F206 HydrophobicContact CG2-CZ 3.71Å; I79-V210 HydrophobicContact CG1-CG1 4.08Å; I79-A214 HydrophobicContact CD1-CB 3.82Å; I79-A214 HydrophobicContact CG1-CB 4.19Å; I79-F215 HydrophobicContact CD1-CE2 4.35Å; I79-F215 HydrophobicContact CD1-CZ 4.14Å
80	L	93.7	Very high	88.3	Confident	4 Å²	4	40 Å²	40	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-43.4	179.7	-178.9	65.9	0	0	0	111.2	Y76 T77 A78 C82 Q83 T84 W104 T170 V173	Y76-L80 WeakPolarHBondContact O-CB 3.16Å; Y76-L80 PolarHBondContact O-N 3.21Å; T77-L80 PolarHBondContact O-N 2.83Å; A78-L80 PolarHBondContact O-N 3.14Å; L80-C82 PolarHBondContact O-N 2.88Å; L80-Q83 PolarHBondContact O-N 2.96Å; L80-T84 HydrophobicContact CD1-CG2 4.43Å; L80-T84 WeakPolarHBondContact O-CG2 3.45Å; L80-T84 PolarHBondContact O-N 3.21Å; L80-T84 PolarHBondContact O-OG1 3.41Å; L80-W104 HydrophobicContact CD2-CB 3.57Å; L80-W104 HydrophobicContact CD2-CD2 3.97Å; L80-W104 HydrophobicContact CD2-CE3 4.37Å; L80-W104 HydrophobicContact CD2-CG 3.62Å; L80-T170 HydrophobicContact CB-CG2 4.21Å; L80-V173 HydrophobicContact CD1-CB 4.14Å; L80-V173 HydrophobicContact CD1-CG1 3.89Å; L80-V173 HydrophobicContact CD2-CG1 4.1Å
81	N	94.8	Very high	88.8	Confident	47 Å²	47	41.7 Å²	41.7	25%	0.251	23%	0.232	S	C	.	.	H	α-helix	trans	-58.7	-49.5	176	-77.6	-34.3	0	0	0	111.4	T77 A78 I79 Q83 T84 D85	T77-N81 PolarHBondContact O-N 2.86Å; T77-N81 PolarHBondContact O-ND2 2.83Å; A78-N81 PolarHBondContact O-N 2.96Å; I79-N81 VanDerWaalsContact C-N 3.33Å; I79-N81 PolarHBondContact O-N 2.8Å; N81-Q83 VanDerWaalsContact C-N 3.27Å; N81-Q83 PolarHBondContact O-N 3.24Å; N81-T84 WeakPolarHBondContact CA-OG1 3.41Å; N81-T84 PolarHBondContact O-N 3.43Å; N81-T84 PolarHBondContact O-OG1 3.3Å; N81-D85 WeakPolarHBondContact O-CB 3.37Å; N81-D85 VanDerWaalsContact O-CG 3.3Å; N81-D85 PolarHBondContact O-N 2.93Å
82	C	94.6	Very high	89.4	Confident	23 Å²	23	35.7 Å²	35.7	16%	0.155	21%	0.206	C	C	.	.	H	α-helix	trans	-57.4	-39.8	175.7	-69.6	0	0	0	0	112.7	A78 I79 L80 A86 F206	A78-C82 PolarHBondContact O-N 3.25Å; A78-C82 PolarHBondContact O-SG 3.11Å; I79-C82 PolarHBondContact O-N 2.84Å; L80-C82 PolarHBondContact O-N 2.88Å; C82-A86 WeakPolarHBondContact O-CB 3.4Å; C82-A86 PolarHBondContact O-N 3.45Å; C82-F206 HydrophobicContact CB-CD1 3.96Å; C82-F206 HydrophobicContact CB-CE1 4.05Å
83	Q	95.1	Very high	89.8	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.8	-44.9	177.5	-73.4	172.9	-15	0	0	111.8	I79 L80 N81 A86 L87 T170 L199 P200	I79-Q83 WeakPolarHBondContact O-CG 3.06Å; I79-Q83 PolarHBondContact O-N 3.4Å; L80-Q83 PolarHBondContact O-N 2.96Å; N81-Q83 VanDerWaalsContact C-N 3.27Å; N81-Q83 PolarHBondContact O-N 3.24Å; Q83-A86 PolarHBondContact O-N 3.38Å; Q83-L87 WeakPolarHBondContact O-CG 3.17Å; Q83-L87 PolarHBondContact O-N 3.49Å; Q83-T170 PolarHBondContact NE2-OG1 2.99Å; Q83-T170 VanDerWaalsContact OE1-C 3.32Å; Q83-T170 PolarHBondContact OE1-OG1 2.74Å; Q83-L199 HydrophobicContact CB-CD1 3.9Å; Q83-L199 HydrophobicContact CG-CD1 4.16Å; Q83-L199 WeakPolarHBondContact O-CD1 3.33Å; Q83-P200 WeakPolarHBondContact CG-O 3.47Å; Q83-P200 PolarHBondContact NE2-O 3.41Å
84	T	96.1	Very high	90.4	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.012	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-38.6	176.7	56.9	0	0	0	0	112.5	L80 N81 L87 I88 A100	L80-T84 HydrophobicContact CD1-CG2 4.43Å; L80-T84 WeakPolarHBondContact O-CG2 3.45Å; L80-T84 PolarHBondContact O-N 3.21Å; L80-T84 PolarHBondContact O-OG1 3.41Å; N81-T84 WeakPolarHBondContact CA-OG1 3.41Å; N81-T84 PolarHBondContact O-N 3.43Å; N81-T84 PolarHBondContact O-OG1 3.3Å; T84-L87 PolarHBondContact O-N 3.15Å; T84-I88 WeakPolarHBondContact O-CG1 3.17Å; T84-I88 PolarHBondContact O-N 3.39Å; T84-A100 HydrophobicContact CG2-CB 3.62Å
85	D	95.5	Very high	90.8	Very high	70 Å²	70	33.9 Å²	33.9	37%	0.374	22%	0.215	S	C	.	.	H	α-helix	trans	-67.6	-38.3	177.2	-70.4	-25.8	0	0	0	111.1	N81 I88 S89 K97	N81-D85 WeakPolarHBondContact O-CB 3.37Å; N81-D85 VanDerWaalsContact O-CG 3.3Å; N81-D85 PolarHBondContact O-N 2.93Å; D85-I88 PolarHBondContact O-N 3.14Å; D85-S89 WeakPolarHBondContact O-CB 3.31Å; D85-S89 PolarHBondContact O-N 3.12Å; D85-K97 WeakPolarHBondContact OD1-CE 3.44Å; D85-K97 IonicContact OD1-NZ 2.71Å; D85-K97 PolarHBondContact OD1-NZ 3.27Å; D85-K97 IonicContact OD2-NZ 3.52Å; D85-K97 PolarHBondContact OD2-NZ 2.87Å
86	A	91.2	Very high	91.2	Very high	13 Å²	13	33.1 Å²	33.1	11%	0.107	21%	0.211	C	C	.	.	H	α-helix	trans	-62	-44.3	172.1	0	0	0	0	0	111.8	C82 Q83 I88 S89 L90 L199 P200	C82-A86 WeakPolarHBondContact O-CB 3.4Å; C82-A86 PolarHBondContact O-N 3.45Å; Q83-A86 PolarHBondContact O-N 3.38Å; A86-I88 PolarHBondContact O-N 2.9Å; A86-S89 WeakPolarHBondContact O-CB 3.42Å; A86-S89 PolarHBondContact O-N 3.22Å; A86-S89 PolarHBondContact O-OG 2.85Å; A86-L90 WeakPolarHBondContact O-CG 3.28Å; A86-L90 PolarHBondContact O-N 3.25Å; A86-L90 VanDerWaalsContact O-N 3.14Å; A86-L199 HydrophobicContact CB-CD1 4.29Å; A86-P200 HydrophobicContact CB-CG 4.07Å
87	L	90.9	Very high	91.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59	-48	173.6	-68	170	0	0	0	111	Q83 T84 S89 L90 G91 F92 C174 L193 L199	Q83-L87 WeakPolarHBondContact O-CG 3.17Å; Q83-L87 PolarHBondContact O-N 3.49Å; T84-L87 PolarHBondContact O-N 3.15Å; L87-S89 PolarHBondContact O-N 2.92Å; L87-L90 WeakPolarHBondContact O-CA 3.45Å; L87-L90 WeakPolarHBondContact O-CB 3.46Å; L87-L90 PolarHBondContact O-N 3.29Å; L87-G91 PolarHBondContact O-N 2.78Å; L87-F92 HydrophobicContact CB-CB 4.28Å; L87-F92 HydrophobicContact CB-CD2 3.69Å; L87-F92 HydrophobicContact CB-CE2 4.21Å; L87-F92 HydrophobicContact CB-CG 4.17Å; L87-F92 HydrophobicContact CD2-CD2 3.88Å; L87-F92 HydrophobicContact CD2-CE2 3.48Å; L87-F92 VanDerWaalsContact CD2-CE2 3.48Å; L87-F92 HydrophobicContact CD2-CZ 4.23Å; L87-F92 HydrophobicContact CG-CD2 4.36Å; L87-F92 HydrophobicContact CG-CE2 4.4Å; L87-F92 WeakPolarHBondContact O-CB 3.16Å; L87-F92 WeakPolarHBondContact O-CD2 3.45Å; L87-F92 PolarHBondContact O-N 3.18Å; L87-C174 HydrophobicContact CD1-CB 3.87Å; L87-L193 HydrophobicContact CD2-CD1 4Å; L87-L199 HydrophobicContact CD1-CD1 4.43Å; L87-L199 HydrophobicContact CD2-CD1 4.03Å; L87-L199 HydrophobicContact CG-CD1 3.85Å
88	I	91.2	Very high	91.7	Very high	47 Å²	47	34.4 Å²	34.4	24%	0.241	22%	0.215	C	C	.	.	H	α-helix	trans	-58.3	-40.6	177.8	-67.1	163.9	0	0	0	111.2	T84 D85 A86 L90 G91 F92 P94 K97	T84-I88 WeakPolarHBondContact O-CG1 3.17Å; T84-I88 PolarHBondContact O-N 3.39Å; D85-I88 PolarHBondContact O-N 3.14Å; A86-I88 PolarHBondContact O-N 2.9Å; I88-L90 PolarHBondContact O-N 3.24Å; I88-G91 PolarHBondContact O-N 3.35Å; I88-F92 WeakPolarHBondContact CA-O 3.27Å; I88-P94 HydrophobicContact CD1-CB 4.47Å; I88-P94 HydrophobicContact CG2-CG 4.48Å; I88-K97 HydrophobicContact CD1-CB 4.01Å; I88-K97 HydrophobicContact CD1-CD 4.34Å
89	S	88	Confident	91.8	Very high	97 Å²	97	34.2 Å²	34.2	68%	0.678	21%	0.213	S	C	*	.	H	α-helix	trans	-62.8	-23.3	175.8	82.5	0	0	0	0	113.9	D85 A86 L87 G91	D85-S89 WeakPolarHBondContact O-CB 3.31Å; D85-S89 PolarHBondContact O-N 3.12Å; A86-S89 WeakPolarHBondContact O-CB 3.42Å; A86-S89 PolarHBondContact O-N 3.22Å; A86-S89 PolarHBondContact O-OG 2.85Å; L87-S89 PolarHBondContact O-N 2.92Å; S89-G91 VanDerWaalsContact C-N 3.3Å
90	L	85.2	Confident	92	Very high	47 Å²	47	34.1 Å²	34.1	25%	0.246	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	0.1	174.6	-64.4	168	0	0	0	112.9	A86 L87 I88 F92 L193 L198 F462	A86-L90 WeakPolarHBondContact O-CG 3.28Å; A86-L90 PolarHBondContact O-N 3.25Å; A86-L90 VanDerWaalsContact O-N 3.14Å; L87-L90 WeakPolarHBondContact O-CA 3.45Å; L87-L90 WeakPolarHBondContact O-CB 3.46Å; L87-L90 PolarHBondContact O-N 3.29Å; I88-L90 PolarHBondContact O-N 3.24Å; L90-F92 HydrophobicContact CB-CD2 4.48Å; L90-L193 HydrophobicContact CD1-CD1 4.28Å; L90-L193 HydrophobicContact CD1-CD2 3.71Å; L90-L198 HydrophobicContact CD1-CB 4.26Å; L90-L198 HydrophobicContact CD2-CB 4.36Å; L90-L198 HydrophobicContact CD2-CD1 4.24Å; L90-F462 HydrophobicContact CD1-CZ 4.42Å
91	G	85.9	Confident	91.9	Very high	56 Å²	56	35.8 Å²	35.8	58%	0.577	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	103.7	6.1	176.6	0	0	0	0	0	115	L87 I88 S89	L87-G91 PolarHBondContact O-N 2.78Å; I88-G91 PolarHBondContact O-N 3.35Å; S89-G91 VanDerWaalsContact C-N 3.3Å
92	F	87.1	Confident	91.7	Very high	5 Å²	5	36 Å²	36	2%	0.022	22%	0.222	C	C	.	.			trans	-67.9	145.3	169.6	-76.1	-84.2	0	0	0	111.2	L87 I88 L90 I96 C178 Y183 I185 F462	L87-F92 HydrophobicContact CB-CB 4.28Å; L87-F92 HydrophobicContact CB-CD2 3.69Å; L87-F92 HydrophobicContact CB-CE2 4.21Å; L87-F92 HydrophobicContact CB-CG 4.17Å; L87-F92 HydrophobicContact CD2-CD2 3.88Å; L87-F92 HydrophobicContact CD2-CE2 3.48Å; L87-F92 VanDerWaalsContact CD2-CE2 3.48Å; L87-F92 HydrophobicContact CD2-CZ 4.23Å; L87-F92 HydrophobicContact CG-CD2 4.36Å; L87-F92 HydrophobicContact CG-CE2 4.4Å; L87-F92 WeakPolarHBondContact O-CB 3.16Å; L87-F92 WeakPolarHBondContact O-CD2 3.45Å; L87-F92 PolarHBondContact O-N 3.18Å; I88-F92 WeakPolarHBondContact CA-O 3.27Å; L90-F92 HydrophobicContact CB-CD2 4.48Å; F92-I96 HydrophobicContact CB-CD1 3.6Å; F92-I96 HydrophobicContact CD1-CD1 3.26Å; F92-I96 HydrophobicContact CE1-CD1 4.19Å; F92-I96 HydrophobicContact CG-CD1 3.76Å; F92-C178 HydrophobicContact CE1-CB 4.29Å; F92-Y183 AromaticContact CD1-CD1 3.25Å; F92-Y183 HydrophobicContact CD1-CD1 3.25Å; F92-Y183 HydrophobicContact CD1-CD2 4.17Å; F92-Y183 AromaticContact CD1-CE1 3.35Å; F92-Y183 HydrophobicContact CD1-CE1 3.35Å; F92-Y183 HydrophobicContact CD1-CE2 4.21Å; F92-Y183 AromaticContact CD1-CG 3.75Å; F92-Y183 HydrophobicContact CD1-CG 3.75Å; F92-Y183 AromaticContact CD1-CZ 3.85Å; F92-Y183 AromaticContact CE1-CD1 3.29Å; F92-Y183 HydrophobicContact CE1-CD1 3.29Å; F92-Y183 HydrophobicContact CE1-CD2 4.47Å; F92-Y183 AromaticContact CE1-CE1 3.89Å; F92-Y183 HydrophobicContact CE1-CE1 3.89Å; F92-Y183 AromaticContact CE1-CG 3.69Å; F92-Y183 HydrophobicContact CE1-CG 3.69Å; F92-Y183 HydrophobicContact CG-CD1 4.47Å; F92-Y183 HydrophobicContact CG-CE1 4.28Å; F92-I185 HydrophobicContact CZ-CD1 3.83Å; F92-F462 AromaticContact CD2-CE2 3.93Å; F92-F462 HydrophobicContact CD2-CE2 3.93Å; F92-F462 HydrophobicContact CE1-CD2 4.3Å; F92-F462 HydrophobicContact CE1-CE2 4.2Å; F92-F462 AromaticContact CE2-CD2 3.81Å; F92-F462 HydrophobicContact CE2-CD2 3.81Å; F92-F462 AromaticContact CE2-CE2 2.94Å; F92-F462 HydrophobicContact CE2-CE2 2.94Å; F92-F462 AromaticContact CE2-CZ 3.51Å; F92-F462 HydrophobicContact CE2-CZ 3.51Å; F92-F462 AromaticContact CZ-CD2 3.45Å; F92-F462 HydrophobicContact CZ-CD2 3.45Å; F92-F462 VanDerWaalsContact CZ-CD2 3.45Å; F92-F462 AromaticContact CZ-CE2 3.1Å; F92-F462 HydrophobicContact CZ-CE2 3.1Å; F92-F462 AromaticContact CZ-CZ 3.9Å; F92-F462 HydrophobicContact CZ-CZ 3.9Å
93	A	88.7	Confident	91.5	Very high	35 Å²	35	34.9 Å²	34.9	29%	0.289	22%	0.215	S	C	.	.			trans	-67.7	142.9	179.9	0	0	0	0	0	110.4	I95 I96 Y183	A93-I95 HydrophobicContact CB-CG2 3.78Å; A93-I95 PolarHBondContact O-N 2.77Å; A93-I96 PolarHBondContact O-N 3.45Å; A93-I96 VanDerWaalsContact O-N 3.1Å; A93-Y183 WeakPolarHBondContact CB-OH 3.42Å; A93-Y183 PolarHBondContact N-OH 2.95Å
94	P	93.2	Very high	91.4	Very high	97 Å²	97	35.1 Å²	35.1	63%	0.63	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-22.9	-179.3	-28.4	35.8	0	0	0	115.1	I88 I96 K97	I88-P94 HydrophobicContact CD1-CB 4.47Å; I88-P94 HydrophobicContact CG2-CG 4.48Å; P94-I96 PolarHBondContact O-N 3.2Å; P94-I96 VanDerWaalsContact O-N 3.15Å; P94-K97 WeakPolarHBondContact O-CB 3.42Å; P94-K97 PolarHBondContact O-N 3.49Å
95	I	92.8	Very high	91	Very high	47 Å²	47	35.8 Å²	35.8	24%	0.241	22%	0.219	C	C	.	.	H	α-helix	trans	-54.5	-29.5	175.8	-171.4	168.1	0	0	0	113.6	D17 A93 K97 K98 S99 C181	D17-I95 WeakPolarHBondContact O-CD1 3.46Å; A93-I95 HydrophobicContact CB-CG2 3.78Å; A93-I95 PolarHBondContact O-N 2.77Å; I95-K97 PolarHBondContact O-N 3.37Å; I95-K98 WeakPolarHBondContact O-CB 3.3Å; I95-K98 PolarHBondContact O-N 2.87Å; I95-S99 PolarHBondContact O-N 3.2Å; I95-S99 PolarHBondContact O-OG 2.94Å; I95-C181 HydrophobicContact CG2-CB 4.18Å
96	I	92.8	Very high	90.6	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.5	-34.6	177.1	-77.2	163.3	0	0	0	111.6	F92 A93 P94 K98 S99 A100 A177 C178 C181 Y183	F92-I96 HydrophobicContact CB-CD1 3.6Å; F92-I96 HydrophobicContact CD1-CD1 3.26Å; F92-I96 HydrophobicContact CE1-CD1 4.19Å; F92-I96 HydrophobicContact CG-CD1 3.76Å; A93-I96 PolarHBondContact O-N 3.45Å; A93-I96 VanDerWaalsContact O-N 3.1Å; P94-I96 PolarHBondContact O-N 3.2Å; P94-I96 VanDerWaalsContact O-N 3.15Å; I96-K98 VanDerWaalsContact C-N 3.3Å; I96-K98 PolarHBondContact O-N 2.99Å; I96-S99 PolarHBondContact O-N 3.34Å; I96-A100 VanDerWaalsContact O-CB 3.27Å; I96-A100 WeakPolarHBondContact O-CB 3.48Å; I96-A100 PolarHBondContact O-N 3Å; I96-A177 HydrophobicContact CG2-CB 4.03Å; I96-C178 HydrophobicContact CD1-CB 4.31Å; I96-C181 HydrophobicContact CG1-CB 3.9Å; I96-Y183 HydrophobicContact CD1-CD2 3.56Å; I96-Y183 HydrophobicContact CD1-CE1 4.48Å; I96-Y183 HydrophobicContact CD1-CE2 3.32Å; I96-Y183 HydrophobicContact CD1-CG 4.25Å; I96-Y183 HydrophobicContact CG1-CD2 4.24Å; I96-Y183 HydrophobicContact CG1-CE2 3.96Å
97	K	95.2	Very high	90.3	Very high	53 Å²	53	35.4 Å²	35.4	23%	0.23	21%	0.213	C	C	.	.	H	α-helix	trans	-63.4	-38.2	177.1	-169.7	169.7	-169.6	167.8	0	111.5	D85 I88 P94 I95 K101	D85-K97 WeakPolarHBondContact OD1-CE 3.44Å; D85-K97 IonicContact OD1-NZ 2.71Å; D85-K97 PolarHBondContact OD1-NZ 3.27Å; D85-K97 IonicContact OD2-NZ 3.52Å; D85-K97 PolarHBondContact OD2-NZ 2.87Å; I88-K97 HydrophobicContact CD1-CB 4.01Å; I88-K97 HydrophobicContact CD1-CD 4.34Å; P94-K97 WeakPolarHBondContact O-CB 3.42Å; P94-K97 PolarHBondContact O-N 3.49Å; I95-K97 PolarHBondContact O-N 3.37Å; K97-K101 WeakPolarHBondContact O-CD 3.34Å; K97-K101 VanDerWaalsContact O-CG 3.22Å; K97-K101 WeakPolarHBondContact O-CG 3.45Å; K97-K101 PolarHBondContact O-N 2.82Å
98	K	92.7	Very high	90	Very high	51 Å²	51	35.8 Å²	35.8	22%	0.222	22%	0.215	C	C	.	.	H	α-helix	trans	-66.7	-48.4	174.8	-171.2	-179.3	179.2	-177.3	0	110.5	G18 I36 I95 I96 A100 K101 V102	G18-K98 PolarHBondContact O-NZ 3.2Å; I36-K98 HydrophobicContact CG2-CG 4.06Å; I95-K98 WeakPolarHBondContact O-CB 3.3Å; I95-K98 PolarHBondContact O-N 2.87Å; I96-K98 VanDerWaalsContact C-N 3.3Å; I96-K98 PolarHBondContact O-N 2.99Å; K98-A100 PolarHBondContact O-N 3.27Å; K98-K101 WeakPolarHBondContact O-CB 3.42Å; K98-K101 PolarHBondContact O-N 3.44Å; K98-V102 PolarHBondContact O-N 2.9Å; K98-V102 VanDerWaalsContact O-N 3.1Å
99	S	92.5	Very high	89.7	Confident	23 Å²	23	38.9 Å²	38.9	16%	0.161	22%	0.223	C	C	.	.	H	α-helix	trans	-62	-42.6	179.1	-59.6	0	0	0	0	112.9	I95 I96 K101 V102 L103 C181	I95-S99 PolarHBondContact O-N 3.2Å; I95-S99 PolarHBondContact O-OG 2.94Å; I96-S99 PolarHBondContact O-N 3.34Å; S99-K101 VanDerWaalsContact C-N 3.31Å; S99-K101 PolarHBondContact O-N 3.03Å; S99-V102 PolarHBondContact O-N 3.48Å; S99-L103 WeakPolarHBondContact O-CG 3.01Å; S99-L103 PolarHBondContact O-N 3.25Å; S99-C181 PolarHBondContact OG-SG 3.5Å
100	A	94.2	Very high	89.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.9	-38.4	176.5	0	0	0	0	0	112.2	T84 I96 K98 W104 V173 A177	T84-A100 HydrophobicContact CG2-CB 3.62Å; I96-A100 VanDerWaalsContact O-CB 3.27Å; I96-A100 WeakPolarHBondContact O-CB 3.48Å; I96-A100 PolarHBondContact O-N 3Å; K98-A100 PolarHBondContact O-N 3.27Å; A100-W104 VanDerWaalsContact O-CB 3.28Å; A100-W104 WeakPolarHBondContact O-CB 3.46Å; A100-W104 PolarHBondContact O-N 3.2Å; A100-V173 HydrophobicContact CB-CG1 4.12Å; A100-V173 VanDerWaalsContact O-CG1 3.31Å; A100-V173 WeakPolarHBondContact O-CG1 3.45Å; A100-A177 HydrophobicContact CB-CB 3.68Å
101	K	92.1	Very high	89	Confident	38 Å²	38	35.5 Å²	35.5	17%	0.165	20%	0.196	C	C	.	.	H	α-helix	trans	-64.8	-48.2	175.8	-74.8	164.6	178.6	166.1	0	112.1	M40 K97 K98 S99 L103 W104 I105	M40-K101 HydrophobicContact CE-CD 4.17Å; M40-K101 VanDerWaalsContact CE-CE 3.44Å; M40-K101 HydrophobicContact CG-CD 3.99Å; M40-K101 HydrophobicContact SD-CD 3.43Å; M40-K101 WeakPolarHBondContact SD-CD 3.31Å; M40-K101 WeakPolarHBondContact SD-CE 3.42Å; M40-K101 PolarHBondContact SD-NZ 3.33Å; K97-K101 WeakPolarHBondContact O-CD 3.34Å; K97-K101 VanDerWaalsContact O-CG 3.22Å; K97-K101 WeakPolarHBondContact O-CG 3.45Å; K97-K101 PolarHBondContact O-N 2.82Å; K98-K101 WeakPolarHBondContact O-CB 3.42Å; K98-K101 PolarHBondContact O-N 3.44Å; S99-K101 VanDerWaalsContact C-N 3.31Å; S99-K101 PolarHBondContact O-N 3.03Å; K101-L103 VanDerWaalsContact C-N 3.3Å; K101-L103 PolarHBondContact O-N 3.45Å; K101-W104 PolarHBondContact O-N 2.63Å; K101-I105 VanDerWaalsContact O-CG1 3.24Å; K101-I105 WeakPolarHBondContact O-CG1 3.36Å; K101-I105 PolarHBondContact O-N 2.79Å
102	V	90.6	Very high	88.6	Confident	51 Å²	51	34.6 Å²	34.6	31%	0.309	18%	0.178	S	C	.	.	H	α-helix	trans	-56.6	-48	177.9	172.7	0	0	0	0	110.4	K98 S99 I105 Q106	K98-V102 PolarHBondContact O-N 2.9Å; K98-V102 VanDerWaalsContact O-N 3.1Å; S99-V102 PolarHBondContact O-N 3.48Å; V102-I105 PolarHBondContact O-N 3.28Å; V102-Q106 VanDerWaalsContact O-CG 3.31Å; V102-Q106 WeakPolarHBondContact O-CG 3.14Å; V102-Q106 PolarHBondContact O-N 3.16Å
103	L	90.7	Very high	88.2	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-58.5	-49	175.5	-76.4	168.1	0	0	0	111.9	S99 K101 I105 Q106 M107 V173 F176 A177 L180 F272 F274	S99-L103 WeakPolarHBondContact O-CG 3.01Å; S99-L103 PolarHBondContact O-N 3.25Å; K101-L103 VanDerWaalsContact C-N 3.3Å; K101-L103 PolarHBondContact O-N 3.45Å; L103-I105 PolarHBondContact O-N 2.86Å; L103-Q106 PolarHBondContact O-N 3.18Å; L103-M107 WeakPolarHBondContact O-CG 3.49Å; L103-M107 PolarHBondContact O-N 3.06Å; L103-V173 HydrophobicContact CB-CG1 3.92Å; L103-V173 HydrophobicContact CD1-CG1 4.47Å; L103-F176 HydrophobicContact CD1-CB 3.64Å; L103-A177 HydrophobicContact CD1-CB 3.97Å; L103-L180 HydrophobicContact CD1-CD1 3.73Å; L103-L180 HydrophobicContact CD2-CD1 3.98Å; L103-L180 HydrophobicContact CG-CD1 3.95Å; L103-F272 HydrophobicContact CB-CE1 4.05Å; L103-F272 HydrophobicContact CB-CZ 3.94Å; L103-F272 HydrophobicContact CD2-CD1 3.73Å; L103-F272 HydrophobicContact CD2-CD2 4.37Å; L103-F272 HydrophobicContact CD2-CE1 3.4Å; L103-F272 HydrophobicContact CD2-CE2 4.08Å; L103-F272 HydrophobicContact CD2-CG 4.15Å; L103-F272 HydrophobicContact CD2-CZ 3.53Å; L103-F272 HydrophobicContact CG-CE1 4.36Å; L103-F272 HydrophobicContact CG-CZ 4.35Å; L103-F272 VanDerWaalsContact O-CE1 3.28Å; L103-F272 WeakPolarHBondContact O-CE1 3.41Å; L103-F274 HydrophobicContact CD2-CE1 4.31Å; L103-F274 HydrophobicContact CD2-CE2 4.34Å; L103-F274 HydrophobicContact CD2-CZ 3.51Å
104	W	92.3	Very high	87.4	Confident	5 Å²	5	41.6 Å²	41.6	2%	0.019	21%	0.205	C	C	.	.	H	α-helix	trans	-60.1	-46	-179.6	-176.3	-116.4	0	0	0	112.5	L73 T77 L80 A100 K101 Q106 M107 V108 F165 T169 T170 V173	L73-W104 HydrophobicContact CD1-CZ2 4.1Å; T77-W104 PolarHBondContact OG1-NE1 3.16Å; L80-W104 HydrophobicContact CD2-CB 3.57Å; L80-W104 HydrophobicContact CD2-CD2 3.97Å; L80-W104 HydrophobicContact CD2-CE3 4.37Å; L80-W104 HydrophobicContact CD2-CG 3.62Å; A100-W104 VanDerWaalsContact O-CB 3.28Å; A100-W104 WeakPolarHBondContact O-CB 3.46Å; A100-W104 PolarHBondContact O-N 3.2Å; K101-W104 PolarHBondContact O-N 2.63Å; W104-Q106 VanDerWaalsContact C-N 3.33Å; W104-Q106 PolarHBondContact O-N 3.19Å; W104-M107 PolarHBondContact O-N 2.85Å; W104-V108 HydrophobicContact CD2-CG2 4.28Å; W104-V108 HydrophobicContact CZ2-CG2 4.29Å; W104-V108 VanDerWaalsContact O-CG2 3.28Å; W104-V108 WeakPolarHBondContact O-CG2 3.32Å; W104-V108 PolarHBondContact O-N 2.91Å; W104-F165 HydrophobicContact CH2-CD1 4.34Å; W104-F165 HydrophobicContact CH2-CE1 4.41Å; W104-F165 HydrophobicContact CZ2-CE1 4.25Å; W104-T169 HydrophobicContact CZ3-CG2 4.14Å; W104-T170 HydrophobicContact CH2-CG2 4.23Å; W104-T170 HydrophobicContact CZ3-CG2 4.19Å; W104-V173 HydrophobicContact CB-CG1 4.45Å; W104-V173 HydrophobicContact CE3-CG2 4.15Å
105	I	89.2	Confident	86.4	Confident	15 Å²	15	41.4 Å²	41.4	8%	0.077	20%	0.199	C	C	.	.	H	α-helix	trans	-59.8	-45.5	177.7	-68.1	165.6	0	0	0	110.5	L43 K101 V102 L103 M107 V108 R109	L43-I105 HydrophobicContact CD1-CD1 3.7Å; L43-I105 HydrophobicContact CD1-CG1 3.68Å; L43-I105 HydrophobicContact CD1-CG2 4.19Å; L43-I105 HydrophobicContact CD2-CD1 4.1Å; L43-I105 HydrophobicContact CD2-CG1 3.61Å; L43-I105 HydrophobicContact CG-CG1 4.3Å; K101-I105 VanDerWaalsContact O-CG1 3.24Å; K101-I105 WeakPolarHBondContact O-CG1 3.36Å; K101-I105 PolarHBondContact O-N 2.79Å; V102-I105 PolarHBondContact O-N 3.28Å; L103-I105 PolarHBondContact O-N 2.86Å; I105-M107 PolarHBondContact O-N 2.83Å; I105-V108 PolarHBondContact O-N 3.04Å; I105-R109 HydrophobicContact CG2-CG 4.35Å; I105-R109 WeakPolarHBondContact O-CB 3.39Å; I105-R109 VanDerWaalsContact O-CG 3.32Å; I105-R109 WeakPolarHBondContact O-CG 3.46Å; I105-R109 PolarHBondContact O-N 3.22Å
106	Q	85.7	Confident	85.4	Confident	74 Å²	74	43.1 Å²	43.1	35%	0.346	22%	0.219	S	C	.	.	H	α-helix	trans	-61.4	-44	177.9	-74.2	174.5	-13.4	0	0	111.8	V102 L103 W104 V108 R109 Q110 F272	V102-Q106 VanDerWaalsContact O-CG 3.31Å; V102-Q106 WeakPolarHBondContact O-CG 3.14Å; V102-Q106 PolarHBondContact O-N 3.16Å; L103-Q106 PolarHBondContact O-N 3.18Å; W104-Q106 VanDerWaalsContact C-N 3.33Å; W104-Q106 PolarHBondContact O-N 3.19Å; Q106-V108 PolarHBondContact O-N 3.39Å; Q106-R109 PolarHBondContact O-N 3.41Å; Q106-Q110 WeakPolarHBondContact O-CB 3.35Å; Q106-Q110 PolarHBondContact O-N 3.32Å; Q106-F272 HydrophobicContact CB-CE1 4.21Å
107	M	84.7	Confident	84.3	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-59.8	-46.1	175.7	-70.2	-171.5	69.9	0	0	112.4	L103 W104 I105 Q110 A111 L164 T169 V173 I268 T271 F272	L103-M107 WeakPolarHBondContact O-CG 3.49Å; L103-M107 PolarHBondContact O-N 3.06Å; W104-M107 PolarHBondContact O-N 2.85Å; I105-M107 PolarHBondContact O-N 2.83Å; M107-Q110 PolarHBondContact O-N 2.78Å; M107-A111 WeakPolarHBondContact O-CB 3.43Å; M107-A111 PolarHBondContact O-N 3.25Å; M107-L164 HydrophobicContact CE-CD1 4Å; M107-L164 HydrophobicContact CE-CG 4.34Å; M107-T169 HydrophobicContact CE-CG2 3.43Å; M107-T169 VanDerWaalsContact CE-CG2 3.43Å; M107-T169 HydrophobicContact SD-CG2 4.13Å; M107-V173 HydrophobicContact SD-CG2 3.42Å; M107-V173 WeakPolarHBondContact SD-CG2 3.21Å; M107-I268 HydrophobicContact CE-CG2 3.57Å; M107-I268 HydrophobicContact SD-CG2 3.93Å; M107-T271 HydrophobicContact CB-CG2 4.42Å; M107-T271 HydrophobicContact CG-CG2 4.06Å; M107-F272 HydrophobicContact CB-CZ 4.46Å; M107-F272 HydrophobicContact CG-CE1 3.46Å; M107-F272 VanDerWaalsContact CG-CE1 3.46Å; M107-F272 HydrophobicContact CG-CE2 3.8Å; M107-F272 HydrophobicContact CG-CZ 3.04Å; M107-F272 HydrophobicContact SD-CE1 4.38Å; M107-F272 HydrophobicContact SD-CE2 3.75Å; M107-F272 HydrophobicContact SD-CZ 3.39Å; M107-F272 WeakPolarHBondContact SD-CZ 3.02Å
108	V	85.5	Confident	82.6	Confident	7 Å²	7	50.5 Å²	50.5	4%	0.042	26%	0.262	C	S	.	.	H	α-helix	trans	-65.7	-43.3	-178.5	173.1	0	0	0	0	110.4	M47 L73 W104 I105 Q106 Q110 A111 I112 L164	M47-V108 HydrophobicContact CE-CG1 3.84Å; M47-V108 HydrophobicContact SD-CG1 4.46Å; L73-V108 HydrophobicContact CD1-CB 4.35Å; L73-V108 HydrophobicContact CD1-CG1 3.9Å; L73-V108 HydrophobicContact CD1-CG2 3.51Å; L73-V108 HydrophobicContact CD2-CG1 4.14Å; W104-V108 HydrophobicContact CD2-CG2 4.28Å; W104-V108 HydrophobicContact CZ2-CG2 4.29Å; W104-V108 VanDerWaalsContact O-CG2 3.28Å; W104-V108 WeakPolarHBondContact O-CG2 3.32Å; W104-V108 PolarHBondContact O-N 2.91Å; I105-V108 PolarHBondContact O-N 3.04Å; Q106-V108 PolarHBondContact O-N 3.39Å; V108-Q110 VanDerWaalsContact C-N 3.32Å; V108-Q110 PolarHBondContact O-N 3.45Å; V108-A111 PolarHBondContact O-N 3.43Å; V108-I112 HydrophobicContact CG1-CD1 3.93Å; V108-I112 VanDerWaalsContact O-CG1 3.32Å; V108-I112 WeakPolarHBondContact O-CG1 3.28Å; V108-I112 PolarHBondContact O-N 3.33Å; V108-L164 HydrophobicContact CG2-CD2 4.45Å
109	R	83.8	Confident	80.5	Confident	112 Å²	112	53.3 Å²	53.3	42%	0.423	29%	0.285	S	S	.	.	H	α-helix	trans	-58.9	-43.3	174.6	-75.8	177	178	165.6	1.9	111.4	I105 Q106 I112 K113	I105-R109 HydrophobicContact CG2-CG 4.35Å; I105-R109 WeakPolarHBondContact O-CB 3.39Å; I105-R109 VanDerWaalsContact O-CG 3.32Å; I105-R109 WeakPolarHBondContact O-CG 3.46Å; I105-R109 PolarHBondContact O-N 3.22Å; Q106-R109 PolarHBondContact O-N 3.41Å; R109-I112 PolarHBondContact O-N 3.06Å; R109-K113 WeakPolarHBondContact O-CG 3.06Å; R109-K113 PolarHBondContact O-N 3.49Å; R109-K113 VanDerWaalsContact O-N 3.12Å
110	Q	80.9	Confident	78.3	Confident	71 Å²	71	56.2 Å²	56.2	33%	0.332	31%	0.31	S	S	.	.	H	α-helix	trans	-65.5	-45.3	178.3	-171.6	57.1	36.5	0	0	111.5	Q106 M107 V108 I112 K113 D114 T271	Q106-Q110 WeakPolarHBondContact O-CB 3.35Å; Q106-Q110 PolarHBondContact O-N 3.32Å; M107-Q110 PolarHBondContact O-N 2.78Å; V108-Q110 VanDerWaalsContact C-N 3.32Å; V108-Q110 PolarHBondContact O-N 3.45Å; Q110-I112 VanDerWaalsContact C-N 3.27Å; Q110-I112 PolarHBondContact O-N 3.3Å; Q110-K113 WeakPolarHBondContact O-CB 3.05Å; Q110-K113 PolarHBondContact O-N 3.32Å; Q110-K113 VanDerWaalsContact O-N 3.12Å; Q110-D114 PolarHBondContact NE2-OD1 3.33Å; Q110-D114 VanDerWaalsContact O-CG 3.28Å; Q110-D114 PolarHBondContact O-N 3.11Å; Q110-T271 HydrophobicContact CB-CG2 4.05Å; Q110-T271 HydrophobicContact CG-CG2 4.11Å
111	A	78.5	Confident	76.1	Confident	3 Å²	3	62.2 Å²	62.2	3%	0.025	35%	0.349	C	S	.	.	H	α-helix	trans	-58.1	-39	178.1	0	0	0	0	0	112.9	M107 V108 D115 M161 L164	M107-A111 WeakPolarHBondContact O-CB 3.43Å; M107-A111 PolarHBondContact O-N 3.25Å; V108-A111 PolarHBondContact O-N 3.43Å; A111-D115 PolarHBondContact O-N 2.87Å; A111-D115 VanDerWaalsContact O-N 3.14Å; A111-M161 HydrophobicContact CB-CE 4.39Å; A111-M161 HydrophobicContact CB-SD 4.5Å; A111-L164 HydrophobicContact CB-CD1 3.83Å; A111-L164 HydrophobicContact CB-CD2 3.92Å; A111-L164 HydrophobicContact CB-CG 4.37Å
112	I	78.1	Confident	73.7	Confident	36 Å²	36	65.7 Å²	65.7	19%	0.185	38%	0.379	C	S	.	.	H	α-helix	trans	-70.1	-40.2	177.6	-68.2	167.7	0	0	0	111.4	M47 I51 V108 R109 Q110 D114 D115 A116 M161	M47-I112 HydrophobicContact CE-CD1 3.17Å; M47-I112 HydrophobicContact SD-CD1 4.48Å; I51-I112 HydrophobicContact CD1-CG2 4.3Å; V108-I112 HydrophobicContact CG1-CD1 3.93Å; V108-I112 VanDerWaalsContact O-CG1 3.32Å; V108-I112 WeakPolarHBondContact O-CG1 3.28Å; V108-I112 PolarHBondContact O-N 3.33Å; R109-I112 PolarHBondContact O-N 3.06Å; Q110-I112 VanDerWaalsContact C-N 3.27Å; Q110-I112 PolarHBondContact O-N 3.3Å; I112-D114 VanDerWaalsContact C-N 3.32Å; I112-D115 PolarHBondContact O-N 3.2Å; I112-A116 PolarHBondContact O-N 3.18Å; I112-M161 HydrophobicContact CB-CE 4.49Å; I112-M161 HydrophobicContact CG1-CE 3.74Å
113	K	77.9	Confident	71.3	Confident	124 Å²	124	72.4 Å²	72.4	54%	0.539	40%	0.404	S	S	.	.	H	α-helix	trans	-62.6	-40.8	175	-73	174.7	-178	179.4	0	111.6	R109 Q110 D115 A116 N117	R109-K113 WeakPolarHBondContact O-CG 3.06Å; R109-K113 PolarHBondContact O-N 3.49Å; R109-K113 VanDerWaalsContact O-N 3.12Å; Q110-K113 WeakPolarHBondContact O-CB 3.05Å; Q110-K113 PolarHBondContact O-N 3.32Å; Q110-K113 VanDerWaalsContact O-N 3.12Å; K113-D115 VanDerWaalsContact C-N 3.34Å; K113-A116 PolarHBondContact O-N 3.5Å; K113-N117 PolarHBondContact O-N 2.83Å; K113-N117 PolarHBondContact O-ND2 3.27Å
114	D	72.5	Confident	68.6	Low	63 Å²	63	78.5 Å²	78.5	34%	0.337	45%	0.445	S	S	.	.	H	α-helix	trans	-66.2	-37.4	179.3	-65.8	-19.9	0	0	0	111.5	Q110 I112 N117 D118	Q110-D114 PolarHBondContact NE2-OD1 3.33Å; Q110-D114 VanDerWaalsContact O-CG 3.28Å; Q110-D114 PolarHBondContact O-N 3.11Å; I112-D114 VanDerWaalsContact C-N 3.32Å; D114-N117 PolarHBondContact O-N 2.88Å; D114-D118 PolarHBondContact O-N 2.84Å
115	D	71.4	Confident	65.9	Low	94 Å²	94	86.9 Å²	86.9	50%	0.503	48%	0.484	S	S	.	.	H	α-helix	trans	-68.6	-38.1	175.7	-160.7	57.2	0	0	0	112.3	A111 I112 K113 N117 D118 M161	A111-D115 PolarHBondContact O-N 2.87Å; A111-D115 VanDerWaalsContact O-N 3.14Å; I112-D115 PolarHBondContact O-N 3.2Å; K113-D115 VanDerWaalsContact C-N 3.34Å; D115-N117 VanDerWaalsContact C-N 3.27Å; D115-N117 PolarHBondContact O-N 3Å; D115-D118 PolarHBondContact O-N 3.27Å; D115-M161 HydrophobicContact CB-CE 4.28Å; D115-M161 HydrophobicContact CB-CG 4.25Å
116	A	72.4	Confident	63.3	Low	82 Å²	82	92.3 Å²	92.3	68%	0.678	52%	0.518	S	S	*	.	H	α-helix	trans	-68.8	-24.5	177.4	0	0	0	0	0	113.7	I112 K113	I112-A116 PolarHBondContact O-N 3.18Å; K113-A116 PolarHBondContact O-N 3.5Å
117	N	69	Low	61	Low	127 Å²	127	94.4 Å²	94.4	68%	0.679	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-6.9	-180	-73.2	-37.6	0	0	0	113.5	K113 D114 D115 P119	K113-N117 PolarHBondContact O-N 2.83Å; K113-N117 PolarHBondContact O-ND2 3.27Å; D114-N117 PolarHBondContact O-N 2.88Å; D115-N117 VanDerWaalsContact C-N 3.27Å; D115-N117 PolarHBondContact O-N 3Å; N117-P119 WeakPolarHBondContact O-CD 3.4Å
118	D	59.4	Low	58.8	Low	82 Å²	82	103.7 Å²	103.7	44%	0.439	58%	0.581	S	S	.	*	S	Bend	trans	-76.6	108.8	177	-149.2	1.9	0	0	0	108.5	D114 D115 A120	D114-D118 PolarHBondContact O-N 2.84Å; D115-D118 PolarHBondContact O-N 3.27Å; D118-A120 PolarHBondContact O-N 2.83Å; D118-A120 VanDerWaalsContact O-N 3.09Å
119	P	48.1	Very low	56.3	Low	109 Å²	109	113 Å²	113	71%	0.708	62%	0.624	S	S	*	*			trans	-63	119.4	-175.7	24.9	-31.7	0	0	0	109.2	N117	N117-P119 WeakPolarHBondContact O-CD 3.4Å
120	A	47.6	Very low	53.8	Low	84 Å²	84	110.8 Å²	110.8	69%	0.694	64%	0.637	S	S	*	*			trans	-42.9	133	178.9	0	0	0	0	0	110.8	D118 S122	D118-A120 PolarHBondContact O-N 2.83Å; D118-A120 VanDerWaalsContact O-N 3.09Å; A120-S122 PolarHBondContact O-N 3.16Å
121	P	48.1	Very low	51.3	Low	126 Å²	126	114.9 Å²	114.9	82%	0.818	66%	0.661	S	S	*	*			trans	-55.9	117.7	-175	21.4	-31.2	0	0	0	108.4	K123	P121-K123 PolarHBondContact O-N 2.8Å
122	S	41.3	Very low	49.3	Very low	112 Å²	112	120.4 Å²	120.4	78%	0.783	70%	0.7	S	S	*	*			trans	-47.8	119.8	-177.5	64	0	0	0	0	108.4	A120 C124	A120-S122 PolarHBondContact O-N 3.16Å; S122-C124 PolarHBondContact O-N 2.99Å
123	K	40.1	Very low	47.1	Very low	192 Å²	192	124.8 Å²	124.8	84%	0.835	73%	0.728	S	S	*	*			trans	-44.4	111.6	172.7	-75.2	174.2	174.3	176.5	0	108.4	P121 Q125	P121-K123 PolarHBondContact O-N 2.8Å; K123-Q125 VanDerWaalsContact C-N 3.34Å; K123-Q125 PolarHBondContact O-N 3.2Å
124	C	34.1	Very low	45.1	Very low	129 Å²	129	125.2 Å²	125.2	87%	0.872	74%	0.741	S	S	*	*			trans	-51.7	105.9	159.9	-99	0	0	0	0	106.3	S122 T126	S122-C124 PolarHBondContact O-N 2.99Å; C124-T126 PolarHBondContact O-N 3.06Å
125	Q	35.9	Very low	43	Very low	180 Å²	180	130.1 Å²	130.1	84%	0.841	76%	0.761	S	S	*	*			trans	-64.8	119.4	167.9	-71.3	177.5	-5.5	0	0	106.5	K123	K123-Q125 VanDerWaalsContact C-N 3.34Å; K123-Q125 PolarHBondContact O-N 3.2Å
126	T	34	Very low	41.4	Very low	129 Å²	129	131.5 Å²	131.5	79%	0.791	78%	0.778	S	S	*	*			trans	-54.1	126.8	168.6	-12.6	0	0	0	0	108.1	C124 E128	C124-T126 PolarHBondContact O-N 3.06Å; T126-E128 PolarHBondContact O-N 3.34Å
127	P	38.2	Very low	39.4	Very low	118 Å²	118	134.5 Å²	134.5	77%	0.766	78%	0.783	S	S	*	*			trans	-72.8	112.8	179.1	28.5	-30.8	0	0	0	108.5	E129	P127-E129 PolarHBondContact O-N 3.22Å
128	E	38.3	Very low	37.7	Very low	197 Å²	197	137.2 Å²	137.2	92%	0.921	79%	0.791	S	S	*	*			trans	-68	115.5	163.3	-71.6	-176	160.7	0	0	108	T126	T126-E128 PolarHBondContact O-N 3.34Å
129	E	33.5	Very low	36.3	Very low	202 Å²	202	137.5 Å²	137.5	94%	0.944	81%	0.805	S	S	*	*			trans	-56.2	143.7	166.6	-73.8	171.8	134	0	0	111	P127	P127-E129 PolarHBondContact O-N 3.22Å
130	G	29.6	Very low	35.4	Very low	67 Å²	67	141.1 Å²	141.1	69%	0.691	81%	0.813	S	S	*	*			trans	138.3	82.5	151.4	0	0	0	0	0	116
131	D	30.2	Very low	34.5	Very low	157 Å²	157	141 Å²	141	84%	0.84	81%	0.812	S	S	*	*			trans	46.6	111.6	134.7	-67.1	-20.4	0	0	0	120.1
132	S	36	Very low	33.5	Very low	119 Å²	119	141.7 Å²	141.7	83%	0.832	81%	0.814	S	S	*	*				-174	108.3	108.5	30.7	0	0	0	0	112.4
133	V	31.1	Very low	33	Very low	128 Å²	128	141.1 Å²	141.1	78%	0.776	81%	0.81	S	S	*	*			trans	-4.8	127.5	139.6	-173.1	0	0	0	0	115.7
134	V	36.4	Very low	32.6	Very low	133 Å²	133	139.8 Å²	139.8	81%	0.806	81%	0.812	S	S	*	*				-177.1	134.9	111.5	158.5	0	0	0	0	109.4
135	Q	29.1	Very low	32.7	Very low	166 Å²	166	142.5 Å²	142.5	78%	0.776	81%	0.809	S	S	*	*			trans	-57.4	152.8	179.7	-63.6	154.2	-49.7	0	0	114.5
136	S	36.2	Very low	32.5	Very low	122 Å²	122	143.5 Å²	143.5	85%	0.853	81%	0.814	S	S	*	*				-165.8	144	117.9	14.3	0	0	0	0	111.5
137	D	30.7	Very low	32.4	Very low	145 Å²	145	142.4 Å²	142.4	78%	0.775	81%	0.811	S	S	*	*			trans	-75.1	178.6	-170.6	-61.1	-73.2	0	0	0	114.9
138	E	32.9	Very low	32.5	Very low	184 Å²	184	142.1 Å²	142.1	86%	0.86	81%	0.81	S	S	*	*			trans	100.8	95.5	149	-74	178	-177.7	0	0	119.1
139	A	30.3	Very low	32.4	Very low	88 Å²	88	138.3 Å²	138.3	73%	0.727	80%	0.8	S	S	*	*				86.7	139.4	106.4	0	0	0	0	0	120.6
140	E	29.9	Very low	32.6	Very low	185 Å²	185	136.5 Å²	136.5	86%	0.864	79%	0.791	S	S	*	*			trans	79.9	89.5	152.8	-73.9	-178.9	161.3	0	0	120
141	A	28.4	Very low	33.1	Very low	83 Å²	83	138.5 Å²	138.5	69%	0.686	79%	0.786	S	S	*	*				56.8	135.4	103.7	0	0	0	0	0	120.4
142	T	27.1	Very low	33.6	Very low	140 Å²	140	136.6 Å²	136.6	86%	0.859	78%	0.776	S	S	*	*			trans	86.3	110.4	158.8	70.4	0	0	0	0	117.6
143	S	32	Very low	33.8	Very low	99 Å²	99	134.7 Å²	134.7	69%	0.692	76%	0.763	S	S	*	*				-179.1	104.7	123.6	172.6	0	0	0	0	109.3	K145	S143-K145 PolarHBondContact O-N 3.03Å
144	D	30.9	Very low	34	Very low	165 Å²	165	134.8 Å²	134.8	88%	0.882	76%	0.757	S	S	*	*			trans	-46.6	121.8	161.3	-74.9	-53.8	0	0	0	111.3
145	K	35.5	Very low	34.3	Very low	186 Å²	186	132.9 Å²	132.9	81%	0.809	74%	0.742	S	S	*	*			trans	-136.1	98.7	155.9	-76.3	-169.7	179.8	176	0	108.6	S143 S147	S143-K145 PolarHBondContact O-N 3.03Å; K145-S147 PolarHBondContact O-N 3.08Å
146	Q	32.4	Very low	35	Very low	200 Å²	200	133.3 Å²	133.3	94%	0.935	74%	0.742	S	S	*	*			trans	-56.6	120.6	161	-71.9	170.7	-24	0	0	108.9
147	S	32.1	Very low	35.1	Very low	106 Å²	106	131.7 Å²	131.7	74%	0.741	73%	0.73	S	S	*	*			trans	-133.9	125.3	159.9	58.8	0	0	0	0	108.8	K145	K145-S147 PolarHBondContact O-N 3.08Å
148	P	39.1	Very low	35.6	Very low	113 Å²	113	132.7 Å²	132.7	73%	0.734	73%	0.73	S	S	*	*			trans	-81.4	174.3	-177.8	34.5	-33.6	0	0	0	111.5
149	T	37.5	Very low	36.1	Very low	116 Å²	116	131.8 Å²	131.8	71%	0.712	72%	0.723	S	S	*	*			trans	85.4	55.7	168.2	62.3	0	0	0	0	118.3	N151	T149-N151 VanDerWaalsContact C-N 3.28Å
150	E	38.2	Very low	37	Very low	164 Å²	164	130.5 Å²	130.5	77%	0.766	71%	0.706	S	S	*	*			trans	-84.4	-2.1	155.5	-124.3	178.4	177.6	0	0	112.9	S153	E150-S153 PolarHBondContact O-OG 3.46Å
151	N	39.7	Very low	37.8	Very low	109 Å²	109	122.9 Å²	122.9	58%	0.583	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-13	-171.6	-78.1	-26.3	0	0	0	115.4	T149	T149-N151 VanDerWaalsContact C-N 3.28Å
152	D	39.2	Very low	39	Very low	118 Å²	118	123 Å²	123	63%	0.631	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-17.7	-179.3	-78.7	-13.3	0	0	0	113.5
153	S	40.8	Very low	40.5	Very low	79 Å²	79	119 Å²	119	55%	0.552	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-31	-178.4	63.4	0	0	0	0	112.9	E150 L155 K156	E150-S153 PolarHBondContact O-OG 3.46Å; S153-L155 PolarHBondContact O-N 3.06Å; S153-K156 PolarHBondContact O-N 2.68Å
154	I	36.4	Very low	42	Very low	129 Å²	129	114.9 Å²	114.9	66%	0.662	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-17.1	-178.3	-60.3	175.4	0	0	0	112.1
155	L	42.7	Very low	43.8	Very low	93 Å²	93	108 Å²	108	49%	0.487	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.8	-17.7	-179.7	-88.6	156.1	0	0	0	114.5	S153	S153-L155 PolarHBondContact O-N 3.06Å
156	K	43.1	Very low	46	Very low	176 Å²	176	104.9 Å²	104.9	77%	0.765	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-19.4	-174.5	-73.1	-173.6	176	-178	0	114.7	S153 Q158	S153-K156 PolarHBondContact O-N 2.68Å; K156-Q158 PolarHBondContact O-N 3.04Å
157	S	39	Very low	48.2	Very low	87 Å²	87	95.6 Å²	95.6	61%	0.608	52%	0.516	S	S	*	.			trans	-88.6	5.3	-173.1	68.1	0	0	0	0	114.9	K159	S157-K159 PolarHBondContact O-N 3.12Å
158	Q	40.4	Very low	50.8	Low	166 Å²	166	91.4 Å²	91.4	78%	0.776	49%	0.485	S	S	*	.	S	Bend	trans	-80.9	88	174.1	-157.1	170.2	32.2	0	0	108.5	K156 V160	K156-Q158 PolarHBondContact O-N 3.04Å; Q158-V160 PolarHBondContact O-N 2.77Å
159	K	43.8	Very low	53.1	Low	166 Å²	166	86.2 Å²	86.2	72%	0.722	45%	0.451	S	S	*	.			trans	-26.9	102.6	177.7	-69.1	-178	177.1	-177.5	0	111.3	S157 M161 P162	S157-K159 PolarHBondContact O-N 3.12Å; K159-M161 PolarHBondContact O-N 3.43Å; K159-P162 HydrophobicContact CB-CG 4.45Å; K159-P162 WeakPolarHBondContact O-CD 3.37Å
160	V	48.4	Very low	55.7	Low	60 Å²	60	80.7 Å²	80.7	36%	0.364	42%	0.417	S	S	.	.	S	Bend	trans	-70.2	-34.8	-169.7	175.4	0	0	0	0	111	Q158 S163	Q158-V160 PolarHBondContact O-N 2.77Å; V160-S163 PolarHBondContact O-N 2.85Å; V160-S163 PolarHBondContact O-OG 2.64Å
161	M	47.7	Very low	58.3	Low	26 Å²	26	72.9 Å²	72.9	13%	0.128	38%	0.381	C	S	.	.	H	α-helix	trans	-57.4	-51.6	-174	-91.3	-79.2	-170.8	0	0	115.6	A111 I112 D115 K159 S163 L164 F165	A111-M161 HydrophobicContact CB-CE 4.39Å; A111-M161 HydrophobicContact CB-SD 4.5Å; I112-M161 HydrophobicContact CB-CE 4.49Å; I112-M161 HydrophobicContact CG1-CE 3.74Å; D115-M161 HydrophobicContact CB-CE 4.28Å; D115-M161 HydrophobicContact CB-CG 4.25Å; K159-M161 PolarHBondContact O-N 3.43Å; M161-S163 PolarHBondContact O-N 3.45Å; M161-L164 PolarHBondContact O-N 3.06Å; M161-F165 HydrophobicContact SD-CE2 3.9Å
162	P	52.9	Low	60.8	Low	86 Å²	86	67.7 Å²	67.7	56%	0.558	35%	0.353	S	S	*	.	H	α-helix	trans	-64.3	-15.7	-179.7	-22.2	32.8	0	0	0	114.4	K159	K159-P162 HydrophobicContact CB-CG 4.45Å; K159-P162 WeakPolarHBondContact O-CD 3.37Å
163	S	59	Low	63.4	Low	55 Å²	55	62.1 Å²	62.1	39%	0.385	32%	0.323	S	S	.	.	H	α-helix	trans	-86.4	-28.2	-179.9	78.7	0	0	0	0	113	V160 M161 R166	V160-S163 PolarHBondContact O-N 2.85Å; V160-S163 PolarHBondContact O-OG 2.64Å; M161-S163 PolarHBondContact O-N 3.45Å; S163-R166 WeakPolarHBondContact O-CD 3.43Å; S163-R166 WeakPolarHBondContact O-CG 3.4Å
164	L	62.2	Low	65.9	Low	13 Å²	13	58.3 Å²	58.3	7%	0.068	30%	0.297	C	S	.	.	H	α-helix	trans	-71.1	-43.3	-175.3	-157.1	107.7	0	0	0	111.5	M107 V108 A111 M161 R166 T169	M107-L164 HydrophobicContact CE-CD1 4Å; M107-L164 HydrophobicContact CE-CG 4.34Å; V108-L164 HydrophobicContact CG2-CD2 4.45Å; A111-L164 HydrophobicContact CB-CD1 3.83Å; A111-L164 HydrophobicContact CB-CD2 3.92Å; A111-L164 HydrophobicContact CB-CG 4.37Å; M161-L164 PolarHBondContact O-N 3.06Å; L164-R166 VanDerWaalsContact C-N 3.27Å; L164-R166 PolarHBondContact O-N 3.13Å; L164-T169 WeakPolarHBondContact O-CB 3.49Å; L164-T169 WeakPolarHBondContact O-CG2 3.2Å; L164-T169 PolarHBondContact O-OG1 2.68Å
165	F	70	Confident	68.6	Low	20 Å²	20	52.9 Å²	52.9	9%	0.088	27%	0.268	C	S	.	.	S	Bend	trans	-82.3	70.9	-179.1	-67.2	-59.5	0	0	0	111.2	D72 L73 Y76 W104 M161	D72-F165 HydrophobicContact CB-CD1 4.5Å; D72-F165 HydrophobicContact CB-CD2 4.5Å; D72-F165 HydrophobicContact CB-CG 4.28Å; L73-F165 HydrophobicContact CB-CE1 4.1Å; L73-F165 HydrophobicContact CB-CZ 4.21Å; L73-F165 HydrophobicContact CD1-CE1 3.85Å; L73-F165 HydrophobicContact CD1-CZ 4.21Å; Y76-F165 HydrophobicContact CD2-CB 3.64Å; Y76-F165 AromaticContact CD2-CD1 3.58Å; Y76-F165 HydrophobicContact CD2-CD1 3.58Å; Y76-F165 HydrophobicContact CD2-CG 4Å; Y76-F165 HydrophobicContact CE2-CB 3.45Å; Y76-F165 VanDerWaalsContact CE2-CB 3.45Å; Y76-F165 HydrophobicContact CE2-CD1 4.3Å; Y76-F165 HydrophobicContact CE2-CG 4.28Å; Y76-F165 WeakPolarHBondContact CE2-O 3.4Å; Y76-F165 HydrophobicContact CG-CD1 4.14Å; Y76-F165 PolarHBondContact OH-O 3.32Å; W104-F165 HydrophobicContact CH2-CD1 4.34Å; W104-F165 HydrophobicContact CH2-CE1 4.41Å; W104-F165 HydrophobicContact CZ2-CE1 4.25Å; M161-F165 HydrophobicContact SD-CE2 3.9Å
166	R	80.6	Confident	70.9	Confident	120 Å²	120	48.5 Å²	48.5	45%	0.453	25%	0.245	S	C	.	.	S	Bend	trans	-132.4	145.7	173.3	-65	179.9	177.1	-177	-4.3	109.2	Y76 S163 L164 I168 T169	Y76-R166 VanDerWaalsContact CE1-C 3.41Å; S163-R166 WeakPolarHBondContact O-CD 3.43Å; S163-R166 WeakPolarHBondContact O-CG 3.4Å; L164-R166 VanDerWaalsContact C-N 3.27Å; L164-R166 PolarHBondContact O-N 3.13Å; R166-I168 HydrophobicContact CB-CG2 3.95Å; R166-I168 PolarHBondContact O-N 3.34Å; R166-T169 WeakPolarHBondContact O-CA 3.38Å; R166-T169 WeakPolarHBondContact O-CB 3.31Å; R166-T169 PolarHBondContact O-N 3.32Å; R166-T169 PolarHBondContact O-OG1 3.04Å
167	A	80	Confident	73.3	Confident	6 Å²	6	40.1 Å²	40.1	5%	0.05	21%	0.208	C	C	.	.	H	α-helix	trans	-59.9	-25.2	-179.7	0	0	0	0	0	113	T169 T170 L171 F201	A167-T169 VanDerWaalsContact C-N 3.25Å; A167-T169 PolarHBondContact O-N 2.95Å; A167-T170 PolarHBondContact O-N 2.71Å; A167-T170 PolarHBondContact O-OG1 3.25Å; A167-L171 PolarHBondContact O-N 2.92Å; A167-F201 HydrophobicContact CB-CD2 3.97Å; A167-F201 HydrophobicContact CB-CE2 3.59Å; A167-F201 HydrophobicContact CB-CZ 4.34Å
168	I	85.8	Confident	75.8	Confident	17 Å²	17	36 Å²	36	9%	0.087	18%	0.179	C	C	.	.	H	α-helix	trans	-69	-25.7	174.7	-165.4	141.6	0	0	0	112.7	R166 L171 A172 V261 K264 F265	R166-I168 HydrophobicContact CB-CG2 3.95Å; R166-I168 PolarHBondContact O-N 3.34Å; I168-L171 PolarHBondContact O-N 2.86Å; I168-A172 PolarHBondContact O-N 3.41Å; I168-V261 HydrophobicContact CD1-CG1 4.42Å; I168-V261 HydrophobicContact CD1-CG2 4.16Å; I168-K264 HydrophobicContact CB-CD 4.45Å; I168-K264 HydrophobicContact CD1-CD 3.66Å; I168-K264 HydrophobicContact CG1-CD 4Å; I168-K264 HydrophobicContact CG2-CD 3.74Å; I168-F265 HydrophobicContact CG1-CE1 4.22Å
169	T	88.8	Confident	78.1	Confident	4 Å²	4	28.6 Å²	28.6	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-68.5	-42.4	175.9	-48.5	0	0	0	0	110.7	W104 M107 L164 R166 A167 L171 A172 V173 I268	W104-T169 HydrophobicContact CZ3-CG2 4.14Å; M107-T169 HydrophobicContact CE-CG2 3.43Å; M107-T169 VanDerWaalsContact CE-CG2 3.43Å; M107-T169 HydrophobicContact SD-CG2 4.13Å; L164-T169 WeakPolarHBondContact O-CB 3.49Å; L164-T169 WeakPolarHBondContact O-CG2 3.2Å; L164-T169 PolarHBondContact O-OG1 2.68Å; R166-T169 WeakPolarHBondContact O-CA 3.38Å; R166-T169 WeakPolarHBondContact O-CB 3.31Å; R166-T169 PolarHBondContact O-N 3.32Å; R166-T169 PolarHBondContact O-OG1 3.04Å; A167-T169 VanDerWaalsContact C-N 3.25Å; A167-T169 PolarHBondContact O-N 2.95Å; T169-L171 VanDerWaalsContact C-N 3.32Å; T169-L171 PolarHBondContact O-N 3.26Å; T169-A172 WeakPolarHBondContact O-CB 3.46Å; T169-A172 PolarHBondContact O-N 3.35Å; T169-V173 WeakPolarHBondContact O-CG2 3.12Å; T169-V173 PolarHBondContact O-N 2.83Å; T169-I268 HydrophobicContact CG2-CD1 4.08Å
170	T	91.9	Very high	80.2	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66.7	-36.1	177.4	66.7	0	0	0	0	111.4	Y76 I79 L80 Q83 W104 A167 V173 C174	Y76-T170 HydrophobicContact CD1-CG2 4.02Å; I79-T170 HydrophobicContact CG2-CG2 4.19Å; I79-T170 WeakPolarHBondContact CG2-OG1 3.31Å; L80-T170 HydrophobicContact CB-CG2 4.21Å; Q83-T170 PolarHBondContact NE2-OG1 2.99Å; Q83-T170 VanDerWaalsContact OE1-C 3.32Å; Q83-T170 PolarHBondContact OE1-OG1 2.74Å; W104-T170 HydrophobicContact CH2-CG2 4.23Å; W104-T170 HydrophobicContact CZ3-CG2 4.19Å; A167-T170 PolarHBondContact O-N 2.71Å; A167-T170 PolarHBondContact O-OG1 3.25Å; T170-V173 PolarHBondContact O-N 2.88Å; T170-C174 PolarHBondContact O-N 3.33Å; T170-C174 PolarHBondContact O-SG 2.9Å
171	L	92.4	Very high	82.1	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-61.8	-42.2	170.6	-70.1	-176.7	0	0	0	112.8	A167 I168 T169 V173 C174 W175 I190 V194 L199 F201 I255 F265	A167-L171 PolarHBondContact O-N 2.92Å; I168-L171 PolarHBondContact O-N 2.86Å; T169-L171 VanDerWaalsContact C-N 3.32Å; T169-L171 PolarHBondContact O-N 3.26Å; L171-V173 VanDerWaalsContact C-N 3.35Å; L171-C174 WeakPolarHBondContact O-CB 3.43Å; L171-C174 PolarHBondContact O-N 2.89Å; L171-W175 PolarHBondContact O-N 3.49Å; L171-I190 HydrophobicContact CB-CG2 4.24Å; L171-I190 HydrophobicContact CD1-CG2 4.36Å; L171-I190 HydrophobicContact CD2-CG2 4.18Å; L171-V194 HydrophobicContact CD1-CG2 3.95Å; L171-V194 HydrophobicContact CD2-CG2 3.92Å; L171-L199 HydrophobicContact CD2-CD2 3.57Å; L171-L199 HydrophobicContact CD2-CG 4.03Å; L171-F201 HydrophobicContact CD1-CD2 3.32Å; L171-F201 HydrophobicContact CD1-CE2 3.41Å; L171-F201 VanDerWaalsContact CD1-CE2 3.41Å; L171-F201 HydrophobicContact CD1-CG 4.08Å; L171-F201 HydrophobicContact CD1-CZ 4.23Å; L171-F201 HydrophobicContact CD2-CD2 4.24Å; L171-F201 HydrophobicContact CG-CD2 3.73Å; L171-F201 HydrophobicContact CG-CE2 4.01Å; L171-I255 HydrophobicContact CD1-CD1 4.36Å; L171-F265 HydrophobicContact CB-CE1 4.42Å; L171-F265 HydrophobicContact CB-CZ 4.16Å
172	A	91.8	Very high	83.9	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.3	-44.6	176.6	0	0	0	0	0	110.8	I168 T169 C174 W175 F176 F265 I268	I168-A172 PolarHBondContact O-N 3.41Å; T169-A172 WeakPolarHBondContact O-CB 3.46Å; T169-A172 PolarHBondContact O-N 3.35Å; A172-C174 PolarHBondContact O-N 3.07Å; A172-W175 WeakPolarHBondContact O-CB 3.42Å; A172-W175 PolarHBondContact O-N 3.21Å; A172-W175 VanDerWaalsContact O-N 3.14Å; A172-F176 HydrophobicContact CB-CD2 4.36Å; A172-F176 HydrophobicContact CB-CE2 3.98Å; A172-F176 WeakPolarHBondContact O-CD2 3.47Å; A172-F176 WeakPolarHBondContact O-CG 3.41Å; A172-F176 PolarHBondContact O-N 3.26Å; A172-F265 HydrophobicContact CB-CD1 3.55Å; A172-F265 HydrophobicContact CB-CD2 4.42Å; A172-F265 HydrophobicContact CB-CE1 3.58Å; A172-F265 HydrophobicContact CB-CE2 4.46Å; A172-F265 HydrophobicContact CB-CG 4Å; A172-F265 HydrophobicContact CB-CZ 4.07Å; A172-I268 HydrophobicContact CB-CB 4.36Å; A172-I268 HydrophobicContact CB-CD1 3.47Å; A172-I268 VanDerWaalsContact CB-CD1 3.47Å; A172-I268 HydrophobicContact CB-CG2 4.18Å
173	V	93.1	Very high	85.4	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.2	-44.4	176	171.3	0	0	0	0	111.6	L80 A100 L103 W104 M107 T169 T170 L171 W175 F176 A177	L80-V173 HydrophobicContact CD1-CB 4.14Å; L80-V173 HydrophobicContact CD1-CG1 3.89Å; L80-V173 HydrophobicContact CD2-CG1 4.1Å; A100-V173 HydrophobicContact CB-CG1 4.12Å; A100-V173 VanDerWaalsContact O-CG1 3.31Å; A100-V173 WeakPolarHBondContact O-CG1 3.45Å; L103-V173 HydrophobicContact CB-CG1 3.92Å; L103-V173 HydrophobicContact CD1-CG1 4.47Å; W104-V173 HydrophobicContact CB-CG1 4.45Å; W104-V173 HydrophobicContact CE3-CG2 4.15Å; M107-V173 HydrophobicContact SD-CG2 3.42Å; M107-V173 WeakPolarHBondContact SD-CG2 3.21Å; T169-V173 WeakPolarHBondContact O-CG2 3.12Å; T169-V173 PolarHBondContact O-N 2.83Å; T170-V173 PolarHBondContact O-N 2.88Å; L171-V173 VanDerWaalsContact C-N 3.35Å; V173-W175 VanDerWaalsContact C-N 3.33Å; V173-W175 PolarHBondContact O-N 3.09Å; V173-F176 PolarHBondContact O-N 2.87Å; V173-A177 VanDerWaalsContact O-CB 3.24Å; V173-A177 WeakPolarHBondContact O-CB 3.45Å; V173-A177 PolarHBondContact O-N 3.02Å
174	C	94.5	Very high	86.6	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-57.3	-45.9	173	-77.7	0	0	0	0	111.8	L87 T170 L171 A172 A177 C178	L87-C174 HydrophobicContact CD1-CB 3.87Å; T170-C174 PolarHBondContact O-N 3.33Å; T170-C174 PolarHBondContact O-SG 2.9Å; L171-C174 WeakPolarHBondContact O-CB 3.43Å; L171-C174 PolarHBondContact O-N 2.89Å; A172-C174 PolarHBondContact O-N 3.07Å; C174-A177 PolarHBondContact O-N 3.48Å; C174-C178 PolarHBondContact O-N 3.19Å; C174-C178 PolarHBondContact O-SG 2.82Å
175	W	92.8	Very high	87.8	Confident	14 Å²	14	22.8 Å²	22.8	5%	0.053	12%	0.115	C	C	.	.	H	α-helix	trans	-61.2	-49.7	177.4	-176.1	82.8	0	0	0	111.8	L171 A172 V173 A177 C178 R179 I185 L186 V187 I190 F265 L319	L171-W175 PolarHBondContact O-N 3.49Å; A172-W175 WeakPolarHBondContact O-CB 3.42Å; A172-W175 PolarHBondContact O-N 3.21Å; A172-W175 VanDerWaalsContact O-N 3.14Å; V173-W175 VanDerWaalsContact C-N 3.33Å; V173-W175 PolarHBondContact O-N 3.09Å; W175-A177 VanDerWaalsContact C-N 3.32Å; W175-A177 PolarHBondContact O-N 3.41Å; W175-C178 WeakPolarHBondContact O-CB 3.33Å; W175-C178 PolarHBondContact O-N 3.28Å; W175-R179 HydrophobicContact CD2-CG 3.99Å; W175-R179 HydrophobicContact CE3-CG 4Å; W175-R179 HydrophobicContact CH2-CG 3.65Å; W175-R179 HydrophobicContact CZ2-CG 3.67Å; W175-R179 HydrophobicContact CZ3-CG 3.79Å; W175-R179 WeakPolarHBondContact O-CG 3.43Å; W175-R179 PolarHBondContact O-N 2.84Å; W175-I185 PolarHBondContact NE1-O 3.45Å; W175-L186 PolarHBondContact NE1-O 3.45Å; W175-V187 HydrophobicContact CD2-CG2 4.46Å; W175-V187 HydrophobicContact CZ2-CG2 4.18Å; W175-I190 HydrophobicContact CB-CD1 4.41Å; W175-I190 HydrophobicContact CB-CG1 4.09Å; W175-I190 HydrophobicContact CG-CG1 4.22Å; W175-F265 HydrophobicContact CB-CD2 4.2Å; W175-F265 HydrophobicContact CB-CE2 3.56Å; W175-F265 HydrophobicContact CB-CZ 4.37Å; W175-F265 HydrophobicContact CD2-CD2 4.1Å; W175-F265 HydrophobicContact CD2-CE2 4.23Å; W175-F265 HydrophobicContact CE3-CD2 4.27Å; W175-F265 HydrophobicContact CG-CD2 4.07Å; W175-F265 AromaticContact CG-CE2 3.71Å; W175-F265 HydrophobicContact CG-CE2 3.71Å; W175-L319 HydrophobicContact CE3-CD1 4.19Å; W175-L319 HydrophobicContact CH2-CD1 3.23Å; W175-L319 HydrophobicContact CH2-CG 4.34Å; W175-L319 HydrophobicContact CZ2-CD1 4.25Å; W175-L319 HydrophobicContact CZ3-CD1 3.19Å
176	F	91.8	Very high	88.7	Confident	2 Å²	2	22 Å²	22	1%	0.009	11%	0.112	C	C	.	.	H	α-helix	trans	-61	-40.9	177.1	-68.4	-57.8	0	0	0	112	L103 A172 V173 C178 R179 L180 F265 I268 F272 L275 L319	L103-F176 HydrophobicContact CD1-CB 3.64Å; A172-F176 HydrophobicContact CB-CD2 4.36Å; A172-F176 HydrophobicContact CB-CE2 3.98Å; A172-F176 WeakPolarHBondContact O-CD2 3.47Å; A172-F176 WeakPolarHBondContact O-CG 3.41Å; A172-F176 PolarHBondContact O-N 3.26Å; V173-F176 PolarHBondContact O-N 2.87Å; F176-C178 PolarHBondContact O-N 2.91Å; F176-R179 PolarHBondContact O-N 3.32Å; F176-L180 WeakPolarHBondContact O-CG 3.03Å; F176-L180 PolarHBondContact O-N 3.09Å; F176-F265 WeakPolarHBondContact CZ-O 3.28Å; F176-I268 HydrophobicContact CD2-CG2 4.44Å; F176-I268 HydrophobicContact CE2-CB 4.22Å; F176-I268 HydrophobicContact CE2-CG2 3.74Å; F176-F272 HydrophobicContact CD2-CE2 4.15Å; F176-F272 HydrophobicContact CE2-CE2 4.43Å; F176-L275 HydrophobicContact CB-CD1 4.36Å; F176-L275 HydrophobicContact CD1-CD1 3.33Å; F176-L275 HydrophobicContact CD1-CD2 4.17Å; F176-L275 HydrophobicContact CD1-CG 4.39Å; F176-L275 HydrophobicContact CD2-CD1 4.17Å; F176-L275 HydrophobicContact CE1-CD1 3.51Å; F176-L275 HydrophobicContact CE2-CD1 4.36Å; F176-L275 HydrophobicContact CG-CD1 3.71Å; F176-L275 HydrophobicContact CZ-CD1 4.06Å; F176-L319 HydrophobicContact CE1-CD1 3.86Å; F176-L319 HydrophobicContact CZ-CD1 4.37Å
177	A	92.7	Very high	89.2	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-61.2	-44.2	177.2	0	0	0	0	0	111.7	I96 A100 L103 V173 C174 W175 L180 C181	I96-A177 HydrophobicContact CG2-CB 4.03Å; A100-A177 HydrophobicContact CB-CB 3.68Å; L103-A177 HydrophobicContact CD1-CB 3.97Å; V173-A177 VanDerWaalsContact O-CB 3.24Å; V173-A177 WeakPolarHBondContact O-CB 3.45Å; V173-A177 PolarHBondContact O-N 3.02Å; C174-A177 PolarHBondContact O-N 3.48Å; W175-A177 VanDerWaalsContact C-N 3.32Å; W175-A177 PolarHBondContact O-N 3.41Å; A177-L180 PolarHBondContact O-N 3.12Å; A177-C181 PolarHBondContact O-N 3.29Å; A177-C181 VanDerWaalsContact O-N 3.13Å; A177-C181 PolarHBondContact O-SG 3.19Å
178	C	91.6	Very high	89.6	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.3	-47.1	172.8	-68.9	0	0	0	0	111.1	F92 I96 C174 W175 F176 L180 C181 G182 Y183 I185	F92-C178 HydrophobicContact CE1-CB 4.29Å; I96-C178 HydrophobicContact CD1-CB 4.31Å; C174-C178 PolarHBondContact O-N 3.19Å; C174-C178 PolarHBondContact O-SG 2.82Å; W175-C178 WeakPolarHBondContact O-CB 3.33Å; W175-C178 PolarHBondContact O-N 3.28Å; F176-C178 PolarHBondContact O-N 2.91Å; C178-L180 PolarHBondContact O-N 3.23Å; C178-C181 CarbonylContact O-C 3.55Å; C178-C181 PolarHBondContact O-N 2.94Å; C178-C181 VanDerWaalsContact O-N 3.15Å; C178-G182 PolarHBondContact O-N 2.94Å; C178-Y183 VanDerWaalsContact O-CB 3.3Å; C178-Y183 WeakPolarHBondContact O-CB 3.42Å; C178-Y183 VanDerWaalsContact O-CD2 3.3Å; C178-Y183 WeakPolarHBondContact O-CD2 3.37Å; C178-Y183 PolarHBondContact O-N 3.41Å; C178-I185 HydrophobicContact CB-CG2 3.49Å; C178-I185 VanDerWaalsContact CB-CG2 3.49Å
179	R	87.8	Confident	89.7	Confident	10 Å²	10	15.6 Å²	15.6	4%	0.038	9%	0.086	C	C	.	.	H	α-helix	trans	-60.8	-42.3	178.5	-66.8	-64	-61	143	-7.9	112.7	W175 F176 C181 G182 Y183 I185 V279	W175-R179 HydrophobicContact CD2-CG 3.99Å; W175-R179 HydrophobicContact CE3-CG 4Å; W175-R179 HydrophobicContact CH2-CG 3.65Å; W175-R179 HydrophobicContact CZ2-CG 3.67Å; W175-R179 HydrophobicContact CZ3-CG 3.79Å; W175-R179 WeakPolarHBondContact O-CG 3.43Å; W175-R179 PolarHBondContact O-N 2.84Å; F176-R179 PolarHBondContact O-N 3.32Å; R179-C181 PolarHBondContact O-N 3.15Å; R179-G182 PolarHBondContact O-N 3.28Å; R179-Y183 WeakPolarHBondContact CD-O 3.3Å; R179-Y183 PolarHBondContact NH1-O 3.5Å; R179-I185 WeakPolarHBondContact CD-O 3.14Å; R179-V279 PolarHBondContact NH2-O 3.17Å
180	L	87.9	Confident	89.8	Confident	70 Å²	70	15.4 Å²	15.4	37%	0.366	9%	0.085	S	C	.	.	H	α-helix	trans	-63.9	-29.9	177	-73	175.1	0	0	0	113	L103 F176 A177 C178 G182 F274 L275 T278	L103-L180 HydrophobicContact CD1-CD1 3.73Å; L103-L180 HydrophobicContact CD2-CD1 3.98Å; L103-L180 HydrophobicContact CG-CD1 3.95Å; F176-L180 WeakPolarHBondContact O-CG 3.03Å; F176-L180 PolarHBondContact O-N 3.09Å; A177-L180 PolarHBondContact O-N 3.12Å; C178-L180 PolarHBondContact O-N 3.23Å; L180-G182 PolarHBondContact O-N 2.93Å; L180-F274 HydrophobicContact CD1-CE2 3.77Å; L180-F274 HydrophobicContact CD1-CZ 4.23Å; L180-F274 HydrophobicContact CD2-CD2 4.29Å; L180-F274 HydrophobicContact CD2-CE2 3.77Å; L180-F274 HydrophobicContact CG-CE2 4.39Å; L180-L275 HydrophobicContact CD1-CD2 4.4Å; L180-L275 HydrophobicContact CD2-CD2 4Å; L180-L275 HydrophobicContact CG-CD2 4.23Å; L180-T278 HydrophobicContact CD2-CG2 3.93Å
181	C	88.5	Confident	89.7	Confident	30 Å²	30	15.4 Å²	15.4	20%	0.203	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	14.9	175	-55.3	0	0	0	0	112.5	I95 I96 S99 A177 C178 R179 Y183	I95-C181 HydrophobicContact CG2-CB 4.18Å; I96-C181 HydrophobicContact CG1-CB 3.9Å; S99-C181 PolarHBondContact OG-SG 3.5Å; A177-C181 PolarHBondContact O-N 3.29Å; A177-C181 VanDerWaalsContact O-N 3.13Å; A177-C181 PolarHBondContact O-SG 3.19Å; C178-C181 CarbonylContact O-C 3.55Å; C178-C181 PolarHBondContact O-N 2.94Å; C178-C181 VanDerWaalsContact O-N 3.15Å; R179-C181 PolarHBondContact O-N 3.15Å; C181-Y183 VanDerWaalsContact C-N 3.33Å; C181-Y183 HydrophobicContact CB-CD2 3.7Å; C181-Y183 HydrophobicContact CB-CE2 3.69Å; C181-Y183 WeakPolarHBondContact O-CD2 3.5Å; C181-Y183 PolarHBondContact O-N 3.33Å
182	G	85.6	Confident	89.3	Confident	43 Å²	43	16 Å²	16	44%	0.443	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	3.9	176.4	0	0	0	0	0	115.3	C178 R179 L180	C178-G182 PolarHBondContact O-N 2.94Å; R179-G182 PolarHBondContact O-N 3.28Å; L180-G182 PolarHBondContact O-N 2.93Å
183	Y	85.8	Confident	89	Confident	26 Å²	26	16.1 Å²	16.1	10%	0.102	9%	0.089	C	C	.	.			trans	-72	131.9	178.6	-66.4	-97.9	0	0	0	111	F92 A93 I96 C178 R179 C181 I185 S459	F92-Y183 AromaticContact CD1-CD1 3.25Å; F92-Y183 HydrophobicContact CD1-CD1 3.25Å; F92-Y183 HydrophobicContact CD1-CD2 4.17Å; F92-Y183 AromaticContact CD1-CE1 3.35Å; F92-Y183 HydrophobicContact CD1-CE1 3.35Å; F92-Y183 HydrophobicContact CD1-CE2 4.21Å; F92-Y183 AromaticContact CD1-CG 3.75Å; F92-Y183 HydrophobicContact CD1-CG 3.75Å; F92-Y183 AromaticContact CD1-CZ 3.85Å; F92-Y183 AromaticContact CE1-CD1 3.29Å; F92-Y183 HydrophobicContact CE1-CD1 3.29Å; F92-Y183 HydrophobicContact CE1-CD2 4.47Å; F92-Y183 AromaticContact CE1-CE1 3.89Å; F92-Y183 HydrophobicContact CE1-CE1 3.89Å; F92-Y183 AromaticContact CE1-CG 3.69Å; F92-Y183 HydrophobicContact CE1-CG 3.69Å; F92-Y183 HydrophobicContact CG-CD1 4.47Å; F92-Y183 HydrophobicContact CG-CE1 4.28Å; A93-Y183 WeakPolarHBondContact CB-OH 3.42Å; A93-Y183 PolarHBondContact N-OH 2.95Å; I96-Y183 HydrophobicContact CD1-CD2 3.56Å; I96-Y183 HydrophobicContact CD1-CE1 4.48Å; I96-Y183 HydrophobicContact CD1-CE2 3.32Å; I96-Y183 HydrophobicContact CD1-CG 4.25Å; I96-Y183 HydrophobicContact CG1-CD2 4.24Å; I96-Y183 HydrophobicContact CG1-CE2 3.96Å; C178-Y183 VanDerWaalsContact O-CB 3.3Å; C178-Y183 WeakPolarHBondContact O-CB 3.42Å; C178-Y183 VanDerWaalsContact O-CD2 3.3Å; C178-Y183 WeakPolarHBondContact O-CD2 3.37Å; C178-Y183 PolarHBondContact O-N 3.41Å; R179-Y183 WeakPolarHBondContact CD-O 3.3Å; R179-Y183 PolarHBondContact NH1-O 3.5Å; C181-Y183 VanDerWaalsContact C-N 3.33Å; C181-Y183 HydrophobicContact CB-CD2 3.7Å; C181-Y183 HydrophobicContact CB-CE2 3.69Å; C181-Y183 WeakPolarHBondContact O-CD2 3.5Å; C181-Y183 PolarHBondContact O-N 3.33Å; Y183-I185 PolarHBondContact O-N 3.3Å; Y183-I185 VanDerWaalsContact O-N 3.07Å; Y183-S459 WeakPolarHBondContact CA-OG 3.44Å; Y183-S459 WeakPolarHBondContact CD1-OG 3.35Å; Y183-S459 WeakPolarHBondContact CE1-OG 3.37Å; Y183-S459 VanDerWaalsContact CG-OG 3.24Å
184	K	83.9	Confident	88.7	Confident	112 Å²	112	16.1 Å²	16.1	49%	0.487	9%	0.089	S	C	.	.			trans	-85.5	44.3	177.7	-62.3	-176.3	175.3	-179.6	0	113.2	E285 R289	K184-E285 WeakPolarHBondContact CD-OE1 3.24Å; K184-E285 WeakPolarHBondContact CE-OE1 3.48Å; K184-E285 IonicContact NZ-OE1 3.78Å; K184-E285 PolarHBondContact NZ-OE1 3.42Å; K184-E285 IonicContact NZ-OE2 3.54Å; K184-R289 PolarHBondContact O-NH1 3.11Å
185	I	86.7	Confident	88.1	Confident	3 Å²	3	21.4 Å²	21.4	2%	0.015	11%	0.109	C	C	.	.			trans	-78	135.2	178.6	-172	160	0	0	0	111.5	F92 W175 C178 R179 Y183 D189 I190	F92-I185 HydrophobicContact CZ-CD1 3.83Å; W175-I185 PolarHBondContact NE1-O 3.45Å; C178-I185 HydrophobicContact CB-CG2 3.49Å; C178-I185 VanDerWaalsContact CB-CG2 3.49Å; R179-I185 WeakPolarHBondContact CD-O 3.14Å; Y183-I185 PolarHBondContact O-N 3.3Å; Y183-I185 VanDerWaalsContact O-N 3.07Å; I185-D189 HydrophobicContact CD1-CB 4Å; I185-D189 HydrophobicContact CG1-CB 3.65Å; I185-D189 WeakPolarHBondContact CG1-OD2 3.22Å; I185-I190 HydrophobicContact CD1-CD1 3.58Å; I185-I190 HydrophobicContact CD1-CG1 4.05Å; I185-I190 HydrophobicContact CG1-CD1 4.43Å; I185-I190 HydrophobicContact CG1-CG1 4.41Å
186	L	88.9	Confident	87.5	Confident	4 Å²	4	23.4 Å²	23.4	2%	0.021	12%	0.119	C	C	.	.			trans	-93.2	161.7	177.7	-69.6	-178.6	0	0	0	110.8	W175 S188 D189 I190 M286 F290 E337	W175-L186 PolarHBondContact NE1-O 3.45Å; L186-S188 VanDerWaalsContact C-N 3.3Å; L186-D189 WeakPolarHBondContact CB-OD2 3.37Å; L186-D189 PolarHBondContact N-OD2 2.87Å; L186-D189 WeakPolarHBondContact O-CB 3.47Å; L186-D189 PolarHBondContact O-N 3.31Å; L186-I190 PolarHBondContact O-N 3.49Å; L186-M286 HydrophobicContact CD2-CG 4.09Å; L186-M286 HydrophobicContact CD2-SD 4.33Å; L186-F290 HydrophobicContact CD1-CE1 4.48Å; L186-F290 HydrophobicContact CD1-CZ 4.06Å; L186-E337 WeakPolarHBondContact CA-OE1 3.32Å; L186-E337 HydrophobicContact CB-CG 4.3Å; L186-E337 WeakPolarHBondContact CB-OE1 3.4Å; L186-E337 HydrophobicContact CD1-CG 3.97Å; L186-E337 HydrophobicContact CD2-CG 3.83Å; L186-E337 WeakPolarHBondContact CD2-OE1 3.5Å; L186-E337 HydrophobicContact CG-CG 4.21Å
187	V	89.9	Confident	87.2	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-69.2	-35.5	175.7	-177.9	0	0	0	0	110	W175 D189 I190 C191 L258 V261 Y262 F265 E337	W175-V187 HydrophobicContact CD2-CG2 4.46Å; W175-V187 HydrophobicContact CZ2-CG2 4.18Å; V187-D189 PolarHBondContact O-N 3.47Å; V187-I190 PolarHBondContact O-N 2.77Å; V187-C191 PolarHBondContact O-N 3.48Å; V187-C191 VanDerWaalsContact O-N 3.12Å; V187-C191 PolarHBondContact O-SG 2.82Å; V187-L258 HydrophobicContact CB-CD1 3.95Å; V187-L258 HydrophobicContact CG1-CD1 3.71Å; V187-V261 HydrophobicContact CG1-CB 4.25Å; V187-V261 HydrophobicContact CG1-CG1 3.67Å; V187-Y262 HydrophobicContact CB-CD2 4.43Å; V187-Y262 HydrophobicContact CG2-CD2 4.01Å; V187-F265 HydrophobicContact CG1-CD2 4Å; V187-F265 HydrophobicContact CG1-CE2 3.98Å; V187-F265 HydrophobicContact CG2-CD2 3.83Å; V187-F265 HydrophobicContact CG2-CE2 4.25Å; V187-E337 PolarHBondContact N-OE1 3.41Å
188	S	88.7	Confident	86.9	Confident	2 Å²	2	33 Å²	33	1%	0.014	16%	0.159	C	C	.	.	H	α-helix	trans	-55.3	-36.3	171	60.6	0	0	0	0	112.7	L186 C191 L192 E337	L186-S188 VanDerWaalsContact C-N 3.3Å; S188-C191 WeakPolarHBondContact O-CB 3.34Å; S188-C191 PolarHBondContact O-N 3.31Å; S188-L192 WeakPolarHBondContact O-CB 3.47Å; S188-L192 PolarHBondContact O-N 3.19Å; S188-E337 VanDerWaalsContact CB-OE2 3.26Å; S188-E337 WeakPolarHBondContact CB-OE2 3.29Å; S188-E337 PolarHBondContact N-OE2 3.37Å; S188-E337 PolarHBondContact OG-OE2 3.31Å
189	D	88.7	Confident	86.8	Confident	5 Å²	5	33 Å²	33	3%	0.027	16%	0.159	C	C	.	.	H	α-helix	trans	-66.7	-43.6	179.7	-58.4	-28.4	0	0	0	112.1	I185 L186 V187 C191 L192 L193 R289 F462	I185-D189 HydrophobicContact CD1-CB 4Å; I185-D189 HydrophobicContact CG1-CB 3.65Å; I185-D189 WeakPolarHBondContact CG1-OD2 3.22Å; L186-D189 WeakPolarHBondContact CB-OD2 3.37Å; L186-D189 PolarHBondContact N-OD2 2.87Å; L186-D189 WeakPolarHBondContact O-CB 3.47Å; L186-D189 PolarHBondContact O-N 3.31Å; V187-D189 PolarHBondContact O-N 3.47Å; D189-C191 VanDerWaalsContact C-N 3.28Å; D189-C191 PolarHBondContact O-N 2.64Å; D189-L192 WeakPolarHBondContact O-CB 3.41Å; D189-L192 PolarHBondContact O-N 3.49Å; D189-L193 WeakPolarHBondContact O-CB 3.46Å; D189-L193 WeakPolarHBondContact O-CG 3.32Å; D189-L193 PolarHBondContact O-N 3.46Å; D189-R289 IonicContact OD1-CZ 3.49Å; D189-R289 IonicContact OD1-NH1 3.11Å; D189-R289 IonicContact OD1-NH2 2.77Å; D189-R289 PolarHBondContact OD1-NH2 3.47Å; D189-R289 IonicContact OD2-CZ 2.64Å; D189-R289 IonicContact OD2-NH1 3.66Å; D189-R289 PolarHBondContact OD2-NH1 3.15Å; D189-R289 IonicContact OD2-NH2 3.54Å; D189-R289 PolarHBondContact OD2-NH2 3.46Å; D189-F462 HydrophobicContact CB-CD1 4.34Å
190	I	90.3	Very high	86.9	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.4	-43.5	176.2	-64.7	-68.2	0	0	0	109.7	L171 W175 I185 L186 V187 L192 L193 V194 L199 F265	L171-I190 HydrophobicContact CB-CG2 4.24Å; L171-I190 HydrophobicContact CD1-CG2 4.36Å; L171-I190 HydrophobicContact CD2-CG2 4.18Å; W175-I190 HydrophobicContact CB-CD1 4.41Å; W175-I190 HydrophobicContact CB-CG1 4.09Å; W175-I190 HydrophobicContact CG-CG1 4.22Å; I185-I190 HydrophobicContact CD1-CD1 3.58Å; I185-I190 HydrophobicContact CD1-CG1 4.05Å; I185-I190 HydrophobicContact CG1-CD1 4.43Å; I185-I190 HydrophobicContact CG1-CG1 4.41Å; L186-I190 PolarHBondContact O-N 3.49Å; V187-I190 PolarHBondContact O-N 2.77Å; I190-L192 VanDerWaalsContact C-N 3.3Å; I190-L192 PolarHBondContact O-N 3.31Å; I190-L193 PolarHBondContact O-N 2.88Å; I190-V194 WeakPolarHBondContact O-CG2 3.36Å; I190-V194 PolarHBondContact O-N 2.96Å; I190-L199 HydrophobicContact CD1-CD2 4.1Å; I190-L199 HydrophobicContact CG2-CD2 4.06Å; I190-F265 HydrophobicContact CG2-CZ 4.38Å
191	C	89.8	Confident	86.9	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.007	15%	0.146	C	C	.	.	H	α-helix	trans	-61.7	-41.8	177.2	-62.6	0	0	0	0	111.5	V187 S188 D189 V194 R195 F553	V187-C191 PolarHBondContact O-N 3.48Å; V187-C191 VanDerWaalsContact O-N 3.12Å; V187-C191 PolarHBondContact O-SG 2.82Å; S188-C191 WeakPolarHBondContact O-CB 3.34Å; S188-C191 PolarHBondContact O-N 3.31Å; D189-C191 VanDerWaalsContact C-N 3.28Å; D189-C191 PolarHBondContact O-N 2.64Å; C191-V194 PolarHBondContact O-N 2.81Å; C191-R195 WeakPolarHBondContact O-CB 3.09Å; C191-R195 PolarHBondContact O-N 3.13Å; C191-F553 HydrophobicContact CB-CB 3.75Å; C191-F553 HydrophobicContact CB-CD1 3.86Å; C191-F553 HydrophobicContact CB-CD2 4.3Å; C191-F553 HydrophobicContact CB-CG 3.7Å
192	L	83.6	Confident	86.7	Confident	12 Å²	12	31.6 Å²	31.6	6%	0.063	15%	0.147	C	C	.	.	H	α-helix	trans	-65.6	-47.4	177.4	-173.4	84.5	0	0	0	112.1	S188 D189 I190 V194 R195 Q196 V398 F464	S188-L192 WeakPolarHBondContact O-CB 3.47Å; S188-L192 PolarHBondContact O-N 3.19Å; D189-L192 WeakPolarHBondContact O-CB 3.41Å; D189-L192 PolarHBondContact O-N 3.49Å; I190-L192 VanDerWaalsContact C-N 3.3Å; I190-L192 PolarHBondContact O-N 3.31Å; L192-V194 PolarHBondContact O-N 3.27Å; L192-R195 CarbonylContact O-C 3.51Å; L192-R195 WeakPolarHBondContact O-CA 3.06Å; L192-R195 WeakPolarHBondContact O-CB 3.09Å; L192-R195 PolarHBondContact O-N 3.49Å; L192-Q196 HydrophobicContact CG-CG 4.38Å; L192-Q196 WeakPolarHBondContact O-CB 3.37Å; L192-Q196 WeakPolarHBondContact O-CG 3.48Å; L192-Q196 PolarHBondContact O-N 3.24Å; L192-V398 HydrophobicContact CD1-CG1 3.67Å; L192-V398 HydrophobicContact CG-CG1 4.48Å; L192-F464 HydrophobicContact CD1-CE1 4.43Å; L192-F464 HydrophobicContact CD1-CZ 3.79Å; L192-F464 HydrophobicContact CD2-CE1 3.58Å; L192-F464 HydrophobicContact CD2-CE2 3.51Å; L192-F464 HydrophobicContact CD2-CZ 2.99Å; L192-F464 HydrophobicContact CG-CZ 3.96Å
193	L	86.6	Confident	86.4	Confident	4 Å²	4	31 Å²	31	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-57.6	-40.1	177.2	-77.2	176.5	0	0	0	111.8	L87 L90 D189 I190 R197 L198 L199 F462	L87-L193 HydrophobicContact CD2-CD1 4Å; L90-L193 HydrophobicContact CD1-CD1 4.28Å; L90-L193 HydrophobicContact CD1-CD2 3.71Å; D189-L193 WeakPolarHBondContact O-CB 3.46Å; D189-L193 WeakPolarHBondContact O-CG 3.32Å; D189-L193 PolarHBondContact O-N 3.46Å; I190-L193 PolarHBondContact O-N 2.88Å; L193-R197 PolarHBondContact O-N 3.47Å; L193-L198 HydrophobicContact CD2-CB 3.89Å; L193-L198 HydrophobicContact CD2-CD1 3.98Å; L193-L198 PolarHBondContact O-N 3.41Å; L193-L199 HydrophobicContact CB-CB 3.71Å; L193-L199 HydrophobicContact CB-CD2 4.45Å; L193-L199 PolarHBondContact O-N 2.91Å; L193-L199 VanDerWaalsContact O-N 3.11Å; L193-F462 HydrophobicContact CD1-CE1 3.57Å; L193-F462 HydrophobicContact CD1-CZ 3.63Å; L193-F462 HydrophobicContact CD2-CE1 3.6Å; L193-F462 HydrophobicContact CD2-CZ 3.89Å; L193-F462 HydrophobicContact CG-CE1 3.69Å; L193-F462 HydrophobicContact CG-CZ 4.13Å
194	V	87.5	Confident	86.1	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-66.6	-43.7	174	171.2	0	0	0	0	111.1	L171 I190 C191 L192 Q196 R197 L199 F201 Y202 I255	L171-V194 HydrophobicContact CD1-CG2 3.95Å; L171-V194 HydrophobicContact CD2-CG2 3.92Å; I190-V194 WeakPolarHBondContact O-CG2 3.36Å; I190-V194 PolarHBondContact O-N 2.96Å; C191-V194 PolarHBondContact O-N 2.81Å; L192-V194 PolarHBondContact O-N 3.27Å; V194-Q196 VanDerWaalsContact C-N 3.3Å; V194-Q196 PolarHBondContact O-N 3.46Å; V194-R197 PolarHBondContact O-N 3.01Å; V194-L199 HydrophobicContact CG2-CB 4.12Å; V194-L199 HydrophobicContact CG2-CD2 4.14Å; V194-L199 HydrophobicContact CG2-CG 4.28Å; V194-F201 HydrophobicContact CB-CB 4.38Å; V194-F201 HydrophobicContact CG1-CB 3.55Å; V194-F201 HydrophobicContact CG1-CD1 3.7Å; V194-F201 HydrophobicContact CG1-CG 3.84Å; V194-F201 HydrophobicContact CG2-CB 3.93Å; V194-F201 HydrophobicContact CG2-CG 4.38Å; V194-Y202 HydrophobicContact CG1-CD2 4.41Å; V194-Y202 HydrophobicContact CG1-CE2 3.73Å; V194-I255 HydrophobicContact CB-CD1 3.71Å; V194-I255 HydrophobicContact CG1-CD1 3.43Å; V194-I255 VanDerWaalsContact CG1-CD1 3.43Å; V194-I255 HydrophobicContact CG1-CG1 4.27Å; V194-I255 HydrophobicContact CG2-CD1 4.1Å
195	R	81.7	Confident	86.1	Confident	110 Å²	110	30.1 Å²	30.1	42%	0.415	14%	0.142	S	C	.	.	H	α-helix	trans	-59.8	-42.2	177.2	-173.1	-176.2	-179.2	99.4	-5.8	111.5	C191 L192 R197 E399 F553	C191-R195 WeakPolarHBondContact O-CB 3.09Å; C191-R195 PolarHBondContact O-N 3.13Å; L192-R195 CarbonylContact O-C 3.51Å; L192-R195 WeakPolarHBondContact O-CA 3.06Å; L192-R195 WeakPolarHBondContact O-CB 3.09Å; L192-R195 PolarHBondContact O-N 3.49Å; R195-R197 PolarHBondContact O-N 2.95Å; R195-E399 IonicContact CZ-OE1 3.83Å; R195-E399 IonicContact NE-OE1 2.99Å; R195-E399 IonicContact NH2-OE1 3.78Å; R195-E399 PolarHBondContact NH2-OE1 2.85Å; R195-F553 HydrophobicContact CB-CD2 4.43Å; R195-F553 HydrophobicContact CB-CE2 4.08Å; R195-F553 HydrophobicContact CG-CE2 4.17Å
196	Q	80.5	Confident	86	Confident	56 Å²	56	30.3 Å²	30.3	26%	0.262	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-0.9	176.2	-68.1	-177.7	-35.3	0	0	113.5	L192 V194 L198 V398	L192-Q196 HydrophobicContact CG-CG 4.38Å; L192-Q196 WeakPolarHBondContact O-CB 3.37Å; L192-Q196 WeakPolarHBondContact O-CG 3.48Å; L192-Q196 PolarHBondContact O-N 3.24Å; V194-Q196 VanDerWaalsContact C-N 3.3Å; V194-Q196 PolarHBondContact O-N 3.46Å; Q196-L198 HydrophobicContact CB-CD1 4.1Å; Q196-L198 HydrophobicContact CB-CG 3.91Å; Q196-L198 PolarHBondContact O-N 3.34Å; Q196-L198 VanDerWaalsContact O-N 3.13Å; Q196-V398 WeakPolarHBondContact CG-O 3.39Å
197	R	84.7	Confident	85.8	Confident	152 Å²	152	33.5 Å²	33.5	57%	0.574	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	21.4	-176.3	-53.1	179.6	170.2	-139.1	-11.3	113.7	L193 V194 R195 D204 T205	L193-R197 PolarHBondContact O-N 3.47Å; V194-R197 PolarHBondContact O-N 3.01Å; R195-R197 PolarHBondContact O-N 2.95Å; R197-D204 IonicContact CZ-OD2 3.89Å; R197-D204 VanDerWaalsContact CZ-OD2 3.26Å; R197-D204 IonicContact NH1-OD2 3.85Å; R197-D204 PolarHBondContact NH1-OD2 3.31Å; R197-D204 IonicContact NH2-OD2 2.69Å; R197-D204 PolarHBondContact NH2-OD2 2.95Å; R197-T205 HydrophobicContact CB-CG2 3.95Å; R197-T205 HydrophobicContact CG-CG2 4.16Å
198	L	85.7	Confident	85.5	Confident	52 Å²	52	38 Å²	38	27%	0.272	19%	0.187	S	C	.	.	S	Bend	trans	-83	-27.5	174.8	-64.7	179.9	0	0	0	111.7	L90 L193 Q196	L90-L198 HydrophobicContact CD1-CB 4.26Å; L90-L198 HydrophobicContact CD2-CB 4.36Å; L90-L198 HydrophobicContact CD2-CD1 4.24Å; L193-L198 HydrophobicContact CD2-CB 3.89Å; L193-L198 HydrophobicContact CD2-CD1 3.98Å; L193-L198 PolarHBondContact O-N 3.41Å; Q196-L198 HydrophobicContact CB-CD1 4.1Å; Q196-L198 HydrophobicContact CB-CG 3.91Å; Q196-L198 PolarHBondContact O-N 3.34Å; Q196-L198 VanDerWaalsContact O-N 3.13Å
199	L	89.5	Confident	85.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.223	C	C	.	.	S	Bend	trans	-110.3	115.7	171.9	-173.8	62.3	0	0	0	109.5	Q83 A86 L87 L171 I190 L193 V194 F201	Q83-L199 HydrophobicContact CB-CD1 3.9Å; Q83-L199 HydrophobicContact CG-CD1 4.16Å; Q83-L199 WeakPolarHBondContact O-CD1 3.33Å; A86-L199 HydrophobicContact CB-CD1 4.29Å; L87-L199 HydrophobicContact CD1-CD1 4.43Å; L87-L199 HydrophobicContact CD2-CD1 4.03Å; L87-L199 HydrophobicContact CG-CD1 3.85Å; L171-L199 HydrophobicContact CD2-CD2 3.57Å; L171-L199 HydrophobicContact CD2-CG 4.03Å; I190-L199 HydrophobicContact CD1-CD2 4.1Å; I190-L199 HydrophobicContact CG2-CD2 4.06Å; L193-L199 HydrophobicContact CB-CB 3.71Å; L193-L199 HydrophobicContact CB-CD2 4.45Å; L193-L199 PolarHBondContact O-N 2.91Å; L193-L199 VanDerWaalsContact O-N 3.11Å; V194-L199 HydrophobicContact CG2-CB 4.12Å; V194-L199 HydrophobicContact CG2-CD2 4.14Å; V194-L199 HydrophobicContact CG2-CG 4.28Å; L199-F201 PolarHBondContact O-N 3.06Å
200	P	90.2	Very high	84.9	Confident	15 Å²	15	46.3 Å²	46.3	10%	0.097	23%	0.227	C	C	.	.			trans	-58.1	129.8	-177.6	-28.3	35.7	0	0	0	113.1	Q83 A86 T205 F206	Q83-P200 WeakPolarHBondContact CG-O 3.47Å; Q83-P200 PolarHBondContact NE2-O 3.41Å; A86-P200 HydrophobicContact CB-CG 4.07Å; P200-T205 VanDerWaalsContact CA-OG1 3.28Å; P200-T205 WeakPolarHBondContact CA-OG1 3.34Å; P200-F206 VanDerWaalsContact C-CZ 3.49Å; P200-F206 HydrophobicContact CB-CD1 3.74Å; P200-F206 HydrophobicContact CB-CE1 3.41Å; P200-F206 VanDerWaalsContact CB-CE1 3.41Å; P200-F206 HydrophobicContact CB-CE2 4.34Å; P200-F206 HydrophobicContact CB-CG 4.33Å; P200-F206 HydrophobicContact CB-CZ 3.74Å; P200-F206 WeakPolarHBondContact O-CZ 3.4Å
201	F	88.1	Confident	84.3	Confident	8 Å²	8	50 Å²	50	4%	0.035	24%	0.241	C	C	.	.			trans	-156.3	-37	179.5	-177.3	-105.1	0	0	0	112.4	A167 L171 V194 L199 T205 N253 I255	A167-F201 HydrophobicContact CB-CD2 3.97Å; A167-F201 HydrophobicContact CB-CE2 3.59Å; A167-F201 HydrophobicContact CB-CZ 4.34Å; L171-F201 HydrophobicContact CD1-CD2 3.32Å; L171-F201 HydrophobicContact CD1-CE2 3.41Å; L171-F201 VanDerWaalsContact CD1-CE2 3.41Å; L171-F201 HydrophobicContact CD1-CG 4.08Å; L171-F201 HydrophobicContact CD1-CZ 4.23Å; L171-F201 HydrophobicContact CD2-CD2 4.24Å; L171-F201 HydrophobicContact CG-CD2 3.73Å; L171-F201 HydrophobicContact CG-CE2 4.01Å; V194-F201 HydrophobicContact CB-CB 4.38Å; V194-F201 HydrophobicContact CG1-CB 3.55Å; V194-F201 HydrophobicContact CG1-CD1 3.7Å; V194-F201 HydrophobicContact CG1-CG 3.84Å; V194-F201 HydrophobicContact CG2-CB 3.93Å; V194-F201 HydrophobicContact CG2-CG 4.38Å; L199-F201 PolarHBondContact O-N 3.06Å; F201-T205 PolarHBondContact N-OG1 3.12Å; F201-N253 WeakPolarHBondContact CE1-O 3.29Å; F201-I255 HydrophobicContact CD1-CD1 4.33Å; F201-I255 HydrophobicContact CD1-CG1 4.1Å; F201-I255 HydrophobicContact CE1-CD1 4.2Å; F201-I255 HydrophobicContact CE1-CG1 3.58Å; F201-I255 HydrophobicContact CZ-CG1 4.07Å
202	Y	83.5	Confident	83.8	Confident	57 Å²	57	53.9 Å²	53.9	22%	0.224	26%	0.259	C	S	.	.	S	Bend	trans	-82.8	148.9	172.1	-56.4	-67	0	0	0	110.3	V194 D204 T205 F206	V194-Y202 HydrophobicContact CG1-CD2 4.41Å; V194-Y202 HydrophobicContact CG1-CE2 3.73Å; Y202-D204 WeakPolarHBondContact CB-OD1 3.04Å; Y202-D204 PolarHBondContact O-N 2.89Å; Y202-D204 VanDerWaalsContact O-N 3.12Å; Y202-T205 PolarHBondContact N-OG1 3.29Å; Y202-T205 PolarHBondContact O-N 3.48Å; Y202-T205 PolarHBondContact O-OG1 3.28Å; Y202-F206 WeakPolarHBondContact O-CD2 3.39Å; Y202-F206 WeakPolarHBondContact O-CE2 3.4Å
203	A	79.6	Confident	83.5	Confident	32 Å²	32	55.6 Å²	55.6	26%	0.264	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-56.3	-34.2	-174.8	0	0	0	0	0	113.2	T205 F206 R211 F215	A203-T205 VanDerWaalsContact C-N 3.26Å; A203-T205 PolarHBondContact O-N 3.34Å; A203-F206 PolarHBondContact O-N 2.92Å; A203-R211 HydrophobicContact CB-CG 4.4Å; A203-R211 WeakPolarHBondContact O-CD 3.43Å; A203-R211 WeakPolarHBondContact O-CG 3.01Å; A203-F215 HydrophobicContact CB-CD1 4.41Å; A203-F215 HydrophobicContact CB-CD2 4.26Å; A203-F215 HydrophobicContact CB-CE2 4.44Å; A203-F215 HydrophobicContact CB-CG 4.23Å
204	D	80.6	Confident	82.8	Confident	89 Å²	89	56.6 Å²	56.6	48%	0.476	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-74.2	-11.2	177.9	62.4	-35.7	0	0	0	114.2	R197 Y202	R197-D204 IonicContact CZ-OD2 3.89Å; R197-D204 VanDerWaalsContact CZ-OD2 3.26Å; R197-D204 IonicContact NH1-OD2 3.85Å; R197-D204 PolarHBondContact NH1-OD2 3.31Å; R197-D204 IonicContact NH2-OD2 2.69Å; R197-D204 PolarHBondContact NH2-OD2 2.95Å; Y202-D204 WeakPolarHBondContact CB-OD1 3.04Å; Y202-D204 PolarHBondContact O-N 2.89Å; Y202-D204 VanDerWaalsContact O-N 3.12Å
205	T	82.4	Confident	82	Confident	30 Å²	30	57.7 Å²	57.7	18%	0.184	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-91.6	-6.8	175.9	61.2	0	0	0	0	113.6	R197 P200 F201 Y202 A203	R197-T205 HydrophobicContact CB-CG2 3.95Å; R197-T205 HydrophobicContact CG-CG2 4.16Å; P200-T205 VanDerWaalsContact CA-OG1 3.28Å; P200-T205 WeakPolarHBondContact CA-OG1 3.34Å; F201-T205 PolarHBondContact N-OG1 3.12Å; Y202-T205 PolarHBondContact N-OG1 3.29Å; Y202-T205 PolarHBondContact O-N 3.48Å; Y202-T205 PolarHBondContact O-OG1 3.28Å; A203-T205 VanDerWaalsContact C-N 3.26Å; A203-T205 PolarHBondContact O-N 3.34Å
206	F	84.8	Confident	81.3	Confident	7 Å²	7	54 Å²	54	3%	0.031	28%	0.281	C	S	.	.	S	Bend	trans	-97.2	148	177.7	-67.2	-78.5	0	0	0	111.8	I79 C82 P200 Y202 A203 V210 R211 F215	I79-F206 HydrophobicContact CB-CE1 4.17Å; I79-F206 HydrophobicContact CB-CZ 4.38Å; I79-F206 HydrophobicContact CG1-CE1 4.05Å; I79-F206 HydrophobicContact CG1-CZ 4.14Å; I79-F206 HydrophobicContact CG2-CE1 3.84Å; I79-F206 HydrophobicContact CG2-CZ 3.71Å; C82-F206 HydrophobicContact CB-CD1 3.96Å; C82-F206 HydrophobicContact CB-CE1 4.05Å; P200-F206 VanDerWaalsContact C-CZ 3.49Å; P200-F206 HydrophobicContact CB-CD1 3.74Å; P200-F206 HydrophobicContact CB-CE1 3.41Å; P200-F206 VanDerWaalsContact CB-CE1 3.41Å; P200-F206 HydrophobicContact CB-CE2 4.34Å; P200-F206 HydrophobicContact CB-CG 4.33Å; P200-F206 HydrophobicContact CB-CZ 3.74Å; P200-F206 WeakPolarHBondContact O-CZ 3.4Å; Y202-F206 WeakPolarHBondContact O-CD2 3.39Å; Y202-F206 WeakPolarHBondContact O-CE2 3.4Å; A203-F206 PolarHBondContact O-N 2.92Å; F206-V210 HydrophobicContact CB-CB 4.32Å; F206-V210 HydrophobicContact CB-CG1 4.3Å; F206-V210 HydrophobicContact CD1-CG1 3.99Å; F206-V210 HydrophobicContact CG-CG1 4.32Å; F206-R211 HydrophobicContact CB-CB 4.5Å; F206-F215 AromaticContact CD2-CE2 3.71Å; F206-F215 HydrophobicContact CD2-CE2 3.71Å; F206-F215 HydrophobicContact CD2-CZ 4.08Å; F206-F215 HydrophobicContact CE2-CE2 4.02Å; F206-F215 AromaticContact CE2-CZ 3.94Å; F206-F215 HydrophobicContact CE2-CZ 3.94Å; F206-F215 HydrophobicContact CG-CE2 4.42Å
207	P	86.1	Confident	80.1	Confident	70 Å²	70	61.2 Å²	61.2	46%	0.455	31%	0.306	S	S	.	.			trans	-54	149.8	168.6	-23.2	33.2	0	0	0	111.8	E209 V210 R211	P207-E209 PolarHBondContact O-N 3.4Å; P207-E209 VanDerWaalsContact O-N 3.13Å; P207-V210 PolarHBondContact O-N 3.34Å; P207-R211 WeakPolarHBondContact O-CB 3.5Å; P207-R211 PolarHBondContact O-N 2.91Å
208	D	83.7	Confident	78.3	Confident	95 Å²	95	64 Å²	64	51%	0.508	32%	0.317	S	S	.	.	H	α-helix	trans	-53.7	-38.2	-175.2	-70.2	-6.5	0	0	0	112.9	R211 E212	D208-R211 PolarHBondContact O-N 3.14Å; D208-R211 IonicContact OD1-CZ 3.76Å; D208-R211 IonicContact OD1-NH1 3.26Å; D208-R211 PolarHBondContact OD1-NH1 3.5Å; D208-R211 IonicContact OD1-NH2 2.68Å; D208-R211 PolarHBondContact OD1-NH2 3.14Å; D208-R211 IonicContact OD2-NH2 3.23Å; D208-E212 WeakPolarHBondContact O-CB 3.28Å; D208-E212 WeakPolarHBondContact O-CG 3.47Å; D208-E212 PolarHBondContact O-N 3.02Å
209	E	83.2	Confident	76.3	Confident	165 Å²	165	65.7 Å²	65.7	77%	0.771	33%	0.333	S	S	*	.	H	α-helix	trans	-62.3	-47	177.8	-62.1	176.7	-178	0	0	112.7	P207 R211 S213	P207-E209 PolarHBondContact O-N 3.4Å; P207-E209 VanDerWaalsContact O-N 3.13Å; E209-R211 VanDerWaalsContact C-N 3.35Å; E209-S213 WeakPolarHBondContact O-CB 3.5Å; E209-S213 PolarHBondContact O-N 3.19Å; E209-S213 PolarHBondContact O-OG 3.28Å
210	V	81.2	Confident	74	Confident	17 Å²	17	70.8 Å²	70.8	10%	0.103	36%	0.355	C	S	.	.	H	α-helix	trans	-71.2	-36.9	177.3	-179.3	0	0	0	0	110	A78 I79 F206 P207 S213 A214	A78-V210 HydrophobicContact CB-CG1 4.14Å; A78-V210 HydrophobicContact CB-CG2 4.19Å; I79-V210 HydrophobicContact CG1-CG1 4.08Å; F206-V210 HydrophobicContact CB-CB 4.32Å; F206-V210 HydrophobicContact CB-CG1 4.3Å; F206-V210 HydrophobicContact CD1-CG1 3.99Å; F206-V210 HydrophobicContact CG-CG1 4.32Å; P207-V210 PolarHBondContact O-N 3.34Å; V210-S213 VanDerWaalsContact CA-OG 3.32Å; V210-S213 WeakPolarHBondContact CA-OG 3.39Å; V210-S213 PolarHBondContact O-OG 3.46Å; V210-S213 VanDerWaalsContact O-OG 3.09Å; V210-A214 WeakPolarHBondContact O-CB 3.4Å; V210-A214 PolarHBondContact O-N 3.29Å
211	R	78.3	Confident	71.6	Confident	79 Å²	79	76 Å²	76	30%	0.298	38%	0.381	S	S	.	.	H	α-helix	trans	-62.8	-49.1	177.5	-169.7	177.5	68.3	-134.8	-3.6	111.5	A203 F206 P207 D208 E209 F215 G216	A203-R211 HydrophobicContact CB-CG 4.4Å; A203-R211 WeakPolarHBondContact O-CD 3.43Å; A203-R211 WeakPolarHBondContact O-CG 3.01Å; F206-R211 HydrophobicContact CB-CB 4.5Å; P207-R211 WeakPolarHBondContact O-CB 3.5Å; P207-R211 PolarHBondContact O-N 2.91Å; D208-R211 PolarHBondContact O-N 3.14Å; D208-R211 IonicContact OD1-CZ 3.76Å; D208-R211 IonicContact OD1-NH1 3.26Å; D208-R211 PolarHBondContact OD1-NH1 3.5Å; D208-R211 IonicContact OD1-NH2 2.68Å; D208-R211 PolarHBondContact OD1-NH2 3.14Å; D208-R211 IonicContact OD2-NH2 3.23Å; E209-R211 VanDerWaalsContact C-N 3.35Å; R211-F215 HydrophobicContact CG-CD2 4.35Å; R211-F215 WeakPolarHBondContact O-CA 3.31Å; R211-F215 VanDerWaalsContact O-CB 3.3Å; R211-F215 WeakPolarHBondContact O-CB 3.44Å; R211-F215 PolarHBondContact O-N 3.11Å; R211-G216 PolarHBondContact O-N 3.48Å
212	E	78.9	Confident	69.2	Low	82 Å²	82	79.4 Å²	79.4	38%	0.383	40%	0.402	S	S	.	.	H	α-helix	trans	-67.7	-38.6	179.7	-75.7	-168.1	-165.8	0	0	112.6	D208 G216 R217	D208-E212 WeakPolarHBondContact O-CB 3.28Å; D208-E212 WeakPolarHBondContact O-CG 3.47Å; D208-E212 PolarHBondContact O-N 3.02Å; E212-G216 CarbonylContact O-C 3.6Å; E212-G216 WeakPolarHBondContact O-CA 3.28Å; E212-G216 PolarHBondContact O-N 3.06Å; E212-R217 HydrophobicContact CB-CG 4.49Å; E212-R217 HydrophobicContact CG-CG 3.96Å; E212-R217 WeakPolarHBondContact OE2-CG 3.46Å; E212-R217 IonicContact OE2-CZ 3.59Å; E212-R217 IonicContact OE2-NE 3.23Å; E212-R217 PolarHBondContact OE2-NE 3.26Å; E212-R217 IonicContact OE2-NH2 3.83Å
213	S	76.8	Confident	66.7	Low	47 Å²	47	86.3 Å²	86.3	33%	0.329	43%	0.429	S	S	.	.	H	α-helix	trans	-71.7	-50.2	179.2	54.4	0	0	0	0	112.1	N75 E209 V210	N75-S213 VanDerWaalsContact CG-O 3.3Å; N75-S213 PolarHBondContact ND2-O 3.28Å; N75-S213 VanDerWaalsContact OD1-C 3.26Å; N75-S213 WeakPolarHBondContact OD1-CB 3.41Å; N75-S213 PolarHBondContact OD1-O 3Å; E209-S213 WeakPolarHBondContact O-CB 3.5Å; E209-S213 PolarHBondContact O-N 3.19Å; E209-S213 PolarHBondContact O-OG 3.28Å; V210-S213 VanDerWaalsContact CA-OG 3.32Å; V210-S213 WeakPolarHBondContact CA-OG 3.39Å; V210-S213 PolarHBondContact O-OG 3.46Å; V210-S213 VanDerWaalsContact O-OG 3.09Å
214	A	72.8	Confident	64.3	Low	25 Å²	25	90.7 Å²	90.7	21%	0.207	44%	0.444	C	S	.	.	H	α-helix	trans	-79.4	-36.1	-174.9	0	0	0	0	0	114	N75 I79 V210	N75-A214 HydrophobicContact CB-CB 3.88Å; I79-A214 HydrophobicContact CD1-CB 3.82Å; I79-A214 HydrophobicContact CG1-CB 4.19Å; V210-A214 WeakPolarHBondContact O-CB 3.4Å; V210-A214 PolarHBondContact O-N 3.29Å
215	F	70.6	Confident	62.1	Low	24 Å²	24	89.5 Å²	89.5	11%	0.105	44%	0.437	C	S	.	.	H	α-helix	trans	-112.7	-7.8	-176	-53	-87.2	0	0	0	113.5	I79 A203 F206 R211 F220	I79-F215 HydrophobicContact CD1-CE2 4.35Å; I79-F215 HydrophobicContact CD1-CZ 4.14Å; A203-F215 HydrophobicContact CB-CD1 4.41Å; A203-F215 HydrophobicContact CB-CD2 4.26Å; A203-F215 HydrophobicContact CB-CE2 4.44Å; A203-F215 HydrophobicContact CB-CG 4.23Å; F206-F215 AromaticContact CD2-CE2 3.71Å; F206-F215 HydrophobicContact CD2-CE2 3.71Å; F206-F215 HydrophobicContact CD2-CZ 4.08Å; F206-F215 HydrophobicContact CE2-CE2 4.02Å; F206-F215 AromaticContact CE2-CZ 3.94Å; F206-F215 HydrophobicContact CE2-CZ 3.94Å; F206-F215 HydrophobicContact CG-CE2 4.42Å; R211-F215 HydrophobicContact CG-CD2 4.35Å; R211-F215 WeakPolarHBondContact O-CA 3.31Å; R211-F215 VanDerWaalsContact O-CB 3.3Å; R211-F215 WeakPolarHBondContact O-CB 3.44Å; R211-F215 PolarHBondContact O-N 3.11Å; F215-F220 HydrophobicContact CB-CB 4.35Å; F215-F220 HydrophobicContact CB-CD2 4.27Å; F215-F220 WeakPolarHBondContact O-CD2 3.35Å
216	G	67.2	Low	59.9	Low	32 Å²	32	92.9 Å²	92.9	33%	0.33	46%	0.458	S	S	.	.			trans	81.8	156.4	-177.3	0	0	0	0	0	113.9	R211 E212 R218	R211-G216 PolarHBondContact O-N 3.48Å; E212-G216 CarbonylContact O-C 3.6Å; E212-G216 WeakPolarHBondContact O-CA 3.28Å; E212-G216 PolarHBondContact O-N 3.06Å; G216-R218 PolarHBondContact O-N 3.19Å
217	R	54.6	Low	57.4	Low	207 Å²	207	102.9 Å²	102.9	78%	0.781	50%	0.496	S	S	*	.	S	Bend	trans	-61.4	-25.9	174.4	-84.3	-171.9	-175.8	179.5	5.2	114.2	E212 S219	E212-R217 HydrophobicContact CB-CG 4.49Å; E212-R217 HydrophobicContact CG-CG 3.96Å; E212-R217 WeakPolarHBondContact OE2-CG 3.46Å; E212-R217 IonicContact OE2-CZ 3.59Å; E212-R217 IonicContact OE2-NE 3.23Å; E212-R217 PolarHBondContact OE2-NE 3.26Å; E212-R217 IonicContact OE2-NH2 3.83Å; R217-S219 PolarHBondContact O-N 3.16Å; R217-S219 VanDerWaalsContact O-N 3.08Å
218	R	46.7	Very low	55	Low	211 Å²	211	103.3 Å²	103.3	80%	0.796	50%	0.497	S	S	*	.	S	Bend	trans	-83.8	83.2	169.7	-67.4	-177	-175.5	167.3	1.7	106.1	G216 F220	G216-R218 PolarHBondContact O-N 3.19Å; R218-F220 PolarHBondContact O-N 3.1Å
219	S	44.4	Very low	52.8	Low	87 Å²	87	102 Å²	102	61%	0.608	49%	0.493	S	S	*	.			trans	-23.5	113.7	165.5	32	0	0	0	0	109.9	R217 I221	R217-S219 PolarHBondContact O-N 3.16Å; R217-S219 VanDerWaalsContact O-N 3.08Å; S219-I221 PolarHBondContact O-N 3.09Å
220	F	40.2	Very low	50.5	Low	107 Å²	107	102.3 Å²	102.3	47%	0.469	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	21.9	-172.5	-144.4	-96.2	0	0	0	114.6	F215 R218 V222	F215-F220 HydrophobicContact CB-CB 4.35Å; F215-F220 HydrophobicContact CB-CD2 4.27Å; F215-F220 WeakPolarHBondContact O-CD2 3.35Å; R218-F220 PolarHBondContact O-N 3.1Å; F220-V222 VanDerWaalsContact C-N 3.28Å; F220-V222 PolarHBondContact O-N 3.32Å
221	I	39.7	Very low	48.3	Very low	124 Å²	124	109.3 Å²	109.3	64%	0.636	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-24.9	-172.1	-62.5	-175.5	0	0	0	111.1	S219	S219-I221 PolarHBondContact O-N 3.09Å
222	V	38.2	Very low	46.3	Very low	81 Å²	81	112.6 Å²	112.6	49%	0.491	54%	0.537	S	S	.	.	S	Bend	trans	-148.8	-20.3	-175.3	-162.9	0	0	0	0	118.2	F220 E224 L225	F220-V222 VanDerWaalsContact C-N 3.28Å; F220-V222 PolarHBondContact O-N 3.32Å; V222-E224 PolarHBondContact O-N 3.32Å; V222-L225 WeakPolarHBondContact O-CB 3.45Å; V222-L225 PolarHBondContact O-N 2.94Å
223	Y	30.2	Very low	44.3	Very low	201 Å²	201	113.7 Å²	113.7	79%	0.788	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-81.3	-22.8	-152.5	-106.9	-87.8	0	0	0	119.7	L225	Y223-L225 VanDerWaalsContact C-N 3.29Å
224	E	30.7	Very low	42.6	Very low	125 Å²	125	122.9 Å²	122.9	58%	0.584	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-83.3	-5.6	172.2	-100.9	-72.5	137.2	0	0	112.8	V222 V226 V228	V222-E224 PolarHBondContact O-N 3.32Å; E224-V226 PolarHBondContact O-N 2.72Å; E224-V228 WeakPolarHBondContact OE2-CG2 3.48Å
225	L	33.4	Very low	40.8	Very low	63 Å²	63	126.1 Å²	126.1	33%	0.33	59%	0.593	S	S	.	*	G	3₁₀ helix	trans	-70.5	-14.2	179.2	-102.6	103.5	0	0	0	114.5	V222 Y223 T229 S250	V222-L225 WeakPolarHBondContact O-CB 3.45Å; V222-L225 PolarHBondContact O-N 2.94Å; Y223-L225 VanDerWaalsContact C-N 3.29Å; L225-T229 PolarHBondContact O-OG1 3.26Å; L225-S250 VanDerWaalsContact CD2-N 3.35Å
226	V	35.6	Very low	39	Very low	102 Å²	102	130.9 Å²	130.9	62%	0.618	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-29.2	-175.7	-179.8	0	0	0	0	112.9	E224	E224-V226 PolarHBondContact O-N 2.72Å
227	R	32.8	Very low	37.6	Very low	216 Å²	216	133.4 Å²	133.4	82%	0.815	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-34.3	-171.5	-92.5	-169.9	176.3	-172.7	-0.7	116
228	V	35.4	Very low	37	Very low	80 Å²	80	127 Å²	127	49%	0.485	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.6	-25.1	-178	-177.6	0	0	0	0	112	E224 E230 F231 Y232	E224-V228 WeakPolarHBondContact OE2-CG2 3.48Å; V228-E230 PolarHBondContact O-N 3.04Å; V228-F231 PolarHBondContact O-N 2.88Å; V228-Y232 HydrophobicContact CG1-CD2 4.39Å; V228-Y232 PolarHBondContact O-N 3.09Å
229	T	37.5	Very low	36.7	Very low	68 Å²	68	124.5 Å²	124.5	42%	0.417	62%	0.618	S	S	.	*	H	α-helix	trans	-72.5	-29.7	-173.7	-34.4	0	0	0	0	113	L225 I233	L225-T229 PolarHBondContact O-OG1 3.26Å; T229-I233 HydrophobicContact CG2-CD1 3.55Å; T229-I233 HydrophobicContact CG2-CG1 4.27Å; T229-I233 WeakPolarHBondContact O-CG1 3.45Å
230	E	36.6	Very low	36.5	Very low	170 Å²	170	124.3 Å²	124.3	79%	0.794	61%	0.613	S	S	*	*	H	α-helix	trans	-72.9	-28.8	174.7	-98.3	-171.2	155.2	0	0	113.3	V228	V228-E230 PolarHBondContact O-N 3.04Å
231	F	35	Very low	36.2	Very low	164 Å²	164	122.8 Å²	122.8	72%	0.719	61%	0.607	S	S	*	*	H	α-helix	trans	-86.9	-31.4	-172.3	-161	-100.5	0	0	0	113.6	V228	V228-F231 PolarHBondContact O-N 2.88Å
232	Y	34.8	Very low	36.3	Very low	148 Å²	148	119.1 Å²	119.1	58%	0.58	59%	0.589	S	S	*	*	H	α-helix	trans	-99.3	-16.3	-174.1	-93.3	-86.9	0	0	0	115.7	V228 R234 S235	V228-Y232 HydrophobicContact CG1-CD2 4.39Å; V228-Y232 PolarHBondContact O-N 3.09Å; Y232-R234 PolarHBondContact O-N 3.19Å; Y232-S235 PolarHBondContact O-N 3.37Å
233	I	36.8	Very low	36.3	Very low	105 Å²	105	121.9 Å²	121.9	54%	0.538	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.2	-15.8	-178.6	-74.1	-175.2	0	0	0	113	T229	T229-I233 HydrophobicContact CG2-CD1 3.55Å; T229-I233 HydrophobicContact CG2-CG1 4.27Å; T229-I233 WeakPolarHBondContact O-CG1 3.45Å
234	R	41.2	Very low	36.5	Very low	240 Å²	240	116.5 Å²	116.5	91%	0.906	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-7.6	176	-81.9	-174.1	174.6	164.4	0.5	115.5	Y232	Y232-R234 PolarHBondContact O-N 3.19Å
235	S	35.9	Very low	36.5	Very low	93 Å²	93	113.8 Å²	113.8	65%	0.65	57%	0.568	S	S	*	*	S	Bend	trans	-127	11.7	-165.9	-52.5	0	0	0	0	116.3	Y232	Y232-S235 PolarHBondContact O-N 3.37Å
236	L	33	Very low	36.5	Very low	125 Å²	125	119.6 Å²	119.6	65%	0.654	59%	0.594	S	S	*	*	S	Bend	trans	-116	132.7	178.8	-77.9	164.6	0	0	0	113.2
237	P	38	Very low	36.5	Very low	84 Å²	84	120.4 Å²	120.4	55%	0.545	60%	0.595	S	S	.	*			trans	-60.8	146.1	180	-21.1	31.3	0	0	0	113.2	E239 V240	P237-E239 PolarHBondContact O-N 2.83Å; P237-V240 PolarHBondContact O-N 3.45Å
238	A	41.7	Very low	36.7	Very low	74 Å²	74	117.1 Å²	117.1	61%	0.612	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-56.9	-17.3	-171.9	0	0	0	0	0	115.6	V240 H241	A238-V240 PolarHBondContact O-N 2.88Å; A238-V240 VanDerWaalsContact O-N 3.17Å; A238-H241 PolarHBondContact O-N 3.36Å
239	E	38.7	Very low	36.7	Very low	157 Å²	157	117.1 Å²	117.1	73%	0.734	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-71.9	-7.2	-173.8	-67.8	153.4	178.6	0	0	114.3	P237	P237-E239 PolarHBondContact O-N 2.83Å
240	V	41.7	Very low	36.6	Very low	83 Å²	83	116.7 Å²	116.7	50%	0.503	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-102.7	-0.4	178	-172.5	0	0	0	0	112.4	P237 A238 L242	P237-V240 PolarHBondContact O-N 3.45Å; A238-V240 PolarHBondContact O-N 2.88Å; A238-V240 VanDerWaalsContact O-N 3.17Å; V240-L242 PolarHBondContact O-N 3.45Å
241	H	33.6	Very low	36.8	Very low	75 Å²	75	111.4 Å²	111.4	35%	0.347	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-71.7	-22.4	-171.1	-88.7	-49.3	0	0	0	116.1	A238 H244 T245 R248	A238-H241 PolarHBondContact O-N 3.36Å; H241-H244 CarbonylContact O-C 3.5Å; H241-H244 WeakPolarHBondContact O-CA 3.27Å; H241-H244 WeakPolarHBondContact O-CB 3.2Å; H241-H244 PolarHBondContact O-N 3.34Å; H241-T245 WeakPolarHBondContact O-CG2 3.4Å; H241-T245 PolarHBondContact O-N 3.45Å; H241-T245 VanDerWaalsContact O-N 3.17Å; H241-T245 PolarHBondContact O-OG1 2.88Å; H241-R248 PolarHBondContact ND1-NH2 2.87Å
242	L	42.1	Very low	37.4	Very low	48 Å²	48	107.8 Å²	107.8	25%	0.251	56%	0.556	S	S	.	*	G	3₁₀ helix	trans	-84.3	-14.6	-171.8	-80.8	109.8	0	0	0	117.7	V240 H244 S522 D523	V240-L242 PolarHBondContact O-N 3.45Å; L242-H244 PolarHBondContact O-N 2.82Å; L242-S522 VanDerWaalsContact CD1-OG 3.29Å; L242-S522 WeakPolarHBondContact CD1-OG 3.49Å; L242-D523 HydrophobicContact CD1-CB 4.05Å; L242-D523 WeakPolarHBondContact CD1-OD1 3.16Å; L242-D523 VanDerWaalsContact CD1-OD2 3.27Å; L242-D523 WeakPolarHBondContact CD1-OD2 3.22Å; L242-D523 HydrophobicContact CD2-CB 4.37Å; L242-D523 WeakPolarHBondContact CD2-OD1 3.35Å; L242-D523 VanDerWaalsContact CG-OD1 3.29Å; L242-D523 WeakPolarHBondContact CG-OD1 3.47Å
243	F	37.2	Very low	38.1	Very low	138 Å²	138	103.8 Å²	103.8	61%	0.605	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-79.9	3.2	162.3	-68.8	-71.4	0	0	0	111.9
244	H	35	Very low	39.2	Very low	89 Å²	89	103.8 Å²	103.8	41%	0.412	54%	0.541	S	S	.	.	S	Bend	trans	-127.6	1.4	-172.8	-90	-78.2	0	0	0	114.7	H241 L242 R248 R256	H241-H244 CarbonylContact O-C 3.5Å; H241-H244 WeakPolarHBondContact O-CA 3.27Å; H241-H244 WeakPolarHBondContact O-CB 3.2Å; H241-H244 PolarHBondContact O-N 3.34Å; L242-H244 PolarHBondContact O-N 2.82Å; H244-R248 VanDerWaalsContact O-CG 3.28Å; H244-R248 WeakPolarHBondContact O-CG 3.12Å; H244-R248 PolarHBondContact O-NE 3.37Å; H244-R256 PolarHBondContact CE1-NH2 3.04Å; H244-R256 PolarHBondContact NE2-NH1 3.08Å
245	T	31.5	Very low	40	Very low	68 Å²	68	93 Å²	93	42%	0.417	50%	0.501	S	S	.	.			trans	-114.8	62.1	179.2	51.6	0	0	0	0	111.2	H241	H241-T245 WeakPolarHBondContact O-CG2 3.4Å; H241-T245 PolarHBondContact O-N 3.45Å; H241-T245 VanDerWaalsContact O-N 3.17Å; H241-T245 PolarHBondContact O-OG1 2.88Å
246	E	32.7	Very low	41.6	Very low	185 Å²	185	94.1 Å²	94.1	86%	0.864	49%	0.491	S	S	*	.	S	Bend	trans	-156.7	115.5	151.6	-104.8	162.8	-154.6	0	0	105
247	D	35	Very low	43.8	Very low	119 Å²	119	88.9 Å²	88.9	64%	0.636	46%	0.464	S	S	*	.			trans	61.9	79.1	-171.9	-85.3	-15.3	0	0	0	118.2	S249	D247-S249 VanDerWaalsContact C-N 3.28Å; D247-S249 PolarHBondContact O-N 3.24Å
248	R	37.2	Very low	45.9	Very low	147 Å²	147	84.9 Å²	84.9	56%	0.555	44%	0.438	S	S	*	.			trans	-81.8	13.1	174.3	-76.2	-171.3	175.9	-175.8	2.3	115.5	H241 H244	H241-R248 PolarHBondContact ND1-NH2 2.87Å; H244-R248 VanDerWaalsContact O-CG 3.28Å; H244-R248 WeakPolarHBondContact O-CG 3.12Å; H244-R248 PolarHBondContact O-NE 3.37Å
249	S	35.4	Very low	47.8	Very low	79 Å²	79	81.5 Å²	81.5	55%	0.552	41%	0.41	S	S	*	.	S	Bend	trans	-109	118	167.8	48.3	0	0	0	0	109.7	D247	D247-S249 VanDerWaalsContact C-N 3.28Å; D247-S249 PolarHBondContact O-N 3.24Å
250	S	36.2	Very low	49.9	Very low	59 Å²	59	75.8 Å²	75.8	41%	0.413	39%	0.385	S	S	.	.	S	Bend	trans	66.5	66.7	162.5	44.1	0	0	0	0	119	L225	L225-S250 VanDerWaalsContact CD2-N 3.35Å
251	Q	39.5	Very low	52	Low	59 Å²	59	72 Å²	72	28%	0.276	36%	0.362	S	S	.	.			trans	-148.7	57.6	174.5	-58.6	-171.5	12.7	0	0	116.6	K254	Q251-K254 HydrophobicContact CB-CB 4.44Å; Q251-K254 HydrophobicContact CB-CD 4.34Å; Q251-K254 HydrophobicContact CB-CG 4.14Å; Q251-K254 VanDerWaalsContact CD-CD 3.45Å; Q251-K254 HydrophobicContact CG-CD 3.75Å; Q251-K254 HydrophobicContact CG-CG 4.06Å
252	S	47.3	Very low	54.5	Low	88 Å²	88	68.5 Å²	68.5	62%	0.615	35%	0.346	S	S	*	.	S	Bend	trans	-76.1	-21	170.6	60.7	0	0	0	0	113.9
253	N	50.2	Low	56.4	Low	64 Å²	64	69.6 Å²	69.6	34%	0.342	35%	0.347	S	S	.	.	S	Bend	trans	-120.4	22.4	-175.1	-72.9	-16.1	0	0	0	114.5	F201	F201-N253 WeakPolarHBondContact CE1-O 3.29Å
254	K	60.8	Low	58.6	Low	106 Å²	106	65.3 Å²	65.3	46%	0.461	33%	0.328	S	S	.	.			trans	-84.3	130.5	170.2	-66.9	-159.7	-171	166.6	0	110.2	Q251 R256	Q251-K254 HydrophobicContact CB-CB 4.44Å; Q251-K254 HydrophobicContact CB-CD 4.34Å; Q251-K254 HydrophobicContact CB-CG 4.14Å; Q251-K254 VanDerWaalsContact CD-CD 3.45Å; Q251-K254 HydrophobicContact CG-CD 3.75Å; Q251-K254 HydrophobicContact CG-CG 4.06Å; K254-R256 PolarHBondContact O-N 2.95Å
255	I	56.9	Low	61.2	Low	14 Å²	14	61 Å²	61	7%	0.072	31%	0.308	C	S	.	.			trans	-62.1	112.1	165.9	-53.2	-171.8	0	0	0	106.5	L171 V194 F201 V261 F553	L171-I255 HydrophobicContact CD1-CD1 4.36Å; V194-I255 HydrophobicContact CB-CD1 3.71Å; V194-I255 HydrophobicContact CG1-CD1 3.43Å; V194-I255 VanDerWaalsContact CG1-CD1 3.43Å; V194-I255 HydrophobicContact CG1-CG1 4.27Å; V194-I255 HydrophobicContact CG2-CD1 4.1Å; F201-I255 HydrophobicContact CD1-CD1 4.33Å; F201-I255 HydrophobicContact CD1-CG1 4.1Å; F201-I255 HydrophobicContact CE1-CD1 4.2Å; F201-I255 HydrophobicContact CE1-CG1 3.58Å; F201-I255 HydrophobicContact CZ-CG1 4.07Å; I255-V261 HydrophobicContact CG2-CG2 3.25Å; I255-F553 HydrophobicContact CB-CE1 3.58Å; I255-F553 HydrophobicContact CB-CZ 3.79Å; I255-F553 HydrophobicContact CG2-CD1 3.83Å; I255-F553 HydrophobicContact CG2-CE1 3.2Å; I255-F553 HydrophobicContact CG2-CZ 3.92Å; I255-F553 WeakPolarHBondContact O-CE1 3.3Å; I255-F553 WeakPolarHBondContact O-CZ 3.4Å
256	R	69.4	Low	63.7	Low	115 Å²	115	57.8 Å²	57.8	43%	0.434	29%	0.288	S	S	.	.			trans	-79.6	-46.9	-172.4	-67.6	-169.5	-179.3	177.7	2.3	112.8	H244 K254	H244-R256 PolarHBondContact CE1-NH2 3.04Å; H244-R256 PolarHBondContact NE2-NH1 3.08Å; K254-R256 PolarHBondContact O-N 2.95Å
257	S	79.2	Confident	66	Low	15 Å²	15	53 Å²	53	11%	0.105	27%	0.268	C	S	.	.			trans	-165.2	153.6	-178.6	63.4	0	0	0	0	110.1	S259 N260 V261 F553	S257-S259 VanDerWaalsContact C-N 3.3Å; S257-S259 PolarHBondContact O-N 3.22Å; S257-N260 WeakPolarHBondContact O-CB 3.49Å; S257-N260 PolarHBondContact O-N 3.3Å; S257-N260 VanDerWaalsContact O-N 3.1Å; S257-V261 PolarHBondContact O-N 3.39Å; S257-V261 VanDerWaalsContact O-N 3.15Å; S257-F553 CarbonylContact C-O 3.45Å
258	L	83.5	Confident	68.3	Low	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-51.9	-46.7	174.9	178.1	65.4	0	0	0	112.4	V187 N260 V261 Y262 P335 L552 F553 C554	V187-L258 HydrophobicContact CB-CD1 3.95Å; V187-L258 HydrophobicContact CG1-CD1 3.71Å; L258-N260 PolarHBondContact O-N 3.21Å; L258-V261 PolarHBondContact O-N 3.4Å; L258-V261 VanDerWaalsContact O-N 3.08Å; L258-Y262 WeakPolarHBondContact O-CB 3.27Å; L258-Y262 PolarHBondContact O-N 3.46Å; L258-P335 HydrophobicContact CD2-CB 4.36Å; L258-P335 HydrophobicContact CD2-CG 4.17Å; L258-P335 HydrophobicContact CG-CG 4.17Å; L258-L552 WeakPolarHBondContact CB-O 3.45Å; L258-L552 HydrophobicContact CD2-CB 4.17Å; L258-L552 HydrophobicContact CD2-CD2 4.24Å; L258-L552 WeakPolarHBondContact CD2-O 3.45Å; L258-F553 PolarHBondContact N-O 3.5Å; L258-C554 HydrophobicContact CB-CB 4.39Å
259	S	81.7	Confident	70.5	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-59.7	-32.7	-178.8	-50.2	0	0	0	0	112.8	S257 W263 M332 L558	S257-S259 VanDerWaalsContact C-N 3.3Å; S257-S259 PolarHBondContact O-N 3.22Å; S259-W263 VanDerWaalsContact O-CB 3.27Å; S259-W263 WeakPolarHBondContact O-CB 3.49Å; S259-W263 PolarHBondContact O-N 2.92Å; S259-M332 WeakPolarHBondContact O-CE 3.41Å; S259-L558 VanDerWaalsContact OG-CD2 3.25Å; S259-L558 WeakPolarHBondContact OG-CD2 3.39Å
260	N	82.2	Confident	72.6	Confident	38 Å²	38	41.5 Å²	41.5	20%	0.203	21%	0.205	C	C	.	.	H	α-helix	trans	-73.2	-43.1	175.9	-176	12.3	0	0	0	111.3	S257 L258 W263 K264 M332	S257-N260 WeakPolarHBondContact O-CB 3.49Å; S257-N260 PolarHBondContact O-N 3.3Å; S257-N260 VanDerWaalsContact O-N 3.1Å; L258-N260 PolarHBondContact O-N 3.21Å; N260-W263 PolarHBondContact O-N 3.24Å; N260-K264 WeakPolarHBondContact O-CG 3.26Å; N260-K264 PolarHBondContact O-N 3.32Å; N260-M332 HydrophobicContact CB-CE 4.1Å
261	V	85	Confident	74.6	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.018	20%	0.199	C	C	.	.	H	α-helix	trans	-61	-50.3	174.9	-178.4	0	0	0	0	110.4	I168 V187 I255 S257 L258 W263 K264 F265	I168-V261 HydrophobicContact CD1-CG1 4.42Å; I168-V261 HydrophobicContact CD1-CG2 4.16Å; V187-V261 HydrophobicContact CG1-CB 4.25Å; V187-V261 HydrophobicContact CG1-CG1 3.67Å; I255-V261 HydrophobicContact CG2-CG2 3.25Å; S257-V261 PolarHBondContact O-N 3.39Å; S257-V261 VanDerWaalsContact O-N 3.15Å; L258-V261 PolarHBondContact O-N 3.4Å; L258-V261 VanDerWaalsContact O-N 3.08Å; V261-W263 PolarHBondContact O-N 2.98Å; V261-K264 PolarHBondContact O-N 3.16Å; V261-K264 VanDerWaalsContact O-N 3.1Å; V261-F265 HydrophobicContact CG1-CD1 3.85Å; V261-F265 HydrophobicContact CG1-CE1 3.46Å; V261-F265 VanDerWaalsContact CG1-CE1 3.46Å; V261-F265 HydrophobicContact CG1-CE2 4.33Å; V261-F265 HydrophobicContact CG1-CG 4.45Å; V261-F265 HydrophobicContact CG1-CZ 3.72Å; V261-F265 WeakPolarHBondContact O-CD1 3.48Å; V261-F265 PolarHBondContact O-N 2.94Å
262	Y	86.3	Confident	76.4	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-55.7	-48.3	177.8	-174.9	-94.5	0	0	0	111.7	V187 L258 K264 F265 C266 L319 D322 P333 P335	V187-Y262 HydrophobicContact CB-CD2 4.43Å; V187-Y262 HydrophobicContact CG2-CD2 4.01Å; L258-Y262 WeakPolarHBondContact O-CB 3.27Å; L258-Y262 PolarHBondContact O-N 3.46Å; Y262-K264 VanDerWaalsContact C-N 3.33Å; Y262-K264 PolarHBondContact O-N 2.97Å; Y262-F265 WeakPolarHBondContact O-CB 3.49Å; Y262-F265 PolarHBondContact O-N 3.2Å; Y262-F265 VanDerWaalsContact O-N 3.13Å; Y262-C266 WeakPolarHBondContact CE1-SG 3.37Å; Y262-C266 PolarHBondContact O-N 3.35Å; Y262-C266 PolarHBondContact O-SG 3.11Å; Y262-L319 HydrophobicContact CD2-CD2 4.02Å; Y262-L319 HydrophobicContact CE1-CD2 4.17Å; Y262-L319 HydrophobicContact CE2-CD2 3.35Å; Y262-L319 VanDerWaalsContact CZ-CD2 3.43Å; Y262-D322 HydrophobicContact CE1-CB 4.44Å; Y262-D322 PolarHBondContact OH-OD2 2.57Å; Y262-P333 HydrophobicContact CD1-CB 4.45Å; Y262-P333 HydrophobicContact CD1-CG 4.28Å; Y262-P333 HydrophobicContact CE1-CB 4.28Å; Y262-P335 HydrophobicContact CD1-CB 4.22Å; Y262-P335 HydrophobicContact CD1-CG 3.87Å; Y262-P335 HydrophobicContact CD2-CB 3.72Å; Y262-P335 HydrophobicContact CD2-CG 3.96Å; Y262-P335 HydrophobicContact CE1-CB 4.38Å; Y262-P335 HydrophobicContact CE1-CG 4.44Å; Y262-P335 HydrophobicContact CE2-CB 3.91Å; Y262-P335 HydrophobicContact CG-CB 3.89Å; Y262-P335 HydrophobicContact CG-CG 3.61Å
263	W	82.5	Confident	77.6	Confident	71 Å²	71	40.1 Å²	40.1	27%	0.269	19%	0.189	S	C	.	.	H	α-helix	trans	-59.8	-41.6	175.9	172.7	74.1	0	0	0	112.6	S259 N260 V261 F265 C266 L267 F327 P333	S259-W263 VanDerWaalsContact O-CB 3.27Å; S259-W263 WeakPolarHBondContact O-CB 3.49Å; S259-W263 PolarHBondContact O-N 2.92Å; N260-W263 PolarHBondContact O-N 3.24Å; V261-W263 PolarHBondContact O-N 2.98Å; W263-F265 VanDerWaalsContact C-N 3.32Å; W263-F265 PolarHBondContact O-N 2.9Å; W263-C266 WeakPolarHBondContact O-CB 3.44Å; W263-C266 PolarHBondContact O-N 3.27Å; W263-L267 HydrophobicContact CH2-CD2 4.42Å; W263-L267 PolarHBondContact O-N 3.34Å; W263-F327 HydrophobicContact CZ2-CD2 4.46Å; W263-P333 HydrophobicContact CB-CG 4.12Å
264	K	84.2	Confident	78.6	Confident	47 Å²	47	40.9 Å²	40.9	20%	0.204	19%	0.19	C	C	.	.	H	α-helix	trans	-65.9	-37.2	175.2	-70.6	-171.1	-170.5	-179.5	0	112.1	I168 N260 V261 Y262 L267 I268	I168-K264 HydrophobicContact CB-CD 4.45Å; I168-K264 HydrophobicContact CD1-CD 3.66Å; I168-K264 HydrophobicContact CG1-CD 4Å; I168-K264 HydrophobicContact CG2-CD 3.74Å; N260-K264 WeakPolarHBondContact O-CG 3.26Å; N260-K264 PolarHBondContact O-N 3.32Å; V261-K264 PolarHBondContact O-N 3.16Å; V261-K264 VanDerWaalsContact O-N 3.1Å; Y262-K264 VanDerWaalsContact C-N 3.33Å; Y262-K264 PolarHBondContact O-N 2.97Å; K264-L267 PolarHBondContact O-N 3.45Å; K264-I268 WeakPolarHBondContact O-CD1 3.38Å; K264-I268 VanDerWaalsContact O-CG1 3.26Å; K264-I268 WeakPolarHBondContact O-CG1 3.25Å; K264-I268 PolarHBondContact O-N 3.16Å
265	F	87.8	Confident	79	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.5	-42.2	175.4	-77.3	27.8	0	0	0	110.1	I168 L171 A172 W175 F176 V187 I190 V261 Y262 W263 L267 I268 S269	I168-F265 HydrophobicContact CG1-CE1 4.22Å; L171-F265 HydrophobicContact CB-CE1 4.42Å; L171-F265 HydrophobicContact CB-CZ 4.16Å; A172-F265 HydrophobicContact CB-CD1 3.55Å; A172-F265 HydrophobicContact CB-CD2 4.42Å; A172-F265 HydrophobicContact CB-CE1 3.58Å; A172-F265 HydrophobicContact CB-CE2 4.46Å; A172-F265 HydrophobicContact CB-CG 4Å; A172-F265 HydrophobicContact CB-CZ 4.07Å; W175-F265 HydrophobicContact CB-CD2 4.2Å; W175-F265 HydrophobicContact CB-CE2 3.56Å; W175-F265 HydrophobicContact CB-CZ 4.37Å; W175-F265 HydrophobicContact CD2-CD2 4.1Å; W175-F265 HydrophobicContact CD2-CE2 4.23Å; W175-F265 HydrophobicContact CE3-CD2 4.27Å; W175-F265 HydrophobicContact CG-CD2 4.07Å; W175-F265 AromaticContact CG-CE2 3.71Å; W175-F265 HydrophobicContact CG-CE2 3.71Å; F176-F265 WeakPolarHBondContact CZ-O 3.28Å; V187-F265 HydrophobicContact CG1-CD2 4Å; V187-F265 HydrophobicContact CG1-CE2 3.98Å; V187-F265 HydrophobicContact CG2-CD2 3.83Å; V187-F265 HydrophobicContact CG2-CE2 4.25Å; I190-F265 HydrophobicContact CG2-CZ 4.38Å; V261-F265 HydrophobicContact CG1-CD1 3.85Å; V261-F265 HydrophobicContact CG1-CE1 3.46Å; V261-F265 VanDerWaalsContact CG1-CE1 3.46Å; V261-F265 HydrophobicContact CG1-CE2 4.33Å; V261-F265 HydrophobicContact CG1-CG 4.45Å; V261-F265 HydrophobicContact CG1-CZ 3.72Å; V261-F265 WeakPolarHBondContact O-CD1 3.48Å; V261-F265 PolarHBondContact O-N 2.94Å; Y262-F265 WeakPolarHBondContact O-CB 3.49Å; Y262-F265 PolarHBondContact O-N 3.2Å; Y262-F265 VanDerWaalsContact O-N 3.13Å; W263-F265 VanDerWaalsContact C-N 3.32Å; W263-F265 PolarHBondContact O-N 2.9Å; F265-L267 VanDerWaalsContact C-N 3.32Å; F265-L267 PolarHBondContact O-N 3.21Å; F265-I268 PolarHBondContact O-N 3.07Å; F265-S269 WeakPolarHBondContact O-CB 3.38Å; F265-S269 PolarHBondContact O-N 3.39Å
266	C	83.9	Confident	79.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-56.3	-46.8	172	-63.5	0	0	0	0	111.1	Y262 W263 I268 S269 L319 A323	Y262-C266 WeakPolarHBondContact CE1-SG 3.37Å; Y262-C266 PolarHBondContact O-N 3.35Å; Y262-C266 PolarHBondContact O-SG 3.11Å; W263-C266 WeakPolarHBondContact O-CB 3.44Å; W263-C266 PolarHBondContact O-N 3.27Å; C266-I268 PolarHBondContact O-N 2.7Å; C266-S269 PolarHBondContact O-N 3.04Å; C266-S269 PolarHBondContact O-OG 3.5Å; C266-L319 WeakPolarHBondContact SG-CD2 3.49Å; C266-A323 HydrophobicContact CB-CB 3.81Å; C266-A323 WeakPolarHBondContact O-CB 3.34Å
267	L	81.5	Confident	79	Confident	83 Å²	83	41.4 Å²	41.4	44%	0.435	20%	0.203	S	C	.	.	H	α-helix	trans	-61.7	-43.5	178.2	-176.2	64	0	0	0	112.2	W263 K264 F265 S269 R270	W263-L267 HydrophobicContact CH2-CD2 4.42Å; W263-L267 PolarHBondContact O-N 3.34Å; K264-L267 PolarHBondContact O-N 3.45Å; F265-L267 VanDerWaalsContact C-N 3.32Å; F265-L267 PolarHBondContact O-N 3.21Å; L267-S269 VanDerWaalsContact C-N 3.32Å; L267-R270 WeakPolarHBondContact O-CB 3.25Å; L267-R270 PolarHBondContact O-N 3.47Å
268	I	83.4	Confident	78.4	Confident	17 Å²	17	42.4 Å²	42.4	9%	0.087	21%	0.209	C	C	.	.	H	α-helix	trans	-68.6	-33	178.3	-66.9	162.8	0	0	0	111.2	M107 T169 A172 F176 K264 F265 C266 R270 T271 F272	M107-I268 HydrophobicContact CE-CG2 3.57Å; M107-I268 HydrophobicContact SD-CG2 3.93Å; T169-I268 HydrophobicContact CG2-CD1 4.08Å; A172-I268 HydrophobicContact CB-CB 4.36Å; A172-I268 HydrophobicContact CB-CD1 3.47Å; A172-I268 VanDerWaalsContact CB-CD1 3.47Å; A172-I268 HydrophobicContact CB-CG2 4.18Å; F176-I268 HydrophobicContact CD2-CG2 4.44Å; F176-I268 HydrophobicContact CE2-CB 4.22Å; F176-I268 HydrophobicContact CE2-CG2 3.74Å; K264-I268 WeakPolarHBondContact O-CD1 3.38Å; K264-I268 VanDerWaalsContact O-CG1 3.26Å; K264-I268 WeakPolarHBondContact O-CG1 3.25Å; K264-I268 PolarHBondContact O-N 3.16Å; F265-I268 PolarHBondContact O-N 3.07Å; C266-I268 PolarHBondContact O-N 2.7Å; I268-R270 PolarHBondContact O-N 3Å; I268-R270 VanDerWaalsContact O-N 3.15Å; I268-T271 VanDerWaalsContact O-CB 3.31Å; I268-T271 WeakPolarHBondContact O-CB 3.48Å; I268-T271 PolarHBondContact O-N 3.44Å; I268-T271 PolarHBondContact O-OG1 2.84Å; I268-F272 HydrophobicContact CG2-CE2 3.95Å; I268-F272 WeakPolarHBondContact O-CD2 3.22Å
269	S	84.5	Confident	77.4	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.014	24%	0.235	C	C	.	.	H	α-helix	trans	-59	-28.9	178.6	75.6	0	0	0	0	112.6	F265 C266 L267 T271 F272	F265-S269 WeakPolarHBondContact O-CB 3.38Å; F265-S269 PolarHBondContact O-N 3.39Å; C266-S269 PolarHBondContact O-N 3.04Å; C266-S269 PolarHBondContact O-OG 3.5Å; L267-S269 VanDerWaalsContact C-N 3.32Å; S269-T271 PolarHBondContact O-N 3.34Å; S269-F272 PolarHBondContact O-N 3.2Å
270	R	79.2	Confident	77	Confident	85 Å²	85	49.4 Å²	49.4	32%	0.321	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-14.9	175.5	-66.9	174.7	159.8	-168.5	-9	114.4	L267 I268 F272 A323 P325	L267-R270 WeakPolarHBondContact O-CB 3.25Å; L267-R270 PolarHBondContact O-N 3.47Å; I268-R270 PolarHBondContact O-N 3Å; I268-R270 VanDerWaalsContact O-N 3.15Å; R270-F272 PolarHBondContact O-N 3.48Å; R270-A323 HydrophobicContact CG-CB 3.94Å; R270-A323 VanDerWaalsContact CZ-O 3.27Å; R270-A323 PolarHBondContact NE-O 3.27Å; R270-A323 PolarHBondContact NH2-O 3.38Å; R270-P325 VanDerWaalsContact NH2-CD 3.31Å; R270-P325 VanDerWaalsContact NH2-N 3.16Å
271	T	77.3	Confident	76.8	Confident	47 Å²	47	48.2 Å²	48.2	29%	0.288	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-12.7	171.6	-49.3	0	0	0	0	111.3	M107 Q110 I268 S269	M107-T271 HydrophobicContact CB-CG2 4.42Å; M107-T271 HydrophobicContact CG-CG2 4.06Å; Q110-T271 HydrophobicContact CB-CG2 4.05Å; Q110-T271 HydrophobicContact CG-CG2 4.11Å; I268-T271 VanDerWaalsContact O-CB 3.31Å; I268-T271 WeakPolarHBondContact O-CB 3.48Å; I268-T271 PolarHBondContact O-N 3.44Å; I268-T271 PolarHBondContact O-OG1 2.84Å; S269-T271 PolarHBondContact O-N 3.34Å
272	F	76.8	Confident	76.8	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.018	27%	0.266	C	S	.	.			trans	-128.7	90.5	-172.5	-52.1	-75.9	0	0	0	111.2	L103 Q106 M107 F176 I268 S269 R270 F274 L275	L103-F272 HydrophobicContact CB-CE1 4.05Å; L103-F272 HydrophobicContact CB-CZ 3.94Å; L103-F272 HydrophobicContact CD2-CD1 3.73Å; L103-F272 HydrophobicContact CD2-CD2 4.37Å; L103-F272 HydrophobicContact CD2-CE1 3.4Å; L103-F272 HydrophobicContact CD2-CE2 4.08Å; L103-F272 HydrophobicContact CD2-CG 4.15Å; L103-F272 HydrophobicContact CD2-CZ 3.53Å; L103-F272 HydrophobicContact CG-CE1 4.36Å; L103-F272 HydrophobicContact CG-CZ 4.35Å; L103-F272 VanDerWaalsContact O-CE1 3.28Å; L103-F272 WeakPolarHBondContact O-CE1 3.41Å; Q106-F272 HydrophobicContact CB-CE1 4.21Å; M107-F272 HydrophobicContact CB-CZ 4.46Å; M107-F272 HydrophobicContact CG-CE1 3.46Å; M107-F272 VanDerWaalsContact CG-CE1 3.46Å; M107-F272 HydrophobicContact CG-CE2 3.8Å; M107-F272 HydrophobicContact CG-CZ 3.04Å; M107-F272 HydrophobicContact SD-CE1 4.38Å; M107-F272 HydrophobicContact SD-CE2 3.75Å; M107-F272 HydrophobicContact SD-CZ 3.39Å; M107-F272 WeakPolarHBondContact SD-CZ 3.02Å; F176-F272 HydrophobicContact CD2-CE2 4.15Å; F176-F272 HydrophobicContact CE2-CE2 4.43Å; I268-F272 HydrophobicContact CG2-CE2 3.95Å; I268-F272 WeakPolarHBondContact O-CD2 3.22Å; S269-F272 PolarHBondContact O-N 3.2Å; R270-F272 PolarHBondContact O-N 3.48Å; F272-F274 HydrophobicContact CB-CD1 4.1Å; F272-F274 HydrophobicContact CB-CE1 3.78Å; F272-F274 HydrophobicContact CB-CZ 4.37Å; F272-F274 AromaticContact CD1-CE1 3.81Å; F272-F274 HydrophobicContact CD1-CE1 3.81Å; F272-F274 HydrophobicContact CD1-CZ 4.28Å; F272-F274 HydrophobicContact CG-CE1 4.2Å; F272-F274 PolarHBondContact O-N 3.36Å; F272-F274 VanDerWaalsContact O-N 3.09Å; F272-L275 HydrophobicContact CB-CB 4.15Å; F272-L275 HydrophobicContact CB-CD1 3.5Å; F272-L275 HydrophobicContact CB-CG 3.48Å; F272-L275 VanDerWaalsContact CB-CG 3.48Å; F272-L275 HydrophobicContact CD2-CD1 3.38Å; F272-L275 HydrophobicContact CD2-CG 4.28Å; F272-L275 HydrophobicContact CE2-CD1 4.23Å; F272-L275 HydrophobicContact CG-CD1 3.74Å; F272-L275 HydrophobicContact CG-CG 4.15Å; F272-L275 WeakPolarHBondContact O-CB 3.29Å; F272-L275 PolarHBondContact O-N 3.28Å
273	D	73.2	Confident	76.9	Confident	126 Å²	126	52.6 Å²	52.6	67%	0.674	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-53.5	-36	179.9	-59.8	-24.3	0	0	0	112.5	L275 E276	D273-L275 PolarHBondContact O-N 3.13Å; D273-E276 VanDerWaalsContact O-CB 3.24Å; D273-E276 WeakPolarHBondContact O-CB 3.18Å; D273-E276 PolarHBondContact O-N 3.31Å
274	F	72.2	Confident	77.3	Confident	81 Å²	81	52 Å²	52	36%	0.355	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-69.4	-17.6	179.9	73	-87.7	0	0	0	113.9	L103 L180 F272 E276 N277	L103-F274 HydrophobicContact CD2-CE1 4.31Å; L103-F274 HydrophobicContact CD2-CE2 4.34Å; L103-F274 HydrophobicContact CD2-CZ 3.51Å; L180-F274 HydrophobicContact CD1-CE2 3.77Å; L180-F274 HydrophobicContact CD1-CZ 4.23Å; L180-F274 HydrophobicContact CD2-CD2 4.29Å; L180-F274 HydrophobicContact CD2-CE2 3.77Å; L180-F274 HydrophobicContact CG-CE2 4.39Å; F272-F274 HydrophobicContact CB-CD1 4.1Å; F272-F274 HydrophobicContact CB-CE1 3.78Å; F272-F274 HydrophobicContact CB-CZ 4.37Å; F272-F274 AromaticContact CD1-CE1 3.81Å; F272-F274 HydrophobicContact CD1-CE1 3.81Å; F272-F274 HydrophobicContact CD1-CZ 4.28Å; F272-F274 HydrophobicContact CG-CE1 4.2Å; F272-F274 PolarHBondContact O-N 3.36Å; F272-F274 VanDerWaalsContact O-N 3.09Å; F274-E276 PolarHBondContact O-N 2.99Å; F274-N277 PolarHBondContact O-N 2.81Å
275	L	69.5	Low	77.5	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.016	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-70.2	-15.3	175.4	-67.3	-179	0	0	0	112.5	F176 L180 F272 D273 N277 T278	F176-L275 HydrophobicContact CB-CD1 4.36Å; F176-L275 HydrophobicContact CD1-CD1 3.33Å; F176-L275 HydrophobicContact CD1-CD2 4.17Å; F176-L275 HydrophobicContact CD1-CG 4.39Å; F176-L275 HydrophobicContact CD2-CD1 4.17Å; F176-L275 HydrophobicContact CE1-CD1 3.51Å; F176-L275 HydrophobicContact CE2-CD1 4.36Å; F176-L275 HydrophobicContact CG-CD1 3.71Å; F176-L275 HydrophobicContact CZ-CD1 4.06Å; L180-L275 HydrophobicContact CD1-CD2 4.4Å; L180-L275 HydrophobicContact CD2-CD2 4Å; L180-L275 HydrophobicContact CG-CD2 4.23Å; F272-L275 HydrophobicContact CB-CB 4.15Å; F272-L275 HydrophobicContact CB-CD1 3.5Å; F272-L275 HydrophobicContact CB-CG 3.48Å; F272-L275 VanDerWaalsContact CB-CG 3.48Å; F272-L275 HydrophobicContact CD2-CD1 3.38Å; F272-L275 HydrophobicContact CD2-CG 4.28Å; F272-L275 HydrophobicContact CE2-CD1 4.23Å; F272-L275 HydrophobicContact CG-CD1 3.74Å; F272-L275 HydrophobicContact CG-CG 4.15Å; F272-L275 WeakPolarHBondContact O-CB 3.29Å; F272-L275 PolarHBondContact O-N 3.28Å; D273-L275 PolarHBondContact O-N 3.13Å; L275-N277 PolarHBondContact O-N 2.93Å; L275-N277 VanDerWaalsContact O-N 3.16Å; L275-T278 HydrophobicContact CB-CG2 4.26Å; L275-T278 HydrophobicContact CD2-CG2 3.46Å; L275-T278 VanDerWaalsContact CD2-CG2 3.46Å; L275-T278 HydrophobicContact CG-CG2 4.44Å; L275-T278 WeakPolarHBondContact O-CB 3.29Å; L275-T278 PolarHBondContact O-N 3.26Å; L275-T278 PolarHBondContact O-OG1 3.27Å
276	E	66	Low	77.6	Confident	101 Å²	101	52.9 Å²	52.9	47%	0.472	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-55.9	-28.3	170.2	-167.7	172.8	-165.1	0	0	111.7	D273 F274	D273-E276 VanDerWaalsContact O-CB 3.24Å; D273-E276 WeakPolarHBondContact O-CB 3.18Å; D273-E276 PolarHBondContact O-N 3.31Å; F274-E276 PolarHBondContact O-N 2.99Å
277	N	59.8	Low	78	Confident	142 Å²	142	52.9 Å²	52.9	76%	0.759	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-97.9	9.7	177.6	-62.5	-44.4	0	0	0	114	F274 L275	F274-N277 PolarHBondContact O-N 2.81Å; L275-N277 PolarHBondContact O-N 2.93Å; L275-N277 VanDerWaalsContact O-N 3.16Å
278	T	66.8	Low	78.5	Confident	36 Å²	36	50.3 Å²	50.3	22%	0.221	26%	0.263	C	S	.	.	S	Bend	trans	-61.1	147	174.3	45.6	0	0	0	0	110.7	L180 L275 P280	L180-T278 HydrophobicContact CD2-CG2 3.93Å; L275-T278 HydrophobicContact CB-CG2 4.26Å; L275-T278 HydrophobicContact CD2-CG2 3.46Å; L275-T278 VanDerWaalsContact CD2-CG2 3.46Å; L275-T278 HydrophobicContact CG-CG2 4.44Å; L275-T278 WeakPolarHBondContact O-CB 3.29Å; L275-T278 PolarHBondContact O-N 3.26Å; L275-T278 PolarHBondContact O-OG1 3.27Å; T278-P280 WeakPolarHBondContact O-CD 3.27Å
279	V	61.8	Low	78.8	Confident	90 Å²	90	51.1 Å²	51.1	55%	0.545	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-50	116.9	-179.5	-178.7	0	0	0	0	108.4	R179	R179-V279 PolarHBondContact NH2-O 3.17Å
280	P	72.7	Confident	79.2	Confident	60 Å²	60	51.2 Å²	51.2	39%	0.39	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-63.5	141.9	177.6	24.3	-32.3	0	0	0	109.5	T278 V316	T278-P280 WeakPolarHBondContact O-CD 3.27Å; P280-V316 HydrophobicContact CB-CB 4.17Å; P280-V316 HydrophobicContact CB-CG1 3.2Å; P280-V316 HydrophobicContact CB-CG2 4.06Å; P280-V316 HydrophobicContact CG-CG1 4.24Å
281	V	77.6	Confident	79.9	Confident	12 Å²	12	47.4 Å²	47.4	7%	0.073	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-93.1	125.8	166.6	-171.1	0	0	0	0	107.5	E285 M286 I317	V281-E285 HydrophobicContact CG1-CG 4.44Å; V281-M286 HydrophobicContact CB-CE 3.57Å; V281-M286 HydrophobicContact CG1-CE 3.31Å; V281-M286 HydrophobicContact CG1-CG 3.91Å; V281-I317 HydrophobicContact CB-CD1 4.36Å; V281-I317 PolarHBondContact O-N 3.13Å
282	E	85.1	Confident	80.4	Confident	95 Å²	95	49 Å²	49	44%	0.444	26%	0.257	S	S	.	.	B	Isolated β-bridge	trans	-81.6	146.7	179.1	-63.5	-172	163.3	0	0	111.5	E284 E285 M286 K315 V316	E282-E284 VanDerWaalsContact C-N 3.25Å; E282-E284 PolarHBondContact O-N 3.49Å; E282-E285 HydrophobicContact CB-CB 4.34Å; E282-E285 WeakPolarHBondContact O-CB 3.32Å; E282-E285 PolarHBondContact O-N 3.41Å; E282-M286 PolarHBondContact O-N 2.97Å; E282-M286 VanDerWaalsContact O-N 3.09Å; E282-K315 CarbonylContact C-O 3.57Å; E282-K315 WeakPolarHBondContact CA-O 2.91Å; E282-V316 HydrophobicContact CG-CG2 4.4Å
283	A	89.1	Confident	80.9	Confident	2 Å²	2	48.9 Å²	48.9	2%	0.017	26%	0.257	C	S	.	.	H	α-helix	trans	-59.1	-38.8	177.8	0	0	0	0	0	112	E285 M286 I287 L308 K315 L336	A283-E285 VanDerWaalsContact C-N 3.34Å; A283-M286 PolarHBondContact O-N 3.38Å; A283-I287 WeakPolarHBondContact O-CG1 3.4Å; A283-I287 PolarHBondContact O-N 3.46Å; A283-L308 HydrophobicContact CB-CD1 4.03Å; A283-L308 HydrophobicContact CB-CD2 3.7Å; A283-K315 PolarHBondContact N-O 3.09Å; A283-L336 HydrophobicContact CB-CD1 4.1Å; A283-L336 HydrophobicContact CB-CD2 4.1Å; A283-L336 HydrophobicContact CB-CG 4.39Å
284	E	91	Very high	81.8	Confident	59 Å²	59	42.9 Å²	42.9	28%	0.276	23%	0.225	S	C	.	.	H	α-helix	trans	-64.1	-39.4	177.8	-67.1	166.5	164.3	0	0	111.3	E282 I287 A288 L308	E282-E284 VanDerWaalsContact C-N 3.25Å; E282-E284 PolarHBondContact O-N 3.49Å; E284-I287 PolarHBondContact O-N 3.42Å; E284-A288 WeakPolarHBondContact O-CB 3.13Å; E284-A288 PolarHBondContact O-N 2.54Å; E284-L308 HydrophobicContact CG-CD2 3.6Å
285	E	89	Confident	82.7	Confident	63 Å²	63	39.6 Å²	39.6	29%	0.294	21%	0.211	S	C	.	.	H	α-helix	trans	-65.4	-39.4	174.8	173.1	161.8	-128	0	0	112.1	K184 V281 E282 A283 A288 R289	K184-E285 WeakPolarHBondContact CD-OE1 3.24Å; K184-E285 WeakPolarHBondContact CE-OE1 3.48Å; K184-E285 IonicContact NZ-OE1 3.78Å; K184-E285 PolarHBondContact NZ-OE1 3.42Å; K184-E285 IonicContact NZ-OE2 3.54Å; V281-E285 HydrophobicContact CG1-CG 4.44Å; E282-E285 HydrophobicContact CB-CB 4.34Å; E282-E285 WeakPolarHBondContact O-CB 3.32Å; E282-E285 PolarHBondContact O-N 3.41Å; A283-E285 VanDerWaalsContact C-N 3.34Å; E285-A288 PolarHBondContact O-N 3.48Å; E285-R289 WeakPolarHBondContact O-CB 3.47Å; E285-R289 PolarHBondContact O-N 2.72Å
286	M	89.9	Confident	83.8	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-65.3	-41.1	172.8	-83.9	178.4	-122.8	0	0	112.7	L186 V281 E282 A283 A288 R289 F290 I317 L336 E337 A340	L186-M286 HydrophobicContact CD2-CG 4.09Å; L186-M286 HydrophobicContact CD2-SD 4.33Å; V281-M286 HydrophobicContact CB-CE 3.57Å; V281-M286 HydrophobicContact CG1-CE 3.31Å; V281-M286 HydrophobicContact CG1-CG 3.91Å; E282-M286 PolarHBondContact O-N 2.97Å; E282-M286 VanDerWaalsContact O-N 3.09Å; A283-M286 PolarHBondContact O-N 3.38Å; M286-A288 VanDerWaalsContact C-N 3.32Å; M286-R289 PolarHBondContact O-N 3.47Å; M286-F290 VanDerWaalsContact O-CD2 3.27Å; M286-F290 WeakPolarHBondContact O-CD2 3.05Å; M286-F290 PolarHBondContact O-N 2.8Å; M286-I317 HydrophobicContact CE-CD1 3.26Å; M286-I317 HydrophobicContact CE-CG1 3.64Å; M286-I317 HydrophobicContact SD-CD1 4.37Å; M286-L336 HydrophobicContact CE-CB 3.82Å; M286-L336 HydrophobicContact CE-CD2 3.51Å; M286-L336 HydrophobicContact CE-CG 3.64Å; M286-L336 HydrophobicContact SD-CB 3.91Å; M286-L336 HydrophobicContact SD-CD2 4.33Å; M286-L336 HydrophobicContact SD-CG 3.81Å; M286-E337 HydrophobicContact SD-CB 4.31Å; M286-E337 HydrophobicContact SD-CG 3.74Å; M286-E337 PolarHBondContact SD-N 2.84Å; M286-E337 VanDerWaalsContact SD-N 3.39Å; M286-A340 HydrophobicContact CB-CB 3.71Å
287	I	92.8	Very high	85.1	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.5	-44.2	175.1	-68.4	173.9	0	0	0	109.8	A283 E284 R289 F290 S291 F301 A304 V305 L308 A340 V343 I344	A283-I287 WeakPolarHBondContact O-CG1 3.4Å; A283-I287 PolarHBondContact O-N 3.46Å; E284-I287 PolarHBondContact O-N 3.42Å; I287-R289 VanDerWaalsContact C-N 3.32Å; I287-R289 PolarHBondContact O-N 2.66Å; I287-F290 PolarHBondContact O-N 3.29Å; I287-S291 VanDerWaalsContact O-CB 3.22Å; I287-S291 WeakPolarHBondContact O-CB 3.14Å; I287-S291 PolarHBondContact O-N 3.06Å; I287-S291 PolarHBondContact O-OG 3.38Å; I287-F301 HydrophobicContact CB-CE2 4.47Å; I287-F301 HydrophobicContact CG2-CD2 3.84Å; I287-F301 HydrophobicContact CG2-CE2 3.96Å; I287-A304 HydrophobicContact CG2-CB 3.69Å; I287-V305 HydrophobicContact CG2-CG2 4.45Å; I287-L308 HydrophobicContact CD1-CB 3.84Å; I287-L308 HydrophobicContact CD1-CD1 4.33Å; I287-L308 HydrophobicContact CD1-CD2 3.72Å; I287-L308 HydrophobicContact CD1-CG 4.17Å; I287-A340 HydrophobicContact CG1-CB 3.9Å; I287-V343 HydrophobicContact CD1-CB 4.17Å; I287-V343 HydrophobicContact CD1-CG1 3.82Å; I287-I344 HydrophobicContact CG2-CD1 4.36Å; I287-I344 HydrophobicContact CG2-CG1 4.17Å
288	A	91.6	Very high	86.5	Confident	29 Å²	29	30.6 Å²	30.6	24%	0.24	18%	0.178	C	C	.	.	H	α-helix	trans	-59.1	-46.6	176.9	0	0	0	0	0	110.6	E284 E285 M286 S291 L292 F301	E284-A288 WeakPolarHBondContact O-CB 3.13Å; E284-A288 PolarHBondContact O-N 2.54Å; E285-A288 PolarHBondContact O-N 3.48Å; M286-A288 VanDerWaalsContact C-N 3.32Å; A288-S291 PolarHBondContact O-N 2.67Å; A288-L292 VanDerWaalsContact O-CG 3.31Å; A288-L292 WeakPolarHBondContact O-CG 3.32Å; A288-L292 PolarHBondContact O-N 3.41Å; A288-F301 VanDerWaalsContact CA-CE2 3.41Å; A288-F301 HydrophobicContact CB-CD2 4.3Å; A288-F301 HydrophobicContact CB-CE2 3.56Å; A288-F301 HydrophobicContact CB-CZ 4.04Å
289	R	89.5	Confident	87.7	Confident	34 Å²	34	32.3 Å²	32.3	13%	0.128	18%	0.183	C	C	.	.	H	α-helix	trans	-60.7	-52.5	177.8	-178.8	173	176.9	-179.4	-6	112.7	K184 D189 E285 M286 I287 S291 L292 D293 F462	K184-R289 PolarHBondContact O-NH1 3.11Å; D189-R289 IonicContact OD1-CZ 3.49Å; D189-R289 IonicContact OD1-NH1 3.11Å; D189-R289 IonicContact OD1-NH2 2.77Å; D189-R289 PolarHBondContact OD1-NH2 3.47Å; D189-R289 IonicContact OD2-CZ 2.64Å; D189-R289 IonicContact OD2-NH1 3.66Å; D189-R289 PolarHBondContact OD2-NH1 3.15Å; D189-R289 IonicContact OD2-NH2 3.54Å; D189-R289 PolarHBondContact OD2-NH2 3.46Å; E285-R289 WeakPolarHBondContact O-CB 3.47Å; E285-R289 PolarHBondContact O-N 2.72Å; M286-R289 PolarHBondContact O-N 3.47Å; I287-R289 VanDerWaalsContact C-N 3.32Å; I287-R289 PolarHBondContact O-N 2.66Å; R289-S291 PolarHBondContact O-N 2.68Å; R289-L292 WeakPolarHBondContact O-CB 3.02Å; R289-L292 PolarHBondContact O-N 3.48Å; R289-L292 VanDerWaalsContact O-N 3.14Å; R289-D293 IonicContact NE-OD2 2.66Å; R289-D293 PolarHBondContact O-N 3.31Å; R289-F462 PolarHBondContact NH2-O 3.33Å; R289-F462 VanDerWaalsContact NH2-O 3.12Å
290	F	93.1	Very high	89.2	Confident	4 Å²	4	28 Å²	28	2%	0.018	16%	0.157	C	C	.	.	H	α-helix	trans	-64.1	-33.6	178	-74.3	-50.6	0	0	0	112	L186 M286 I287 L292 D293 L294 E337 A340 M341 I344 L552	L186-F290 HydrophobicContact CD1-CE1 4.48Å; L186-F290 HydrophobicContact CD1-CZ 4.06Å; M286-F290 VanDerWaalsContact O-CD2 3.27Å; M286-F290 WeakPolarHBondContact O-CD2 3.05Å; M286-F290 PolarHBondContact O-N 2.8Å; I287-F290 PolarHBondContact O-N 3.29Å; F290-L292 VanDerWaalsContact C-N 3.33Å; F290-L292 PolarHBondContact O-N 2.93Å; F290-D293 PolarHBondContact O-N 2.95Å; F290-L294 WeakPolarHBondContact O-CB 3.29Å; F290-L294 WeakPolarHBondContact O-CG 3.38Å; F290-L294 PolarHBondContact O-N 3.37Å; F290-E337 HydrophobicContact CE2-CB 4.11Å; F290-E337 VanDerWaalsContact CE2-O 3.27Å; F290-E337 WeakPolarHBondContact CE2-O 3.03Å; F290-E337 HydrophobicContact CZ-CB 4.01Å; F290-A340 HydrophobicContact CD2-CB 4.1Å; F290-A340 HydrophobicContact CE2-CB 4.21Å; F290-M341 HydrophobicContact CB-CE 4.26Å; F290-M341 HydrophobicContact CD1-CE 3.4Å; F290-M341 VanDerWaalsContact CD1-CE 3.4Å; F290-M341 HydrophobicContact CD2-CE 4.16Å; F290-M341 HydrophobicContact CE1-CE 3.67Å; F290-M341 HydrophobicContact CE2-CE 4.37Å; F290-M341 HydrophobicContact CG-CE 3.69Å; F290-M341 HydrophobicContact CZ-CE 4.16Å; F290-I344 HydrophobicContact CB-CD1 3.42Å; F290-I344 VanDerWaalsContact CB-CD1 3.42Å; F290-I344 HydrophobicContact CG-CD1 4.44Å; F290-L552 HydrophobicContact CE1-CD2 4.24Å; F290-L552 HydrophobicContact CE2-CD2 4.31Å; F290-L552 HydrophobicContact CZ-CD2 3.65Å
291	S	93.1	Very high	90.2	Very high	5 Å²	5	28 Å²	28	4%	0.035	15%	0.151	C	C	.	.	H	α-helix	trans	-63.7	-40	174.1	-58.7	0	0	0	0	111.6	I287 A288 R289 N295 L296	I287-S291 VanDerWaalsContact O-CB 3.22Å; I287-S291 WeakPolarHBondContact O-CB 3.14Å; I287-S291 PolarHBondContact O-N 3.06Å; I287-S291 PolarHBondContact O-OG 3.38Å; A288-S291 PolarHBondContact O-N 2.67Å; R289-S291 PolarHBondContact O-N 2.68Å; S291-N295 PolarHBondContact O-N 2.6Å; S291-L296 PolarHBondContact O-N 3.26Å
292	L	88	Confident	90.9	Very high	81 Å²	81	31.2 Å²	31.2	42%	0.424	17%	0.165	S	C	.	.	H	α-helix	trans	-66.7	-45.6	173.5	-70.9	168.9	0	0	0	112.1	A288 R289 F290 L294 N295	A288-L292 VanDerWaalsContact O-CG 3.31Å; A288-L292 WeakPolarHBondContact O-CG 3.32Å; A288-L292 PolarHBondContact O-N 3.41Å; R289-L292 WeakPolarHBondContact O-CB 3.02Å; R289-L292 PolarHBondContact O-N 3.48Å; R289-L292 VanDerWaalsContact O-N 3.14Å; F290-L292 VanDerWaalsContact C-N 3.33Å; F290-L292 PolarHBondContact O-N 2.93Å; L292-L294 VanDerWaalsContact C-N 3.33Å; L292-L294 PolarHBondContact O-N 3.09Å; L292-N295 PolarHBondContact O-N 3.12Å; L292-N295 VanDerWaalsContact O-N 3.14Å
293	D	87.4	Confident	91.3	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.011	15%	0.148	C	C	.	.	H	α-helix	trans	-66.5	-36.1	-179.4	-74.5	-25.8	0	0	0	111.8	R289 F290 N295 K394 S463 F464 Y551	R289-D293 IonicContact NE-OD2 2.66Å; R289-D293 PolarHBondContact O-N 3.31Å; F290-D293 PolarHBondContact O-N 2.95Å; D293-N295 VanDerWaalsContact C-N 3.29Å; D293-K394 PolarHBondContact O-NZ 3.33Å; D293-S463 PolarHBondContact OD1-OG 3.43Å; D293-F464 HydrophobicContact CB-CB 4.34Å; D293-F464 HydrophobicContact CB-CD2 4.37Å; D293-F464 PolarHBondContact OD1-N 2.94Å; D293-Y551 HydrophobicContact CB-CE1 4.35Å; D293-Y551 PolarHBondContact O-OH 2.91Å
294	L	92.4	Very high	91.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-3	174.8	-69.7	171.6	0	0	0	113.5	F290 L292 L296 M341 I344 W387 N391 Y551	F290-L294 WeakPolarHBondContact O-CB 3.29Å; F290-L294 WeakPolarHBondContact O-CG 3.38Å; F290-L294 PolarHBondContact O-N 3.37Å; L292-L294 VanDerWaalsContact C-N 3.33Å; L292-L294 PolarHBondContact O-N 3.09Å; L294-L296 VanDerWaalsContact C-N 3.35Å; L294-L296 HydrophobicContact CB-CD1 4.18Å; L294-L296 HydrophobicContact CB-CG 3.94Å; L294-L296 HydrophobicContact CD1-CD1 4.2Å; L294-L296 PolarHBondContact O-N 3.25Å; L294-M341 HydrophobicContact CD1-CE 4.5Å; L294-M341 HydrophobicContact CD1-SD 3.99Å; L294-I344 HydrophobicContact CD1-CG2 4.14Å; L294-W387 HydrophobicContact CB-CZ2 4.11Å; L294-W387 HydrophobicContact CD2-CZ2 4.4Å; L294-W387 PolarHBondContact O-NE1 3.3Å; L294-N391 PolarHBondContact O-ND2 3.37Å; L294-N391 PolarHBondContact O-OD1 3.44Å; L294-Y551 HydrophobicContact CD2-CD2 3.92Å; L294-Y551 HydrophobicContact CD2-CE2 3.51Å
295	N	90.6	Very high	91.6	Very high	12 Å²	12	24.7 Å²	24.7	6%	0.064	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	42.8	-179.3	-160.7	17	0	0	0	113	S291 L292 D293 F492 N493 F494 A495	S291-N295 PolarHBondContact O-N 2.6Å; L292-N295 PolarHBondContact O-N 3.12Å; L292-N295 VanDerWaalsContact O-N 3.14Å; D293-N295 VanDerWaalsContact C-N 3.29Å; N295-F492 PolarHBondContact ND2-O 3.01Å; N295-N493 PolarHBondContact OD1-OD1 3.2Å; N295-F494 HydrophobicContact CB-CB 4.47Å; N295-F494 PolarHBondContact ND2-N 3.33Å; N295-F494 VanDerWaalsContact ND2-N 3.11Å; N295-F494 CarbonylContact O-C 3.5Å; N295-F494 WeakPolarHBondContact O-CB 3.27Å; N295-A495 PolarHBondContact O-N 3.32Å; N295-A495 VanDerWaalsContact OD1-CB 3.28Å; N295-A495 WeakPolarHBondContact OD1-CB 3.38Å; N295-A495 PolarHBondContact OD1-N 2.91Å
296	L	93.4	Very high	91.7	Very high	8 Å²	8	24.9 Å²	24.9	4%	0.042	14%	0.139	C	C	.	.			trans	-84.7	143.3	-179.7	-69.2	175.6	0	0	0	111.8	S291 L294 I300 I344 L348 F382 W387	S291-L296 PolarHBondContact O-N 3.26Å; L294-L296 VanDerWaalsContact C-N 3.35Å; L294-L296 HydrophobicContact CB-CD1 4.18Å; L294-L296 HydrophobicContact CB-CG 3.94Å; L294-L296 HydrophobicContact CD1-CD1 4.2Å; L294-L296 PolarHBondContact O-N 3.25Å; L296-I300 HydrophobicContact CB-CB 4.42Å; L296-I300 HydrophobicContact CD1-CG2 4.05Å; L296-I300 HydrophobicContact CD2-CD1 4.07Å; L296-I300 HydrophobicContact CD2-CG2 4.21Å; L296-I344 HydrophobicContact CD1-CG2 3.65Å; L296-L348 HydrophobicContact CD2-CD2 4.09Å; L296-F382 HydrophobicContact CD2-CZ 4.24Å; L296-W387 HydrophobicContact CD2-CD2 4.26Å; L296-W387 VanDerWaalsContact CD2-CE2 3.42Å; L296-W387 HydrophobicContact CD2-CH2 4.27Å; L296-W387 HydrophobicContact CD2-CZ2 3.44Å; L296-W387 VanDerWaalsContact CD2-CZ2 3.44Å; L296-W387 HydrophobicContact CG-CZ2 4.16Å
297	P	92.4	Very high	91.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.138	C	C	.	.			trans	-57.7	155.4	168.2	-24.4	31.9	0	0	0	113.8	E299 I300 F301 F382 T497 V499	P297-E299 VanDerWaalsContact CB-OE2 3.31Å; P297-E299 WeakPolarHBondContact CB-OE2 2.86Å; P297-E299 PolarHBondContact O-N 2.63Å; P297-I300 HydrophobicContact CB-CG1 4.43Å; P297-I300 HydrophobicContact CG-CD1 4.26Å; P297-I300 HydrophobicContact CG-CG1 4.41Å; P297-I300 PolarHBondContact O-N 2.96Å; P297-I300 VanDerWaalsContact O-N 3.12Å; P297-F301 PolarHBondContact O-N 3.41Å; P297-F301 VanDerWaalsContact O-N 3.14Å; P297-F382 VanDerWaalsContact CD-CD2 3.5Å; P297-F382 VanDerWaalsContact CD-CE2 3.49Å; P297-F382 HydrophobicContact CG-CB 4.09Å; P297-F382 HydrophobicContact CG-CD2 3.31Å; P297-F382 HydrophobicContact CG-CE2 3.89Å; P297-F382 HydrophobicContact CG-CG 3.84Å; P297-T497 WeakPolarHBondContact CG-OG1 3.11Å; P297-V499 HydrophobicContact CB-CG2 4.36Å; P297-V499 HydrophobicContact CG-CG2 4.42Å
298	G	90.2	Very high	91.7	Very high	49 Å²	49	25.3 Å²	25.3	51%	0.505	14%	0.141	S	C	.	.	H	α-helix	trans	-59.6	-31.9	178	0	0	0	0	0	113.5	F301 Q302	G298-F301 WeakPolarHBondContact O-CB 3.14Å; G298-F301 PolarHBondContact O-N 2.7Å; G298-Q302 WeakPolarHBondContact O-CB 3.08Å; G298-Q302 PolarHBondContact O-N 2.57Å
299	E	91.2	Very high	91.7	Very high	71 Å²	71	31 Å²	31	33%	0.332	16%	0.157	S	C	.	.	H	α-helix	trans	-67.6	-36.4	177.8	-60.2	88.3	157.8	0	0	112	P297 T303 V499	P297-E299 VanDerWaalsContact CB-OE2 3.31Å; P297-E299 WeakPolarHBondContact CB-OE2 2.86Å; P297-E299 PolarHBondContact O-N 2.63Å; E299-T303 WeakPolarHBondContact O-CB 3.4Å; E299-T303 PolarHBondContact O-N 2.85Å; E299-T303 PolarHBondContact O-OG1 3.23Å; E299-V499 HydrophobicContact CB-CB 4.24Å; E299-V499 HydrophobicContact CB-CG2 3.94Å
300	I	93.4	Very high	91.7	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-72.4	-41.8	176.1	-56.7	-170.5	0	0	0	109.8	L296 P297 Q302 T303 A304 L348 L351 F352 F382 V499	L296-I300 HydrophobicContact CB-CB 4.42Å; L296-I300 HydrophobicContact CD1-CG2 4.05Å; L296-I300 HydrophobicContact CD2-CD1 4.07Å; L296-I300 HydrophobicContact CD2-CG2 4.21Å; P297-I300 HydrophobicContact CB-CG1 4.43Å; P297-I300 HydrophobicContact CG-CD1 4.26Å; P297-I300 HydrophobicContact CG-CG1 4.41Å; P297-I300 PolarHBondContact O-N 2.96Å; P297-I300 VanDerWaalsContact O-N 3.12Å; I300-Q302 VanDerWaalsContact C-N 3.34Å; I300-Q302 PolarHBondContact O-N 2.84Å; I300-T303 PolarHBondContact O-N 3.4Å; I300-A304 WeakPolarHBondContact O-CB 3.43Å; I300-A304 PolarHBondContact O-N 3.19Å; I300-L348 HydrophobicContact CD1-CD2 3.88Å; I300-L348 HydrophobicContact CG2-CD2 3.81Å; I300-L348 HydrophobicContact CG2-CG 4.38Å; I300-L351 HydrophobicContact CG1-CD1 4.07Å; I300-L351 HydrophobicContact CG2-CD1 4.41Å; I300-F352 HydrophobicContact CD1-CE2 3.86Å; I300-F352 HydrophobicContact CD1-CZ 4.06Å; I300-F382 HydrophobicContact CD1-CD1 3.96Å; I300-F382 HydrophobicContact CD1-CE1 3.59Å; I300-F382 HydrophobicContact CD1-CE2 4.2Å; I300-F382 HydrophobicContact CD1-CG 4.37Å; I300-F382 HydrophobicContact CD1-CZ 3.71Å; I300-V499 HydrophobicContact CD1-CG2 4.05Å; I300-V499 HydrophobicContact CG1-CG2 3.61Å
301	F	93.3	Very high	91.4	Very high	59 Å²	59	34.6 Å²	34.6	26%	0.259	18%	0.178	S	C	.	.	H	α-helix	trans	-56.1	-49.3	171.8	166.1	-104.9	0	0	0	111.2	I287 A288 P297 G298 T303 A304 V305	I287-F301 HydrophobicContact CB-CE2 4.47Å; I287-F301 HydrophobicContact CG2-CD2 3.84Å; I287-F301 HydrophobicContact CG2-CE2 3.96Å; A288-F301 VanDerWaalsContact CA-CE2 3.41Å; A288-F301 HydrophobicContact CB-CD2 4.3Å; A288-F301 HydrophobicContact CB-CE2 3.56Å; A288-F301 HydrophobicContact CB-CZ 4.04Å; P297-F301 PolarHBondContact O-N 3.41Å; P297-F301 VanDerWaalsContact O-N 3.14Å; G298-F301 WeakPolarHBondContact O-CB 3.14Å; G298-F301 PolarHBondContact O-N 2.7Å; F301-T303 VanDerWaalsContact C-N 3.32Å; F301-T303 PolarHBondContact O-N 3.25Å; F301-A304 WeakPolarHBondContact O-CB 3.22Å; F301-A304 PolarHBondContact O-N 2.98Å; F301-A304 VanDerWaalsContact O-N 3.15Å; F301-V305 HydrophobicContact CD2-CG2 4.24Å; F301-V305 HydrophobicContact CE1-CG2 4.13Å; F301-V305 HydrophobicContact CE2-CG2 3.65Å; F301-V305 HydrophobicContact CZ-CG2 3.6Å; F301-V305 WeakPolarHBondContact O-CG2 3.37Å; F301-V305 PolarHBondContact O-N 3.49Å
302	Q	93.1	Very high	90.8	Very high	79 Å²	79	41.6 Å²	41.6	37%	0.369	22%	0.215	S	C	.	.	H	α-helix	trans	-61.8	-42.1	179.1	-174.3	54.8	57.1	0	0	111.5	G298 I300 A304 V305 D306	G298-Q302 WeakPolarHBondContact O-CB 3.08Å; G298-Q302 PolarHBondContact O-N 2.57Å; I300-Q302 VanDerWaalsContact C-N 3.34Å; I300-Q302 PolarHBondContact O-N 2.84Å; Q302-A304 VanDerWaalsContact C-N 3.34Å; Q302-A304 PolarHBondContact O-N 2.79Å; Q302-V305 PolarHBondContact O-N 3.21Å; Q302-D306 PolarHBondContact NE2-OD1 3Å; Q302-D306 VanDerWaalsContact NE2-OD1 3.11Å; Q302-D306 VanDerWaalsContact O-CG 3.28Å; Q302-D306 PolarHBondContact O-N 3.23Å
303	T	92.3	Very high	90.4	Very high	14 Å²	14	38.4 Å²	38.4	9%	0.086	20%	0.199	C	C	.	.	H	α-helix	trans	-59.9	-44.7	174.7	-56.4	0	0	0	0	111	E299 I300 F301 V305 D306 V307 A347 L351 F505	E299-T303 WeakPolarHBondContact O-CB 3.4Å; E299-T303 PolarHBondContact O-N 2.85Å; E299-T303 PolarHBondContact O-OG1 3.23Å; I300-T303 PolarHBondContact O-N 3.4Å; F301-T303 VanDerWaalsContact C-N 3.32Å; F301-T303 PolarHBondContact O-N 3.25Å; T303-V305 VanDerWaalsContact C-N 3.34Å; T303-V305 PolarHBondContact O-N 2.88Å; T303-D306 PolarHBondContact O-N 3.45Å; T303-D306 VanDerWaalsContact O-N 3.15Å; T303-V307 WeakPolarHBondContact O-CG2 3.38Å; T303-V307 PolarHBondContact O-N 2.94Å; T303-A347 HydrophobicContact CG2-CB 3.99Å; T303-L351 HydrophobicContact CG2-CD1 4.06Å; T303-L351 HydrophobicContact CG2-CD2 4.18Å; T303-L351 HydrophobicContact CG2-CG 4.14Å; T303-F505 HydrophobicContact CG2-CB 4.17Å; T303-F505 HydrophobicContact CG2-CG 4.42Å
304	A	94.1	Very high	89.9	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.2	-40.2	176.7	0	0	0	0	0	112.1	I287 I300 F301 Q302 D306 V307 L308 V343 I344 A347	I287-A304 HydrophobicContact CG2-CB 3.69Å; I300-A304 WeakPolarHBondContact O-CB 3.43Å; I300-A304 PolarHBondContact O-N 3.19Å; F301-A304 WeakPolarHBondContact O-CB 3.22Å; F301-A304 PolarHBondContact O-N 2.98Å; F301-A304 VanDerWaalsContact O-N 3.15Å; Q302-A304 VanDerWaalsContact C-N 3.34Å; Q302-A304 PolarHBondContact O-N 2.79Å; A304-D306 VanDerWaalsContact C-N 3.33Å; A304-D306 PolarHBondContact O-N 3.26Å; A304-V307 PolarHBondContact O-N 3.19Å; A304-L308 WeakPolarHBondContact O-CB 3.4Å; A304-L308 PolarHBondContact O-N 3.08Å; A304-V343 HydrophobicContact CB-CG1 4.14Å; A304-V343 WeakPolarHBondContact O-CG1 3.4Å; A304-I344 HydrophobicContact CB-CG1 4.19Å; A304-A347 HydrophobicContact CB-CB 4.07Å
305	V	92.9	Very high	89	Confident	6 Å²	6	48.6 Å²	48.6	4%	0.036	25%	0.251	C	S	.	.	H	α-helix	trans	-63.4	-39.4	173.2	171.9	0	0	0	0	111.4	I287 F301 Q302 T303 L308 R309	I287-V305 HydrophobicContact CG2-CG2 4.45Å; F301-V305 HydrophobicContact CD2-CG2 4.24Å; F301-V305 HydrophobicContact CE1-CG2 4.13Å; F301-V305 HydrophobicContact CE2-CG2 3.65Å; F301-V305 HydrophobicContact CZ-CG2 3.6Å; F301-V305 WeakPolarHBondContact O-CG2 3.37Å; F301-V305 PolarHBondContact O-N 3.49Å; Q302-V305 PolarHBondContact O-N 3.21Å; T303-V305 VanDerWaalsContact C-N 3.34Å; T303-V305 PolarHBondContact O-N 2.88Å; V305-L308 WeakPolarHBondContact O-CB 3.24Å; V305-L308 PolarHBondContact O-N 3.08Å; V305-R309 VanDerWaalsContact CG1-CZ 3.47Å; V305-R309 VanDerWaalsContact O-CG 3.31Å; V305-R309 WeakPolarHBondContact O-CG 2.83Å; V305-R309 PolarHBondContact O-N 2.95Å
306	D	91.4	Very high	88	Confident	66 Å²	66	51.2 Å²	51.2	35%	0.353	27%	0.267	S	S	.	.	H	α-helix	trans	-67	-39.3	176.3	-65.6	-27.4	0	0	0	111.7	Q302 T303 A304 R309 L310	Q302-D306 PolarHBondContact NE2-OD1 3Å; Q302-D306 VanDerWaalsContact NE2-OD1 3.11Å; Q302-D306 VanDerWaalsContact O-CG 3.28Å; Q302-D306 PolarHBondContact O-N 3.23Å; T303-D306 PolarHBondContact O-N 3.45Å; T303-D306 VanDerWaalsContact O-N 3.15Å; A304-D306 VanDerWaalsContact C-N 3.33Å; A304-D306 PolarHBondContact O-N 3.26Å; D306-R309 PolarHBondContact O-N 3.11Å; D306-R309 IonicContact OD1-CZ 2.68Å; D306-R309 IonicContact OD1-NH1 2.82Å; D306-R309 PolarHBondContact OD1-NH1 3.4Å; D306-L310 WeakPolarHBondContact O-CG 3.42Å; D306-L310 PolarHBondContact O-N 3.36Å; D306-L310 VanDerWaalsContact O-N 3.14Å
307	V	91	Very high	86.8	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.5	-45	170.6	179.3	0	0	0	0	111	T303 A304 R309 L310 L311 V343 I346 A347 F505 L570	T303-V307 WeakPolarHBondContact O-CG2 3.38Å; T303-V307 PolarHBondContact O-N 2.94Å; A304-V307 PolarHBondContact O-N 3.19Å; V307-R309 VanDerWaalsContact C-N 3.26Å; V307-R309 PolarHBondContact O-N 3.03Å; V307-L310 WeakPolarHBondContact O-CB 3.31Å; V307-L310 PolarHBondContact O-N 3.12Å; V307-L310 VanDerWaalsContact O-N 3.11Å; V307-L311 HydrophobicContact CG1-CD1 3.94Å; V307-L311 WeakPolarHBondContact O-CG 3.33Å; V307-L311 PolarHBondContact O-N 3.34Å; V307-L311 VanDerWaalsContact O-N 3.11Å; V307-V343 HydrophobicContact CB-CG1 3.87Å; V307-V343 HydrophobicContact CG1-CG1 3.94Å; V307-I346 HydrophobicContact CG1-CB 4.24Å; V307-I346 HydrophobicContact CG1-CG2 3.72Å; V307-I346 HydrophobicContact CG2-CG2 4.42Å; V307-A347 HydrophobicContact CG2-CB 4.27Å; V307-F505 HydrophobicContact CB-CE1 4.33Å; V307-F505 HydrophobicContact CG1-CE1 4.33Å; V307-F505 HydrophobicContact CG2-CD1 3.45Å; V307-F505 VanDerWaalsContact CG2-CD1 3.45Å; V307-F505 HydrophobicContact CG2-CE1 3.24Å; V307-F505 HydrophobicContact CG2-CZ 4.18Å; V307-L570 HydrophobicContact CG1-CD1 4.15Å; V307-L570 HydrophobicContact CG1-CD2 4.47Å
308	L	92.3	Very high	85.6	Confident	11 Å²	11	53.7 Å²	53.7	6%	0.058	28%	0.28	C	S	.	.	H	α-helix	trans	-57.8	-40.6	177.4	179.7	70	0	0	0	111.4	A283 E284 I287 A304 V305 L310 L311 V313 V343	A283-L308 HydrophobicContact CB-CD1 4.03Å; A283-L308 HydrophobicContact CB-CD2 3.7Å; E284-L308 HydrophobicContact CG-CD2 3.6Å; I287-L308 HydrophobicContact CD1-CB 3.84Å; I287-L308 HydrophobicContact CD1-CD1 4.33Å; I287-L308 HydrophobicContact CD1-CD2 3.72Å; I287-L308 HydrophobicContact CD1-CG 4.17Å; A304-L308 WeakPolarHBondContact O-CB 3.4Å; A304-L308 PolarHBondContact O-N 3.08Å; V305-L308 WeakPolarHBondContact O-CB 3.24Å; V305-L308 PolarHBondContact O-N 3.08Å; L308-L310 VanDerWaalsContact C-N 3.3Å; L308-L310 PolarHBondContact O-N 3.02Å; L308-L311 PolarHBondContact O-N 3.43Å; L308-V313 HydrophobicContact CD1-CB 3.7Å; L308-V313 HydrophobicContact CD1-CG1 3.93Å; L308-V313 HydrophobicContact CD1-CG2 4.15Å; L308-V343 HydrophobicContact CB-CG1 4.19Å; L308-V343 HydrophobicContact CD1-CG2 4.21Å
309	R	89.9	Confident	84.6	Confident	150 Å²	150	52 Å²	52	57%	0.566	26%	0.259	S	S	*	.	H	α-helix	trans	-69.2	-26.9	178.3	-69.2	166.9	-175.7	162.4	-4.2	113.5	V305 D306 V307 L311	V305-R309 VanDerWaalsContact CG1-CZ 3.47Å; V305-R309 VanDerWaalsContact O-CG 3.31Å; V305-R309 WeakPolarHBondContact O-CG 2.83Å; V305-R309 PolarHBondContact O-N 2.95Å; D306-R309 PolarHBondContact O-N 3.11Å; D306-R309 IonicContact OD1-CZ 2.68Å; D306-R309 IonicContact OD1-NH1 2.82Å; D306-R309 PolarHBondContact OD1-NH1 3.4Å; V307-R309 VanDerWaalsContact C-N 3.26Å; V307-R309 PolarHBondContact O-N 3.03Å; R309-L311 VanDerWaalsContact C-N 3.32Å
310	L	89.1	Confident	83.5	Confident	102 Å²	102	50.7 Å²	50.7	53%	0.534	25%	0.253	S	S	.	.	H	α-helix	trans	-78.1	-22	174.4	-67.7	173.2	0	0	0	112.3	D306 V307 L308 P506 L570	D306-L310 WeakPolarHBondContact O-CG 3.42Å; D306-L310 PolarHBondContact O-N 3.36Å; D306-L310 VanDerWaalsContact O-N 3.14Å; V307-L310 WeakPolarHBondContact O-CB 3.31Å; V307-L310 PolarHBondContact O-N 3.12Å; V307-L310 VanDerWaalsContact O-N 3.11Å; L308-L310 VanDerWaalsContact C-N 3.3Å; L308-L310 PolarHBondContact O-N 3.02Å; L310-P506 HydrophobicContact CD1-CG 4.23Å; L310-L570 HydrophobicContact CB-CD2 3.88Å
311	L	88.1	Confident	82.2	Confident	10 Å²	10	55.3 Å²	55.3	5%	0.052	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	146.4	175.2	-67.1	165.2	0	0	0	110.5	V307 L308 R309 V313 V343 M566 E569 L570	V307-L311 HydrophobicContact CG1-CD1 3.94Å; V307-L311 WeakPolarHBondContact O-CG 3.33Å; V307-L311 PolarHBondContact O-N 3.34Å; V307-L311 VanDerWaalsContact O-N 3.11Å; L308-L311 PolarHBondContact O-N 3.43Å; R309-L311 VanDerWaalsContact C-N 3.32Å; L311-V313 HydrophobicContact CB-CG2 3.78Å; L311-V313 HydrophobicContact CD1-CG2 4.26Å; L311-V313 PolarHBondContact O-N 2.77Å; L311-V343 HydrophobicContact CD1-CG2 3.84Å; L311-M566 HydrophobicContact CD1-CE 3.62Å; L311-M566 WeakPolarHBondContact CD2-O 3.33Å; L311-E569 HydrophobicContact CD2-CB 3.83Å; L311-L570 HydrophobicContact CD2-CD1 4.35Å; L311-L570 HydrophobicContact CD2-CD2 3.66Å; L311-L570 HydrophobicContact CD2-CG 3.54Å; L311-L570 HydrophobicContact CG-CD2 3.74Å; L311-L570 HydrophobicContact CG-CG 4.09Å
312	D	80	Confident	80.9	Confident	153 Å²	153	55.4 Å²	55.4	82%	0.818	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	48	171.8	-164.5	28.8	0	0	0	110.8
313	V	80.6	Confident	79.3	Confident	14 Å²	14	52 Å²	52	9%	0.085	27%	0.266	C	S	.	.			trans	-76.9	128.7	178.3	175.4	0	0	0	0	108.7	L308 L311 K315 L336 K339 M566	L308-V313 HydrophobicContact CD1-CB 3.7Å; L308-V313 HydrophobicContact CD1-CG1 3.93Å; L308-V313 HydrophobicContact CD1-CG2 4.15Å; L311-V313 HydrophobicContact CB-CG2 3.78Å; L311-V313 HydrophobicContact CD1-CG2 4.26Å; L311-V313 PolarHBondContact O-N 2.77Å; V313-K315 PolarHBondContact O-N 3.03Å; V313-L336 HydrophobicContact CG1-CD1 3.8Å; V313-K339 HydrophobicContact CG1-CB 4.47Å; V313-K339 HydrophobicContact CG1-CD 4Å; V313-M566 HydrophobicContact CG2-CE 3.76Å
314	P	76.1	Confident	77.7	Confident	76 Å²	76	57.1 Å²	57.1	49%	0.494	29%	0.293	S	S	.	.			trans	-53	126.2	173.7	-24.8	32.4	0	0	0	110.9	V316	P314-V316 VanDerWaalsContact C-N 3.25Å; P314-V316 PolarHBondContact O-N 3.01Å
315	K	73.6	Confident	75.7	Confident	140 Å²	140	60.8 Å²	60.8	61%	0.609	32%	0.316	S	S	*	.	S	Bend	trans	-70.2	-21.4	-175.5	-66.9	-169.4	177.2	-165.9	0	113.6	E282 A283 V313	E282-K315 CarbonylContact C-O 3.57Å; E282-K315 WeakPolarHBondContact CA-O 2.91Å; A283-K315 PolarHBondContact N-O 3.09Å; V313-K315 PolarHBondContact O-N 3.03Å
316	V	69.5	Low	73.7	Confident	67 Å²	67	67.4 Å²	67.4	41%	0.406	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-129.7	132.9	-168.5	161.6	0	0	0	0	110.4	P280 E282 P314	P280-V316 HydrophobicContact CB-CB 4.17Å; P280-V316 HydrophobicContact CB-CG1 3.2Å; P280-V316 HydrophobicContact CB-CG2 4.06Å; P280-V316 HydrophobicContact CG-CG1 4.24Å; E282-V316 HydrophobicContact CG-CG2 4.4Å; P314-V316 VanDerWaalsContact C-N 3.25Å; P314-V316 PolarHBondContact O-N 3.01Å
317	I	67.3	Low	72	Confident	25 Å²	25	70.6 Å²	70.6	13%	0.128	36%	0.355	C	S	.	.			trans	-71.5	131	164.7	-62.2	-175.2	0	0	0	109.6	V281 M286 L319 L336	V281-I317 HydrophobicContact CB-CD1 4.36Å; V281-I317 PolarHBondContact O-N 3.13Å; M286-I317 HydrophobicContact CE-CD1 3.26Å; M286-I317 HydrophobicContact CE-CG1 3.64Å; M286-I317 HydrophobicContact SD-CD1 4.37Å; I317-L319 HydrophobicContact CG2-CD2 4.47Å; I317-L319 HydrophobicContact CG2-CG 4.07Å; I317-L336 HydrophobicContact CD1-CB 3.82Å; I317-L336 HydrophobicContact CD1-CD2 4.37Å; I317-L336 HydrophobicContact CG1-CB 3.52Å; I317-L336 HydrophobicContact CG1-CD2 3.45Å; I317-L336 VanDerWaalsContact CG1-CD2 3.45Å; I317-L336 HydrophobicContact CG1-CG 4.06Å
318	N	67.7	Low	70.1	Confident	35 Å²	35	74 Å²	74	19%	0.187	38%	0.377	C	S	.	.			trans	-128	103.9	150.3	-173.6	-23.2	0	0	0	108.9	H320 N321 D322	N318-H320 PolarHBondContact O-N 2.96Å; N318-H320 WeakPolarHBondContact OD1-CA 3.31Å; N318-H320 WeakPolarHBondContact OD1-CB 3.4Å; N318-H320 PolarHBondContact OD1-N 3.47Å; N318-N321 HydrophobicContact CB-CB 3.99Å; N318-N321 PolarHBondContact ND2-ND2 3.18Å; N318-N321 PolarHBondContact O-N 3.34Å; N318-N321 PolarHBondContact OD1-N 2.75Å; N318-D322 PolarHBondContact O-N 3.42Å
319	L	70	Confident	68.1	Low	13 Å²	13	76.5 Å²	76.5	7%	0.068	40%	0.395	C	S	.	.	H	α-helix	trans	-55.8	-33.5	178.6	-77.1	173.8	0	0	0	112.1	W175 F176 Y262 C266 I317 N321 D322 A323	W175-L319 HydrophobicContact CE3-CD1 4.19Å; W175-L319 HydrophobicContact CH2-CD1 3.23Å; W175-L319 HydrophobicContact CH2-CG 4.34Å; W175-L319 HydrophobicContact CZ2-CD1 4.25Å; W175-L319 HydrophobicContact CZ3-CD1 3.19Å; F176-L319 HydrophobicContact CE1-CD1 3.86Å; F176-L319 HydrophobicContact CZ-CD1 4.37Å; Y262-L319 HydrophobicContact CD2-CD2 4.02Å; Y262-L319 HydrophobicContact CE1-CD2 4.17Å; Y262-L319 HydrophobicContact CE2-CD2 3.35Å; Y262-L319 VanDerWaalsContact CZ-CD2 3.43Å; C266-L319 WeakPolarHBondContact SG-CD2 3.49Å; I317-L319 HydrophobicContact CG2-CD2 4.47Å; I317-L319 HydrophobicContact CG2-CG 4.07Å; L319-N321 VanDerWaalsContact C-N 3.34Å; L319-D322 PolarHBondContact O-N 2.84Å; L319-A323 PolarHBondContact O-N 3.43Å
320	H	66.8	Low	66.3	Low	44 Å²	44	76.5 Å²	76.5	20%	0.204	40%	0.401	C	S	.	.	H	α-helix	trans	-66	-39.3	178.4	-167.3	-90	0	0	0	111	N318 A323	N318-H320 PolarHBondContact O-N 2.96Å; N318-H320 WeakPolarHBondContact OD1-CA 3.31Å; N318-H320 WeakPolarHBondContact OD1-CB 3.4Å; N318-H320 PolarHBondContact OD1-N 3.47Å; H320-A323 WeakPolarHBondContact O-CB 3.14Å
321	N	66.3	Low	65	Low	98 Å²	98	81.8 Å²	81.8	52%	0.524	41%	0.414	S	S	.	.	H	α-helix	trans	-75.5	-35.6	177.3	-65.8	-15.2	0	0	0	112.6	N318 L319 A323	N318-N321 HydrophobicContact CB-CB 3.99Å; N318-N321 PolarHBondContact ND2-ND2 3.18Å; N318-N321 PolarHBondContact O-N 3.34Å; N318-N321 PolarHBondContact OD1-N 2.75Å; L319-N321 VanDerWaalsContact C-N 3.34Å; N321-A323 PolarHBondContact O-N 3.08Å
322	D	66.7	Low	64	Low	60 Å²	60	83.6 Å²	83.6	32%	0.321	42%	0.423	S	S	.	.	H	α-helix	trans	-73	-19.2	176.9	-74.8	-29	0	0	0	112.6	Y262 N318 L319 L324	Y262-D322 HydrophobicContact CE1-CB 4.44Å; Y262-D322 PolarHBondContact OH-OD2 2.57Å; N318-D322 PolarHBondContact O-N 3.42Å; L319-D322 PolarHBondContact O-N 2.84Å; D322-L324 PolarHBondContact O-N 2.92Å
323	A	58.9	Low	63.7	Low	7 Å²	7	77.6 Å²	77.6	6%	0.058	39%	0.392	C	S	.	.			trans	-66.1	88.3	164.6	0	0	0	0	0	108.1	C266 R270 L319 H320 N321	C266-A323 HydrophobicContact CB-CB 3.81Å; C266-A323 WeakPolarHBondContact O-CB 3.34Å; R270-A323 HydrophobicContact CG-CB 3.94Å; R270-A323 VanDerWaalsContact CZ-O 3.27Å; R270-A323 PolarHBondContact NE-O 3.27Å; R270-A323 PolarHBondContact NH2-O 3.38Å; L319-A323 PolarHBondContact O-N 3.43Å; H320-A323 WeakPolarHBondContact O-CB 3.14Å; N321-A323 PolarHBondContact O-N 3.08Å
324	L	58.5	Low	63.8	Low	123 Å²	123	79.2 Å²	79.2	64%	0.644	40%	0.402	S	S	*	.			trans	-77.8	135.7	166.6	-72.1	170.6	0	0	0	109.1	D322 K326	D322-L324 PolarHBondContact O-N 2.92Å; L324-K326 PolarHBondContact O-N 3Å
325	P	53.6	Low	64.4	Low	77 Å²	77	75.6 Å²	75.6	50%	0.5	38%	0.379	S	S	.	.	S	Bend	trans	-69.3	-19.1	-176.7	24.2	-29	0	0	0	113.7	R270	R270-P325 VanDerWaalsContact NH2-CD 3.31Å; R270-P325 VanDerWaalsContact NH2-N 3.16Å
326	K	51.2	Low	65.1	Low	144 Å²	144	69.3 Å²	69.3	63%	0.626	35%	0.352	S	S	*	.			trans	-111.5	104.9	-177.6	-69.7	-174.7	178.6	-179.3	0	111.5	L324 T328	L324-K326 PolarHBondContact O-N 3Å; K326-T328 PolarHBondContact O-N 3.34Å
327	F	53.9	Low	66.1	Low	133 Å²	133	66.2 Å²	66.2	58%	0.583	33%	0.333	S	S	*	.			trans	-64.8	114.2	162.1	-175.1	-93	0	0	0	108.6	W263	W263-F327 HydrophobicContact CZ2-CD2 4.46Å
328	T	51	Low	67.3	Low	73 Å²	73	65.1 Å²	65.1	45%	0.448	33%	0.327	S	S	.	.			trans	-105.7	135.4	146.6	58	0	0	0	0	105.5	K326 Q330 R331	K326-T328 PolarHBondContact O-N 3.34Å; T328-Q330 PolarHBondContact O-N 3.17Å; T328-R331 PolarHBondContact O-N 3.33Å
329	S	50.5	Low	68.6	Low	63 Å²	63	66 Å²	66	44%	0.441	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-13.8	172.2	48.3	0	0	0	0	113.4
330	Q	53	Low	69.7	Low	150 Å²	150	65.5 Å²	65.5	70%	0.701	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-15.4	179.5	-60.1	-172	-0.5	0	0	115.1	T328	T328-Q330 PolarHBondContact O-N 3.17Å
331	R	62.2	Low	71.2	Confident	212 Å²	212	63.4 Å²	63.4	80%	0.8	32%	0.317	S	S	*	.			trans	-139.9	73.9	-176.7	-66	-171.4	-177.2	-175.7	0.3	112.3	T328	T328-R331 PolarHBondContact O-N 3.33Å
332	M	66.4	Low	72.6	Confident	49 Å²	49	58.7 Å²	58.7	24%	0.241	29%	0.292	C	S	.	.			trans	-63.9	137.3	163.5	-71.6	-171	80.3	0	0	109.1	S259 N260 V334	S259-M332 WeakPolarHBondContact O-CE 3.41Å; N260-M332 HydrophobicContact CB-CE 4.1Å; M332-V334 PolarHBondContact O-N 3.48Å
333	P	73.5	Confident	73.9	Confident	27 Å²	27	55.9 Å²	55.9	18%	0.175	28%	0.277	C	S	.	.			trans	-58.6	134.2	172.3	25.6	-32.6	0	0	0	108.7	Y262 W263 P335	Y262-P333 HydrophobicContact CD1-CB 4.45Å; Y262-P333 HydrophobicContact CD1-CG 4.28Å; Y262-P333 HydrophobicContact CE1-CB 4.28Å; W263-P333 HydrophobicContact CB-CG 4.12Å; P333-P335 WeakPolarHBondContact O-CD 3.36Å
334	V	83.6	Confident	75.7	Confident	47 Å²	47	55.5 Å²	55.5	29%	0.285	27%	0.274	S	S	.	.			trans	-89.6	112.5	177.6	178.3	0	0	0	0	107.3	M332 M338 K339 V562	M332-V334 PolarHBondContact O-N 3.48Å; V334-M338 HydrophobicContact CG1-CB 4.08Å; V334-M338 HydrophobicContact CG1-CG 4.29Å; V334-M338 HydrophobicContact CG1-SD 4.29Å; V334-K339 HydrophobicContact CG1-CG 3.74Å; V334-V562 HydrophobicContact CB-CG2 4.42Å; V334-V562 HydrophobicContact CG1-CB 4.3Å; V334-V562 HydrophobicContact CG1-CG1 3.57Å; V334-V562 HydrophobicContact CG1-CG2 3.67Å; V334-V562 HydrophobicContact CG2-CG2 3.8Å
335	P	87.8	Confident	77.5	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.243	C	C	.	.			trans	-55.8	142.3	178.6	-21.1	31.5	0	0	0	110.8	L258 Y262 P333 E337 M338 K339	L258-P335 HydrophobicContact CD2-CB 4.36Å; L258-P335 HydrophobicContact CD2-CG 4.17Å; L258-P335 HydrophobicContact CG-CG 4.17Å; Y262-P335 HydrophobicContact CD1-CB 4.22Å; Y262-P335 HydrophobicContact CD1-CG 3.87Å; Y262-P335 HydrophobicContact CD2-CB 3.72Å; Y262-P335 HydrophobicContact CD2-CG 3.96Å; Y262-P335 HydrophobicContact CE1-CB 4.38Å; Y262-P335 HydrophobicContact CE1-CG 4.44Å; Y262-P335 HydrophobicContact CE2-CB 3.91Å; Y262-P335 HydrophobicContact CG-CB 3.89Å; Y262-P335 HydrophobicContact CG-CG 3.61Å; P333-P335 WeakPolarHBondContact O-CD 3.36Å; P335-E337 PolarHBondContact O-N 3.04Å; P335-M338 HydrophobicContact CB-CB 4.4Å; P335-M338 WeakPolarHBondContact O-CA 3.41Å; P335-M338 VanDerWaalsContact O-CB 3.26Å; P335-M338 WeakPolarHBondContact O-CB 3.24Å; P335-M338 PolarHBondContact O-N 3.15Å; P335-K339 PolarHBondContact O-N 2.62Å
336	L	88.3	Confident	79.4	Confident	9 Å²	9	46 Å²	46	5%	0.047	22%	0.22	C	C	.	.	H	α-helix	trans	-59.6	-31.3	177.6	-172.8	55.8	0	0	0	111.7	A283 M286 V313 I317 M338 K339 A340	A283-L336 HydrophobicContact CB-CD1 4.1Å; A283-L336 HydrophobicContact CB-CD2 4.1Å; A283-L336 HydrophobicContact CB-CG 4.39Å; M286-L336 HydrophobicContact CE-CB 3.82Å; M286-L336 HydrophobicContact CE-CD2 3.51Å; M286-L336 HydrophobicContact CE-CG 3.64Å; M286-L336 HydrophobicContact SD-CB 3.91Å; M286-L336 HydrophobicContact SD-CD2 4.33Å; M286-L336 HydrophobicContact SD-CG 3.81Å; V313-L336 HydrophobicContact CG1-CD1 3.8Å; I317-L336 HydrophobicContact CD1-CB 3.82Å; I317-L336 HydrophobicContact CD1-CD2 4.37Å; I317-L336 HydrophobicContact CG1-CB 3.52Å; I317-L336 HydrophobicContact CG1-CD2 3.45Å; I317-L336 VanDerWaalsContact CG1-CD2 3.45Å; I317-L336 HydrophobicContact CG1-CG 4.06Å; L336-M338 VanDerWaalsContact C-N 3.25Å; L336-M338 PolarHBondContact O-N 2.97Å; L336-K339 HydrophobicContact CD1-CB 4.24Å; L336-K339 HydrophobicContact CD1-CD 4.14Å; L336-K339 PolarHBondContact O-N 2.81Å; L336-K339 VanDerWaalsContact O-N 3.12Å; L336-A340 WeakPolarHBondContact O-CB 3.45Å; L336-A340 PolarHBondContact O-N 2.89Å
337	E	91.2	Very high	81.4	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.009	19%	0.19	C	C	.	.	H	α-helix	trans	-55	-42	172.3	-63.6	167.5	-161.9	0	0	112	L186 V187 S188 M286 F290 P335 A340 M341 L552	L186-E337 WeakPolarHBondContact CA-OE1 3.32Å; L186-E337 HydrophobicContact CB-CG 4.3Å; L186-E337 WeakPolarHBondContact CB-OE1 3.4Å; L186-E337 HydrophobicContact CD1-CG 3.97Å; L186-E337 HydrophobicContact CD2-CG 3.83Å; L186-E337 WeakPolarHBondContact CD2-OE1 3.5Å; L186-E337 HydrophobicContact CG-CG 4.21Å; V187-E337 PolarHBondContact N-OE1 3.41Å; S188-E337 VanDerWaalsContact CB-OE2 3.26Å; S188-E337 WeakPolarHBondContact CB-OE2 3.29Å; S188-E337 PolarHBondContact N-OE2 3.37Å; S188-E337 PolarHBondContact OG-OE2 3.31Å; M286-E337 HydrophobicContact SD-CB 4.31Å; M286-E337 HydrophobicContact SD-CG 3.74Å; M286-E337 PolarHBondContact SD-N 2.84Å; M286-E337 VanDerWaalsContact SD-N 3.39Å; F290-E337 HydrophobicContact CE2-CB 4.11Å; F290-E337 VanDerWaalsContact CE2-O 3.27Å; F290-E337 WeakPolarHBondContact CE2-O 3.03Å; F290-E337 HydrophobicContact CZ-CB 4.01Å; P335-E337 PolarHBondContact O-N 3.04Å; E337-A340 PolarHBondContact O-N 2.84Å; E337-M341 WeakPolarHBondContact O-CB 3.26Å; E337-M341 PolarHBondContact O-N 2.67Å; E337-L552 HydrophobicContact CB-CD2 4.04Å
338	M	93.1	Very high	83.3	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-69.2	-40.6	178.6	-165.6	165.8	-158.5	0	0	111.2	V334 P335 L336 M341 C342 L552 C554 L558 L559 V562	V334-M338 HydrophobicContact CG1-CB 4.08Å; V334-M338 HydrophobicContact CG1-CG 4.29Å; V334-M338 HydrophobicContact CG1-SD 4.29Å; P335-M338 HydrophobicContact CB-CB 4.4Å; P335-M338 WeakPolarHBondContact O-CA 3.41Å; P335-M338 VanDerWaalsContact O-CB 3.26Å; P335-M338 WeakPolarHBondContact O-CB 3.24Å; P335-M338 PolarHBondContact O-N 3.15Å; L336-M338 VanDerWaalsContact C-N 3.25Å; L336-M338 PolarHBondContact O-N 2.97Å; M338-M341 PolarHBondContact O-N 2.96Å; M338-C342 PolarHBondContact O-N 2.97Å; M338-C342 PolarHBondContact O-SG 3.06Å; M338-L552 HydrophobicContact CB-CD1 4.29Å; M338-L552 HydrophobicContact CG-CD1 4.09Å; M338-C554 HydrophobicContact CE-CB 4.12Å; M338-L558 HydrophobicContact CE-CB 4.03Å; M338-L558 HydrophobicContact CE-CD2 4.02Å; M338-L558 HydrophobicContact CE-CG 3.66Å; M338-L559 HydrophobicContact CE-CB 3.9Å; M338-L559 HydrophobicContact CE-CD1 4.05Å; M338-L559 VanDerWaalsContact CE-N 3.3Å; M338-L559 HydrophobicContact CG-CD1 3.79Å; M338-V562 HydrophobicContact CE-CG2 4.17Å; M338-V562 HydrophobicContact CG-CG1 4.43Å; M338-V562 HydrophobicContact CG-CG2 4.31Å; M338-V562 HydrophobicContact SD-CG2 3.95Å
339	K	93.5	Very high	85.2	Confident	54 Å²	54	30 Å²	30	24%	0.235	14%	0.143	C	C	.	.	H	α-helix	trans	-64.3	-46.1	174.7	-59.1	-176.7	-175.1	176.7	0	111.1	V313 V334 P335 L336 M341 C342 V343 M566	V313-K339 HydrophobicContact CG1-CB 4.47Å; V313-K339 HydrophobicContact CG1-CD 4Å; V334-K339 HydrophobicContact CG1-CG 3.74Å; P335-K339 PolarHBondContact O-N 2.62Å; L336-K339 HydrophobicContact CD1-CB 4.24Å; L336-K339 HydrophobicContact CD1-CD 4.14Å; L336-K339 PolarHBondContact O-N 2.81Å; L336-K339 VanDerWaalsContact O-N 3.12Å; K339-M341 VanDerWaalsContact C-N 3.32Å; K339-M341 PolarHBondContact O-N 3.29Å; K339-C342 CarbonylContact O-C 3.6Å; K339-C342 WeakPolarHBondContact O-CA 3.11Å; K339-C342 WeakPolarHBondContact O-CB 3.44Å; K339-C342 PolarHBondContact O-N 3.41Å; K339-C342 VanDerWaalsContact O-N 3.09Å; K339-V343 WeakPolarHBondContact O-CG2 3.46Å; K339-V343 PolarHBondContact O-N 2.89Å; K339-M566 HydrophobicContact CB-CE 4.14Å; K339-M566 HydrophobicContact CB-SD 3.99Å; K339-M566 HydrophobicContact CG-SD 4.23Å
340	A	94.6	Very high	87	Confident	2 Å²	2	27.4 Å²	27.4	2%	0.017	13%	0.127	C	C	.	.	H	α-helix	trans	-58.3	-44.4	177.8	0	0	0	0	0	111.5	M286 I287 F290 L336 E337 V343 I344	M286-A340 HydrophobicContact CB-CB 3.71Å; I287-A340 HydrophobicContact CG1-CB 3.9Å; F290-A340 HydrophobicContact CD2-CB 4.1Å; F290-A340 HydrophobicContact CE2-CB 4.21Å; L336-A340 WeakPolarHBondContact O-CB 3.45Å; L336-A340 PolarHBondContact O-N 2.89Å; E337-A340 PolarHBondContact O-N 2.84Å; A340-V343 WeakPolarHBondContact O-CB 3.11Å; A340-V343 PolarHBondContact O-N 2.94Å; A340-I344 PolarHBondContact O-N 3.15Å; A340-I344 VanDerWaalsContact O-N 3.09Å
341	M	96.6	Very high	88.7	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-63.3	-41.2	173.5	-169.5	65.6	73.8	0	0	112.3	F290 L294 E337 M338 K339 V343 I344 I345 C548 L552	F290-M341 HydrophobicContact CB-CE 4.26Å; F290-M341 HydrophobicContact CD1-CE 3.4Å; F290-M341 VanDerWaalsContact CD1-CE 3.4Å; F290-M341 HydrophobicContact CD2-CE 4.16Å; F290-M341 HydrophobicContact CE1-CE 3.67Å; F290-M341 HydrophobicContact CE2-CE 4.37Å; F290-M341 HydrophobicContact CG-CE 3.69Å; F290-M341 HydrophobicContact CZ-CE 4.16Å; L294-M341 HydrophobicContact CD1-CE 4.5Å; L294-M341 HydrophobicContact CD1-SD 3.99Å; E337-M341 WeakPolarHBondContact O-CB 3.26Å; E337-M341 PolarHBondContact O-N 2.67Å; M338-M341 PolarHBondContact O-N 2.96Å; K339-M341 VanDerWaalsContact C-N 3.32Å; K339-M341 PolarHBondContact O-N 3.29Å; M341-V343 VanDerWaalsContact C-N 3.32Å; M341-V343 PolarHBondContact O-N 3.11Å; M341-I344 PolarHBondContact O-N 3.11Å; M341-I345 HydrophobicContact CG-CD1 4.18Å; M341-I345 WeakPolarHBondContact O-CG1 3.2Å; M341-I345 PolarHBondContact O-N 2.98Å; M341-C548 HydrophobicContact CG-CB 3.67Å; M341-C548 HydrophobicContact SD-CB 3.83Å; M341-L552 HydrophobicContact CB-CD1 3.71Å; M341-L552 HydrophobicContact CB-CD2 4.34Å; M341-L552 HydrophobicContact CB-CG 4.27Å; M341-L552 HydrophobicContact CE-CD2 4.36Å; M341-L552 HydrophobicContact CE-CG 4.22Å; M341-L552 HydrophobicContact CG-CD1 3.82Å; M341-L552 HydrophobicContact CG-CG 4.27Å
342	C	95.9	Very high	90	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-59.9	-41.3	173.6	-74.4	0	0	0	0	112	M338 K339 I344 I345 I346 L559 L563 M566	M338-C342 PolarHBondContact O-N 2.97Å; M338-C342 PolarHBondContact O-SG 3.06Å; K339-C342 CarbonylContact O-C 3.6Å; K339-C342 WeakPolarHBondContact O-CA 3.11Å; K339-C342 WeakPolarHBondContact O-CB 3.44Å; K339-C342 PolarHBondContact O-N 3.41Å; K339-C342 VanDerWaalsContact O-N 3.09Å; C342-I344 VanDerWaalsContact C-N 3.32Å; C342-I344 PolarHBondContact O-N 3.1Å; C342-I345 PolarHBondContact O-N 3.39Å; C342-I346 VanDerWaalsContact O-CG1 3.28Å; C342-I346 WeakPolarHBondContact O-CG1 3.4Å; C342-I346 PolarHBondContact O-N 3.36Å; C342-L559 VanDerWaalsContact SG-CD1 3.53Å; C342-L563 HydrophobicContact CB-CD1 4.13Å; C342-M566 HydrophobicContact CB-CE 4.32Å; C342-M566 HydrophobicContact CB-SD 3.5Å; C342-M566 VanDerWaalsContact CB-SD 3.5Å
343	V	95.5	Very high	90.9	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-58.9	-44.7	174.5	175.9	0	0	0	0	111.2	I287 A304 V307 L308 L311 K339 A340 M341 I345 I346 A347 M566	I287-V343 HydrophobicContact CD1-CB 4.17Å; I287-V343 HydrophobicContact CD1-CG1 3.82Å; A304-V343 HydrophobicContact CB-CG1 4.14Å; A304-V343 WeakPolarHBondContact O-CG1 3.4Å; V307-V343 HydrophobicContact CB-CG1 3.87Å; V307-V343 HydrophobicContact CG1-CG1 3.94Å; L308-V343 HydrophobicContact CB-CG1 4.19Å; L308-V343 HydrophobicContact CD1-CG2 4.21Å; L311-V343 HydrophobicContact CD1-CG2 3.84Å; K339-V343 WeakPolarHBondContact O-CG2 3.46Å; K339-V343 PolarHBondContact O-N 2.89Å; A340-V343 WeakPolarHBondContact O-CB 3.11Å; A340-V343 PolarHBondContact O-N 2.94Å; M341-V343 VanDerWaalsContact C-N 3.32Å; M341-V343 PolarHBondContact O-N 3.11Å; V343-I345 VanDerWaalsContact C-N 3.34Å; V343-I345 PolarHBondContact O-N 2.88Å; V343-I346 PolarHBondContact O-N 3.37Å; V343-A347 PolarHBondContact O-N 3Å; V343-M566 HydrophobicContact CG2-CE 3.5Å; V343-M566 VanDerWaalsContact CG2-CE 3.5Å
344	I	96.7	Very high	91.5	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-61.5	-43.6	175.7	-67.8	169.3	0	0	0	110.9	I287 F290 L294 L296 A304 A340 M341 C342 I346 A347 L348	I287-I344 HydrophobicContact CG2-CD1 4.36Å; I287-I344 HydrophobicContact CG2-CG1 4.17Å; F290-I344 HydrophobicContact CB-CD1 3.42Å; F290-I344 VanDerWaalsContact CB-CD1 3.42Å; F290-I344 HydrophobicContact CG-CD1 4.44Å; L294-I344 HydrophobicContact CD1-CG2 4.14Å; L296-I344 HydrophobicContact CD1-CG2 3.65Å; A304-I344 HydrophobicContact CB-CG1 4.19Å; A340-I344 PolarHBondContact O-N 3.15Å; A340-I344 VanDerWaalsContact O-N 3.09Å; M341-I344 PolarHBondContact O-N 3.11Å; C342-I344 VanDerWaalsContact C-N 3.32Å; C342-I344 PolarHBondContact O-N 3.1Å; I344-I346 VanDerWaalsContact C-N 3.34Å; I344-I346 PolarHBondContact O-N 2.76Å; I344-A347 PolarHBondContact O-N 2.9Å; I344-L348 HydrophobicContact CG2-CD1 3.94Å; I344-L348 HydrophobicContact CG2-CG 4.36Å; I344-L348 WeakPolarHBondContact O-CG 3.49Å; I344-L348 PolarHBondContact O-N 3.12Å
345	I	96.2	Very high	91.6	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-61.4	-42.6	176.8	-67.9	160.9	0	0	0	110.9	M341 C342 V343 L348 K349 F541 L544 L545 C548 L559 L563	M341-I345 HydrophobicContact CG-CD1 4.18Å; M341-I345 WeakPolarHBondContact O-CG1 3.2Å; M341-I345 PolarHBondContact O-N 2.98Å; C342-I345 PolarHBondContact O-N 3.39Å; V343-I345 VanDerWaalsContact C-N 3.34Å; V343-I345 PolarHBondContact O-N 2.88Å; I345-L348 PolarHBondContact O-N 3.35Å; I345-K349 WeakPolarHBondContact O-CB 3.39Å; I345-K349 PolarHBondContact O-N 2.75Å; I345-F541 HydrophobicContact CG2-CE2 3.9Å; I345-L544 HydrophobicContact CG1-CD2 4.44Å; I345-L544 HydrophobicContact CG1-CG 4.41Å; I345-L544 HydrophobicContact CG2-CD2 4.22Å; I345-L545 HydrophobicContact CD1-CD2 4.19Å; I345-C548 HydrophobicContact CD1-CB 3.86Å; I345-C548 HydrophobicContact CG1-CB 4.43Å; I345-L559 HydrophobicContact CD1-CD2 3.89Å; I345-L559 HydrophobicContact CD1-CG 4.25Å; I345-L563 HydrophobicContact CB-CD1 4.26Å; I345-L563 HydrophobicContact CG2-CD1 4Å; I345-L563 HydrophobicContact CG2-CD2 3.83Å
346	I	93.4	Very high	91.5	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60.6	-46.5	175.9	-69.3	168.6	0	0	0	110.3	V307 C342 V343 I344 K349 G350 F505 Y511 L563 M566 E567 L570	V307-I346 HydrophobicContact CG1-CB 4.24Å; V307-I346 HydrophobicContact CG1-CG2 3.72Å; V307-I346 HydrophobicContact CG2-CG2 4.42Å; C342-I346 VanDerWaalsContact O-CG1 3.28Å; C342-I346 WeakPolarHBondContact O-CG1 3.4Å; C342-I346 PolarHBondContact O-N 3.36Å; V343-I346 PolarHBondContact O-N 3.37Å; I344-I346 VanDerWaalsContact C-N 3.34Å; I344-I346 PolarHBondContact O-N 2.76Å; I346-K349 PolarHBondContact O-N 3.07Å; I346-G350 PolarHBondContact O-N 2.98Å; I346-F505 HydrophobicContact CG2-CE1 4.08Å; I346-F505 HydrophobicContact CG2-CZ 3.57Å; I346-Y511 HydrophobicContact CG2-CE2 4.34Å; I346-L563 HydrophobicContact CD1-CD1 3.96Å; I346-L563 HydrophobicContact CG1-CD1 3.41Å; I346-L563 VanDerWaalsContact CG1-CD1 3.41Å; I346-M566 HydrophobicContact CD1-CB 4.12Å; I346-E567 HydrophobicContact CD1-CG 4.18Å; I346-E567 HydrophobicContact CG1-CG 4.15Å; I346-L570 HydrophobicContact CD1-CD1 4.01Å; I346-L570 HydrophobicContact CG2-CD1 3.65Å
347	A	93	Very high	91.3	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60	-49.8	178.2	0	0	0	0	0	111.3	T303 A304 V307 V343 I344 K349 G350 L351	T303-A347 HydrophobicContact CG2-CB 3.99Å; A304-A347 HydrophobicContact CB-CB 4.07Å; V307-A347 HydrophobicContact CG2-CB 4.27Å; V343-A347 PolarHBondContact O-N 3Å; I344-A347 PolarHBondContact O-N 2.9Å; A347-K349 PolarHBondContact O-N 2.69Å; A347-G350 PolarHBondContact O-N 3.16Å; A347-L351 WeakPolarHBondContact O-CB 3.4Å; A347-L351 VanDerWaalsContact O-CG 3.28Å; A347-L351 WeakPolarHBondContact O-CG 3.21Å; A347-L351 PolarHBondContact O-N 3.32Å
348	L	94	Very high	91.1	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-61.2	-46	177.3	-70.8	172.4	0	0	0	112	L296 I300 I344 I345 G350 L351 F352 F384 W387 L544	L296-L348 HydrophobicContact CD2-CD2 4.09Å; I300-L348 HydrophobicContact CD1-CD2 3.88Å; I300-L348 HydrophobicContact CG2-CD2 3.81Å; I300-L348 HydrophobicContact CG2-CG 4.38Å; I344-L348 HydrophobicContact CG2-CD1 3.94Å; I344-L348 HydrophobicContact CG2-CG 4.36Å; I344-L348 WeakPolarHBondContact O-CG 3.49Å; I344-L348 PolarHBondContact O-N 3.12Å; I345-L348 PolarHBondContact O-N 3.35Å; L348-G350 PolarHBondContact O-N 3.19Å; L348-L351 PolarHBondContact O-N 3.18Å; L348-F352 HydrophobicContact CD2-CD2 4.17Å; L348-F352 HydrophobicContact CD2-CE2 3.9Å; L348-F352 WeakPolarHBondContact O-CD2 3.27Å; L348-F352 PolarHBondContact O-N 2.72Å; L348-F384 HydrophobicContact CB-CE2 4.24Å; L348-F384 HydrophobicContact CD1-CE2 4.4Å; L348-F384 HydrophobicContact CD2-CD2 4.25Å; L348-F384 HydrophobicContact CD2-CE2 4.08Å; L348-F384 HydrophobicContact CG-CE2 4.48Å; L348-W387 HydrophobicContact CD1-CH2 3.57Å; L348-W387 HydrophobicContact CD1-CZ2 4.33Å; L348-W387 HydrophobicContact CD1-CZ3 4.02Å; L348-L544 HydrophobicContact CB-CD2 4.18Å; L348-L544 HydrophobicContact CD1-CD1 3.99Å; L348-L544 HydrophobicContact CD1-CD2 4.08Å
349	K	90.8	Very high	90.8	Very high	13 Å²	13	20 Å²	20	6%	0.057	11%	0.106	C	C	.	.	H	α-helix	trans	-59.4	-38.8	176.7	179.8	174.2	158.8	-172.5	0	111.7	I345 I346 A347 K353 L354 Y511 G512 H514 F541 E567	I345-K349 WeakPolarHBondContact O-CB 3.39Å; I345-K349 PolarHBondContact O-N 2.75Å; I346-K349 PolarHBondContact O-N 3.07Å; A347-K349 PolarHBondContact O-N 2.69Å; K349-K353 VanDerWaalsContact O-CA 3.27Å; K349-K353 WeakPolarHBondContact O-CA 3.36Å; K349-K353 PolarHBondContact O-N 3.24Å; K349-L354 HydrophobicContact CB-CD1 4.23Å; K349-Y511 HydrophobicContact CB-CE2 4.21Å; K349-Y511 HydrophobicContact CD-CE2 4.29Å; K349-Y511 WeakPolarHBondContact CD-OH 3.33Å; K349-Y511 HydrophobicContact CG-CE2 3.96Å; K349-G512 WeakPolarHBondContact CE-O 3.38Å; K349-G512 PolarHBondContact NZ-O 2.98Å; K349-H514 PolarHBondContact NZ-CD2 3.45Å; K349-H514 PolarHBondContact NZ-NE2 2.74Å; K349-H514 VanDerWaalsContact NZ-NE2 3.14Å; K349-F541 HydrophobicContact CD-CD2 4.32Å; K349-F541 HydrophobicContact CD-CE2 3.99Å; K349-E567 IonicContact NZ-OE1 3Å; K349-E567 PolarHBondContact NZ-OE1 2.83Å; K349-E567 IonicContact NZ-OE2 2.78Å
350	G	87.5	Confident	90.5	Very high	10 Å²	10	18.9 Å²	18.9	10%	0.103	10%	0.102	C	C	.	.	H	α-helix	trans	-69	-48.3	178.4	0	0	0	0	0	114.7	I346 A347 L348	I346-G350 PolarHBondContact O-N 2.98Å; A347-G350 PolarHBondContact O-N 3.16Å; L348-G350 PolarHBondContact O-N 3.19Å
351	L	89.1	Confident	90.2	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-67.5	-45.3	-178.1	-69.3	172.2	0	0	0	111.5	I300 T303 A347 L348 C502 P503	I300-L351 HydrophobicContact CG1-CD1 4.07Å; I300-L351 HydrophobicContact CG2-CD1 4.41Å; T303-L351 HydrophobicContact CG2-CD1 4.06Å; T303-L351 HydrophobicContact CG2-CD2 4.18Å; T303-L351 HydrophobicContact CG2-CG 4.14Å; A347-L351 WeakPolarHBondContact O-CB 3.4Å; A347-L351 VanDerWaalsContact O-CG 3.28Å; A347-L351 WeakPolarHBondContact O-CG 3.21Å; A347-L351 PolarHBondContact O-N 3.32Å; L348-L351 PolarHBondContact O-N 3.18Å; L351-C502 VanDerWaalsContact CD2-SG 3.51Å; L351-P503 HydrophobicContact CD2-CG 4.3Å
352	F	88.5	Confident	89.7	Confident	6 Å²	6	26.4 Å²	26.4	3%	0.026	14%	0.137	C	C	.	.	H	α-helix	trans	-103	1.3	-170.3	-59.9	-74.3	0	0	0	114.4	I300 L348 L354 H358 E359 M362 F382 F384 V499	I300-F352 HydrophobicContact CD1-CE2 3.86Å; I300-F352 HydrophobicContact CD1-CZ 4.06Å; L348-F352 HydrophobicContact CD2-CD2 4.17Å; L348-F352 HydrophobicContact CD2-CE2 3.9Å; L348-F352 WeakPolarHBondContact O-CD2 3.27Å; L348-F352 PolarHBondContact O-N 2.72Å; F352-L354 VanDerWaalsContact C-N 3.26Å; F352-L354 HydrophobicContact CB-CD2 3.73Å; F352-L354 PolarHBondContact O-N 2.9Å; F352-L354 VanDerWaalsContact O-N 3.16Å; F352-H358 PolarHBondContact O-CD2 3.39Å; F352-E359 HydrophobicContact CB-CB 4.19Å; F352-M362 HydrophobicContact CD1-SD 3.56Å; F352-M362 VanDerWaalsContact CD1-SD 3.56Å; F352-M362 HydrophobicContact CE1-SD 3.93Å; F352-F382 AromaticContact CE1-CD1 3.83Å; F352-F382 HydrophobicContact CE1-CD1 3.83Å; F352-F382 HydrophobicContact CE1-CE1 4.11Å; F352-F382 HydrophobicContact CE2-CD1 4.1Å; F352-F382 AromaticContact CE2-CE1 3.71Å; F352-F382 HydrophobicContact CE2-CE1 3.71Å; F352-F382 AromaticContact CZ-CD1 3.3Å; F352-F382 HydrophobicContact CZ-CD1 3.3Å; F352-F382 AromaticContact CZ-CE1 3.39Å; F352-F382 HydrophobicContact CZ-CE1 3.39Å; F352-F384 HydrophobicContact CB-CD2 4.39Å; F352-F384 HydrophobicContact CB-CG 4.42Å; F352-F384 HydrophobicContact CD1-CB 3.82Å; F352-F384 HydrophobicContact CD1-CG 4.38Å; F352-F384 HydrophobicContact CD2-CB 4.3Å; F352-F384 AromaticContact CD2-CD2 3.52Å; F352-F384 HydrophobicContact CD2-CD2 3.52Å; F352-F384 HydrophobicContact CD2-CE2 4.24Å; F352-F384 HydrophobicContact CD2-CG 4.15Å; F352-F384 HydrophobicContact CE1-CB 4.06Å; F352-F384 AromaticContact CE2-CD2 3.96Å; F352-F384 HydrophobicContact CE2-CD2 3.96Å; F352-F384 HydrophobicContact CG-CB 3.98Å; F352-F384 AromaticContact CG-CD2 3.88Å; F352-F384 HydrophobicContact CG-CD2 3.88Å; F352-F384 HydrophobicContact CG-CG 4.04Å; F352-F384 HydrophobicContact CZ-CB 4.43Å; F352-V499 HydrophobicContact CZ-CG1 4.32Å
353	K	85.8	Confident	89.4	Confident	70 Å²	70	26.6 Å²	26.6	30%	0.304	14%	0.138	S	C	.	.			trans	40.8	52.2	-178.7	-45.3	-177.5	-174.1	173.9	0	113.2	K349 N355 H358 N510	K349-K353 VanDerWaalsContact O-CA 3.27Å; K349-K353 WeakPolarHBondContact O-CA 3.36Å; K349-K353 PolarHBondContact O-N 3.24Å; K353-N355 WeakPolarHBondContact O-CB 3.37Å; K353-N355 VanDerWaalsContact O-CG 3.31Å; K353-N355 PolarHBondContact O-N 3.04Å; K353-H358 VanDerWaalsContact CB-CD2 3.5Å; K353-H358 WeakPolarHBondContact CB-CD2 3.46Å; K353-N510 HydrophobicContact CD-CB 4.48Å
354	L	87.4	Confident	89.2	Confident	17 Å²	17	26.9 Å²	26.9	9%	0.089	14%	0.14	C	C	.	.			trans	-47	101.7	-170.3	-56	176.2	0	0	0	112.1	K349 F352 E359 F384 S538 T540 F541 L544	K349-L354 HydrophobicContact CB-CD1 4.23Å; F352-L354 VanDerWaalsContact C-N 3.26Å; F352-L354 HydrophobicContact CB-CD2 3.73Å; F352-L354 PolarHBondContact O-N 2.9Å; F352-L354 VanDerWaalsContact O-N 3.16Å; L354-E359 HydrophobicContact CD2-CB 4.26Å; L354-E359 HydrophobicContact CD2-CG 4.42Å; L354-F384 HydrophobicContact CD1-CZ 4.14Å; L354-F384 HydrophobicContact CD2-CD1 3.97Å; L354-F384 HydrophobicContact CD2-CD2 4.35Å; L354-F384 HydrophobicContact CD2-CE1 3.52Å; L354-F384 HydrophobicContact CD2-CE2 3.9Å; L354-F384 HydrophobicContact CD2-CG 4.39Å; L354-F384 HydrophobicContact CD2-CZ 3.47Å; L354-F384 VanDerWaalsContact CD2-CZ 3.47Å; L354-F384 HydrophobicContact CG-CZ 4.46Å; L354-S538 PolarHBondContact O-OG 3.49Å; L354-T540 HydrophobicContact CD2-CG2 3.97Å; L354-F541 HydrophobicContact CB-CB 4.34Å; L354-F541 HydrophobicContact CD1-CD2 4.25Å; L354-L544 HydrophobicContact CD1-CD2 3.63Å
355	N	85.1	Confident	88.8	Confident	82 Å²	82	32.1 Å²	32.1	44%	0.439	17%	0.165	S	C	.	.	S	Bend	trans	-143.4	21.2	-175.2	74.1	15.6	0	0	0	113.3	K353 S357 H358 E359	K353-N355 WeakPolarHBondContact O-CB 3.37Å; K353-N355 VanDerWaalsContact O-CG 3.31Å; K353-N355 PolarHBondContact O-N 3.04Å; N355-S357 PolarHBondContact O-N 3.5Å; N355-S357 PolarHBondContact OD1-N 3.25Å; N355-H358 VanDerWaalsContact OD1-CB 3.28Å; N355-H358 WeakPolarHBondContact OD1-CB 3.18Å; N355-H358 PolarHBondContact OD1-N 3.26Å; N355-E359 PolarHBondContact N-OE2 2.93Å
356	D	84.9	Confident	88.4	Confident	45 Å²	45	32.7 Å²	32.7	24%	0.241	17%	0.169	C	C	.	.	S	Bend	trans	69.9	-19.6	-175.4	-57.6	-39.5	0	0	0	115.3	E359 Q360 S538 A539 T540	D356-E359 WeakPolarHBondContact CA-OE1 3.31Å; D356-E359 PolarHBondContact N-OE1 2.77Å; D356-E359 PolarHBondContact N-OE2 3.49Å; D356-Q360 VanDerWaalsContact O-CD 3.29Å; D356-Q360 PolarHBondContact O-NE2 3.27Å; D356-S538 VanDerWaalsContact CG-CB 3.47Å; D356-S538 WeakPolarHBondContact OD1-CB 3.11Å; D356-S538 WeakPolarHBondContact OD2-CA 2.99Å; D356-S538 WeakPolarHBondContact OD2-CB 3.41Å; D356-A539 VanDerWaalsContact CG-N 3.25Å; D356-A539 WeakPolarHBondContact OD1-CA 3.06Å; D356-A539 WeakPolarHBondContact OD1-CB 3.41Å; D356-A539 PolarHBondContact OD1-N 3.3Å; D356-A539 PolarHBondContact OD2-N 3.12Å; D356-T540 PolarHBondContact OD1-N 3.4Å; D356-T540 PolarHBondContact OD1-OG1 3.36Å
357	S	85.5	Confident	88.1	Confident	67 Å²	67	33 Å²	33	47%	0.469	17%	0.171	S	C	.	.	S	Bend	trans	-114.5	-48.4	-174.9	-54.1	0	0	0	0	112.4	N355 Q360 E361	N355-S357 PolarHBondContact O-N 3.5Å; N355-S357 PolarHBondContact OD1-N 3.25Å; S357-Q360 WeakPolarHBondContact O-CB 3.46Å; S357-Q360 PolarHBondContact O-N 3.43Å; S357-E361 WeakPolarHBondContact O-CG 3.3Å; S357-E361 PolarHBondContact O-N 3.32Å
358	H	85.6	Confident	87.8	Confident	50 Å²	50	39.1 Å²	39.1	23%	0.231	19%	0.194	C	C	.	.	H	α-helix	trans	-66.2	-43.7	-172.2	-172.4	67.5	0	0	0	112.1	F352 K353 N355 Q360 E361 M362	F352-H358 PolarHBondContact O-CD2 3.39Å; K353-H358 VanDerWaalsContact CB-CD2 3.5Å; K353-H358 WeakPolarHBondContact CB-CD2 3.46Å; N355-H358 VanDerWaalsContact OD1-CB 3.28Å; N355-H358 WeakPolarHBondContact OD1-CB 3.18Å; N355-H358 PolarHBondContact OD1-N 3.26Å; H358-Q360 PolarHBondContact O-N 3.39Å; H358-E361 PolarHBondContact O-N 3.46Å; H358-M362 VanDerWaalsContact NE2-CE 3.27Å; H358-M362 WeakPolarHBondContact NE2-CE 2.89Å; H358-M362 VanDerWaalsContact O-CB 3.22Å; H358-M362 WeakPolarHBondContact O-CB 3.42Å; H358-M362 PolarHBondContact O-N 2.7Å
359	E	86.3	Confident	87.3	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.009	21%	0.212	C	C	.	.	H	α-helix	trans	-65.2	-28.8	177	67.8	-85.8	-159.9	0	0	112.4	F352 L354 N355 D356 A363 F384 P385 T540	F352-E359 HydrophobicContact CB-CB 4.19Å; L354-E359 HydrophobicContact CD2-CB 4.26Å; L354-E359 HydrophobicContact CD2-CG 4.42Å; N355-E359 PolarHBondContact N-OE2 2.93Å; D356-E359 WeakPolarHBondContact CA-OE1 3.31Å; D356-E359 PolarHBondContact N-OE1 2.77Å; D356-E359 PolarHBondContact N-OE2 3.49Å; E359-A363 WeakPolarHBondContact O-CB 3.12Å; E359-A363 PolarHBondContact O-N 3.08Å; E359-F384 HydrophobicContact CB-CD1 4.23Å; E359-F384 HydrophobicContact CG-CD1 4.25Å; E359-P385 HydrophobicContact CG-CG 4.47Å; E359-T540 HydrophobicContact CG-CG2 4.18Å; E359-T540 WeakPolarHBondContact OE1-CB 3.17Å; E359-T540 WeakPolarHBondContact OE1-CG2 3.49Å; E359-T540 PolarHBondContact OE1-OG1 3.33Å
360	Q	87.5	Confident	87	Confident	30 Å²	30	43.8 Å²	43.8	14%	0.14	22%	0.215	C	C	.	.	H	α-helix	trans	-74.8	-47.3	174.1	-62.7	-175	24.6	0	0	111	D356 S357 H358 M362 A363 L364 I418 V422	D356-Q360 VanDerWaalsContact O-CD 3.29Å; D356-Q360 PolarHBondContact O-NE2 3.27Å; S357-Q360 WeakPolarHBondContact O-CB 3.46Å; S357-Q360 PolarHBondContact O-N 3.43Å; H358-Q360 PolarHBondContact O-N 3.39Å; Q360-M362 VanDerWaalsContact C-N 3.33Å; Q360-M362 PolarHBondContact O-N 3.23Å; Q360-A363 PolarHBondContact O-N 3.11Å; Q360-L364 VanDerWaalsContact O-CG 3.3Å; Q360-L364 WeakPolarHBondContact O-CG 3.4Å; Q360-L364 PolarHBondContact O-N 3.09Å; Q360-I418 HydrophobicContact CG-CG2 4.29Å; Q360-I418 VanDerWaalsContact NE2-CG2 3.29Å; Q360-V422 HydrophobicContact CB-CG2 4.34Å
361	E	88	Confident	86.7	Confident	119 Å²	119	48 Å²	48	56%	0.556	23%	0.232	S	C	*	.	H	α-helix	trans	-60.4	-44.5	178.3	-74	177	173.3	0	0	111	S357 H358 A363 L364 E365	S357-E361 WeakPolarHBondContact O-CG 3.3Å; S357-E361 PolarHBondContact O-N 3.32Å; H358-E361 PolarHBondContact O-N 3.46Å; E361-A363 PolarHBondContact O-N 3.19Å; E361-L364 PolarHBondContact O-N 3.05Å; E361-E365 VanDerWaalsContact O-CB 3.28Å; E361-E365 WeakPolarHBondContact O-CB 3.25Å; E361-E365 PolarHBondContact O-N 3.29Å
362	M	87.8	Confident	86.4	Confident	42 Å²	42	54.2 Å²	54.2	21%	0.207	27%	0.265	C	S	.	.	H	α-helix	trans	-59.8	-44.4	175.2	-174.1	-174.3	-65	0	0	111.5	F352 H358 Q360 E365 A366	F352-M362 HydrophobicContact CD1-SD 3.56Å; F352-M362 VanDerWaalsContact CD1-SD 3.56Å; F352-M362 HydrophobicContact CE1-SD 3.93Å; H358-M362 VanDerWaalsContact NE2-CE 3.27Å; H358-M362 WeakPolarHBondContact NE2-CE 2.89Å; H358-M362 VanDerWaalsContact O-CB 3.22Å; H358-M362 WeakPolarHBondContact O-CB 3.42Å; H358-M362 PolarHBondContact O-N 2.7Å; Q360-M362 VanDerWaalsContact C-N 3.33Å; Q360-M362 PolarHBondContact O-N 3.23Å; M362-E365 PolarHBondContact O-N 3.24Å; M362-A366 VanDerWaalsContact O-CB 3.26Å; M362-A366 WeakPolarHBondContact O-CB 3.16Å; M362-A366 PolarHBondContact O-N 3.44Å
363	A	89.6	Confident	85.6	Confident	3 Å²	3	60.4 Å²	60.4	3%	0.025	29%	0.292	C	S	.	.	H	α-helix	trans	-64.2	-43	177.1	0	0	0	0	0	112.3	E359 Q360 E361 A366 L367 L383 P385 V422	E359-A363 WeakPolarHBondContact O-CB 3.12Å; E359-A363 PolarHBondContact O-N 3.08Å; Q360-A363 PolarHBondContact O-N 3.11Å; E361-A363 PolarHBondContact O-N 3.19Å; A363-A366 PolarHBondContact O-N 3.3Å; A363-L367 WeakPolarHBondContact O-CG 3.1Å; A363-L367 PolarHBondContact O-N 2.71Å; A363-L383 HydrophobicContact CB-CD2 4.06Å; A363-P385 HydrophobicContact CB-CG 4.31Å; A363-V422 HydrophobicContact CB-CG1 3.73Å; A363-V422 HydrophobicContact CB-CG2 4.18Å
364	L	89.6	Confident	84.4	Confident	7 Å²	7	63.9 Å²	63.9	4%	0.037	31%	0.314	C	S	.	.	H	α-helix	trans	-67	-40.6	177.5	-70.3	173.2	0	0	0	112.3	Q360 E361 L367 R368 R421 V422 E425	Q360-L364 VanDerWaalsContact O-CG 3.3Å; Q360-L364 WeakPolarHBondContact O-CG 3.4Å; Q360-L364 PolarHBondContact O-N 3.09Å; E361-L364 PolarHBondContact O-N 3.05Å; L364-L367 PolarHBondContact O-N 2.91Å; L364-R368 VanDerWaalsContact O-CG 3.28Å; L364-R368 WeakPolarHBondContact O-CG 3.49Å; L364-R368 PolarHBondContact O-N 3.17Å; L364-R421 HydrophobicContact CD1-CG 4.3Å; L364-R421 HydrophobicContact CD2-CG 4.44Å; L364-V422 HydrophobicContact CD2-CG2 4.32Å; L364-V422 HydrophobicContact CG-CG2 4.22Å; L364-E425 HydrophobicContact CD2-CB 3.99Å; L364-E425 HydrophobicContact CD2-CG 3.73Å
365	E	89.2	Confident	83.2	Confident	110 Å²	110	65.1 Å²	65.1	51%	0.514	32%	0.322	S	S	.	.	H	α-helix	trans	-64.9	-43.9	176.4	-177.4	166.3	-160.1	0	0	111.1	E361 M362 L367 R368 H369	E361-E365 VanDerWaalsContact O-CB 3.28Å; E361-E365 WeakPolarHBondContact O-CB 3.25Å; E361-E365 PolarHBondContact O-N 3.29Å; M362-E365 PolarHBondContact O-N 3.24Å; E365-L367 PolarHBondContact O-N 3.12Å; E365-R368 PolarHBondContact O-N 2.87Å; E365-H369 WeakPolarHBondContact O-CB 3.41Å; E365-H369 PolarHBondContact O-N 3.02Å; E365-H369 PolarHBondContact O-ND1 3.15Å; E365-H369 IonicContact OE1-CE1 3.55Å
366	A	88.2	Confident	81.8	Confident	12 Å²	12	70.9 Å²	70.9	10%	0.099	35%	0.346	C	S	.	.	H	α-helix	trans	-61.3	-42.7	175.8	0	0	0	0	0	111.9	M362 A363 H369 Y370 P381 A500	M362-A366 VanDerWaalsContact O-CB 3.26Å; M362-A366 WeakPolarHBondContact O-CB 3.16Å; M362-A366 PolarHBondContact O-N 3.44Å; A363-A366 PolarHBondContact O-N 3.3Å; A366-H369 PolarHBondContact O-N 3.25Å; A366-Y370 WeakPolarHBondContact O-CB 3.35Å; A366-Y370 PolarHBondContact O-N 3.39Å; A366-P381 HydrophobicContact CB-CB 3.76Å; A366-P381 HydrophobicContact CB-CG 3.94Å; A366-A500 HydrophobicContact CB-CB 4.19Å
367	L	86.8	Confident	81.1	Confident	6 Å²	6	74.4 Å²	74.4	3%	0.031	37%	0.365	C	S	.	.	H	α-helix	trans	-60	-47.2	173.9	-79.5	173.3	0	0	0	112.2	A363 L364 E365 H369 Y370 E371 L383 V422 E425 F426 V429	A363-L367 WeakPolarHBondContact O-CG 3.1Å; A363-L367 PolarHBondContact O-N 2.71Å; L364-L367 PolarHBondContact O-N 2.91Å; E365-L367 PolarHBondContact O-N 3.12Å; L367-H369 VanDerWaalsContact C-N 3.32Å; L367-H369 PolarHBondContact O-N 3.49Å; L367-Y370 PolarHBondContact O-N 2.64Å; L367-E371 PolarHBondContact O-N 3.24Å; L367-L383 HydrophobicContact CD1-CD1 4.11Å; L367-L383 HydrophobicContact CD1-CD2 4.4Å; L367-L383 HydrophobicContact CD2-CD1 3.81Å; L367-L383 HydrophobicContact CD2-CD2 4.24Å; L367-L383 HydrophobicContact CG-CD1 4.04Å; L367-L383 HydrophobicContact CG-CD2 3.87Å; L367-V422 HydrophobicContact CD1-CG1 4.28Å; L367-E425 HydrophobicContact CD1-CB 3.92Å; L367-F426 HydrophobicContact CD1-CB 4.44Å; L367-F426 HydrophobicContact CD2-CD2 4.43Å; L367-V429 HydrophobicContact CD2-CG2 3.92Å
368	R	86.3	Confident	80.6	Confident	128 Å²	128	73.5 Å²	73.5	48%	0.483	37%	0.366	S	S	.	.	H	α-helix	trans	-63.2	-39.2	177.1	-70.8	170.2	-173.2	169.9	3	112.1	L364 E365 Y370 E371 N372	L364-R368 VanDerWaalsContact O-CG 3.28Å; L364-R368 WeakPolarHBondContact O-CG 3.49Å; L364-R368 PolarHBondContact O-N 3.17Å; E365-R368 PolarHBondContact O-N 2.87Å; R368-Y370 VanDerWaalsContact C-N 3.33Å; R368-E371 PolarHBondContact O-N 2.81Å; R368-N372 WeakPolarHBondContact O-CB 3.45Å; R368-N372 VanDerWaalsContact O-CG 3.29Å; R368-N372 PolarHBondContact O-N 3.45Å; R368-N372 VanDerWaalsContact O-N 3.11Å; R368-N372 PolarHBondContact O-ND2 2.94Å
369	H	83.8	Confident	80.4	Confident	84 Å²	84	77.4 Å²	77.4	39%	0.389	38%	0.379	S	S	.	.	H	α-helix	trans	-66.1	-40.2	177.2	-81.4	63.9	0	0	0	111.3	E365 A366 L367 N372 K373	E365-H369 WeakPolarHBondContact O-CB 3.41Å; E365-H369 PolarHBondContact O-N 3.02Å; E365-H369 PolarHBondContact O-ND1 3.15Å; E365-H369 IonicContact OE1-CE1 3.55Å; A366-H369 PolarHBondContact O-N 3.25Å; L367-H369 VanDerWaalsContact C-N 3.32Å; L367-H369 PolarHBondContact O-N 3.49Å; H369-N372 PolarHBondContact O-N 3.24Å; H369-K373 WeakPolarHBondContact O-CB 3.46Å; H369-K373 PolarHBondContact O-N 3.41Å
370	Y	83.7	Confident	80.3	Confident	27 Å²	27	78.4 Å²	78.4	11%	0.106	39%	0.385	C	S	.	.	H	α-helix	trans	-65.8	-37.9	176	-179.7	-94.3	0	0	0	112.9	A366 L367 R368 T375 G378 R379 L380 V429	A366-Y370 WeakPolarHBondContact O-CB 3.35Å; A366-Y370 PolarHBondContact O-N 3.39Å; L367-Y370 PolarHBondContact O-N 2.64Å; R368-Y370 VanDerWaalsContact C-N 3.33Å; Y370-T375 HydrophobicContact CD2-CG2 4.06Å; Y370-T375 WeakPolarHBondContact CD2-OG1 3.37Å; Y370-T375 WeakPolarHBondContact CE2-OG1 3.47Å; Y370-G378 PolarHBondContact OH-O 2.85Å; Y370-R379 WeakPolarHBondContact CE2-O 3.5Å; Y370-L380 HydrophobicContact CD1-CD2 3.9Å; Y370-L380 HydrophobicContact CE1-CD2 3.46Å; Y370-L380 VanDerWaalsContact CE1-CD2 3.46Å; Y370-L380 HydrophobicContact CE1-CG 4.44Å; Y370-L380 HydrophobicContact CE2-CD2 4.18Å; Y370-L380 HydrophobicContact CG-CD2 4.42Å; Y370-V429 HydrophobicContact CD1-CG1 4.22Å; Y370-V429 HydrophobicContact CE1-CG1 4.02Å
371	E	81.8	Confident	80.3	Confident	98 Å²	98	77.1 Å²	77.1	46%	0.458	38%	0.379	S	S	.	.	H	α-helix	trans	-70.2	-36.7	176.4	-172.1	176.2	-154.1	0	0	112.3	L367 R368	L367-E371 PolarHBondContact O-N 3.24Å; R368-E371 PolarHBondContact O-N 2.81Å
372	N	82.8	Confident	80.5	Confident	133 Å²	133	71.9 Å²	71.9	71%	0.711	35%	0.354	S	S	*	.	H	α-helix	trans	-80.7	-36.8	-177.6	-73.2	-47.2	0	0	0	113.5	R368 H369	R368-N372 WeakPolarHBondContact O-CB 3.45Å; R368-N372 VanDerWaalsContact O-CG 3.29Å; R368-N372 PolarHBondContact O-N 3.45Å; R368-N372 VanDerWaalsContact O-N 3.11Å; R368-N372 PolarHBondContact O-ND2 2.94Å; H369-N372 PolarHBondContact O-N 3.24Å
373	K	71.9	Confident	80.6	Confident	136 Å²	136	70 Å²	70	59%	0.591	35%	0.345	S	S	*	.	S	Bend	trans	-98.5	110.6	175	-62.5	-179.9	-178.4	177.7	0	106	H369 T375	H369-K373 WeakPolarHBondContact O-CB 3.46Å; H369-K373 PolarHBondContact O-N 3.41Å; K373-T375 HydrophobicContact CB-CG2 4.4Å; K373-T375 PolarHBondContact O-N 2.94Å
374	N	60.7	Low	80.7	Confident	144 Å²	144	70 Å²	70	77%	0.77	34%	0.344	S	S	*	.			trans	-55.9	87.7	157.5	-77.5	-25.6	0	0	0	106.5	E376	N374-E376 PolarHBondContact O-N 3.32Å
375	T	62.3	Low	80.7	Confident	42 Å²	42	69.8 Å²	69.8	26%	0.258	34%	0.344	S	S	.	.			trans	-59.3	129.5	-174.1	39.6	0	0	0	0	106.8	Y370 K373 D377 G378	Y370-T375 HydrophobicContact CD2-CG2 4.06Å; Y370-T375 WeakPolarHBondContact CD2-OG1 3.37Å; Y370-T375 WeakPolarHBondContact CE2-OG1 3.47Å; K373-T375 HydrophobicContact CB-CG2 4.4Å; K373-T375 PolarHBondContact O-N 2.94Å; T375-D377 PolarHBondContact O-N 2.82Å; T375-G378 PolarHBondContact O-N 3.29Å
376	E	55.4	Low	80.7	Confident	203 Å²	203	64.6 Å²	64.6	95%	0.949	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-26.4	-173	-66.8	-176.1	160.9	0	0	112.2	N374	N374-E376 PolarHBondContact O-N 3.32Å
377	D	69.5	Low	80.9	Confident	119 Å²	119	64 Å²	64	64%	0.636	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-11.3	-179.2	-71.7	-10.3	0	0	0	114.7	T375 R379	T375-D377 PolarHBondContact O-N 2.82Å; D377-R379 HydrophobicContact CB-CG 4.27Å; D377-R379 PolarHBondContact O-N 3.13Å
378	G	75.4	Confident	81.2	Confident	48 Å²	48	63.8 Å²	63.8	50%	0.495	31%	0.313	S	S	.	.			trans	59.7	8.2	-177.3	0	0	0	0	0	116	Y370 T375	Y370-G378 PolarHBondContact OH-O 2.85Å; T375-G378 PolarHBondContact O-N 3.29Å
379	R	81.7	Confident	81.2	Confident	133 Å²	133	57.7 Å²	57.7	50%	0.502	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-79.4	137.5	178.3	-60.9	-174.1	-146.1	176.7	10	109.9	Y370 D377 F498	Y370-R379 WeakPolarHBondContact CE2-O 3.5Å; D377-R379 HydrophobicContact CB-CG 4.27Å; D377-R379 PolarHBondContact O-N 3.13Å; R379-F498 HydrophobicContact CB-CD1 4.05Å; R379-F498 WeakPolarHBondContact O-CE1 3.37Å
380	L	84.3	Confident	81.4	Confident	23 Å²	23	53.9 Å²	53.9	12%	0.12	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-72.4	144.8	174.4	-76.8	160.5	0	0	0	111.1	Y370 F426 L432 F492 T497 F498	Y370-L380 HydrophobicContact CD1-CD2 3.9Å; Y370-L380 HydrophobicContact CE1-CD2 3.46Å; Y370-L380 VanDerWaalsContact CE1-CD2 3.46Å; Y370-L380 HydrophobicContact CE1-CG 4.44Å; Y370-L380 HydrophobicContact CE2-CD2 4.18Å; Y370-L380 HydrophobicContact CG-CD2 4.42Å; L380-F426 HydrophobicContact CD1-CE2 4.47Å; L380-L432 HydrophobicContact CD1-CD1 4.27Å; L380-L432 HydrophobicContact CD1-CD2 3.91Å; L380-L432 HydrophobicContact CD1-CG 4.38Å; L380-L432 HydrophobicContact CD2-CD1 4.47Å; L380-F492 HydrophobicContact CB-CZ 4.2Å; L380-F492 HydrophobicContact CD1-CE2 3.57Å; L380-F492 HydrophobicContact CD1-CZ 3.68Å; L380-T497 HydrophobicContact CB-CG2 4.33Å; L380-T497 VanDerWaalsContact O-CA 3.27Å; L380-T497 WeakPolarHBondContact O-CA 3.38Å; L380-T497 WeakPolarHBondContact O-CB 3.48Å; L380-F498 VanDerWaalsContact O-CD1 3.28Å; L380-F498 WeakPolarHBondContact O-CD1 3.48Å; L380-F498 PolarHBondContact O-N 3.28Å
381	P	88.6	Confident	81.7	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.013	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-66.6	149.9	171.5	28	-33.4	0	0	0	110.7	A366 L383 F498	A366-P381 HydrophobicContact CB-CB 3.76Å; A366-P381 HydrophobicContact CB-CG 3.94Å; P381-L383 HydrophobicContact CG-CD2 4.16Å; P381-L383 PolarHBondContact O-N 3.5Å; P381-F498 CarbonylContact C-O 3.53Å; P381-F498 VanDerWaalsContact CA-CE1 3.47Å; P381-F498 WeakPolarHBondContact CA-O 3.16Å; P381-F498 HydrophobicContact CB-CE1 3.89Å; P381-F498 HydrophobicContact CB-CE2 4.41Å; P381-F498 HydrophobicContact CB-CZ 3.8Å; P381-F498 VanDerWaalsContact N-CE1 3.34Å
382	F	90.5	Very high	82.1	Confident	9 Å²	9	49.3 Å²	49.3	4%	0.039	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-69.9	117.5	174.6	179	-98.3	0	0	0	109.9	L296 P297 I300 F352 F384 W387 F494 T497 F498 V499	L296-F382 HydrophobicContact CD2-CZ 4.24Å; P297-F382 VanDerWaalsContact CD-CD2 3.5Å; P297-F382 VanDerWaalsContact CD-CE2 3.49Å; P297-F382 HydrophobicContact CG-CB 4.09Å; P297-F382 HydrophobicContact CG-CD2 3.31Å; P297-F382 HydrophobicContact CG-CE2 3.89Å; P297-F382 HydrophobicContact CG-CG 3.84Å; I300-F382 HydrophobicContact CD1-CD1 3.96Å; I300-F382 HydrophobicContact CD1-CE1 3.59Å; I300-F382 HydrophobicContact CD1-CE2 4.2Å; I300-F382 HydrophobicContact CD1-CG 4.37Å; I300-F382 HydrophobicContact CD1-CZ 3.71Å; F352-F382 AromaticContact CE1-CD1 3.83Å; F352-F382 HydrophobicContact CE1-CD1 3.83Å; F352-F382 HydrophobicContact CE1-CE1 4.11Å; F352-F382 HydrophobicContact CE2-CD1 4.1Å; F352-F382 AromaticContact CE2-CE1 3.71Å; F352-F382 HydrophobicContact CE2-CE1 3.71Å; F352-F382 AromaticContact CZ-CD1 3.3Å; F352-F382 HydrophobicContact CZ-CD1 3.3Å; F352-F382 AromaticContact CZ-CE1 3.39Å; F352-F382 HydrophobicContact CZ-CE1 3.39Å; F382-F384 HydrophobicContact CD1-CB 4.47Å; F382-F384 HydrophobicContact CE1-CB 3.91Å; F382-F384 HydrophobicContact CE1-CD2 4.16Å; F382-W387 HydrophobicContact CE2-CB 3.67Å; F382-W387 AromaticContact CE2-CD1 3.61Å; F382-W387 HydrophobicContact CE2-CD2 4.26Å; F382-W387 AromaticContact CE2-CG 3.54Å; F382-W387 HydrophobicContact CE2-CG 3.54Å; F382-W387 HydrophobicContact CZ-CB 3.63Å; F382-W387 AromaticContact CZ-CD1 3.87Å; F382-W387 AromaticContact CZ-CD2 3.72Å; F382-W387 HydrophobicContact CZ-CD2 3.72Å; F382-W387 HydrophobicContact CZ-CE3 4.2Å; F382-W387 AromaticContact CZ-CG 3.42Å; F382-W387 HydrophobicContact CZ-CG 3.42Å; F382-W387 VanDerWaalsContact CZ-CG 3.42Å; F382-F494 HydrophobicContact CD2-CB 4.48Å; F382-F494 HydrophobicContact CD2-CD1 4.18Å; F382-F494 HydrophobicContact CE2-CB 4.28Å; F382-F494 HydrophobicContact CE2-CD1 4.2Å; F382-T497 WeakPolarHBondContact CA-OG1 3.26Å; F382-T497 WeakPolarHBondContact CB-OG1 3.37Å; F382-T497 WeakPolarHBondContact CD2-OG1 3.38Å; F382-F498 WeakPolarHBondContact CB-O 3.48Å; F382-F498 PolarHBondContact N-O 3.2Å; F382-V499 HydrophobicContact CB-CG2 4.3Å
383	L	90.5	Very high	82.3	Confident	3 Å²	3	43 Å²	43	2%	0.016	22%	0.218	C	C	.	.			trans	-103.2	94.4	-179.3	-54.2	179.1	0	0	0	109.5	A363 L367 P381 C386 W387 F426	A363-L383 HydrophobicContact CB-CD2 4.06Å; L367-L383 HydrophobicContact CD1-CD1 4.11Å; L367-L383 HydrophobicContact CD1-CD2 4.4Å; L367-L383 HydrophobicContact CD2-CD1 3.81Å; L367-L383 HydrophobicContact CD2-CD2 4.24Å; L367-L383 HydrophobicContact CG-CD1 4.04Å; L367-L383 HydrophobicContact CG-CD2 3.87Å; P381-L383 HydrophobicContact CG-CD2 4.16Å; P381-L383 PolarHBondContact O-N 3.5Å; L383-C386 HydrophobicContact CB-CB 3.92Å; L383-C386 WeakPolarHBondContact O-CB 3.32Å; L383-C386 PolarHBondContact O-N 3.39Å; L383-W387 PolarHBondContact O-N 3.07Å; L383-F426 HydrophobicContact CD1-CB 4.3Å; L383-F426 HydrophobicContact CD1-CD2 3.36Å; L383-F426 HydrophobicContact CD1-CE2 3.98Å; L383-F426 HydrophobicContact CD1-CG 4.17Å
384	F	91.9	Very high	82.9	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.009	19%	0.192	C	C	.	.	H	α-helix	trans	-50.2	-47.1	-176.5	178.4	-80.6	0	0	0	113.6	L348 F352 L354 E359 F382 C386 W387 L388 T540 L544	L348-F384 HydrophobicContact CB-CE2 4.24Å; L348-F384 HydrophobicContact CD1-CE2 4.4Å; L348-F384 HydrophobicContact CD2-CD2 4.25Å; L348-F384 HydrophobicContact CD2-CE2 4.08Å; L348-F384 HydrophobicContact CG-CE2 4.48Å; F352-F384 HydrophobicContact CB-CD2 4.39Å; F352-F384 HydrophobicContact CB-CG 4.42Å; F352-F384 HydrophobicContact CD1-CB 3.82Å; F352-F384 HydrophobicContact CD1-CG 4.38Å; F352-F384 HydrophobicContact CD2-CB 4.3Å; F352-F384 AromaticContact CD2-CD2 3.52Å; F352-F384 HydrophobicContact CD2-CD2 3.52Å; F352-F384 HydrophobicContact CD2-CE2 4.24Å; F352-F384 HydrophobicContact CD2-CG 4.15Å; F352-F384 HydrophobicContact CE1-CB 4.06Å; F352-F384 AromaticContact CE2-CD2 3.96Å; F352-F384 HydrophobicContact CE2-CD2 3.96Å; F352-F384 HydrophobicContact CG-CB 3.98Å; F352-F384 AromaticContact CG-CD2 3.88Å; F352-F384 HydrophobicContact CG-CD2 3.88Å; F352-F384 HydrophobicContact CG-CG 4.04Å; F352-F384 HydrophobicContact CZ-CB 4.43Å; L354-F384 HydrophobicContact CD1-CZ 4.14Å; L354-F384 HydrophobicContact CD2-CD1 3.97Å; L354-F384 HydrophobicContact CD2-CD2 4.35Å; L354-F384 HydrophobicContact CD2-CE1 3.52Å; L354-F384 HydrophobicContact CD2-CE2 3.9Å; L354-F384 HydrophobicContact CD2-CG 4.39Å; L354-F384 HydrophobicContact CD2-CZ 3.47Å; L354-F384 VanDerWaalsContact CD2-CZ 3.47Å; L354-F384 HydrophobicContact CG-CZ 4.46Å; E359-F384 HydrophobicContact CB-CD1 4.23Å; E359-F384 HydrophobicContact CG-CD1 4.25Å; F382-F384 HydrophobicContact CD1-CB 4.47Å; F382-F384 HydrophobicContact CE1-CB 3.91Å; F382-F384 HydrophobicContact CE1-CD2 4.16Å; F384-C386 VanDerWaalsContact C-N 3.32Å; F384-C386 PolarHBondContact O-N 3.1Å; F384-W387 AromaticContact CD2-CE3 3.91Å; F384-W387 HydrophobicContact CD2-CE3 3.91Å; F384-W387 HydrophobicContact CD2-CZ3 4.1Å; F384-W387 AromaticContact CE2-CE3 3.79Å; F384-W387 HydrophobicContact CE2-CE3 3.79Å; F384-W387 AromaticContact CE2-CZ3 3.5Å; F384-W387 HydrophobicContact CE2-CZ3 3.5Å; F384-W387 VanDerWaalsContact CE2-CZ3 3.5Å; F384-W387 HydrophobicContact CZ-CE3 4.26Å; F384-W387 AromaticContact CZ-CZ3 3.88Å; F384-W387 HydrophobicContact CZ-CZ3 3.88Å; F384-W387 PolarHBondContact O-N 3.21Å; F384-L388 HydrophobicContact CE1-CB 4.22Å; F384-L388 HydrophobicContact CE1-CD2 3.99Å; F384-L388 HydrophobicContact CZ-CD2 4.41Å; F384-L388 WeakPolarHBondContact O-CB 3.4Å; F384-L388 PolarHBondContact O-N 3.23Å; F384-T540 HydrophobicContact CD1-CG2 4.24Å; F384-T540 HydrophobicContact CE1-CG2 3.38Å; F384-T540 HydrophobicContact CZ-CG2 4.15Å; F384-L544 HydrophobicContact CZ-CD2 4.42Å
385	P	90	Very high	84.2	Confident	4 Å²	4	30.2 Å²	30.2	3%	0.026	16%	0.156	C	C	.	.	H	α-helix	trans	-62.2	-37	179.9	-25.9	37.7	0	0	0	113.7	E359 A363 L389 V422	E359-P385 HydrophobicContact CG-CG 4.47Å; A363-P385 HydrophobicContact CB-CG 4.31Å; P385-L389 PolarHBondContact O-N 3.15Å; P385-V422 HydrophobicContact CB-CB 4.49Å; P385-V422 HydrophobicContact CB-CG2 4.42Å; P385-V422 HydrophobicContact CG-CG2 4.23Å
386	C	88.5	Confident	85.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-70.4	-42.4	176.6	-61.2	0	0	0	0	111	L383 F384 L389 H390 L489 F494	L383-C386 HydrophobicContact CB-CB 3.92Å; L383-C386 WeakPolarHBondContact O-CB 3.32Å; L383-C386 PolarHBondContact O-N 3.39Å; F384-C386 VanDerWaalsContact C-N 3.32Å; F384-C386 PolarHBondContact O-N 3.1Å; C386-L389 PolarHBondContact O-N 3.1Å; C386-H390 WeakPolarHBondContact O-CB 3.3Å; C386-H390 PolarHBondContact O-N 3.06Å; C386-L489 HydrophobicContact CB-CD1 3.77Å; C386-F494 VanDerWaalsContact C-CZ 3.49Å; C386-F494 HydrophobicContact CB-CE1 3.96Å; C386-F494 HydrophobicContact CB-CZ 3.75Å
387	W	91.9	Very high	86.5	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.7	-43	176.3	165.1	84.1	0	0	0	112.5	L294 L296 L348 F382 L383 F384 H390 N391 F494 L544	L294-W387 HydrophobicContact CB-CZ2 4.11Å; L294-W387 HydrophobicContact CD2-CZ2 4.4Å; L294-W387 PolarHBondContact O-NE1 3.3Å; L296-W387 HydrophobicContact CD2-CD2 4.26Å; L296-W387 VanDerWaalsContact CD2-CE2 3.42Å; L296-W387 HydrophobicContact CD2-CH2 4.27Å; L296-W387 HydrophobicContact CD2-CZ2 3.44Å; L296-W387 VanDerWaalsContact CD2-CZ2 3.44Å; L296-W387 HydrophobicContact CG-CZ2 4.16Å; L348-W387 HydrophobicContact CD1-CH2 3.57Å; L348-W387 HydrophobicContact CD1-CZ2 4.33Å; L348-W387 HydrophobicContact CD1-CZ3 4.02Å; F382-W387 HydrophobicContact CE2-CB 3.67Å; F382-W387 AromaticContact CE2-CD1 3.61Å; F382-W387 HydrophobicContact CE2-CD2 4.26Å; F382-W387 AromaticContact CE2-CG 3.54Å; F382-W387 HydrophobicContact CE2-CG 3.54Å; F382-W387 HydrophobicContact CZ-CB 3.63Å; F382-W387 AromaticContact CZ-CD1 3.87Å; F382-W387 AromaticContact CZ-CD2 3.72Å; F382-W387 HydrophobicContact CZ-CD2 3.72Å; F382-W387 HydrophobicContact CZ-CE3 4.2Å; F382-W387 AromaticContact CZ-CG 3.42Å; F382-W387 HydrophobicContact CZ-CG 3.42Å; F382-W387 VanDerWaalsContact CZ-CG 3.42Å; L383-W387 PolarHBondContact O-N 3.07Å; F384-W387 AromaticContact CD2-CE3 3.91Å; F384-W387 HydrophobicContact CD2-CE3 3.91Å; F384-W387 HydrophobicContact CD2-CZ3 4.1Å; F384-W387 AromaticContact CE2-CE3 3.79Å; F384-W387 HydrophobicContact CE2-CE3 3.79Å; F384-W387 AromaticContact CE2-CZ3 3.5Å; F384-W387 HydrophobicContact CE2-CZ3 3.5Å; F384-W387 VanDerWaalsContact CE2-CZ3 3.5Å; F384-W387 HydrophobicContact CZ-CE3 4.26Å; F384-W387 AromaticContact CZ-CZ3 3.88Å; F384-W387 HydrophobicContact CZ-CZ3 3.88Å; F384-W387 PolarHBondContact O-N 3.21Å; W387-H390 WeakPolarHBondContact O-CB 3.44Å; W387-H390 PolarHBondContact O-N 3.27Å; W387-N391 VanDerWaalsContact CE2-ND2 3.33Å; W387-N391 PolarHBondContact NE1-ND2 3.39Å; W387-N391 PolarHBondContact O-N 3.38Å; W387-N391 PolarHBondContact O-ND2 3.02Å; W387-N391 VanDerWaalsContact O-ND2 3.08Å; W387-F494 HydrophobicContact CB-CD1 3.68Å; W387-F494 HydrophobicContact CB-CD2 4.39Å; W387-F494 HydrophobicContact CB-CE1 3.79Å; W387-F494 HydrophobicContact CB-CE2 4.49Å; W387-F494 HydrophobicContact CB-CG 4Å; W387-F494 HydrophobicContact CB-CZ 4.22Å; W387-F494 AromaticContact CD1-CG 3.91Å; W387-F494 HydrophobicContact CG-CD1 4.46Å; W387-F494 HydrophobicContact CG-CG 4.39Å; W387-L544 HydrophobicContact CH2-CD1 3.81Å; W387-L544 HydrophobicContact CZ3-CD1 4.01Å
388	L	92.6	Very high	86.9	Confident	1 Å²	1	14.8 Å²	14.8	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-62.8	-48.4	178.5	178.3	61.7	0	0	0	109.8	F384 H390 N391 E392 T540 R543 L544 L547	F384-L388 HydrophobicContact CE1-CB 4.22Å; F384-L388 HydrophobicContact CE1-CD2 3.99Å; F384-L388 HydrophobicContact CZ-CD2 4.41Å; F384-L388 WeakPolarHBondContact O-CB 3.4Å; F384-L388 PolarHBondContact O-N 3.23Å; L388-H390 PolarHBondContact O-N 3.19Å; L388-N391 PolarHBondContact O-N 3.38Å; L388-E392 HydrophobicContact CD1-CG 4.49Å; L388-E392 WeakPolarHBondContact O-CG 3.38Å; L388-E392 PolarHBondContact O-N 3.41Å; L388-T540 HydrophobicContact CD2-CG2 4.02Å; L388-R543 HydrophobicContact CD2-CB 4Å; L388-L544 HydrophobicContact CD1-CB 4.43Å; L388-L544 HydrophobicContact CD1-CD1 4.39Å; L388-L547 HydrophobicContact CD1-CD2 3.7Å
389	L	88.1	Confident	87.2	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-59.6	-46.3	176.9	178.4	58.3	0	0	0	111.7	P385 C386 N391 E392 L393 W411 F412 V419 L489	P385-L389 PolarHBondContact O-N 3.15Å; C386-L389 PolarHBondContact O-N 3.1Å; L389-N391 VanDerWaalsContact C-N 3.28Å; L389-N391 PolarHBondContact O-N 3.25Å; L389-E392 PolarHBondContact O-N 3.29Å; L389-E392 VanDerWaalsContact O-N 3.16Å; L389-L393 HydrophobicContact CD1-CD1 4.34Å; L389-L393 HydrophobicContact CD1-CD2 4.45Å; L389-L393 HydrophobicContact CD1-CG 4.11Å; L389-L393 HydrophobicContact CG-CD1 4.09Å; L389-L393 HydrophobicContact CG-CG 4.34Å; L389-L393 VanDerWaalsContact O-CG 3.25Å; L389-L393 WeakPolarHBondContact O-CG 3.48Å; L389-L393 PolarHBondContact O-N 2.96Å; L389-W411 HydrophobicContact CD1-CE3 4.2Å; L389-W411 HydrophobicContact CD1-CZ3 3.61Å; L389-F412 HydrophobicContact CD2-CD1 3.96Å; L389-F412 HydrophobicContact CD2-CE1 3.4Å; L389-F412 HydrophobicContact CD2-CZ 3.84Å; L389-V419 HydrophobicContact CB-CG1 4.07Å; L389-V419 HydrophobicContact CD2-CB 4.3Å; L389-V419 HydrophobicContact CD2-CG1 3.46Å; L389-V419 VanDerWaalsContact CD2-CG1 3.46Å; L389-V419 HydrophobicContact CG-CG1 4.36Å; L389-L489 HydrophobicContact CB-CD2 4.38Å; L389-L489 HydrophobicContact CD2-CD2 3.63Å; L389-L489 HydrophobicContact CG-CD2 3.95Å
390	H	87.1	Confident	87.1	Confident	4 Å²	4	12.2 Å²	12.2	2%	0.019	8%	0.078	C	C	.	.	H	α-helix	trans	-52.7	-46.2	175.4	166.9	98.7	0	0	0	112.2	C386 W387 L388 L393 K394 L489 F490 F494	C386-H390 WeakPolarHBondContact O-CB 3.3Å; C386-H390 PolarHBondContact O-N 3.06Å; W387-H390 WeakPolarHBondContact O-CB 3.44Å; W387-H390 PolarHBondContact O-N 3.27Å; L388-H390 PolarHBondContact O-N 3.19Å; H390-L393 PolarHBondContact O-N 3.42Å; H390-K394 WeakPolarHBondContact O-CB 3.38Å; H390-K394 PolarHBondContact O-N 3.02Å; H390-L489 PolarHBondContact ND1-O 3.34Å; H390-L489 VanDerWaalsContact ND1-O 3.09Å; H390-F490 PolarHBondContact CE1-O 2.76Å; H390-F490 PolarHBondContact ND1-O 2.77Å; H390-F490 VanDerWaalsContact ND1-O 3.09Å; H390-F494 HydrophobicContact CB-CD2 4.18Å; H390-F494 HydrophobicContact CB-CE2 3.54Å; H390-F494 HydrophobicContact CB-CZ 4.37Å; H390-F494 AromaticContact CG-CD2 3.93Å; H390-F494 AromaticContact CG-CE2 3.68Å; H390-F494 AromaticContact ND1-CE2 3.92Å
391	N	90.4	Very high	87.1	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-71.6	-33.6	179.9	-84.6	-78.9	0	0	0	113.3	L294 W387 L388 L389 K394 M395 L547 Y551	L294-N391 PolarHBondContact O-ND2 3.37Å; L294-N391 PolarHBondContact O-OD1 3.44Å; W387-N391 VanDerWaalsContact CE2-ND2 3.33Å; W387-N391 PolarHBondContact NE1-ND2 3.39Å; W387-N391 PolarHBondContact O-N 3.38Å; W387-N391 PolarHBondContact O-ND2 3.02Å; W387-N391 VanDerWaalsContact O-ND2 3.08Å; L388-N391 PolarHBondContact O-N 3.38Å; L389-N391 VanDerWaalsContact C-N 3.28Å; L389-N391 PolarHBondContact O-N 3.25Å; N391-K394 PolarHBondContact O-N 3.16Å; N391-M395 WeakPolarHBondContact O-CB 3.26Å; N391-M395 VanDerWaalsContact O-CG 3.32Å; N391-M395 WeakPolarHBondContact O-CG 3.45Å; N391-M395 PolarHBondContact O-N 2.91Å; N391-L547 HydrophobicContact CB-CD1 4.07Å; N391-L547 HydrophobicContact CB-CD2 3.53Å; N391-L547 HydrophobicContact CB-CG 4.39Å; N391-L547 WeakPolarHBondContact O-CD1 3.42Å; N391-Y551 PolarHBondContact OD1-OH 3.41Å
392	E	90.4	Very high	86.8	Confident	30 Å²	30	15.2 Å²	15.2	14%	0.14	10%	0.101	C	C	.	.	H	α-helix	trans	-67	-42.1	174.1	-68	172.9	155.4	0	0	111.9	L388 L389 K394 M395 A396 W411 R543 L547	L388-E392 HydrophobicContact CD1-CG 4.49Å; L388-E392 WeakPolarHBondContact O-CG 3.38Å; L388-E392 PolarHBondContact O-N 3.41Å; L389-E392 PolarHBondContact O-N 3.29Å; L389-E392 VanDerWaalsContact O-N 3.16Å; E392-K394 VanDerWaalsContact C-N 3.34Å; E392-M395 PolarHBondContact O-N 3.49Å; E392-A396 WeakPolarHBondContact O-CB 3.47Å; E392-A396 PolarHBondContact O-N 2.9Å; E392-W411 HydrophobicContact CB-CH2 3.87Å; E392-W411 HydrophobicContact CB-CZ3 4.46Å; E392-R543 WeakPolarHBondContact OE1-CB 3.23Å; E392-R543 IonicContact OE1-CZ 3.48Å; E392-R543 IonicContact OE1-NE 2.78Å; E392-R543 PolarHBondContact OE1-NE 3.4Å; E392-R543 IonicContact OE1-NH2 3.45Å; E392-R543 PolarHBondContact OE1-NH2 3.23Å; E392-R543 IonicContact OE2-CZ 3.63Å; E392-R543 IonicContact OE2-NE 3.83Å; E392-R543 PolarHBondContact OE2-NE 2.94Å; E392-R543 IonicContact OE2-NH2 2.82Å; E392-R543 PolarHBondContact OE2-NH2 2.68Å; E392-L547 HydrophobicContact CG-CD1 4.17Å
393	L	85.9	Confident	86.4	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-58.8	-47.9	173	-66	169.7	0	0	0	110.4	L389 H390 M395 A396 I397 V406 W411 F412 F490	L389-L393 HydrophobicContact CD1-CD1 4.34Å; L389-L393 HydrophobicContact CD1-CD2 4.45Å; L389-L393 HydrophobicContact CD1-CG 4.11Å; L389-L393 HydrophobicContact CG-CD1 4.09Å; L389-L393 HydrophobicContact CG-CG 4.34Å; L389-L393 VanDerWaalsContact O-CG 3.25Å; L389-L393 WeakPolarHBondContact O-CG 3.48Å; L389-L393 PolarHBondContact O-N 2.96Å; H390-L393 PolarHBondContact O-N 3.42Å; L393-M395 VanDerWaalsContact C-N 3.31Å; L393-M395 PolarHBondContact O-N 3.22Å; L393-A396 PolarHBondContact O-N 3.42Å; L393-I397 PolarHBondContact O-N 3.32Å; L393-V406 HydrophobicContact CB-CG1 3.73Å; L393-V406 HydrophobicContact CD2-CG1 3.43Å; L393-V406 VanDerWaalsContact CD2-CG1 3.43Å; L393-V406 VanDerWaalsContact CD2-O 3.29Å; L393-V406 WeakPolarHBondContact CD2-O 3.43Å; L393-V406 HydrophobicContact CG-CG1 4.19Å; L393-W411 HydrophobicContact CD2-CD2 3.73Å; L393-W411 HydrophobicContact CD2-CE3 3.18Å; L393-W411 HydrophobicContact CD2-CG 4.48Å; L393-W411 HydrophobicContact CD2-CH2 3.99Å; L393-W411 HydrophobicContact CD2-CZ2 4.46Å; L393-W411 HydrophobicContact CD2-CZ3 3.34Å; L393-W411 HydrophobicContact CG-CE3 4.21Å; L393-W411 HydrophobicContact CG-CH2 4.43Å; L393-W411 HydrophobicContact CG-CZ3 3.9Å; L393-F412 HydrophobicContact CD1-CE2 4.35Å; L393-F412 HydrophobicContact CD1-CZ 4.28Å; L393-F490 HydrophobicContact CB-CD2 3.83Å; L393-F490 HydrophobicContact CB-CE2 4.09Å; L393-F490 HydrophobicContact CD1-CD2 4.44Å
394	K	85.6	Confident	86.1	Confident	8 Å²	8	18.9 Å²	18.9	4%	0.035	12%	0.119	C	C	.	.	H	α-helix	trans	-56.7	-46.8	176.1	-177.8	-177.8	172.5	-177.3	0	111	D293 H390 N391 E392 I397 V398 M467 F490	D293-K394 PolarHBondContact O-NZ 3.33Å; H390-K394 WeakPolarHBondContact O-CB 3.38Å; H390-K394 PolarHBondContact O-N 3.02Å; N391-K394 PolarHBondContact O-N 3.16Å; E392-K394 VanDerWaalsContact C-N 3.34Å; K394-I397 PolarHBondContact O-N 3.08Å; K394-V398 VanDerWaalsContact O-CG2 3.26Å; K394-V398 WeakPolarHBondContact O-CG2 3.2Å; K394-V398 PolarHBondContact O-N 2.98Å; K394-V398 VanDerWaalsContact O-N 3.12Å; K394-M467 HydrophobicContact CB-CE 4.45Å; K394-M467 HydrophobicContact CG-CE 3.47Å; K394-M467 VanDerWaalsContact CG-CE 3.47Å; K394-M467 WeakPolarHBondContact O-CE 3.39Å; K394-F490 HydrophobicContact CB-CE2 4.17Å
395	M	86.5	Confident	85.7	Confident	3 Å²	3	23.6 Å²	23.6	2%	0.015	14%	0.141	C	C	.	.	H	α-helix	trans	-68.7	-33.1	179.7	-74.4	-54.8	-65.5	0	0	113.4	N391 E392 L393 I397 V398 E399 F464 L547 K550 Y551	N391-M395 WeakPolarHBondContact O-CB 3.26Å; N391-M395 VanDerWaalsContact O-CG 3.32Å; N391-M395 WeakPolarHBondContact O-CG 3.45Å; N391-M395 PolarHBondContact O-N 2.91Å; E392-M395 PolarHBondContact O-N 3.49Å; L393-M395 VanDerWaalsContact C-N 3.31Å; L393-M395 PolarHBondContact O-N 3.22Å; M395-I397 VanDerWaalsContact C-N 3.33Å; M395-I397 PolarHBondContact O-N 3.08Å; M395-V398 HydrophobicContact CE-CG1 4Å; M395-V398 WeakPolarHBondContact O-CB 3.46Å; M395-V398 PolarHBondContact O-N 3.3Å; M395-V398 HydrophobicContact SD-CB 4.31Å; M395-V398 HydrophobicContact SD-CG1 4.21Å; M395-V398 HydrophobicContact SD-CG2 4.32Å; M395-E399 WeakPolarHBondContact O-CB 3.47Å; M395-E399 VanDerWaalsContact O-CG 3.26Å; M395-E399 WeakPolarHBondContact O-CG 3.47Å; M395-E399 PolarHBondContact O-N 3.15Å; M395-F464 HydrophobicContact SD-CE1 4.36Å; M395-F464 HydrophobicContact SD-CZ 4.47Å; M395-L547 HydrophobicContact CB-CD1 4Å; M395-L547 HydrophobicContact CG-CD1 3.52Å; M395-K550 HydrophobicContact CE-CB 3.8Å; M395-Y551 HydrophobicContact CE-CD2 4.15Å; M395-Y551 HydrophobicContact CE-CE2 4.44Å; M395-Y551 HydrophobicContact CE-CG 4.21Å; M395-Y551 HydrophobicContact CG-CD2 3.77Å; M395-Y551 HydrophobicContact CG-CE2 3.29Å; M395-Y551 HydrophobicContact SD-CD1 3.96Å; M395-Y551 HydrophobicContact SD-CD2 3.65Å; M395-Y551 HydrophobicContact SD-CE1 3.67Å; M395-Y551 HydrophobicContact SD-CE2 3.36Å; M395-Y551 WeakPolarHBondContact SD-CE2 3.39Å; M395-Y551 HydrophobicContact SD-CG 3.95Å
396	A	86.3	Confident	85.4	Confident	7 Å²	7	23.4 Å²	23.4	6%	0.058	14%	0.14	C	C	.	.	H	α-helix	trans	-61	-43.6	174.8	0	0	0	0	0	111.5	E392 L393 E399 G400 S401 V406 W411	E392-A396 WeakPolarHBondContact O-CB 3.47Å; E392-A396 PolarHBondContact O-N 2.9Å; L393-A396 PolarHBondContact O-N 3.42Å; A396-E399 PolarHBondContact O-N 3.13Å; A396-E399 VanDerWaalsContact O-N 3.17Å; A396-G400 PolarHBondContact O-N 2.83Å; A396-S401 VanDerWaalsContact O-CB 3.31Å; A396-S401 WeakPolarHBondContact O-CB 3.31Å; A396-S401 PolarHBondContact O-N 3.04Å; A396-S401 PolarHBondContact O-OG 3.21Å; A396-V406 HydrophobicContact CB-CG1 4.47Å; A396-V406 HydrophobicContact CB-CG2 3.71Å; A396-W411 HydrophobicContact CB-CZ2 3.83Å
397	I	81.1	Confident	85.1	Confident	27 Å²	27	23.4 Å²	23.4	14%	0.138	14%	0.14	C	C	.	.	H	α-helix	trans	-63.3	-43.8	175.6	-63.2	166.8	0	0	0	110.8	L393 K394 M395 E399 G400 V403 V406 M467 F471 F490	L393-I397 PolarHBondContact O-N 3.32Å; K394-I397 PolarHBondContact O-N 3.08Å; M395-I397 VanDerWaalsContact C-N 3.33Å; M395-I397 PolarHBondContact O-N 3.08Å; I397-E399 PolarHBondContact O-N 2.87Å; I397-G400 PolarHBondContact O-N 2.92Å; I397-V403 HydrophobicContact CD1-CG2 4.2Å; I397-V403 HydrophobicContact CG1-CG2 4.47Å; I397-V403 HydrophobicContact CG2-CG2 4.39Å; I397-V406 HydrophobicContact CD1-CB 4.48Å; I397-V406 HydrophobicContact CD1-CG1 4.16Å; I397-V406 HydrophobicContact CG1-CB 4.07Å; I397-V406 HydrophobicContact CG1-CG1 4.03Å; I397-V406 HydrophobicContact CG1-CG2 3.9Å; I397-M467 HydrophobicContact CB-CE 4.33Å; I397-M467 HydrophobicContact CG2-CE 4.3Å; I397-M467 HydrophobicContact CG2-SD 4.09Å; I397-F471 HydrophobicContact CD1-CE2 3.82Å; I397-F490 HydrophobicContact CD1-CE2 3.55Å; I397-F490 HydrophobicContact CD1-CZ 3.55Å
398	V	78.5	Confident	84.6	Confident	7 Å²	7	24.6 Å²	24.6	4%	0.042	15%	0.148	C	C	.	.	H	α-helix	trans	-57.7	-36	175.3	164.2	0	0	0	0	111.6	L192 Q196 K394 M395 G400 F464 M467	L192-V398 HydrophobicContact CD1-CG1 3.67Å; L192-V398 HydrophobicContact CG-CG1 4.48Å; Q196-V398 WeakPolarHBondContact CG-O 3.39Å; K394-V398 VanDerWaalsContact O-CG2 3.26Å; K394-V398 WeakPolarHBondContact O-CG2 3.2Å; K394-V398 PolarHBondContact O-N 2.98Å; K394-V398 VanDerWaalsContact O-N 3.12Å; M395-V398 HydrophobicContact CE-CG1 4Å; M395-V398 WeakPolarHBondContact O-CB 3.46Å; M395-V398 PolarHBondContact O-N 3.3Å; M395-V398 HydrophobicContact SD-CB 4.31Å; M395-V398 HydrophobicContact SD-CG1 4.21Å; M395-V398 HydrophobicContact SD-CG2 4.32Å; V398-G400 PolarHBondContact O-N 3.16Å; V398-F464 HydrophobicContact CB-CE1 4.34Å; V398-F464 HydrophobicContact CG1-CE1 3.78Å; V398-F464 HydrophobicContact CG1-CZ 4.31Å; V398-F464 HydrophobicContact CG2-CD1 4.03Å; V398-F464 HydrophobicContact CG2-CE1 3.57Å; V398-M467 HydrophobicContact CG2-CE 3.37Å; V398-M467 HydrophobicContact CG2-CG 4.38Å; V398-M467 HydrophobicContact CG2-SD 3.45Å; V398-M467 WeakPolarHBondContact CG2-SD 3.24Å
399	E	80.9	Confident	83.6	Confident	62 Å²	62	28.3 Å²	28.3	29%	0.29	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-3.7	178	-70.4	-174.5	130.8	0	0	113.7	R195 M395 A396 I397 K550	R195-E399 IonicContact CZ-OE1 3.83Å; R195-E399 IonicContact NE-OE1 2.99Å; R195-E399 IonicContact NH2-OE1 3.78Å; R195-E399 PolarHBondContact NH2-OE1 2.85Å; M395-E399 WeakPolarHBondContact O-CB 3.47Å; M395-E399 VanDerWaalsContact O-CG 3.26Å; M395-E399 WeakPolarHBondContact O-CG 3.47Å; M395-E399 PolarHBondContact O-N 3.15Å; A396-E399 PolarHBondContact O-N 3.13Å; A396-E399 VanDerWaalsContact O-N 3.17Å; I397-E399 PolarHBondContact O-N 2.87Å; E399-K550 WeakPolarHBondContact OE1-CD 3.42Å; E399-K550 IonicContact OE1-NZ 3.78Å; E399-K550 WeakPolarHBondContact OE2-CE 3.26Å; E399-K550 IonicContact OE2-NZ 2.6Å; E399-K550 PolarHBondContact OE2-NZ 2.88Å
400	G	80	Confident	82.9	Confident	65 Å²	65	34.6 Å²	34.6	67%	0.67	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	104.6	3.3	173.6	0	0	0	0	0	114.9	A396 I397 V398	A396-G400 PolarHBondContact O-N 2.83Å; I397-G400 PolarHBondContact O-N 2.92Å; V398-G400 PolarHBondContact O-N 3.16Å
401	S	84.2	Confident	82.1	Confident	37 Å²	37	36.9 Å²	36.9	26%	0.259	21%	0.214	S	C	.	.			trans	-62	143.2	168.4	-64.6	0	0	0	0	110.1	A396 V406	A396-S401 VanDerWaalsContact O-CB 3.31Å; A396-S401 WeakPolarHBondContact O-CB 3.31Å; A396-S401 PolarHBondContact O-N 3.04Å; A396-S401 PolarHBondContact O-OG 3.21Å; S401-V406 VanDerWaalsContact CB-CG2 3.47Å
402	S	83.1	Confident	81.1	Confident	51 Å²	51	37.7 Å²	37.7	36%	0.357	22%	0.217	S	C	.	.			trans	-69	152.5	176.2	67.9	0	0	0	0	110.7	E404 E405 V406	S402-E404 VanDerWaalsContact C-N 3.26Å; S402-E404 WeakPolarHBondContact CB-OE2 3.48Å; S402-E404 PolarHBondContact O-N 3.43Å; S402-E405 PolarHBondContact O-N 3.4Å; S402-E405 WeakPolarHBondContact OG-CB 3.35Å; S402-E405 PolarHBondContact OG-N 3.17Å; S402-V406 VanDerWaalsContact O-CG2 3.32Å; S402-V406 WeakPolarHBondContact O-CG2 3.38Å; S402-V406 PolarHBondContact O-N 3.13Å; S402-V406 VanDerWaalsContact O-N 3.08Å
403	V	81.3	Confident	79.9	Confident	16 Å²	16	41.8 Å²	41.8	10%	0.097	24%	0.24	C	C	.	.	H	α-helix	trans	-65.2	-37.2	178.8	175.9	0	0	0	0	110.4	I397 E405 V406 L407 F471 F474	I397-V403 HydrophobicContact CD1-CG2 4.2Å; I397-V403 HydrophobicContact CG1-CG2 4.47Å; I397-V403 HydrophobicContact CG2-CG2 4.39Å; V403-E405 VanDerWaalsContact C-N 3.35Å; V403-E405 PolarHBondContact O-N 3.01Å; V403-V406 PolarHBondContact O-N 3.47Å; V403-L407 HydrophobicContact CG1-CD1 3.71Å; V403-L407 HydrophobicContact CG1-CG 4.15Å; V403-L407 WeakPolarHBondContact O-CB 3.37Å; V403-L407 WeakPolarHBondContact O-CG 3.28Å; V403-L407 PolarHBondContact O-N 2.97Å; V403-F471 HydrophobicContact CB-CE2 4.09Å; V403-F471 HydrophobicContact CG1-CD2 4.24Å; V403-F471 HydrophobicContact CG1-CE2 3.31Å; V403-F471 HydrophobicContact CG1-CZ 3.77Å; V403-F471 HydrophobicContact CG2-CD2 3.88Å; V403-F471 HydrophobicContact CG2-CE2 3.59Å; V403-F474 HydrophobicContact CB-CD1 3.74Å; V403-F474 HydrophobicContact CB-CE1 3.36Å; V403-F474 HydrophobicContact CB-CE2 4.4Å; V403-F474 HydrophobicContact CB-CG 4.46Å; V403-F474 HydrophobicContact CB-CZ 3.75Å; V403-F474 HydrophobicContact CG1-CD1 3.54Å; V403-F474 HydrophobicContact CG1-CE1 3.21Å; V403-F474 HydrophobicContact CG1-CZ 4.08Å; V403-F474 HydrophobicContact CG2-CD1 4.01Å; V403-F474 HydrophobicContact CG2-CE1 4.13Å; V403-F474 HydrophobicContact CG2-CG 4.38Å
404	E	83.3	Confident	78.6	Confident	72 Å²	72	46.4 Å²	46.4	34%	0.336	27%	0.273	S	S	.	.	H	α-helix	trans	-59.8	-44.2	176.5	-60.5	88	161.8	0	0	111.7	S402 S408 F474 L482	S402-E404 VanDerWaalsContact C-N 3.26Å; S402-E404 WeakPolarHBondContact CB-OE2 3.48Å; S402-E404 PolarHBondContact O-N 3.43Å; E404-S408 VanDerWaalsContact O-CB 3.3Å; E404-S408 WeakPolarHBondContact O-CB 3.44Å; E404-S408 PolarHBondContact O-N 3.25Å; E404-S408 VanDerWaalsContact O-N 3.11Å; E404-F474 HydrophobicContact CG-CZ 3.84Å; E404-F474 WeakPolarHBondContact OE1-CE2 3.39Å; E404-F474 WeakPolarHBondContact OE1-CZ 3.42Å; E404-L482 HydrophobicContact CG-CD2 4.46Å
405	E	85.1	Confident	77.4	Confident	101 Å²	101	47.1 Å²	47.1	47%	0.472	28%	0.278	S	S	.	.	H	α-helix	trans	-65.8	-47.2	177.6	179.3	-175.4	-177.2	0	0	111.4	S402 V403 S408	S402-E405 PolarHBondContact O-N 3.4Å; S402-E405 WeakPolarHBondContact OG-CB 3.35Å; S402-E405 PolarHBondContact OG-N 3.17Å; V403-E405 VanDerWaalsContact C-N 3.35Å; V403-E405 PolarHBondContact O-N 3.01Å; E405-S408 WeakPolarHBondContact O-CB 3.49Å; E405-S408 PolarHBondContact O-N 2.99Å; E405-S408 PolarHBondContact O-OG 2.83Å
406	V	83.3	Confident	75.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.9	-37	-175.8	171.6	0	0	0	0	112	L393 A396 I397 S401 S402 V403 S408 W411	L393-V406 HydrophobicContact CB-CG1 3.73Å; L393-V406 HydrophobicContact CD2-CG1 3.43Å; L393-V406 VanDerWaalsContact CD2-CG1 3.43Å; L393-V406 VanDerWaalsContact CD2-O 3.29Å; L393-V406 WeakPolarHBondContact CD2-O 3.43Å; L393-V406 HydrophobicContact CG-CG1 4.19Å; A396-V406 HydrophobicContact CB-CG1 4.47Å; A396-V406 HydrophobicContact CB-CG2 3.71Å; I397-V406 HydrophobicContact CD1-CB 4.48Å; I397-V406 HydrophobicContact CD1-CG1 4.16Å; I397-V406 HydrophobicContact CG1-CB 4.07Å; I397-V406 HydrophobicContact CG1-CG1 4.03Å; I397-V406 HydrophobicContact CG1-CG2 3.9Å; S401-V406 VanDerWaalsContact CB-CG2 3.47Å; S402-V406 VanDerWaalsContact O-CG2 3.32Å; S402-V406 WeakPolarHBondContact O-CG2 3.38Å; S402-V406 PolarHBondContact O-N 3.13Å; S402-V406 VanDerWaalsContact O-N 3.08Å; V403-V406 PolarHBondContact O-N 3.47Å; V406-S408 VanDerWaalsContact C-N 3.33Å; V406-W411 WeakPolarHBondContact O-CB 3.43Å
407	L	82	Confident	74.5	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	11.3	177.1	-59.6	-175.8	0	0	0	113.2	V403 F471 L475 L482 V487 F490	V403-L407 HydrophobicContact CG1-CD1 3.71Å; V403-L407 HydrophobicContact CG1-CG 4.15Å; V403-L407 WeakPolarHBondContact O-CB 3.37Å; V403-L407 WeakPolarHBondContact O-CG 3.28Å; V403-L407 PolarHBondContact O-N 2.97Å; L407-F471 HydrophobicContact CD1-CZ 3.93Å; L407-L475 HydrophobicContact CD1-CD2 4.27Å; L407-L482 HydrophobicContact CB-CD2 4.2Å; L407-L482 HydrophobicContact CD1-CD1 4Å; L407-V487 HydrophobicContact CD1-CG2 3.82Å; L407-F490 HydrophobicContact CD2-CB 3.89Å; L407-F490 HydrophobicContact CD2-CD2 4.17Å; L407-F490 HydrophobicContact CD2-CG 4.14Å
408	S	80.6	Confident	73.4	Confident	25 Å²	25	57.1 Å²	57.1	18%	0.175	32%	0.323	C	S	.	.	S	Bend	trans	-78.6	152	173.4	74.1	0	0	0	0	111.2	E404 E405 V406 L410 W411	E404-S408 VanDerWaalsContact O-CB 3.3Å; E404-S408 WeakPolarHBondContact O-CB 3.44Å; E404-S408 PolarHBondContact O-N 3.25Å; E404-S408 VanDerWaalsContact O-N 3.11Å; E405-S408 WeakPolarHBondContact O-CB 3.49Å; E405-S408 PolarHBondContact O-N 2.99Å; E405-S408 PolarHBondContact O-OG 2.83Å; V406-S408 VanDerWaalsContact C-N 3.33Å; S408-L410 PolarHBondContact O-N 3.41Å; S408-L410 VanDerWaalsContact O-N 3.08Å; S408-W411 PolarHBondContact O-N 3.38Å; S408-W411 VanDerWaalsContact O-N 3.08Å
409	P	72.8	Confident	72.8	Confident	79 Å²	79	56.8 Å²	56.8	51%	0.513	32%	0.32	S	S	.	.	H	α-helix	trans	-55.2	-28.4	174.9	-27.2	35	0	0	0	114.2	W411 F412 D413 D483	P409-W411 PolarHBondContact O-N 3.37Å; P409-F412 PolarHBondContact O-N 3.14Å; P409-D413 PolarHBondContact O-N 2.85Å; P409-D413 VanDerWaalsContact O-N 3.11Å; P409-D483 HydrophobicContact CG-CB 4.44Å
410	L	73.3	Confident	72.4	Confident	133 Å²	133	56.8 Å²	56.8	70%	0.696	32%	0.322	S	S	*	.	H	α-helix	trans	-61.9	-30.3	-180	-63.7	172.2	0	0	0	112.8	S408 S414	S408-L410 PolarHBondContact O-N 3.41Å; S408-L410 VanDerWaalsContact O-N 3.08Å; L410-S414 PolarHBondContact O-N 2.95Å; L410-S414 PolarHBondContact O-OG 3.23Å
411	W	70.6	Confident	72.2	Confident	51 Å²	51	60.1 Å²	60.1	19%	0.193	32%	0.315	C	S	.	.	H	α-helix	trans	-76.1	-34.7	179.9	-144.5	94.1	0	0	0	111.7	L389 E392 L393 A396 V406 S408 P409 S414 S415	L389-W411 HydrophobicContact CD1-CE3 4.2Å; L389-W411 HydrophobicContact CD1-CZ3 3.61Å; E392-W411 HydrophobicContact CB-CH2 3.87Å; E392-W411 HydrophobicContact CB-CZ3 4.46Å; L393-W411 HydrophobicContact CD2-CD2 3.73Å; L393-W411 HydrophobicContact CD2-CE3 3.18Å; L393-W411 HydrophobicContact CD2-CG 4.48Å; L393-W411 HydrophobicContact CD2-CH2 3.99Å; L393-W411 HydrophobicContact CD2-CZ2 4.46Å; L393-W411 HydrophobicContact CD2-CZ3 3.34Å; L393-W411 HydrophobicContact CG-CE3 4.21Å; L393-W411 HydrophobicContact CG-CH2 4.43Å; L393-W411 HydrophobicContact CG-CZ3 3.9Å; A396-W411 HydrophobicContact CB-CZ2 3.83Å; V406-W411 WeakPolarHBondContact O-CB 3.43Å; S408-W411 PolarHBondContact O-N 3.38Å; S408-W411 VanDerWaalsContact O-N 3.08Å; P409-W411 PolarHBondContact O-N 3.37Å; W411-S414 PolarHBondContact O-N 3.26Å; W411-S414 PolarHBondContact O-OG 3.45Å; W411-S415 PolarHBondContact O-N 3.45Å; W411-S415 PolarHBondContact O-OG 3.29Å
412	F	68	Low	72	Confident	18 Å²	18	58.3 Å²	58.3	8%	0.079	30%	0.302	C	S	.	.	H	α-helix	trans	-67.3	-42.4	173.1	-84.3	-103.4	0	0	0	111	L389 L393 P409 S414 S415 A416 V423 S486 L489	L389-F412 HydrophobicContact CD2-CD1 3.96Å; L389-F412 HydrophobicContact CD2-CE1 3.4Å; L389-F412 HydrophobicContact CD2-CZ 3.84Å; L393-F412 HydrophobicContact CD1-CE2 4.35Å; L393-F412 HydrophobicContact CD1-CZ 4.28Å; P409-F412 PolarHBondContact O-N 3.14Å; F412-S414 PolarHBondContact O-N 2.83Å; F412-S415 CarbonylContact O-C 3.41Å; F412-S415 PolarHBondContact O-N 2.98Å; F412-A416 WeakPolarHBondContact O-CA 2.71Å; F412-A416 WeakPolarHBondContact O-CB 3.46Å; F412-A416 PolarHBondContact O-N 3.41Å; F412-V423 HydrophobicContact CE1-CG1 4.42Å; F412-S486 VanDerWaalsContact CD2-OG 3.31Å; F412-S486 WeakPolarHBondContact CD2-OG 3.21Å; F412-S486 VanDerWaalsContact CE2-CB 3.49Å; F412-S486 WeakPolarHBondContact CE2-OG 3.08Å; F412-S486 WeakPolarHBondContact CZ-OG 3.06Å; F412-L489 HydrophobicContact CE1-CD2 4.16Å; F412-L489 HydrophobicContact CZ-CD2 4.02Å
413	D	65.1	Low	71.7	Confident	115 Å²	115	56.3 Å²	56.3	62%	0.615	29%	0.288	S	S	*	.	H	α-helix	trans	-58.7	-31.2	178.4	-80.7	-17.8	0	0	0	113.9	P409 A416	P409-D413 PolarHBondContact O-N 2.85Å; P409-D413 VanDerWaalsContact O-N 3.11Å; D413-A416 VanDerWaalsContact O-CB 3.29Å; D413-A416 WeakPolarHBondContact O-CB 3.35Å
414	S	59.3	Low	71.6	Confident	98 Å²	98	58.2 Å²	58.2	69%	0.685	31%	0.305	S	S	*	.	H	α-helix	trans	-78.9	-30.5	176.7	30.6	0	0	0	0	112.6	L410 W411 F412	L410-S414 PolarHBondContact O-N 2.95Å; L410-S414 PolarHBondContact O-OG 3.23Å; W411-S414 PolarHBondContact O-N 3.26Å; W411-S414 PolarHBondContact O-OG 3.45Å; F412-S414 PolarHBondContact O-N 2.83Å
415	S	61	Low	71.3	Confident	22 Å²	22	58.4 Å²	58.4	15%	0.154	31%	0.306	C	S	.	.	H	α-helix	trans	-89.8	-3.6	174	-57.6	0	0	0	0	113.6	W411 F412 K417	W411-S415 PolarHBondContact O-N 3.45Å; W411-S415 PolarHBondContact O-OG 3.29Å; F412-S415 CarbonylContact O-C 3.41Å; F412-S415 PolarHBondContact O-N 2.98Å; S415-K417 PolarHBondContact O-N 3.18Å
416	A	53.5	Low	71	Confident	9 Å²	9	53.9 Å²	53.9	7%	0.074	29%	0.285	C	S	.	.	H	α-helix	trans	-67.9	-42.9	-148.2	0	0	0	0	0	116.5	F412 D413 I418 V419 N420	F412-A416 WeakPolarHBondContact O-CA 2.71Å; F412-A416 WeakPolarHBondContact O-CB 3.46Å; F412-A416 PolarHBondContact O-N 3.41Å; D413-A416 VanDerWaalsContact O-CB 3.29Å; D413-A416 WeakPolarHBondContact O-CB 3.35Å; A416-I418 VanDerWaalsContact C-N 3.26Å; A416-I418 PolarHBondContact O-N 3.46Å; A416-I418 VanDerWaalsContact O-N 3.15Å; A416-V419 PolarHBondContact O-N 3.03Å; A416-N420 WeakPolarHBondContact CA-OD1 3.44Å; A416-N420 WeakPolarHBondContact CB-ND2 3.18Å; A416-N420 WeakPolarHBondContact O-CB 3.37Å; A416-N420 PolarHBondContact O-N 3.37Å; A416-N420 PolarHBondContact O-OD1 3.47Å
417	K	57.9	Low	70.6	Confident	206 Å²	206	54.9 Å²	54.9	90%	0.896	29%	0.289	S	S	*	.	H	α-helix	trans	-65	-33.1	-159.9	-72.5	-173.4	179.3	178.3	0	113.4	S415	S415-K417 PolarHBondContact O-N 3.18Å
418	I	57.3	Low	70.3	Confident	33 Å²	33	57.7 Å²	57.7	17%	0.169	31%	0.306	C	S	.	.	H	α-helix	trans	-87.9	-40.3	-178.6	-68.9	175.3	0	0	0	110.4	Q360 A416 A539	Q360-I418 HydrophobicContact CG-CG2 4.29Å; Q360-I418 VanDerWaalsContact NE2-CG2 3.29Å; A416-I418 VanDerWaalsContact C-N 3.26Å; A416-I418 PolarHBondContact O-N 3.46Å; A416-I418 VanDerWaalsContact O-N 3.15Å; I418-A539 HydrophobicContact CD1-CB 3.87Å
419	V	67.4	Low	69.8	Low	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-88.9	-31.5	-169.2	-173.7	0	0	0	0	112.2	L389 A416 R421 V422 V423	L389-V419 HydrophobicContact CB-CG1 4.07Å; L389-V419 HydrophobicContact CD2-CB 4.3Å; L389-V419 HydrophobicContact CD2-CG1 3.46Å; L389-V419 VanDerWaalsContact CD2-CG1 3.46Å; L389-V419 HydrophobicContact CG-CG1 4.36Å; A416-V419 PolarHBondContact O-N 3.03Å; V419-R421 VanDerWaalsContact C-N 3.28Å; V419-R421 PolarHBondContact O-N 3.04Å; V419-V422 PolarHBondContact O-N 3.31Å; V419-V423 HydrophobicContact CG1-CB 4.41Å; V419-V423 HydrophobicContact CG1-CG2 3.39Å; V419-V423 WeakPolarHBondContact O-CB 3.48Å; V419-V423 WeakPolarHBondContact O-CG2 3.3Å; V419-V423 PolarHBondContact O-N 3.4Å
420	N	71	Confident	69	Low	61 Å²	61	54.9 Å²	54.9	33%	0.326	29%	0.288	S	S	.	.	H	α-helix	trans	-61.6	-32.2	-173	-75.2	4.2	0	0	0	113.5	A416 A424	A416-N420 WeakPolarHBondContact CA-OD1 3.44Å; A416-N420 WeakPolarHBondContact CB-ND2 3.18Å; A416-N420 WeakPolarHBondContact O-CB 3.37Å; A416-N420 PolarHBondContact O-N 3.37Å; A416-N420 PolarHBondContact O-OD1 3.47Å; N420-A424 WeakPolarHBondContact O-CB 3.39Å; N420-A424 PolarHBondContact O-N 2.92Å
421	R	77.4	Confident	68.4	Low	135 Å²	135	52.1 Å²	52.1	51%	0.509	27%	0.271	S	S	.	.	H	α-helix	trans	-68	-46.7	179	-171.8	180	178.7	-166.8	1.4	111.6	L364 V419 E425	L364-R421 HydrophobicContact CD1-CG 4.3Å; L364-R421 HydrophobicContact CD2-CG 4.44Å; V419-R421 VanDerWaalsContact C-N 3.28Å; V419-R421 PolarHBondContact O-N 3.04Å; R421-E425 WeakPolarHBondContact O-CG 3.46Å; R421-E425 PolarHBondContact O-N 3.42Å
422	V	79.4	Confident	67.8	Low	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.8	-40.2	179	-178	0	0	0	0	110.3	Q360 A363 L364 L367 P385 V419 E425 F426	Q360-V422 HydrophobicContact CB-CG2 4.34Å; A363-V422 HydrophobicContact CB-CG1 3.73Å; A363-V422 HydrophobicContact CB-CG2 4.18Å; L364-V422 HydrophobicContact CD2-CG2 4.32Å; L364-V422 HydrophobicContact CG-CG2 4.22Å; L367-V422 HydrophobicContact CD1-CG1 4.28Å; P385-V422 HydrophobicContact CB-CB 4.49Å; P385-V422 HydrophobicContact CB-CG2 4.42Å; P385-V422 HydrophobicContact CG-CG2 4.23Å; V419-V422 PolarHBondContact O-N 3.31Å; V422-E425 PolarHBondContact O-N 2.81Å; V422-F426 VanDerWaalsContact O-CB 3.3Å; V422-F426 WeakPolarHBondContact O-CB 3.42Å; V422-F426 PolarHBondContact O-N 3.11Å
423	V	76.1	Confident	67.2	Low	9 Å²	9	59.1 Å²	59.1	6%	0.055	30%	0.301	C	S	.	.	H	α-helix	trans	-66.5	-41.3	177.8	167.3	0	0	0	0	111.8	F412 V419 E425 F426 Y427 L489	F412-V423 HydrophobicContact CE1-CG1 4.42Å; V419-V423 HydrophobicContact CG1-CB 4.41Å; V419-V423 HydrophobicContact CG1-CG2 3.39Å; V419-V423 WeakPolarHBondContact O-CB 3.48Å; V419-V423 WeakPolarHBondContact O-CG2 3.3Å; V419-V423 PolarHBondContact O-N 3.4Å; V423-E425 VanDerWaalsContact C-N 3.34Å; V423-E425 PolarHBondContact O-N 3.03Å; V423-F426 WeakPolarHBondContact O-CB 3.06Å; V423-F426 PolarHBondContact O-N 3.45Å; V423-Y427 HydrophobicContact CB-CE2 4.45Å; V423-Y427 HydrophobicContact CG1-CD2 3.78Å; V423-Y427 HydrophobicContact CG1-CE2 3.14Å; V423-Y427 WeakPolarHBondContact O-CD2 3.24Å; V423-Y427 PolarHBondContact O-N 3.28Å; V423-L489 HydrophobicContact CG2-CD2 4.47Å
424	A	78.5	Confident	66.4	Low	55 Å²	55	63 Å²	63	46%	0.455	31%	0.307	S	S	.	.	H	α-helix	trans	-60.2	-44.7	174.4	0	0	0	0	0	111.5	N420 Y427 T428	N420-A424 WeakPolarHBondContact O-CB 3.39Å; N420-A424 PolarHBondContact O-N 2.92Å; A424-Y427 PolarHBondContact O-N 3.26Å; A424-T428 WeakPolarHBondContact O-CG2 3.35Å; A424-T428 PolarHBondContact O-N 3.5Å; A424-T428 VanDerWaalsContact O-N 3.13Å
425	E	78.8	Confident	65.9	Low	77 Å²	77	63 Å²	63	36%	0.36	30%	0.3	S	S	.	.	H	α-helix	trans	-70.1	-33.2	176.1	-68.5	-72.3	-173.1	0	0	112.7	L364 L367 R421 V422 V423 Y427 T428 V429	L364-E425 HydrophobicContact CD2-CB 3.99Å; L364-E425 HydrophobicContact CD2-CG 3.73Å; L367-E425 HydrophobicContact CD1-CB 3.92Å; R421-E425 WeakPolarHBondContact O-CG 3.46Å; R421-E425 PolarHBondContact O-N 3.42Å; V422-E425 PolarHBondContact O-N 2.81Å; V423-E425 VanDerWaalsContact C-N 3.34Å; V423-E425 PolarHBondContact O-N 3.03Å; E425-Y427 PolarHBondContact O-N 3.01Å; E425-T428 VanDerWaalsContact CA-OG1 3.3Å; E425-T428 WeakPolarHBondContact CA-OG1 3.3Å; E425-T428 PolarHBondContact O-N 2.88Å; E425-T428 PolarHBondContact O-OG1 3.18Å; E425-T428 PolarHBondContact OE2-OG1 2.74Å; E425-V429 PolarHBondContact O-N 3.42Å
426	F	77.7	Confident	65.1	Low	5 Å²	5	69.1 Å²	69.1	2%	0.022	33%	0.326	C	S	.	.	H	α-helix	trans	-58.5	-40.6	172.4	176.8	-105.4	0	0	0	110.9	L367 L380 L383 V422 V423 L432 F492	L367-F426 HydrophobicContact CD1-CB 4.44Å; L367-F426 HydrophobicContact CD2-CD2 4.43Å; L380-F426 HydrophobicContact CD1-CE2 4.47Å; L383-F426 HydrophobicContact CD1-CB 4.3Å; L383-F426 HydrophobicContact CD1-CD2 3.36Å; L383-F426 HydrophobicContact CD1-CE2 3.98Å; L383-F426 HydrophobicContact CD1-CG 4.17Å; V422-F426 VanDerWaalsContact O-CB 3.3Å; V422-F426 WeakPolarHBondContact O-CB 3.42Å; V422-F426 PolarHBondContact O-N 3.11Å; V423-F426 WeakPolarHBondContact O-CB 3.06Å; V423-F426 PolarHBondContact O-N 3.45Å; F426-L432 HydrophobicContact CD1-CD1 4.25Å; F426-L432 HydrophobicContact CD2-CD1 3.71Å; F426-L432 HydrophobicContact CE1-CD1 3.96Å; F426-L432 HydrophobicContact CE2-CD1 3.41Å; F426-L432 VanDerWaalsContact CE2-CD1 3.41Å; F426-L432 HydrophobicContact CG-CD1 4.15Å; F426-L432 HydrophobicContact CZ-CD1 3.55Å; F426-L432 HydrophobicContact CZ-CD2 4.33Å; F426-L432 VanDerWaalsContact O-CD1 3.28Å; F426-L432 WeakPolarHBondContact O-CD1 3.46Å; F426-F492 HydrophobicContact CZ-CD2 4.1Å; F426-F492 HydrophobicContact CZ-CE2 4.16Å
427	Y	74.4	Confident	64.6	Low	22 Å²	22	75.8 Å²	75.8	9%	0.086	36%	0.355	C	S	.	.	H	α-helix	trans	-82.1	-11.2	176.9	-59.7	-53.6	0	0	0	115.1	V423 A424 E425 V429 R433 D485 A488 L489	V423-Y427 HydrophobicContact CB-CE2 4.45Å; V423-Y427 HydrophobicContact CG1-CD2 3.78Å; V423-Y427 HydrophobicContact CG1-CE2 3.14Å; V423-Y427 WeakPolarHBondContact O-CD2 3.24Å; V423-Y427 PolarHBondContact O-N 3.28Å; A424-Y427 PolarHBondContact O-N 3.26Å; E425-Y427 PolarHBondContact O-N 3.01Å; Y427-V429 VanDerWaalsContact C-N 3.35Å; Y427-R433 WeakPolarHBondContact O-CG 3.47Å; Y427-R433 PolarHBondContact O-NE 3.27Å; Y427-R433 PolarHBondContact O-NH2 2.95Å; Y427-D485 HydrophobicContact CD2-CB 4.02Å; Y427-D485 WeakPolarHBondContact CD2-OD2 3.07Å; Y427-D485 HydrophobicContact CE1-CB 4.04Å; Y427-D485 HydrophobicContact CE2-CB 3.37Å; Y427-D485 VanDerWaalsContact CZ-CB 3.44Å; Y427-D485 PolarHBondContact OH-O 3.49Å; Y427-A488 HydrophobicContact CE1-CB 4.42Å; Y427-L489 WeakPolarHBondContact OH-CB 3.35Å
428	T	76.5	Confident	64	Low	58 Å²	58	66.6 Å²	66.6	36%	0.356	32%	0.318	S	S	.	.	H	α-helix	trans	-78.5	-22.8	171.6	54.1	0	0	0	0	111.7	A424 E425 S430	A424-T428 WeakPolarHBondContact O-CG2 3.35Å; A424-T428 PolarHBondContact O-N 3.5Å; A424-T428 VanDerWaalsContact O-N 3.13Å; E425-T428 VanDerWaalsContact CA-OG1 3.3Å; E425-T428 WeakPolarHBondContact CA-OG1 3.3Å; E425-T428 PolarHBondContact O-N 2.88Å; E425-T428 PolarHBondContact O-OG1 3.18Å; E425-T428 PolarHBondContact OE2-OG1 2.74Å; T428-S430 PolarHBondContact O-N 3.05Å
429	V	70.7	Confident	63.4	Low	3 Å²	3	67 Å²	67	2%	0.018	33%	0.33	C	S	.	.	S	Bend	trans	-57.9	110.2	176.1	-179.9	0	0	0	0	110.2	L367 Y370 E425 Y427 H431 L432	L367-V429 HydrophobicContact CD2-CG2 3.92Å; Y370-V429 HydrophobicContact CD1-CG1 4.22Å; Y370-V429 HydrophobicContact CE1-CG1 4.02Å; E425-V429 PolarHBondContact O-N 3.42Å; Y427-V429 VanDerWaalsContact C-N 3.35Å; V429-H431 PolarHBondContact O-N 3.4Å; V429-L432 HydrophobicContact CB-CD1 4.31Å; V429-L432 PolarHBondContact O-N 3.17Å
430	S	55.4	Low	62.2	Low	42 Å²	42	73.3 Å²	73.3	29%	0.294	36%	0.364	S	S	.	.	H	α-helix	trans	-56.6	-28.6	-166.6	63.2	0	0	0	0	115.4	T428 R433 R434	T428-S430 PolarHBondContact O-N 3.05Å; S430-R433 PolarHBondContact O-N 3.37Å; S430-R434 WeakPolarHBondContact O-CG 3.37Å; S430-R434 PolarHBondContact O-N 3.44Å; S430-R434 VanDerWaalsContact O-N 3.08Å
431	H	59.9	Low	60.6	Low	75 Å²	75	75.9 Å²	75.9	35%	0.347	37%	0.373	S	S	.	.	H	α-helix	trans	-69.9	-40.1	179.4	-40.1	-66.5	0	0	0	112.1	V429 R433 R434 D435	V429-H431 PolarHBondContact O-N 3.4Å; H431-R433 PolarHBondContact O-N 2.81Å; H431-R434 PolarHBondContact O-N 3.06Å; H431-D435 PolarHBondContact O-N 3.12Å
432	L	59.5	Low	58.8	Low	56 Å²	56	72.2 Å²	72.2	29%	0.293	36%	0.363	S	S	.	.	H	α-helix	trans	-66.4	-28.1	178.2	-73.4	169.5	0	0	0	112	L380 F426 V429	L380-L432 HydrophobicContact CD1-CD1 4.27Å; L380-L432 HydrophobicContact CD1-CD2 3.91Å; L380-L432 HydrophobicContact CD1-CG 4.38Å; L380-L432 HydrophobicContact CD2-CD1 4.47Å; F426-L432 HydrophobicContact CD1-CD1 4.25Å; F426-L432 HydrophobicContact CD2-CD1 3.71Å; F426-L432 HydrophobicContact CE1-CD1 3.96Å; F426-L432 HydrophobicContact CE2-CD1 3.41Å; F426-L432 VanDerWaalsContact CE2-CD1 3.41Å; F426-L432 HydrophobicContact CG-CD1 4.15Å; F426-L432 HydrophobicContact CZ-CD1 3.55Å; F426-L432 HydrophobicContact CZ-CD2 4.33Å; F426-L432 VanDerWaalsContact O-CD1 3.28Å; F426-L432 WeakPolarHBondContact O-CD1 3.46Å; V429-L432 HydrophobicContact CB-CD1 4.31Å; V429-L432 PolarHBondContact O-N 3.17Å
433	R	54.2	Low	56.8	Low	160 Å²	160	74 Å²	74	60%	0.604	37%	0.372	S	S	*	.	H	α-helix	trans	-77.8	-39.6	171.7	-71	-169.7	-175.8	-178.2	0.5	113.7	Y427 S430 H431 D435	Y427-R433 WeakPolarHBondContact O-CG 3.47Å; Y427-R433 PolarHBondContact O-NE 3.27Å; Y427-R433 PolarHBondContact O-NH2 2.95Å; S430-R433 PolarHBondContact O-N 3.37Å; H431-R433 PolarHBondContact O-N 2.81Å; R433-D435 PolarHBondContact O-N 3.33Å
434	R	48.9	Very low	55.1	Low	196 Å²	196	74.7 Å²	74.7	74%	0.74	38%	0.377	S	S	*	.	H	α-helix	trans	-70.4	-23.7	-175.7	-79.1	-177.3	-169.6	156.1	7	112.6	S430 H431 E436	S430-R434 WeakPolarHBondContact O-CG 3.37Å; S430-R434 PolarHBondContact O-N 3.44Å; S430-R434 VanDerWaalsContact O-N 3.08Å; H431-R434 PolarHBondContact O-N 3.06Å; R434-E436 PolarHBondContact O-N 3.11Å
435	D	47.8	Very low	53.2	Low	100 Å²	100	75.7 Å²	75.7	54%	0.535	38%	0.375	S	S	.	.			trans	-79.2	44.9	178.2	-119.2	-11.4	0	0	0	112.2	H431 R433 H437 A438 G439	H431-D435 PolarHBondContact O-N 3.12Å; R433-D435 PolarHBondContact O-N 3.33Å; D435-H437 PolarHBondContact O-N 2.91Å; D435-A438 HydrophobicContact CB-CB 3.52Å; D435-A438 WeakPolarHBondContact O-CA 3.48Å; D435-A438 VanDerWaalsContact O-CB 3.29Å; D435-A438 WeakPolarHBondContact O-CB 3.45Å; D435-A438 PolarHBondContact O-N 2.79Å; D435-G439 PolarHBondContact O-N 3Å
436	E	44.4	Very low	51.3	Low	150 Å²	150	72.7 Å²	72.7	70%	0.701	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-15.7	167.8	-70.5	-167	147.2	0	0	111.7	R434	R434-E436 PolarHBondContact O-N 3.11Å
437	H	43.8	Very low	49.4	Very low	148 Å²	148	73 Å²	73	69%	0.685	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-19	170.1	-66.7	8.8	0	0	0	113.1	D435 G439 N440 H441	D435-H437 PolarHBondContact O-N 2.91Å; H437-G439 VanDerWaalsContact C-N 3.27Å; H437-G439 PolarHBondContact O-N 3.14Å; H437-N440 PolarHBondContact O-N 3.04Å; H437-H441 PolarHBondContact O-CD2 3.1Å; H437-H441 PolarHBondContact O-N 2.89Å; H437-H441 VanDerWaalsContact O-N 3.11Å
438	A	44.6	Very low	47.7	Very low	14 Å²	14	77.3 Å²	77.3	12%	0.116	38%	0.384	C	S	.	.	H	α-helix	trans	-73.3	-15.9	169.7	0	0	0	0	0	112.8	D435 N440 H441 M442	D435-A438 HydrophobicContact CB-CB 3.52Å; D435-A438 WeakPolarHBondContact O-CA 3.48Å; D435-A438 VanDerWaalsContact O-CB 3.29Å; D435-A438 WeakPolarHBondContact O-CB 3.45Å; D435-A438 PolarHBondContact O-N 2.79Å; A438-N440 PolarHBondContact O-N 2.85Å; A438-N440 VanDerWaalsContact O-N 3.15Å; A438-H441 PolarHBondContact O-N 3.26Å; A438-M442 HydrophobicContact CB-CB 4.13Å; A438-M442 WeakPolarHBondContact O-CA 2.96Å; A438-M442 WeakPolarHBondContact O-CB 3.45Å; A438-M442 PolarHBondContact O-N 2.85Å
439	G	44.7	Very low	45.9	Very low	41 Å²	41	77.6 Å²	77.6	42%	0.423	39%	0.386	S	S	.	.	H	α-helix	trans	-51.8	-38.6	166.3	0	0	0	0	0	112	D435 H437 L443	D435-G439 PolarHBondContact O-N 3Å; H437-G439 VanDerWaalsContact C-N 3.27Å; H437-G439 PolarHBondContact O-N 3.14Å; G439-L443 WeakPolarHBondContact O-CB 3.42Å; G439-L443 WeakPolarHBondContact O-CD1 3.44Å; G439-L443 WeakPolarHBondContact O-CG 3.11Å
440	N	41.8	Very low	44.3	Very low	133 Å²	133	79.3 Å²	79.3	71%	0.711	40%	0.396	S	S	*	.	H	α-helix	trans	-89.2	-40.9	174.2	-73.1	-21.8	0	0	0	112.6	H437 A438 S444	H437-N440 PolarHBondContact O-N 3.04Å; A438-N440 PolarHBondContact O-N 2.85Å; A438-N440 VanDerWaalsContact O-N 3.15Å; N440-S444 WeakPolarHBondContact O-CB 3.47Å; N440-S444 PolarHBondContact O-N 3.3Å
441	H	38.3	Very low	43.4	Very low	114 Å²	114	80.3 Å²	80.3	53%	0.528	40%	0.403	S	S	.	.	H	α-helix	trans	-77.1	-39.2	-177.9	-76.2	-72	0	0	0	114.2	H437 A438 S444 D445	H437-H441 PolarHBondContact O-CD2 3.1Å; H437-H441 PolarHBondContact O-N 2.89Å; H437-H441 VanDerWaalsContact O-N 3.11Å; A438-H441 PolarHBondContact O-N 3.26Å; H441-S444 PolarHBondContact O-N 2.98Å; H441-D445 WeakPolarHBondContact O-CA 3.31Å; H441-D445 WeakPolarHBondContact O-CB 3.43Å; H441-D445 PolarHBondContact O-N 3.42Å
442	M	39.7	Very low	42.1	Very low	59 Å²	59	81 Å²	81	29%	0.291	42%	0.416	S	S	.	.	H	α-helix	trans	-67.1	-42.9	175.8	-134.4	-168	76.9	0	0	110.7	A438 I446 C491 F492	A438-M442 HydrophobicContact CB-CB 4.13Å; A438-M442 WeakPolarHBondContact O-CA 2.96Å; A438-M442 WeakPolarHBondContact O-CB 3.45Å; A438-M442 PolarHBondContact O-N 2.85Å; M442-I446 HydrophobicContact CB-CD1 4.35Å; M442-I446 HydrophobicContact CE-CD1 3.48Å; M442-I446 VanDerWaalsContact CE-CD1 3.48Å; M442-I446 HydrophobicContact CG-CD1 3.86Å; M442-I446 WeakPolarHBondContact O-CB 3.43Å; M442-I446 WeakPolarHBondContact O-CD1 3.33Å; M442-I446 WeakPolarHBondContact O-CG1 3.47Å; M442-I446 PolarHBondContact O-N 3.31Å; M442-I446 HydrophobicContact SD-CD1 4.43Å; M442-C491 HydrophobicContact CE-CB 4.32Å; M442-C491 WeakPolarHBondContact CE-O 3.44Å; M442-F492 HydrophobicContact CE-CD2 4.37Å
443	L	38.1	Very low	40.9	Very low	36 Å²	36	82.1 Å²	82.1	19%	0.188	43%	0.429	C	S	.	.	H	α-helix	trans	-61.3	-53.4	172.8	-68.5	-177.9	0	0	0	110.5	G439 D445 I446 F447 L475 C491	G439-L443 WeakPolarHBondContact O-CB 3.42Å; G439-L443 WeakPolarHBondContact O-CD1 3.44Å; G439-L443 WeakPolarHBondContact O-CG 3.11Å; L443-D445 PolarHBondContact O-N 3.13Å; L443-I446 PolarHBondContact O-N 3.42Å; L443-F447 HydrophobicContact CB-CD2 4.23Å; L443-F447 HydrophobicContact CB-CE2 3.93Å; L443-F447 HydrophobicContact CD2-CE2 3.87Å; L443-F447 HydrophobicContact CD2-CZ 4.07Å; L443-F447 HydrophobicContact CG-CE2 4.44Å; L443-F447 VanDerWaalsContact O-CB 3.3Å; L443-F447 WeakPolarHBondContact O-CB 3.23Å; L443-F447 WeakPolarHBondContact O-CD2 3.03Å; L443-F447 WeakPolarHBondContact O-CG 3.42Å; L443-F447 PolarHBondContact O-N 3.15Å; L443-L475 HydrophobicContact CD1-CD1 4.1Å; L443-L475 HydrophobicContact CD2-CD1 4Å; L443-C491 HydrophobicContact CD2-CB 3.46Å; L443-C491 VanDerWaalsContact CD2-CB 3.46Å; L443-C491 WeakPolarHBondContact CD2-SG 3.39Å
444	S	40.3	Very low	39.9	Very low	25 Å²	25	79 Å²	79	18%	0.175	42%	0.42	C	S	.	.	H	α-helix	trans	-52.4	-53.3	175.8	164.5	0	0	0	0	111.5	N440 H441 F447 Q448	N440-S444 WeakPolarHBondContact O-CB 3.47Å; N440-S444 PolarHBondContact O-N 3.3Å; H441-S444 PolarHBondContact O-N 2.98Å; S444-F447 CarbonylContact O-C 3.49Å; S444-F447 PolarHBondContact O-N 2.95Å; S444-Q448 WeakPolarHBondContact O-CA 3.32Å; S444-Q448 WeakPolarHBondContact O-CB 3.44Å; S444-Q448 WeakPolarHBondContact O-CG 3.13Å; S444-Q448 PolarHBondContact O-N 3.14Å; S444-Q448 VanDerWaalsContact OG-CD 3.28Å; S444-Q448 PolarHBondContact OG-NE2 3.21Å
445	D	37.9	Very low	39.1	Very low	75 Å²	75	72.4 Å²	72.4	40%	0.401	41%	0.413	S	S	.	.	H	α-helix	trans	-73.9	-36	-171.7	-67.9	-9.3	0	0	0	111.1	H441 L443 F447 Q448 T449	H441-D445 WeakPolarHBondContact O-CA 3.31Å; H441-D445 WeakPolarHBondContact O-CB 3.43Å; H441-D445 PolarHBondContact O-N 3.42Å; L443-D445 PolarHBondContact O-N 3.13Å; D445-F447 VanDerWaalsContact C-N 3.33Å; D445-Q448 PolarHBondContact O-N 3.41Å; D445-T449 WeakPolarHBondContact O-CA 3.49Å; D445-T449 VanDerWaalsContact O-CB 3.24Å; D445-T449 WeakPolarHBondContact O-CB 3.46Å; D445-T449 WeakPolarHBondContact O-CG2 2.97Å; D445-T449 PolarHBondContact O-N 3.26Å; D445-T449 PolarHBondContact O-OG1 3.48Å
446	I	38.9	Very low	38.4	Very low	15 Å²	15	74 Å²	74	8%	0.077	43%	0.431	C	S	.	.	H	α-helix	trans	-65.5	-39.8	172.6	-68.6	161.5	0	0	0	110.3	M442 L443 T450 C491 N493	M442-I446 HydrophobicContact CB-CD1 4.35Å; M442-I446 HydrophobicContact CE-CD1 3.48Å; M442-I446 VanDerWaalsContact CE-CD1 3.48Å; M442-I446 HydrophobicContact CG-CD1 3.86Å; M442-I446 WeakPolarHBondContact O-CB 3.43Å; M442-I446 WeakPolarHBondContact O-CD1 3.33Å; M442-I446 WeakPolarHBondContact O-CG1 3.47Å; M442-I446 PolarHBondContact O-N 3.31Å; M442-I446 HydrophobicContact SD-CD1 4.43Å; L443-I446 PolarHBondContact O-N 3.42Å; I446-T450 WeakPolarHBondContact O-CB 3.34Å; I446-T450 WeakPolarHBondContact O-CG2 3.06Å; I446-T450 PolarHBondContact O-N 3.4Å; I446-T450 PolarHBondContact O-OG1 2.82Å; I446-C491 WeakPolarHBondContact CD1-O 3.48Å; I446-N493 HydrophobicContact CD1-CB 4.21Å; I446-N493 HydrophobicContact CG1-CB 4.1Å
447	F	37.9	Very low	38	Very low	10 Å²	10	73.2 Å²	73.2	4%	0.044	43%	0.431	C	S	.	.	H	α-helix	trans	-78.6	-24.9	177.5	-57.4	-33.8	0	0	0	113.3	L443 S444 D445 T450 S451 H468 E472	L443-F447 HydrophobicContact CB-CD2 4.23Å; L443-F447 HydrophobicContact CB-CE2 3.93Å; L443-F447 HydrophobicContact CD2-CE2 3.87Å; L443-F447 HydrophobicContact CD2-CZ 4.07Å; L443-F447 HydrophobicContact CG-CE2 4.44Å; L443-F447 VanDerWaalsContact O-CB 3.3Å; L443-F447 WeakPolarHBondContact O-CB 3.23Å; L443-F447 WeakPolarHBondContact O-CD2 3.03Å; L443-F447 WeakPolarHBondContact O-CG 3.42Å; L443-F447 PolarHBondContact O-N 3.15Å; S444-F447 CarbonylContact O-C 3.49Å; S444-F447 PolarHBondContact O-N 2.95Å; D445-F447 VanDerWaalsContact C-N 3.33Å; F447-T450 VanDerWaalsContact C-OG1 3.26Å; F447-T450 WeakPolarHBondContact CA-OG1 3.49Å; F447-T450 PolarHBondContact O-OG1 2.91Å; F447-S451 PolarHBondContact O-OG 3.35Å; F447-H468 HydrophobicContact CD1-CB 3.46Å; F447-H468 VanDerWaalsContact CD1-CB 3.46Å; F447-H468 AromaticContact CD1-CG 3.85Å; F447-H468 HydrophobicContact CE1-CB 3.28Å; F447-H468 AromaticContact CE1-CG 3.37Å; F447-H468 AromaticContact CE1-ND1 3.42Å; F447-H468 WeakPolarHBondContact CE1-ND1 3.22Å; F447-H468 HydrophobicContact CZ-CB 4.3Å; F447-E472 HydrophobicContact CD2-CB 3.86Å; F447-E472 VanDerWaalsContact CD2-CD 3.48Å; F447-E472 HydrophobicContact CD2-CG 3.66Å; F447-E472 HydrophobicContact CE2-CB 3.73Å; F447-E472 HydrophobicContact CE2-CG 3.79Å; F447-E472 HydrophobicContact CZ-CB 4.46Å
448	Q	38.3	Very low	37.5	Very low	113 Å²	113	69.2 Å²	69.2	53%	0.528	43%	0.429	S	S	.	.	H	α-helix	trans	-90.1	-43.5	179.1	-75.5	179.7	19.4	0	0	112.8	S444 D445 T450 S451 S452	S444-Q448 WeakPolarHBondContact O-CA 3.32Å; S444-Q448 WeakPolarHBondContact O-CB 3.44Å; S444-Q448 WeakPolarHBondContact O-CG 3.13Å; S444-Q448 PolarHBondContact O-N 3.14Å; S444-Q448 VanDerWaalsContact OG-CD 3.28Å; S444-Q448 PolarHBondContact OG-NE2 3.21Å; D445-Q448 PolarHBondContact O-N 3.41Å; Q448-T450 PolarHBondContact O-N 3.06Å; Q448-S451 CarbonylContact O-C 3.59Å; Q448-S451 VanDerWaalsContact O-CA 3.31Å; Q448-S451 WeakPolarHBondContact O-CA 3.43Å; Q448-S451 WeakPolarHBondContact O-CB 3.27Å; Q448-S451 PolarHBondContact O-N 3.46Å; Q448-S452 PolarHBondContact O-N 3.29Å; Q448-S452 PolarHBondContact O-OG 3.28Å
449	T	39.5	Very low	37.3	Very low	65 Å²	65	71 Å²	71	40%	0.399	44%	0.441	S	S	.	.	H	α-helix	trans	-64.4	-31.8	174.9	50	0	0	0	0	111.7	D445 S451 S452 S453	D445-T449 WeakPolarHBondContact O-CA 3.49Å; D445-T449 VanDerWaalsContact O-CB 3.24Å; D445-T449 WeakPolarHBondContact O-CB 3.46Å; D445-T449 WeakPolarHBondContact O-CG2 2.97Å; D445-T449 PolarHBondContact O-N 3.26Å; D445-T449 PolarHBondContact O-OG1 3.48Å; T449-S451 PolarHBondContact O-N 2.64Å; T449-S452 PolarHBondContact O-N 3.22Å; T449-S453 VanDerWaalsContact O-CB 3.32Å; T449-S453 WeakPolarHBondContact O-CB 3.21Å; T449-S453 PolarHBondContact O-N 3.44Å; T449-S453 VanDerWaalsContact O-N 3.09Å; T449-S453 PolarHBondContact O-OG 2.97Å
450	T	37.5	Very low	37.3	Very low	38 Å²	38	74.1 Å²	74.1	23%	0.233	45%	0.445	C	S	.	.	H	α-helix	trans	-66.1	-24.5	168	48.2	0	0	0	0	112.9	I446 F447 Q448	I446-T450 WeakPolarHBondContact O-CB 3.34Å; I446-T450 WeakPolarHBondContact O-CG2 3.06Å; I446-T450 PolarHBondContact O-N 3.4Å; I446-T450 PolarHBondContact O-OG1 2.82Å; F447-T450 VanDerWaalsContact C-OG1 3.26Å; F447-T450 WeakPolarHBondContact CA-OG1 3.49Å; F447-T450 PolarHBondContact O-OG1 2.91Å; Q448-T450 PolarHBondContact O-N 3.06Å
451	S	34.9	Very low	37.3	Very low	63 Å²	63	69.2 Å²	69.2	44%	0.441	42%	0.422	S	S	.	.	H	α-helix	trans	-91.2	-25.6	176.9	-60.5	0	0	0	0	113.7	F447 Q448 T449 R469	F447-S451 PolarHBondContact O-OG 3.35Å; Q448-S451 CarbonylContact O-C 3.59Å; Q448-S451 VanDerWaalsContact O-CA 3.31Å; Q448-S451 WeakPolarHBondContact O-CA 3.43Å; Q448-S451 WeakPolarHBondContact O-CB 3.27Å; Q448-S451 PolarHBondContact O-N 3.46Å; T449-S451 PolarHBondContact O-N 2.64Å; S451-R469 PolarHBondContact OG-NH2 3.42Å
452	S	32.4	Very low	37.9	Very low	89 Å²	89	65.5 Å²	65.5	62%	0.622	41%	0.405	S	S	*	.	H	α-helix	trans	-104.5	-24.1	-172.5	63.7	0	0	0	0	115.2	Q448 T449 F454	Q448-S452 PolarHBondContact O-N 3.29Å; Q448-S452 PolarHBondContact O-OG 3.28Å; T449-S452 PolarHBondContact O-N 3.22Å; S452-F454 VanDerWaalsContact C-N 3.27Å; S452-F454 PolarHBondContact O-N 2.99Å
453	S	34.8	Very low	38.3	Very low	80 Å²	80	64 Å²	64	56%	0.559	40%	0.4	S	S	*	.	S	Bend	trans	-82	-2.3	-174.7	-54.4	0	0	0	0	114.4	T449	T449-S453 VanDerWaalsContact O-CB 3.32Å; T449-S453 WeakPolarHBondContact O-CB 3.21Å; T449-S453 PolarHBondContact O-N 3.44Å; T449-S453 VanDerWaalsContact O-N 3.09Å; T449-S453 PolarHBondContact O-OG 2.97Å
454	F	34.1	Very low	38.8	Very low	96 Å²	96	63.3 Å²	63.3	42%	0.421	40%	0.396	S	S	.	.	S	Bend	trans	-119.4	101.1	179.7	-62.8	-79.6	0	0	0	108.4	S452	S452-F454 VanDerWaalsContact C-N 3.27Å; S452-F454 PolarHBondContact O-N 2.99Å
455	G	31.6	Very low	39	Very low	57 Å²	57	64.6 Å²	64.6	59%	0.588	40%	0.397	S	S	*	.			trans	-56.2	171.3	169.3	0	0	0	0	0	111	I457	G455-I457 PolarHBondContact O-N 3.17Å
456	S	33.5	Very low	39.3	Very low	132 Å²	132	64.7 Å²	64.7	92%	0.923	40%	0.402	S	S	*	.	S	Bend	trans	-65.9	57.2	-170	75.9	0	0	0	0	115.1
457	I	35.4	Very low	40	Very low	135 Å²	135	66 Å²	66	69%	0.692	41%	0.409	S	S	*	.			trans	-87.4	107.4	166.8	-59.1	175.3	0	0	0	104.1	G455	G455-I457 PolarHBondContact O-N 3.17Å
458	G	34.4	Very low	40.7	Very low	64 Å²	64	66.7 Å²	66.7	66%	0.66	41%	0.412	S	S	*	.	S	Bend	trans	-55.8	160.2	-177	0	0	0	0	0	112.7
459	S	40	Very low	41.2	Very low	52 Å²	52	69.7 Å²	69.7	36%	0.364	42%	0.418	S	S	.	.			trans	79.5	22.7	161.4	-154.6	0	0	0	0	117.8	Y183 A461	Y183-S459 WeakPolarHBondContact CA-OG 3.44Å; Y183-S459 WeakPolarHBondContact CD1-OG 3.35Å; Y183-S459 WeakPolarHBondContact CE1-OG 3.37Å; Y183-S459 VanDerWaalsContact CG-OG 3.24Å; S459-A461 PolarHBondContact O-N 2.89Å
460	E	43.5	Very low	41.8	Very low	105 Å²	105	75.4 Å²	75.4	49%	0.491	43%	0.433	S	S	.	.			trans	-77.4	28.7	169	-68	-166.2	166.4	0	0	114.3	F462	E460-F462 PolarHBondContact O-N 2.93Å
461	A	42.1	Very low	42.9	Very low	30 Å²	30	74 Å²	74	25%	0.248	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-8.3	-175.6	0	0	0	0	0	114.5	S459	S459-A461 PolarHBondContact O-N 2.89Å
462	F	50.4	Low	44	Very low	37 Å²	37	75.1 Å²	75.1	16%	0.162	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.5	20.3	-168.7	-85.3	-86.7	0	0	0	116.7	L90 F92 D189 L193 R289 E460 F464	L90-F462 HydrophobicContact CD1-CZ 4.42Å; F92-F462 AromaticContact CD2-CE2 3.93Å; F92-F462 HydrophobicContact CD2-CE2 3.93Å; F92-F462 HydrophobicContact CE1-CD2 4.3Å; F92-F462 HydrophobicContact CE1-CE2 4.2Å; F92-F462 AromaticContact CE2-CD2 3.81Å; F92-F462 HydrophobicContact CE2-CD2 3.81Å; F92-F462 AromaticContact CE2-CE2 2.94Å; F92-F462 HydrophobicContact CE2-CE2 2.94Å; F92-F462 AromaticContact CE2-CZ 3.51Å; F92-F462 HydrophobicContact CE2-CZ 3.51Å; F92-F462 AromaticContact CZ-CD2 3.45Å; F92-F462 HydrophobicContact CZ-CD2 3.45Å; F92-F462 VanDerWaalsContact CZ-CD2 3.45Å; F92-F462 AromaticContact CZ-CE2 3.1Å; F92-F462 HydrophobicContact CZ-CE2 3.1Å; F92-F462 AromaticContact CZ-CZ 3.9Å; F92-F462 HydrophobicContact CZ-CZ 3.9Å; D189-F462 HydrophobicContact CB-CD1 4.34Å; L193-F462 HydrophobicContact CD1-CE1 3.57Å; L193-F462 HydrophobicContact CD1-CZ 3.63Å; L193-F462 HydrophobicContact CD2-CE1 3.6Å; L193-F462 HydrophobicContact CD2-CZ 3.89Å; L193-F462 HydrophobicContact CG-CE1 3.69Å; L193-F462 HydrophobicContact CG-CZ 4.13Å; R289-F462 PolarHBondContact NH2-O 3.33Å; R289-F462 VanDerWaalsContact NH2-O 3.12Å; E460-F462 PolarHBondContact O-N 2.93Å; F462-F464 PolarHBondContact O-N 2.95Å
463	S	49	Very low	45.5	Very low	27 Å²	27	74.1 Å²	74.1	19%	0.189	42%	0.415	C	S	.	.			trans	-68.1	128.5	159	-176	0	0	0	0	108.3	D293 R465 C466	D293-S463 PolarHBondContact OD1-OG 3.43Å; S463-R465 PolarHBondContact O-N 3.29Å; S463-R465 WeakPolarHBondContact OG-CB 3.41Å; S463-R465 WeakPolarHBondContact OG-CG 3.49Å; S463-R465 PolarHBondContact OG-N 2.67Å; S463-C466 PolarHBondContact O-N 2.83Å
464	F	49.3	Very low	47.1	Very low	21 Å²	21	72.1 Å²	72.1	9%	0.092	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-54.8	-14.3	172.7	-100.5	-90.8	0	0	0	112.8	L192 D293 M395 V398 F462 C466 M467 Y551	L192-F464 HydrophobicContact CD1-CE1 4.43Å; L192-F464 HydrophobicContact CD1-CZ 3.79Å; L192-F464 HydrophobicContact CD2-CE1 3.58Å; L192-F464 HydrophobicContact CD2-CE2 3.51Å; L192-F464 HydrophobicContact CD2-CZ 2.99Å; L192-F464 HydrophobicContact CG-CZ 3.96Å; D293-F464 HydrophobicContact CB-CB 4.34Å; D293-F464 HydrophobicContact CB-CD2 4.37Å; D293-F464 PolarHBondContact OD1-N 2.94Å; M395-F464 HydrophobicContact SD-CE1 4.36Å; M395-F464 HydrophobicContact SD-CZ 4.47Å; V398-F464 HydrophobicContact CB-CE1 4.34Å; V398-F464 HydrophobicContact CG1-CE1 3.78Å; V398-F464 HydrophobicContact CG1-CZ 4.31Å; V398-F464 HydrophobicContact CG2-CD1 4.03Å; V398-F464 HydrophobicContact CG2-CE1 3.57Å; F462-F464 PolarHBondContact O-N 2.95Å; F464-C466 PolarHBondContact O-N 3.37Å; F464-C466 VanDerWaalsContact O-N 3.11Å; F464-M467 PolarHBondContact O-N 3.13Å; F464-M467 VanDerWaalsContact O-N 3.1Å; F464-Y551 HydrophobicContact CD2-CD1 4.44Å; F464-Y551 HydrophobicContact CD2-CE1 4.07Å; F464-Y551 HydrophobicContact CE1-CE1 4.38Å; F464-Y551 AromaticContact CE2-CD1 3.89Å; F464-Y551 HydrophobicContact CE2-CD1 3.89Å; F464-Y551 AromaticContact CE2-CE1 3.9Å; F464-Y551 HydrophobicContact CE2-CE1 3.9Å; F464-Y551 HydrophobicContact CG-CE1 4.33Å; F464-Y551 HydrophobicContact CZ-CD1 4.05Å; F464-Y551 AromaticContact CZ-CE1 3.99Å; F464-Y551 HydrophobicContact CZ-CE1 3.99Å
465	R	44.5	Very low	48.7	Very low	53 Å²	53	67.8 Å²	67.8	20%	0.2	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-50.9	-25.2	167.8	-72.4	-176.1	171.9	-161.2	-5.9	112.9	S463 M467 H468	S463-R465 PolarHBondContact O-N 3.29Å; S463-R465 WeakPolarHBondContact OG-CB 3.41Å; S463-R465 WeakPolarHBondContact OG-CG 3.49Å; S463-R465 PolarHBondContact OG-N 2.67Å; R465-M467 PolarHBondContact O-N 3.43Å; R465-M467 VanDerWaalsContact O-N 3.11Å; R465-H468 WeakPolarHBondContact O-CB 3.39Å; R465-H468 PolarHBondContact O-CD2 3.25Å; R465-H468 PolarHBondContact O-N 2.95Å
466	C	43.8	Very low	50.5	Low	76 Å²	76	68.9 Å²	68.9	51%	0.514	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-59	-22.3	175.3	-76.1	0	0	0	0	114.5	S463 F464 H468 R469	S463-C466 PolarHBondContact O-N 2.83Å; F464-C466 PolarHBondContact O-N 3.37Å; F464-C466 VanDerWaalsContact O-N 3.11Å; C466-H468 PolarHBondContact O-N 2.92Å; C466-H468 VanDerWaalsContact O-N 3.15Å; C466-R469 PolarHBondContact O-N 3.4Å
467	M	53	Low	52.4	Low	43 Å²	43	70.2 Å²	70.2	21%	0.212	37%	0.37	C	S	.	.	H	α-helix	trans	-54.5	-32.4	171.9	-81.9	-126.5	-62.9	0	0	112.3	K394 I397 V398 F464 R465 R469 R470 F471	K394-M467 HydrophobicContact CB-CE 4.45Å; K394-M467 HydrophobicContact CG-CE 3.47Å; K394-M467 VanDerWaalsContact CG-CE 3.47Å; K394-M467 WeakPolarHBondContact O-CE 3.39Å; I397-M467 HydrophobicContact CB-CE 4.33Å; I397-M467 HydrophobicContact CG2-CE 4.3Å; I397-M467 HydrophobicContact CG2-SD 4.09Å; V398-M467 HydrophobicContact CG2-CE 3.37Å; V398-M467 HydrophobicContact CG2-CG 4.38Å; V398-M467 HydrophobicContact CG2-SD 3.45Å; V398-M467 WeakPolarHBondContact CG2-SD 3.24Å; F464-M467 PolarHBondContact O-N 3.13Å; F464-M467 VanDerWaalsContact O-N 3.1Å; R465-M467 PolarHBondContact O-N 3.43Å; R465-M467 VanDerWaalsContact O-N 3.11Å; M467-R469 VanDerWaalsContact C-N 3.32Å; M467-R469 PolarHBondContact O-N 3.46Å; M467-R470 PolarHBondContact O-N 3.43Å; M467-F471 WeakPolarHBondContact O-CB 3.41Å; M467-F471 PolarHBondContact O-N 3.31Å; M467-F471 VanDerWaalsContact O-N 3.16Å
468	H	51.7	Low	54.2	Low	24 Å²	24	66.2 Å²	66.2	11%	0.111	35%	0.348	C	S	.	.	H	α-helix	trans	-59.8	-35.7	-176.5	-76.2	-40.2	0	0	0	114.2	F447 R465 C466 F471 E472	F447-H468 HydrophobicContact CD1-CB 3.46Å; F447-H468 VanDerWaalsContact CD1-CB 3.46Å; F447-H468 AromaticContact CD1-CG 3.85Å; F447-H468 HydrophobicContact CE1-CB 3.28Å; F447-H468 AromaticContact CE1-CG 3.37Å; F447-H468 AromaticContact CE1-ND1 3.42Å; F447-H468 WeakPolarHBondContact CE1-ND1 3.22Å; F447-H468 HydrophobicContact CZ-CB 4.3Å; R465-H468 WeakPolarHBondContact O-CB 3.39Å; R465-H468 PolarHBondContact O-CD2 3.25Å; R465-H468 PolarHBondContact O-N 2.95Å; C466-H468 PolarHBondContact O-N 2.92Å; C466-H468 VanDerWaalsContact O-N 3.15Å; H468-F471 WeakPolarHBondContact O-CB 3.28Å; H468-F471 PolarHBondContact O-N 3.44Å; H468-E472 PolarHBondContact O-N 2.88Å
469	R	50.1	Low	55.9	Low	177 Å²	177	66.4 Å²	66.4	67%	0.668	34%	0.34	S	S	*	.	H	α-helix	trans	-68.8	-41.6	-178.2	-72.9	-171.6	179.7	179.8	1	113.3	S451 C466 M467 F471	S451-R469 PolarHBondContact OG-NH2 3.42Å; C466-R469 PolarHBondContact O-N 3.4Å; M467-R469 VanDerWaalsContact C-N 3.32Å; M467-R469 PolarHBondContact O-N 3.46Å; R469-F471 PolarHBondContact O-N 3.3Å
470	R	51.8	Low	57.5	Low	184 Å²	184	69.2 Å²	69.2	69%	0.694	36%	0.359	S	S	*	.	H	α-helix	trans	-66.4	-35.8	173.8	-73.8	-174.1	179.9	173.1	1.3	110.4	M467 S473 F474	M467-R470 PolarHBondContact O-N 3.43Å; R470-S473 PolarHBondContact O-OG 3.46Å; R470-F474 PolarHBondContact O-N 2.85Å
471	F	60.5	Low	59	Low	10 Å²	10	71.3 Å²	71.3	4%	0.044	37%	0.369	C	S	.	.	H	α-helix	trans	-67.5	-39.7	-178.4	-160.1	-106.3	0	0	0	113.6	I397 V403 L407 M467 H468 R469 S473 F474 L475 F490	I397-F471 HydrophobicContact CD1-CE2 3.82Å; V403-F471 HydrophobicContact CB-CE2 4.09Å; V403-F471 HydrophobicContact CG1-CD2 4.24Å; V403-F471 HydrophobicContact CG1-CE2 3.31Å; V403-F471 HydrophobicContact CG1-CZ 3.77Å; V403-F471 HydrophobicContact CG2-CD2 3.88Å; V403-F471 HydrophobicContact CG2-CE2 3.59Å; L407-F471 HydrophobicContact CD1-CZ 3.93Å; M467-F471 WeakPolarHBondContact O-CB 3.41Å; M467-F471 PolarHBondContact O-N 3.31Å; M467-F471 VanDerWaalsContact O-N 3.16Å; H468-F471 WeakPolarHBondContact O-CB 3.28Å; H468-F471 PolarHBondContact O-N 3.44Å; R469-F471 PolarHBondContact O-N 3.3Å; F471-S473 PolarHBondContact O-N 2.95Å; F471-F474 WeakPolarHBondContact O-CB 3.41Å; F471-F474 PolarHBondContact O-N 3.23Å; F471-F474 VanDerWaalsContact O-N 3.08Å; F471-L475 HydrophobicContact CD1-CD1 3.47Å; F471-L475 VanDerWaalsContact CD1-CD1 3.47Å; F471-L475 HydrophobicContact CD1-CD2 4.3Å; F471-L475 HydrophobicContact CD1-CG 3.62Å; F471-L475 HydrophobicContact CE1-CD1 3.34Å; F471-L475 HydrophobicContact CE1-CD2 3.63Å; F471-L475 HydrophobicContact CE1-CG 3.45Å; F471-L475 VanDerWaalsContact CE1-CG 3.45Å; F471-L475 HydrophobicContact CG-CG 4.41Å; F471-L475 HydrophobicContact CZ-CD1 4.4Å; F471-L475 HydrophobicContact CZ-CD2 3.88Å; F471-L475 HydrophobicContact CZ-CG 4.11Å; F471-L475 WeakPolarHBondContact O-CG 3.49Å; F471-L475 PolarHBondContact O-N 3.39Å; F471-F490 HydrophobicContact CD1-CD1 4.05Å; F471-F490 AromaticContact CD1-CE1 3.7Å; F471-F490 HydrophobicContact CD1-CE1 3.7Å; F471-F490 HydrophobicContact CD2-CE1 4.06Å; F471-F490 HydrophobicContact CD2-CZ 4.46Å; F471-F490 AromaticContact CE1-CD1 3.18Å; F471-F490 HydrophobicContact CE1-CD1 3.18Å; F471-F490 AromaticContact CE1-CE1 3.2Å; F471-F490 HydrophobicContact CE1-CE1 3.2Å; F471-F490 HydrophobicContact CE1-CG 4.27Å; F471-F490 HydrophobicContact CE1-CZ 4.29Å; F471-F490 HydrophobicContact CE2-CD1 4.16Å; F471-F490 AromaticContact CE2-CE1 3.61Å; F471-F490 HydrophobicContact CE2-CE1 3.61Å; F471-F490 AromaticContact CE2-CZ 3.95Å; F471-F490 HydrophobicContact CE2-CZ 3.95Å; F471-F490 HydrophobicContact CG-CE1 4.08Å; F471-F490 AromaticContact CZ-CD1 3.26Å; F471-F490 HydrophobicContact CZ-CD1 3.26Å; F471-F490 AromaticContact CZ-CE1 3.15Å; F471-F490 HydrophobicContact CZ-CE1 3.15Å; F471-F490 HydrophobicContact CZ-CG 4.03Å; F471-F490 AromaticContact CZ-CZ 3.86Å; F471-F490 HydrophobicContact CZ-CZ 3.86Å
472	E	58.7	Low	60.7	Low	86 Å²	86	70.7 Å²	70.7	40%	0.402	36%	0.361	S	S	.	.	H	α-helix	trans	-58.1	-48.4	179	-171.9	179.2	-171.3	0	0	111.8	F447 H468 F474 L475 A476	F447-E472 HydrophobicContact CD2-CB 3.86Å; F447-E472 VanDerWaalsContact CD2-CD 3.48Å; F447-E472 HydrophobicContact CD2-CG 3.66Å; F447-E472 HydrophobicContact CE2-CB 3.73Å; F447-E472 HydrophobicContact CE2-CG 3.79Å; F447-E472 HydrophobicContact CZ-CB 4.46Å; H468-E472 PolarHBondContact O-N 2.88Å; E472-F474 PolarHBondContact O-N 3.07Å; E472-L475 PolarHBondContact O-N 3.22Å; E472-A476 WeakPolarHBondContact O-CB 3.21Å; E472-A476 PolarHBondContact O-N 2.94Å
473	S	63.5	Low	61.9	Low	68 Å²	68	71.5 Å²	71.5	48%	0.476	37%	0.367	S	S	.	.	H	α-helix	trans	-62.5	-30.1	177.4	76.2	0	0	0	0	113.1	R470 F471 K477	R470-S473 PolarHBondContact O-OG 3.46Å; F471-S473 PolarHBondContact O-N 2.95Å; S473-K477 WeakPolarHBondContact O-CG 3.31Å
474	F	67.3	Low	63.1	Low	37 Å²	37	79.4 Å²	79.4	16%	0.162	39%	0.393	C	S	.	.	H	α-helix	trans	-77.2	-48.8	179.8	174.7	-83.7	0	0	0	110.9	V403 E404 R470 F471 E472 A476 K477 H478 L482	V403-F474 HydrophobicContact CB-CD1 3.74Å; V403-F474 HydrophobicContact CB-CE1 3.36Å; V403-F474 HydrophobicContact CB-CE2 4.4Å; V403-F474 HydrophobicContact CB-CG 4.46Å; V403-F474 HydrophobicContact CB-CZ 3.75Å; V403-F474 HydrophobicContact CG1-CD1 3.54Å; V403-F474 HydrophobicContact CG1-CE1 3.21Å; V403-F474 HydrophobicContact CG1-CZ 4.08Å; V403-F474 HydrophobicContact CG2-CD1 4.01Å; V403-F474 HydrophobicContact CG2-CE1 4.13Å; V403-F474 HydrophobicContact CG2-CG 4.38Å; E404-F474 HydrophobicContact CG-CZ 3.84Å; E404-F474 WeakPolarHBondContact OE1-CE2 3.39Å; E404-F474 WeakPolarHBondContact OE1-CZ 3.42Å; R470-F474 PolarHBondContact O-N 2.85Å; F471-F474 WeakPolarHBondContact O-CB 3.41Å; F471-F474 PolarHBondContact O-N 3.23Å; F471-F474 VanDerWaalsContact O-N 3.08Å; E472-F474 PolarHBondContact O-N 3.07Å; F474-A476 VanDerWaalsContact C-N 3.29Å; F474-A476 PolarHBondContact O-N 3.12Å; F474-K477 PolarHBondContact O-N 2.68Å; F474-H478 AromaticContact CD2-CE1 3.98Å; F474-H478 AromaticContact CD2-ND1 3.61Å; F474-H478 HydrophobicContact CE1-CB 4.04Å; F474-H478 AromaticContact CE2-CE1 3.58Å; F474-H478 AromaticContact CE2-CG 3.97Å; F474-H478 AromaticContact CE2-ND1 3.24Å; F474-H478 WeakPolarHBondContact CE2-ND1 3.42Å; F474-H478 HydrophobicContact CZ-CB 3.89Å; F474-H478 AromaticContact CZ-CG 3.72Å; F474-H478 AromaticContact CZ-ND1 3.42Å; F474-H478 WeakPolarHBondContact CZ-ND1 3.31Å; F474-H478 PolarHBondContact O-N 3.05Å; F474-H478 VanDerWaalsContact O-N 3.08Å; F474-H478 PolarHBondContact O-ND1 3.22Å; F474-L482 HydrophobicContact CE1-CD1 4.19Å
475	L	68.7	Low	64.3	Low	5 Å²	5	82 Å²	82	3%	0.026	41%	0.408	C	S	.	.	H	α-helix	trans	-58.2	-42.5	176.9	-76	-177.5	0	0	0	111.2	L407 L443 F471 E472 K477 H478 S479 L482 V487	L407-L475 HydrophobicContact CD1-CD2 4.27Å; L443-L475 HydrophobicContact CD1-CD1 4.1Å; L443-L475 HydrophobicContact CD2-CD1 4Å; F471-L475 HydrophobicContact CD1-CD1 3.47Å; F471-L475 VanDerWaalsContact CD1-CD1 3.47Å; F471-L475 HydrophobicContact CD1-CD2 4.3Å; F471-L475 HydrophobicContact CD1-CG 3.62Å; F471-L475 HydrophobicContact CE1-CD1 3.34Å; F471-L475 HydrophobicContact CE1-CD2 3.63Å; F471-L475 HydrophobicContact CE1-CG 3.45Å; F471-L475 VanDerWaalsContact CE1-CG 3.45Å; F471-L475 HydrophobicContact CG-CG 4.41Å; F471-L475 HydrophobicContact CZ-CD1 4.4Å; F471-L475 HydrophobicContact CZ-CD2 3.88Å; F471-L475 HydrophobicContact CZ-CG 4.11Å; F471-L475 WeakPolarHBondContact O-CG 3.49Å; F471-L475 PolarHBondContact O-N 3.39Å; E472-L475 PolarHBondContact O-N 3.22Å; L475-K477 PolarHBondContact O-N 2.86Å; L475-K477 VanDerWaalsContact O-N 3.16Å; L475-H478 PolarHBondContact O-N 3.27Å; L475-S479 WeakPolarHBondContact O-CA 3.44Å; L475-S479 WeakPolarHBondContact O-CB 3.36Å; L475-S479 PolarHBondContact O-N 2.75Å; L475-L482 HydrophobicContact CD2-CD1 3.79Å; L475-V487 HydrophobicContact CD1-CG1 4.35Å; L475-V487 HydrophobicContact CD2-CG1 4.07Å; L475-V487 HydrophobicContact CD2-CG2 4.25Å
476	A	69.2	Low	65.6	Low	81 Å²	81	79.4 Å²	79.4	67%	0.669	40%	0.398	S	S	*	.	H	α-helix	trans	-58.4	-29.3	177.6	0	0	0	0	0	113	E472 F474	E472-A476 WeakPolarHBondContact O-CB 3.21Å; E472-A476 PolarHBondContact O-N 2.94Å; F474-A476 VanDerWaalsContact C-N 3.29Å; F474-A476 PolarHBondContact O-N 3.12Å
477	K	73.5	Confident	67	Low	160 Å²	160	76.9 Å²	76.9	70%	0.696	38%	0.38	S	S	*	.	H	α-helix	trans	-88.6	-31.8	-179.3	-71.1	176.1	-177.5	177.6	0	113.8	S473 F474 L475	S473-K477 WeakPolarHBondContact O-CG 3.31Å; F474-K477 PolarHBondContact O-N 2.68Å; L475-K477 PolarHBondContact O-N 2.86Å; L475-K477 VanDerWaalsContact O-N 3.16Å
478	H	73.4	Confident	68	Low	50 Å²	50	77 Å²	77	23%	0.231	39%	0.388	C	S	.	.	H	α-helix	trans	-118.5	1.8	-169.6	-57.7	96.1	0	0	0	114.5	F474 L475 S480 Q481 L482	F474-H478 AromaticContact CD2-CE1 3.98Å; F474-H478 AromaticContact CD2-ND1 3.61Å; F474-H478 HydrophobicContact CE1-CB 4.04Å; F474-H478 AromaticContact CE2-CE1 3.58Å; F474-H478 AromaticContact CE2-CG 3.97Å; F474-H478 AromaticContact CE2-ND1 3.24Å; F474-H478 WeakPolarHBondContact CE2-ND1 3.42Å; F474-H478 HydrophobicContact CZ-CB 3.89Å; F474-H478 AromaticContact CZ-CG 3.72Å; F474-H478 AromaticContact CZ-ND1 3.42Å; F474-H478 WeakPolarHBondContact CZ-ND1 3.31Å; F474-H478 PolarHBondContact O-N 3.05Å; F474-H478 VanDerWaalsContact O-N 3.08Å; F474-H478 PolarHBondContact O-ND1 3.22Å; L475-H478 PolarHBondContact O-N 3.27Å; H478-S480 PolarHBondContact O-N 3.22Å; H478-Q481 PolarHBondContact O-N 3.22Å; H478-L482 HydrophobicContact CB-CD1 4.47Å; H478-L482 WeakPolarHBondContact O-CG 3.48Å
479	S	70.7	Confident	69.2	Low	69 Å²	69	75.9 Å²	75.9	48%	0.483	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-50.5	-31.7	-175.3	56.5	0	0	0	0	115	L475 Q481	L475-S479 WeakPolarHBondContact O-CA 3.44Å; L475-S479 WeakPolarHBondContact O-CB 3.36Å; L475-S479 PolarHBondContact O-N 2.75Å; S479-Q481 VanDerWaalsContact C-N 3.28Å; S479-Q481 PolarHBondContact O-N 2.94Å
480	S	73.5	Confident	70.5	Confident	110 Å²	110	67.7 Å²	67.7	77%	0.769	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-72.2	-17.7	179.8	64	0	0	0	0	114.5	H478	H478-S480 PolarHBondContact O-N 3.22Å
481	Q	75.4	Confident	71.7	Confident	149 Å²	149	59.2 Å²	59.2	70%	0.696	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-99.2	-13.5	-178.9	-61.2	179.7	9.6	0	0	112.7	H478 S479	H478-Q481 PolarHBondContact O-N 3.22Å; S479-Q481 VanDerWaalsContact C-N 3.28Å; S479-Q481 PolarHBondContact O-N 2.94Å
482	L	76.3	Confident	72.5	Confident	17 Å²	17	59.5 Å²	59.5	9%	0.089	32%	0.322	C	S	.	.	S	Bend	trans	-92.7	151.4	-174.4	-57.3	173.2	0	0	0	110.7	E404 L407 F474 L475 H478 R484 V487	E404-L482 HydrophobicContact CG-CD2 4.46Å; L407-L482 HydrophobicContact CB-CD2 4.2Å; L407-L482 HydrophobicContact CD1-CD1 4Å; F474-L482 HydrophobicContact CE1-CD1 4.19Å; L475-L482 HydrophobicContact CD2-CD1 3.79Å; H478-L482 HydrophobicContact CB-CD1 4.47Å; H478-L482 WeakPolarHBondContact O-CG 3.48Å; L482-R484 PolarHBondContact O-N 3.43Å; L482-V487 HydrophobicContact CB-CG2 3.71Å; L482-V487 HydrophobicContact CD1-CG2 4.05Å
483	D	76.5	Confident	73.7	Confident	55 Å²	55	57.3 Å²	57.3	29%	0.294	31%	0.313	S	S	.	.			trans	-66.1	118.4	171.5	177.8	64.9	0	0	0	109.7	P409 D485 S486 V487	P409-D483 HydrophobicContact CG-CB 4.44Å; D483-D485 VanDerWaalsContact C-N 3.26Å; D483-D485 PolarHBondContact O-N 3.47Å; D483-D485 WeakPolarHBondContact OD2-CB 3.48Å; D483-S486 WeakPolarHBondContact CB-OG 3.49Å; D483-S486 WeakPolarHBondContact O-CB 3.19Å; D483-S486 PolarHBondContact O-N 3.38Å; D483-S486 VanDerWaalsContact OD2-CB 3.31Å; D483-S486 WeakPolarHBondContact OD2-CB 3.5Å; D483-S486 PolarHBondContact OD2-N 3.18Å; D483-S486 PolarHBondContact OD2-OG 3.09Å; D483-V487 WeakPolarHBondContact O-CG2 3.18Å; D483-V487 PolarHBondContact O-N 2.69Å
484	R	73.8	Confident	74.7	Confident	193 Å²	193	54.1 Å²	54.1	73%	0.728	29%	0.291	S	S	*	.	H	α-helix	trans	-60.6	-39.6	-173	-72.8	-174	178.1	-172.4	-1.2	112.1	L482 V487 A488	L482-R484 PolarHBondContact O-N 3.43Å; R484-V487 PolarHBondContact O-N 2.93Å; R484-A488 WeakPolarHBondContact O-CB 3.43Å; R484-A488 PolarHBondContact O-N 3.33Å
485	D	73.6	Confident	75.6	Confident	74 Å²	74	53.9 Å²	53.9	40%	0.396	30%	0.296	S	S	.	.	H	α-helix	trans	-62.2	-53	178.8	-76.6	1.1	0	0	0	109.2	Y427 D483 V487 A488 L489	Y427-D485 HydrophobicContact CD2-CB 4.02Å; Y427-D485 WeakPolarHBondContact CD2-OD2 3.07Å; Y427-D485 HydrophobicContact CE1-CB 4.04Å; Y427-D485 HydrophobicContact CE2-CB 3.37Å; Y427-D485 VanDerWaalsContact CZ-CB 3.44Å; Y427-D485 PolarHBondContact OH-O 3.49Å; D483-D485 VanDerWaalsContact C-N 3.26Å; D483-D485 PolarHBondContact O-N 3.47Å; D483-D485 WeakPolarHBondContact OD2-CB 3.48Å; D485-V487 VanDerWaalsContact C-N 3.3Å; D485-V487 PolarHBondContact O-N 2.9Å; D485-A488 WeakPolarHBondContact O-CB 3.4Å; D485-A488 PolarHBondContact O-N 3.06Å; D485-L489 PolarHBondContact O-N 3.31Å
486	S	73.4	Confident	76.4	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-52.8	-44.4	174.5	-57.8	0	0	0	0	113.3	F412 D483 F490	F412-S486 VanDerWaalsContact CD2-OG 3.31Å; F412-S486 WeakPolarHBondContact CD2-OG 3.21Å; F412-S486 VanDerWaalsContact CE2-CB 3.49Å; F412-S486 WeakPolarHBondContact CE2-OG 3.08Å; F412-S486 WeakPolarHBondContact CZ-OG 3.06Å; D483-S486 WeakPolarHBondContact CB-OG 3.49Å; D483-S486 WeakPolarHBondContact O-CB 3.19Å; D483-S486 PolarHBondContact O-N 3.38Å; D483-S486 VanDerWaalsContact OD2-CB 3.31Å; D483-S486 WeakPolarHBondContact OD2-CB 3.5Å; D483-S486 PolarHBondContact OD2-N 3.18Å; D483-S486 PolarHBondContact OD2-OG 3.09Å; S486-F490 VanDerWaalsContact O-CB 3.24Å; S486-F490 WeakPolarHBondContact O-CB 3.35Å; S486-F490 PolarHBondContact O-N 3.42Å
487	V	72.8	Confident	77.2	Confident	23 Å²	23	53.1 Å²	53.1	14%	0.139	29%	0.285	C	S	.	.	H	α-helix	trans	-62.4	-45.7	176.3	174.7	0	0	0	0	110.8	L407 L475 L482 D483 R484 D485 F490 C491	L407-V487 HydrophobicContact CD1-CG2 3.82Å; L475-V487 HydrophobicContact CD1-CG1 4.35Å; L475-V487 HydrophobicContact CD2-CG1 4.07Å; L475-V487 HydrophobicContact CD2-CG2 4.25Å; L482-V487 HydrophobicContact CB-CG2 3.71Å; L482-V487 HydrophobicContact CD1-CG2 4.05Å; D483-V487 WeakPolarHBondContact O-CG2 3.18Å; D483-V487 PolarHBondContact O-N 2.69Å; R484-V487 PolarHBondContact O-N 2.93Å; D485-V487 VanDerWaalsContact C-N 3.3Å; D485-V487 PolarHBondContact O-N 2.9Å; V487-F490 PolarHBondContact O-N 2.72Å; V487-C491 WeakPolarHBondContact O-CB 3.19Å; V487-C491 PolarHBondContact O-N 3.43Å; V487-C491 PolarHBondContact O-SG 2.96Å
488	A	74.6	Confident	77.9	Confident	46 Å²	46	48.3 Å²	48.3	38%	0.38	27%	0.265	S	S	.	.	H	α-helix	trans	-61.4	-47.1	179.7	0	0	0	0	0	111.7	Y427 R484 D485 C491 F492	Y427-A488 HydrophobicContact CE1-CB 4.42Å; R484-A488 WeakPolarHBondContact O-CB 3.43Å; R484-A488 PolarHBondContact O-N 3.33Å; D485-A488 WeakPolarHBondContact O-CB 3.4Å; D485-A488 PolarHBondContact O-N 3.06Å; A488-C491 PolarHBondContact O-N 3.47Å; A488-F492 PolarHBondContact O-N 2.81Å; A488-F492 VanDerWaalsContact O-N 3.1Å
489	L	76.4	Confident	78.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-44.7	175.2	177.3	65.9	0	0	0	112.1	C386 L389 H390 F412 V423 Y427 D485 C491 F492 F494	C386-L489 HydrophobicContact CB-CD1 3.77Å; L389-L489 HydrophobicContact CB-CD2 4.38Å; L389-L489 HydrophobicContact CD2-CD2 3.63Å; L389-L489 HydrophobicContact CG-CD2 3.95Å; H390-L489 PolarHBondContact ND1-O 3.34Å; H390-L489 VanDerWaalsContact ND1-O 3.09Å; F412-L489 HydrophobicContact CE1-CD2 4.16Å; F412-L489 HydrophobicContact CZ-CD2 4.02Å; V423-L489 HydrophobicContact CG2-CD2 4.47Å; Y427-L489 WeakPolarHBondContact OH-CB 3.35Å; D485-L489 PolarHBondContact O-N 3.31Å; L489-C491 PolarHBondContact O-N 3.44Å; L489-F492 WeakPolarHBondContact O-CB 3.06Å; L489-F492 PolarHBondContact O-N 3.06Å; L489-F492 VanDerWaalsContact O-N 3.16Å; L489-F494 HydrophobicContact CD1-CE2 4.21Å; L489-F494 HydrophobicContact CD1-CZ 3.81Å
490	F	77.6	Confident	78.7	Confident	5 Å²	5	44.5 Å²	44.5	2%	0.022	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-33.8	179.9	-173.3	-87.6	0	0	0	111.9	H390 L393 K394 I397 L407 F471 S486 V487 F492	H390-F490 PolarHBondContact CE1-O 2.76Å; H390-F490 PolarHBondContact ND1-O 2.77Å; H390-F490 VanDerWaalsContact ND1-O 3.09Å; L393-F490 HydrophobicContact CB-CD2 3.83Å; L393-F490 HydrophobicContact CB-CE2 4.09Å; L393-F490 HydrophobicContact CD1-CD2 4.44Å; K394-F490 HydrophobicContact CB-CE2 4.17Å; I397-F490 HydrophobicContact CD1-CE2 3.55Å; I397-F490 HydrophobicContact CD1-CZ 3.55Å; L407-F490 HydrophobicContact CD2-CB 3.89Å; L407-F490 HydrophobicContact CD2-CD2 4.17Å; L407-F490 HydrophobicContact CD2-CG 4.14Å; F471-F490 HydrophobicContact CD1-CD1 4.05Å; F471-F490 AromaticContact CD1-CE1 3.7Å; F471-F490 HydrophobicContact CD1-CE1 3.7Å; F471-F490 HydrophobicContact CD2-CE1 4.06Å; F471-F490 HydrophobicContact CD2-CZ 4.46Å; F471-F490 AromaticContact CE1-CD1 3.18Å; F471-F490 HydrophobicContact CE1-CD1 3.18Å; F471-F490 AromaticContact CE1-CE1 3.2Å; F471-F490 HydrophobicContact CE1-CE1 3.2Å; F471-F490 HydrophobicContact CE1-CG 4.27Å; F471-F490 HydrophobicContact CE1-CZ 4.29Å; F471-F490 HydrophobicContact CE2-CD1 4.16Å; F471-F490 AromaticContact CE2-CE1 3.61Å; F471-F490 HydrophobicContact CE2-CE1 3.61Å; F471-F490 AromaticContact CE2-CZ 3.95Å; F471-F490 HydrophobicContact CE2-CZ 3.95Å; F471-F490 HydrophobicContact CG-CE1 4.08Å; F471-F490 AromaticContact CZ-CD1 3.26Å; F471-F490 HydrophobicContact CZ-CD1 3.26Å; F471-F490 AromaticContact CZ-CE1 3.15Å; F471-F490 HydrophobicContact CZ-CE1 3.15Å; F471-F490 HydrophobicContact CZ-CG 4.03Å; F471-F490 AromaticContact CZ-CZ 3.86Å; F471-F490 HydrophobicContact CZ-CZ 3.86Å; S486-F490 VanDerWaalsContact O-CB 3.24Å; S486-F490 WeakPolarHBondContact O-CB 3.35Å; S486-F490 PolarHBondContact O-N 3.42Å; V487-F490 PolarHBondContact O-N 2.72Å; F490-F492 VanDerWaalsContact C-N 3.34Å
491	C	75.5	Confident	78.6	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.034	25%	0.247	C	C	.	.	H	α-helix	trans	-87.4	-6.7	-179.7	-59.1	0	0	0	0	112.6	M442 L443 I446 V487 A488 L489 N493	M442-C491 HydrophobicContact CE-CB 4.32Å; M442-C491 WeakPolarHBondContact CE-O 3.44Å; L443-C491 HydrophobicContact CD2-CB 3.46Å; L443-C491 VanDerWaalsContact CD2-CB 3.46Å; L443-C491 WeakPolarHBondContact CD2-SG 3.39Å; I446-C491 WeakPolarHBondContact CD1-O 3.48Å; V487-C491 WeakPolarHBondContact O-CB 3.19Å; V487-C491 PolarHBondContact O-N 3.43Å; V487-C491 PolarHBondContact O-SG 2.96Å; A488-C491 PolarHBondContact O-N 3.47Å; L489-C491 PolarHBondContact O-N 3.44Å; C491-N493 PolarHBondContact O-N 3.04Å
492	F	78	Confident	78.2	Confident	16 Å²	16	42.3 Å²	42.3	7%	0.07	23%	0.233	C	C	.	.			trans	-65.4	132.6	-176.1	-168.2	-99.4	0	0	0	113.4	N295 L380 F426 M442 A488 L489 F490 F494 T497	N295-F492 PolarHBondContact ND2-O 3.01Å; L380-F492 HydrophobicContact CB-CZ 4.2Å; L380-F492 HydrophobicContact CD1-CE2 3.57Å; L380-F492 HydrophobicContact CD1-CZ 3.68Å; F426-F492 HydrophobicContact CZ-CD2 4.1Å; F426-F492 HydrophobicContact CZ-CE2 4.16Å; M442-F492 HydrophobicContact CE-CD2 4.37Å; A488-F492 PolarHBondContact O-N 2.81Å; A488-F492 VanDerWaalsContact O-N 3.1Å; L489-F492 WeakPolarHBondContact O-CB 3.06Å; L489-F492 PolarHBondContact O-N 3.06Å; L489-F492 VanDerWaalsContact O-N 3.16Å; F490-F492 VanDerWaalsContact C-N 3.34Å; F492-F494 HydrophobicContact CB-CD2 4.48Å; F492-F494 HydrophobicContact CB-CE2 4.04Å; F492-F494 HydrophobicContact CB-CZ 4.48Å; F492-F494 AromaticContact CD1-CD1 3.75Å; F492-F494 HydrophobicContact CD1-CD1 3.75Å; F492-F494 AromaticContact CD1-CD2 3.68Å; F492-F494 HydrophobicContact CD1-CD2 3.68Å; F492-F494 AromaticContact CD1-CE1 3.7Å; F492-F494 HydrophobicContact CD1-CE1 3.7Å; F492-F494 AromaticContact CD1-CE2 3.61Å; F492-F494 HydrophobicContact CD1-CE2 3.61Å; F492-F494 AromaticContact CD1-CG 3.73Å; F492-F494 HydrophobicContact CD1-CG 3.73Å; F492-F494 AromaticContact CD1-CZ 3.62Å; F492-F494 HydrophobicContact CD1-CZ 3.62Å; F492-F494 AromaticContact CE1-CD1 3.81Å; F492-F494 HydrophobicContact CE1-CD1 3.81Å; F492-F494 HydrophobicContact CE1-CD2 4.5Å; F492-F494 AromaticContact CE1-CE1 3.92Å; F492-F494 HydrophobicContact CE1-CE1 3.92Å; F492-F494 HydrophobicContact CE1-CG 4.11Å; F492-F494 HydrophobicContact CE1-CZ 4.29Å; F492-F494 HydrophobicContact CG-CE2 4.29Å; F492-F494 HydrophobicContact CG-CZ 4.41Å; F492-F494 PolarHBondContact O-N 2.94Å; F492-T497 HydrophobicContact CE1-CG2 3.45Å; F492-T497 VanDerWaalsContact CE1-CG2 3.45Å; F492-T497 HydrophobicContact CZ-CG2 3.69Å
493	N	83.4	Confident	77.7	Confident	41 Å²	41	43.9 Å²	43.9	22%	0.219	24%	0.244	C	C	.	.			trans	-89.3	83.4	177.5	-177.5	12.1	0	0	0	111.3	N295 I446 C491 A495 S496	N295-N493 PolarHBondContact OD1-OD1 3.2Å; I446-N493 HydrophobicContact CD1-CB 4.21Å; I446-N493 HydrophobicContact CG1-CB 4.1Å; C491-N493 PolarHBondContact O-N 3.04Å; N493-A495 PolarHBondContact O-N 3Å; N493-A495 WeakPolarHBondContact OD1-CB 3.38Å; N493-A495 PolarHBondContact OD1-N 3.04Å; N493-S496 PolarHBondContact O-N 3.1Å; N493-S496 PolarHBondContact O-OG 3.22Å
494	F	86.1	Confident	77.2	Confident	1 Å²	1	50.7 Å²	50.7	0%	0.004	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-58.3	-27.3	178.3	-74.7	-82	0	0	0	113.8	N295 F382 C386 W387 H390 L489 F492 S496 T497	N295-F494 HydrophobicContact CB-CB 4.47Å; N295-F494 PolarHBondContact ND2-N 3.33Å; N295-F494 VanDerWaalsContact ND2-N 3.11Å; N295-F494 CarbonylContact O-C 3.5Å; N295-F494 WeakPolarHBondContact O-CB 3.27Å; F382-F494 HydrophobicContact CD2-CB 4.48Å; F382-F494 HydrophobicContact CD2-CD1 4.18Å; F382-F494 HydrophobicContact CE2-CB 4.28Å; F382-F494 HydrophobicContact CE2-CD1 4.2Å; C386-F494 VanDerWaalsContact C-CZ 3.49Å; C386-F494 HydrophobicContact CB-CE1 3.96Å; C386-F494 HydrophobicContact CB-CZ 3.75Å; W387-F494 HydrophobicContact CB-CD1 3.68Å; W387-F494 HydrophobicContact CB-CD2 4.39Å; W387-F494 HydrophobicContact CB-CE1 3.79Å; W387-F494 HydrophobicContact CB-CE2 4.49Å; W387-F494 HydrophobicContact CB-CG 4Å; W387-F494 HydrophobicContact CB-CZ 4.22Å; W387-F494 AromaticContact CD1-CG 3.91Å; W387-F494 HydrophobicContact CG-CD1 4.46Å; W387-F494 HydrophobicContact CG-CG 4.39Å; H390-F494 HydrophobicContact CB-CD2 4.18Å; H390-F494 HydrophobicContact CB-CE2 3.54Å; H390-F494 HydrophobicContact CB-CZ 4.37Å; H390-F494 AromaticContact CG-CD2 3.93Å; H390-F494 AromaticContact CG-CE2 3.68Å; H390-F494 AromaticContact ND1-CE2 3.92Å; L489-F494 HydrophobicContact CD1-CE2 4.21Å; L489-F494 HydrophobicContact CD1-CZ 3.81Å; F492-F494 HydrophobicContact CB-CD2 4.48Å; F492-F494 HydrophobicContact CB-CE2 4.04Å; F492-F494 HydrophobicContact CB-CZ 4.48Å; F492-F494 AromaticContact CD1-CD1 3.75Å; F492-F494 HydrophobicContact CD1-CD1 3.75Å; F492-F494 AromaticContact CD1-CD2 3.68Å; F492-F494 HydrophobicContact CD1-CD2 3.68Å; F492-F494 AromaticContact CD1-CE1 3.7Å; F492-F494 HydrophobicContact CD1-CE1 3.7Å; F492-F494 AromaticContact CD1-CE2 3.61Å; F492-F494 HydrophobicContact CD1-CE2 3.61Å; F492-F494 AromaticContact CD1-CG 3.73Å; F492-F494 HydrophobicContact CD1-CG 3.73Å; F492-F494 AromaticContact CD1-CZ 3.62Å; F492-F494 HydrophobicContact CD1-CZ 3.62Å; F492-F494 AromaticContact CE1-CD1 3.81Å; F492-F494 HydrophobicContact CE1-CD1 3.81Å; F492-F494 HydrophobicContact CE1-CD2 4.5Å; F492-F494 AromaticContact CE1-CE1 3.92Å; F492-F494 HydrophobicContact CE1-CE1 3.92Å; F492-F494 HydrophobicContact CE1-CG 4.11Å; F492-F494 HydrophobicContact CE1-CZ 4.29Å; F492-F494 HydrophobicContact CG-CE2 4.29Å; F492-F494 HydrophobicContact CG-CZ 4.41Å; F492-F494 PolarHBondContact O-N 2.94Å; F494-S496 PolarHBondContact O-N 3.23Å; F494-S496 VanDerWaalsContact O-N 3.12Å; F494-T497 WeakPolarHBondContact O-CB 3.42Å; F494-T497 PolarHBondContact O-N 2.88Å; F494-T497 PolarHBondContact O-OG1 2.83Å
495	A	85.6	Confident	76.8	Confident	32 Å²	32	43.6 Å²	43.6	26%	0.264	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-64.8	-15.5	176	0	0	0	0	0	114	N295 N493	N295-A495 PolarHBondContact O-N 3.32Å; N295-A495 VanDerWaalsContact OD1-CB 3.28Å; N295-A495 WeakPolarHBondContact OD1-CB 3.38Å; N295-A495 PolarHBondContact OD1-N 2.91Å; N493-A495 PolarHBondContact O-N 3Å; N493-A495 WeakPolarHBondContact OD1-CB 3.38Å; N493-A495 PolarHBondContact OD1-N 3.04Å
496	S	85.4	Confident	76.1	Confident	64 Å²	64	42.9 Å²	42.9	45%	0.448	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-89.6	-5.3	175.3	70.1	0	0	0	0	114.4	N493 F494	N493-S496 PolarHBondContact O-N 3.1Å; N493-S496 PolarHBondContact O-OG 3.22Å; F494-S496 PolarHBondContact O-N 3.23Å; F494-S496 VanDerWaalsContact O-N 3.12Å
497	T	85.9	Confident	75.3	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.031	26%	0.264	C	S	.	.	S	Bend	trans	-82.1	164.6	178.4	63	0	0	0	0	111.9	P297 L380 F382 F492 F494	P297-T497 WeakPolarHBondContact CG-OG1 3.11Å; L380-T497 HydrophobicContact CB-CG2 4.33Å; L380-T497 VanDerWaalsContact O-CA 3.27Å; L380-T497 WeakPolarHBondContact O-CA 3.38Å; L380-T497 WeakPolarHBondContact O-CB 3.48Å; F382-T497 WeakPolarHBondContact CA-OG1 3.26Å; F382-T497 WeakPolarHBondContact CB-OG1 3.37Å; F382-T497 WeakPolarHBondContact CD2-OG1 3.38Å; F492-T497 HydrophobicContact CE1-CG2 3.45Å; F492-T497 VanDerWaalsContact CE1-CG2 3.45Å; F492-T497 HydrophobicContact CZ-CG2 3.69Å; F494-T497 WeakPolarHBondContact O-CB 3.42Å; F494-T497 PolarHBondContact O-N 2.88Å; F494-T497 PolarHBondContact O-OG1 2.83Å
498	F	87.2	Confident	74.4	Confident	59 Å²	59	47.6 Å²	47.6	26%	0.259	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-110.5	147.8	175.1	75.8	-85.3	0	0	0	110.8	R379 L380 P381 F382 A500	R379-F498 HydrophobicContact CB-CD1 4.05Å; R379-F498 WeakPolarHBondContact O-CE1 3.37Å; L380-F498 VanDerWaalsContact O-CD1 3.28Å; L380-F498 WeakPolarHBondContact O-CD1 3.48Å; L380-F498 PolarHBondContact O-N 3.28Å; P381-F498 CarbonylContact C-O 3.53Å; P381-F498 VanDerWaalsContact CA-CE1 3.47Å; P381-F498 WeakPolarHBondContact CA-O 3.16Å; P381-F498 HydrophobicContact CB-CE1 3.89Å; P381-F498 HydrophobicContact CB-CE2 4.41Å; P381-F498 HydrophobicContact CB-CZ 3.8Å; P381-F498 VanDerWaalsContact N-CE1 3.34Å; F382-F498 WeakPolarHBondContact CB-O 3.48Å; F382-F498 PolarHBondContact N-O 3.2Å; F498-A500 HydrophobicContact CE2-CB 3.91Å; F498-A500 PolarHBondContact O-N 2.87Å
499	V	84.9	Confident	73.5	Confident	15 Å²	15	56.6 Å²	56.6	9%	0.091	31%	0.305	C	S	.	.			trans	-84.8	110.5	174.4	-178.4	0	0	0	0	109.3	P297 E299 I300 F352 F382 D501 C502	P297-V499 HydrophobicContact CB-CG2 4.36Å; P297-V499 HydrophobicContact CG-CG2 4.42Å; E299-V499 HydrophobicContact CB-CB 4.24Å; E299-V499 HydrophobicContact CB-CG2 3.94Å; I300-V499 HydrophobicContact CD1-CG2 4.05Å; I300-V499 HydrophobicContact CG1-CG2 3.61Å; F352-V499 HydrophobicContact CZ-CG1 4.32Å; F382-V499 HydrophobicContact CB-CG2 4.3Å; V499-D501 PolarHBondContact O-N 3.35Å; V499-C502 HydrophobicContact CG1-CB 4.23Å
500	A	77.7	Confident	72.5	Confident	25 Å²	25	60.5 Å²	60.5	21%	0.207	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	129.5	175.7	0	0	0	0	0	110.4	A366 F498 C502	A366-A500 HydrophobicContact CB-CB 4.19Å; F498-A500 HydrophobicContact CE2-CB 3.91Å; F498-A500 PolarHBondContact O-N 2.87Å; A500-C502 PolarHBondContact O-N 3.3Å
501	D	71	Confident	72	Confident	153 Å²	153	61.1 Å²	61.1	82%	0.818	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	46.7	174.1	-60.3	-39.7	0	0	0	115.1	V499 P503	V499-D501 PolarHBondContact O-N 3.35Å; D501-P503 WeakPolarHBondContact O-CD 3.36Å
502	C	66.4	Low	71.5	Confident	60 Å²	60	63.1 Å²	63.1	41%	0.405	35%	0.349	S	S	.	.			trans	-49.9	101.7	178	-170.4	0	0	0	0	111.4	L351 V499 A500	L351-C502 VanDerWaalsContact CD2-SG 3.51Å; V499-C502 HydrophobicContact CG1-CB 4.23Å; A500-C502 PolarHBondContact O-N 3.3Å
503	P	66.3	Low	71.2	Confident	49 Å²	49	64.9 Å²	64.9	32%	0.318	36%	0.357	S	S	.	.			trans	-68.7	148.8	-176.7	28.6	-32.9	0	0	0	109.2	L351 D501 F505	L351-P503 HydrophobicContact CD2-CG 4.3Å; D501-P503 WeakPolarHBondContact O-CD 3.36Å; P503-F505 PolarHBondContact O-N 3.05Å
504	K	66.2	Low	70.7	Confident	198 Å²	198	64.6 Å²	64.6	86%	0.861	35%	0.354	S	S	*	.			trans	-60.6	112	173	-71.1	-172.7	179.2	-176.9	0	109.1	D507	K504-D507 PolarHBondContact O-N 2.97Å
505	F	65	Low	69.8	Low	44 Å²	44	68.1 Å²	68.1	19%	0.193	38%	0.377	C	S	.	.	S	Bend	trans	-92	142.4	176.3	-173.6	-89.3	0	0	0	110.9	T303 V307 I346 P503 Y511	T303-F505 HydrophobicContact CG2-CB 4.17Å; T303-F505 HydrophobicContact CG2-CG 4.42Å; V307-F505 HydrophobicContact CB-CE1 4.33Å; V307-F505 HydrophobicContact CG1-CE1 4.33Å; V307-F505 HydrophobicContact CG2-CD1 3.45Å; V307-F505 VanDerWaalsContact CG2-CD1 3.45Å; V307-F505 HydrophobicContact CG2-CE1 3.24Å; V307-F505 HydrophobicContact CG2-CZ 4.18Å; I346-F505 HydrophobicContact CG2-CE1 4.08Å; I346-F505 HydrophobicContact CG2-CZ 3.57Å; P503-F505 PolarHBondContact O-N 3.05Å; F505-Y511 AromaticContact CE2-CD2 3.56Å; F505-Y511 HydrophobicContact CE2-CD2 3.56Å; F505-Y511 AromaticContact CE2-CE2 3.67Å; F505-Y511 HydrophobicContact CE2-CE2 3.67Å; F505-Y511 HydrophobicContact CZ-CD2 4.09Å; F505-Y511 AromaticContact CZ-CE2 3.94Å; F505-Y511 HydrophobicContact CZ-CE2 3.94Å
506	P	58.8	Low	69.2	Low	59 Å²	59	70.9 Å²	70.9	38%	0.383	38%	0.384	S	S	.	.			cis	-82	120.4	-11.4	30.2	-30.3	0	0	0	110.9	L310 G508	L310-P506 HydrophobicContact CD1-CG 4.23Å; P506-G508 VanDerWaalsContact C-N 3.29Å; P506-G508 PolarHBondContact O-N 3.45Å
507	D	56.9	Low	68.4	Low	75 Å²	75	68 Å²	68	40%	0.401	36%	0.363	S	S	.	.			trans	-76.9	88.2	164.7	-173.8	5.8	0	0	0	107.7	K504 R509 N510 Y511	K504-D507 PolarHBondContact O-N 2.97Å; D507-R509 PolarHBondContact O-N 3.44Å; D507-N510 HydrophobicContact CB-CB 4.49Å; D507-N510 PolarHBondContact O-N 2.9Å; D507-N510 PolarHBondContact OD2-ND2 3.5Å; D507-Y511 PolarHBondContact O-N 3.34Å
508	G	53.2	Low	67.5	Low	47 Å²	47	70 Å²	70	49%	0.485	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-10.5	-167.8	0	0	0	0	0	116	P506	P506-G508 VanDerWaalsContact C-N 3.29Å; P506-G508 PolarHBondContact O-N 3.45Å
509	R	56	Low	66.3	Low	236 Å²	236	72.8 Å²	72.8	89%	0.891	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-22.7	171.8	-59.9	-170.4	-152.9	-165.8	6.3	113.5	D507	D507-R509 PolarHBondContact O-N 3.44Å
510	N	55.8	Low	65	Low	81 Å²	81	74.1 Å²	74.1	43%	0.433	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-14	-172	-73.1	-35.8	0	0	0	113.3	K353 D507 G512	K353-N510 HydrophobicContact CD-CB 4.48Å; D507-N510 HydrophobicContact CB-CB 4.49Å; D507-N510 PolarHBondContact O-N 2.9Å; D507-N510 PolarHBondContact OD2-ND2 3.5Å; N510-G512 PolarHBondContact O-N 3.19Å
511	Y	66.6	Low	64.2	Low	18 Å²	18	76.7 Å²	76.7	7%	0.071	42%	0.417	C	S	.	.			trans	-76.9	108.3	175	-164	-95.5	0	0	0	110.9	I346 K349 F505 D507 F513 E567	I346-Y511 HydrophobicContact CG2-CE2 4.34Å; K349-Y511 HydrophobicContact CB-CE2 4.21Å; K349-Y511 HydrophobicContact CD-CE2 4.29Å; K349-Y511 WeakPolarHBondContact CD-OH 3.33Å; K349-Y511 HydrophobicContact CG-CE2 3.96Å; F505-Y511 AromaticContact CE2-CD2 3.56Å; F505-Y511 HydrophobicContact CE2-CD2 3.56Å; F505-Y511 AromaticContact CE2-CE2 3.67Å; F505-Y511 HydrophobicContact CE2-CE2 3.67Å; F505-Y511 HydrophobicContact CZ-CD2 4.09Å; F505-Y511 AromaticContact CZ-CE2 3.94Å; F505-Y511 HydrophobicContact CZ-CE2 3.94Å; D507-Y511 PolarHBondContact O-N 3.34Å; Y511-F513 HydrophobicContact CD1-CD1 4.08Å; Y511-F513 HydrophobicContact CD1-CD2 4.21Å; Y511-F513 AromaticContact CD1-CE1 3.69Å; Y511-F513 HydrophobicContact CD1-CE1 3.69Å; Y511-F513 AromaticContact CD1-CE2 3.84Å; Y511-F513 HydrophobicContact CD1-CE2 3.84Å; Y511-F513 HydrophobicContact CD1-CG 4.32Å; Y511-F513 AromaticContact CD1-CZ 3.55Å; Y511-F513 HydrophobicContact CD1-CZ 3.55Å; Y511-F513 HydrophobicContact CE1-CD1 4.14Å; Y511-F513 AromaticContact CE1-CE1 3.85Å; Y511-F513 HydrophobicContact CE1-CE1 3.85Å; Y511-F513 HydrophobicContact CE1-CZ 4.18Å; Y511-F513 HydrophobicContact CG-CZ 4.49Å; Y511-F513 WeakPolarHBondContact O-CD2 3.37Å; Y511-F513 PolarHBondContact O-N 2.89Å; Y511-E567 HydrophobicContact CE1-CG 4.26Å; Y511-E567 VanDerWaalsContact CE1-OE1 3.32Å; Y511-E567 WeakPolarHBondContact CE1-OE1 3.47Å; Y511-E567 PolarHBondContact OH-OE1 2.91Å
512	G	66	Low	63.7	Low	47 Å²	47	71.6 Å²	71.6	49%	0.485	39%	0.394	S	S	.	.			trans	-75	109.7	178.4	0	0	0	0	0	112.3	K349 N510	K349-G512 WeakPolarHBondContact CE-O 3.38Å; K349-G512 PolarHBondContact NZ-O 2.98Å; N510-G512 PolarHBondContact O-N 3.19Å
513	F	71.7	Confident	63.5	Low	54 Å²	54	73.6 Å²	73.6	24%	0.237	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-81.3	136.5	172	-65.9	-84.2	0	0	0	111.1	Y511 E567 T571 L574 Y576	Y511-F513 HydrophobicContact CD1-CD1 4.08Å; Y511-F513 HydrophobicContact CD1-CD2 4.21Å; Y511-F513 AromaticContact CD1-CE1 3.69Å; Y511-F513 HydrophobicContact CD1-CE1 3.69Å; Y511-F513 AromaticContact CD1-CE2 3.84Å; Y511-F513 HydrophobicContact CD1-CE2 3.84Å; Y511-F513 HydrophobicContact CD1-CG 4.32Å; Y511-F513 AromaticContact CD1-CZ 3.55Å; Y511-F513 HydrophobicContact CD1-CZ 3.55Å; Y511-F513 HydrophobicContact CE1-CD1 4.14Å; Y511-F513 AromaticContact CE1-CE1 3.85Å; Y511-F513 HydrophobicContact CE1-CE1 3.85Å; Y511-F513 HydrophobicContact CE1-CZ 4.18Å; Y511-F513 HydrophobicContact CG-CZ 4.49Å; Y511-F513 WeakPolarHBondContact O-CD2 3.37Å; Y511-F513 PolarHBondContact O-N 2.89Å; F513-E567 HydrophobicContact CD1-CB 4.21Å; F513-E567 HydrophobicContact CE1-CB 4.2Å; F513-T571 HydrophobicContact CD1-CG2 4.2Å; F513-T571 HydrophobicContact CD2-CG2 4.47Å; F513-T571 HydrophobicContact CE1-CG2 3.42Å; F513-T571 VanDerWaalsContact CE1-CG2 3.42Å; F513-T571 HydrophobicContact CE2-CG2 3.74Å; F513-T571 HydrophobicContact CZ-CG2 3.14Å; F513-L574 HydrophobicContact CE2-CD1 4.44Å; F513-Y576 WeakPolarHBondContact CB-OH 3.26Å
514	H	72.6	Confident	63.9	Low	34 Å²	34	74 Å²	74	16%	0.157	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-83.1	149.6	175.8	-62.1	-63.1	0	0	0	111.5	K349 M532 F537 F541 F560	K349-H514 PolarHBondContact NZ-CD2 3.45Å; K349-H514 PolarHBondContact NZ-NE2 2.74Å; K349-H514 VanDerWaalsContact NZ-NE2 3.14Å; H514-M532 HydrophobicContact CB-CE 3.9Å; H514-F537 HydrophobicContact CB-CE1 4.38Å; H514-F537 AromaticContact CE1-CD1 3.93Å; H514-F537 AromaticContact CG-CE1 3.92Å; H514-F537 AromaticContact ND1-CD1 3.9Å; H514-F541 AromaticContact NE2-CD1 3.93Å; H514-F541 AromaticContact NE2-CE1 3.59Å; H514-F541 AromaticContact NE2-CZ 3.87Å; H514-F560 HydrophobicContact CB-CE2 4.49Å; H514-F560 HydrophobicContact CB-CZ 4.09Å; H514-F560 AromaticContact CD2-CE2 3.98Å
515	P	66.3	Low	64.2	Low	75 Å²	75	67.2 Å²	67.2	49%	0.487	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-55.8	140.5	172.6	-26.6	36.7	0	0	0	112.3	M532 I536 Q564	P515-M532 WeakPolarHBondContact O-CE 3.39Å; P515-I536 HydrophobicContact CG-CD1 3.99Å; P515-Q564 PolarHBondContact O-NE2 3.29Å
516	F	72.7	Confident	64.9	Low	91 Å²	91	67.9 Å²	67.9	40%	0.399	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-72.1	133.6	-176.5	-171.1	-103.1	0	0	0	112.4	S518 H519 M568	F516-S518 PolarHBondContact O-N 3.31Å; F516-H519 AromaticContact CZ-CE1 3.8Å; F516-H519 AromaticContact CZ-NE2 3.67Å; F516-M568 HydrophobicContact CD2-CE 4.25Å; F516-M568 HydrophobicContact CD2-SD 3.99Å; F516-M568 HydrophobicContact CE2-CE 3.57Å; F516-M568 HydrophobicContact CE2-SD 3.87Å; F516-M568 HydrophobicContact CZ-CE 4.3Å
517	I	70	Confident	65.8	Low	2 Å²	2	72.1 Å²	72.1	1%	0.01	39%	0.389	C	S	.	.			trans	-78.8	104.4	168.9	-63	-179.7	0	0	0	107.7	R525 Q528 F529 M532 F560 L561	I517-R525 HydrophobicContact CG2-CB 4.26Å; I517-R525 HydrophobicContact CG2-CG 4.22Å; I517-Q528 HydrophobicContact CG1-CB 4.46Å; I517-Q528 HydrophobicContact CG2-CB 3.98Å; I517-F529 HydrophobicContact CD1-CB 3.83Å; I517-F529 HydrophobicContact CD1-CD2 4.22Å; I517-M532 HydrophobicContact CD1-SD 3.79Å; I517-M532 HydrophobicContact CG1-SD 3.31Å; I517-M532 WeakPolarHBondContact CG1-SD 3.4Å; I517-F560 HydrophobicContact CD1-CD1 3.88Å; I517-F560 HydrophobicContact CD1-CE1 3.67Å; I517-F560 HydrophobicContact CG1-CE1 4.19Å; I517-L561 HydrophobicContact CB-CD2 4.19Å; I517-L561 HydrophobicContact CD1-CD2 4.49Å; I517-L561 HydrophobicContact CG2-CD2 4.34Å
518	S	66.2	Low	66.8	Low	49 Å²	49	70.5 Å²	70.5	34%	0.343	38%	0.378	S	S	.	.			trans	-52.9	141.9	-179.1	66.3	0	0	0	0	112.1	F516 S520 Q528	F516-S518 PolarHBondContact O-N 3.31Å; S518-S520 PolarHBondContact O-N 2.88Å; S518-S520 PolarHBondContact OG-OG 2.94Å; S518-Q528 PolarHBondContact OG-OE1 3.5Å
519	H	61.9	Low	68.2	Low	116 Å²	116	69.4 Å²	69.4	54%	0.537	36%	0.361	S	S	.	.			trans	-67.4	15.8	177	-68.1	-48.3	0	0	0	115.2	F516 R525	F516-H519 AromaticContact CZ-CE1 3.8Å; F516-H519 AromaticContact CZ-NE2 3.67Å; H519-R525 VanDerWaalsContact CA-NH2 3.31Å; H519-R525 PolarHBondContact ND1-NH2 3.35Å; H519-R525 PolarHBondContact O-NH2 3.48Å
520	S	58.6	Low	69.4	Low	43 Å²	43	64.7 Å²	64.7	30%	0.301	35%	0.346	S	S	.	.			trans	-54.3	168.3	171.7	69.1	0	0	0	0	112.2	S518 N524 R525	S518-S520 PolarHBondContact O-N 2.88Å; S518-S520 PolarHBondContact OG-OG 2.94Å; S520-N524 PolarHBondContact OG-ND2 3.28Å; S520-R525 PolarHBondContact O-NE 3.45Å
521	S	59.4	Low	70.5	Confident	79 Å²	79	68.2 Å²	68.2	55%	0.552	35%	0.354	S	S	*	.			trans	-40.9	143.4	-172.1	60.7	0	0	0	0	113	D523 N524	S521-D523 PolarHBondContact O-N 3.06Å; S521-N524 WeakPolarHBondContact O-CB 3.47Å; S521-N524 PolarHBondContact O-N 3.12Å
522	S	61.7	Low	71	Confident	46 Å²	46	68 Å²	68	32%	0.322	35%	0.353	S	S	.	.	H	α-helix	trans	-52.5	-34.1	-173	47.9	0	0	0	0	113.7	L242 N524 R525	L242-S522 VanDerWaalsContact CD1-OG 3.29Å; L242-S522 WeakPolarHBondContact CD1-OG 3.49Å; S522-N524 PolarHBondContact O-N 3.48Å; S522-R525 PolarHBondContact O-N 3.32Å; S522-R525 VanDerWaalsContact O-N 3.12Å
523	D	61.5	Low	71.5	Confident	102 Å²	102	67 Å²	67	55%	0.545	34%	0.339	S	S	.	.	H	α-helix	trans	-53.2	-42.3	175.2	-79.2	-60.9	0	0	0	112.1	L242 S521 R525	L242-D523 HydrophobicContact CD1-CB 4.05Å; L242-D523 WeakPolarHBondContact CD1-OD1 3.16Å; L242-D523 VanDerWaalsContact CD1-OD2 3.27Å; L242-D523 WeakPolarHBondContact CD1-OD2 3.22Å; L242-D523 HydrophobicContact CD2-CB 4.37Å; L242-D523 WeakPolarHBondContact CD2-OD1 3.35Å; L242-D523 VanDerWaalsContact CG-OD1 3.29Å; L242-D523 WeakPolarHBondContact CG-OD1 3.47Å; S521-D523 PolarHBondContact O-N 3.06Å; D523-R525 VanDerWaalsContact C-N 3.33Å; D523-R525 PolarHBondContact O-N 2.99Å
524	N	74.4	Confident	71.7	Confident	59 Å²	59	70.6 Å²	70.6	32%	0.316	36%	0.36	S	S	.	.	H	α-helix	trans	-76.8	-23.6	-175.3	-156.1	2.7	0	0	0	111.6	S520 S521 S522 Q528	S520-N524 PolarHBondContact OG-ND2 3.28Å; S521-N524 WeakPolarHBondContact O-CB 3.47Å; S521-N524 PolarHBondContact O-N 3.12Å; S522-N524 PolarHBondContact O-N 3.48Å; N524-Q528 PolarHBondContact ND2-NE2 2.9Å; N524-Q528 WeakPolarHBondContact O-CB 3.32Å; N524-Q528 WeakPolarHBondContact O-CG 3.44Å; N524-Q528 PolarHBondContact O-N 2.61Å; N524-Q528 PolarHBondContact OD1-NE2 3.41Å; N524-Q528 VanDerWaalsContact OD1-NE2 3.16Å
525	R	73.6	Confident	72	Confident	55 Å²	55	73.4 Å²	73.4	21%	0.208	38%	0.38	C	S	.	.	H	α-helix	trans	-70.8	-47.3	-175.8	-64.8	-171.4	-170.8	-177.4	1.3	112.7	I517 H519 S520 S522 D523 Y527 Q528 F529	I517-R525 HydrophobicContact CG2-CB 4.26Å; I517-R525 HydrophobicContact CG2-CG 4.22Å; H519-R525 VanDerWaalsContact CA-NH2 3.31Å; H519-R525 PolarHBondContact ND1-NH2 3.35Å; H519-R525 PolarHBondContact O-NH2 3.48Å; S520-R525 PolarHBondContact O-NE 3.45Å; S522-R525 PolarHBondContact O-N 3.32Å; S522-R525 VanDerWaalsContact O-N 3.12Å; D523-R525 VanDerWaalsContact C-N 3.33Å; D523-R525 PolarHBondContact O-N 2.99Å; R525-Y527 VanDerWaalsContact C-N 3.3Å; R525-Y527 PolarHBondContact O-N 2.97Å; R525-Q528 PolarHBondContact O-N 3.38Å; R525-F529 WeakPolarHBondContact O-CB 3.48Å; R525-F529 PolarHBondContact O-N 3.12Å
526	S	78	Confident	72.6	Confident	57 Å²	57	73.4 Å²	73.4	40%	0.399	38%	0.375	S	S	.	.	H	α-helix	trans	-63.7	-39.5	177.2	-64.6	0	0	0	0	111.2	K530	S526-K530 WeakPolarHBondContact O-CB 3.45Å; S526-K530 PolarHBondContact O-N 3.05Å
527	Y	79.4	Confident	73	Confident	149 Å²	149	69.9 Å²	69.9	58%	0.584	36%	0.359	S	S	*	.	H	α-helix	trans	-63.9	-46.1	173.7	178	-100	0	0	0	112.4	R525 K530 R531	R525-Y527 VanDerWaalsContact C-N 3.3Å; R525-Y527 PolarHBondContact O-N 2.97Å; Y527-K530 PolarHBondContact O-N 3.38Å; Y527-R531 WeakPolarHBondContact O-CB 3.32Å; Y527-R531 PolarHBondContact O-N 3.14Å
528	Q	77.4	Confident	73.8	Confident	40 Å²	40	70.3 Å²	70.3	19%	0.187	36%	0.363	C	S	.	.	H	α-helix	trans	-61.3	-44.5	176.2	-78.6	174	20.5	0	0	111.6	I517 S518 N524 R525 R531 M532	I517-Q528 HydrophobicContact CG1-CB 4.46Å; I517-Q528 HydrophobicContact CG2-CB 3.98Å; S518-Q528 PolarHBondContact OG-OE1 3.5Å; N524-Q528 PolarHBondContact ND2-NE2 2.9Å; N524-Q528 WeakPolarHBondContact O-CB 3.32Å; N524-Q528 WeakPolarHBondContact O-CG 3.44Å; N524-Q528 PolarHBondContact O-N 2.61Å; N524-Q528 PolarHBondContact OD1-NE2 3.41Å; N524-Q528 VanDerWaalsContact OD1-NE2 3.16Å; R525-Q528 PolarHBondContact O-N 3.38Å; Q528-R531 PolarHBondContact O-N 2.82Å; Q528-M532 WeakPolarHBondContact O-CB 3.41Å; Q528-M532 VanDerWaalsContact O-CG 3.31Å; Q528-M532 WeakPolarHBondContact O-CG 3.28Å; Q528-M532 PolarHBondContact O-N 2.68Å
529	F	82.6	Confident	74.8	Confident	25 Å²	25	70.1 Å²	70.1	11%	0.11	36%	0.364	C	S	.	.	H	α-helix	trans	-58.6	-50.5	174.9	175.9	-98.2	0	0	0	111.3	I517 R525 R531 M532 S533 F537 P556 N557 F560	I517-F529 HydrophobicContact CD1-CB 3.83Å; I517-F529 HydrophobicContact CD1-CD2 4.22Å; R525-F529 WeakPolarHBondContact O-CB 3.48Å; R525-F529 PolarHBondContact O-N 3.12Å; F529-R531 VanDerWaalsContact C-N 3.27Å; F529-R531 PolarHBondContact O-N 3.39Å; F529-M532 CarbonylContact O-C 3.42Å; F529-M532 PolarHBondContact O-N 3.3Å; F529-M532 VanDerWaalsContact O-N 3.11Å; F529-S533 WeakPolarHBondContact O-CB 3.28Å; F529-S533 PolarHBondContact O-N 2.97Å; F529-S533 PolarHBondContact O-OG 3.05Å; F529-F537 HydrophobicContact CD2-CE2 4.3Å; F529-F537 HydrophobicContact CD2-CZ 4.5Å; F529-F537 AromaticContact CE2-CE2 3.69Å; F529-F537 HydrophobicContact CE2-CE2 3.69Å; F529-F537 HydrophobicContact CE2-CZ 4.21Å; F529-F537 HydrophobicContact CZ-CE2 4.22Å; F529-P556 HydrophobicContact CE1-CB 4.39Å; F529-P556 HydrophobicContact CZ-CB 4.06Å; F529-N557 HydrophobicContact CB-CB 4.21Å; F529-N557 HydrophobicContact CD1-CB 3.62Å; F529-N557 HydrophobicContact CD2-CB 4.04Å; F529-N557 HydrophobicContact CE1-CB 3.96Å; F529-N557 HydrophobicContact CE2-CB 4.34Å; F529-N557 HydrophobicContact CG-CB 3.66Å; F529-N557 HydrophobicContact CZ-CB 4.31Å; F529-F560 HydrophobicContact CD2-CB 4.04Å; F529-F560 AromaticContact CD2-CD1 3.62Å; F529-F560 HydrophobicContact CD2-CD1 3.62Å; F529-F560 HydrophobicContact CD2-CE1 4.39Å; F529-F560 HydrophobicContact CD2-CG 4Å; F529-F560 HydrophobicContact CE2-CB 3.49Å; F529-F560 VanDerWaalsContact CE2-CB 3.49Å; F529-F560 AromaticContact CE2-CD1 3.81Å; F529-F560 HydrophobicContact CE2-CD1 3.81Å; F529-F560 AromaticContact CE2-CG 3.68Å; F529-F560 HydrophobicContact CE2-CG 3.68Å; F529-F560 HydrophobicContact CZ-CB 4.48Å
530	K	81.2	Confident	76.1	Confident	136 Å²	136	64.8 Å²	64.8	59%	0.591	34%	0.34	S	S	*	.	H	α-helix	trans	-60.6	-37.6	178.1	-173.5	174.8	-176.4	174.3	0	112.1	S526 Y527 S533 L534	S526-K530 WeakPolarHBondContact O-CB 3.45Å; S526-K530 PolarHBondContact O-N 3.05Å; Y527-K530 PolarHBondContact O-N 3.38Å; K530-S533 WeakPolarHBondContact CA-OG 3.37Å; K530-S533 PolarHBondContact O-OG 2.9Å; K530-L534 HydrophobicContact CG-CD1 4.17Å; K530-L534 WeakPolarHBondContact O-CB 3.32Å; K530-L534 WeakPolarHBondContact O-CD1 3.24Å; K530-L534 WeakPolarHBondContact O-CG 3.33Å; K530-L534 PolarHBondContact O-N 3.26Å
531	R	79.1	Confident	77.7	Confident	155 Å²	155	62.8 Å²	62.8	59%	0.585	33%	0.325	S	S	*	.	H	α-helix	trans	-64.9	-48.3	174	-175.9	178.6	169.3	-177.8	-2.1	110.4	Y527 Q528 F529 S533 L534 T535	Y527-R531 WeakPolarHBondContact O-CB 3.32Å; Y527-R531 PolarHBondContact O-N 3.14Å; Q528-R531 PolarHBondContact O-N 2.82Å; F529-R531 VanDerWaalsContact C-N 3.27Å; F529-R531 PolarHBondContact O-N 3.39Å; R531-S533 VanDerWaalsContact C-N 3.35Å; R531-S533 PolarHBondContact O-N 3.26Å; R531-L534 PolarHBondContact O-N 3.19Å; R531-T535 HydrophobicContact CG-CG2 4.26Å; R531-T535 WeakPolarHBondContact O-CB 3.28Å; R531-T535 WeakPolarHBondContact O-CG2 3.44Å; R531-T535 PolarHBondContact O-N 3.31Å; R531-T535 PolarHBondContact O-OG1 3.03Å
532	M	77.1	Confident	79.2	Confident	14 Å²	14	60.4 Å²	60.4	7%	0.069	31%	0.307	C	S	.	.	H	α-helix	trans	-60.8	-42.5	177.9	-72.1	-175.6	59	0	0	112.4	H514 P515 I517 Q528 F529 L534 T535 I536 F537 F560	H514-M532 HydrophobicContact CB-CE 3.9Å; P515-M532 WeakPolarHBondContact O-CE 3.39Å; I517-M532 HydrophobicContact CD1-SD 3.79Å; I517-M532 HydrophobicContact CG1-SD 3.31Å; I517-M532 WeakPolarHBondContact CG1-SD 3.4Å; Q528-M532 WeakPolarHBondContact O-CB 3.41Å; Q528-M532 VanDerWaalsContact O-CG 3.31Å; Q528-M532 WeakPolarHBondContact O-CG 3.28Å; Q528-M532 PolarHBondContact O-N 2.68Å; F529-M532 CarbonylContact O-C 3.42Å; F529-M532 PolarHBondContact O-N 3.3Å; F529-M532 VanDerWaalsContact O-N 3.11Å; M532-L534 PolarHBondContact O-N 3.46Å; M532-T535 PolarHBondContact O-N 3.28Å; M532-I536 HydrophobicContact CB-CD1 4.46Å; M532-I536 HydrophobicContact CG-CD1 3.99Å; M532-I536 WeakPolarHBondContact O-CA 3.49Å; M532-I536 WeakPolarHBondContact O-CB 3.18Å; M532-I536 PolarHBondContact O-N 3.44Å; M532-F537 HydrophobicContact CB-CE1 4.11Å; M532-F537 HydrophobicContact CB-CZ 4.11Å; M532-F537 HydrophobicContact CE-CE1 3.75Å; M532-F537 HydrophobicContact CE-CZ 4.17Å; M532-F537 PolarHBondContact O-N 3.27Å; M532-F560 HydrophobicContact CE-CE1 3.95Å; M532-F560 HydrophobicContact CE-CZ 3.74Å; M532-F560 HydrophobicContact SD-CE1 4.41Å
533	S	77	Confident	80.6	Confident	26 Å²	26	59.9 Å²	59.9	18%	0.182	30%	0.298	C	S	.	.	H	α-helix	trans	-62.7	-32.6	178.2	72.7	0	0	0	0	112.4	F529 K530 R531 F537	F529-S533 WeakPolarHBondContact O-CB 3.28Å; F529-S533 PolarHBondContact O-N 2.97Å; F529-S533 PolarHBondContact O-OG 3.05Å; K530-S533 WeakPolarHBondContact CA-OG 3.37Å; K530-S533 PolarHBondContact O-OG 2.9Å; R531-S533 VanDerWaalsContact C-N 3.35Å; R531-S533 PolarHBondContact O-N 3.26Å; S533-F537 VanDerWaalsContact CA-CD2 3.43Å
534	L	75.9	Confident	82.2	Confident	130 Å²	130	55 Å²	55	68%	0.681	27%	0.272	S	S	*	.	H	α-helix	trans	-84.4	-29.9	177.1	-68	171.9	0	0	0	113.9	K530 R531 M532	K530-L534 HydrophobicContact CG-CD1 4.17Å; K530-L534 WeakPolarHBondContact O-CB 3.32Å; K530-L534 WeakPolarHBondContact O-CD1 3.24Å; K530-L534 WeakPolarHBondContact O-CG 3.33Å; K530-L534 PolarHBondContact O-N 3.26Å; R531-L534 PolarHBondContact O-N 3.19Å; M532-L534 PolarHBondContact O-N 3.46Å
535	T	78	Confident	83.2	Confident	93 Å²	93	52.2 Å²	52.2	57%	0.571	26%	0.257	S	S	*	.	H	α-helix	trans	-110.7	-22.7	-169.9	63.3	0	0	0	0	115.2	R531 M532	R531-T535 HydrophobicContact CG-CG2 4.26Å; R531-T535 WeakPolarHBondContact O-CB 3.28Å; R531-T535 WeakPolarHBondContact O-CG2 3.44Å; R531-T535 PolarHBondContact O-N 3.31Å; R531-T535 PolarHBondContact O-OG1 3.03Å; M532-T535 PolarHBondContact O-N 3.28Å
536	I	78.7	Confident	84.1	Confident	75 Å²	75	53.6 Å²	53.6	39%	0.385	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.1	-39.2	-168.7	-67.4	161.6	0	0	0	111.6	P515 M532 S538	P515-I536 HydrophobicContact CG-CD1 3.99Å; M532-I536 HydrophobicContact CB-CD1 4.46Å; M532-I536 HydrophobicContact CG-CD1 3.99Å; M532-I536 WeakPolarHBondContact O-CA 3.49Å; M532-I536 WeakPolarHBondContact O-CB 3.18Å; M532-I536 PolarHBondContact O-N 3.44Å; I536-S538 PolarHBondContact O-N 3.46Å
537	F	82.2	Confident	84.9	Confident	16 Å²	16	51 Å²	51	7%	0.07	25%	0.247	C	C	.	.	S	Bend	trans	-71.3	135.2	179.3	-63	-7.7	0	0	0	109.9	H514 F529 M532 S533 F541 N542 L545 F560	H514-F537 HydrophobicContact CB-CE1 4.38Å; H514-F537 AromaticContact CE1-CD1 3.93Å; H514-F537 AromaticContact CG-CE1 3.92Å; H514-F537 AromaticContact ND1-CD1 3.9Å; F529-F537 HydrophobicContact CD2-CE2 4.3Å; F529-F537 HydrophobicContact CD2-CZ 4.5Å; F529-F537 AromaticContact CE2-CE2 3.69Å; F529-F537 HydrophobicContact CE2-CE2 3.69Å; F529-F537 HydrophobicContact CE2-CZ 4.21Å; F529-F537 HydrophobicContact CZ-CE2 4.22Å; M532-F537 HydrophobicContact CB-CE1 4.11Å; M532-F537 HydrophobicContact CB-CZ 4.11Å; M532-F537 HydrophobicContact CE-CE1 3.75Å; M532-F537 HydrophobicContact CE-CZ 4.17Å; M532-F537 PolarHBondContact O-N 3.27Å; S533-F537 VanDerWaalsContact CA-CD2 3.43Å; F537-F541 HydrophobicContact CB-CD1 4.06Å; F537-F541 HydrophobicContact CD1-CD1 4.02Å; F537-F541 HydrophobicContact CD1-CE1 4.01Å; F537-F541 AromaticContact CD2-CD1 3.98Å; F537-F541 HydrophobicContact CD2-CD1 3.98Å; F537-F541 HydrophobicContact CD2-CE1 4.07Å; F537-F541 HydrophobicContact CE1-CE1 4.08Å; F537-F541 HydrophobicContact CE2-CE1 4.17Å; F537-F541 AromaticContact CG-CD1 3.76Å; F537-F541 HydrophobicContact CG-CD1 3.76Å; F537-F541 HydrophobicContact CG-CE1 4.05Å; F537-F541 HydrophobicContact CZ-CE1 4.21Å; F537-N542 HydrophobicContact CB-CB 4.5Å; F537-L545 HydrophobicContact CD2-CD1 4.33Å; F537-L545 HydrophobicContact CE2-CD1 4.03Å; F537-F560 HydrophobicContact CE1-CD2 4.35Å; F537-F560 HydrophobicContact CE1-CE1 4.28Å; F537-F560 AromaticContact CE1-CE2 3.56Å; F537-F560 HydrophobicContact CE1-CE2 3.56Å; F537-F560 AromaticContact CE1-CZ 3.52Å; F537-F560 HydrophobicContact CE1-CZ 3.52Å; F537-F560 HydrophobicContact CE2-CD2 4.13Å; F537-F560 HydrophobicContact CE2-CE2 4.15Å; F537-F560 HydrophobicContact CE2-CG 4.41Å; F537-F560 HydrophobicContact CE2-CZ 4.42Å; F537-F560 HydrophobicContact CZ-CD1 4.01Å; F537-F560 AromaticContact CZ-CD2 3.61Å; F537-F560 HydrophobicContact CZ-CD2 3.61Å; F537-F560 AromaticContact CZ-CE1 3.63Å; F537-F560 HydrophobicContact CZ-CE1 3.63Å; F537-F560 AromaticContact CZ-CE2 3.22Å; F537-F560 HydrophobicContact CZ-CE2 3.22Å; F537-F560 AromaticContact CZ-CG 3.99Å; F537-F560 HydrophobicContact CZ-CG 3.99Å; F537-F560 AromaticContact CZ-CZ 3.24Å; F537-F560 HydrophobicContact CZ-CZ 3.24Å
538	S	85.9	Confident	85.7	Confident	12 Å²	12	44 Å²	44	8%	0.084	22%	0.219	C	C	.	.			trans	-59.4	145.4	159.8	65.5	0	0	0	0	109.2	L354 D356 I536 T540 F541 N542	L354-S538 PolarHBondContact O-OG 3.49Å; D356-S538 VanDerWaalsContact CG-CB 3.47Å; D356-S538 WeakPolarHBondContact OD1-CB 3.11Å; D356-S538 WeakPolarHBondContact OD2-CA 2.99Å; D356-S538 WeakPolarHBondContact OD2-CB 3.41Å; I536-S538 PolarHBondContact O-N 3.46Å; S538-T540 PolarHBondContact O-N 3.47Å; S538-F541 PolarHBondContact O-N 3.45Å; S538-F541 WeakPolarHBondContact OG-CB 3.41Å; S538-F541 PolarHBondContact OG-N 3.45Å; S538-N542 PolarHBondContact O-N 3.26Å
539	A	87.1	Confident	86.5	Confident	45 Å²	45	42.3 Å²	42.3	37%	0.372	21%	0.212	S	C	.	.	H	α-helix	trans	-54.7	-40.1	174.3	0	0	0	0	0	111.7	D356 I418 N542 R543	D356-A539 VanDerWaalsContact CG-N 3.25Å; D356-A539 WeakPolarHBondContact OD1-CA 3.06Å; D356-A539 WeakPolarHBondContact OD1-CB 3.41Å; D356-A539 PolarHBondContact OD1-N 3.3Å; D356-A539 PolarHBondContact OD2-N 3.12Å; I418-A539 HydrophobicContact CD1-CB 3.87Å; A539-N542 PolarHBondContact O-N 3.44Å; A539-R543 WeakPolarHBondContact O-CG 3.45Å; A539-R543 PolarHBondContact O-N 3.49Å
540	T	89.2	Confident	86.9	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.018	22%	0.224	C	C	.	.	H	α-helix	trans	-60.9	-48.3	177	-61.1	0	0	0	0	112.6	L354 D356 E359 F384 L388 S538 N542 R543 L544	L354-T540 HydrophobicContact CD2-CG2 3.97Å; D356-T540 PolarHBondContact OD1-N 3.4Å; D356-T540 PolarHBondContact OD1-OG1 3.36Å; E359-T540 HydrophobicContact CG-CG2 4.18Å; E359-T540 WeakPolarHBondContact OE1-CB 3.17Å; E359-T540 WeakPolarHBondContact OE1-CG2 3.49Å; E359-T540 PolarHBondContact OE1-OG1 3.33Å; F384-T540 HydrophobicContact CD1-CG2 4.24Å; F384-T540 HydrophobicContact CE1-CG2 3.38Å; F384-T540 HydrophobicContact CZ-CG2 4.15Å; L388-T540 HydrophobicContact CD2-CG2 4.02Å; S538-T540 PolarHBondContact O-N 3.47Å; T540-N542 VanDerWaalsContact C-N 3.34Å; T540-N542 PolarHBondContact O-N 3.28Å; T540-R543 WeakPolarHBondContact O-CB 3.35Å; T540-R543 PolarHBondContact O-N 3.44Å; T540-L544 PolarHBondContact O-N 3.3Å
541	F	91.4	Very high	87.3	Confident	1 Å²	1	38.7 Å²	38.7	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-40.4	176.4	177.6	-109.7	0	0	0	112.3	I345 K349 L354 H514 F537 S538 R543 L544 L545 F560 L563	I345-F541 HydrophobicContact CG2-CE2 3.9Å; K349-F541 HydrophobicContact CD-CD2 4.32Å; K349-F541 HydrophobicContact CD-CE2 3.99Å; L354-F541 HydrophobicContact CB-CB 4.34Å; L354-F541 HydrophobicContact CD1-CD2 4.25Å; H514-F541 AromaticContact NE2-CD1 3.93Å; H514-F541 AromaticContact NE2-CE1 3.59Å; H514-F541 AromaticContact NE2-CZ 3.87Å; F537-F541 HydrophobicContact CB-CD1 4.06Å; F537-F541 HydrophobicContact CD1-CD1 4.02Å; F537-F541 HydrophobicContact CD1-CE1 4.01Å; F537-F541 AromaticContact CD2-CD1 3.98Å; F537-F541 HydrophobicContact CD2-CD1 3.98Å; F537-F541 HydrophobicContact CD2-CE1 4.07Å; F537-F541 HydrophobicContact CE1-CE1 4.08Å; F537-F541 HydrophobicContact CE2-CE1 4.17Å; F537-F541 AromaticContact CG-CD1 3.76Å; F537-F541 HydrophobicContact CG-CD1 3.76Å; F537-F541 HydrophobicContact CG-CE1 4.05Å; F537-F541 HydrophobicContact CZ-CE1 4.21Å; S538-F541 PolarHBondContact O-N 3.45Å; S538-F541 WeakPolarHBondContact OG-CB 3.41Å; S538-F541 PolarHBondContact OG-N 3.45Å; F541-R543 VanDerWaalsContact C-N 3.34Å; F541-R543 PolarHBondContact O-N 3.43Å; F541-L544 PolarHBondContact O-N 3.04Å; F541-L545 HydrophobicContact CD1-CD1 3.92Å; F541-L545 HydrophobicContact CD1-CG 4.45Å; F541-L545 HydrophobicContact CE1-CD1 3.34Å; F541-L545 HydrophobicContact CE1-CG 4.02Å; F541-L545 HydrophobicContact CE2-CD1 4.39Å; F541-L545 HydrophobicContact CE2-CD2 4.49Å; F541-L545 HydrophobicContact CE2-CG 4.2Å; F541-L545 HydrophobicContact CZ-CD1 3.62Å; F541-L545 HydrophobicContact CZ-CD2 4.17Å; F541-L545 HydrophobicContact CZ-CG 3.88Å; F541-L545 PolarHBondContact O-N 3.33Å; F541-F560 HydrophobicContact CE1-CD2 4.13Å; F541-F560 HydrophobicContact CE1-CE2 4.01Å; F541-F560 HydrophobicContact CZ-CD2 4.18Å; F541-F560 HydrophobicContact CZ-CE2 4.19Å; F541-L563 HydrophobicContact CE2-CD2 3.94Å; F541-L563 HydrophobicContact CZ-CD2 3.57Å
542	N	91.2	Very high	87.8	Confident	30 Å²	30	31.3 Å²	31.3	16%	0.16	17%	0.169	C	C	.	.	H	α-helix	trans	-62.9	-42.3	176.7	-171.5	66.7	0	0	0	111.5	F537 S538 A539 T540 L545 E546	F537-N542 HydrophobicContact CB-CB 4.5Å; S538-N542 PolarHBondContact O-N 3.26Å; A539-N542 PolarHBondContact O-N 3.44Å; T540-N542 VanDerWaalsContact C-N 3.34Å; T540-N542 PolarHBondContact O-N 3.28Å; N542-L545 PolarHBondContact O-N 3.35Å; N542-E546 PolarHBondContact ND2-OE1 2.81Å; N542-E546 WeakPolarHBondContact O-CG 3.26Å; N542-E546 PolarHBondContact O-N 3.48Å
543	R	92.5	Very high	88.3	Confident	35 Å²	35	31.8 Å²	31.8	13%	0.132	17%	0.17	C	C	.	.	H	α-helix	trans	-59.9	-44.1	173.6	-76.8	173.6	67.7	-169.5	8.2	112.6	L388 E392 A539 T540 F541 L545 E546 L547	L388-R543 HydrophobicContact CD2-CB 4Å; E392-R543 WeakPolarHBondContact OE1-CB 3.23Å; E392-R543 IonicContact OE1-CZ 3.48Å; E392-R543 IonicContact OE1-NE 2.78Å; E392-R543 PolarHBondContact OE1-NE 3.4Å; E392-R543 IonicContact OE1-NH2 3.45Å; E392-R543 PolarHBondContact OE1-NH2 3.23Å; E392-R543 IonicContact OE2-CZ 3.63Å; E392-R543 IonicContact OE2-NE 3.83Å; E392-R543 PolarHBondContact OE2-NE 2.94Å; E392-R543 IonicContact OE2-NH2 2.82Å; E392-R543 PolarHBondContact OE2-NH2 2.68Å; A539-R543 WeakPolarHBondContact O-CG 3.45Å; A539-R543 PolarHBondContact O-N 3.49Å; T540-R543 WeakPolarHBondContact O-CB 3.35Å; T540-R543 PolarHBondContact O-N 3.44Å; F541-R543 VanDerWaalsContact C-N 3.34Å; F541-R543 PolarHBondContact O-N 3.43Å; R543-L545 PolarHBondContact O-N 2.92Å; R543-E546 PolarHBondContact O-N 3.24Å; R543-L547 WeakPolarHBondContact O-CB 3.43Å; R543-L547 PolarHBondContact O-N 3.37Å
544	L	94.8	Very high	88.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.5	-45.5	175.1	178.2	61.8	0	0	0	111.6	I345 L348 L354 F384 W387 L388 T540 F541 E546 L547 C548	I345-L544 HydrophobicContact CG1-CD2 4.44Å; I345-L544 HydrophobicContact CG1-CG 4.41Å; I345-L544 HydrophobicContact CG2-CD2 4.22Å; L348-L544 HydrophobicContact CB-CD2 4.18Å; L348-L544 HydrophobicContact CD1-CD1 3.99Å; L348-L544 HydrophobicContact CD1-CD2 4.08Å; L354-L544 HydrophobicContact CD1-CD2 3.63Å; F384-L544 HydrophobicContact CZ-CD2 4.42Å; W387-L544 HydrophobicContact CH2-CD1 3.81Å; W387-L544 HydrophobicContact CZ3-CD1 4.01Å; L388-L544 HydrophobicContact CD1-CB 4.43Å; L388-L544 HydrophobicContact CD1-CD1 4.39Å; T540-L544 PolarHBondContact O-N 3.3Å; F541-L544 PolarHBondContact O-N 3.04Å; L544-E546 PolarHBondContact O-N 3.47Å; L544-L547 PolarHBondContact O-N 2.67Å; L544-C548 WeakPolarHBondContact O-CB 3.43Å; L544-C548 PolarHBondContact O-N 2.91Å; L544-C548 PolarHBondContact O-SG 3.08Å; L544-C548 VanDerWaalsContact O-SG 3.33Å
545	L	94.5	Very high	89.3	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-45.1	175.9	-78.3	176.6	0	0	0	112	I345 F537 F541 N542 R543 S549 L559 F560 L563	I345-L545 HydrophobicContact CD1-CD2 4.19Å; F537-L545 HydrophobicContact CD2-CD1 4.33Å; F537-L545 HydrophobicContact CE2-CD1 4.03Å; F541-L545 HydrophobicContact CD1-CD1 3.92Å; F541-L545 HydrophobicContact CD1-CG 4.45Å; F541-L545 HydrophobicContact CE1-CD1 3.34Å; F541-L545 HydrophobicContact CE1-CG 4.02Å; F541-L545 HydrophobicContact CE2-CD1 4.39Å; F541-L545 HydrophobicContact CE2-CD2 4.49Å; F541-L545 HydrophobicContact CE2-CG 4.2Å; F541-L545 HydrophobicContact CZ-CD1 3.62Å; F541-L545 HydrophobicContact CZ-CD2 4.17Å; F541-L545 HydrophobicContact CZ-CG 3.88Å; F541-L545 PolarHBondContact O-N 3.33Å; N542-L545 PolarHBondContact O-N 3.35Å; R543-L545 PolarHBondContact O-N 2.92Å; L545-S549 WeakPolarHBondContact O-CB 3.16Å; L545-S549 PolarHBondContact O-N 3Å; L545-S549 PolarHBondContact O-OG 3.09Å; L545-L559 HydrophobicContact CD2-CD2 4.31Å; L545-L559 HydrophobicContact CD2-CG 4.35Å; L545-F560 HydrophobicContact CD1-CB 4.26Å; L545-F560 HydrophobicContact CD1-CD2 3.89Å; L545-F560 HydrophobicContact CD1-CG 4.43Å; L545-L563 HydrophobicContact CD2-CD2 4.14Å
546	E	93.6	Very high	89.9	Confident	83 Å²	83	26.5 Å²	26.5	39%	0.388	14%	0.139	S	C	.	.	H	α-helix	trans	-61.3	-48.3	177.6	-75.2	177.1	-167.5	0	0	111.1	N542 R543 L544 S549 K550 P556	N542-E546 PolarHBondContact ND2-OE1 2.81Å; N542-E546 WeakPolarHBondContact O-CG 3.26Å; N542-E546 PolarHBondContact O-N 3.48Å; R543-E546 PolarHBondContact O-N 3.24Å; L544-E546 PolarHBondContact O-N 3.47Å; E546-S549 PolarHBondContact O-N 2.82Å; E546-S549 PolarHBondContact O-OG 3.47Å; E546-K550 WeakPolarHBondContact O-CG 3.29Å; E546-K550 PolarHBondContact O-N 2.88Å; E546-P556 HydrophobicContact CG-CG 4.18Å
547	L	94.1	Very high	90.2	Very high	4 Å²	4	24.7 Å²	24.7	2%	0.021	13%	0.13	C	C	.	.	H	α-helix	trans	-55.2	-55.3	175.9	176	68.2	0	0	0	111.9	L388 N391 E392 M395 R543 L544 S549 K550 Y551	L388-L547 HydrophobicContact CD1-CD2 3.7Å; N391-L547 HydrophobicContact CB-CD1 4.07Å; N391-L547 HydrophobicContact CB-CD2 3.53Å; N391-L547 HydrophobicContact CB-CG 4.39Å; N391-L547 WeakPolarHBondContact O-CD1 3.42Å; E392-L547 HydrophobicContact CG-CD1 4.17Å; M395-L547 HydrophobicContact CB-CD1 4Å; M395-L547 HydrophobicContact CG-CD1 3.52Å; R543-L547 WeakPolarHBondContact O-CB 3.43Å; R543-L547 PolarHBondContact O-N 3.37Å; L544-L547 PolarHBondContact O-N 2.67Å; L547-S549 VanDerWaalsContact C-N 3.28Å; L547-S549 PolarHBondContact O-N 3.33Å; L547-K550 WeakPolarHBondContact O-CB 3.49Å; L547-K550 PolarHBondContact O-N 3.47Å; L547-K550 VanDerWaalsContact O-N 3.16Å; L547-Y551 HydrophobicContact CD1-CD2 4.26Å; L547-Y551 HydrophobicContact CD1-CE2 3.98Å; L547-Y551 HydrophobicContact CG-CD2 4.34Å; L547-Y551 HydrophobicContact CG-CE2 4.3Å; L547-Y551 PolarHBondContact O-N 3.19Å
548	C	96.1	Very high	90.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.7	-35.8	-179.3	-70.8	0	0	0	0	112	M341 I345 L544 K550 Y551 L552 L559	M341-C548 HydrophobicContact CG-CB 3.67Å; M341-C548 HydrophobicContact SD-CB 3.83Å; I345-C548 HydrophobicContact CD1-CB 3.86Å; I345-C548 HydrophobicContact CG1-CB 4.43Å; L544-C548 WeakPolarHBondContact O-CB 3.43Å; L544-C548 PolarHBondContact O-N 2.91Å; L544-C548 PolarHBondContact O-SG 3.08Å; L544-C548 VanDerWaalsContact O-SG 3.33Å; C548-K550 VanDerWaalsContact C-N 3.31Å; C548-K550 PolarHBondContact O-N 3.06Å; C548-Y551 PolarHBondContact O-N 3.42Å; C548-L552 PolarHBondContact O-N 3.39Å; C548-L552 VanDerWaalsContact O-N 3.11Å; C548-L559 HydrophobicContact CB-CD2 3.74Å
549	S	93.5	Very high	90.7	Very high	5 Å²	5	25.3 Å²	25.3	4%	0.035	13%	0.134	C	C	.	.	H	α-helix	trans	-66.5	-32.8	177.3	75.5	0	0	0	0	112.7	L545 E546 L547 L552 F553 C554 P556	L545-S549 WeakPolarHBondContact O-CB 3.16Å; L545-S549 PolarHBondContact O-N 3Å; L545-S549 PolarHBondContact O-OG 3.09Å; E546-S549 PolarHBondContact O-N 2.82Å; E546-S549 PolarHBondContact O-OG 3.47Å; L547-S549 VanDerWaalsContact C-N 3.28Å; L547-S549 PolarHBondContact O-N 3.33Å; S549-L552 PolarHBondContact O-N 3.06Å; S549-F553 PolarHBondContact O-N 2.84Å; S549-C554 WeakPolarHBondContact CB-O 3.32Å; S549-C554 PolarHBondContact O-N 2.93Å; S549-P556 WeakPolarHBondContact OG-CG 3.11Å
550	K	91	Very high	90.9	Very high	80 Å²	80	23.2 Å²	23.2	35%	0.348	12%	0.116	S	C	.	.	H	α-helix	trans	-67.2	-44.3	173.1	-68.4	173.8	173	-160.6	0	112.1	M395 E399 E546 L547 C548 L552 F553	M395-K550 HydrophobicContact CE-CB 3.8Å; E399-K550 WeakPolarHBondContact OE1-CD 3.42Å; E399-K550 IonicContact OE1-NZ 3.78Å; E399-K550 WeakPolarHBondContact OE2-CE 3.26Å; E399-K550 IonicContact OE2-NZ 2.6Å; E399-K550 PolarHBondContact OE2-NZ 2.88Å; E546-K550 WeakPolarHBondContact O-CG 3.29Å; E546-K550 PolarHBondContact O-N 2.88Å; L547-K550 WeakPolarHBondContact O-CB 3.49Å; L547-K550 PolarHBondContact O-N 3.47Å; L547-K550 VanDerWaalsContact O-N 3.16Å; C548-K550 VanDerWaalsContact C-N 3.31Å; C548-K550 PolarHBondContact O-N 3.06Å; K550-L552 PolarHBondContact O-N 3.13Å; K550-F553 PolarHBondContact O-N 3.44Å; K550-F553 VanDerWaalsContact O-N 3.12Å
551	Y	90.1	Very high	90.8	Very high	5 Å²	5	24.6 Å²	24.6	2%	0.02	12%	0.123	C	C	.	.	H	α-helix	trans	-57.3	-39.4	174.3	-91.7	-82.7	0	0	0	112	D293 L294 N391 M395 F464 L547 C548	D293-Y551 HydrophobicContact CB-CE1 4.35Å; D293-Y551 PolarHBondContact O-OH 2.91Å; L294-Y551 HydrophobicContact CD2-CD2 3.92Å; L294-Y551 HydrophobicContact CD2-CE2 3.51Å; N391-Y551 PolarHBondContact OD1-OH 3.41Å; M395-Y551 HydrophobicContact CE-CD2 4.15Å; M395-Y551 HydrophobicContact CE-CE2 4.44Å; M395-Y551 HydrophobicContact CE-CG 4.21Å; M395-Y551 HydrophobicContact CG-CD2 3.77Å; M395-Y551 HydrophobicContact CG-CE2 3.29Å; M395-Y551 HydrophobicContact SD-CD1 3.96Å; M395-Y551 HydrophobicContact SD-CD2 3.65Å; M395-Y551 HydrophobicContact SD-CE1 3.67Å; M395-Y551 HydrophobicContact SD-CE2 3.36Å; M395-Y551 WeakPolarHBondContact SD-CE2 3.39Å; M395-Y551 HydrophobicContact SD-CG 3.95Å; F464-Y551 HydrophobicContact CD2-CD1 4.44Å; F464-Y551 HydrophobicContact CD2-CE1 4.07Å; F464-Y551 HydrophobicContact CE1-CE1 4.38Å; F464-Y551 AromaticContact CE2-CD1 3.89Å; F464-Y551 HydrophobicContact CE2-CD1 3.89Å; F464-Y551 AromaticContact CE2-CE1 3.9Å; F464-Y551 HydrophobicContact CE2-CE1 3.9Å; F464-Y551 HydrophobicContact CG-CE1 4.33Å; F464-Y551 HydrophobicContact CZ-CD1 4.05Å; F464-Y551 AromaticContact CZ-CE1 3.99Å; F464-Y551 HydrophobicContact CZ-CE1 3.99Å; L547-Y551 HydrophobicContact CD1-CD2 4.26Å; L547-Y551 HydrophobicContact CD1-CE2 3.98Å; L547-Y551 HydrophobicContact CG-CD2 4.34Å; L547-Y551 HydrophobicContact CG-CE2 4.3Å; L547-Y551 PolarHBondContact O-N 3.19Å; C548-Y551 PolarHBondContact O-N 3.42Å
552	L	90.2	Very high	90.7	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-7.3	179.1	-69.4	175.7	0	0	0	114.2	L258 F290 E337 M338 M341 C548 S549 K550 C554 L559	L258-L552 WeakPolarHBondContact CB-O 3.45Å; L258-L552 HydrophobicContact CD2-CB 4.17Å; L258-L552 HydrophobicContact CD2-CD2 4.24Å; L258-L552 WeakPolarHBondContact CD2-O 3.45Å; F290-L552 HydrophobicContact CE1-CD2 4.24Å; F290-L552 HydrophobicContact CE2-CD2 4.31Å; F290-L552 HydrophobicContact CZ-CD2 3.65Å; E337-L552 HydrophobicContact CB-CD2 4.04Å; M338-L552 HydrophobicContact CB-CD1 4.29Å; M338-L552 HydrophobicContact CG-CD1 4.09Å; M341-L552 HydrophobicContact CB-CD1 3.71Å; M341-L552 HydrophobicContact CB-CD2 4.34Å; M341-L552 HydrophobicContact CB-CG 4.27Å; M341-L552 HydrophobicContact CE-CD2 4.36Å; M341-L552 HydrophobicContact CE-CG 4.22Å; M341-L552 HydrophobicContact CG-CD1 3.82Å; M341-L552 HydrophobicContact CG-CG 4.27Å; C548-L552 PolarHBondContact O-N 3.39Å; C548-L552 VanDerWaalsContact O-N 3.11Å; S549-L552 PolarHBondContact O-N 3.06Å; K550-L552 PolarHBondContact O-N 3.13Å; L552-C554 VanDerWaalsContact C-N 3.3Å; L552-C554 HydrophobicContact CB-CB 4.44Å; L552-C554 PolarHBondContact O-N 2.78Å; L552-L559 HydrophobicContact CD1-CD1 3.72Å; L552-L559 HydrophobicContact CD1-CD2 4.43Å
553	F	87.7	Confident	90.8	Very high	25 Å²	25	23.5 Å²	23.5	11%	0.11	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	44	-169.7	-161.8	-93.5	0	0	0	112.7	C191 R195 I255 S257 L258 S549 K550	C191-F553 HydrophobicContact CB-CB 3.75Å; C191-F553 HydrophobicContact CB-CD1 3.86Å; C191-F553 HydrophobicContact CB-CD2 4.3Å; C191-F553 HydrophobicContact CB-CG 3.7Å; R195-F553 HydrophobicContact CB-CD2 4.43Å; R195-F553 HydrophobicContact CB-CE2 4.08Å; R195-F553 HydrophobicContact CG-CE2 4.17Å; I255-F553 HydrophobicContact CB-CE1 3.58Å; I255-F553 HydrophobicContact CB-CZ 3.79Å; I255-F553 HydrophobicContact CG2-CD1 3.83Å; I255-F553 HydrophobicContact CG2-CE1 3.2Å; I255-F553 HydrophobicContact CG2-CZ 3.92Å; I255-F553 WeakPolarHBondContact O-CE1 3.3Å; I255-F553 WeakPolarHBondContact O-CZ 3.4Å; S257-F553 CarbonylContact C-O 3.45Å; L258-F553 PolarHBondContact N-O 3.5Å; S549-F553 PolarHBondContact O-N 2.84Å; K550-F553 PolarHBondContact O-N 3.44Å; K550-F553 VanDerWaalsContact O-N 3.12Å
554	C	87.6	Confident	90.6	Very high	13 Å²	13	22.1 Å²	22.1	9%	0.088	11%	0.113	C	C	.	.	S	Bend	trans	-128.1	169.6	177.3	76.7	0	0	0	0	112.2	L258 M338 S549 L552	L258-C554 HydrophobicContact CB-CB 4.39Å; M338-C554 HydrophobicContact CE-CB 4.12Å; S549-C554 WeakPolarHBondContact CB-O 3.32Å; S549-C554 PolarHBondContact O-N 2.93Å; L552-C554 VanDerWaalsContact C-N 3.3Å; L552-C554 HydrophobicContact CB-CB 4.44Å; L552-C554 PolarHBondContact O-N 2.78Å
555	L	86.4	Confident	90.2	Very high	90 Å²	90	25 Å²	25	47%	0.471	13%	0.128	S	C	.	.			trans	-79.7	142.3	174.2	-63.7	174	0	0	0	110.3	N557 L558 L559	L555-N557 VanDerWaalsContact C-N 3.26Å; L555-N557 WeakPolarHBondContact CB-OD1 3.31Å; L555-N557 PolarHBondContact O-N 3.4Å; L555-L558 PolarHBondContact O-N 3.24Å; L555-L558 VanDerWaalsContact O-N 3.13Å; L555-L559 PolarHBondContact O-N 3.39Å
556	P	89.5	Confident	90	Very high	34 Å²	34	25.3 Å²	25.3	22%	0.221	13%	0.13	C	C	.	.	H	α-helix	trans	-56.9	-37.4	178.3	-24.5	30.4	0	0	0	113.5	F529 E546 S549 L558 L559 F560	F529-P556 HydrophobicContact CE1-CB 4.39Å; F529-P556 HydrophobicContact CZ-CB 4.06Å; E546-P556 HydrophobicContact CG-CG 4.18Å; S549-P556 WeakPolarHBondContact OG-CG 3.11Å; P556-L558 VanDerWaalsContact C-N 3.32Å; P556-L558 PolarHBondContact O-N 3.49Å; P556-L559 PolarHBondContact O-N 2.86Å; P556-F560 WeakPolarHBondContact O-CB 3.47Å; P556-F560 PolarHBondContact O-N 2.91Å
557	N	86.6	Confident	89.7	Confident	37 Å²	37	21.6 Å²	21.6	20%	0.198	11%	0.112	C	C	.	.	H	α-helix	trans	-63	-38.1	178.9	68.8	-24.7	0	0	0	112.2	F529 L555 L561	F529-N557 HydrophobicContact CB-CB 4.21Å; F529-N557 HydrophobicContact CD1-CB 3.62Å; F529-N557 HydrophobicContact CD2-CB 4.04Å; F529-N557 HydrophobicContact CE1-CB 3.96Å; F529-N557 HydrophobicContact CE2-CB 4.34Å; F529-N557 HydrophobicContact CG-CB 3.66Å; F529-N557 HydrophobicContact CZ-CB 4.31Å; L555-N557 VanDerWaalsContact C-N 3.26Å; L555-N557 WeakPolarHBondContact CB-OD1 3.31Å; L555-N557 PolarHBondContact O-N 3.4Å; N557-L561 VanDerWaalsContact O-CG 3.28Å; N557-L561 WeakPolarHBondContact O-CG 3.39Å; N557-L561 PolarHBondContact O-N 3.04Å
558	L	86	Confident	89.1	Confident	42 Å²	42	25.8 Å²	25.8	22%	0.22	13%	0.133	C	C	.	.	H	α-helix	trans	-69.8	-43.2	178.3	-172.6	64.7	0	0	0	110.4	S259 M338 L555 P556 F560 L561 V562	S259-L558 VanDerWaalsContact OG-CD2 3.25Å; S259-L558 WeakPolarHBondContact OG-CD2 3.39Å; M338-L558 HydrophobicContact CE-CB 4.03Å; M338-L558 HydrophobicContact CE-CD2 4.02Å; M338-L558 HydrophobicContact CE-CG 3.66Å; L555-L558 PolarHBondContact O-N 3.24Å; L555-L558 VanDerWaalsContact O-N 3.13Å; P556-L558 VanDerWaalsContact C-N 3.32Å; P556-L558 PolarHBondContact O-N 3.49Å; L558-F560 VanDerWaalsContact C-N 3.31Å; L558-F560 PolarHBondContact O-N 3.42Å; L558-L561 PolarHBondContact O-N 3.08Å; L558-V562 WeakPolarHBondContact O-CG2 3.14Å; L558-V562 PolarHBondContact O-N 2.91Å; L558-V562 VanDerWaalsContact O-N 3.13Å
559	L	91.6	Very high	88.5	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.3	-43.5	175.4	-174.9	60.6	0	0	0	111.4	M338 C342 I345 L545 C548 L552 L555 P556 V562 L563	M338-L559 HydrophobicContact CE-CB 3.9Å; M338-L559 HydrophobicContact CE-CD1 4.05Å; M338-L559 VanDerWaalsContact CE-N 3.3Å; M338-L559 HydrophobicContact CG-CD1 3.79Å; C342-L559 VanDerWaalsContact SG-CD1 3.53Å; I345-L559 HydrophobicContact CD1-CD2 3.89Å; I345-L559 HydrophobicContact CD1-CG 4.25Å; L545-L559 HydrophobicContact CD2-CD2 4.31Å; L545-L559 HydrophobicContact CD2-CG 4.35Å; C548-L559 HydrophobicContact CB-CD2 3.74Å; L552-L559 HydrophobicContact CD1-CD1 3.72Å; L552-L559 HydrophobicContact CD1-CD2 4.43Å; L555-L559 PolarHBondContact O-N 3.39Å; P556-L559 PolarHBondContact O-N 2.86Å; L559-V562 PolarHBondContact O-N 2.94Å; L559-L563 WeakPolarHBondContact O-CB 3.34Å; L559-L563 PolarHBondContact O-N 3.35Å
560	F	91.6	Very high	87.9	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.7	-40.6	176.5	-179.2	-105.7	0	0	0	113	H514 I517 F529 M532 F537 F541 L545 P556 L558 V562 L563 Q564	H514-F560 HydrophobicContact CB-CE2 4.49Å; H514-F560 HydrophobicContact CB-CZ 4.09Å; H514-F560 AromaticContact CD2-CE2 3.98Å; I517-F560 HydrophobicContact CD1-CD1 3.88Å; I517-F560 HydrophobicContact CD1-CE1 3.67Å; I517-F560 HydrophobicContact CG1-CE1 4.19Å; F529-F560 HydrophobicContact CD2-CB 4.04Å; F529-F560 AromaticContact CD2-CD1 3.62Å; F529-F560 HydrophobicContact CD2-CD1 3.62Å; F529-F560 HydrophobicContact CD2-CE1 4.39Å; F529-F560 HydrophobicContact CD2-CG 4Å; F529-F560 HydrophobicContact CE2-CB 3.49Å; F529-F560 VanDerWaalsContact CE2-CB 3.49Å; F529-F560 AromaticContact CE2-CD1 3.81Å; F529-F560 HydrophobicContact CE2-CD1 3.81Å; F529-F560 AromaticContact CE2-CG 3.68Å; F529-F560 HydrophobicContact CE2-CG 3.68Å; F529-F560 HydrophobicContact CZ-CB 4.48Å; M532-F560 HydrophobicContact CE-CE1 3.95Å; M532-F560 HydrophobicContact CE-CZ 3.74Å; M532-F560 HydrophobicContact SD-CE1 4.41Å; F537-F560 HydrophobicContact CE1-CD2 4.35Å; F537-F560 HydrophobicContact CE1-CE1 4.28Å; F537-F560 AromaticContact CE1-CE2 3.56Å; F537-F560 HydrophobicContact CE1-CE2 3.56Å; F537-F560 AromaticContact CE1-CZ 3.52Å; F537-F560 HydrophobicContact CE1-CZ 3.52Å; F537-F560 HydrophobicContact CE2-CD2 4.13Å; F537-F560 HydrophobicContact CE2-CE2 4.15Å; F537-F560 HydrophobicContact CE2-CG 4.41Å; F537-F560 HydrophobicContact CE2-CZ 4.42Å; F537-F560 HydrophobicContact CZ-CD1 4.01Å; F537-F560 AromaticContact CZ-CD2 3.61Å; F537-F560 HydrophobicContact CZ-CD2 3.61Å; F537-F560 AromaticContact CZ-CE1 3.63Å; F537-F560 HydrophobicContact CZ-CE1 3.63Å; F537-F560 AromaticContact CZ-CE2 3.22Å; F537-F560 HydrophobicContact CZ-CE2 3.22Å; F537-F560 AromaticContact CZ-CG 3.99Å; F537-F560 HydrophobicContact CZ-CG 3.99Å; F537-F560 AromaticContact CZ-CZ 3.24Å; F537-F560 HydrophobicContact CZ-CZ 3.24Å; F541-F560 HydrophobicContact CE1-CD2 4.13Å; F541-F560 HydrophobicContact CE1-CE2 4.01Å; F541-F560 HydrophobicContact CZ-CD2 4.18Å; F541-F560 HydrophobicContact CZ-CE2 4.19Å; L545-F560 HydrophobicContact CD1-CB 4.26Å; L545-F560 HydrophobicContact CD1-CD2 3.89Å; L545-F560 HydrophobicContact CD1-CG 4.43Å; P556-F560 WeakPolarHBondContact O-CB 3.47Å; P556-F560 PolarHBondContact O-N 2.91Å; L558-F560 VanDerWaalsContact C-N 3.31Å; L558-F560 PolarHBondContact O-N 3.42Å; F560-V562 VanDerWaalsContact C-N 3.31Å; F560-V562 PolarHBondContact O-N 3Å; F560-L563 HydrophobicContact CD2-CD2 4.24Å; F560-L563 WeakPolarHBondContact O-CB 3.32Å; F560-L563 PolarHBondContact O-N 3.42Å; F560-Q564 HydrophobicContact CD1-CG 4.1Å; F560-Q564 HydrophobicContact CD2-CG 4.45Å; F560-Q564 HydrophobicContact CE1-CG 3.58Å; F560-Q564 VanDerWaalsContact CE1-NE2 3.31Å; F560-Q564 VanDerWaalsContact CE1-OE1 3.29Å; F560-Q564 HydrophobicContact CE2-CG 3.96Å; F560-Q564 HydrophobicContact CZ-CG 3.48Å; F560-Q564 VanDerWaalsContact CZ-CG 3.48Å; F560-Q564 VanDerWaalsContact CZ-NE2 3.26Å; F560-Q564 WeakPolarHBondContact O-CG 3.21Å; F560-Q564 PolarHBondContact O-N 3.37Å
561	L	87.2	Confident	86.9	Confident	32 Å²	32	29.1 Å²	29.1	17%	0.168	15%	0.152	C	C	.	.	H	α-helix	trans	-62.7	-39.2	176.4	-73.4	171.2	0	0	0	112.2	I517 N557 L558 N565	I517-L561 HydrophobicContact CB-CD2 4.19Å; I517-L561 HydrophobicContact CD1-CD2 4.49Å; I517-L561 HydrophobicContact CG2-CD2 4.34Å; N557-L561 VanDerWaalsContact O-CG 3.28Å; N557-L561 WeakPolarHBondContact O-CG 3.39Å; N557-L561 PolarHBondContact O-N 3.04Å; L558-L561 PolarHBondContact O-N 3.08Å; L561-N565 VanDerWaalsContact O-CG 3.3Å; L561-N565 PolarHBondContact O-N 3.19Å; L561-N565 PolarHBondContact O-ND2 3.19Å
562	V	89.6	Confident	85.3	Confident	9 Å²	9	34.7 Å²	34.7	6%	0.055	19%	0.188	C	C	.	.	H	α-helix	trans	-64.9	-46.4	174.2	175.8	0	0	0	0	110.4	V334 M338 L558 L559 F560 Q564 N565 M566	V334-V562 HydrophobicContact CB-CG2 4.42Å; V334-V562 HydrophobicContact CG1-CB 4.3Å; V334-V562 HydrophobicContact CG1-CG1 3.57Å; V334-V562 HydrophobicContact CG1-CG2 3.67Å; V334-V562 HydrophobicContact CG2-CG2 3.8Å; M338-V562 HydrophobicContact CE-CG2 4.17Å; M338-V562 HydrophobicContact CG-CG1 4.43Å; M338-V562 HydrophobicContact CG-CG2 4.31Å; M338-V562 HydrophobicContact SD-CG2 3.95Å; L558-V562 WeakPolarHBondContact O-CG2 3.14Å; L558-V562 PolarHBondContact O-N 2.91Å; L558-V562 VanDerWaalsContact O-N 3.13Å; L559-V562 PolarHBondContact O-N 2.94Å; F560-V562 VanDerWaalsContact C-N 3.31Å; F560-V562 PolarHBondContact O-N 3Å; V562-Q564 VanDerWaalsContact C-N 3.34Å; V562-Q564 PolarHBondContact O-N 2.97Å; V562-N565 PolarHBondContact O-N 2.78Å; V562-N565 VanDerWaalsContact O-N 3.16Å; V562-M566 HydrophobicContact CG1-SD 4.01Å; V562-M566 WeakPolarHBondContact O-CG 3.36Å; V562-M566 PolarHBondContact O-N 3.43Å
563	L	92	Very high	83.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-55.6	-47.4	176.4	179.4	69.9	0	0	0	111.7	C342 I345 I346 F541 L545 L559 F560 N565 M566 E567	C342-L563 HydrophobicContact CB-CD1 4.13Å; I345-L563 HydrophobicContact CB-CD1 4.26Å; I345-L563 HydrophobicContact CG2-CD1 4Å; I345-L563 HydrophobicContact CG2-CD2 3.83Å; I346-L563 HydrophobicContact CD1-CD1 3.96Å; I346-L563 HydrophobicContact CG1-CD1 3.41Å; I346-L563 VanDerWaalsContact CG1-CD1 3.41Å; F541-L563 HydrophobicContact CE2-CD2 3.94Å; F541-L563 HydrophobicContact CZ-CD2 3.57Å; L545-L563 HydrophobicContact CD2-CD2 4.14Å; L559-L563 WeakPolarHBondContact O-CB 3.34Å; L559-L563 PolarHBondContact O-N 3.35Å; F560-L563 HydrophobicContact CD2-CD2 4.24Å; F560-L563 WeakPolarHBondContact O-CB 3.32Å; F560-L563 PolarHBondContact O-N 3.42Å; L563-N565 VanDerWaalsContact C-N 3.31Å; L563-N565 PolarHBondContact O-N 3.49Å; L563-M566 PolarHBondContact O-N 2.99Å; L563-E567 PolarHBondContact O-N 3.41Å; L563-E567 WeakPolarHBondContact O-CG 3.36Å; L563-E567 HydrophobicContact CG-CG 4.45Å; L563-E567 HydrophobicContact CD1-CG 4.46Å
564	Q	88.9	Confident	81.4	Confident	5 Å²	5	43 Å²	43	2%	0.023	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-41.1	177.8	-73.6	-166.1	-56.7	0	0	112.4	P515 F560 V562 M566 E567 M568	P515-Q564 PolarHBondContact O-NE2 3.29Å; F560-Q564 HydrophobicContact CD1-CG 4.1Å; F560-Q564 HydrophobicContact CD2-CG 4.45Å; F560-Q564 HydrophobicContact CE1-CG 3.58Å; F560-Q564 VanDerWaalsContact CE1-NE2 3.31Å; F560-Q564 VanDerWaalsContact CE1-OE1 3.29Å; F560-Q564 HydrophobicContact CE2-CG 3.96Å; F560-Q564 HydrophobicContact CZ-CG 3.48Å; F560-Q564 VanDerWaalsContact CZ-CG 3.48Å; F560-Q564 VanDerWaalsContact CZ-NE2 3.26Å; F560-Q564 WeakPolarHBondContact O-CG 3.21Å; F560-Q564 PolarHBondContact O-N 3.37Å; V562-Q564 VanDerWaalsContact C-N 3.34Å; V562-Q564 PolarHBondContact O-N 2.97Å; Q564-M566 VanDerWaalsContact C-N 3.35Å; Q564-E567 PolarHBondContact O-N 3.49Å; Q564-M568 WeakPolarHBondContact O-CG 3.45Å; Q564-M568 PolarHBondContact O-N 3.01Å; Q564-M568 VanDerWaalsContact O-N 3.11Å
565	N	86.6	Confident	79.2	Confident	60 Å²	60	47.7 Å²	47.7	32%	0.321	27%	0.274	S	S	.	.	H	α-helix	trans	-63.8	-42.4	177.9	-68.7	-22.9	0	0	0	111.6	L561 V562 L563 M568 E569	L561-N565 VanDerWaalsContact O-CG 3.3Å; L561-N565 PolarHBondContact O-N 3.19Å; L561-N565 PolarHBondContact O-ND2 3.19Å; V562-N565 PolarHBondContact O-N 2.78Å; V562-N565 VanDerWaalsContact O-N 3.16Å; L563-N565 VanDerWaalsContact C-N 3.31Å; L563-N565 PolarHBondContact O-N 3.49Å; N565-M568 HydrophobicContact CB-CE 4.38Å; N565-M568 PolarHBondContact O-N 3.19Å; N565-M568 WeakPolarHBondContact OD1-CE 3.39Å; N565-E569 PolarHBondContact O-N 2.75Å
566	M	89.5	Confident	77	Confident	8 Å²	8	49 Å²	49	4%	0.039	27%	0.274	C	S	.	.	H	α-helix	trans	-69.3	-38.5	177.3	-64.5	179.3	67.7	0	0	112.1	L311 V313 K339 C342 V343 I346 V562 L563 Q564 M568 E569 L570	L311-M566 HydrophobicContact CD1-CE 3.62Å; L311-M566 WeakPolarHBondContact CD2-O 3.33Å; V313-M566 HydrophobicContact CG2-CE 3.76Å; K339-M566 HydrophobicContact CB-CE 4.14Å; K339-M566 HydrophobicContact CB-SD 3.99Å; K339-M566 HydrophobicContact CG-SD 4.23Å; C342-M566 HydrophobicContact CB-CE 4.32Å; C342-M566 HydrophobicContact CB-SD 3.5Å; C342-M566 VanDerWaalsContact CB-SD 3.5Å; V343-M566 HydrophobicContact CG2-CE 3.5Å; V343-M566 VanDerWaalsContact CG2-CE 3.5Å; I346-M566 HydrophobicContact CD1-CB 4.12Å; V562-M566 HydrophobicContact CG1-SD 4.01Å; V562-M566 WeakPolarHBondContact O-CG 3.36Å; V562-M566 PolarHBondContact O-N 3.43Å; L563-M566 PolarHBondContact O-N 2.99Å; Q564-M566 VanDerWaalsContact C-N 3.35Å; M566-M568 VanDerWaalsContact C-N 3.25Å; M566-M568 PolarHBondContact O-N 2.65Å; M566-E569 WeakPolarHBondContact O-CB 3.44Å; M566-E569 VanDerWaalsContact O-N 3.12Å; M566-E569 PolarHBondContact O-N 3.37Å; M566-L570 PolarHBondContact O-N 2.81Å
567	E	87.4	Confident	74.6	Confident	5 Å²	5	52.5 Å²	52.5	2%	0.023	30%	0.297	C	S	.	.	H	α-helix	trans	-61.2	-33.3	174.6	-76.1	-173.1	153.3	0	0	112.3	I346 K349 Y511 F513 L563 Q564 E569 L570	I346-E567 HydrophobicContact CD1-CG 4.18Å; I346-E567 HydrophobicContact CG1-CG 4.15Å; K349-E567 IonicContact NZ-OE1 3Å; K349-E567 PolarHBondContact NZ-OE1 2.83Å; K349-E567 IonicContact NZ-OE2 2.78Å; Y511-E567 HydrophobicContact CE1-CG 4.26Å; Y511-E567 VanDerWaalsContact CE1-OE1 3.32Å; Y511-E567 WeakPolarHBondContact CE1-OE1 3.47Å; Y511-E567 PolarHBondContact OH-OE1 2.91Å; F513-E567 HydrophobicContact CD1-CB 4.21Å; F513-E567 HydrophobicContact CE1-CB 4.2Å; L563-E567 PolarHBondContact O-N 3.41Å; L563-E567 WeakPolarHBondContact O-CG 3.36Å; L563-E567 HydrophobicContact CG-CG 4.45Å; L563-E567 HydrophobicContact CD1-CG 4.46Å; Q564-E567 PolarHBondContact O-N 3.49Å; E567-E569 VanDerWaalsContact C-N 3.32Å; E567-E569 PolarHBondContact O-N 3.05Å; E567-L570 PolarHBondContact O-N 2.66Å
568	M	83	Confident	72.3	Confident	92 Å²	92	62.2 Å²	62.2	45%	0.453	33%	0.33	S	S	.	.	H	α-helix	trans	-65.6	-34.9	174.9	-72.5	-170.8	-65.8	0	0	112.5	F516 Q564 N565 M566 L570 T571	F516-M568 HydrophobicContact CD2-CE 4.25Å; F516-M568 HydrophobicContact CD2-SD 3.99Å; F516-M568 HydrophobicContact CE2-CE 3.57Å; F516-M568 HydrophobicContact CE2-SD 3.87Å; F516-M568 HydrophobicContact CZ-CE 4.3Å; Q564-M568 WeakPolarHBondContact O-CG 3.45Å; Q564-M568 PolarHBondContact O-N 3.01Å; Q564-M568 VanDerWaalsContact O-N 3.11Å; N565-M568 HydrophobicContact CB-CE 4.38Å; N565-M568 PolarHBondContact O-N 3.19Å; N565-M568 WeakPolarHBondContact OD1-CE 3.39Å; M566-M568 VanDerWaalsContact C-N 3.25Å; M566-M568 PolarHBondContact O-N 2.65Å; M568-L570 VanDerWaalsContact C-N 3.31Å; M568-T571 PolarHBondContact O-N 3.03Å; M568-T571 VanDerWaalsContact O-N 3.17Å; M568-T571 PolarHBondContact O-OG1 3.19Å
569	E	83	Confident	70.1	Confident	104 Å²	104	69.6 Å²	69.6	49%	0.486	36%	0.357	S	S	.	.	H	α-helix	trans	-68.4	-31.7	177.3	-67.1	173.8	-166.2	0	0	111.7	L311 N565 M566 E567 T571	L311-E569 HydrophobicContact CD2-CB 3.83Å; N565-E569 PolarHBondContact O-N 2.75Å; M566-E569 WeakPolarHBondContact O-CB 3.44Å; M566-E569 VanDerWaalsContact O-N 3.12Å; M566-E569 PolarHBondContact O-N 3.37Å; E567-E569 VanDerWaalsContact C-N 3.32Å; E567-E569 PolarHBondContact O-N 3.05Å; E569-T571 PolarHBondContact O-N 2.78Å
570	L	79.6	Confident	67.4	Low	26 Å²	26	78.7 Å²	78.7	14%	0.136	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-10.1	173	-70.6	173.9	0	0	0	114	V307 L310 L311 I346 M566 E567 M568 P572	V307-L570 HydrophobicContact CG1-CD1 4.15Å; V307-L570 HydrophobicContact CG1-CD2 4.47Å; L310-L570 HydrophobicContact CB-CD2 3.88Å; L311-L570 HydrophobicContact CD2-CD1 4.35Å; L311-L570 HydrophobicContact CD2-CD2 3.66Å; L311-L570 HydrophobicContact CD2-CG 3.54Å; L311-L570 HydrophobicContact CG-CD2 3.74Å; L311-L570 HydrophobicContact CG-CG 4.09Å; I346-L570 HydrophobicContact CD1-CD1 4.01Å; I346-L570 HydrophobicContact CG2-CD1 3.65Å; M566-L570 PolarHBondContact O-N 2.81Å; E567-L570 PolarHBondContact O-N 2.66Å; M568-L570 VanDerWaalsContact C-N 3.31Å; L570-P572 WeakPolarHBondContact O-CD 3.47Å
571	T	71.4	Confident	64.7	Low	25 Å²	25	90 Å²	90	15%	0.153	44%	0.439	C	S	.	.			trans	-105.3	62.7	178	50.2	0	0	0	0	113.2	F513 M568 E569 S573 L574	F513-T571 HydrophobicContact CD1-CG2 4.2Å; F513-T571 HydrophobicContact CD2-CG2 4.47Å; F513-T571 HydrophobicContact CE1-CG2 3.42Å; F513-T571 VanDerWaalsContact CE1-CG2 3.42Å; F513-T571 HydrophobicContact CE2-CG2 3.74Å; F513-T571 HydrophobicContact CZ-CG2 3.14Å; M568-T571 PolarHBondContact O-N 3.03Å; M568-T571 VanDerWaalsContact O-N 3.17Å; M568-T571 PolarHBondContact O-OG1 3.19Å; E569-T571 PolarHBondContact O-N 2.78Å; T571-S573 PolarHBondContact O-N 3Å; T571-L574 HydrophobicContact CG2-CD1 4.49Å
572	P	55.5	Low	62.4	Low	121 Å²	121	95.7 Å²	95.7	79%	0.786	47%	0.468	S	S	*	.	S	Bend	trans	-72.4	-11.3	176.3	27.3	-29.8	0	0	0	113.4	L570	L570-P572 WeakPolarHBondContact O-CD 3.47Å
573	S	49.5	Very low	59.8	Low	105 Å²	105	102.9 Å²	102.9	73%	0.734	51%	0.505	S	S	*	.	S	Bend	trans	-124.7	-9.8	-171.5	64.4	0	0	0	0	116.9	T571 S575	T571-S573 PolarHBondContact O-N 3Å; S573-S575 PolarHBondContact O-N 3.27Å
574	L	46.9	Very low	57	Low	95 Å²	95	110.9 Å²	110.9	50%	0.497	55%	0.547	S	S	.	.			trans	-87.4	88.5	169.1	-75.5	165.1	0	0	0	106.5	F513 T571 Y576	F513-L574 HydrophobicContact CE2-CD1 4.44Å; T571-L574 HydrophobicContact CG2-CD1 4.49Å; L574-Y576 PolarHBondContact O-N 3.2Å
575	S	40.9	Very low	54.5	Low	111 Å²	111	124 Å²	124	78%	0.776	60%	0.604	S	S	*	*			trans	-50.5	88	160.6	50.7	0	0	0	0	108	S573 P577	S573-S575 PolarHBondContact O-N 3.27Å; S575-P577 WeakPolarHBondContact O-CD 3.03Å
576	Y	39.8	Very low	52.9	Low	119 Å²	119	127.2 Å²	127.2	47%	0.467	62%	0.618	S	S	.	*			trans	-53.9	114.8	171.6	-101.8	-91.4	0	0	0	104.4	F513 L574 R578	F513-Y576 WeakPolarHBondContact CB-OH 3.26Å; L574-Y576 PolarHBondContact O-N 3.2Å; Y576-R578 VanDerWaalsContact C-N 3.31Å; Y576-R578 PolarHBondContact O-N 3.02Å
577	P	39.8	Very low	51	Low	107 Å²	107	133.5 Å²	133.5	70%	0.695	65%	0.649	S	S	*	*			trans	-60.1	110.5	170.3	5.6	2.7	0	0	0	103.5	S575 Y579	S575-P577 WeakPolarHBondContact O-CD 3.03Å; P577-Y579 PolarHBondContact O-N 3.3Å
578	R	38	Very low	48.9	Very low	240 Å²	240	140.6 Å²	140.6	91%	0.906	68%	0.684	S	S	*	*			trans	-35.5	106.6	177.8	-79.6	178.1	172.4	168.7	-2.3	106.9	Y576 K580	Y576-R578 VanDerWaalsContact C-N 3.31Å; Y576-R578 PolarHBondContact O-N 3.02Å; R578-K580 PolarHBondContact O-N 2.99Å
579	Y	39.5	Very low	46.9	Very low	197 Å²	197	143.5 Å²	143.5	77%	0.773	70%	0.697	S	S	*	*			trans	-57.4	97.3	-178.3	-114.6	-97.2	0	0	0	105.9	P577 R581	P577-Y579 PolarHBondContact O-N 3.3Å; Y579-R581 PolarHBondContact O-N 2.77Å
580	K	35.8	Very low	44.7	Very low	192 Å²	192	145.9 Å²	145.9	84%	0.835	71%	0.71	S	S	*	*			trans	-76	87.9	-174.1	-157.7	-176.7	-168	-177	0	104.5	R578 I582	R578-K580 PolarHBondContact O-N 2.99Å; K580-I582 WeakPolarHBondContact O-CG1 3.39Å; K580-I582 PolarHBondContact O-N 3.23Å
581	R	34.9	Very low	42.4	Very low	236 Å²	236	153.9 Å²	153.9	89%	0.891	75%	0.749	S	S	*	*			trans	14.6	78	170.2	-77.2	-178	179.8	162.1	-0.7	113	Y579 L583	Y579-R581 PolarHBondContact O-N 2.77Å; R581-L583 PolarHBondContact O-N 2.78Å
582	I	38.8	Very low	40.3	Very low	153 Å²	153	163.1 Å²	163.1	79%	0.785	79%	0.791	S	S	*	*			trans	-92.2	67.3	161.1	-52.6	-179.8	0	0	0	106.3	K580	K580-I582 WeakPolarHBondContact O-CG1 3.39Å; K580-I582 PolarHBondContact O-N 3.23Å
583	L	35	Very low	39.1	Very low	159 Å²	159	166.4 Å²	166.4	83%	0.832	79%	0.792	S	S	*	*			trans	-149.4	78.2	162.5	-85.5	176.8	0	0	0	104.7	R581	R581-L583 PolarHBondContact O-N 2.78Å
584	L	33.7	Very low	38.3	Very low	169 Å²	169	171.5 Å²	171.5	89%	0.885	80%	0.796	S	S	*	*			trans	-176.9	72.4	158.5	-95.3	172.3	0	0	0	108
585	K	36.1	Very low	37.5	Very low	280 Å²	280	178.5 Å²	178.5	100%	1.217	82%	0.824	S	S	*	*			trans	-144.8	0	141.4	-84.9	-167.5	179.6	-178.6	0	105.3

Retrieved 585 of 585 residues in 661.2 ms (Link to these results)

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