A0A087XMA9_POEFO Loading...

Choline transporter-like protein

Choline transporter.

AlphaFold DB , UniProt , Accession A0A087XMA9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 654 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	46.5	Very low	55.5	Low	239 Å²	239	97.9 Å²	97.9	100%	1.177	61%	0.614	S	S	*	*				0	13.2	0	-70.9	-164.2	-99.3	0	0	114.1
2	G	56.3	Low	56.6	Low	87 Å²	87	100.8 Å²	100.8	90%	0.897	62%	0.622	S	S	*	*			trans	-85.3	-15.6	-174.9	0	0	0	0	0	117.5
3	C	66.4	Low	58	Low	43 Å²	43	94.3 Å²	94.3	29%	0.291	58%	0.579	S	S	.	*	S	Bend	trans	-100.9	-27.9	-178.7	-69.8	0	0	0	0	113.8	S5 C511 C515	C3-S5 PolarHBondContact O-N 3.47Å; C3-C511 HydrophobicContact CB-CB 3.44Å; C3-C511 VanDerWaalsContact CB-CB 3.44Å; C3-C511 WeakPolarHBondContact CB-SG 3.32Å; C3-C511 WeakPolarHBondContact SG-CA 3.32Å; C3-C511 WeakPolarHBondContact SG-CB 3.46Å; C3-C511 CovalentContact SG-SG 2.06Å; C3-C511 PolarHBondContact SG-SG 3.11Å; C3-C515 PolarHBondContact O-SG 3.29Å
4	C	65.8	Low	59.2	Low	61 Å²	61	94.4 Å²	94.4	41%	0.412	57%	0.567	S	S	.	*			trans	-101.5	89.6	-172.5	-46.2	0	0	0	0	109.6	C515	C4-C515 WeakPolarHBondContact CA-SG 3.48Å; C4-C515 HydrophobicContact CB-CB 4.05Å; C4-C515 WeakPolarHBondContact CB-SG 3.48Å; C4-C515 PolarHBondContact N-SG 3.34Å; C4-C515 VanDerWaalsContact SG-CA 3.53Å; C4-C515 WeakPolarHBondContact SG-CB 3.39Å; C4-C515 CovalentContact SG-SG 2.04Å; C4-C515 PolarHBondContact SG-SG 2.94Å
5	S	57.2	Low	59.9	Low	67 Å²	67	89.9 Å²	89.9	47%	0.469	54%	0.541	S	S	.	.			trans	-74.3	140.1	168.1	-177.3	0	0	0	0	109.5	C3 T7 E8	C3-S5 PolarHBondContact O-N 3.47Å; S5-T7 PolarHBondContact O-N 3.4Å; S5-T7 PolarHBondContact OG-N 3.25Å; S5-T7 PolarHBondContact OG-OG1 3.07Å; S5-E8 PolarHBondContact O-N 3.04Å
6	S	51.1	Low	60.2	Low	125 Å²	125	91.1 Å²	91.1	87%	0.874	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-7.2	175.1	47.9	0	0	0	0	114.1
7	T	44.9	Very low	60.4	Low	119 Å²	119	92.5 Å²	92.5	73%	0.73	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-10	-178.5	50.2	0	0	0	0	114.9	S5 G9	S5-T7 PolarHBondContact O-N 3.4Å; S5-T7 PolarHBondContact OG-N 3.25Å; S5-T7 PolarHBondContact OG-OG1 3.07Å; T7-G9 PolarHBondContact O-N 3.2Å
8	E	50.2	Low	60.6	Low	71 Å²	71	96.1 Å²	96.1	33%	0.332	56%	0.564	S	S	.	*	S	Bend	trans	-82.5	101.6	170.7	-72.2	-168.2	146.1	0	0	108.8	S5 R11	S5-E8 PolarHBondContact O-N 3.04Å; E8-R11 IonicContact OE1-CZ 3.19Å; E8-R11 IonicContact OE1-NH1 3.93Å; E8-R11 PolarHBondContact OE1-NH1 3.28Å; E8-R11 IonicContact OE1-NH2 3.23Å; E8-R11 IonicContact OE2-CZ 3.87Å; E8-R11 VanDerWaalsContact OE2-CZ 3.32Å; E8-R11 IonicContact OE2-NH1 3.06Å; E8-R11 PolarHBondContact OE2-NH1 2.95Å; E8-R11 IonicContact OE2-NH2 3.14Å; E8-R11 PolarHBondContact OE2-NH2 2.75Å
9	G	52.2	Low	61.5	Low	59 Å²	59	94.3 Å²	94.3	61%	0.608	55%	0.547	S	S	*	.			trans	-53.2	160.5	169.4	0	0	0	0	0	111.8	T7 R11	T7-G9 PolarHBondContact O-N 3.2Å; G9-R11 PolarHBondContact O-N 2.95Å
10	D	56.4	Low	62.5	Low	118 Å²	118	97.3 Å²	97.3	63%	0.631	55%	0.553	S	S	*	*			trans	-58	108.9	178.4	-89.5	-9.1	0	0	0	109.9	K519	D10-K519 IonicContact OD1-NZ 3.34Å; D10-K519 PolarHBondContact OD1-NZ 2.73Å
11	R	63.2	Low	63.8	Low	88 Å²	88	99.9 Å²	99.9	33%	0.332	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-78	133	175.9	-74.4	-173.8	-70.4	-125.6	-17	108.9	E8 G9 S512 D516	E8-R11 IonicContact OE1-CZ 3.19Å; E8-R11 IonicContact OE1-NH1 3.93Å; E8-R11 PolarHBondContact OE1-NH1 3.28Å; E8-R11 IonicContact OE1-NH2 3.23Å; E8-R11 IonicContact OE2-CZ 3.87Å; E8-R11 VanDerWaalsContact OE2-CZ 3.32Å; E8-R11 IonicContact OE2-NH1 3.06Å; E8-R11 PolarHBondContact OE2-NH1 2.95Å; E8-R11 IonicContact OE2-NH2 3.14Å; E8-R11 PolarHBondContact OE2-NH2 2.75Å; G9-R11 PolarHBondContact O-N 2.95Å; R11-S512 PolarHBondContact NH1-OG 2.9Å; R11-S512 VanDerWaalsContact NH2-CB 3.31Å; R11-D516 IonicContact NE-OD1 2.71Å; R11-D516 IonicContact NE-OD2 2.76Å; R11-D516 IonicContact NH2-OD1 3.07Å; R11-D516 PolarHBondContact NH2-OD1 3.3Å; R11-D516 IonicContact NH2-OD2 3.19Å
12	D	69.5	Low	65.9	Low	132 Å²	132	88.9 Å²	88.9	71%	0.706	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-66.6	135.3	170.5	-68.4	-34.1	0	0	0	110.4
13	W	74.2	Confident	67.6	Low	17 Å²	17	85.6 Å²	85.6	6%	0.064	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-71.4	135.4	172.8	-71.9	76.9	0	0	0	109.6	A502 I505 N506 D516 L520 V602 L606	W13-A502 HydrophobicContact CH2-CB 3.64Å; W13-A502 HydrophobicContact CZ3-CB 3.93Å; W13-I505 HydrophobicContact CE3-CB 4.37Å; W13-I505 HydrophobicContact CE3-CG2 3.92Å; W13-I505 HydrophobicContact CZ3-CB 4.24Å; W13-I505 HydrophobicContact CZ3-CD1 4.14Å; W13-I505 HydrophobicContact CZ3-CG2 4.28Å; W13-N506 VanDerWaalsContact CE3-CG 3.46Å; W13-N506 VanDerWaalsContact CE3-OD1 3.32Å; W13-N506 WeakPolarHBondContact CZ3-ND2 3.42Å; W13-D516 HydrophobicContact CH2-CB 4.17Å; W13-D516 HydrophobicContact CZ2-CB 3.73Å; W13-L520 HydrophobicContact CZ2-CD2 4.07Å; W13-V602 HydrophobicContact CB-CG1 3.84Å; W13-V602 HydrophobicContact CD2-CB 4.37Å; W13-V602 HydrophobicContact CD2-CG1 3.78Å; W13-V602 HydrophobicContact CD2-CG2 3.65Å; W13-V602 HydrophobicContact CE3-CB 4.28Å; W13-V602 HydrophobicContact CE3-CG1 3.74Å; W13-V602 HydrophobicContact CE3-CG2 3.45Å; W13-V602 VanDerWaalsContact CE3-CG2 3.45Å; W13-V602 HydrophobicContact CG-CG1 3.85Å; W13-V602 HydrophobicContact CG-CG2 4.45Å; W13-V602 HydrophobicContact CH2-CG2 3.73Å; W13-V602 HydrophobicContact CZ2-CG2 3.89Å; W13-V602 HydrophobicContact CZ3-CG2 3.51Å; W13-L606 HydrophobicContact CB-CD1 3.68Å; W13-L606 HydrophobicContact CB-CD2 3.9Å; W13-L606 HydrophobicContact CB-CG 3.96Å
14	K	74.8	Confident	69	Low	96 Å²	96	87.8 Å²	87.8	42%	0.417	47%	0.471	S	S	.	.			trans	-130.2	76.8	-174.4	-58.8	-160.2	179.1	-166.3	0	111.3	T16 E17 N506	K14-T16 PolarHBondContact O-N 2.72Å; K14-E17 HydrophobicContact CB-CB 4.31Å; K14-E17 HydrophobicContact CB-CG 4.25Å; K14-E17 HydrophobicContact CD-CG 4.39Å; K14-E17 WeakPolarHBondContact CD-OE1 3.29Å; K14-E17 WeakPolarHBondContact CD-OE2 3.46Å; K14-E17 IonicContact NZ-OE1 3.74Å; K14-E17 PolarHBondContact NZ-OE1 3.31Å; K14-E17 IonicContact NZ-OE2 3.03Å; K14-E17 PolarHBondContact NZ-OE2 3.09Å; K14-E17 VanDerWaalsContact NZ-OE2 3.14Å; K14-N506 PolarHBondContact N-OD1 3.32Å
15	P	70.6	Confident	70.4	Confident	27 Å²	27	89 Å²	89	18%	0.175	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	133.7	178.5	-20.1	31.9	0	0	0	110.2	E17 F415 I505 L606	P15-E17 VanDerWaalsContact C-N 3.29Å; P15-E17 PolarHBondContact O-N 2.73Å; P15-F415 HydrophobicContact CB-CB 4.14Å; P15-F415 HydrophobicContact CB-CD1 3.81Å; P15-F415 HydrophobicContact CB-CD2 4.12Å; P15-F415 HydrophobicContact CB-CE1 4.24Å; P15-F415 HydrophobicContact CB-CG 3.75Å; P15-F415 HydrophobicContact CG-CD1 3.92Å; P15-F415 HydrophobicContact CG-CE1 3.9Å; P15-F415 HydrophobicContact CG-CG 4.32Å; P15-F415 HydrophobicContact CG-CZ 4.29Å; P15-I505 HydrophobicContact CB-CG2 4.15Å; P15-I505 HydrophobicContact CG-CG2 4.09Å; P15-L606 HydrophobicContact CG-CD1 3.91Å
16	T	63.5	Low	72.2	Confident	108 Å²	108	88.9 Å²	88.9	66%	0.663	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	7.9	170.8	70.2	0	0	0	0	117.5	K14 F415	K14-T16 PolarHBondContact O-N 2.72Å; T16-F415 HydrophobicContact CG2-CB 4.28Å
17	E	64.3	Low	74.3	Confident	116 Å²	116	85.3 Å²	85.3	54%	0.542	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-68.6	162.7	169.2	-89.6	-166.5	-175	0	0	112.4	K14 P15 R19	K14-E17 HydrophobicContact CB-CB 4.31Å; K14-E17 HydrophobicContact CB-CG 4.25Å; K14-E17 HydrophobicContact CD-CG 4.39Å; K14-E17 WeakPolarHBondContact CD-OE1 3.29Å; K14-E17 WeakPolarHBondContact CD-OE2 3.46Å; K14-E17 IonicContact NZ-OE1 3.74Å; K14-E17 PolarHBondContact NZ-OE1 3.31Å; K14-E17 IonicContact NZ-OE2 3.03Å; K14-E17 PolarHBondContact NZ-OE2 3.09Å; K14-E17 VanDerWaalsContact NZ-OE2 3.14Å; P15-E17 VanDerWaalsContact C-N 3.29Å; P15-E17 PolarHBondContact O-N 2.73Å; E17-R19 PolarHBondContact O-N 3.16Å; E17-R19 VanDerWaalsContact O-N 3.16Å
18	N	64.6	Low	76.8	Confident	156 Å²	156	84.2 Å²	84.2	83%	0.834	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-47.2	117.7	-175.1	-76.7	-35	0	0	0	113.5
19	R	77.1	Confident	79.1	Confident	63 Å²	63	84.8 Å²	84.8	24%	0.238	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-65.4	133.6	177.2	-62.5	-179	-175.8	-100.1	-2.2	110.6	E17 Y437 H438	E17-R19 PolarHBondContact O-N 3.16Å; E17-R19 VanDerWaalsContact O-N 3.16Å; R19-Y437 HydrophobicContact CB-CD1 4.32Å; R19-Y437 HydrophobicContact CB-CD2 3.94Å; R19-Y437 HydrophobicContact CB-CE2 4.21Å; R19-Y437 HydrophobicContact CB-CG 3.99Å; R19-H438 PolarHBondContact NH1-NE2 3.15Å
20	K	82.2	Confident	81.2	Confident	154 Å²	154	82.5 Å²	82.5	67%	0.67	41%	0.405	S	S	*	.			trans	-110.7	156.7	173.6	-64.6	-180	-177.4	177.4	0	109.8	T22	K20-T22 PolarHBondContact O-N 2.61Å
21	Y	88.9	Confident	83.2	Confident	151 Å²	151	79.4 Å²	79.4	59%	0.592	39%	0.392	S	S	*	.			trans	-63.8	128.4	170.9	-65.4	-85.8	0	0	0	110	R436 Y437	Y21-R436 VanDerWaalsContact CD1-O 3.26Å; Y21-R436 WeakPolarHBondContact CD1-O 3.36Å; Y21-R436 WeakPolarHBondContact CE1-O 3.03Å; Y21-Y437 WeakPolarHBondContact CA-O 3.05Å; Y21-Y437 HydrophobicContact CD1-CD1 4.31Å; Y21-Y437 HydrophobicContact CE1-CD1 4.3Å; Y21-Y437 HydrophobicContact CE2-CD1 4.49Å; Y21-Y437 HydrophobicContact CE2-CE1 4.41Å; Y21-Y437 HydrophobicContact CG-CD1 4.43Å
22	T	90.3	Very high	84.8	Confident	8 Å²	8	80.4 Å²	80.4	5%	0.049	40%	0.403	C	S	.	.			trans	-113	140.3	-176.1	57.3	0	0	0	0	112.1	K20 I24 Y437 H438 T441 G507 T508	K20-T22 PolarHBondContact O-N 2.61Å; T22-I24 VanDerWaalsContact C-N 3.34Å; T22-I24 PolarHBondContact O-N 2.95Å; T22-Y437 PolarHBondContact N-O 3.07Å; T22-Y437 PolarHBondContact OG1-O 3.07Å; T22-H438 WeakPolarHBondContact OG1-CA 3.26Å; T22-H438 PolarHBondContact OG1-ND1 3.49Å; T22-T441 WeakPolarHBondContact CB-OG1 3.3Å; T22-T441 PolarHBondContact OG1-OG1 2.99Å; T22-G507 WeakPolarHBondContact CG2-O 3.45Å; T22-T508 WeakPolarHBondContact CG2-O 3.37Å
23	D	93.4	Very high	86.1	Confident	19 Å²	19	75.1 Å²	75.1	10%	0.102	37%	0.374	C	S	.	.			trans	49.9	43.7	175.3	-57.8	-84.5	0	0	0	114.5	P25 W26 L27 G440 T441 K444 N509 F510	D23-P25 VanDerWaalsContact C-N 3.33Å; D23-W26 HydrophobicContact CB-CB 4.35Å; D23-W26 WeakPolarHBondContact O-CB 3.36Å; D23-W26 PolarHBondContact O-N 3.12Å; D23-L27 PolarHBondContact O-N 2.88Å; D23-G440 WeakPolarHBondContact O-CA 3.48Å; D23-T441 PolarHBondContact OD2-OG1 3.43Å; D23-K444 VanDerWaalsContact OD1-CD 3.3Å; D23-K444 WeakPolarHBondContact OD1-CD 3.18Å; D23-K444 IonicContact OD1-NZ 3.88Å; D23-K444 PolarHBondContact OD1-NZ 3.39Å; D23-N509 WeakPolarHBondContact OD2-CA 3.4Å; D23-F510 WeakPolarHBondContact OD2-CB 3.31Å; D23-F510 PolarHBondContact OD2-N 3.07Å
24	I	94.4	Very high	87.2	Confident	89 Å²	89	76.4 Å²	76.4	46%	0.456	39%	0.386	S	S	.	.	H	α-helix	trans	-48.4	-42.5	-179.3	-59.3	173.1	0	0	0	113.8	T22 W26 L27 I28	T22-I24 VanDerWaalsContact C-N 3.34Å; T22-I24 PolarHBondContact O-N 2.95Å; I24-W26 VanDerWaalsContact C-N 3.25Å; I24-W26 PolarHBondContact O-N 3.28Å; I24-L27 WeakPolarHBondContact O-CB 3.37Å; I24-L27 PolarHBondContact O-N 3.16Å; I24-L27 VanDerWaalsContact O-N 3.1Å; I24-I28 HydrophobicContact CG2-CD1 4.08Å; I24-I28 HydrophobicContact CG2-CG1 4.43Å; I24-I28 WeakPolarHBondContact O-CG1 3.37Å; I24-I28 PolarHBondContact O-N 3.15Å
25	P	95.8	Very high	88.3	Confident	85 Å²	85	76.4 Å²	76.4	55%	0.552	39%	0.389	S	S	*	.	H	α-helix	trans	-58	-37.1	177.5	-26.1	36	0	0	0	113.3	D23 I28 I29	D23-P25 VanDerWaalsContact C-N 3.33Å; P25-I28 PolarHBondContact O-N 3.03Å; P25-I29 VanDerWaalsContact O-CG1 3.29Å; P25-I29 WeakPolarHBondContact O-CG1 3.35Å; P25-I29 PolarHBondContact O-N 3.31Å
26	W	95.6	Very high	89.5	Confident	65 Å²	65	75.9 Å²	75.9	25%	0.246	39%	0.389	C	S	.	.	H	α-helix	trans	-71.8	-33.2	177.8	-76.7	96.5	0	0	0	112.5	D23 I24 I28 I29 F30 A443 K444 F447	D23-W26 HydrophobicContact CB-CB 4.35Å; D23-W26 WeakPolarHBondContact O-CB 3.36Å; D23-W26 PolarHBondContact O-N 3.12Å; I24-W26 VanDerWaalsContact C-N 3.25Å; I24-W26 PolarHBondContact O-N 3.28Å; W26-I28 VanDerWaalsContact C-N 3.33Å; W26-I29 HydrophobicContact CE3-CD1 4.41Å; W26-I29 PolarHBondContact O-N 3.23Å; W26-F30 WeakPolarHBondContact O-CB 3.44Å; W26-F30 PolarHBondContact O-N 3.01Å; W26-A443 HydrophobicContact CB-CB 4.49Å; W26-K444 HydrophobicContact CB-CB 4.04Å; W26-K444 HydrophobicContact CD2-CB 3.9Å; W26-K444 HydrophobicContact CD2-CD 4.45Å; W26-K444 HydrophobicContact CD2-CG 3.95Å; W26-K444 HydrophobicContact CE3-CB 4.49Å; W26-K444 HydrophobicContact CG-CB 3.68Å; W26-K444 HydrophobicContact CG-CD 4.12Å; W26-K444 HydrophobicContact CG-CG 3.98Å; W26-K444 HydrophobicContact CZ2-CG 4.41Å; W26-F447 HydrophobicContact CE3-CD1 4.4Å; W26-F447 AromaticContact CH2-CD1 3.36Å; W26-F447 HydrophobicContact CH2-CD1 3.36Å; W26-F447 AromaticContact CH2-CE1 3.57Å; W26-F447 HydrophobicContact CH2-CE1 3.57Å; W26-F447 HydrophobicContact CH2-CG 4.25Å; W26-F447 HydrophobicContact CZ3-CB 4.06Å; W26-F447 AromaticContact CZ3-CD1 3.25Å; W26-F447 HydrophobicContact CZ3-CD1 3.25Å; W26-F447 HydrophobicContact CZ3-CD2 4.46Å; W26-F447 AromaticContact CZ3-CE1 3.69Å; W26-F447 HydrophobicContact CZ3-CE1 3.69Å; W26-F447 AromaticContact CZ3-CG 3.68Å; W26-F447 HydrophobicContact CZ3-CG 3.68Å; W26-F447 HydrophobicContact CZ3-CZ 4.46Å
27	L	95.5	Very high	91	Very high	51 Å²	51	70.9 Å²	70.9	27%	0.267	36%	0.358	S	S	.	.	H	α-helix	trans	-62.5	-42.4	170.7	-179.2	56.8	0	0	0	111.3	D23 I24 F30 S31 M439	D23-L27 PolarHBondContact O-N 2.88Å; I24-L27 WeakPolarHBondContact O-CB 3.37Å; I24-L27 PolarHBondContact O-N 3.16Å; I24-L27 VanDerWaalsContact O-N 3.1Å; L27-F30 PolarHBondContact O-N 3.18Å; L27-S31 VanDerWaalsContact O-CB 3.3Å; L27-S31 WeakPolarHBondContact O-CB 3.15Å; L27-S31 PolarHBondContact O-N 3.09Å; L27-S31 PolarHBondContact O-OG 3.05Å; L27-M439 HydrophobicContact CD1-CB 3.56Å; L27-M439 HydrophobicContact CD1-CE 4.2Å; L27-M439 HydrophobicContact CD1-SD 4.34Å; L27-M439 HydrophobicContact CD2-CB 4.36Å
28	I	97.1	Very high	92.5	Very high	95 Å²	95	68.1 Å²	68.1	49%	0.487	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-48.8	177	-65.1	168.8	0	0	0	110.3	I24 P25 W26 F30 S31 L32	I24-I28 HydrophobicContact CG2-CD1 4.08Å; I24-I28 HydrophobicContact CG2-CG1 4.43Å; I24-I28 WeakPolarHBondContact O-CG1 3.37Å; I24-I28 PolarHBondContact O-N 3.15Å; P25-I28 PolarHBondContact O-N 3.03Å; W26-I28 VanDerWaalsContact C-N 3.33Å; I28-F30 PolarHBondContact O-N 3.23Å; I28-S31 PolarHBondContact O-N 3.5Å; I28-L32 HydrophobicContact CG2-CD1 3.99Å; I28-L32 HydrophobicContact CG2-CG 4.37Å; I28-L32 WeakPolarHBondContact O-CG 3.16Å; I28-L32 PolarHBondContact O-N 2.94Å
29	I	97.2	Very high	93.9	Very high	83 Å²	83	66.5 Å²	66.5	43%	0.426	35%	0.345	S	S	.	.	H	α-helix	trans	-59.2	-46.8	179.2	-65.1	165.8	0	0	0	110.8	P25 W26 S31 L32 F33 W393	P25-I29 VanDerWaalsContact O-CG1 3.29Å; P25-I29 WeakPolarHBondContact O-CG1 3.35Å; P25-I29 PolarHBondContact O-N 3.31Å; W26-I29 HydrophobicContact CE3-CD1 4.41Å; W26-I29 PolarHBondContact O-N 3.23Å; I29-S31 PolarHBondContact O-N 3.49Å; I29-L32 PolarHBondContact O-N 3.4Å; I29-F33 WeakPolarHBondContact O-CB 3.42Å; I29-F33 PolarHBondContact O-N 2.97Å; I29-W393 HydrophobicContact CG2-CH2 4.06Å
30	F	97.5	Very high	94.6	Very high	12 Å²	12	64 Å²	64	5%	0.053	34%	0.337	C	S	.	.	H	α-helix	trans	-64.6	-39.9	178.7	-176.8	-107.6	0	0	0	112.1	W26 L27 I28 F33 C34 W393 I394 F397 A443	W26-F30 WeakPolarHBondContact O-CB 3.44Å; W26-F30 PolarHBondContact O-N 3.01Å; L27-F30 PolarHBondContact O-N 3.18Å; I28-F30 PolarHBondContact O-N 3.23Å; F30-F33 WeakPolarHBondContact O-CB 3.44Å; F30-F33 PolarHBondContact O-N 3.15Å; F30-C34 PolarHBondContact O-N 3.5Å; F30-C34 PolarHBondContact O-SG 3.32Å; F30-W393 HydrophobicContact CB-CH2 4.38Å; F30-W393 HydrophobicContact CB-CZ2 4.2Å; F30-W393 HydrophobicContact CD2-CD2 4.09Å; F30-W393 AromaticContact CD2-CE2 3.64Å; F30-W393 HydrophobicContact CD2-CE3 4.48Å; F30-W393 HydrophobicContact CD2-CH2 4.11Å; F30-W393 AromaticContact CD2-CZ2 3.66Å; F30-W393 HydrophobicContact CD2-CZ2 3.66Å; F30-W393 HydrophobicContact CD2-CZ3 4.49Å; F30-W393 AromaticContact CD2-NE1 4Å; F30-W393 HydrophobicContact CE2-CD2 4.32Å; F30-W393 HydrophobicContact CG-CZ2 4.41Å; F30-I394 HydrophobicContact CE2-CG1 4.37Å; F30-I394 HydrophobicContact CZ-CG1 4.46Å; F30-F397 HydrophobicContact CD1-CD2 4.16Å; F30-F397 AromaticContact CD1-CE2 3.9Å; F30-F397 HydrophobicContact CD1-CE2 3.9Å; F30-F397 HydrophobicContact CD1-CZ 4.28Å; F30-F397 HydrophobicContact CD2-CD2 4.38Å; F30-F397 AromaticContact CE1-CD1 3.95Å; F30-F397 HydrophobicContact CE1-CD1 3.95Å; F30-F397 AromaticContact CE1-CD2 3.67Å; F30-F397 HydrophobicContact CE1-CD2 3.67Å; F30-F397 AromaticContact CE1-CE1 3.88Å; F30-F397 HydrophobicContact CE1-CE1 3.88Å; F30-F397 AromaticContact CE1-CE2 3.6Å; F30-F397 HydrophobicContact CE1-CE2 3.6Å; F30-F397 AromaticContact CE1-CG 3.85Å; F30-F397 HydrophobicContact CE1-CG 3.85Å; F30-F397 AromaticContact CE1-CZ 3.71Å; F30-F397 HydrophobicContact CE1-CZ 3.71Å; F30-F397 HydrophobicContact CE2-CB 4.06Å; F30-F397 AromaticContact CE2-CD2 3.9Å; F30-F397 HydrophobicContact CE2-CD2 3.9Å; F30-F397 AromaticContact CE2-CG 3.97Å; F30-F397 HydrophobicContact CE2-CG 3.97Å; F30-F397 HydrophobicContact CG-CD2 4.49Å; F30-F397 HydrophobicContact CZ-CB 3.84Å; F30-F397 AromaticContact CZ-CD1 3.72Å; F30-F397 HydrophobicContact CZ-CD1 3.72Å; F30-F397 AromaticContact CZ-CD2 3.52Å; F30-F397 HydrophobicContact CZ-CD2 3.52Å; F30-F397 HydrophobicContact CZ-CE1 4.15Å; F30-F397 AromaticContact CZ-CE2 3.98Å; F30-F397 HydrophobicContact CZ-CE2 3.98Å; F30-F397 AromaticContact CZ-CG 3.39Å; F30-F397 HydrophobicContact CZ-CG 3.39Å; F30-F397 HydrophobicContact CZ-CZ 4.27Å; F30-A443 HydrophobicContact CB-CB 3.76Å; F30-A443 HydrophobicContact CD1-CB 4.49Å; F30-A443 HydrophobicContact CG-CB 4.03Å
31	S	96.9	Very high	95	Very high	52 Å²	52	57.9 Å²	57.9	36%	0.364	31%	0.313	S	S	.	.	H	α-helix	trans	-64.2	-44.5	176.9	-57.8	0	0	0	0	111.6	L27 I28 I29 F33 C34 I35	L27-S31 VanDerWaalsContact O-CB 3.3Å; L27-S31 WeakPolarHBondContact O-CB 3.15Å; L27-S31 PolarHBondContact O-N 3.09Å; L27-S31 PolarHBondContact O-OG 3.05Å; I28-S31 PolarHBondContact O-N 3.5Å; I29-S31 PolarHBondContact O-N 3.49Å; S31-F33 VanDerWaalsContact C-N 3.26Å; S31-F33 PolarHBondContact O-N 2.79Å; S31-C34 PolarHBondContact O-N 3.21Å; S31-I35 VanDerWaalsContact O-CG1 3.29Å; S31-I35 WeakPolarHBondContact O-CG1 3.48Å; S31-I35 PolarHBondContact O-N 3.15Å
32	L	97.7	Very high	95	Very high	109 Å²	109	52.5 Å²	52.5	57%	0.571	30%	0.303	S	S	*	.	H	α-helix	trans	-60.4	-38	173.3	-70.5	173.9	0	0	0	111.5	I28 I29 I35 G36	I28-L32 HydrophobicContact CG2-CD1 3.99Å; I28-L32 HydrophobicContact CG2-CG 4.37Å; I28-L32 WeakPolarHBondContact O-CG 3.16Å; I28-L32 PolarHBondContact O-N 2.94Å; I29-L32 PolarHBondContact O-N 3.4Å; L32-I35 PolarHBondContact O-N 3.13Å; L32-G36 PolarHBondContact O-N 3.06Å
33	F	97.4	Very high	95	Very high	21 Å²	21	55.7 Å²	55.7	9%	0.092	32%	0.317	C	S	.	.	H	α-helix	trans	-63.8	-46.3	174.9	-175.5	-88.7	0	0	0	112.1	I29 F30 S31 I35 G36 M37 Y386 V389 W393 I394	I29-F33 WeakPolarHBondContact O-CB 3.42Å; I29-F33 PolarHBondContact O-N 2.97Å; F30-F33 WeakPolarHBondContact O-CB 3.44Å; F30-F33 PolarHBondContact O-N 3.15Å; S31-F33 VanDerWaalsContact C-N 3.26Å; S31-F33 PolarHBondContact O-N 2.79Å; F33-I35 VanDerWaalsContact C-N 3.33Å; F33-I35 PolarHBondContact O-N 3.05Å; F33-G36 PolarHBondContact O-N 3.41Å; F33-M37 HydrophobicContact CD1-CG 4.24Å; F33-M37 HydrophobicContact CE1-CG 3.85Å; F33-M37 HydrophobicContact CE1-SD 4.2Å; F33-M37 HydrophobicContact CZ-CG 4.43Å; F33-M37 HydrophobicContact CZ-SD 4.3Å; F33-M37 WeakPolarHBondContact O-CG 3.37Å; F33-M37 PolarHBondContact O-N 3.11Å; F33-Y386 VanDerWaalsContact CA-OH 3.23Å; F33-Y386 WeakPolarHBondContact CA-OH 3.32Å; F33-Y386 HydrophobicContact CD2-CE1 4.21Å; F33-Y386 AromaticContact CD2-CE2 3.78Å; F33-Y386 HydrophobicContact CD2-CE2 3.78Å; F33-Y386 AromaticContact CD2-CZ 3.51Å; F33-Y386 WeakPolarHBondContact CD2-OH 3.25Å; F33-Y386 HydrophobicContact CE2-CD1 4.33Å; F33-Y386 HydrophobicContact CE2-CD2 4.15Å; F33-Y386 AromaticContact CE2-CE1 3.86Å; F33-Y386 HydrophobicContact CE2-CE1 3.86Å; F33-Y386 AromaticContact CE2-CE2 3.65Å; F33-Y386 HydrophobicContact CE2-CE2 3.65Å; F33-Y386 HydrophobicContact CE2-CG 4.48Å; F33-Y386 AromaticContact CE2-CZ 3.5Å; F33-Y386 HydrophobicContact CZ-CD1 4.39Å; F33-Y386 HydrophobicContact CZ-CE1 4.02Å; F33-Y386 PolarHBondContact O-OH 3.13Å; F33-V389 HydrophobicContact CE2-CG1 4.36Å; F33-V389 HydrophobicContact CZ-CG1 4.29Å; F33-W393 HydrophobicContact CB-CE3 4.37Å; F33-W393 HydrophobicContact CB-CH2 4.4Å; F33-W393 HydrophobicContact CB-CZ3 3.74Å; F33-W393 AromaticContact CD1-CE3 3.76Å; F33-W393 HydrophobicContact CD1-CE3 3.76Å; F33-W393 HydrophobicContact CD1-CZ3 4.01Å; F33-W393 AromaticContact CD2-CE3 3.89Å; F33-W393 HydrophobicContact CD2-CE3 3.89Å; F33-W393 AromaticContact CD2-CZ3 3.67Å; F33-W393 HydrophobicContact CD2-CZ3 3.67Å; F33-W393 AromaticContact CE1-CE3 4Å; F33-W393 HydrophobicContact CE1-CE3 4Å; F33-W393 HydrophobicContact CE2-CE3 4.11Å; F33-W393 HydrophobicContact CE2-CZ3 4.31Å; F33-W393 AromaticContact CG-CE3 3.72Å; F33-W393 HydrophobicContact CG-CE3 3.72Å; F33-W393 AromaticContact CG-CZ3 3.51Å; F33-W393 HydrophobicContact CG-CZ3 3.51Å; F33-W393 HydrophobicContact CZ-CE3 4.17Å; F33-I394 HydrophobicContact CE1-CD1 4.41Å
34	C	96.8	Very high	94.5	Very high	45 Å²	45	54.8 Å²	54.8	30%	0.304	31%	0.312	S	S	.	.	H	α-helix	trans	-63.5	-37.1	175.5	-69.4	0	0	0	0	112.7	F30 S31 G36 M37 A38	F30-C34 PolarHBondContact O-N 3.5Å; F30-C34 PolarHBondContact O-SG 3.32Å; S31-C34 PolarHBondContact O-N 3.21Å; C34-G36 VanDerWaalsContact C-N 3.34Å; C34-M37 WeakPolarHBondContact O-CB 3.34Å; C34-M37 PolarHBondContact O-N 3.2Å; C34-A38 PolarHBondContact O-N 2.87Å
35	I	97.1	Very high	94	Very high	95 Å²	95	55 Å²	55	49%	0.487	31%	0.313	S	S	.	.	H	α-helix	trans	-61.6	-44.5	173.1	-69	164	0	0	0	110	S31 L32 F33 M37 A38 L39	S31-I35 VanDerWaalsContact O-CG1 3.29Å; S31-I35 WeakPolarHBondContact O-CG1 3.48Å; S31-I35 PolarHBondContact O-N 3.15Å; L32-I35 PolarHBondContact O-N 3.13Å; F33-I35 VanDerWaalsContact C-N 3.33Å; F33-I35 PolarHBondContact O-N 3.05Å; I35-M37 VanDerWaalsContact C-N 3.32Å; I35-M37 PolarHBondContact O-N 2.89Å; I35-A38 PolarHBondContact O-N 3.39Å; I35-A38 VanDerWaalsContact O-N 3.14Å; I35-L39 HydrophobicContact CG2-CD1 4.14Å; I35-L39 HydrophobicContact CG2-CG 4.34Å; I35-L39 WeakPolarHBondContact O-CG 3.47Å; I35-L39 PolarHBondContact O-N 3.33Å
36	G	95.9	Very high	93.5	Very high	16 Å²	16	55 Å²	55	17%	0.165	32%	0.32	C	S	.	.	H	α-helix	trans	-57.6	-42.2	174.1	0	0	0	0	0	112.9	L32 F33 C34 A38 L39 I40	L32-G36 PolarHBondContact O-N 3.06Å; F33-G36 PolarHBondContact O-N 3.41Å; C34-G36 VanDerWaalsContact C-N 3.34Å; G36-A38 PolarHBondContact O-N 3.25Å; G36-L39 PolarHBondContact O-N 2.97Å; G36-I40 WeakPolarHBondContact O-CG1 3.42Å; G36-I40 PolarHBondContact O-N 2.64Å
37	M	95.8	Very high	92.6	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.02	33%	0.328	C	S	.	.	H	α-helix	trans	-60.8	-43.3	174.1	-67.7	-68.6	-72.2	0	0	112	F33 C34 I35 I40 C41 Y349 Y386 H387 I394	F33-M37 HydrophobicContact CD1-CG 4.24Å; F33-M37 HydrophobicContact CE1-CG 3.85Å; F33-M37 HydrophobicContact CE1-SD 4.2Å; F33-M37 HydrophobicContact CZ-CG 4.43Å; F33-M37 HydrophobicContact CZ-SD 4.3Å; F33-M37 WeakPolarHBondContact O-CG 3.37Å; F33-M37 PolarHBondContact O-N 3.11Å; C34-M37 WeakPolarHBondContact O-CB 3.34Å; C34-M37 PolarHBondContact O-N 3.2Å; I35-M37 VanDerWaalsContact C-N 3.32Å; I35-M37 PolarHBondContact O-N 2.89Å; M37-I40 PolarHBondContact O-N 3.44Å; M37-C41 PolarHBondContact O-N 3.04Å; M37-Y349 HydrophobicContact CE-CE1 4.5Å; M37-Y349 PolarHBondContact O-OH 3.49Å; M37-Y386 HydrophobicContact CG-CD1 4.46Å; M37-Y386 HydrophobicContact CG-CE1 3.81Å; M37-Y386 HydrophobicContact SD-CD1 3.68Å; M37-Y386 HydrophobicContact SD-CE1 3.64Å; M37-H387 WeakPolarHBondContact CE-ND1 3.45Å; M37-I394 HydrophobicContact CE-CD1 4.32Å; M37-I394 HydrophobicContact CG-CD1 4.24Å
38	A	94.8	Very high	91	Very high	58 Å²	58	53.9 Å²	53.9	48%	0.479	33%	0.327	S	S	.	.	H	α-helix	trans	-66.2	-38	177.5	0	0	0	0	0	112.2	C34 I35 G36 C41 G42	C34-A38 PolarHBondContact O-N 2.87Å; I35-A38 PolarHBondContact O-N 3.39Å; I35-A38 VanDerWaalsContact O-N 3.14Å; G36-A38 PolarHBondContact O-N 3.25Å; A38-C41 WeakPolarHBondContact O-CB 3.03Å; A38-C41 PolarHBondContact O-N 2.85Å; A38-G42 PolarHBondContact O-N 2.99Å
39	L	94.1	Very high	89.5	Confident	121 Å²	121	49.4 Å²	49.4	63%	0.634	31%	0.305	S	S	*	.	H	α-helix	trans	-64.6	-40.9	174.4	-70.1	174.3	0	0	0	111.8	I35 G36 C41 G42 F43	I35-L39 HydrophobicContact CG2-CD1 4.14Å; I35-L39 HydrophobicContact CG2-CG 4.34Å; I35-L39 WeakPolarHBondContact O-CG 3.47Å; I35-L39 PolarHBondContact O-N 3.33Å; G36-L39 PolarHBondContact O-N 2.97Å; L39-C41 VanDerWaalsContact C-N 3.34Å; L39-G42 PolarHBondContact O-N 2.93Å; L39-F43 VanDerWaalsContact O-CB 3.31Å; L39-F43 WeakPolarHBondContact O-CB 3.44Å; L39-F43 PolarHBondContact O-N 3.19Å
40	I	91.9	Very high	88.1	Confident	12 Å²	12	46.8 Å²	46.8	6%	0.062	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-43.1	174.1	-68.9	167.5	0	0	0	110.5	G36 M37 F43 A44 V353 L357 M383 Y386	G36-I40 WeakPolarHBondContact O-CG1 3.42Å; G36-I40 PolarHBondContact O-N 2.64Å; M37-I40 PolarHBondContact O-N 3.44Å; I40-F43 PolarHBondContact O-N 2.7Å; I40-A44 VanDerWaalsContact O-CB 3.3Å; I40-A44 WeakPolarHBondContact O-CB 3.47Å; I40-A44 PolarHBondContact O-N 3.42Å; I40-V353 HydrophobicContact CG2-CG1 4.23Å; I40-L357 HydrophobicContact CG2-CD1 4.46Å; I40-L357 HydrophobicContact CG2-CD2 4.3Å; I40-M383 HydrophobicContact CD1-CB 4.17Å; I40-M383 HydrophobicContact CD1-CG 4.34Å; I40-M383 HydrophobicContact CG1-CB 4.28Å; I40-M383 HydrophobicContact CG1-CG 4.12Å; I40-M383 HydrophobicContact CG2-CB 4.37Å; I40-Y386 HydrophobicContact CD1-CD1 3.34Å; I40-Y386 HydrophobicContact CD1-CE1 3.95Å; I40-Y386 HydrophobicContact CD1-CG 3.96Å
41	C	91.1	Very high	87.1	Confident	24 Å²	24	47.4 Å²	47.4	16%	0.162	30%	0.302	C	S	.	.	H	α-helix	trans	-57.9	-51.4	173.9	179.3	0	0	0	0	111.3	M37 A38 L39 F43 A44 I45 Y349 V353	M37-C41 PolarHBondContact O-N 3.04Å; A38-C41 WeakPolarHBondContact O-CB 3.03Å; A38-C41 PolarHBondContact O-N 2.85Å; L39-C41 VanDerWaalsContact C-N 3.34Å; C41-F43 VanDerWaalsContact C-N 3.34Å; C41-F43 PolarHBondContact O-N 3.17Å; C41-A44 PolarHBondContact O-N 2.98Å; C41-I45 WeakPolarHBondContact O-CG1 3.5Å; C41-I45 PolarHBondContact O-N 3.4Å; C41-Y349 HydrophobicContact CB-CE2 4.11Å; C41-V353 HydrophobicContact CB-CG1 4.44Å; C41-V353 HydrophobicContact CB-CG2 3.77Å
42	G	89.8	Confident	86.2	Confident	38 Å²	38	46.4 Å²	46.4	39%	0.392	29%	0.29	S	S	.	.	H	α-helix	trans	-58.5	-43.2	177.6	0	0	0	0	0	112.7	A38 L39 I45 A46	A38-G42 PolarHBondContact O-N 2.99Å; L39-G42 PolarHBondContact O-N 2.93Å; G42-I45 PolarHBondContact O-N 3.23Å; G42-A46 WeakPolarHBondContact O-CB 3.45Å; G42-A46 PolarHBondContact O-N 2.76Å
43	F	88.4	Confident	85.2	Confident	75 Å²	75	43.1 Å²	43.1	33%	0.329	27%	0.273	S	S	.	.	H	α-helix	trans	-64	-45.2	175.8	174.7	-93.7	0	0	0	112.5	L39 I40 C41 I45 A46 T47 L380 M383	L39-F43 VanDerWaalsContact O-CB 3.31Å; L39-F43 WeakPolarHBondContact O-CB 3.44Å; L39-F43 PolarHBondContact O-N 3.19Å; I40-F43 PolarHBondContact O-N 2.7Å; C41-F43 VanDerWaalsContact C-N 3.34Å; C41-F43 PolarHBondContact O-N 3.17Å; F43-I45 VanDerWaalsContact C-N 3.3Å; F43-I45 PolarHBondContact O-N 3.19Å; F43-A46 PolarHBondContact O-N 3.21Å; F43-T47 HydrophobicContact CD1-CG2 4.37Å; F43-T47 HydrophobicContact CD2-CG2 3.93Å; F43-T47 HydrophobicContact CE1-CG2 4Å; F43-T47 HydrophobicContact CE2-CG2 3.52Å; F43-T47 HydrophobicContact CG-CG2 4.35Å; F43-T47 HydrophobicContact CZ-CG2 3.56Å; F43-T47 WeakPolarHBondContact O-CB 3.43Å; F43-T47 WeakPolarHBondContact O-CG2 3.39Å; F43-T47 PolarHBondContact O-N 3.01Å; F43-T47 PolarHBondContact O-OG1 3.49Å; F43-L380 HydrophobicContact CE1-CD1 3.58Å; F43-L380 HydrophobicContact CZ-CD1 3.78Å; F43-M383 HydrophobicContact CD1-CE 4.1Å; F43-M383 HydrophobicContact CD1-SD 3.74Å; F43-M383 HydrophobicContact CE1-CE 4.18Å; F43-M383 HydrophobicContact CE1-SD 3.83Å; F43-M383 HydrophobicContact CG-CE 4.35Å; F43-M383 HydrophobicContact CG-SD 4.5Å; F43-M383 HydrophobicContact CZ-CE 4.48Å
44	A	84.4	Confident	84.4	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.4	-37	179.1	0	0	0	0	0	111.9	I40 C41 T47 F356 L357	I40-A44 VanDerWaalsContact O-CB 3.3Å; I40-A44 WeakPolarHBondContact O-CB 3.47Å; I40-A44 PolarHBondContact O-N 3.42Å; C41-A44 PolarHBondContact O-N 2.98Å; A44-T47 PolarHBondContact O-OG1 3.12Å; A44-F356 HydrophobicContact CB-CB 3.9Å; A44-L357 HydrophobicContact CB-CB 4.46Å
45	I	84.3	Confident	83.7	Confident	95 Å²	95	43.7 Å²	43.7	49%	0.487	28%	0.277	S	S	.	.	H	α-helix	trans	-69.6	-49.6	173.7	-66.1	168.6	0	0	0	110.7	C41 G42 F43 T47 G48 F356	C41-I45 WeakPolarHBondContact O-CG1 3.5Å; C41-I45 PolarHBondContact O-N 3.4Å; G42-I45 PolarHBondContact O-N 3.23Å; F43-I45 VanDerWaalsContact C-N 3.3Å; F43-I45 PolarHBondContact O-N 3.19Å; I45-T47 PolarHBondContact O-N 2.77Å; I45-G48 PolarHBondContact O-N 3.25Å; I45-G48 VanDerWaalsContact O-N 3.15Å; I45-F356 HydrophobicContact CG1-CD2 4.06Å; I45-F356 HydrophobicContact CG1-CE2 4.3Å
46	A	84.1	Confident	83.1	Confident	85 Å²	85	39.4 Å²	39.4	70%	0.702	26%	0.256	S	S	*	.	H	α-helix	trans	-65.9	-36.7	-174.8	0	0	0	0	0	113.4	G42 F43 G48	G42-A46 WeakPolarHBondContact O-CB 3.45Å; G42-A46 PolarHBondContact O-N 2.76Å; F43-A46 PolarHBondContact O-N 3.21Å; A46-G48 PolarHBondContact O-N 3.26Å; A46-G48 VanDerWaalsContact O-N 3.13Å
47	T	77.5	Confident	82.6	Confident	66 Å²	66	42.5 Å²	42.5	41%	0.405	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-0.2	177.2	52	0	0	0	0	113.5	F43 A44 I45 G49 S360	F43-T47 HydrophobicContact CD1-CG2 4.37Å; F43-T47 HydrophobicContact CD2-CG2 3.93Å; F43-T47 HydrophobicContact CE1-CG2 4Å; F43-T47 HydrophobicContact CE2-CG2 3.52Å; F43-T47 HydrophobicContact CG-CG2 4.35Å; F43-T47 HydrophobicContact CZ-CG2 3.56Å; F43-T47 WeakPolarHBondContact O-CB 3.43Å; F43-T47 WeakPolarHBondContact O-CG2 3.39Å; F43-T47 PolarHBondContact O-N 3.01Å; F43-T47 PolarHBondContact O-OG1 3.49Å; A44-T47 PolarHBondContact O-OG1 3.12Å; I45-T47 PolarHBondContact O-N 2.77Å; T47-G49 VanDerWaalsContact C-N 3.32Å; T47-G49 PolarHBondContact O-N 3.45Å; T47-S360 WeakPolarHBondContact OG1-CB 3.35Å; T47-S360 PolarHBondContact OG1-OG 3.34Å
48	G	60.6	Low	82.4	Confident	25 Å²	25	42.3 Å²	42.3	26%	0.258	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	11	161.4	0	0	0	0	0	115.5	I45 A46 A50 S51	I45-G48 PolarHBondContact O-N 3.25Å; I45-G48 VanDerWaalsContact O-N 3.15Å; A46-G48 PolarHBondContact O-N 3.26Å; A46-G48 VanDerWaalsContact O-N 3.13Å; G48-A50 PolarHBondContact O-N 2.75Å; G48-S51 PolarHBondContact O-N 3.04Å; G48-S51 PolarHBondContact O-OG 3.35Å
49	G	65.3	Low	82.1	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-58.5	-29.8	177.1	0	0	0	0	0	113.7	T47 S51 R52 L53 T359	T47-G49 VanDerWaalsContact C-N 3.32Å; T47-G49 PolarHBondContact O-N 3.45Å; G49-S51 VanDerWaalsContact C-N 3.25Å; G49-S51 PolarHBondContact O-N 3.42Å; G49-R52 WeakPolarHBondContact O-CB 3.27Å; G49-R52 PolarHBondContact O-N 3.16Å; G49-L53 PolarHBondContact O-N 2.59Å; G49-L53 VanDerWaalsContact O-N 3.08Å; G49-T359 WeakPolarHBondContact CA-OG1 3.08Å; G49-T359 WeakPolarHBondContact O-CB 3.48Å; G49-T359 PolarHBondContact O-OG1 3Å; G49-T359 VanDerWaalsContact O-OG1 3.05Å
50	A	69.7	Low	81.9	Confident	29 Å²	29	35.4 Å²	35.4	24%	0.24	22%	0.218	C	C	.	.	H	α-helix	trans	-54.1	-39.2	178.7	0	0	0	0	0	113.2	G48 R52 L53 V54 F356	G48-A50 PolarHBondContact O-N 2.75Å; A50-R52 PolarHBondContact O-N 3.27Å; A50-L53 WeakPolarHBondContact O-CB 3.05Å; A50-L53 PolarHBondContact O-N 3.07Å; A50-V54 PolarHBondContact O-N 2.93Å; A50-F356 HydrophobicContact CB-CD1 3.79Å; A50-F356 HydrophobicContact CB-CE1 3.58Å; A50-F356 HydrophobicContact CB-CG 4.37Å; A50-F356 HydrophobicContact CB-CZ 4Å
51	S	75.6	Confident	81.6	Confident	25 Å²	25	35.3 Å²	35.3	18%	0.175	22%	0.219	C	C	.	.	H	α-helix	trans	-67.4	-35.8	178.3	64.5	0	0	0	0	112.7	G48 G49 L53 V54 S55	G48-S51 PolarHBondContact O-N 3.04Å; G48-S51 PolarHBondContact O-OG 3.35Å; G49-S51 VanDerWaalsContact C-N 3.25Å; G49-S51 PolarHBondContact O-N 3.42Å; S51-L53 VanDerWaalsContact C-N 3.32Å; S51-V54 PolarHBondContact O-N 3.02Å; S51-S55 WeakPolarHBondContact O-CB 3.4Å; S51-S55 PolarHBondContact O-N 2.89Å
52	R	79	Confident	81.6	Confident	30 Å²	30	34.1 Å²	34.1	11%	0.113	21%	0.211	C	C	.	.	H	α-helix	trans	-74	-24.7	177.2	-71.1	172.6	51.8	-140.6	-16.7	112.4	G49 A50 G56 T63 T359 Y374	G49-R52 WeakPolarHBondContact O-CB 3.27Å; G49-R52 PolarHBondContact O-N 3.16Å; A50-R52 PolarHBondContact O-N 3.27Å; R52-G56 WeakPolarHBondContact O-CA 3.39Å; R52-G56 PolarHBondContact O-N 3.38Å; R52-G56 VanDerWaalsContact O-N 3.13Å; R52-T63 HydrophobicContact CG-CG2 4.11Å; R52-T359 PolarHBondContact NH1-O 2.88Å; R52-Y374 VanDerWaalsContact CZ-CE2 3.43Å; R52-Y374 VanDerWaalsContact NH2-CD1 3.31Å
53	L	76.8	Confident	81.6	Confident	40 Å²	40	32.6 Å²	32.6	21%	0.209	19%	0.194	C	C	.	.	H	α-helix	trans	-68.7	-46.6	172.8	-170.4	64.8	0	0	0	111.5	G49 A50 S51 L355 F356 T359	G49-L53 PolarHBondContact O-N 2.59Å; G49-L53 VanDerWaalsContact O-N 3.08Å; A50-L53 WeakPolarHBondContact O-CB 3.05Å; A50-L53 PolarHBondContact O-N 3.07Å; S51-L53 VanDerWaalsContact C-N 3.32Å; L53-L355 HydrophobicContact CD2-CB 3.93Å; L53-L355 HydrophobicContact CD2-CD1 4.48Å; L53-F356 HydrophobicContact CD2-CD1 4.27Å; L53-F356 HydrophobicContact CD2-CE1 4.23Å; L53-T359 HydrophobicContact CB-CG2 4.08Å; L53-T359 HydrophobicContact CD1-CG2 4.09Å
54	V	78.9	Confident	81.7	Confident	65 Å²	65	29 Å²	29	39%	0.394	18%	0.179	S	C	.	.	H	α-helix	trans	-82.9	-49.7	-174.7	178.6	0	0	0	0	112.1	A50 S51 F170	A50-V54 PolarHBondContact O-N 2.93Å; S51-V54 PolarHBondContact O-N 3.02Å; V54-F170 CarbonylContact O-C 3.43Å; V54-F170 WeakPolarHBondContact O-CA 3.38Å; V54-F170 VanDerWaalsContact O-O 3.12Å
55	S	82.9	Confident	82	Confident	14 Å²	14	30 Å²	30	10%	0.098	19%	0.189	C	C	.	.	S	Bend	trans	-89	-18.1	-177.1	-59.1	0	0	0	0	113.9	S51 C64 V89	S51-S55 WeakPolarHBondContact O-CB 3.4Å; S51-S55 PolarHBondContact O-N 2.89Å; S55-C64 WeakPolarHBondContact CB-O 3.38Å; S55-V89 WeakPolarHBondContact O-CG2 3.37Å
56	G	83.6	Confident	82.3	Confident	4 Å²	4	32.2 Å²	32.2	4%	0.041	19%	0.191	C	C	.	.			trans	69.5	-179.6	-172.1	0	0	0	0	0	113.6	R52 T63 C64	R52-G56 WeakPolarHBondContact O-CA 3.39Å; R52-G56 PolarHBondContact O-N 3.38Å; R52-G56 VanDerWaalsContact O-N 3.13Å; G56-T63 WeakPolarHBondContact O-CG2 3.31Å; G56-C64 PolarHBondContact O-N 2.93Å
57	Y	86.9	Confident	82.6	Confident	81 Å²	81	32.2 Å²	32.2	32%	0.318	18%	0.179	S	C	.	.	B	Isolated β-bridge	trans	-143.5	154.1	178.4	66.8	-84.6	0	0	0	110	N62 Y374	Y57-N62 CarbonylContact C-O 3.5Å; Y57-N62 WeakPolarHBondContact CA-O 3.26Å; Y57-N62 WeakPolarHBondContact CB-O 3.42Å; Y57-Y374 HydrophobicContact CD1-CE2 4.24Å; Y57-Y374 HydrophobicContact CD2-CD2 4.31Å; Y57-Y374 AromaticContact CD2-CE2 3.58Å; Y57-Y374 HydrophobicContact CD2-CE2 3.58Å; Y57-Y374 HydrophobicContact CE1-CD2 4.09Å; Y57-Y374 HydrophobicContact CE1-CE2 4.08Å; Y57-Y374 AromaticContact CE2-CD2 3.71Å; Y57-Y374 HydrophobicContact CE2-CD2 3.71Å; Y57-Y374 AromaticContact CE2-CE2 3.44Å; Y57-Y374 HydrophobicContact CE2-CE2 3.44Å; Y57-Y374 VanDerWaalsContact CE2-CE2 3.44Å; Y57-Y374 HydrophobicContact CG-CE2 4.01Å; Y57-Y374 AromaticContact CZ-CD2 3.58Å; Y57-Y374 AromaticContact CZ-CE2 3.7Å
58	D	89.9	Confident	83.2	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.005	16%	0.161	C	C	.	.			trans	-82.9	171.4	176.9	72.2	15.1	0	0	0	112.5	Y60 G61 N62 M83 A108 Y139	D58-Y60 PolarHBondContact O-N 3.35Å; D58-Y60 WeakPolarHBondContact OD1-CA 3.5Å; D58-Y60 PolarHBondContact OD1-N 2.93Å; D58-G61 PolarHBondContact O-N 3.44Å; D58-G61 PolarHBondContact OD1-N 3.37Å; D58-N62 PolarHBondContact N-O 3.47Å; D58-N62 PolarHBondContact OD1-N 3.21Å; D58-N62 PolarHBondContact OD1-ND2 3.23Å; D58-N62 WeakPolarHBondContact OD2-CB 3.28Å; D58-N62 PolarHBondContact OD2-ND2 3.27Å; D58-M83 WeakPolarHBondContact OD2-CE 3.29Å; D58-A108 WeakPolarHBondContact CA-O 3.5Å; D58-A108 WeakPolarHBondContact CB-O 3.34Å; D58-Y139 WeakPolarHBondContact OD2-CE2 3.24Å; D58-Y139 PolarHBondContact OD2-OH 3.04Å
59	S	88.9	Confident	84.5	Confident	12 Å²	12	31.6 Å²	31.6	8%	0.084	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-8.9	-179.7	-73	0	0	0	0	114.9	I107 A108 V371 V372	S59-I107 WeakPolarHBondContact OG-CA 3.39Å; S59-A108 PolarHBondContact N-O 3.37Å; S59-A108 PolarHBondContact OG-N 3.06Å; S59-V371 WeakPolarHBondContact O-CA 3.41Å; S59-V371 WeakPolarHBondContact O-CB 3.36Å; S59-V372 PolarHBondContact O-N 2.95Å
60	Y	89.5	Confident	85.5	Confident	22 Å²	22	39.1 Å²	39.1	9%	0.086	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	3.1	178.5	-51.6	-74.6	0	0	0	112.4	D58 V76 L78 S79 L109 S138 Y139 V372	D58-Y60 PolarHBondContact O-N 3.35Å; D58-Y60 WeakPolarHBondContact OD1-CA 3.5Å; D58-Y60 PolarHBondContact OD1-N 2.93Å; Y60-V76 HydrophobicContact CD1-CG1 4.4Å; Y60-L78 HydrophobicContact CD1-CB 3.73Å; Y60-L78 HydrophobicContact CD1-CD1 3.87Å; Y60-L78 HydrophobicContact CD1-CG 4.41Å; Y60-L78 HydrophobicContact CD2-CB 4.27Å; Y60-L78 HydrophobicContact CE1-CB 4.2Å; Y60-L78 HydrophobicContact CE1-CD1 3.43Å; Y60-L78 VanDerWaalsContact CE1-CD1 3.43Å; Y60-L78 HydrophobicContact CE1-CG 4.42Å; Y60-L78 HydrophobicContact CE2-CD1 4.15Å; Y60-L78 HydrophobicContact CG-CB 3.75Å; Y60-L78 HydrophobicContact CG-CD1 4.38Å; Y60-S79 VanDerWaalsContact O-CB 3.32Å; Y60-S79 WeakPolarHBondContact O-CB 3.28Å; Y60-L109 HydrophobicContact CE2-CD2 4.04Å; Y60-S138 PolarHBondContact OH-OG 3.31Å; Y60-Y139 AromaticContact CD2-CD2 3.56Å; Y60-Y139 HydrophobicContact CD2-CD2 3.56Å; Y60-Y139 AromaticContact CD2-CE2 3.53Å; Y60-Y139 HydrophobicContact CD2-CE2 3.53Å; Y60-Y139 AromaticContact CE2-CD2 3.58Å; Y60-Y139 HydrophobicContact CE2-CD2 3.58Å; Y60-Y139 AromaticContact CE2-CE2 3.85Å; Y60-Y139 HydrophobicContact CE2-CE2 3.85Å; Y60-Y139 HydrophobicContact CE2-CG 4.43Å; Y60-V372 WeakPolarHBondContact O-CG2 3.44Å
61	G	86.8	Confident	86.1	Confident	9 Å²	9	43.9 Å²	43.9	9%	0.093	23%	0.226	C	C	.	.	S	Bend	trans	87.3	8.1	176.5	0	0	0	0	0	114.8	D58 Y374	D58-G61 PolarHBondContact O-N 3.44Å; D58-G61 PolarHBondContact OD1-N 3.37Å; G61-Y374 PolarHBondContact O-OH 3.11Å
62	N	90.8	Very high	86.7	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-77.5	130.1	173.7	-53.3	-64.2	0	0	0	109.6	Y57 D58 L78 S79 G80 A81 M83	Y57-N62 CarbonylContact C-O 3.5Å; Y57-N62 WeakPolarHBondContact CA-O 3.26Å; Y57-N62 WeakPolarHBondContact CB-O 3.42Å; D58-N62 PolarHBondContact N-O 3.47Å; D58-N62 PolarHBondContact OD1-N 3.21Å; D58-N62 PolarHBondContact OD1-ND2 3.23Å; D58-N62 WeakPolarHBondContact OD2-CB 3.28Å; D58-N62 PolarHBondContact OD2-ND2 3.27Å; N62-L78 PolarHBondContact ND2-O 3.05Å; N62-S79 WeakPolarHBondContact OD1-CA 3.41Å; N62-G80 PolarHBondContact OD1-N 2.72Å; N62-A81 PolarHBondContact OD1-N 3.1Å; N62-A81 VanDerWaalsContact OD1-N 3.12Å; N62-M83 HydrophobicContact CB-CE 3.93Å; N62-M83 HydrophobicContact CB-CG 3.83Å
63	T	90.1	Very high	87.1	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.031	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-79.4	126.8	173.5	-54.6	0	0	0	0	109	R52 G56 R66 N68	R52-T63 HydrophobicContact CG-CG2 4.11Å; G56-T63 WeakPolarHBondContact O-CG2 3.31Å; T63-R66 HydrophobicContact CG2-CB 4.37Å; T63-R66 HydrophobicContact CG2-CG 4.04Å; T63-N68 PolarHBondContact N-ND2 3.26Å; T63-N68 PolarHBondContact N-OD1 3.45Å; T63-N68 PolarHBondContact O-ND2 3.26Å
64	C	90.9	Very high	87.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	147	-178.3	-55.9	0	0	0	0	111.2	S55 G56 R66 K86 V89 C110	S55-C64 WeakPolarHBondContact CB-O 3.38Å; G56-C64 PolarHBondContact O-N 2.93Å; C64-R66 PolarHBondContact O-N 3.19Å; C64-K86 CarbonylContact C-O 3.42Å; C64-K86 WeakPolarHBondContact CA-O 3.25Å; C64-K86 VanDerWaalsContact CB-O 3.3Å; C64-K86 WeakPolarHBondContact CB-O 3.34Å; C64-V89 HydrophobicContact CB-CG2 4.43Å; C64-V89 VanDerWaalsContact SG-CG2 3.6Å; C64-C110 WeakPolarHBondContact CA-SG 3.26Å; C64-C110 HydrophobicContact CB-CB 3.86Å; C64-C110 WeakPolarHBondContact CB-SG 3.49Å; C64-C110 WeakPolarHBondContact SG-CA 3.43Å; C64-C110 WeakPolarHBondContact SG-CB 3.31Å; C64-C110 CovalentContact SG-SG 2.04Å; C64-C110 PolarHBondContact SG-SG 3.29Å
65	G	89.9	Confident	87.6	Confident	21 Å²	21	54.3 Å²	54.3	22%	0.216	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	19.3	-178	0	0	0	0	0	114.4	M83 K86	G65-M83 WeakPolarHBondContact CA-O 3.44Å; G65-M83 PolarHBondContact N-O 3.2Å; G65-K86 PolarHBondContact N-O 2.92Å
66	R	90.1	Very high	87.8	Confident	142 Å²	142	53.9 Å²	53.9	54%	0.536	28%	0.282	S	S	.	.	S	Bend	trans	-138.1	154.1	-178.6	-66.9	-67.8	-174	163.9	-1.2	111	T63 C64 N68 M83 T84	T63-R66 HydrophobicContact CG2-CB 4.37Å; T63-R66 HydrophobicContact CG2-CG 4.04Å; C64-R66 PolarHBondContact O-N 3.19Å; R66-N68 PolarHBondContact O-ND2 3.37Å; R66-M83 CarbonylContact O-C 3.54Å; R66-M83 WeakPolarHBondContact O-CA 3.41Å; R66-M83 PolarHBondContact O-N 2.96Å; R66-M83 VanDerWaalsContact O-N 3.07Å; R66-T84 PolarHBondContact O-N 2.94Å
67	N	90.9	Very high	87.9	Confident	84 Å²	84	58.9 Å²	58.9	45%	0.449	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-79	120	169.5	-173.1	-11.1	0	0	0	110.1	T69 T84	N67-T69 WeakPolarHBondContact OD1-CB 3.17Å; N67-T69 VanDerWaalsContact OD1-CG2 3.26Å; N67-T69 WeakPolarHBondContact OD1-CG2 3.42Å; N67-T69 PolarHBondContact OD1-N 3.14Å; N67-T69 PolarHBondContact OD1-OG1 3.27Å; N67-T84 PolarHBondContact N-OG1 3.21Å
68	N	90	Very high	88	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.021	31%	0.311	C	S	.	.			trans	-107.2	6.6	-179.7	-52.8	-84.7	0	0	0	113.6	T63 R66 N70 K71 G80 A81	T63-N68 PolarHBondContact N-ND2 3.26Å; T63-N68 PolarHBondContact N-OD1 3.45Å; T63-N68 PolarHBondContact O-ND2 3.26Å; R66-N68 PolarHBondContact O-ND2 3.37Å; N68-N70 PolarHBondContact O-N 2.98Å; N68-K71 WeakPolarHBondContact O-CA 3.45Å; N68-K71 PolarHBondContact O-N 2.87Å; N68-G80 VanDerWaalsContact O-CA 3.23Å; N68-G80 WeakPolarHBondContact O-CA 3.28Å; N68-A81 WeakPolarHBondContact CB-O 3.4Å; N68-A81 PolarHBondContact ND2-O 3.02Å; N68-A81 VanDerWaalsContact ND2-O 3.14Å
69	T	87.8	Confident	87.9	Confident	74 Å²	74	57.5 Å²	57.5	45%	0.454	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-34.8	-173.9	53.3	0	0	0	0	114	N67 K71 G80	N67-T69 WeakPolarHBondContact OD1-CB 3.17Å; N67-T69 VanDerWaalsContact OD1-CG2 3.26Å; N67-T69 WeakPolarHBondContact OD1-CG2 3.42Å; N67-T69 PolarHBondContact OD1-N 3.14Å; N67-T69 PolarHBondContact OD1-OG1 3.27Å; T69-K71 VanDerWaalsContact C-N 3.33Å; T69-K71 PolarHBondContact O-N 2.98Å; T69-G80 WeakPolarHBondContact CA-O 3.36Å
70	N	85.4	Confident	87.9	Confident	160 Å²	160	57.6 Å²	57.6	86%	0.856	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	7.6	178.1	-63	-24.9	0	0	0	114.2	N68	N68-N70 PolarHBondContact O-N 2.98Å
71	K	84.1	Confident	88	Confident	128 Å²	128	58.4 Å²	58.4	56%	0.557	33%	0.327	S	S	*	.			trans	-125.7	31.8	-174	-62.4	-174.3	178.7	-178.2	0	112.6	N68 T69 I73	N68-K71 WeakPolarHBondContact O-CA 3.45Å; N68-K71 PolarHBondContact O-N 2.87Å; T69-K71 VanDerWaalsContact C-N 3.33Å; T69-K71 PolarHBondContact O-N 2.98Å; K71-I73 PolarHBondContact O-N 2.95Å
72	K	87.7	Confident	88.2	Confident	145 Å²	145	62.1 Å²	62.1	63%	0.63	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-61.3	133.7	176.4	-167.8	173.3	-176.3	178.3	0	110.1
73	I	87	Confident	88.3	Confident	23 Å²	23	62.3 Å²	62.3	12%	0.118	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-98.2	128.3	-179.4	-60.2	163.1	0	0	0	108.5	K71 G75 V76 S79 P363 V372	K71-I73 PolarHBondContact O-N 2.95Å; I73-G75 PolarHBondContact O-N 3.22Å; I73-V76 HydrophobicContact CB-CB 4.33Å; I73-V76 HydrophobicContact CB-CG2 4.47Å; I73-V76 HydrophobicContact CG2-CB 4.42Å; I73-V76 HydrophobicContact CG2-CG2 4.04Å; I73-V76 PolarHBondContact O-N 3.24Å; I73-S79 PolarHBondContact N-OG 2.94Å; I73-S79 PolarHBondContact O-OG 2.95Å; I73-P363 HydrophobicContact CD1-CB 3.67Å; I73-P363 HydrophobicContact CD1-CG 4.04Å; I73-P363 HydrophobicContact CG1-CB 4.18Å; I73-P363 HydrophobicContact CG1-CG 4.04Å; I73-P363 HydrophobicContact CG2-CB 4.45Å; I73-V372 HydrophobicContact CD1-CG1 4.05Å; I73-V372 HydrophobicContact CD1-CG2 4.07Å
74	D	84.4	Confident	88.4	Confident	155 Å²	155	64.6 Å²	64.6	83%	0.829	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	135.7	179.7	-64.8	-35.4	0	0	0	111.7	V76	D74-V76 VanDerWaalsContact C-N 3.26Å; D74-V76 PolarHBondContact O-N 3.29Å
75	G	82.6	Confident	88.4	Confident	56 Å²	56	71.5 Å²	71.5	58%	0.577	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	3.6	-178.4	0	0	0	0	0	115.7	I73 K365	I73-G75 PolarHBondContact O-N 3.22Å; G75-K365 WeakPolarHBondContact O-CD 3.48Å; G75-K365 PolarHBondContact O-NZ 3.06Å
76	V	85.8	Confident	88.5	Confident	5 Å²	5	72.4 Å²	72.4	3%	0.03	39%	0.39	C	S	.	.			trans	-122.9	94.1	177.4	-173.8	0	0	0	0	110.3	Y60 I73 D74 L78 S79 K365 V372	Y60-V76 HydrophobicContact CD1-CG1 4.4Å; I73-V76 HydrophobicContact CB-CB 4.33Å; I73-V76 HydrophobicContact CB-CG2 4.47Å; I73-V76 HydrophobicContact CG2-CB 4.42Å; I73-V76 HydrophobicContact CG2-CG2 4.04Å; I73-V76 PolarHBondContact O-N 3.24Å; D74-V76 VanDerWaalsContact C-N 3.26Å; D74-V76 PolarHBondContact O-N 3.29Å; V76-L78 VanDerWaalsContact C-N 3.29Å; V76-L78 PolarHBondContact O-N 3.44Å; V76-S79 WeakPolarHBondContact O-CB 3.31Å; V76-S79 PolarHBondContact O-N 3.48Å; V76-S79 PolarHBondContact O-OG 2.97Å; V76-K365 HydrophobicContact CG2-CB 3.98Å; V76-K365 HydrophobicContact CG2-CD 4.03Å; V76-K365 HydrophobicContact CG2-CG 4.1Å; V76-V372 HydrophobicContact CB-CG2 4.47Å; V76-V372 HydrophobicContact CG1-CG2 4.06Å; V76-V372 HydrophobicContact CG2-CG2 3.87Å
77	P	86	Confident	88.6	Confident	109 Å²	109	70.8 Å²	70.8	71%	0.708	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-31.1	-173.2	-25.9	34.8	0	0	0	115.2	S79	P77-S79 VanDerWaalsContact C-N 3.28Å; P77-S79 PolarHBondContact O-N 3.43Å
78	L	88.3	Confident	88.6	Confident	46 Å²	46	69.7 Å²	69.7	24%	0.241	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	4.9	-177.2	-62.9	171.8	0	0	0	113.6	Y60 N62 V76 E140	Y60-L78 HydrophobicContact CD1-CB 3.73Å; Y60-L78 HydrophobicContact CD1-CD1 3.87Å; Y60-L78 HydrophobicContact CD1-CG 4.41Å; Y60-L78 HydrophobicContact CD2-CB 4.27Å; Y60-L78 HydrophobicContact CE1-CB 4.2Å; Y60-L78 HydrophobicContact CE1-CD1 3.43Å; Y60-L78 VanDerWaalsContact CE1-CD1 3.43Å; Y60-L78 HydrophobicContact CE1-CG 4.42Å; Y60-L78 HydrophobicContact CE2-CD1 4.15Å; Y60-L78 HydrophobicContact CG-CB 3.75Å; Y60-L78 HydrophobicContact CG-CD1 4.38Å; N62-L78 PolarHBondContact ND2-O 3.05Å; V76-L78 VanDerWaalsContact C-N 3.29Å; V76-L78 PolarHBondContact O-N 3.44Å; L78-E140 HydrophobicContact CD1-CG 3.69Å
79	S	89.7	Confident	88.6	Confident	7 Å²	7	69.7 Å²	69.7	5%	0.049	38%	0.377	C	S	.	.			trans	-84.8	159.5	171.8	71.3	0	0	0	0	111.1	Y60 N62 I73 V76 P77	Y60-S79 VanDerWaalsContact O-CB 3.32Å; Y60-S79 WeakPolarHBondContact O-CB 3.28Å; N62-S79 WeakPolarHBondContact OD1-CA 3.41Å; I73-S79 PolarHBondContact N-OG 2.94Å; I73-S79 PolarHBondContact O-OG 2.95Å; V76-S79 WeakPolarHBondContact O-CB 3.31Å; V76-S79 PolarHBondContact O-N 3.48Å; V76-S79 PolarHBondContact O-OG 2.97Å; P77-S79 VanDerWaalsContact C-N 3.28Å; P77-S79 PolarHBondContact O-N 3.43Å
80	G	88.6	Confident	88.7	Confident	15 Å²	15	66.5 Å²	66.5	16%	0.155	36%	0.357	C	S	.	.	S	Bend	trans	80.2	19.3	177.8	0	0	0	0	0	114.6	N62 N68 T69	N62-G80 PolarHBondContact OD1-N 2.72Å; N68-G80 VanDerWaalsContact O-CA 3.23Å; N68-G80 WeakPolarHBondContact O-CA 3.28Å; T69-G80 WeakPolarHBondContact CA-O 3.36Å
81	A	90.5	Very high	88.7	Confident	39 Å²	39	60.5 Å²	60.5	32%	0.322	32%	0.323	S	S	.	.			trans	-83.5	146.1	177	0	0	0	0	0	111.7	N62 N68 M83	N62-A81 PolarHBondContact OD1-N 3.1Å; N62-A81 VanDerWaalsContact OD1-N 3.12Å; N68-A81 WeakPolarHBondContact CB-O 3.4Å; N68-A81 PolarHBondContact ND2-O 3.02Å; N68-A81 VanDerWaalsContact ND2-O 3.14Å; A81-M83 HydrophobicContact CB-CE 3.82Å; A81-M83 PolarHBondContact O-N 3.28Å
82	D	91.7	Very high	88.8	Confident	87 Å²	87	55.1 Å²	55.1	47%	0.465	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-70.5	117.1	173.4	-170.5	1.4	0	0	0	110.2	T84	D82-T84 VanDerWaalsContact OD1-CB 3.32Å; D82-T84 WeakPolarHBondContact OD1-CB 3.42Å; D82-T84 PolarHBondContact OD1-N 3.49Å; D82-T84 PolarHBondContact OD1-OG1 2.99Å
83	M	92.8	Very high	88.3	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.015	28%	0.282	C	S	.	.			trans	-114.7	17.9	-179.3	-60.6	-58.9	-174	0	0	111.9	D58 N62 G65 R66 A81 E85 K86 C110 Y139	D58-M83 WeakPolarHBondContact OD2-CE 3.29Å; N62-M83 HydrophobicContact CB-CE 3.93Å; N62-M83 HydrophobicContact CB-CG 3.83Å; G65-M83 WeakPolarHBondContact CA-O 3.44Å; G65-M83 PolarHBondContact N-O 3.2Å; R66-M83 CarbonylContact O-C 3.54Å; R66-M83 WeakPolarHBondContact O-CA 3.41Å; R66-M83 PolarHBondContact O-N 2.96Å; R66-M83 VanDerWaalsContact O-N 3.07Å; A81-M83 HydrophobicContact CB-CE 3.82Å; A81-M83 PolarHBondContact O-N 3.28Å; M83-E85 VanDerWaalsContact C-N 3.28Å; M83-E85 PolarHBondContact O-N 3.13Å; M83-K86 HydrophobicContact CB-CB 4.47Å; M83-K86 CarbonylContact O-C 3.05Å; M83-K86 PolarHBondContact O-N 3.1Å; M83-K86 HydrophobicContact SD-CB 4.44Å; M83-K86 HydrophobicContact SD-CD 3.72Å; M83-C110 HydrophobicContact CB-CB 4.43Å; M83-C110 HydrophobicContact CG-CB 4.24Å; M83-C110 HydrophobicContact SD-CB 3.93Å; M83-Y139 HydrophobicContact CE-CE1 4.46Å; M83-Y139 HydrophobicContact CE-CE2 3.77Å; M83-Y139 VanDerWaalsContact CE-OH 3.32Å; M83-Y139 WeakPolarHBondContact CE-OH 3.32Å
84	T	91.4	Very high	87.5	Confident	54 Å²	54	50.2 Å²	50.2	33%	0.331	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-41.7	-175.5	-58.5	0	0	0	0	112.7	R66 N67 D82	R66-T84 PolarHBondContact O-N 2.94Å; N67-T84 PolarHBondContact N-OG1 3.21Å; D82-T84 VanDerWaalsContact OD1-CB 3.32Å; D82-T84 WeakPolarHBondContact OD1-CB 3.42Å; D82-T84 PolarHBondContact OD1-N 3.49Å; D82-T84 PolarHBondContact OD1-OG1 2.99Å
85	E	92.1	Very high	86.7	Confident	144 Å²	144	45.8 Å²	45.8	67%	0.673	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-11.4	178.2	-61.6	-53.1	134.2	0	0	114.1	M83 S112	M83-E85 VanDerWaalsContact C-N 3.28Å; M83-E85 PolarHBondContact O-N 3.13Å; E85-S112 WeakPolarHBondContact O-CA 3.43Å; E85-S112 VanDerWaalsContact O-CB 3.26Å; E85-S112 WeakPolarHBondContact O-CB 3.32Å
86	K	92.3	Very high	85.9	Confident	40 Å²	40	48.8 Å²	48.8	17%	0.174	26%	0.258	C	S	.	.			trans	-107.2	81.9	-175.9	-67.7	170.5	-177.4	166.3	0	109.9	C64 G65 M83 C110 V111 G133	C64-K86 CarbonylContact C-O 3.42Å; C64-K86 WeakPolarHBondContact CA-O 3.25Å; C64-K86 VanDerWaalsContact CB-O 3.3Å; C64-K86 WeakPolarHBondContact CB-O 3.34Å; G65-K86 PolarHBondContact N-O 2.92Å; M83-K86 HydrophobicContact CB-CB 4.47Å; M83-K86 CarbonylContact O-C 3.05Å; M83-K86 PolarHBondContact O-N 3.1Å; M83-K86 HydrophobicContact SD-CB 4.44Å; M83-K86 HydrophobicContact SD-CD 3.72Å; K86-C110 HydrophobicContact CB-CB 3.76Å; K86-V111 CarbonylContact C-O 3.6Å; K86-V111 VanDerWaalsContact C-O 3.29Å; K86-V111 WeakPolarHBondContact CA-O 2.96Å; K86-G133 WeakPolarHBondContact CE-O 3.4Å
87	K	91.1	Very high	84.6	Confident	108 Å²	108	50.7 Å²	50.7	47%	0.47	27%	0.266	S	S	.	.			trans	-81.2	-25.9	-168	-63.9	177.2	-176.3	172.5	0	114.6	V111 H171	K87-V111 PolarHBondContact N-O 3.44Å; K87-V111 VanDerWaalsContact N-O 3.1Å; K87-H171 WeakPolarHBondContact O-CB 3.44Å
88	Y	90.9	Very high	83.1	Confident	62 Å²	62	47.1 Å²	47.1	24%	0.243	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	146.9	-170.9	-55.8	-78.5	0	0	0	112.7	C110 V111 S112 A166 H171	Y88-C110 CarbonylContact O-C 3.36Å; Y88-C110 WeakPolarHBondContact O-CA 2.95Å; Y88-V111 PolarHBondContact N-O 3.37Å; Y88-V111 PolarHBondContact O-N 3.49Å; Y88-S112 VanDerWaalsContact CD2-O 3.25Å; Y88-S112 WeakPolarHBondContact CD2-O 3.43Å; Y88-S112 VanDerWaalsContact CE2-O 3.25Å; Y88-S112 WeakPolarHBondContact CE2-O 3.39Å; Y88-A166 HydrophobicContact CD1-CB 3.81Å; Y88-A166 HydrophobicContact CE1-CB 3.38Å; Y88-H171 CarbonylContact C-O 3.6Å; Y88-H171 WeakPolarHBondContact CA-O 3.36Å; Y88-H171 HydrophobicContact CD1-CB 4.06Å; Y88-H171 HydrophobicContact CE1-CB 4.48Å
89	V	89.9	Confident	81.3	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.018	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.1	169.5	-177.1	0	0	0	0	110.2	S55 C64 F91 A108 L109 H171 R172 C173	S55-V89 WeakPolarHBondContact O-CG2 3.37Å; C64-V89 HydrophobicContact CB-CG2 4.43Å; C64-V89 VanDerWaalsContact SG-CG2 3.6Å; V89-F91 HydrophobicContact CG1-CD2 4.49Å; V89-F91 HydrophobicContact CG1-CE1 4.26Å; V89-F91 HydrophobicContact CG1-CE2 3.95Å; V89-F91 HydrophobicContact CG1-CZ 3.82Å; V89-A108 HydrophobicContact CG1-CB 3.93Å; V89-L109 WeakPolarHBondContact CA-O 3.39Å; V89-H171 PolarHBondContact N-O 3.16Å; V89-R172 HydrophobicContact CB-CG 4.13Å; V89-C173 PolarHBondContact O-N 3.18Å
90	F	89.6	Confident	79.2	Confident	7 Å²	7	56.3 Å²	56.3	3%	0.031	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.5	172	175.7	-101.2	0	0	0	110.3	L92 A108 L109 V111 P115 L136 P157 V161 C173	F90-L92 HydrophobicContact CD1-CD1 4.4Å; F90-L92 HydrophobicContact CE1-CD1 4.31Å; F90-A108 CarbonylContact O-C 3.12Å; F90-A108 VanDerWaalsContact O-CA 3.26Å; F90-A108 WeakPolarHBondContact O-CA 2.96Å; F90-L109 PolarHBondContact N-O 3.38Å; F90-L109 PolarHBondContact O-N 3.44Å; F90-V111 HydrophobicContact CB-CG1 3.81Å; F90-V111 HydrophobicContact CB-CG2 3.92Å; F90-P115 HydrophobicContact CE2-CG 4.17Å; F90-L136 HydrophobicContact CD1-CD2 3.84Å; F90-L136 HydrophobicContact CD2-CD2 4.29Å; F90-L136 HydrophobicContact CE1-CB 4.49Å; F90-L136 HydrophobicContact CE1-CD2 3.87Å; F90-L136 HydrophobicContact CE2-CD2 4.32Å; F90-L136 HydrophobicContact CG-CD2 4.06Å; F90-L136 HydrophobicContact CZ-CD2 4.12Å; F90-P157 HydrophobicContact CE1-CB 4.47Å; F90-P157 HydrophobicContact CE1-CG 4.35Å; F90-P157 HydrophobicContact CZ-CB 4.45Å; F90-P157 HydrophobicContact CZ-CG 4.45Å; F90-V161 HydrophobicContact CE2-CG1 4.09Å; F90-V161 HydrophobicContact CZ-CG1 3.9Å; F90-C173 HydrophobicContact CD2-CB 4.27Å
91	F	86.8	Confident	77.3	Confident	35 Å²	35	58 Å²	58	15%	0.154	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	133.9	175.7	-61.3	-85.5	0	0	0	109.6	V89 E93 P94 F104 A108	V89-F91 HydrophobicContact CG1-CD2 4.49Å; V89-F91 HydrophobicContact CG1-CE1 4.26Å; V89-F91 HydrophobicContact CG1-CE2 3.95Å; V89-F91 HydrophobicContact CG1-CZ 3.82Å; F91-E93 VanDerWaalsContact C-N 3.34Å; F91-E93 PolarHBondContact O-N 3.35Å; F91-P94 HydrophobicContact CB-CB 4.32Å; F91-P94 WeakPolarHBondContact O-CD 3.15Å; F91-F104 HydrophobicContact CD1-CB 4.36Å; F91-F104 HydrophobicContact CD1-CG 4.46Å; F91-F104 HydrophobicContact CE1-CB 4.4Å; F91-F104 HydrophobicContact CE1-CD2 4.29Å; F91-F104 HydrophobicContact CE1-CG 4.41Å; F91-A108 HydrophobicContact CD1-CB 3.81Å; F91-A108 HydrophobicContact CE1-CB 3.8Å
92	L	85.2	Confident	75.4	Confident	14 Å²	14	65.5 Å²	65.5	7%	0.073	32%	0.317	C	S	.	.	S	Bend	trans	-64.5	-38.2	-178.7	-93.7	67.7	0	0	0	112.9	F90 S106 I107 L109 P157	F90-L92 HydrophobicContact CD1-CD1 4.4Å; F90-L92 HydrophobicContact CE1-CD1 4.31Å; L92-S106 WeakPolarHBondContact CB-OG 3.37Å; L92-S106 PolarHBondContact N-OG 2.91Å; L92-I107 HydrophobicContact CD1-CB 4.09Å; L92-I107 HydrophobicContact CD1-CG2 4.12Å; L92-I107 WeakPolarHBondContact CD1-O 3.35Å; L92-I107 HydrophobicContact CD2-CB 4.13Å; L92-I107 HydrophobicContact CD2-CD1 4.48Å; L92-I107 PolarHBondContact N-O 3.37Å; L92-L109 HydrophobicContact CD1-CD1 3.66Å; L92-L109 HydrophobicContact CD1-CG 3.98Å; L92-P157 HydrophobicContact CB-CB 4.28Å; L92-P157 HydrophobicContact CG-CB 4.19Å; L92-P157 WeakPolarHBondContact O-CB 3.18Å
93	E	77.8	Confident	73.7	Confident	51 Å²	51	66.3 Å²	66.3	24%	0.238	32%	0.316	C	S	.	.	S	Bend	trans	-129.4	79.6	176.9	-68.1	-174.7	-83	0	0	108	F91 C95 K96 S106 K158	F91-E93 VanDerWaalsContact C-N 3.34Å; F91-E93 PolarHBondContact O-N 3.35Å; E93-C95 PolarHBondContact O-N 2.91Å; E93-C95 VanDerWaalsContact O-N 3.14Å; E93-K96 HydrophobicContact CB-CB 4.04Å; E93-K96 PolarHBondContact O-N 3.38Å; E93-S106 PolarHBondContact N-OG 2.88Å; E93-K158 WeakPolarHBondContact OE2-CE 3.46Å; E93-K158 IonicContact OE2-NZ 3.35Å; E93-K158 PolarHBondContact OE2-NZ 3.36Å
94	P	69.3	Low	72	Confident	14 Å²	14	69.9 Å²	69.9	9%	0.091	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-20.8	-176.9	25.4	-32.3	0	0	0	112.7	F91 F104 P175	F91-P94 HydrophobicContact CB-CB 4.32Å; F91-P94 WeakPolarHBondContact O-CD 3.15Å; P94-F104 WeakPolarHBondContact O-CE1 3.29Å; P94-P175 HydrophobicContact CB-CG 4Å; P94-P175 HydrophobicContact CG-CG 3.7Å
95	C	68.2	Low	70.5	Confident	62 Å²	62	74.1 Å²	74.1	42%	0.419	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-11.2	-178.4	-37.1	0	0	0	0	113.8	E93 F97 C180	E93-C95 PolarHBondContact O-N 2.91Å; E93-C95 VanDerWaalsContact O-N 3.14Å; C95-F97 PolarHBondContact O-N 2.89Å; C95-C180 WeakPolarHBondContact CA-SG 3.25Å; C95-C180 HydrophobicContact CB-CB 4.19Å; C95-C180 WeakPolarHBondContact CB-O 3.3Å; C95-C180 WeakPolarHBondContact CB-SG 3.49Å; C95-C180 WeakPolarHBondContact SG-CB 3.3Å; C95-C180 CovalentContact SG-SG 2.03Å; C95-C180 PolarHBondContact SG-SG 2.72Å
96	K	65.1	Low	69.6	Low	119 Å²	119	67.9 Å²	67.9	52%	0.517	32%	0.318	S	S	.	.			trans	-93.6	71.4	-178	-161.7	-179.8	-175.9	-177.4	0	111	E93	E93-K96 HydrophobicContact CB-CB 4.04Å; E93-K96 PolarHBondContact O-N 3.38Å
97	F	60.3	Low	69.2	Low	45 Å²	45	68 Å²	68	20%	0.197	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	124.5	177	-177.1	-101.4	0	0	0	110.9	C95 I99 F104 F184	C95-F97 PolarHBondContact O-N 2.89Å; F97-I99 HydrophobicContact CD1-CG1 3.89Å; F97-I99 HydrophobicContact CE1-CG1 4.23Å; F97-I99 PolarHBondContact O-N 3.04Å; F97-F104 HydrophobicContact CB-CD1 4.21Å; F97-F104 HydrophobicContact CB-CE1 3.97Å; F97-F104 AromaticContact CD2-CD1 3.84Å; F97-F104 HydrophobicContact CD2-CD1 3.84Å; F97-F104 HydrophobicContact CD2-CD2 4.08Å; F97-F104 AromaticContact CD2-CE1 3.63Å; F97-F104 HydrophobicContact CD2-CE1 3.63Å; F97-F104 AromaticContact CD2-CE2 3.88Å; F97-F104 HydrophobicContact CD2-CE2 3.88Å; F97-F104 HydrophobicContact CD2-CG 4.06Å; F97-F104 AromaticContact CD2-CZ 3.65Å; F97-F104 HydrophobicContact CD2-CZ 3.65Å; F97-F104 HydrophobicContact CE2-CD2 4.38Å; F97-F104 HydrophobicContact CE2-CE2 4.12Å; F97-F104 HydrophobicContact CE2-CZ 4.25Å; F97-F104 HydrophobicContact CG-CE1 4.24Å; F97-F184 AromaticContact CD1-CD2 3.55Å; F97-F184 HydrophobicContact CD1-CD2 3.55Å; F97-F184 HydrophobicContact CD1-CE2 4.24Å; F97-F184 HydrophobicContact CD1-CG 4.47Å; F97-F184 AromaticContact CE1-CD2 3.44Å; F97-F184 HydrophobicContact CE1-CD2 3.44Å; F97-F184 VanDerWaalsContact CE1-CD2 3.44Å; F97-F184 AromaticContact CE1-CE2 3.67Å; F97-F184 HydrophobicContact CE1-CE2 3.67Å; F97-F184 HydrophobicContact CG-CD2 4.25Å; F97-F184 HydrophobicContact CZ-CD2 4.07Å; F97-F184 AromaticContact CZ-CE2 3.92Å; F97-F184 HydrophobicContact CZ-CE2 3.92Å
98	D	54.2	Low	69	Low	34 Å²	34	63.1 Å²	63.1	18%	0.182	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	105.4	173.2	-177.2	-14.2	0	0	0	109.4	I100 S101 R102 K103 K105	D98-I100 VanDerWaalsContact C-N 3.29Å; D98-I100 PolarHBondContact O-N 3.31Å; D98-I100 PolarHBondContact OD1-N 3.41Å; D98-S101 WeakPolarHBondContact CB-OG 3.38Å; D98-S101 PolarHBondContact OD1-N 3.49Å; D98-S101 VanDerWaalsContact OD1-N 3.12Å; D98-S101 PolarHBondContact OD2-OG 2.86Å; D98-R102 WeakPolarHBondContact O-CA 3.48Å; D98-R102 PolarHBondContact O-N 3.12Å; D98-K103 WeakPolarHBondContact CB-O 3.33Å; D98-K103 PolarHBondContact N-O 3.44Å; D98-K103 PolarHBondContact O-N 3.25Å; D98-K105 HydrophobicContact CB-CD 4.27Å; D98-K105 HydrophobicContact CB-CG 4.47Å; D98-K105 WeakPolarHBondContact OD2-CE 3.44Å; D98-K105 IonicContact OD2-NZ 3.03Å; D98-K105 PolarHBondContact OD2-NZ 3.25Å
99	I	49.3	Very low	69.1	Low	84 Å²	84	60.2 Å²	60.2	43%	0.431	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-33.8	-178.1	-61.1	151.3	0	0	0	111.5	F97 A187	F97-I99 HydrophobicContact CD1-CG1 3.89Å; F97-I99 HydrophobicContact CE1-CG1 4.23Å; F97-I99 PolarHBondContact O-N 3.04Å; I99-A187 HydrophobicContact CB-CB 4.45Å; I99-A187 HydrophobicContact CD1-CB 3.33Å; I99-A187 HydrophobicContact CG1-CB 3.68Å; I99-A187 HydrophobicContact CG2-CB 3.9Å
100	I	45.8	Very low	69.2	Low	163 Å²	163	60 Å²	60	84%	0.836	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-42.8	-175.8	-60	175.1	0	0	0	109.9	D98	D98-I100 VanDerWaalsContact C-N 3.29Å; D98-I100 PolarHBondContact O-N 3.31Å; D98-I100 PolarHBondContact OD1-N 3.41Å
101	S	49.8	Very low	69.4	Low	49 Å²	49	59.7 Å²	59.7	34%	0.343	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.4	177.7	66.8	0	0	0	0	114.4	D98 K103	D98-S101 WeakPolarHBondContact CB-OG 3.38Å; D98-S101 PolarHBondContact OD1-N 3.49Å; D98-S101 VanDerWaalsContact OD1-N 3.12Å; D98-S101 PolarHBondContact OD2-OG 2.86Å; S101-K103 WeakPolarHBondContact O-CG 3.49Å; S101-K103 PolarHBondContact O-N 3.24Å
102	R	51.1	Low	69.6	Low	198 Å²	198	59.8 Å²	59.8	75%	0.747	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	34.9	-176.9	-56.9	178.7	-178.2	177.8	-0.3	113.1	D98	D98-R102 WeakPolarHBondContact O-CA 3.48Å; D98-R102 PolarHBondContact O-N 3.12Å
103	K	55.2	Low	69.9	Low	104 Å²	104	64 Å²	64	45%	0.452	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	144.1	-173.6	-74.2	175.9	179.2	-178.4	0	111	D98 S101 K105 E373	D98-K103 WeakPolarHBondContact CB-O 3.33Å; D98-K103 PolarHBondContact N-O 3.44Å; D98-K103 PolarHBondContact O-N 3.25Å; S101-K103 WeakPolarHBondContact O-CG 3.49Å; S101-K103 PolarHBondContact O-N 3.24Å; K103-K105 PolarHBondContact O-N 2.65Å; K103-E373 IonicContact NZ-OE2 3.32Å; K103-E373 PolarHBondContact NZ-OE2 2.88Å
104	F	56.5	Low	70.5	Confident	77 Å²	77	62 Å²	62	34%	0.338	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	116	163.5	-68	-80.8	0	0	0	108	F91 P94 F97 S106	F91-F104 HydrophobicContact CD1-CB 4.36Å; F91-F104 HydrophobicContact CD1-CG 4.46Å; F91-F104 HydrophobicContact CE1-CB 4.4Å; F91-F104 HydrophobicContact CE1-CD2 4.29Å; F91-F104 HydrophobicContact CE1-CG 4.41Å; P94-F104 WeakPolarHBondContact O-CE1 3.29Å; F97-F104 HydrophobicContact CB-CD1 4.21Å; F97-F104 HydrophobicContact CB-CE1 3.97Å; F97-F104 AromaticContact CD2-CD1 3.84Å; F97-F104 HydrophobicContact CD2-CD1 3.84Å; F97-F104 HydrophobicContact CD2-CD2 4.08Å; F97-F104 AromaticContact CD2-CE1 3.63Å; F97-F104 HydrophobicContact CD2-CE1 3.63Å; F97-F104 AromaticContact CD2-CE2 3.88Å; F97-F104 HydrophobicContact CD2-CE2 3.88Å; F97-F104 HydrophobicContact CD2-CG 4.06Å; F97-F104 AromaticContact CD2-CZ 3.65Å; F97-F104 HydrophobicContact CD2-CZ 3.65Å; F97-F104 HydrophobicContact CE2-CD2 4.38Å; F97-F104 HydrophobicContact CE2-CE2 4.12Å; F97-F104 HydrophobicContact CE2-CZ 4.25Å; F97-F104 HydrophobicContact CG-CE1 4.24Å; F104-S106 PolarHBondContact O-N 2.96Å
105	K	61.1	Low	71.5	Confident	144 Å²	144	61.3 Å²	61.3	63%	0.626	30%	0.297	S	S	*	.			trans	-81.6	22.5	173.6	-81.8	179	170.6	159.5	0	112.3	D98 K103	D98-K105 HydrophobicContact CB-CD 4.27Å; D98-K105 HydrophobicContact CB-CG 4.47Å; D98-K105 WeakPolarHBondContact OD2-CE 3.44Å; D98-K105 IonicContact OD2-NZ 3.03Å; D98-K105 PolarHBondContact OD2-NZ 3.25Å; K103-K105 PolarHBondContact O-N 2.65Å
106	S	72.6	Confident	72.5	Confident	13 Å²	13	60.9 Å²	60.9	9%	0.091	30%	0.298	C	S	.	.	S	Bend	trans	-108.5	148	-177.6	-168.8	0	0	0	0	110.4	L92 E93 F104 A108	L92-S106 WeakPolarHBondContact CB-OG 3.37Å; L92-S106 PolarHBondContact N-OG 2.91Å; E93-S106 PolarHBondContact N-OG 2.88Å; F104-S106 PolarHBondContact O-N 2.96Å; S106-A108 PolarHBondContact O-N 2.89Å
107	I	83.1	Confident	73.7	Confident	41 Å²	41	59.6 Å²	59.6	21%	0.21	30%	0.3	C	S	.	.			trans	-63.8	132.2	173.4	-62	172.7	0	0	0	108.2	S59 L92 L109	S59-I107 WeakPolarHBondContact OG-CA 3.39Å; L92-I107 HydrophobicContact CD1-CB 4.09Å; L92-I107 HydrophobicContact CD1-CG2 4.12Å; L92-I107 WeakPolarHBondContact CD1-O 3.35Å; L92-I107 HydrophobicContact CD2-CB 4.13Å; L92-I107 HydrophobicContact CD2-CD1 4.48Å; L92-I107 PolarHBondContact N-O 3.37Å; I107-L109 HydrophobicContact CG2-CD2 3.96Å; I107-L109 HydrophobicContact CG2-CG 4.22Å
108	A	88.5	Confident	75.1	Confident	7 Å²	7	61.7 Å²	61.7	6%	0.058	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.4	173.7	0	0	0	0	0	109.3	D58 S59 V89 F90 F91 S106	D58-A108 WeakPolarHBondContact CA-O 3.5Å; D58-A108 WeakPolarHBondContact CB-O 3.34Å; S59-A108 PolarHBondContact N-O 3.37Å; S59-A108 PolarHBondContact OG-N 3.06Å; V89-A108 HydrophobicContact CG1-CB 3.93Å; F90-A108 CarbonylContact O-C 3.12Å; F90-A108 VanDerWaalsContact O-CA 3.26Å; F90-A108 WeakPolarHBondContact O-CA 2.96Å; F91-A108 HydrophobicContact CD1-CB 3.81Å; F91-A108 HydrophobicContact CE1-CB 3.8Å; S106-A108 PolarHBondContact O-N 2.89Å
109	L	91.6	Very high	76.9	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	150.1	-178.1	-59.8	174.4	0	0	0	110.5	Y60 V89 F90 L92 I107 C137 Y139	Y60-L109 HydrophobicContact CE2-CD2 4.04Å; V89-L109 WeakPolarHBondContact CA-O 3.39Å; F90-L109 PolarHBondContact N-O 3.38Å; F90-L109 PolarHBondContact O-N 3.44Å; L92-L109 HydrophobicContact CD1-CD1 3.66Å; L92-L109 HydrophobicContact CD1-CG 3.98Å; I107-L109 HydrophobicContact CG2-CD2 3.96Å; I107-L109 HydrophobicContact CG2-CG 4.22Å; L109-C137 VanDerWaalsContact CD1-C 3.45Å; L109-C137 VanDerWaalsContact CD1-O 3.25Å; L109-C137 WeakPolarHBondContact CD1-O 3.28Å; L109-Y139 HydrophobicContact CB-CE1 4.49Å; L109-Y139 HydrophobicContact CD2-CD1 4.3Å; L109-Y139 HydrophobicContact CD2-CD2 4.45Å; L109-Y139 HydrophobicContact CD2-CE1 3.9Å; L109-Y139 HydrophobicContact CD2-CE2 4.09Å
110	C	92.9	Very high	78.9	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	129	171	-61.4	0	0	0	0	110.1	C64 M83 K86 Y88 Y139	C64-C110 WeakPolarHBondContact CA-SG 3.26Å; C64-C110 HydrophobicContact CB-CB 3.86Å; C64-C110 WeakPolarHBondContact CB-SG 3.49Å; C64-C110 WeakPolarHBondContact SG-CA 3.43Å; C64-C110 WeakPolarHBondContact SG-CB 3.31Å; C64-C110 CovalentContact SG-SG 2.04Å; C64-C110 PolarHBondContact SG-SG 3.29Å; M83-C110 HydrophobicContact CB-CB 4.43Å; M83-C110 HydrophobicContact CG-CB 4.24Å; M83-C110 HydrophobicContact SD-CB 3.93Å; K86-C110 HydrophobicContact CB-CB 3.76Å; Y88-C110 CarbonylContact O-C 3.36Å; Y88-C110 WeakPolarHBondContact O-CA 2.95Å; C110-Y139 PolarHBondContact N-OH 2.83Å
111	V	92.9	Very high	81.1	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	148.6	178.7	-59.2	0	0	0	0	111	K86 K87 Y88 F90 Q113 L136	K86-V111 CarbonylContact C-O 3.6Å; K86-V111 VanDerWaalsContact C-O 3.29Å; K86-V111 WeakPolarHBondContact CA-O 2.96Å; K87-V111 PolarHBondContact N-O 3.44Å; K87-V111 VanDerWaalsContact N-O 3.1Å; Y88-V111 PolarHBondContact N-O 3.37Å; Y88-V111 PolarHBondContact O-N 3.49Å; F90-V111 HydrophobicContact CB-CG1 3.81Å; F90-V111 HydrophobicContact CB-CG2 3.92Å; V111-Q113 WeakPolarHBondContact CG2-O 3.27Å; V111-L136 HydrophobicContact CG1-CD2 4.16Å
112	S	91.6	Very high	83	Confident	37 Å²	37	57.6 Å²	57.6	26%	0.259	28%	0.281	S	S	.	.	S	Bend	trans	-74.7	-31.6	174.6	58	0	0	0	0	112	E85 Y88 N132 S134	E85-S112 WeakPolarHBondContact O-CA 3.43Å; E85-S112 VanDerWaalsContact O-CB 3.26Å; E85-S112 WeakPolarHBondContact O-CB 3.32Å; Y88-S112 VanDerWaalsContact CD2-O 3.25Å; Y88-S112 WeakPolarHBondContact CD2-O 3.43Å; Y88-S112 VanDerWaalsContact CE2-O 3.25Å; Y88-S112 WeakPolarHBondContact CE2-O 3.39Å; S112-N132 PolarHBondContact OG-O 3.32Å; S112-S134 PolarHBondContact N-OG 2.91Å; S112-S134 PolarHBondContact OG-OG 3.16Å
113	Q	91	Very high	84.9	Confident	101 Å²	101	55.5 Å²	55.5	47%	0.472	27%	0.273	S	S	.	.	S	Bend	trans	-144.6	145.2	179.7	-162.1	172.5	10.3	0	0	111.2	V111 F128	V111-Q113 WeakPolarHBondContact CG2-O 3.27Å; Q113-F128 WeakPolarHBondContact O-CZ 3.34Å
114	C	90.9	Very high	86.5	Confident	9 Å²	9	53.7 Å²	53.7	6%	0.061	27%	0.266	C	S	.	.			trans	-77.8	148.8	171.8	-57.6	0	0	0	0	110.8	A116 S164 C173	C114-A116 PolarHBondContact O-N 3.3Å; C114-S164 WeakPolarHBondContact CB-O 3.48Å; C114-C173 WeakPolarHBondContact CA-SG 3.43Å; C114-C173 HydrophobicContact CB-CB 3.78Å; C114-C173 WeakPolarHBondContact CB-SG 3.4Å; C114-C173 WeakPolarHBondContact SG-CA 3.47Å; C114-C173 WeakPolarHBondContact SG-CB 3.4Å; C114-C173 CovalentContact SG-SG 2.04Å; C114-C173 PolarHBondContact SG-SG 3.14Å
115	P	91	Very high	88.2	Confident	1 Å²	1	50 Å²	50	1%	0.006	25%	0.25	C	C	.	.			trans	-66	102	177.7	26	-33	0	0	0	110.7	F90 T117 L119 F128 V161 S164	F90-P115 HydrophobicContact CE2-CG 4.17Å; P115-T117 PolarHBondContact O-N 3.24Å; P115-L119 HydrophobicContact CB-CD1 4.15Å; P115-L119 HydrophobicContact CB-CG 4.47Å; P115-F128 HydrophobicContact CB-CE2 4.45Å; P115-V161 HydrophobicContact CG-CG1 4.23Å; P115-S164 PolarHBondContact O-N 2.83Å
116	A	88.8	Confident	89.6	Confident	52 Å²	52	45.5 Å²	45.5	43%	0.43	23%	0.23	S	C	.	.	S	Bend	trans	-73.4	-9.7	-177.6	0	0	0	0	0	113.6	C114 Q163	C114-A116 PolarHBondContact O-N 3.3Å; A116-Q163 VanDerWaalsContact O-CG 3.24Å; A116-Q163 WeakPolarHBondContact O-CG 3.29Å; A116-Q163 PolarHBondContact O-NE2 3.48Å
117	T	89.8	Confident	90.5	Very high	93 Å²	93	48.9 Å²	48.9	57%	0.571	25%	0.247	S	C	*	.	S	Bend	trans	-132.2	155.9	175.1	56.2	0	0	0	0	109.6	P115 L119	P115-T117 PolarHBondContact O-N 3.24Å; T117-L119 PolarHBondContact O-N 2.93Å
118	E	89.9	Confident	90.9	Very high	88 Å²	88	48 Å²	48	41%	0.411	24%	0.242	S	C	.	.			trans	-63.9	131.1	172.2	-174.8	-177.1	-141.6	0	0	110.2	K120 P160 V161	E118-K120 HydrophobicContact CG-CG 4.34Å; E118-K120 WeakPolarHBondContact OE2-CE 3.11Å; E118-K120 IonicContact OE2-NZ 3.8Å; E118-P160 HydrophobicContact CG-CB 3.87Å; E118-P160 WeakPolarHBondContact OE1-CB 3.48Å; E118-P160 WeakPolarHBondContact OE1-CG 3.28Å; E118-V161 WeakPolarHBondContact CA-O 3.38Å
119	L	90.9	Very high	90.9	Very high	10 Å²	10	48 Å²	48	5%	0.052	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-106.1	115	177	-51.6	172.2	0	0	0	109.6	P115 T117 E124 L125 F128 L136 P160 V161	P115-L119 HydrophobicContact CB-CD1 4.15Å; P115-L119 HydrophobicContact CB-CG 4.47Å; T117-L119 PolarHBondContact O-N 2.93Å; L119-E124 WeakPolarHBondContact CA-OE2 3.46Å; L119-E124 HydrophobicContact CB-CB 4.35Å; L119-E124 HydrophobicContact CD2-CB 4.14Å; L119-L125 HydrophobicContact CB-CD1 3.59Å; L119-L125 HydrophobicContact CD1-CD1 3.97Å; L119-L125 HydrophobicContact CD1-CG 4.29Å; L119-L125 HydrophobicContact CG-CD1 4.42Å; L119-F128 HydrophobicContact CD1-CB 4.37Å; L119-F128 HydrophobicContact CD1-CG 4.39Å; L119-L136 HydrophobicContact CD1-CD1 3.63Å; L119-P160 CarbonylContact O-C 3.51Å; L119-P160 WeakPolarHBondContact O-CA 3.03Å; L119-V161 HydrophobicContact CB-CB 4.19Å; L119-V161 PolarHBondContact N-O 3.38Å; L119-V161 PolarHBondContact O-N 3.19Å
120	K	91.2	Very high	90.9	Very high	132 Å²	132	52.5 Å²	52.5	57%	0.574	27%	0.265	S	S	*	.			trans	-95.6	-25.2	-170	-64.8	-178.5	179.1	179.8	0	113.4	E118 E124 P160	E118-K120 HydrophobicContact CG-CG 4.34Å; E118-K120 WeakPolarHBondContact OE2-CE 3.11Å; E118-K120 IonicContact OE2-NZ 3.8Å; K120-E124 PolarHBondContact N-OE2 2.82Å; K120-P160 HydrophobicContact CG-CB 4.33Å
121	T	92.6	Very high	90.7	Very high	60 Å²	60	56.6 Å²	56.6	37%	0.368	29%	0.294	S	S	.	.	S	Bend	trans	-128.1	154.4	-173.1	66.1	0	0	0	0	112.6	R123 E124 L125	T121-R123 PolarHBondContact O-N 3.07Å; T121-E124 PolarHBondContact O-N 3.49Å; T121-E124 VanDerWaalsContact O-N 3.15Å; T121-E124 WeakPolarHBondContact OG1-CG 3.26Å; T121-E124 PolarHBondContact OG1-N 3.22Å; T121-E124 PolarHBondContact OG1-OE1 2.85Å; T121-L125 VanDerWaalsContact O-CD1 3.27Å; T121-L125 WeakPolarHBondContact O-CD1 3.45Å; T121-L125 PolarHBondContact O-N 3.26Å
122	Y	89.9	Confident	90.3	Very high	42 Å²	42	59.4 Å²	59.4	17%	0.165	31%	0.309	C	S	.	.	H	α-helix	trans	-62.8	-22.1	173.9	-71.4	-72.4	0	0	0	113.1	L125 K126 R152 C156 L159	Y122-L125 HydrophobicContact CD1-CD2 4.4Å; Y122-K126 WeakPolarHBondContact O-CB 3.22Å; Y122-K126 PolarHBondContact O-N 2.93Å; Y122-R152 HydrophobicContact CE1-CB 4.06Å; Y122-R152 HydrophobicContact CE1-CG 4.39Å; Y122-R152 HydrophobicContact CE2-CG 4.49Å; Y122-C156 HydrophobicContact CE1-CB 3.99Å; Y122-L159 HydrophobicContact CD1-CD1 4.02Å; Y122-L159 HydrophobicContact CD2-CD1 3.53Å; Y122-L159 HydrophobicContact CE1-CD1 4.01Å; Y122-L159 HydrophobicContact CE1-CG 4.49Å; Y122-L159 HydrophobicContact CE2-CD1 3.53Å; Y122-L159 HydrophobicContact CG-CD1 3.78Å
123	R	90.5	Very high	89.8	Confident	154 Å²	154	59.5 Å²	59.5	58%	0.581	32%	0.316	S	S	*	.	H	α-helix	trans	-67.4	-47.7	172.9	-175.2	172.4	-65.1	162.1	0.6	110.9	T121 L125 K126 D127 E147	T121-R123 PolarHBondContact O-N 3.07Å; R123-L125 VanDerWaalsContact C-N 3.28Å; R123-L125 PolarHBondContact O-N 2.8Å; R123-K126 WeakPolarHBondContact O-CB 3.34Å; R123-K126 PolarHBondContact O-N 3.41Å; R123-K126 VanDerWaalsContact O-N 3.1Å; R123-D127 VanDerWaalsContact O-CG 3.26Å; R123-D127 PolarHBondContact O-N 3.43Å; R123-E147 IonicContact CZ-OE2 3.32Å; R123-E147 IonicContact NE-OE2 3.57Å; R123-E147 PolarHBondContact NE-OE2 3.47Å; R123-E147 IonicContact NH2-OE2 2.76Å; R123-E147 PolarHBondContact NH2-OE2 2.83Å
124	E	90.3	Very high	89.7	Confident	66 Å²	66	54.7 Å²	54.7	31%	0.308	29%	0.293	S	S	.	.	H	α-helix	trans	-60.4	-37	174.5	-70.9	158.3	-125.5	0	0	112.2	L119 K120 T121 D127 F128	L119-E124 WeakPolarHBondContact CA-OE2 3.46Å; L119-E124 HydrophobicContact CB-CB 4.35Å; L119-E124 HydrophobicContact CD2-CB 4.14Å; K120-E124 PolarHBondContact N-OE2 2.82Å; T121-E124 PolarHBondContact O-N 3.49Å; T121-E124 VanDerWaalsContact O-N 3.15Å; T121-E124 WeakPolarHBondContact OG1-CG 3.26Å; T121-E124 PolarHBondContact OG1-N 3.22Å; T121-E124 PolarHBondContact OG1-OE1 2.85Å; E124-D127 PolarHBondContact O-N 3.23Å; E124-F128 VanDerWaalsContact O-CB 3.32Å; E124-F128 WeakPolarHBondContact O-CB 3.24Å; E124-F128 PolarHBondContact O-N 3.38Å
125	L	90.3	Very high	89.5	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.1	-41.8	173.8	-91	69	0	0	0	112.4	L119 T121 Y122 R123 A129 L136 Y146 P157 L159 V161	L119-L125 HydrophobicContact CB-CD1 3.59Å; L119-L125 HydrophobicContact CD1-CD1 3.97Å; L119-L125 HydrophobicContact CD1-CG 4.29Å; L119-L125 HydrophobicContact CG-CD1 4.42Å; T121-L125 VanDerWaalsContact O-CD1 3.27Å; T121-L125 WeakPolarHBondContact O-CD1 3.45Å; T121-L125 PolarHBondContact O-N 3.26Å; Y122-L125 HydrophobicContact CD1-CD2 4.4Å; R123-L125 VanDerWaalsContact C-N 3.28Å; R123-L125 PolarHBondContact O-N 2.8Å; L125-A129 WeakPolarHBondContact O-CB 3.24Å; L125-A129 PolarHBondContact O-N 3.09Å; L125-L136 HydrophobicContact CG-CD1 4.26Å; L125-Y146 HydrophobicContact CB-CD2 4.35Å; L125-P157 HydrophobicContact CD2-CG 3.85Å; L125-L159 HydrophobicContact CD1-CD2 3.38Å; L125-L159 HydrophobicContact CD2-CD2 4.18Å; L125-L159 HydrophobicContact CG-CD2 4.43Å; L125-V161 HydrophobicContact CD1-CG2 4.15Å; L125-V161 HydrophobicContact CD2-CG2 4.43Å
126	K	91.2	Very high	89.4	Confident	50 Å²	50	57.9 Å²	57.9	22%	0.217	30%	0.304	C	S	.	.	H	α-helix	trans	-65.1	-45.1	176.8	168.3	-172.9	173.2	-160.6	0	110.7	Y122 R123 F128 A129 L130 P143 Y146 E147	Y122-K126 WeakPolarHBondContact O-CB 3.22Å; Y122-K126 PolarHBondContact O-N 2.93Å; R123-K126 WeakPolarHBondContact O-CB 3.34Å; R123-K126 PolarHBondContact O-N 3.41Å; R123-K126 VanDerWaalsContact O-N 3.1Å; K126-F128 VanDerWaalsContact C-N 3.34Å; K126-A129 PolarHBondContact O-N 2.62Å; K126-L130 HydrophobicContact CG-CD1 3.82Å; K126-L130 HydrophobicContact CG-CG 4.42Å; K126-L130 WeakPolarHBondContact O-CB 3.37Å; K126-L130 WeakPolarHBondContact O-CG 3.36Å; K126-L130 PolarHBondContact O-N 3Å; K126-P143 WeakPolarHBondContact CG-O 3.45Å; K126-Y146 HydrophobicContact CB-CD2 4.17Å; K126-E147 WeakPolarHBondContact CD-OE1 3.35Å; K126-E147 IonicContact NZ-OE1 2.72Å; K126-E147 PolarHBondContact NZ-OE1 3.34Å
127	D	91.5	Very high	89.4	Confident	83 Å²	83	55.4 Å²	55.4	44%	0.444	28%	0.284	S	S	.	.	H	α-helix	trans	-64.6	-41	179.7	-65.5	-21.1	0	0	0	110.7	R123 E124 A129 L130 S131	R123-D127 VanDerWaalsContact O-CG 3.26Å; R123-D127 PolarHBondContact O-N 3.43Å; E124-D127 PolarHBondContact O-N 3.23Å; D127-A129 PolarHBondContact O-N 3.01Å; D127-L130 PolarHBondContact O-N 3.18Å; D127-S131 VanDerWaalsContact O-CB 3.27Å; D127-S131 WeakPolarHBondContact O-CB 3.45Å; D127-S131 PolarHBondContact O-N 3.03Å; D127-S131 PolarHBondContact O-OG 3.34Å
128	F	91.2	Very high	89.3	Confident	23 Å²	23	51 Å²	51	10%	0.101	26%	0.257	C	S	.	.	H	α-helix	trans	-58.9	-46	171.5	-176.4	-88.1	0	0	0	112	Q113 P115 L119 E124 K126 S131 N132 L136	Q113-F128 WeakPolarHBondContact O-CZ 3.34Å; P115-F128 HydrophobicContact CB-CE2 4.45Å; L119-F128 HydrophobicContact CD1-CB 4.37Å; L119-F128 HydrophobicContact CD1-CG 4.39Å; E124-F128 VanDerWaalsContact O-CB 3.32Å; E124-F128 WeakPolarHBondContact O-CB 3.24Å; E124-F128 PolarHBondContact O-N 3.38Å; K126-F128 VanDerWaalsContact C-N 3.34Å; F128-S131 PolarHBondContact O-OG 3.4Å; F128-N132 VanDerWaalsContact CE2-ND2 3.27Å; F128-N132 WeakPolarHBondContact CE2-ND2 3.38Å; F128-N132 WeakPolarHBondContact O-CB 3.21Å; F128-N132 PolarHBondContact O-N 3.39Å; F128-L136 HydrophobicContact CB-CD1 4.4Å; F128-L136 HydrophobicContact CD1-CD1 3.37Å; F128-L136 HydrophobicContact CD1-CD2 4.35Å; F128-L136 HydrophobicContact CD1-CG 3.75Å; F128-L136 HydrophobicContact CE1-CD1 3.77Å; F128-L136 HydrophobicContact CE1-CD2 3.97Å; F128-L136 HydrophobicContact CE1-CG 3.89Å; F128-L136 HydrophobicContact CG-CD1 3.99Å
129	A	90	Very high	89.2	Confident	6 Å²	6	48.7 Å²	48.7	5%	0.05	25%	0.245	C	C	.	.	H	α-helix	trans	-68.1	-37	-178.6	0	0	0	0	0	113.4	L125 K126 D127 G133 S134 P143 Y146	L125-A129 WeakPolarHBondContact O-CB 3.24Å; L125-A129 PolarHBondContact O-N 3.09Å; K126-A129 PolarHBondContact O-N 2.62Å; D127-A129 PolarHBondContact O-N 3.01Å; A129-G133 VanDerWaalsContact O-CA 3.26Å; A129-G133 WeakPolarHBondContact O-CA 3.25Å; A129-G133 PolarHBondContact O-N 3.45Å; A129-G133 VanDerWaalsContact O-N 3.08Å; A129-S134 WeakPolarHBondContact CA-O 3.35Å; A129-S134 VanDerWaalsContact CB-O 3.24Å; A129-S134 WeakPolarHBondContact CB-O 3.44Å; A129-P143 HydrophobicContact CB-CB 4.04Å; A129-P143 HydrophobicContact CB-CG 3.92Å; A129-Y146 HydrophobicContact CB-CE2 4.05Å
130	L	90.6	Very high	89	Confident	95 Å²	95	53.7 Å²	53.7	50%	0.497	27%	0.268	S	S	.	.	H	α-helix	trans	-76.5	-35.4	178.9	-69.6	174.2	0	0	0	112.8	K126 D127 P143	K126-L130 HydrophobicContact CG-CD1 3.82Å; K126-L130 HydrophobicContact CG-CG 4.42Å; K126-L130 WeakPolarHBondContact O-CB 3.37Å; K126-L130 WeakPolarHBondContact O-CG 3.36Å; K126-L130 PolarHBondContact O-N 3Å; D127-L130 PolarHBondContact O-N 3.18Å; L130-P143 HydrophobicContact CD2-CB 3.95Å; L130-P143 HydrophobicContact CD2-CG 4.44Å; L130-P143 HydrophobicContact CG-CB 4.06Å
131	S	88.4	Confident	88.9	Confident	86 Å²	86	47.8 Å²	47.8	60%	0.601	24%	0.243	S	C	*	.	H	α-helix	trans	-76.5	-44.7	179.4	54.4	0	0	0	0	112.8	D127 F128	D127-S131 VanDerWaalsContact O-CB 3.27Å; D127-S131 WeakPolarHBondContact O-CB 3.45Å; D127-S131 PolarHBondContact O-N 3.03Å; D127-S131 PolarHBondContact O-OG 3.34Å; F128-S131 PolarHBondContact O-OG 3.4Å
132	N	84	Confident	88.7	Confident	59 Å²	59	48.1 Å²	48.1	32%	0.316	25%	0.245	S	C	.	.	H	α-helix	trans	-99	-5.4	-173.8	-67.8	-24.5	0	0	0	114	S112 F128 S134	S112-N132 PolarHBondContact OG-O 3.32Å; F128-N132 VanDerWaalsContact CE2-ND2 3.27Å; F128-N132 WeakPolarHBondContact CE2-ND2 3.38Å; F128-N132 WeakPolarHBondContact O-CB 3.21Å; F128-N132 PolarHBondContact O-N 3.39Å; N132-S134 PolarHBondContact O-N 2.9Å
133	G	82.9	Confident	88.6	Confident	39 Å²	39	46.8 Å²	46.8	40%	0.402	24%	0.241	S	C	.	.			trans	66.7	15.2	-175.4	0	0	0	0	0	114.3	K86 A129	K86-G133 WeakPolarHBondContact CE-O 3.4Å; A129-G133 VanDerWaalsContact O-CA 3.26Å; A129-G133 WeakPolarHBondContact O-CA 3.25Å; A129-G133 PolarHBondContact O-N 3.45Å; A129-G133 VanDerWaalsContact O-N 3.08Å
134	S	87.1	Confident	88.5	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.249	C	C	.	.			trans	-101.2	116.5	-176.4	-81.1	0	0	0	0	111.9	S112 A129 N132 L136	S112-S134 PolarHBondContact N-OG 2.91Å; S112-S134 PolarHBondContact OG-OG 3.16Å; A129-S134 WeakPolarHBondContact CA-O 3.35Å; A129-S134 VanDerWaalsContact CB-O 3.24Å; A129-S134 WeakPolarHBondContact CB-O 3.44Å; N132-S134 PolarHBondContact O-N 2.9Å; S134-L136 PolarHBondContact O-N 3.31Å
135	Y	88.2	Confident	88.4	Confident	77 Å²	77	51.8 Å²	51.8	30%	0.302	26%	0.261	S	S	.	.			trans	-78.2	119.2	176.5	-65.8	-103.7	0	0	0	109.4	Y139 P143	Y135-Y139 HydrophobicContact CG-CD1 4.14Å; Y135-P143 HydrophobicContact CD1-CG 4.31Å; Y135-P143 HydrophobicContact CE1-CG 4.04Å
136	L	87.4	Confident	88.3	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.261	C	S	.	.	S	Bend	trans	-95.1	-13.6	173.2	-66.3	178.6	0	0	0	112.6	F90 V111 L119 L125 F128 S134 P157	F90-L136 HydrophobicContact CD1-CD2 3.84Å; F90-L136 HydrophobicContact CD2-CD2 4.29Å; F90-L136 HydrophobicContact CE1-CB 4.49Å; F90-L136 HydrophobicContact CE1-CD2 3.87Å; F90-L136 HydrophobicContact CE2-CD2 4.32Å; F90-L136 HydrophobicContact CG-CD2 4.06Å; F90-L136 HydrophobicContact CZ-CD2 4.12Å; V111-L136 HydrophobicContact CG1-CD2 4.16Å; L119-L136 HydrophobicContact CD1-CD1 3.63Å; L125-L136 HydrophobicContact CG-CD1 4.26Å; F128-L136 HydrophobicContact CB-CD1 4.4Å; F128-L136 HydrophobicContact CD1-CD1 3.37Å; F128-L136 HydrophobicContact CD1-CD2 4.35Å; F128-L136 HydrophobicContact CD1-CG 3.75Å; F128-L136 HydrophobicContact CE1-CD1 3.77Å; F128-L136 HydrophobicContact CE1-CD2 3.97Å; F128-L136 HydrophobicContact CE1-CG 3.89Å; F128-L136 HydrophobicContact CG-CD1 3.99Å; S134-L136 PolarHBondContact O-N 3.31Å; L136-P157 WeakPolarHBondContact O-CD 3.27Å
137	C	89.6	Confident	88.1	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.26	C	S	.	.	S	Bend	trans	-106.5	164.4	168.4	-51.9	0	0	0	0	110.9	L109 Y139 Y146 K155 C156	L109-C137 VanDerWaalsContact CD1-C 3.45Å; L109-C137 VanDerWaalsContact CD1-O 3.25Å; L109-C137 WeakPolarHBondContact CD1-O 3.28Å; C137-Y139 PolarHBondContact O-N 3.15Å; C137-Y146 HydrophobicContact CB-CD1 4.36Å; C137-Y146 HydrophobicContact CB-CE1 3.6Å; C137-Y146 HydrophobicContact CB-CE2 4.37Å; C137-Y146 PolarHBondContact N-OH 3.1Å; C137-Y146 VanDerWaalsContact SG-CZ 3.54Å; C137-K155 CarbonylContact C-O 3.54Å; C137-K155 WeakPolarHBondContact CA-O 3.5Å; C137-K155 WeakPolarHBondContact CB-O 3.43Å; C137-C156 HydrophobicContact CB-CB 3.98Å; C137-C156 WeakPolarHBondContact CB-SG 3.36Å; C137-C156 VanDerWaalsContact SG-CA 3.59Å; C137-C156 WeakPolarHBondContact SG-CB 3.3Å; C137-C156 CovalentContact SG-SG 2.03Å; C137-C156 PolarHBondContact SG-SG 2.93Å
138	S	87.9	Confident	87.8	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.014	27%	0.273	C	S	.	.			trans	-42.1	139.3	172.7	170.8	0	0	0	0	112.2	Y60 E140 L141 K155	Y60-S138 PolarHBondContact OH-OG 3.31Å; S138-E140 PolarHBondContact O-N 3.23Å; S138-E140 PolarHBondContact OG-N 3.44Å; S138-L141 PolarHBondContact O-N 3.22Å; S138-K155 PolarHBondContact N-O 3.12Å
139	Y	88.1	Confident	87.6	Confident	39 Å²	39	54 Å²	54	15%	0.153	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-15.2	-178.5	-53.8	-46.5	0	0	0	113.9	D58 Y60 M83 L109 C110 Y135 C137 L141	D58-Y139 WeakPolarHBondContact OD2-CE2 3.24Å; D58-Y139 PolarHBondContact OD2-OH 3.04Å; Y60-Y139 AromaticContact CD2-CD2 3.56Å; Y60-Y139 HydrophobicContact CD2-CD2 3.56Å; Y60-Y139 AromaticContact CD2-CE2 3.53Å; Y60-Y139 HydrophobicContact CD2-CE2 3.53Å; Y60-Y139 AromaticContact CE2-CD2 3.58Å; Y60-Y139 HydrophobicContact CE2-CD2 3.58Å; Y60-Y139 AromaticContact CE2-CE2 3.85Å; Y60-Y139 HydrophobicContact CE2-CE2 3.85Å; Y60-Y139 HydrophobicContact CE2-CG 4.43Å; M83-Y139 HydrophobicContact CE-CE1 4.46Å; M83-Y139 HydrophobicContact CE-CE2 3.77Å; M83-Y139 VanDerWaalsContact CE-OH 3.32Å; M83-Y139 WeakPolarHBondContact CE-OH 3.32Å; L109-Y139 HydrophobicContact CB-CE1 4.49Å; L109-Y139 HydrophobicContact CD2-CD1 4.3Å; L109-Y139 HydrophobicContact CD2-CD2 4.45Å; L109-Y139 HydrophobicContact CD2-CE1 3.9Å; L109-Y139 HydrophobicContact CD2-CE2 4.09Å; C110-Y139 PolarHBondContact N-OH 2.83Å; Y135-Y139 HydrophobicContact CG-CD1 4.14Å; C137-Y139 PolarHBondContact O-N 3.15Å; Y139-L141 PolarHBondContact O-N 3.25Å
140	E	86.3	Confident	87.3	Confident	114 Å²	114	60 Å²	60	53%	0.533	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-25.3	172.9	-59.2	179.4	178.3	0	0	112.8	L78 S138 K155	L78-E140 HydrophobicContact CD1-CG 3.69Å; S138-E140 PolarHBondContact O-N 3.23Å; S138-E140 PolarHBondContact OG-N 3.44Å; E140-K155 VanDerWaalsContact OE2-CE 3.25Å; E140-K155 WeakPolarHBondContact OE2-CE 3.22Å; E140-K155 IonicContact OE2-NZ 2.59Å; E140-K155 PolarHBondContact OE2-NZ 3.11Å
141	L	88.8	Confident	86.9	Confident	8 Å²	8	58.9 Å²	58.9	4%	0.042	30%	0.302	C	S	.	.	S	Bend	trans	-103.4	119.9	-176.6	-164.9	69.6	0	0	0	110.2	S138 Y139 K145 Y146	S138-L141 PolarHBondContact O-N 3.22Å; Y139-L141 PolarHBondContact O-N 3.25Å; L141-K145 HydrophobicContact CD1-CB 3.9Å; L141-K145 HydrophobicContact CG-CB 4.41Å; L141-Y146 HydrophobicContact CB-CE1 4.17Å; L141-Y146 HydrophobicContact CD2-CD1 3.58Å; L141-Y146 HydrophobicContact CD2-CE1 3.94Å; L141-Y146 HydrophobicContact CG-CD1 3.84Å; L141-Y146 HydrophobicContact CG-CE1 3.96Å; L141-Y146 WeakPolarHBondContact O-CE1 3.38Å
142	T	88.6	Confident	86.7	Confident	68 Å²	68	57.4 Å²	57.4	42%	0.417	28%	0.284	S	S	.	.			trans	-75.4	145.2	175.9	54.5	0	0	0	0	111.2	R144 K145 Y146	T142-R144 PolarHBondContact O-N 3.22Å; T142-K145 PolarHBondContact O-N 3.15Å; T142-Y146 WeakPolarHBondContact O-CD1 3.46Å
143	P	88.4	Confident	86.6	Confident	13 Å²	13	61.6 Å²	61.6	8%	0.084	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-53.6	-34.1	-177	-30.5	36.2	0	0	0	114.4	K126 A129 L130 Y135 K145 Y146	K126-P143 WeakPolarHBondContact CG-O 3.45Å; A129-P143 HydrophobicContact CB-CB 4.04Å; A129-P143 HydrophobicContact CB-CG 3.92Å; L130-P143 HydrophobicContact CD2-CB 3.95Å; L130-P143 HydrophobicContact CD2-CG 4.44Å; L130-P143 HydrophobicContact CG-CB 4.06Å; Y135-P143 HydrophobicContact CD1-CG 4.31Å; Y135-P143 HydrophobicContact CE1-CG 4.04Å; P143-K145 PolarHBondContact O-N 3.47Å; P143-K145 VanDerWaalsContact O-N 3.16Å; P143-Y146 HydrophobicContact CB-CE2 4.25Å; P143-Y146 WeakPolarHBondContact O-CB 3.06Å; P143-Y146 PolarHBondContact O-N 3.38Å
144	R	87.8	Confident	86.5	Confident	200 Å²	200	63.8 Å²	63.8	76%	0.755	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-62.6	-21.4	177.3	-62.3	-174.7	-177.7	-174.6	0.8	113.6	T142	T142-R144 PolarHBondContact O-N 3.22Å
145	K	88.8	Confident	86.4	Confident	125 Å²	125	66 Å²	66	54%	0.543	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-98.4	-1.2	-178.5	-65.8	-176.1	178.5	-177.3	0	113.7	L141 T142 P143 E147 N148 S149	L141-K145 HydrophobicContact CD1-CB 3.9Å; L141-K145 HydrophobicContact CG-CB 4.41Å; T142-K145 PolarHBondContact O-N 3.15Å; P143-K145 PolarHBondContact O-N 3.47Å; P143-K145 VanDerWaalsContact O-N 3.16Å; K145-E147 VanDerWaalsContact C-N 3.29Å; K145-E147 PolarHBondContact O-N 3.48Å; K145-N148 PolarHBondContact O-N 2.94Å; K145-S149 VanDerWaalsContact O-CB 3.26Å; K145-S149 WeakPolarHBondContact O-CB 3.42Å; K145-S149 PolarHBondContact O-N 3Å
146	Y	88.6	Confident	86.4	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-37.2	-177.3	-70.8	0.3	0	0	0	112.8	L125 K126 A129 C137 L141 T142 P143	L125-Y146 HydrophobicContact CB-CD2 4.35Å; K126-Y146 HydrophobicContact CB-CD2 4.17Å; A129-Y146 HydrophobicContact CB-CE2 4.05Å; C137-Y146 HydrophobicContact CB-CD1 4.36Å; C137-Y146 HydrophobicContact CB-CE1 3.6Å; C137-Y146 HydrophobicContact CB-CE2 4.37Å; C137-Y146 PolarHBondContact N-OH 3.1Å; C137-Y146 VanDerWaalsContact SG-CZ 3.54Å; L141-Y146 HydrophobicContact CB-CE1 4.17Å; L141-Y146 HydrophobicContact CD2-CD1 3.58Å; L141-Y146 HydrophobicContact CD2-CE1 3.94Å; L141-Y146 HydrophobicContact CG-CD1 3.84Å; L141-Y146 HydrophobicContact CG-CE1 3.96Å; L141-Y146 WeakPolarHBondContact O-CE1 3.38Å; T142-Y146 WeakPolarHBondContact O-CD1 3.46Å; P143-Y146 HydrophobicContact CB-CE2 4.25Å; P143-Y146 WeakPolarHBondContact O-CB 3.06Å; P143-Y146 PolarHBondContact O-N 3.38Å
147	E	86.7	Confident	86.5	Confident	42 Å²	42	62.9 Å²	62.9	20%	0.196	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-26.1	-179.1	-69.1	175	-88.7	0	0	113.7	R123 K126 K145 R152	R123-E147 IonicContact CZ-OE2 3.32Å; R123-E147 IonicContact NE-OE2 3.57Å; R123-E147 PolarHBondContact NE-OE2 3.47Å; R123-E147 IonicContact NH2-OE2 2.76Å; R123-E147 PolarHBondContact NH2-OE2 2.83Å; K126-E147 WeakPolarHBondContact CD-OE1 3.35Å; K126-E147 IonicContact NZ-OE1 2.72Å; K126-E147 PolarHBondContact NZ-OE1 3.34Å; K145-E147 VanDerWaalsContact C-N 3.29Å; K145-E147 PolarHBondContact O-N 3.48Å; E147-R152 PolarHBondContact O-NH1 3.25Å
148	N	85.3	Confident	86.3	Confident	136 Å²	136	69.4 Å²	69.4	73%	0.727	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	-12.7	-164.7	-63.4	-18.9	0	0	0	114	K145	K145-N148 PolarHBondContact O-N 2.94Å
149	S	85.9	Confident	86.2	Confident	25 Å²	25	71.8 Å²	71.8	18%	0.175	35%	0.348	C	S	.	.			trans	-84.6	137.5	-178.9	-172.2	0	0	0	0	112.1	K145 D151 R152	K145-S149 VanDerWaalsContact O-CB 3.26Å; K145-S149 WeakPolarHBondContact O-CB 3.42Å; K145-S149 PolarHBondContact O-N 3Å; S149-D151 PolarHBondContact O-N 3.29Å; S149-D151 WeakPolarHBondContact OG-CB 3.3Å; S149-D151 PolarHBondContact OG-N 3.33Å; S149-R152 VanDerWaalsContact O-CD 3.28Å; S149-R152 WeakPolarHBondContact O-CD 3.23Å; S149-R152 WeakPolarHBondContact O-CG 3.49Å; S149-R152 PolarHBondContact O-N 2.75Å; S149-R152 PolarHBondContact O-NE 3.22Å
150	N	83.9	Confident	86.2	Confident	132 Å²	132	73.2 Å²	73.2	71%	0.706	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-22.2	170	-71.4	-16.9	0	0	0	112.2	R152 F153	N150-R152 PolarHBondContact O-N 3.43Å; N150-R152 VanDerWaalsContact O-N 3.16Å; N150-F153 WeakPolarHBondContact O-CD2 3.33Å
151	D	83.1	Confident	86.3	Confident	71 Å²	71	67.9 Å²	67.9	38%	0.38	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-11	178	-70.6	-2	0	0	0	113.6	S149 F153 S154 K155	S149-D151 PolarHBondContact O-N 3.29Å; S149-D151 WeakPolarHBondContact OG-CB 3.3Å; S149-D151 PolarHBondContact OG-N 3.33Å; D151-F153 PolarHBondContact O-N 3.43Å; D151-S154 PolarHBondContact O-N 3.41Å; D151-S154 PolarHBondContact O-OG 3.27Å; D151-K155 HydrophobicContact CB-CD 4.01Å; D151-K155 HydrophobicContact CB-CG 4.38Å; D151-K155 WeakPolarHBondContact O-CB 3.42Å; D151-K155 PolarHBondContact O-N 3.27Å; D151-K155 IonicContact OD2-NZ 2.68Å; D151-K155 PolarHBondContact OD2-NZ 3.13Å; D151-K155 VanDerWaalsContact OD2-NZ 3.14Å
152	R	82.5	Confident	86.1	Confident	56 Å²	56	69.5 Å²	69.5	21%	0.211	35%	0.348	C	S	.	.	H	α-helix	trans	-57.9	-33.1	-179.2	67.8	-170.8	152	-175.5	-15.1	113	Y122 E147 S149 N150 S154 C156	Y122-R152 HydrophobicContact CE1-CB 4.06Å; Y122-R152 HydrophobicContact CE1-CG 4.39Å; Y122-R152 HydrophobicContact CE2-CG 4.49Å; E147-R152 PolarHBondContact O-NH1 3.25Å; S149-R152 VanDerWaalsContact O-CD 3.28Å; S149-R152 WeakPolarHBondContact O-CD 3.23Å; S149-R152 WeakPolarHBondContact O-CG 3.49Å; S149-R152 PolarHBondContact O-N 2.75Å; S149-R152 PolarHBondContact O-NE 3.22Å; N150-R152 PolarHBondContact O-N 3.43Å; N150-R152 VanDerWaalsContact O-N 3.16Å; R152-S154 VanDerWaalsContact C-N 3.26Å; R152-S154 PolarHBondContact O-N 3.29Å; R152-C156 WeakPolarHBondContact O-CB 3.42Å; R152-C156 PolarHBondContact O-N 3.46Å; R152-C156 VanDerWaalsContact O-N 3.1Å
153	F	82.1	Confident	86.1	Confident	147 Å²	147	70.4 Å²	70.4	65%	0.645	35%	0.348	S	S	*	.	H	α-helix	trans	-70.5	-21.5	-177.6	-61	-70.9	0	0	0	113.6	N150 D151	N150-F153 WeakPolarHBondContact O-CD2 3.33Å; D151-F153 PolarHBondContact O-N 3.43Å
154	S	80.6	Confident	86	Confident	85 Å²	85	69.9 Å²	69.9	59%	0.594	35%	0.345	S	S	*	.	H	α-helix	trans	-108.1	-26.9	178.9	59.5	0	0	0	0	113.3	D151 R152	D151-S154 PolarHBondContact O-N 3.41Å; D151-S154 PolarHBondContact O-OG 3.27Å; R152-S154 VanDerWaalsContact C-N 3.26Å; R152-S154 PolarHBondContact O-N 3.29Å
155	K	85.7	Confident	86	Confident	46 Å²	46	64.6 Å²	64.6	20%	0.2	33%	0.331	C	S	.	.	H	α-helix	trans	-106.8	-7.8	-172.4	-64.1	-170.8	-170.3	175.8	0	114.9	C137 S138 E140 D151	C137-K155 CarbonylContact C-O 3.54Å; C137-K155 WeakPolarHBondContact CA-O 3.5Å; C137-K155 WeakPolarHBondContact CB-O 3.43Å; S138-K155 PolarHBondContact N-O 3.12Å; E140-K155 VanDerWaalsContact OE2-CE 3.25Å; E140-K155 WeakPolarHBondContact OE2-CE 3.22Å; E140-K155 IonicContact OE2-NZ 2.59Å; E140-K155 PolarHBondContact OE2-NZ 3.11Å; D151-K155 HydrophobicContact CB-CD 4.01Å; D151-K155 HydrophobicContact CB-CG 4.38Å; D151-K155 WeakPolarHBondContact O-CB 3.42Å; D151-K155 PolarHBondContact O-N 3.27Å; D151-K155 IonicContact OD2-NZ 2.68Å; D151-K155 PolarHBondContact OD2-NZ 3.13Å; D151-K155 VanDerWaalsContact OD2-NZ 3.14Å
156	C	88.8	Confident	85.7	Confident	9 Å²	9	60.7 Å²	60.7	6%	0.061	32%	0.322	C	S	.	.	S	Bend	trans	-115.8	159.4	176.6	-65.1	0	0	0	0	111	Y122 C137 R152	Y122-C156 HydrophobicContact CE1-CB 3.99Å; C137-C156 HydrophobicContact CB-CB 3.98Å; C137-C156 WeakPolarHBondContact CB-SG 3.36Å; C137-C156 VanDerWaalsContact SG-CA 3.59Å; C137-C156 WeakPolarHBondContact SG-CB 3.3Å; C137-C156 CovalentContact SG-SG 2.03Å; C137-C156 PolarHBondContact SG-SG 2.93Å; R152-C156 WeakPolarHBondContact O-CB 3.42Å; R152-C156 PolarHBondContact O-N 3.46Å; R152-C156 VanDerWaalsContact O-N 3.1Å
157	P	88.4	Confident	85.2	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.013	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-65.6	152.1	174.5	29	-35.9	0	0	0	110.3	F90 L92 L125 L136 V161	F90-P157 HydrophobicContact CE1-CB 4.47Å; F90-P157 HydrophobicContact CE1-CG 4.35Å; F90-P157 HydrophobicContact CZ-CB 4.45Å; F90-P157 HydrophobicContact CZ-CG 4.45Å; L92-P157 HydrophobicContact CB-CB 4.28Å; L92-P157 HydrophobicContact CG-CB 4.19Å; L92-P157 WeakPolarHBondContact O-CB 3.18Å; L125-P157 HydrophobicContact CD2-CG 3.85Å; L136-P157 WeakPolarHBondContact O-CD 3.27Å; P157-V161 HydrophobicContact CB-CG2 3.94Å; P157-V161 HydrophobicContact CG-CG2 3.62Å
158	K	86.9	Confident	84.4	Confident	137 Å²	137	66.5 Å²	66.5	60%	0.596	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-67.6	140.9	171.8	-71.5	177.6	-179.7	154.1	0	109.7	E93 P160	E93-K158 WeakPolarHBondContact OE2-CE 3.46Å; E93-K158 IonicContact OE2-NZ 3.35Å; E93-K158 PolarHBondContact OE2-NZ 3.36Å; K158-P160 CarbonylContact O-C 3.57Å
159	L	85.7	Confident	83.6	Confident	52 Å²	52	64.5 Å²	64.5	27%	0.272	36%	0.355	S	S	.	.	S	Bend	trans	-92.2	146.1	177.2	-62.9	169.4	0	0	0	110.8	Y122 L125 V161	Y122-L159 HydrophobicContact CD1-CD1 4.02Å; Y122-L159 HydrophobicContact CD2-CD1 3.53Å; Y122-L159 HydrophobicContact CE1-CD1 4.01Å; Y122-L159 HydrophobicContact CE1-CG 4.49Å; Y122-L159 HydrophobicContact CE2-CD1 3.53Å; Y122-L159 HydrophobicContact CG-CD1 3.78Å; L125-L159 HydrophobicContact CD1-CD2 3.38Å; L125-L159 HydrophobicContact CD2-CD2 4.18Å; L125-L159 HydrophobicContact CG-CD2 4.43Å; L159-V161 HydrophobicContact CD2-CG2 4.04Å
160	P	87.7	Confident	83.1	Confident	70 Å²	70	67.5 Å²	67.5	46%	0.455	37%	0.365	S	S	.	.	S	Bend	cis	-74	144.9	-4.2	31.3	-34.6	0	0	0	112.5	E118 L119 K120 K158	E118-P160 HydrophobicContact CG-CB 3.87Å; E118-P160 WeakPolarHBondContact OE1-CB 3.48Å; E118-P160 WeakPolarHBondContact OE1-CG 3.28Å; L119-P160 CarbonylContact O-C 3.51Å; L119-P160 WeakPolarHBondContact O-CA 3.03Å; K120-P160 HydrophobicContact CG-CB 4.33Å; K158-P160 CarbonylContact O-C 3.57Å
161	V	87.5	Confident	83.2	Confident	2 Å²	2	64 Å²	64	1%	0.012	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-78.8	121.3	171.4	-179.9	0	0	0	0	107.9	F90 P115 E118 L119 L125 P157 L159	F90-V161 HydrophobicContact CE2-CG1 4.09Å; F90-V161 HydrophobicContact CZ-CG1 3.9Å; P115-V161 HydrophobicContact CG-CG1 4.23Å; E118-V161 WeakPolarHBondContact CA-O 3.38Å; L119-V161 HydrophobicContact CB-CB 4.19Å; L119-V161 PolarHBondContact N-O 3.38Å; L119-V161 PolarHBondContact O-N 3.19Å; L125-V161 HydrophobicContact CD1-CG2 4.15Å; L125-V161 HydrophobicContact CD2-CG2 4.43Å; P157-V161 HydrophobicContact CB-CG2 3.94Å; P157-V161 HydrophobicContact CG-CG2 3.62Å; L159-V161 HydrophobicContact CD2-CG2 4.04Å
162	P	85.6	Confident	83.3	Confident	41 Å²	41	64.6 Å²	64.6	27%	0.266	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-69.5	146	-175.6	28.6	-35.5	0	0	0	111.6	S164 P175	P162-S164 PolarHBondContact O-N 2.94Å; P162-S164 PolarHBondContact O-OG 2.86Å; P162-S164 VanDerWaalsContact O-OG 3.09Å; P162-P175 HydrophobicContact CB-CB 4.23Å; P162-P175 HydrophobicContact CG-CB 4.11Å; P162-P175 HydrophobicContact CG-CG 4.02Å
163	Q	88.5	Confident	83.5	Confident	87 Å²	87	62.1 Å²	62.1	41%	0.407	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-53.3	130.8	169.7	176.9	177	2.5	0	0	110.1	A116 P175 V176	A116-Q163 VanDerWaalsContact O-CG 3.24Å; A116-Q163 WeakPolarHBondContact O-CG 3.29Å; A116-Q163 PolarHBondContact O-NE2 3.48Å; Q163-P175 CarbonylContact O-C 3.58Å; Q163-P175 VanDerWaalsContact O-CA 3.31Å; Q163-P175 WeakPolarHBondContact O-CA 3.26Å; Q163-V176 HydrophobicContact CG-CG2 3.84Å; Q163-V176 PolarHBondContact O-N 2.82Å
164	S	86.4	Confident	83.5	Confident	3 Å²	3	58.2 Å²	58.2	2%	0.021	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	138.7	-174.8	-60.4	0	0	0	0	112.1	C114 P115 P162 I174	C114-S164 WeakPolarHBondContact CB-O 3.48Å; P115-S164 PolarHBondContact O-N 2.83Å; P162-S164 PolarHBondContact O-N 2.94Å; P162-S164 PolarHBondContact O-OG 2.86Å; P162-S164 VanDerWaalsContact O-OG 3.09Å; S164-I174 CarbonylContact C-O 3.51Å; S164-I174 WeakPolarHBondContact CA-O 3.35Å; S164-I174 WeakPolarHBondContact CB-O 3.32Å
165	N	86.4	Confident	83.6	Confident	89 Å²	89	54.5 Å²	54.5	48%	0.476	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	150.7	175	-74	-23.7	0	0	0	111.1	I174 V176	N165-I174 PolarHBondContact N-O 3.34Å; N165-I174 PolarHBondContact O-N 3.41Å; N165-V176 HydrophobicContact CB-CG2 4.41Å; N165-V176 WeakPolarHBondContact ND2-CG2 3.45Å
166	A	83.7	Confident	83.2	Confident	42 Å²	42	55.6 Å²	55.6	35%	0.347	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	131.9	173.5	0	0	0	0	0	110.9	Y88	Y88-A166 HydrophobicContact CD1-CB 3.81Å; Y88-A166 HydrophobicContact CE1-CB 3.38Å
167	V	78.4	Confident	82.3	Confident	40 Å²	40	59.9 Å²	59.9	24%	0.242	32%	0.324	C	S	.	.			trans	-78.7	128.8	173	-178.1	0	0	0	0	110.3	V169 H171 R172 I174	V167-V169 PolarHBondContact O-N 3.43Å; V167-H171 PolarHBondContact O-N 2.84Å; V167-R172 PolarHBondContact N-O 3.14Å; V167-I174 HydrophobicContact CG2-CB 4.23Å; V167-I174 HydrophobicContact CG2-CD1 3.33Å; V167-I174 HydrophobicContact CG2-CG1 3.65Å
168	P	68.6	Low	80.9	Confident	124 Å²	124	66 Å²	66	81%	0.805	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-26.2	-174.8	-25.5	32.8	0	0	0	115.3
169	V	70.1	Confident	79.7	Confident	94 Å²	94	62.9 Å²	62.9	57%	0.57	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-30.7	-171.6	-178.4	0	0	0	0	113.7	V167	V167-V169 PolarHBondContact O-N 3.43Å
170	F	75.1	Confident	78.6	Confident	89 Å²	89	61.4 Å²	61.4	39%	0.39	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	12.5	-168	-71.2	-68	0	0	0	115.2	V54 R172	V54-F170 CarbonylContact O-C 3.43Å; V54-F170 WeakPolarHBondContact O-CA 3.38Å; V54-F170 VanDerWaalsContact O-O 3.12Å; F170-R172 VanDerWaalsContact O-CG 3.3Å; F170-R172 WeakPolarHBondContact O-CG 3.32Å; F170-R172 PolarHBondContact O-N 3.37Å
171	H	85.4	Confident	77.2	Confident	58 Å²	58	60.4 Å²	60.4	27%	0.269	33%	0.332	S	S	.	.			trans	38.9	46.9	179.7	-58.5	143	0	0	0	113.9	K87 Y88 V89 V167	K87-H171 WeakPolarHBondContact O-CB 3.44Å; Y88-H171 CarbonylContact C-O 3.6Å; Y88-H171 WeakPolarHBondContact CA-O 3.36Å; Y88-H171 HydrophobicContact CD1-CB 4.06Å; Y88-H171 HydrophobicContact CE1-CB 4.48Å; V89-H171 PolarHBondContact N-O 3.16Å; V167-H171 PolarHBondContact O-N 2.84Å
172	R	84.9	Confident	75.8	Confident	83 Å²	83	62.4 Å²	62.4	31%	0.313	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-119.7	143	178.6	-77.2	160.6	-165.3	162.1	8.3	109.4	V89 V167 F170	V89-R172 HydrophobicContact CB-CG 4.13Å; V167-R172 PolarHBondContact N-O 3.14Å; F170-R172 VanDerWaalsContact O-CG 3.3Å; F170-R172 WeakPolarHBondContact O-CG 3.32Å; F170-R172 PolarHBondContact O-N 3.37Å
173	C	86.8	Confident	74.2	Confident	4 Å²	4	67.2 Å²	67.2	3%	0.027	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	118.5	169.1	-59.6	0	0	0	0	109	V89 F90 C114	V89-C173 PolarHBondContact O-N 3.18Å; F90-C173 HydrophobicContact CD2-CB 4.27Å; C114-C173 WeakPolarHBondContact CA-SG 3.43Å; C114-C173 HydrophobicContact CB-CB 3.78Å; C114-C173 WeakPolarHBondContact CB-SG 3.4Å; C114-C173 WeakPolarHBondContact SG-CA 3.47Å; C114-C173 WeakPolarHBondContact SG-CB 3.4Å; C114-C173 CovalentContact SG-SG 2.04Å; C114-C173 PolarHBondContact SG-SG 3.14Å
174	I	82.1	Confident	72.2	Confident	66 Å²	66	67.5 Å²	67.5	34%	0.338	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129.5	177.4	-62.7	-167.6	0	0	0	108.7	S164 N165 V167 Y181	S164-I174 CarbonylContact C-O 3.51Å; S164-I174 WeakPolarHBondContact CA-O 3.35Å; S164-I174 WeakPolarHBondContact CB-O 3.32Å; N165-I174 PolarHBondContact N-O 3.34Å; N165-I174 PolarHBondContact O-N 3.41Å; V167-I174 HydrophobicContact CG2-CB 4.23Å; V167-I174 HydrophobicContact CG2-CD1 3.33Å; V167-I174 HydrophobicContact CG2-CG1 3.65Å; I174-Y181 HydrophobicContact CG2-CE2 3.64Å
175	P	82.6	Confident	70.4	Confident	7 Å²	7	69 Å²	69	5%	0.045	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53	139.3	173.4	-27.1	35.1	0	0	0	112.5	P94 P162 Q163 D177 Y181	P94-P175 HydrophobicContact CB-CG 4Å; P94-P175 HydrophobicContact CG-CG 3.7Å; P162-P175 HydrophobicContact CB-CB 4.23Å; P162-P175 HydrophobicContact CG-CB 4.11Å; P162-P175 HydrophobicContact CG-CG 4.02Å; Q163-P175 CarbonylContact O-C 3.58Å; Q163-P175 VanDerWaalsContact O-CA 3.31Å; Q163-P175 WeakPolarHBondContact O-CA 3.26Å; P175-D177 VanDerWaalsContact C-N 3.35Å; P175-Y181 WeakPolarHBondContact CD-OH 3Å
176	V	77.9	Confident	68.5	Low	69 Å²	69	70.4 Å²	70.4	42%	0.418	38%	0.384	S	S	.	.	S	Bend	trans	-70	-35.8	177.4	178.3	0	0	0	0	110.9	Q163 N165 I178	Q163-V176 HydrophobicContact CG-CG2 3.84Å; Q163-V176 PolarHBondContact O-N 2.82Å; N165-V176 HydrophobicContact CB-CG2 4.41Å; N165-V176 WeakPolarHBondContact ND2-CG2 3.45Å; V176-I178 PolarHBondContact O-N 3.25Å
177	D	69.4	Low	66.6	Low	98 Å²	98	69.1 Å²	69.1	52%	0.524	37%	0.373	S	S	.	.			trans	-77.6	110.7	174.4	-172	8.2	0	0	0	110.8	P175 S179 C180	P175-D177 VanDerWaalsContact C-N 3.35Å; D177-S179 PolarHBondContact O-N 3Å; D177-S179 VanDerWaalsContact OD1-CB 3.29Å; D177-S179 WeakPolarHBondContact OD1-CB 3.34Å; D177-S179 PolarHBondContact OD1-N 3.38Å; D177-S179 PolarHBondContact OD1-OG 3.39Å; D177-S179 WeakPolarHBondContact OD2-CB 3.41Å; D177-S179 PolarHBondContact OD2-OG 2.92Å; D177-C180 PolarHBondContact O-N 3.42Å
178	I	59.7	Low	64.9	Low	132 Å²	132	72.7 Å²	72.7	68%	0.677	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-69.7	-15.2	-178.3	-55.3	168.8	0	0	0	111	V176 C180 Y181	V176-I178 PolarHBondContact O-N 3.25Å; I178-C180 PolarHBondContact O-N 2.91Å; I178-C180 VanDerWaalsContact O-N 3.15Å; I178-Y181 PolarHBondContact O-N 3.44Å
179	S	61.6	Low	63.7	Low	71 Å²	71	68.9 Å²	68.9	50%	0.497	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-54.8	-31.1	176.1	76.6	0	0	0	0	112.8	D177 Y181 A182	D177-S179 PolarHBondContact O-N 3Å; D177-S179 VanDerWaalsContact OD1-CB 3.29Å; D177-S179 WeakPolarHBondContact OD1-CB 3.34Å; D177-S179 PolarHBondContact OD1-N 3.38Å; D177-S179 PolarHBondContact OD1-OG 3.39Å; D177-S179 WeakPolarHBondContact OD2-CB 3.41Å; D177-S179 PolarHBondContact OD2-OG 2.92Å; S179-Y181 VanDerWaalsContact C-N 3.28Å; S179-Y181 PolarHBondContact O-N 3.38Å; S179-A182 WeakPolarHBondContact O-CB 3.46Å; S179-A182 PolarHBondContact O-N 2.96Å
180	C	61.6	Low	62.4	Low	21 Å²	21	68.2 Å²	68.2	14%	0.142	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-63.1	-29.4	176.2	170.7	0	0	0	0	113.7	C95 D177 I178 A182	C95-C180 WeakPolarHBondContact CA-SG 3.25Å; C95-C180 HydrophobicContact CB-CB 4.19Å; C95-C180 WeakPolarHBondContact CB-O 3.3Å; C95-C180 WeakPolarHBondContact CB-SG 3.49Å; C95-C180 WeakPolarHBondContact SG-CB 3.3Å; C95-C180 CovalentContact SG-SG 2.03Å; C95-C180 PolarHBondContact SG-SG 2.72Å; D177-C180 PolarHBondContact O-N 3.42Å; I178-C180 PolarHBondContact O-N 2.91Å; I178-C180 VanDerWaalsContact O-N 3.15Å; C180-A182 VanDerWaalsContact C-N 3.35Å
181	Y	59.9	Low	60.6	Low	49 Å²	49	72 Å²	72	19%	0.192	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-93.9	7.2	174.3	-63.4	-75.4	0	0	0	112.3	I174 P175 I178 S179 E183 F184 A185	I174-Y181 HydrophobicContact CG2-CE2 3.64Å; P175-Y181 WeakPolarHBondContact CD-OH 3Å; I178-Y181 PolarHBondContact O-N 3.44Å; S179-Y181 VanDerWaalsContact C-N 3.28Å; S179-Y181 PolarHBondContact O-N 3.38Å; Y181-E183 PolarHBondContact O-N 3.49Å; Y181-F184 PolarHBondContact O-N 3.2Å; Y181-F184 VanDerWaalsContact O-N 3.08Å; Y181-A185 VanDerWaalsContact O-CB 3.29Å; Y181-A185 WeakPolarHBondContact O-CB 3.39Å; Y181-A185 PolarHBondContact O-N 3.41Å
182	A	56.9	Low	58.8	Low	43 Å²	43	73.1 Å²	73.1	36%	0.355	38%	0.381	S	S	.	.	H	α-helix	trans	-57.1	-35.4	-177.3	0	0	0	0	0	111.9	S179 C180 H186	S179-A182 WeakPolarHBondContact O-CB 3.46Å; S179-A182 PolarHBondContact O-N 2.96Å; C180-A182 VanDerWaalsContact C-N 3.35Å; A182-H186 WeakPolarHBondContact O-CA 3.5Å; A182-H186 WeakPolarHBondContact O-CB 3.4Å; A182-H186 PolarHBondContact O-CD2 2.98Å; A182-H186 VanDerWaalsContact O-CD2 3.22Å; A182-H186 PolarHBondContact O-N 3.04Å
183	E	52.2	Low	56.8	Low	142 Å²	142	70.5 Å²	70.5	66%	0.664	38%	0.381	S	S	*	.	H	α-helix	trans	-71.8	-38.4	175	-73	-163.7	168.3	0	0	113.6	Y181 H186 A187	Y181-E183 PolarHBondContact O-N 3.49Å; E183-H186 CarbonylContact O-C 3.6Å; E183-H186 PolarHBondContact O-N 3.3Å; E183-A187 WeakPolarHBondContact O-CB 3.37Å; E183-A187 PolarHBondContact O-N 2.97Å
184	F	46.1	Very low	54.7	Low	93 Å²	93	76.5 Å²	76.5	41%	0.408	41%	0.412	S	S	.	.	H	α-helix	trans	-69.6	-41.2	174.1	173.8	-100	0	0	0	111.6	F97 Y181 A187 F188	F97-F184 AromaticContact CD1-CD2 3.55Å; F97-F184 HydrophobicContact CD1-CD2 3.55Å; F97-F184 HydrophobicContact CD1-CE2 4.24Å; F97-F184 HydrophobicContact CD1-CG 4.47Å; F97-F184 AromaticContact CE1-CD2 3.44Å; F97-F184 HydrophobicContact CE1-CD2 3.44Å; F97-F184 VanDerWaalsContact CE1-CD2 3.44Å; F97-F184 AromaticContact CE1-CE2 3.67Å; F97-F184 HydrophobicContact CE1-CE2 3.67Å; F97-F184 HydrophobicContact CG-CD2 4.25Å; F97-F184 HydrophobicContact CZ-CD2 4.07Å; F97-F184 AromaticContact CZ-CE2 3.92Å; F97-F184 HydrophobicContact CZ-CE2 3.92Å; Y181-F184 PolarHBondContact O-N 3.2Å; Y181-F184 VanDerWaalsContact O-N 3.08Å; F184-A187 PolarHBondContact O-N 3.37Å; F184-F188 VanDerWaalsContact O-CB 3.27Å; F184-F188 WeakPolarHBondContact O-CB 3.26Å; F184-F188 PolarHBondContact O-N 3.25Å
185	A	48.2	Very low	53.3	Low	34 Å²	34	77.6 Å²	77.6	28%	0.281	42%	0.419	S	S	.	.	H	α-helix	trans	-61.9	-46.2	171.5	0	0	0	0	0	109.4	Y181 A187 F188 I189	Y181-A185 VanDerWaalsContact O-CB 3.29Å; Y181-A185 WeakPolarHBondContact O-CB 3.39Å; Y181-A185 PolarHBondContact O-N 3.41Å; A185-A187 VanDerWaalsContact C-N 3.33Å; A185-A187 PolarHBondContact O-N 3.29Å; A185-F188 PolarHBondContact O-N 3.2Å; A185-I189 HydrophobicContact CB-CD1 4.3Å; A185-I189 WeakPolarHBondContact O-CA 3.43Å; A185-I189 WeakPolarHBondContact O-CB 3.41Å; A185-I189 WeakPolarHBondContact O-CD1 3.47Å; A185-I189 WeakPolarHBondContact O-CG1 3.41Å; A185-I189 PolarHBondContact O-N 3.02Å
186	H	48.2	Very low	52.1	Low	120 Å²	120	81.8 Å²	81.8	56%	0.556	45%	0.445	S	S	*	.	H	α-helix	trans	-61.6	-39.1	174.9	-99.3	-82	0	0	0	111.9	A182 E183 I189 T190	A182-H186 WeakPolarHBondContact O-CA 3.5Å; A182-H186 WeakPolarHBondContact O-CB 3.4Å; A182-H186 PolarHBondContact O-CD2 2.98Å; A182-H186 VanDerWaalsContact O-CD2 3.22Å; A182-H186 PolarHBondContact O-N 3.04Å; E183-H186 CarbonylContact O-C 3.6Å; E183-H186 PolarHBondContact O-N 3.3Å; H186-I189 CarbonylContact O-C 3.43Å; H186-I189 PolarHBondContact O-N 2.94Å; H186-T190 WeakPolarHBondContact O-CB 3Å; H186-T190 PolarHBondContact O-N 3.27Å; H186-T190 PolarHBondContact O-OG1 3.04Å
187	A	43.1	Very low	50.9	Low	15 Å²	15	81.6 Å²	81.6	12%	0.124	44%	0.443	C	S	.	.	H	α-helix	trans	-73.5	-38.9	179.3	0	0	0	0	0	113.2	I99 E183 F184 A185 T190 F191	I99-A187 HydrophobicContact CB-CB 4.45Å; I99-A187 HydrophobicContact CD1-CB 3.33Å; I99-A187 HydrophobicContact CG1-CB 3.68Å; I99-A187 HydrophobicContact CG2-CB 3.9Å; E183-A187 WeakPolarHBondContact O-CB 3.37Å; E183-A187 PolarHBondContact O-N 2.97Å; F184-A187 PolarHBondContact O-N 3.37Å; A185-A187 VanDerWaalsContact C-N 3.33Å; A185-A187 PolarHBondContact O-N 3.29Å; A187-T190 VanDerWaalsContact CA-OG1 3.24Å; A187-T190 WeakPolarHBondContact CA-OG1 3.45Å; A187-T190 PolarHBondContact O-OG1 3.46Å; A187-F191 WeakPolarHBondContact O-CA 3.36Å; A187-F191 WeakPolarHBondContact O-CB 2.98Å; A187-F191 PolarHBondContact O-N 3.41Å
188	F	43.5	Very low	50.2	Low	114 Å²	114	80.5 Å²	80.5	50%	0.5	44%	0.437	S	S	.	.	H	α-helix	trans	-67.9	-39.4	169.8	-174.8	-99.5	0	0	0	110.5	F184 A185 F191 V192	F184-F188 VanDerWaalsContact O-CB 3.27Å; F184-F188 WeakPolarHBondContact O-CB 3.26Å; F184-F188 PolarHBondContact O-N 3.25Å; A185-F188 PolarHBondContact O-N 3.2Å; F188-F191 PolarHBondContact O-N 3.17Å; F188-V192 HydrophobicContact CE1-CG2 4.26Å; F188-V192 HydrophobicContact CE2-CG2 4.38Å; F188-V192 HydrophobicContact CZ-CG2 4.19Å; F188-V192 VanDerWaalsContact O-CB 3.23Å; F188-V192 WeakPolarHBondContact O-CB 3.37Å; F188-V192 VanDerWaalsContact O-CG2 3.27Å; F188-V192 WeakPolarHBondContact O-CG2 3.29Å; F188-V192 PolarHBondContact O-N 3.06Å
189	I	43.7	Very low	50	Low	44 Å²	44	83.4 Å²	83.4	23%	0.226	44%	0.44	C	S	.	.	H	α-helix	trans	-67.7	-38	174.6	-70.8	163.2	0	0	0	111.1	A185 H186 V192 G193 D194	A185-I189 HydrophobicContact CB-CD1 4.3Å; A185-I189 WeakPolarHBondContact O-CA 3.43Å; A185-I189 WeakPolarHBondContact O-CB 3.41Å; A185-I189 WeakPolarHBondContact O-CD1 3.47Å; A185-I189 WeakPolarHBondContact O-CG1 3.41Å; A185-I189 PolarHBondContact O-N 3.02Å; H186-I189 CarbonylContact O-C 3.43Å; H186-I189 PolarHBondContact O-N 2.94Å; I189-V192 CarbonylContact O-C 3.51Å; I189-G193 CarbonylContact O-C 3.29Å; I189-G193 WeakPolarHBondContact O-CA 3.41Å; I189-G193 PolarHBondContact O-N 2.82Å; I189-D194 PolarHBondContact O-N 3.07Å
190	T	42	Very low	50	Low	80 Å²	80	86.9 Å²	86.9	49%	0.491	44%	0.442	S	S	.	.	H	α-helix	trans	-77.9	-32.4	174.7	31.5	0	0	0	0	112	H186 A187 G193	H186-T190 WeakPolarHBondContact O-CB 3Å; H186-T190 PolarHBondContact O-N 3.27Å; H186-T190 PolarHBondContact O-OG1 3.04Å; A187-T190 VanDerWaalsContact CA-OG1 3.24Å; A187-T190 WeakPolarHBondContact CA-OG1 3.45Å; A187-T190 PolarHBondContact O-OG1 3.46Å; T190-G193 WeakPolarHBondContact O-CA 3.45Å; T190-G193 PolarHBondContact O-N 3.48Å; T190-G193 VanDerWaalsContact O-N 3.12Å
191	F	37.3	Very low	50.1	Low	168 Å²	168	87.5 Å²	87.5	74%	0.737	45%	0.445	S	S	*	.	H	α-helix	trans	-70	-32.7	172.3	-176	-99.1	0	0	0	112.4	A187 F188 G193	A187-F191 WeakPolarHBondContact O-CA 3.36Å; A187-F191 WeakPolarHBondContact O-CB 2.98Å; A187-F191 PolarHBondContact O-N 3.41Å; F188-F191 PolarHBondContact O-N 3.17Å; F191-G193 VanDerWaalsContact C-N 3.3Å
192	V	46.5	Very low	50.3	Low	82 Å²	82	89.8 Å²	89.8	50%	0.497	46%	0.459	S	S	.	.	S	Bend	trans	-90.2	2	169.5	179.7	0	0	0	0	111.5	F188 I189	F188-V192 HydrophobicContact CE1-CG2 4.26Å; F188-V192 HydrophobicContact CE2-CG2 4.38Å; F188-V192 HydrophobicContact CZ-CG2 4.19Å; F188-V192 VanDerWaalsContact O-CB 3.23Å; F188-V192 WeakPolarHBondContact O-CB 3.37Å; F188-V192 VanDerWaalsContact O-CG2 3.27Å; F188-V192 WeakPolarHBondContact O-CG2 3.29Å; F188-V192 PolarHBondContact O-N 3.06Å; I189-V192 CarbonylContact O-C 3.51Å
193	G	43.6	Very low	50.6	Low	29 Å²	29	90.2 Å²	90.2	30%	0.299	46%	0.463	S	S	.	.			trans	77	100.1	174.6	0	0	0	0	0	113.8	I189 T190 F191 N195	I189-G193 CarbonylContact O-C 3.29Å; I189-G193 WeakPolarHBondContact O-CA 3.41Å; I189-G193 PolarHBondContact O-N 2.82Å; T190-G193 WeakPolarHBondContact O-CA 3.45Å; T190-G193 PolarHBondContact O-N 3.48Å; T190-G193 VanDerWaalsContact O-N 3.12Å; F191-G193 VanDerWaalsContact C-N 3.3Å; G193-N195 WeakPolarHBondContact O-CB 3.19Å; G193-N195 VanDerWaalsContact O-CG 3.29Å; G193-N195 PolarHBondContact O-N 2.87Å; G193-N195 PolarHBondContact O-ND2 2.98Å
194	D	42.8	Very low	51.3	Low	129 Å²	129	84 Å²	84	69%	0.69	44%	0.437	S	S	*	.	S	Bend	trans	36.1	20.2	143.3	-116.7	3.6	0	0	0	121.2	I189	I189-D194 PolarHBondContact O-N 3.07Å
195	N	53.5	Low	52.4	Low	90 Å²	90	82.1 Å²	82.1	48%	0.481	43%	0.433	S	S	.	.			trans	-111.6	103.7	-164.3	-81.9	-49.7	0	0	0	111.3	G193 V197 L198	G193-N195 WeakPolarHBondContact O-CB 3.19Å; G193-N195 VanDerWaalsContact O-CG 3.29Å; G193-N195 PolarHBondContact O-N 2.87Å; G193-N195 PolarHBondContact O-ND2 2.98Å; N195-V197 HydrophobicContact CB-CB 3.78Å; N195-V197 HydrophobicContact CB-CG2 3.77Å; N195-V197 PolarHBondContact O-N 2.78Å; N195-L198 PolarHBondContact O-N 2.93Å
196	T	56.8	Low	53.5	Low	95 Å²	95	85.9 Å²	85.9	58%	0.583	45%	0.447	S	S	*	.	H	α-helix	trans	-39	-23.9	150.1	54.1	0	0	0	0	112.8	L198 R200	T196-L198 PolarHBondContact O-N 3.24Å; T196-R200 VanDerWaalsContact O-CG 3.31Å; T196-R200 WeakPolarHBondContact O-CG 3.27Å; T196-R200 PolarHBondContact O-N 3.42Å; T196-R200 VanDerWaalsContact O-N 3.09Å
197	V	52.9	Low	54.6	Low	64 Å²	64	84.4 Å²	84.4	39%	0.388	45%	0.447	S	S	.	.	H	α-helix	trans	-53.3	-45.1	169.3	-166.8	0	0	0	0	112.6	N195 R199 R200 V201	N195-V197 HydrophobicContact CB-CB 3.78Å; N195-V197 HydrophobicContact CB-CG2 3.77Å; N195-V197 PolarHBondContact O-N 2.78Å; V197-R199 PolarHBondContact O-N 2.91Å; V197-R200 CarbonylContact O-C 3.51Å; V197-R200 WeakPolarHBondContact O-CA 3.49Å; V197-R200 WeakPolarHBondContact O-CB 3.34Å; V197-R200 PolarHBondContact O-N 3.38Å; V197-R200 VanDerWaalsContact O-N 3.13Å; V197-V201 HydrophobicContact CG1-CG2 4.04Å; V197-V201 WeakPolarHBondContact O-CG2 3.36Å; V197-V201 PolarHBondContact O-N 3.5Å
198	L	54.1	Low	56.3	Low	76 Å²	76	83.7 Å²	83.7	40%	0.398	44%	0.441	S	S	.	.	H	α-helix	trans	-65	-41.4	-176.4	-175.7	65.6	0	0	0	112.7	N195 T196 R200 V201 I202	N195-L198 PolarHBondContact O-N 2.93Å; T196-L198 PolarHBondContact O-N 3.24Å; L198-R200 VanDerWaalsContact C-N 3.34Å; L198-V201 WeakPolarHBondContact O-CB 3.42Å; L198-V201 PolarHBondContact O-N 3.42Å; L198-I202 HydrophobicContact CG-CD1 4.4Å; L198-I202 WeakPolarHBondContact O-CG1 3.26Å; L198-I202 PolarHBondContact O-N 3.29Å
199	R	55.8	Low	58.2	Low	192 Å²	192	83.8 Å²	83.8	73%	0.725	44%	0.442	S	S	*	.	H	α-helix	trans	-65	-39.7	173.1	-72.3	-167.1	-176.9	-137.6	4.7	111.3	V197 V201 I202 A203	V197-R199 PolarHBondContact O-N 2.91Å; R199-V201 VanDerWaalsContact C-N 3.31Å; R199-V201 PolarHBondContact O-N 2.9Å; R199-I202 PolarHBondContact O-N 2.84Å; R199-A203 WeakPolarHBondContact O-CB 3.37Å; R199-A203 PolarHBondContact O-N 3.2Å
200	R	61.6	Low	60.3	Low	144 Å²	144	87.2 Å²	87.2	54%	0.543	46%	0.457	S	S	.	.	H	α-helix	trans	-65.3	-31.5	172.7	-70.4	174.7	-179.9	178.7	0.6	112.5	T196 V197 L198 G204	T196-R200 VanDerWaalsContact O-CG 3.31Å; T196-R200 WeakPolarHBondContact O-CG 3.27Å; T196-R200 PolarHBondContact O-N 3.42Å; T196-R200 VanDerWaalsContact O-N 3.09Å; V197-R200 CarbonylContact O-C 3.51Å; V197-R200 WeakPolarHBondContact O-CA 3.49Å; V197-R200 WeakPolarHBondContact O-CB 3.34Å; V197-R200 PolarHBondContact O-N 3.38Å; V197-R200 VanDerWaalsContact O-N 3.13Å; L198-R200 VanDerWaalsContact C-N 3.34Å; R200-G204 WeakPolarHBondContact O-CA 3.23Å; R200-G204 PolarHBondContact O-N 3.47Å
201	V	62.9	Low	62.3	Low	35 Å²	35	85 Å²	85	21%	0.212	44%	0.441	C	S	.	.	H	α-helix	trans	-64.6	-53.8	174.5	178.3	0	0	0	0	110	V197 L198 R199 A203 G204 V205 L569 I573	V197-V201 HydrophobicContact CG1-CG2 4.04Å; V197-V201 WeakPolarHBondContact O-CG2 3.36Å; V197-V201 PolarHBondContact O-N 3.5Å; L198-V201 WeakPolarHBondContact O-CB 3.42Å; L198-V201 PolarHBondContact O-N 3.42Å; R199-V201 VanDerWaalsContact C-N 3.31Å; R199-V201 PolarHBondContact O-N 2.9Å; V201-A203 PolarHBondContact O-N 3.38Å; V201-G204 PolarHBondContact O-N 3.3Å; V201-V205 HydrophobicContact CG1-CG2 4.27Å; V201-V205 WeakPolarHBondContact O-CB 3.34Å; V201-V205 VanDerWaalsContact O-CG2 3.23Å; V201-V205 WeakPolarHBondContact O-CG2 3.3Å; V201-V205 PolarHBondContact O-N 3.42Å; V201-L569 HydrophobicContact CB-CD2 3.66Å; V201-L569 HydrophobicContact CG1-CD2 4.09Å; V201-L569 HydrophobicContact CG2-CD1 4.17Å; V201-L569 HydrophobicContact CG2-CD2 3.25Å; V201-L569 HydrophobicContact CG2-CG 4.23Å; V201-I573 HydrophobicContact CG1-CD1 4.22Å
202	I	64.2	Low	64.7	Low	96 Å²	96	78 Å²	78	49%	0.492	41%	0.411	S	S	.	.	H	α-helix	trans	-63.1	-46.4	-176.9	-64.7	168	0	0	0	110	L198 R199 V205 I206	L198-I202 HydrophobicContact CG-CD1 4.4Å; L198-I202 WeakPolarHBondContact O-CG1 3.26Å; L198-I202 PolarHBondContact O-N 3.29Å; R199-I202 PolarHBondContact O-N 2.84Å; I202-V205 PolarHBondContact O-N 2.92Å; I202-I206 HydrophobicContact CG2-CD1 3.82Å; I202-I206 VanDerWaalsContact O-CG1 3.26Å; I202-I206 WeakPolarHBondContact O-CG1 3.49Å; I202-I206 PolarHBondContact O-N 3.44Å
203	A	63.9	Low	66.6	Low	53 Å²	53	79 Å²	79	44%	0.438	41%	0.412	S	S	.	.	H	α-helix	trans	-61.2	-47.3	176.2	0	0	0	0	0	111.9	R199 V201 V205 I206 T207	R199-A203 WeakPolarHBondContact O-CB 3.37Å; R199-A203 PolarHBondContact O-N 3.2Å; V201-A203 PolarHBondContact O-N 3.38Å; A203-V205 PolarHBondContact O-N 3.01Å; A203-I206 PolarHBondContact O-N 3.08Å; A203-T207 PolarHBondContact O-N 2.94Å; A203-T207 VanDerWaalsContact O-N 3.08Å; A203-T207 PolarHBondContact O-OG1 3.27Å
204	G	66.3	Low	68.9	Low	11 Å²	11	79.8 Å²	79.8	11%	0.113	42%	0.419	C	S	.	.	H	α-helix	trans	-61.4	-40.4	179.1	0	0	0	0	0	113.3	R200 V201 S208	R200-G204 WeakPolarHBondContact O-CA 3.23Å; R200-G204 PolarHBondContact O-N 3.47Å; V201-G204 PolarHBondContact O-N 3.3Å; G204-S208 WeakPolarHBondContact O-CB 3.42Å; G204-S208 PolarHBondContact O-N 2.87Å; G204-S208 VanDerWaalsContact O-N 3.08Å; G204-S208 PolarHBondContact O-OG 3.38Å
205	V	70.1	Confident	71.2	Confident	54 Å²	54	74.1 Å²	74.1	33%	0.327	39%	0.389	S	S	.	.	H	α-helix	trans	-66.8	-41.9	177	170.6	0	0	0	0	111.5	V201 I202 A203 K209 I212 I573	V201-V205 HydrophobicContact CG1-CG2 4.27Å; V201-V205 WeakPolarHBondContact O-CB 3.34Å; V201-V205 VanDerWaalsContact O-CG2 3.23Å; V201-V205 WeakPolarHBondContact O-CG2 3.3Å; V201-V205 PolarHBondContact O-N 3.42Å; I202-V205 PolarHBondContact O-N 2.92Å; A203-V205 PolarHBondContact O-N 3.01Å; V205-K209 WeakPolarHBondContact O-CA 3.44Å; V205-K209 WeakPolarHBondContact O-CB 3.38Å; V205-K209 PolarHBondContact O-N 2.9Å; V205-K209 VanDerWaalsContact O-N 3.11Å; V205-I212 HydrophobicContact CG1-CD1 4.4Å; V205-I212 HydrophobicContact CG2-CD1 4.41Å; V205-I573 HydrophobicContact CG2-CD1 3.52Å
206	I	70.5	Confident	72.9	Confident	112 Å²	112	71 Å²	71	57%	0.574	37%	0.374	S	S	*	.	H	α-helix	trans	-64.5	-44.5	179.8	-69.1	167	0	0	0	110.7	I202 A203	I202-I206 HydrophobicContact CG2-CD1 3.82Å; I202-I206 VanDerWaalsContact O-CG1 3.26Å; I202-I206 WeakPolarHBondContact O-CG1 3.49Å; I202-I206 PolarHBondContact O-N 3.44Å; A203-I206 PolarHBondContact O-N 3.08Å
207	T	72.3	Confident	74.5	Confident	89 Å²	89	70.9 Å²	70.9	55%	0.546	37%	0.373	S	S	.	.	H	α-helix	trans	-73	-33.3	-177.1	-38	0	0	0	0	112.2	A203 Y564	A203-T207 PolarHBondContact O-N 2.94Å; A203-T207 VanDerWaalsContact O-N 3.08Å; A203-T207 PolarHBondContact O-OG1 3.27Å; T207-Y564 HydrophobicContact CG2-CD1 4.18Å; T207-Y564 HydrophobicContact CG2-CE1 3.52Å; T207-Y564 PolarHBondContact O-OH 3.13Å
208	S	78.7	Confident	76.5	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.007	37%	0.37	C	S	.	.	H	α-helix	trans	-101	11.9	-176.2	64.6	0	0	0	0	115	G204 E210 I211 I212 P570	G204-S208 WeakPolarHBondContact O-CB 3.42Å; G204-S208 PolarHBondContact O-N 2.87Å; G204-S208 VanDerWaalsContact O-N 3.08Å; G204-S208 PolarHBondContact O-OG 3.38Å; S208-E210 VanDerWaalsContact C-N 3.28Å; S208-E210 PolarHBondContact O-N 3.21Å; S208-E210 VanDerWaalsContact O-N 3.13Å; S208-I211 PolarHBondContact O-N 2.88Å; S208-I211 VanDerWaalsContact O-N 3.08Å; S208-I212 WeakPolarHBondContact O-CG1 3.35Å; S208-I212 PolarHBondContact O-N 3.46Å; S208-I212 WeakPolarHBondContact OG-CD1 3.33Å; S208-P570 WeakPolarHBondContact OG-CB 3.2Å; S208-P570 WeakPolarHBondContact OG-CG 3.37Å
209	K	82	Confident	78.3	Confident	116 Å²	116	67.1 Å²	67.1	50%	0.504	35%	0.351	S	S	.	.	H	α-helix	trans	-51.8	-40.1	-172.6	66.1	179	-178.7	159.9	0	114.4	V205 I212 M213	V205-K209 WeakPolarHBondContact O-CA 3.44Å; V205-K209 WeakPolarHBondContact O-CB 3.38Å; V205-K209 PolarHBondContact O-N 2.9Å; V205-K209 VanDerWaalsContact O-N 3.11Å; K209-I212 PolarHBondContact O-N 3.46Å; K209-M213 VanDerWaalsContact O-CG 3.32Å; K209-M213 WeakPolarHBondContact O-CG 3.45Å; K209-M213 PolarHBondContact O-N 3.39Å
210	E	87.6	Confident	79.9	Confident	116 Å²	116	62.6 Å²	62.6	54%	0.542	34%	0.337	S	S	.	.	H	α-helix	trans	-69.3	-40.9	-177.7	-57.5	-56.1	149.8	0	0	111.2	S208 M213 G214	S208-E210 VanDerWaalsContact C-N 3.28Å; S208-E210 PolarHBondContact O-N 3.21Å; S208-E210 VanDerWaalsContact O-N 3.13Å; E210-M213 PolarHBondContact O-N 2.88Å; E210-M213 WeakPolarHBondContact OE2-CE 3.13Å; E210-G214 PolarHBondContact O-N 3.17Å
211	I	85.9	Confident	81.3	Confident	33 Å²	33	58.8 Å²	58.8	17%	0.169	33%	0.329	C	S	.	.	H	α-helix	trans	-67.8	-43.3	176.1	-59.4	173.5	0	0	0	109.8	S208 M213 G214 L215 A557 L558 Y564	S208-I211 PolarHBondContact O-N 2.88Å; S208-I211 VanDerWaalsContact O-N 3.08Å; I211-M213 VanDerWaalsContact C-N 3.34Å; I211-M213 PolarHBondContact O-N 3.22Å; I211-G214 PolarHBondContact O-N 3.44Å; I211-L215 HydrophobicContact CG2-CD1 4.06Å; I211-L215 HydrophobicContact CG2-CG 4.32Å; I211-L215 WeakPolarHBondContact O-CG 3.36Å; I211-L215 PolarHBondContact O-N 2.8Å; I211-A557 HydrophobicContact CG2-CB 3.97Å; I211-L558 HydrophobicContact CB-CD2 4.28Å; I211-L558 HydrophobicContact CD1-CD2 3.93Å; I211-L558 HydrophobicContact CG2-CD2 3.82Å; I211-L558 HydrophobicContact CG2-CG 4.1Å; I211-Y564 HydrophobicContact CD1-CE2 4.07Å
212	I	85.8	Confident	82.7	Confident	21 Å²	21	59 Å²	59	11%	0.108	33%	0.329	C	S	.	.	H	α-helix	trans	-58	-47.8	175.6	-66.3	170.6	0	0	0	110.1	V205 S208 K209 G214 L215 C216 P570	V205-I212 HydrophobicContact CG1-CD1 4.4Å; V205-I212 HydrophobicContact CG2-CD1 4.41Å; S208-I212 WeakPolarHBondContact O-CG1 3.35Å; S208-I212 PolarHBondContact O-N 3.46Å; S208-I212 WeakPolarHBondContact OG-CD1 3.33Å; K209-I212 PolarHBondContact O-N 3.46Å; I212-G214 VanDerWaalsContact C-N 3.35Å; I212-G214 PolarHBondContact O-N 3.35Å; I212-L215 PolarHBondContact O-N 3.46Å; I212-C216 WeakPolarHBondContact O-CB 3.49Å; I212-C216 PolarHBondContact O-N 3.34Å; I212-C216 PolarHBondContact O-SG 3Å; I212-P570 HydrophobicContact CD1-CB 4.15Å; I212-P570 HydrophobicContact CG1-CB 4.28Å
213	M	87.6	Confident	83.9	Confident	104 Å²	104	54.5 Å²	54.5	51%	0.512	31%	0.306	S	S	.	.	H	α-helix	trans	-60	-44.3	176.8	-73.3	-167.1	-57.8	0	0	111.8	K209 E210 I211 L215 C216 V217	K209-M213 VanDerWaalsContact O-CG 3.32Å; K209-M213 WeakPolarHBondContact O-CG 3.45Å; K209-M213 PolarHBondContact O-N 3.39Å; E210-M213 PolarHBondContact O-N 2.88Å; E210-M213 WeakPolarHBondContact OE2-CE 3.13Å; I211-M213 VanDerWaalsContact C-N 3.34Å; I211-M213 PolarHBondContact O-N 3.22Å; M213-L215 PolarHBondContact O-N 3.24Å; M213-C216 WeakPolarHBondContact O-CB 3.27Å; M213-C216 PolarHBondContact O-N 3.45Å; M213-V217 WeakPolarHBondContact O-CG2 3.39Å; M213-V217 PolarHBondContact O-N 3.27Å
214	G	91.4	Very high	84.9	Confident	44 Å²	44	55.2 Å²	55.2	45%	0.454	30%	0.302	S	S	.	.	H	α-helix	trans	-58.5	-44.5	175	0	0	0	0	0	113.1	E210 I211 I212 V217 L218	E210-G214 PolarHBondContact O-N 3.17Å; I211-G214 PolarHBondContact O-N 3.44Å; I212-G214 VanDerWaalsContact C-N 3.35Å; I212-G214 PolarHBondContact O-N 3.35Å; G214-V217 PolarHBondContact O-N 2.95Å; G214-L218 WeakPolarHBondContact O-CB 3.33Å; G214-L218 PolarHBondContact O-N 3.46Å
215	L	90.6	Very high	85.9	Confident	10 Å²	10	59 Å²	59	5%	0.052	32%	0.319	C	S	.	.	H	α-helix	trans	-67.7	-35.7	176.8	-67.6	174.1	0	0	0	112.6	I211 I212 M213 L218 A219 T550 A553	I211-L215 HydrophobicContact CG2-CD1 4.06Å; I211-L215 HydrophobicContact CG2-CG 4.32Å; I211-L215 WeakPolarHBondContact O-CG 3.36Å; I211-L215 PolarHBondContact O-N 2.8Å; I212-L215 PolarHBondContact O-N 3.46Å; M213-L215 PolarHBondContact O-N 3.24Å; L215-L218 HydrophobicContact CD2-CD2 4.38Å; L215-L218 PolarHBondContact O-N 3.06Å; L215-A219 WeakPolarHBondContact O-CB 3.16Å; L215-A219 PolarHBondContact O-N 3.26Å; L215-T550 HydrophobicContact CB-CG2 4.22Å; L215-T550 HydrophobicContact CD2-CG2 4.4Å; L215-A553 HydrophobicContact CD2-CB 4.13Å
216	C	89.4	Confident	86.6	Confident	25 Å²	25	56.9 Å²	56.9	17%	0.169	31%	0.306	C	S	.	.	H	α-helix	trans	-64.3	-43.7	174.2	-71.4	0	0	0	0	111.6	I212 M213 A219 F220 F577	I212-C216 WeakPolarHBondContact O-CB 3.49Å; I212-C216 PolarHBondContact O-N 3.34Å; I212-C216 PolarHBondContact O-SG 3Å; M213-C216 WeakPolarHBondContact O-CB 3.27Å; M213-C216 PolarHBondContact O-N 3.45Å; C216-A219 PolarHBondContact O-N 3.39Å; C216-F220 PolarHBondContact O-N 2.74Å; C216-F577 HydrophobicContact CB-CD1 3.65Å; C216-F577 HydrophobicContact CB-CE1 3.43Å; C216-F577 VanDerWaalsContact CB-CE1 3.43Å; C216-F577 HydrophobicContact CB-CZ 4.17Å; C216-F577 WeakPolarHBondContact SG-CD1 3.49Å
217	V	91.7	Very high	87.1	Confident	93 Å²	93	52 Å²	52	56%	0.564	28%	0.281	S	S	*	.	H	α-helix	trans	-64.2	-44.3	174.5	173.5	0	0	0	0	110.6	M213 G214 A219 F220 V221	M213-V217 WeakPolarHBondContact O-CG2 3.39Å; M213-V217 PolarHBondContact O-N 3.27Å; G214-V217 PolarHBondContact O-N 2.95Å; V217-A219 VanDerWaalsContact C-N 3.34Å; V217-A219 PolarHBondContact O-N 3.45Å; V217-F220 WeakPolarHBondContact O-CB 3.45Å; V217-F220 PolarHBondContact O-N 2.96Å; V217-V221 HydrophobicContact CG1-CG2 4.39Å; V217-V221 WeakPolarHBondContact O-CG2 3.24Å; V217-V221 PolarHBondContact O-N 3.48Å
218	L	93.3	Very high	87.4	Confident	60 Å²	60	51.1 Å²	51.1	31%	0.314	28%	0.275	S	S	.	.	H	α-helix	trans	-57	-47.3	175.2	178.6	64.8	0	0	0	111.3	G214 L215 F220 V221 L222 A553	G214-L218 WeakPolarHBondContact O-CB 3.33Å; G214-L218 PolarHBondContact O-N 3.46Å; L215-L218 HydrophobicContact CD2-CD2 4.38Å; L215-L218 PolarHBondContact O-N 3.06Å; L218-F220 VanDerWaalsContact C-N 3.3Å; L218-F220 PolarHBondContact O-N 3.15Å; L218-V221 PolarHBondContact O-N 2.91Å; L218-L222 HydrophobicContact CD1-CD1 4.14Å; L218-L222 HydrophobicContact CD1-CG 4.07Å; L218-L222 HydrophobicContact CD2-CD1 4.48Å; L218-L222 HydrophobicContact CG-CD1 3.9Å; L218-L222 HydrophobicContact CG-CG 4.25Å; L218-L222 WeakPolarHBondContact O-CB 3.48Å; L218-L222 VanDerWaalsContact O-CG 3.29Å; L218-L222 WeakPolarHBondContact O-CG 3.45Å; L218-L222 PolarHBondContact O-N 2.97Å; L218-A553 HydrophobicContact CD2-CB 3.55Å
219	A	92.8	Very high	87.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-61.7	-37.9	178.8	0	0	0	0	0	112.8	L215 C216 V217 S223 T550 A578	L215-A219 WeakPolarHBondContact O-CB 3.16Å; L215-A219 PolarHBondContact O-N 3.26Å; C216-A219 PolarHBondContact O-N 3.39Å; V217-A219 VanDerWaalsContact C-N 3.34Å; V217-A219 PolarHBondContact O-N 3.45Å; A219-S223 WeakPolarHBondContact O-CB 3.17Å; A219-S223 PolarHBondContact O-N 2.87Å; A219-S223 PolarHBondContact O-OG 2.75Å; A219-T550 HydrophobicContact CB-CG2 4.19Å; A219-A578 HydrophobicContact CB-CB 3.58Å
220	F	89.4	Confident	87.4	Confident	97 Å²	97	48 Å²	48	43%	0.425	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-48.7	173.5	-179.3	-95.7	0	0	0	111.9	C216 V217 L218 L222 S223 L224 V581 F585	C216-F220 PolarHBondContact O-N 2.74Å; V217-F220 WeakPolarHBondContact O-CB 3.45Å; V217-F220 PolarHBondContact O-N 2.96Å; L218-F220 VanDerWaalsContact C-N 3.3Å; L218-F220 PolarHBondContact O-N 3.15Å; F220-L222 PolarHBondContact O-N 2.92Å; F220-S223 WeakPolarHBondContact O-CB 3.36Å; F220-S223 PolarHBondContact O-N 3.4Å; F220-L224 HydrophobicContact CD1-CD1 3.96Å; F220-L224 HydrophobicContact CE1-CD1 3.4Å; F220-L224 HydrophobicContact CE1-CG 4.17Å; F220-L224 HydrophobicContact CZ-CD1 3.9Å; F220-L224 HydrophobicContact CZ-CG 4.37Å; F220-L224 PolarHBondContact O-N 3.37Å; F220-V581 HydrophobicContact CB-CG1 4.43Å; F220-V581 HydrophobicContact CD2-CG1 4.11Å; F220-F585 AromaticContact CD2-CE2 3.96Å; F220-F585 HydrophobicContact CD2-CE2 3.96Å; F220-F585 HydrophobicContact CD2-CZ 4.24Å; F220-F585 AromaticContact CE2-CE2 3.8Å; F220-F585 HydrophobicContact CE2-CE2 3.8Å; F220-F585 AromaticContact CE2-CZ 3.62Å; F220-F585 HydrophobicContact CE2-CZ 3.62Å; F220-F585 HydrophobicContact CZ-CZ 4.19Å
221	V	91.4	Very high	86.7	Confident	64 Å²	64	46.4 Å²	46.4	39%	0.388	26%	0.255	S	S	.	.	H	α-helix	trans	-61.8	-44.9	177.5	172.8	0	0	0	0	111.1	V217 L218 S223 L224 I225	V217-V221 HydrophobicContact CG1-CG2 4.39Å; V217-V221 WeakPolarHBondContact O-CG2 3.24Å; V217-V221 PolarHBondContact O-N 3.48Å; L218-V221 PolarHBondContact O-N 2.91Å; V221-S223 VanDerWaalsContact C-N 3.28Å; V221-S223 PolarHBondContact O-N 3.28Å; V221-L224 PolarHBondContact O-N 3.47Å; V221-I225 HydrophobicContact CG1-CD1 3.77Å; V221-I225 HydrophobicContact CG1-CG1 4.33Å; V221-I225 VanDerWaalsContact O-CG1 3.31Å; V221-I225 WeakPolarHBondContact O-CG1 2.96Å; V221-I225 PolarHBondContact O-N 3.48Å
222	L	91.3	Very high	86	Confident	40 Å²	40	51.5 Å²	51.5	21%	0.209	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-36.8	175.8	-72.8	176.4	0	0	0	112.1	L218 F220 I225 M226 I546 C549	L218-L222 HydrophobicContact CD1-CD1 4.14Å; L218-L222 HydrophobicContact CD1-CG 4.07Å; L218-L222 HydrophobicContact CD2-CD1 4.48Å; L218-L222 HydrophobicContact CG-CD1 3.9Å; L218-L222 HydrophobicContact CG-CG 4.25Å; L218-L222 WeakPolarHBondContact O-CB 3.48Å; L218-L222 VanDerWaalsContact O-CG 3.29Å; L218-L222 WeakPolarHBondContact O-CG 3.45Å; L218-L222 PolarHBondContact O-N 2.97Å; F220-L222 PolarHBondContact O-N 2.92Å; L222-I225 PolarHBondContact O-N 3.1Å; L222-M226 VanDerWaalsContact O-CB 3.28Å; L222-M226 WeakPolarHBondContact O-CB 3.39Å; L222-M226 PolarHBondContact O-N 3.07Å; L222-I546 HydrophobicContact CB-CG2 4.18Å; L222-C549 HydrophobicContact CD1-CB 3.8Å
223	S	90.3	Very high	85.4	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.007	29%	0.289	C	S	.	.	H	α-helix	trans	-66	-43.2	175.8	-60.3	0	0	0	0	111.6	A219 F220 V221 M226 T227	A219-S223 WeakPolarHBondContact O-CB 3.17Å; A219-S223 PolarHBondContact O-N 2.87Å; A219-S223 PolarHBondContact O-OG 2.75Å; F220-S223 WeakPolarHBondContact O-CB 3.36Å; F220-S223 PolarHBondContact O-N 3.4Å; V221-S223 VanDerWaalsContact C-N 3.28Å; V221-S223 PolarHBondContact O-N 3.28Å; S223-M226 PolarHBondContact O-N 3.22Å; S223-T227 PolarHBondContact O-N 2.95Å; S223-T227 PolarHBondContact O-OG1 3.37Å; S223-T227 VanDerWaalsContact O-OG1 3.09Å
224	L	84.4	Confident	84.5	Confident	69 Å²	69	50 Å²	50	36%	0.361	27%	0.266	S	S	.	.	H	α-helix	trans	-63.6	-45.3	174	-70.8	177.5	0	0	0	112.1	F220 V221 M226 T227 V228 F585	F220-L224 HydrophobicContact CD1-CD1 3.96Å; F220-L224 HydrophobicContact CE1-CD1 3.4Å; F220-L224 HydrophobicContact CE1-CG 4.17Å; F220-L224 HydrophobicContact CZ-CD1 3.9Å; F220-L224 HydrophobicContact CZ-CG 4.37Å; F220-L224 PolarHBondContact O-N 3.37Å; V221-L224 PolarHBondContact O-N 3.47Å; L224-M226 VanDerWaalsContact C-N 3.31Å; L224-M226 PolarHBondContact O-N 3.41Å; L224-T227 WeakPolarHBondContact O-CB 3.48Å; L224-T227 PolarHBondContact O-N 3Å; L224-V228 WeakPolarHBondContact O-CG2 3.33Å; L224-V228 PolarHBondContact O-N 3.28Å; L224-F585 HydrophobicContact CD2-CD1 4.32Å; L224-F585 HydrophobicContact CD2-CE1 3.58Å; L224-F585 HydrophobicContact CD2-CZ 3.77Å; L224-F585 HydrophobicContact CG-CZ 4.39Å
225	I	87.1	Confident	83.8	Confident	89 Å²	89	54.7 Å²	54.7	46%	0.456	27%	0.274	S	S	.	.	H	α-helix	trans	-58	-47.5	175	-69.9	168.9	0	0	0	109.3	V221 L222 T227 V228 V229	V221-I225 HydrophobicContact CG1-CD1 3.77Å; V221-I225 HydrophobicContact CG1-CG1 4.33Å; V221-I225 VanDerWaalsContact O-CG1 3.31Å; V221-I225 WeakPolarHBondContact O-CG1 2.96Å; V221-I225 PolarHBondContact O-N 3.48Å; L222-I225 PolarHBondContact O-N 3.1Å; I225-T227 VanDerWaalsContact C-N 3.3Å; I225-T227 PolarHBondContact O-N 3.5Å; I225-V228 CarbonylContact O-C 3.42Å; I225-V228 WeakPolarHBondContact O-CA 3.49Å; I225-V228 PolarHBondContact O-N 3.16Å; I225-V229 HydrophobicContact CG2-CG2 3.83Å; I225-V229 WeakPolarHBondContact O-CB 3.19Å; I225-V229 VanDerWaalsContact O-CG2 3.26Å; I225-V229 WeakPolarHBondContact O-CG2 3.35Å; I225-V229 PolarHBondContact O-N 3.34Å
226	M	85.4	Confident	83.3	Confident	11 Å²	11	57.5 Å²	57.5	5%	0.054	29%	0.292	C	S	.	.	H	α-helix	trans	-57.3	-44.6	179.2	-174.2	64	-171.7	0	0	111.6	L222 S223 L224 V228 V229 I230 L237 L241 I546 L586	L222-M226 VanDerWaalsContact O-CB 3.28Å; L222-M226 WeakPolarHBondContact O-CB 3.39Å; L222-M226 PolarHBondContact O-N 3.07Å; S223-M226 PolarHBondContact O-N 3.22Å; L224-M226 VanDerWaalsContact C-N 3.31Å; L224-M226 PolarHBondContact O-N 3.41Å; M226-V228 VanDerWaalsContact C-N 3.32Å; M226-V228 PolarHBondContact O-N 3.05Å; M226-V229 PolarHBondContact O-N 3.35Å; M226-I230 HydrophobicContact CE-CD1 3.99Å; M226-I230 HydrophobicContact CE-CG1 3.99Å; M226-I230 HydrophobicContact CG-CD1 4.2Å; M226-I230 VanDerWaalsContact O-CG1 3.24Å; M226-I230 WeakPolarHBondContact O-CG1 3.4Å; M226-I230 PolarHBondContact O-N 3.01Å; M226-L237 HydrophobicContact CE-CD1 3.98Å; M226-L237 HydrophobicContact CE-CD2 3.83Å; M226-L237 HydrophobicContact CE-CG 4.34Å; M226-L237 HydrophobicContact SD-CD1 4.17Å; M226-L241 HydrophobicContact CE-CD1 4.05Å; M226-I546 HydrophobicContact CB-CD1 3.88Å; M226-I546 HydrophobicContact CB-CG1 4.29Å; M226-I546 HydrophobicContact CG-CD1 4.01Å; M226-I546 HydrophobicContact CG-CG1 4.5Å; M226-L586 HydrophobicContact CG-CD2 4.27Å
227	T	80.5	Confident	82.6	Confident	8 Å²	8	56.9 Å²	56.9	5%	0.049	29%	0.287	C	S	.	.	H	α-helix	trans	-58.8	-41.8	174.3	-62.3	0	0	0	0	112.5	S223 L224 I225 F333	S223-T227 PolarHBondContact O-N 2.95Å; S223-T227 PolarHBondContact O-OG1 3.37Å; S223-T227 VanDerWaalsContact O-OG1 3.09Å; L224-T227 WeakPolarHBondContact O-CB 3.48Å; L224-T227 PolarHBondContact O-N 3Å; I225-T227 VanDerWaalsContact C-N 3.3Å; I225-T227 PolarHBondContact O-N 3.5Å; T227-F333 HydrophobicContact CG2-CD1 4.22Å; T227-F333 HydrophobicContact CG2-CE1 3.21Å; T227-F333 HydrophobicContact CG2-CZ 3.48Å; T227-F333 VanDerWaalsContact CG2-CZ 3.48Å
228	V	79.5	Confident	82	Confident	71 Å²	71	52.7 Å²	52.7	43%	0.43	26%	0.261	S	S	.	.	H	α-helix	trans	-70.1	-39.6	176.4	173.4	0	0	0	0	111.8	L224 I225 M226 R231 Y232	L224-V228 WeakPolarHBondContact O-CG2 3.33Å; L224-V228 PolarHBondContact O-N 3.28Å; I225-V228 CarbonylContact O-C 3.42Å; I225-V228 WeakPolarHBondContact O-CA 3.49Å; I225-V228 PolarHBondContact O-N 3.16Å; M226-V228 VanDerWaalsContact C-N 3.32Å; M226-V228 PolarHBondContact O-N 3.05Å; V228-R231 VanDerWaalsContact O-CB 3.26Å; V228-R231 WeakPolarHBondContact O-CB 3.23Å; V228-R231 PolarHBondContact O-N 3.02Å; V228-R231 VanDerWaalsContact O-N 3.07Å; V228-Y232 HydrophobicContact CG1-CD2 3.68Å; V228-Y232 HydrophobicContact CG1-CE2 3.68Å; V228-Y232 WeakPolarHBondContact O-CD2 3.26Å; V228-Y232 PolarHBondContact O-N 3.48Å
229	V	81.9	Confident	81.4	Confident	48 Å²	48	54 Å²	54	29%	0.291	27%	0.268	S	S	.	.	H	α-helix	trans	-67.2	-39.1	179.8	174.9	0	0	0	0	110.9	I225 M226 R231 Y232 I233 L237	I225-V229 HydrophobicContact CG2-CG2 3.83Å; I225-V229 WeakPolarHBondContact O-CB 3.19Å; I225-V229 VanDerWaalsContact O-CG2 3.26Å; I225-V229 WeakPolarHBondContact O-CG2 3.35Å; I225-V229 PolarHBondContact O-N 3.34Å; M226-V229 PolarHBondContact O-N 3.35Å; V229-R231 PolarHBondContact O-N 2.86Å; V229-R231 VanDerWaalsContact O-N 3.16Å; V229-Y232 PolarHBondContact O-N 3.09Å; V229-I233 PolarHBondContact O-N 3.01Å; V229-I233 VanDerWaalsContact O-N 3.12Å; V229-L237 HydrophobicContact CG1-CB 4.22Å; V229-L237 HydrophobicContact CG1-CD1 3.78Å; V229-L237 HydrophobicContact CG1-CD2 4.17Å; V229-L237 HydrophobicContact CG1-CG 4.26Å
230	I	77.2	Confident	80.9	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-55.5	-31.8	172.6	-69.4	165	0	0	0	110.9	M226 S234 L237 F319 L539 L586 F589	M226-I230 HydrophobicContact CE-CD1 3.99Å; M226-I230 HydrophobicContact CE-CG1 3.99Å; M226-I230 HydrophobicContact CG-CD1 4.2Å; M226-I230 VanDerWaalsContact O-CG1 3.24Å; M226-I230 WeakPolarHBondContact O-CG1 3.4Å; M226-I230 PolarHBondContact O-N 3.01Å; I230-S234 WeakPolarHBondContact O-CB 3.4Å; I230-S234 PolarHBondContact O-OG 3.19Å; I230-L237 HydrophobicContact CB-CD2 4.09Å; I230-L237 HydrophobicContact CG1-CD2 3.36Å; I230-F319 HydrophobicContact CG2-CB 4.26Å; I230-L539 HydrophobicContact CD1-CD2 4.31Å; I230-L586 HydrophobicContact CD1-CD2 3.52Å; I230-F589 HydrophobicContact CB-CE2 4.46Å; I230-F589 HydrophobicContact CB-CZ 4.45Å; I230-F589 HydrophobicContact CG2-CD2 4.4Å; I230-F589 HydrophobicContact CG2-CE1 3.71Å; I230-F589 HydrophobicContact CG2-CE2 3.6Å; I230-F589 HydrophobicContact CG2-CZ 3.19Å
231	R	73.1	Confident	80.4	Confident	83 Å²	83	53.8 Å²	53.8	31%	0.313	27%	0.27	S	S	.	.	H	α-helix	trans	-73.1	-50.7	177.3	162.7	-171.1	178.5	-171.3	3.5	113.3	V228 V229 T327	V228-R231 VanDerWaalsContact O-CB 3.26Å; V228-R231 WeakPolarHBondContact O-CB 3.23Å; V228-R231 PolarHBondContact O-N 3.02Å; V228-R231 VanDerWaalsContact O-N 3.07Å; V229-R231 PolarHBondContact O-N 2.86Å; V229-R231 VanDerWaalsContact O-N 3.16Å; R231-T327 PolarHBondContact NE-OG1 3.25Å; R231-T327 VanDerWaalsContact NH2-CG2 3.25Å; R231-T327 PolarHBondContact NH2-OG1 3.22Å
232	Y	71.6	Confident	79.8	Confident	139 Å²	139	52.9 Å²	52.9	55%	0.545	27%	0.265	S	S	.	.	H	α-helix	trans	-87.4	-29.2	-166.1	-75	-75.8	0	0	0	114.1	V228 V229	V228-Y232 HydrophobicContact CG1-CD2 3.68Å; V228-Y232 HydrophobicContact CG1-CE2 3.68Å; V228-Y232 WeakPolarHBondContact O-CD2 3.26Å; V228-Y232 PolarHBondContact O-N 3.48Å; V229-Y232 PolarHBondContact O-N 3.09Å
233	I	73.3	Confident	79.5	Confident	89 Å²	89	54.2 Å²	54.2	46%	0.456	27%	0.274	S	S	.	.			trans	-140.7	43.6	-171.8	-25.2	179.3	0	0	0	111.5	V229 K235 V236 L237	V229-I233 PolarHBondContact O-N 3.01Å; V229-I233 VanDerWaalsContact O-N 3.12Å; I233-K235 PolarHBondContact O-N 2.92Å; I233-V236 HydrophobicContact CB-CB 4.23Å; I233-V236 HydrophobicContact CG2-CB 3.33Å; I233-V236 HydrophobicContact CG2-CG1 4.36Å; I233-V236 HydrophobicContact CG2-CG2 3.3Å; I233-V236 PolarHBondContact O-N 3.41Å; I233-L237 VanDerWaalsContact O-CB 3.26Å; I233-L237 WeakPolarHBondContact O-CB 3.32Å; I233-L237 PolarHBondContact O-N 3.02Å
234	S	69.8	Low	79.1	Confident	4 Å²	4	58.2 Å²	58.2	3%	0.028	30%	0.295	C	S	.	.	H	α-helix	trans	-51.2	-35.6	-177.9	-26.6	0	0	0	0	112.2	I230 V238	I230-S234 WeakPolarHBondContact O-CB 3.4Å; I230-S234 PolarHBondContact O-OG 3.19Å; S234-V238 WeakPolarHBondContact O-CB 3.36Å; S234-V238 WeakPolarHBondContact O-CG2 3.5Å; S234-V238 PolarHBondContact O-N 3.34Å
235	K	76	Confident	79	Confident	143 Å²	143	56.2 Å²	56.2	62%	0.622	29%	0.286	S	S	*	.	H	α-helix	trans	-64.5	-53.1	175.4	-173.4	176.6	-179.3	-179.6	0	113	I233 I239 I316	I233-K235 PolarHBondContact O-N 2.92Å; K235-I239 HydrophobicContact CG-CD1 4.31Å; K235-I239 WeakPolarHBondContact O-CD1 3.28Å; K235-I239 VanDerWaalsContact O-CG1 3.28Å; K235-I239 WeakPolarHBondContact O-CG1 3.35Å; K235-I239 PolarHBondContact O-N 3.32Å; K235-I316 HydrophobicContact CB-CD1 4.4Å; K235-I316 HydrophobicContact CB-CG2 3.92Å; K235-I316 HydrophobicContact CG-CD1 4.27Å
236	V	78.9	Confident	79	Confident	69 Å²	69	54.9 Å²	54.9	42%	0.418	28%	0.279	S	S	.	.	H	α-helix	trans	-70	-38.4	-179.5	178.7	0	0	0	0	110	I233 I239 I240	I233-V236 HydrophobicContact CB-CB 4.23Å; I233-V236 HydrophobicContact CG2-CB 3.33Å; I233-V236 HydrophobicContact CG2-CG1 4.36Å; I233-V236 HydrophobicContact CG2-CG2 3.3Å; I233-V236 PolarHBondContact O-N 3.41Å; V236-I239 CarbonylContact O-C 3.4Å; V236-I239 PolarHBondContact O-N 2.95Å; V236-I240 HydrophobicContact CG1-CD1 3.54Å; V236-I240 HydrophobicContact CG1-CG1 3.95Å; V236-I240 WeakPolarHBondContact O-CB 3.33Å; V236-I240 VanDerWaalsContact O-CG1 3.32Å; V236-I240 WeakPolarHBondContact O-CG1 3.39Å; V236-I240 PolarHBondContact O-N 3.23Å
237	L	76.5	Confident	79.1	Confident	13 Å²	13	59.6 Å²	59.6	7%	0.068	30%	0.303	C	S	.	.	H	α-helix	trans	-58.5	-50.6	176.7	176.9	67.2	0	0	0	111.4	M226 V229 I230 I233 I239 I240 L241	M226-L237 HydrophobicContact CE-CD1 3.98Å; M226-L237 HydrophobicContact CE-CD2 3.83Å; M226-L237 HydrophobicContact CE-CG 4.34Å; M226-L237 HydrophobicContact SD-CD1 4.17Å; V229-L237 HydrophobicContact CG1-CB 4.22Å; V229-L237 HydrophobicContact CG1-CD1 3.78Å; V229-L237 HydrophobicContact CG1-CD2 4.17Å; V229-L237 HydrophobicContact CG1-CG 4.26Å; I230-L237 HydrophobicContact CB-CD2 4.09Å; I230-L237 HydrophobicContact CG1-CD2 3.36Å; I233-L237 VanDerWaalsContact O-CB 3.26Å; I233-L237 WeakPolarHBondContact O-CB 3.32Å; I233-L237 PolarHBondContact O-N 3.02Å; L237-I239 VanDerWaalsContact C-N 3.25Å; L237-I239 PolarHBondContact O-N 2.89Å; L237-I240 PolarHBondContact O-N 3.28Å; L237-L241 HydrophobicContact CD1-CD1 3.89Å; L237-L241 HydrophobicContact CD1-CG 3.95Å; L237-L241 HydrophobicContact CD2-CD1 4.42Å; L237-L241 HydrophobicContact CG-CD1 3.79Å; L237-L241 HydrophobicContact CG-CG 4.26Å; L237-L241 WeakPolarHBondContact O-CB 3.48Å; L237-L241 VanDerWaalsContact O-CG 3.24Å; L237-L241 WeakPolarHBondContact O-CG 3.44Å; L237-L241 PolarHBondContact O-N 3.43Å
238	V	77.4	Confident	79.3	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.03	32%	0.324	C	S	.	.	H	α-helix	trans	-61	-39	178.7	173.5	0	0	0	0	110.5	S234 T242 V312 I316 V538	S234-V238 WeakPolarHBondContact O-CB 3.36Å; S234-V238 WeakPolarHBondContact O-CG2 3.5Å; S234-V238 PolarHBondContact O-N 3.34Å; V238-T242 WeakPolarHBondContact O-CB 3.25Å; V238-T242 PolarHBondContact O-N 3.2Å; V238-T242 PolarHBondContact O-OG1 2.97Å; V238-V312 HydrophobicContact CG1-CG1 3.53Å; V238-I316 HydrophobicContact CB-CD1 4.36Å; V238-I316 HydrophobicContact CB-CG1 4.2Å; V238-I316 HydrophobicContact CG2-CG1 3.99Å; V238-V538 HydrophobicContact CG1-CG2 4.42Å; V238-V538 HydrophobicContact CG2-CG1 3.98Å; V238-V538 HydrophobicContact CG2-CG2 4.23Å
239	I	81.5	Confident	79.7	Confident	88 Å²	88	58.8 Å²	58.8	45%	0.451	31%	0.308	S	S	.	.	H	α-helix	trans	-66	-48	175.9	-65.7	166.2	0	0	0	111.4	K235 V236 L237 T242 V243	K235-I239 HydrophobicContact CG-CD1 4.31Å; K235-I239 WeakPolarHBondContact O-CD1 3.28Å; K235-I239 VanDerWaalsContact O-CG1 3.28Å; K235-I239 WeakPolarHBondContact O-CG1 3.35Å; K235-I239 PolarHBondContact O-N 3.32Å; V236-I239 CarbonylContact O-C 3.4Å; V236-I239 PolarHBondContact O-N 2.95Å; L237-I239 VanDerWaalsContact C-N 3.25Å; L237-I239 PolarHBondContact O-N 2.89Å; I239-T242 WeakPolarHBondContact O-CB 3.3Å; I239-T242 PolarHBondContact O-N 3.37Å; I239-V243 HydrophobicContact CG2-CG2 4.28Å; I239-V243 WeakPolarHBondContact O-CB 3.06Å; I239-V243 VanDerWaalsContact O-CG2 3.27Å; I239-V243 WeakPolarHBondContact O-CG2 3.32Å; I239-V243 PolarHBondContact O-N 2.88Å
240	I	82.6	Confident	80.1	Confident	85 Å²	85	59.5 Å²	59.5	44%	0.436	31%	0.313	S	S	.	.	H	α-helix	trans	-61	-48.1	179	-72.5	176.4	0	0	0	110.1	V236 L237 T242 V243 L244	V236-I240 HydrophobicContact CG1-CD1 3.54Å; V236-I240 HydrophobicContact CG1-CG1 3.95Å; V236-I240 WeakPolarHBondContact O-CB 3.33Å; V236-I240 VanDerWaalsContact O-CG1 3.32Å; V236-I240 WeakPolarHBondContact O-CG1 3.39Å; V236-I240 PolarHBondContact O-N 3.23Å; L237-I240 PolarHBondContact O-N 3.28Å; I240-T242 VanDerWaalsContact C-N 3.33Å; I240-T242 PolarHBondContact O-N 3.5Å; I240-V243 PolarHBondContact O-N 2.9Å; I240-L244 HydrophobicContact CG2-CD1 3.61Å; I240-L244 HydrophobicContact CG2-CG 4.1Å; I240-L244 VanDerWaalsContact O-CB 3.3Å; I240-L244 WeakPolarHBondContact O-CB 3.35Å; I240-L244 VanDerWaalsContact O-CG 3.3Å; I240-L244 WeakPolarHBondContact O-CG 3.27Å; I240-L244 PolarHBondContact O-N 2.97Å
241	L	78.8	Confident	80.7	Confident	6 Å²	6	60.7 Å²	60.7	3%	0.031	33%	0.325	C	S	.	.	H	α-helix	trans	-59	-47.2	177	-71.4	171.9	0	0	0	110.8	M226 L237 V243 L244 V245 V538 L545	M226-L241 HydrophobicContact CE-CD1 4.05Å; L237-L241 HydrophobicContact CD1-CD1 3.89Å; L237-L241 HydrophobicContact CD1-CG 3.95Å; L237-L241 HydrophobicContact CD2-CD1 4.42Å; L237-L241 HydrophobicContact CG-CD1 3.79Å; L237-L241 HydrophobicContact CG-CG 4.26Å; L237-L241 WeakPolarHBondContact O-CB 3.48Å; L237-L241 VanDerWaalsContact O-CG 3.24Å; L237-L241 WeakPolarHBondContact O-CG 3.44Å; L237-L241 PolarHBondContact O-N 3.43Å; L241-V243 PolarHBondContact O-N 3.09Å; L241-L244 PolarHBondContact O-N 3.26Å; L241-V245 VanDerWaalsContact O-CB 3.28Å; L241-V245 WeakPolarHBondContact O-CB 3.36Å; L241-V245 WeakPolarHBondContact O-CG2 3.33Å; L241-V245 PolarHBondContact O-N 3.49Å; L241-V538 HydrophobicContact CD1-CG1 4.13Å; L241-L545 HydrophobicContact CD2-CB 4.12Å; L241-L545 HydrophobicContact CD2-CD2 3.64Å; L241-L545 HydrophobicContact CD2-CG 4.4Å
242	T	78.4	Confident	81.2	Confident	46 Å²	46	58.2 Å²	58.2	28%	0.282	33%	0.326	S	S	.	.	H	α-helix	trans	-56	-50.4	176.1	-66.5	0	0	0	0	110.8	V238 I239 I240 V245 I246 M305	V238-T242 WeakPolarHBondContact O-CB 3.25Å; V238-T242 PolarHBondContact O-N 3.2Å; V238-T242 PolarHBondContact O-OG1 2.97Å; I239-T242 WeakPolarHBondContact O-CB 3.3Å; I239-T242 PolarHBondContact O-N 3.37Å; I240-T242 VanDerWaalsContact C-N 3.33Å; I240-T242 PolarHBondContact O-N 3.5Å; T242-V245 PolarHBondContact O-N 3.04Å; T242-I246 HydrophobicContact CG2-CD1 4.12Å; T242-I246 VanDerWaalsContact O-CG1 3.25Å; T242-I246 WeakPolarHBondContact O-CG1 3.49Å; T242-I246 PolarHBondContact O-N 3.08Å; T242-M305 HydrophobicContact CG2-CE 3.03Å; T242-M305 WeakPolarHBondContact O-CE 3.24Å
243	V	84.5	Confident	82.1	Confident	67 Å²	67	52.4 Å²	52.4	41%	0.406	31%	0.305	S	S	.	.	H	α-helix	trans	-66.1	-47.5	-178.7	170.2	0	0	0	0	111.6	I239 I240 L241 V245 I246 I247	I239-V243 HydrophobicContact CG2-CG2 4.28Å; I239-V243 WeakPolarHBondContact O-CB 3.06Å; I239-V243 VanDerWaalsContact O-CG2 3.27Å; I239-V243 WeakPolarHBondContact O-CG2 3.32Å; I239-V243 PolarHBondContact O-N 2.88Å; I240-V243 PolarHBondContact O-N 2.9Å; L241-V243 PolarHBondContact O-N 3.09Å; V243-V245 VanDerWaalsContact C-N 3.27Å; V243-V245 PolarHBondContact O-N 3.47Å; V243-I246 PolarHBondContact O-N 3.38Å; V243-I247 HydrophobicContact CG1-CD1 3.58Å; V243-I247 HydrophobicContact CG1-CG1 4.29Å; V243-I247 VanDerWaalsContact O-CG1 3.32Å; V243-I247 WeakPolarHBondContact O-CG1 3.23Å; V243-I247 PolarHBondContact O-N 3.35Å
244	L	83.5	Confident	83	Confident	85 Å²	85	51.9 Å²	51.9	45%	0.445	31%	0.308	S	S	.	.	H	α-helix	trans	-59.3	-39.7	178.6	-76.9	175.2	0	0	0	111.8	I240 L241 G248 L545	I240-L244 HydrophobicContact CG2-CD1 3.61Å; I240-L244 HydrophobicContact CG2-CG 4.1Å; I240-L244 VanDerWaalsContact O-CB 3.3Å; I240-L244 WeakPolarHBondContact O-CB 3.35Å; I240-L244 VanDerWaalsContact O-CG 3.3Å; I240-L244 WeakPolarHBondContact O-CG 3.27Å; I240-L244 PolarHBondContact O-N 2.97Å; L241-L244 PolarHBondContact O-N 3.26Å; L244-G248 PolarHBondContact O-N 3.31Å; L244-L545 HydrophobicContact CD1-CD1 4.12Å
245	V	82.3	Confident	83.9	Confident	27 Å²	27	56.3 Å²	56.3	16%	0.164	33%	0.331	C	S	.	.	H	α-helix	trans	-70.4	-40.4	179.6	172.7	0	0	0	0	111	L241 T242 V243 S249 L301 M541	L241-V245 VanDerWaalsContact O-CB 3.28Å; L241-V245 WeakPolarHBondContact O-CB 3.36Å; L241-V245 WeakPolarHBondContact O-CG2 3.33Å; L241-V245 PolarHBondContact O-N 3.49Å; T242-V245 PolarHBondContact O-N 3.04Å; V243-V245 VanDerWaalsContact C-N 3.27Å; V243-V245 PolarHBondContact O-N 3.47Å; V245-S249 WeakPolarHBondContact O-CB 3.49Å; V245-S249 PolarHBondContact O-N 2.92Å; V245-L301 HydrophobicContact CG1-CD1 3.74Å; V245-L301 HydrophobicContact CG1-CD2 3.54Å; V245-L301 HydrophobicContact CG1-CG 4.25Å; V245-M541 HydrophobicContact CB-SD 4.13Å; V245-M541 HydrophobicContact CG1-SD 3.79Å; V245-M541 HydrophobicContact CG2-CG 4.2Å; V245-M541 HydrophobicContact CG2-SD 3.24Å; V245-M541 WeakPolarHBondContact CG2-SD 3.24Å
246	I	85.5	Confident	84.4	Confident	61 Å²	61	51.7 Å²	51.7	31%	0.313	31%	0.313	S	S	.	.	H	α-helix	trans	-61.7	-51.2	174.1	-68.1	166.2	0	0	0	109.9	T242 V243 S249 V250 L302 M305	T242-I246 HydrophobicContact CG2-CD1 4.12Å; T242-I246 VanDerWaalsContact O-CG1 3.25Å; T242-I246 WeakPolarHBondContact O-CG1 3.49Å; T242-I246 PolarHBondContact O-N 3.08Å; V243-I246 PolarHBondContact O-N 3.38Å; I246-S249 PolarHBondContact O-N 3.23Å; I246-V250 HydrophobicContact CG2-CG2 4.42Å; I246-V250 WeakPolarHBondContact O-CB 3.5Å; I246-V250 VanDerWaalsContact O-CG2 3.26Å; I246-V250 WeakPolarHBondContact O-CG2 3.2Å; I246-V250 PolarHBondContact O-N 3.06Å; I246-L302 HydrophobicContact CG1-CD2 3.87Å; I246-L302 HydrophobicContact CG2-CD2 4.24Å; I246-M305 HydrophobicContact CD1-CE 3.63Å; I246-M305 HydrophobicContact CD1-SD 4.26Å; I246-M305 HydrophobicContact CG1-CE 3.71Å; I246-M305 HydrophobicContact CG1-SD 3.82Å
247	I	89.1	Confident	85	Confident	111 Å²	111	53.8 Å²	53.8	57%	0.569	31%	0.313	S	S	*	.	H	α-helix	trans	-62.2	-47.3	-179.1	-67	171.9	0	0	0	110.7	V243 G251	V243-I247 HydrophobicContact CG1-CD1 3.58Å; V243-I247 HydrophobicContact CG1-CG1 4.29Å; V243-I247 VanDerWaalsContact O-CG1 3.32Å; V243-I247 WeakPolarHBondContact O-CG1 3.23Å; V243-I247 PolarHBondContact O-N 3.35Å; I247-G251 WeakPolarHBondContact O-CA 3.4Å; I247-G251 PolarHBondContact O-N 3.1Å
248	G	84.4	Confident	85.6	Confident	46 Å²	46	61.9 Å²	61.9	47%	0.474	34%	0.343	S	S	.	.	H	α-helix	trans	-65.4	-39.9	-179.4	0	0	0	0	0	112.9	L244 G252	L244-G248 PolarHBondContact O-N 3.31Å; G248-G252 WeakPolarHBondContact O-CA 3.34Å; G248-G252 PolarHBondContact O-N 3.25Å
249	S	87.5	Confident	86	Confident	16 Å²	16	65.8 Å²	65.8	11%	0.112	36%	0.363	C	S	.	.	H	α-helix	trans	-71.1	-45.6	179.1	-171.8	0	0	0	0	112	V245 I246 T253 T298	V245-S249 WeakPolarHBondContact O-CB 3.49Å; V245-S249 PolarHBondContact O-N 2.92Å; I246-S249 PolarHBondContact O-N 3.23Å; S249-T253 WeakPolarHBondContact O-CB 3.29Å; S249-T253 PolarHBondContact O-N 3.48Å; S249-T253 PolarHBondContact O-OG1 3.32Å; S249-T253 VanDerWaalsContact O-OG1 3.06Å; S249-T298 PolarHBondContact O-OG1 3.47Å; S249-T298 WeakPolarHBondContact OG-CA 3.11Å; S249-T298 WeakPolarHBondContact OG-CB 3.36Å; S249-T298 WeakPolarHBondContact OG-CG2 3.43Å; S249-T298 PolarHBondContact OG-OG1 3.42Å
250	V	90.4	Very high	86.1	Confident	63 Å²	63	63.2 Å²	63.2	38%	0.382	35%	0.348	S	S	.	.	H	α-helix	trans	-65.9	-48.1	175.7	174.6	0	0	0	0	110.2	I246 G252 T253 C254 T298	I246-V250 HydrophobicContact CG2-CG2 4.42Å; I246-V250 WeakPolarHBondContact O-CB 3.5Å; I246-V250 VanDerWaalsContact O-CG2 3.26Å; I246-V250 WeakPolarHBondContact O-CG2 3.2Å; I246-V250 PolarHBondContact O-N 3.06Å; V250-G252 PolarHBondContact O-N 2.91Å; V250-T253 PolarHBondContact O-N 3.43Å; V250-C254 WeakPolarHBondContact O-CB 3.22Å; V250-C254 PolarHBondContact O-N 3.35Å; V250-C254 PolarHBondContact O-SG 2.66Å; V250-T298 HydrophobicContact CG2-CG2 4.24Å
251	G	88.6	Confident	86.3	Confident	28 Å²	28	61.1 Å²	61.1	29%	0.289	34%	0.343	S	S	.	.	H	α-helix	trans	-60.8	-45.7	178.9	0	0	0	0	0	112.7	I247 C254 I255	I247-G251 WeakPolarHBondContact O-CA 3.4Å; I247-G251 PolarHBondContact O-N 3.1Å; G251-C254 PolarHBondContact O-N 2.86Å; G251-I255 VanDerWaalsContact O-CG1 3.28Å; G251-I255 WeakPolarHBondContact O-CG1 3.48Å; G251-I255 PolarHBondContact O-N 3.38Å
252	G	85.4	Confident	86.6	Confident	31 Å²	31	65.7 Å²	65.7	32%	0.32	37%	0.368	S	S	.	.	H	α-helix	trans	-61.3	-44.4	176.3	0	0	0	0	0	112.6	G248 V250 I255 L256	G248-G252 WeakPolarHBondContact O-CA 3.34Å; G248-G252 PolarHBondContact O-N 3.25Å; V250-G252 PolarHBondContact O-N 2.91Å; G252-I255 PolarHBondContact O-N 3.12Å; G252-L256 WeakPolarHBondContact O-CG 3.37Å; G252-L256 PolarHBondContact O-N 3.35Å
253	T	89.8	Confident	86.5	Confident	18 Å²	18	66.3 Å²	66.3	11%	0.11	37%	0.367	C	S	.	.	H	α-helix	trans	-63.5	-42.2	175.3	-65.7	0	0	0	0	111.5	S249 V250 L256 W257 T298	S249-T253 WeakPolarHBondContact O-CB 3.29Å; S249-T253 PolarHBondContact O-N 3.48Å; S249-T253 PolarHBondContact O-OG1 3.32Å; S249-T253 VanDerWaalsContact O-OG1 3.06Å; V250-T253 PolarHBondContact O-N 3.43Å; T253-L256 PolarHBondContact O-N 3.24Å; T253-W257 VanDerWaalsContact O-CD1 3.27Å; T253-W257 PolarHBondContact O-N 3.31Å; T253-T298 PolarHBondContact OG1-OG1 2.83Å
254	C	91.1	Very high	86.3	Confident	78 Å²	78	68.9 Å²	68.9	53%	0.527	37%	0.373	S	S	.	.	H	α-helix	trans	-61.8	-43.5	174.8	-70.7	0	0	0	0	112.4	V250 G251 W257 W258	V250-C254 WeakPolarHBondContact O-CB 3.22Å; V250-C254 PolarHBondContact O-N 3.35Å; V250-C254 PolarHBondContact O-SG 2.66Å; G251-C254 PolarHBondContact O-N 2.86Å; C254-W257 PolarHBondContact O-N 3.08Å; C254-W258 WeakPolarHBondContact O-CB 3.27Å; C254-W258 PolarHBondContact O-N 3.23Å
255	I	89.3	Confident	86.1	Confident	96 Å²	96	71.3 Å²	71.3	49%	0.492	38%	0.382	S	S	.	.	H	α-helix	trans	-63.7	-44.2	177.6	-69.4	165.6	0	0	0	110.7	G251 G252 W257 W258 L259	G251-I255 VanDerWaalsContact O-CG1 3.28Å; G251-I255 WeakPolarHBondContact O-CG1 3.48Å; G251-I255 PolarHBondContact O-N 3.38Å; G252-I255 PolarHBondContact O-N 3.12Å; I255-W257 PolarHBondContact O-N 3.4Å; I255-W258 PolarHBondContact O-N 3.03Å; I255-L259 HydrophobicContact CG2-CD1 3.97Å; I255-L259 HydrophobicContact CG2-CG 4.29Å; I255-L259 WeakPolarHBondContact O-CG 3.35Å; I255-L259 PolarHBondContact O-N 2.93Å
256	L	86.8	Confident	85.6	Confident	47 Å²	47	71.7 Å²	71.7	25%	0.246	39%	0.391	C	S	.	.	H	α-helix	trans	-62.1	-43.7	178.3	-74.3	170.9	0	0	0	112.1	G252 T253 W258 L259 Y260 S291 A294	G252-L256 WeakPolarHBondContact O-CG 3.37Å; G252-L256 PolarHBondContact O-N 3.35Å; T253-L256 PolarHBondContact O-N 3.24Å; L256-W258 VanDerWaalsContact C-N 3.33Å; L256-W258 PolarHBondContact O-N 3.43Å; L256-L259 PolarHBondContact O-N 2.94Å; L256-Y260 WeakPolarHBondContact O-CB 3.33Å; L256-Y260 PolarHBondContact O-N 3.1Å; L256-S291 PolarHBondContact O-OG 3.43Å; L256-A294 HydrophobicContact CD1-CB 3.62Å
257	W	91.1	Very high	84.8	Confident	112 Å²	112	71.7 Å²	71.7	42%	0.424	39%	0.391	S	S	.	.	H	α-helix	trans	-63.9	-38	174.1	-87.1	106	0	0	0	112.6	T253 C254 I255 Y260 A261 T295	T253-W257 VanDerWaalsContact O-CD1 3.27Å; T253-W257 PolarHBondContact O-N 3.31Å; C254-W257 PolarHBondContact O-N 3.08Å; I255-W257 PolarHBondContact O-N 3.4Å; W257-Y260 HydrophobicContact CE3-CD1 4.18Å; W257-Y260 HydrophobicContact CZ3-CD1 4.15Å; W257-Y260 HydrophobicContact CZ3-CE1 4.41Å; W257-Y260 PolarHBondContact O-N 3.1Å; W257-A261 WeakPolarHBondContact O-CB 3.4Å; W257-A261 PolarHBondContact O-N 3.18Å; W257-T295 PolarHBondContact NE1-OG1 2.86Å
258	W	90.5	Very high	83.8	Confident	184 Å²	184	70.8 Å²	70.8	70%	0.697	40%	0.395	S	S	*	.	H	α-helix	trans	-65.5	-46.9	175	-177.1	16.6	0	0	0	111.6	C254 I255 L256 Y260 A261 D262	C254-W258 WeakPolarHBondContact O-CB 3.27Å; C254-W258 PolarHBondContact O-N 3.23Å; I255-W258 PolarHBondContact O-N 3.03Å; L256-W258 VanDerWaalsContact C-N 3.33Å; L256-W258 PolarHBondContact O-N 3.43Å; W258-Y260 VanDerWaalsContact C-N 3.3Å; W258-Y260 PolarHBondContact O-N 2.85Å; W258-A261 PolarHBondContact O-N 2.9Å; W258-A261 VanDerWaalsContact O-N 3.12Å; W258-D262 WeakPolarHBondContact O-CB 3.3Å; W258-D262 PolarHBondContact O-N 3.32Å
259	L	84.2	Confident	83	Confident	86 Å²	86	77 Å²	77	45%	0.45	41%	0.409	S	S	.	.	H	α-helix	trans	-58.9	-41	175.8	-72.5	172	0	0	0	112	I255 L256 Q263	I255-L259 HydrophobicContact CG2-CD1 3.97Å; I255-L259 HydrophobicContact CG2-CG 4.29Å; I255-L259 WeakPolarHBondContact O-CG 3.35Å; I255-L259 PolarHBondContact O-N 2.93Å; L256-L259 PolarHBondContact O-N 2.94Å; L259-Q263 WeakPolarHBondContact O-CB 3.4Å; L259-Q263 PolarHBondContact O-N 2.8Å
260	Y	85.3	Confident	81.8	Confident	35 Å²	35	82.5 Å²	82.5	14%	0.137	44%	0.437	C	S	.	.	H	α-helix	trans	-62	-45.2	174.1	173.5	-102.9	0	0	0	112	L256 W257 W258 K264 L287 L288	L256-Y260 WeakPolarHBondContact O-CB 3.33Å; L256-Y260 PolarHBondContact O-N 3.1Å; W257-Y260 HydrophobicContact CE3-CD1 4.18Å; W257-Y260 HydrophobicContact CZ3-CD1 4.15Å; W257-Y260 HydrophobicContact CZ3-CE1 4.41Å; W257-Y260 PolarHBondContact O-N 3.1Å; W258-Y260 VanDerWaalsContact C-N 3.3Å; W258-Y260 PolarHBondContact O-N 2.85Å; Y260-K264 HydrophobicContact CE1-CD 4.16Å; Y260-K264 VanDerWaalsContact O-CB 3.28Å; Y260-K264 WeakPolarHBondContact O-CB 3.44Å; Y260-K264 PolarHBondContact O-N 3.31Å; Y260-K264 PolarHBondContact OH-NZ 3.36Å; Y260-L287 HydrophobicContact CD2-CB 4.29Å; Y260-L288 HydrophobicContact CD2-CB 4.23Å; Y260-L288 HydrophobicContact CD2-CD1 4.41Å; Y260-L288 HydrophobicContact CE1-CD1 3.98Å; Y260-L288 HydrophobicContact CE2-CB 3.89Å; Y260-L288 HydrophobicContact CE2-CD1 3.69Å; Y260-L288 HydrophobicContact CE2-CG 4.43Å; Y260-L288 VanDerWaalsContact CZ-CD1 3.45Å
261	A	86.5	Confident	80.1	Confident	40 Å²	40	84.4 Å²	84.4	33%	0.331	45%	0.453	S	S	.	.	H	α-helix	trans	-64.8	-44.3	178.5	0	0	0	0	0	112	W257 W258 K264 H265	W257-A261 WeakPolarHBondContact O-CB 3.4Å; W257-A261 PolarHBondContact O-N 3.18Å; W258-A261 PolarHBondContact O-N 2.9Å; W258-A261 VanDerWaalsContact O-N 3.12Å; A261-K264 PolarHBondContact O-N 3.36Å; A261-H265 PolarHBondContact O-CD2 3.23Å; A261-H265 PolarHBondContact O-N 2.96Å
262	D	83.6	Confident	78.6	Confident	103 Å²	103	89.6 Å²	89.6	55%	0.551	48%	0.479	S	S	*	.	H	α-helix	trans	-61.4	-48.5	178.7	-174.4	65.2	0	0	0	111.5	W258 K264 H265 G266	W258-D262 WeakPolarHBondContact O-CB 3.3Å; W258-D262 PolarHBondContact O-N 3.32Å; D262-K264 VanDerWaalsContact C-N 3.33Å; D262-K264 PolarHBondContact O-N 3.44Å; D262-H265 PolarHBondContact O-N 2.85Å; D262-G266 PolarHBondContact O-N 3.03Å
263	Q	77.7	Confident	77.3	Confident	58 Å²	58	90.7 Å²	90.7	27%	0.271	48%	0.482	S	S	.	.	H	α-helix	trans	-64.2	-37.8	178.2	-173	158.3	-23.7	0	0	112.2	L259 G266 L267 L287	L259-Q263 WeakPolarHBondContact O-CB 3.4Å; L259-Q263 PolarHBondContact O-N 2.8Å; Q263-G266 PolarHBondContact O-N 3.48Å; Q263-L267 HydrophobicContact CG-CD1 4.09Å; Q263-L267 WeakPolarHBondContact O-CD1 3.44Å; Q263-L267 PolarHBondContact O-N 3.23Å; Q263-L287 HydrophobicContact CB-CD1 4.48Å
264	K	79.2	Confident	75.9	Confident	122 Å²	122	95.8 Å²	95.8	53%	0.53	51%	0.513	S	S	.	.	H	α-helix	trans	-65.5	-39	174.9	-171.9	170.6	-172.6	169.9	0	112.3	Y260 A261 D262 S268	Y260-K264 HydrophobicContact CE1-CD 4.16Å; Y260-K264 VanDerWaalsContact O-CB 3.28Å; Y260-K264 WeakPolarHBondContact O-CB 3.44Å; Y260-K264 PolarHBondContact O-N 3.31Å; Y260-K264 PolarHBondContact OH-NZ 3.36Å; A261-K264 PolarHBondContact O-N 3.36Å; D262-K264 VanDerWaalsContact C-N 3.33Å; D262-K264 PolarHBondContact O-N 3.44Å; K264-S268 PolarHBondContact O-N 2.98Å
265	H	79.7	Confident	74	Confident	135 Å²	135	98 Å²	98	63%	0.625	52%	0.519	S	S	*	.	H	α-helix	trans	-67.2	-37.6	173	-83.1	-66.4	0	0	0	112.3	A261 D262 S268 K269	A261-H265 PolarHBondContact O-CD2 3.23Å; A261-H265 PolarHBondContact O-N 2.96Å; D262-H265 PolarHBondContact O-N 2.85Å; H265-S268 WeakPolarHBondContact O-CB 3.2Å; H265-S268 PolarHBondContact O-N 3.42Å; H265-K269 PolarHBondContact O-N 3.06Å
266	G	72.5	Confident	72.5	Confident	35 Å²	35	102.3 Å²	102.3	36%	0.361	53%	0.529	S	S	.	.	H	α-helix	trans	-64.5	-42.9	174.6	0	0	0	0	0	113.4	D262 Q263 S268 K269 N270	D262-G266 PolarHBondContact O-N 3.03Å; Q263-G266 PolarHBondContact O-N 3.48Å; G266-S268 VanDerWaalsContact C-N 3.26Å; G266-S268 PolarHBondContact O-N 3.32Å; G266-K269 PolarHBondContact O-N 3.11Å; G266-K269 VanDerWaalsContact O-N 3.11Å; G266-N270 PolarHBondContact O-N 3.22Å; G266-N270 VanDerWaalsContact O-N 3.13Å
267	L	69	Low	71.2	Confident	61 Å²	61	107.4 Å²	107.4	32%	0.319	55%	0.55	S	S	.	.	H	α-helix	trans	-60.4	-33.3	174	-101.7	128.1	0	0	0	112.8	Q263 K269 A280	Q263-L267 HydrophobicContact CG-CD1 4.09Å; Q263-L267 WeakPolarHBondContact O-CD1 3.44Å; Q263-L267 PolarHBondContact O-N 3.23Å; L267-K269 VanDerWaalsContact C-N 3.33Å; L267-A280 HydrophobicContact CD1-CB 3.97Å; L267-A280 HydrophobicContact CD2-CB 4.31Å; L267-A280 HydrophobicContact CG-CB 4.23Å
268	S	66.9	Low	69.7	Low	92 Å²	92	108.8 Å²	108.8	64%	0.643	56%	0.56	S	S	*	*	H	α-helix	trans	-70.8	-24.4	175.9	161.4	0	0	0	0	113.5	K264 H265 G266	K264-S268 PolarHBondContact O-N 2.98Å; H265-S268 WeakPolarHBondContact O-CB 3.2Å; H265-S268 PolarHBondContact O-N 3.42Å; G266-S268 VanDerWaalsContact C-N 3.26Å; G266-S268 PolarHBondContact O-N 3.32Å
269	K	68.9	Low	68.2	Low	176 Å²	176	103.8 Å²	103.8	77%	0.765	55%	0.55	S	S	*	*	H	α-helix	trans	-99.1	-34.4	-174.7	-81.1	-176.2	174.4	178.9	0	114.3	H265 G266 L267	H265-K269 PolarHBondContact O-N 3.06Å; G266-K269 PolarHBondContact O-N 3.11Å; G266-K269 VanDerWaalsContact O-N 3.11Å; L267-K269 VanDerWaalsContact C-N 3.33Å
270	N	61.8	Low	67	Low	133 Å²	133	100.7 Å²	100.7	71%	0.711	54%	0.537	S	S	*	.			trans	-108.2	56.5	-169.1	-77.3	-8.4	0	0	0	114.2	G266 T272	G266-N270 PolarHBondContact O-N 3.22Å; G266-N270 VanDerWaalsContact O-N 3.13Å; N270-T272 VanDerWaalsContact C-N 3.27Å; N270-T272 PolarHBondContact O-N 2.87Å
271	S	54.1	Low	65.9	Low	103 Å²	103	99.8 Å²	99.8	72%	0.72	54%	0.539	S	S	*	.			trans	-75.3	32.2	-172.4	-57	0	0	0	0	116.9
272	T	56.3	Low	64.8	Low	136 Å²	136	102.7 Å²	102.7	83%	0.834	55%	0.549	S	S	*	.			trans	-108.4	0.4	-166.1	48.3	0	0	0	0	117.6	N270	N270-T272 VanDerWaalsContact C-N 3.27Å; N270-T272 PolarHBondContact O-N 2.87Å
273	S	58.2	Low	64.1	Low	54 Å²	54	101.7 Å²	101.7	38%	0.378	54%	0.543	S	S	.	.			trans	-145.5	136.2	174.2	61.2	0	0	0	0	115.1	W276 K277	S273-W276 WeakPolarHBondContact OG-CB 3.21Å; S273-K277 PolarHBondContact O-N 3.4Å
274	V	60.9	Low	64	Low	125 Å²	125	101.1 Å²	101.1	76%	0.758	54%	0.542	S	S	*	.	H	α-helix	trans	-69.7	-39.3	-173.1	-177.7	0	0	0	0	112.2	K277 E278	V274-K277 WeakPolarHBondContact O-CB 3.3Å; V274-K277 PolarHBondContact O-N 3.16Å; V274-E278 PolarHBondContact O-N 3.11Å
275	L	52.4	Low	63.9	Low	126 Å²	126	101.4 Å²	101.4	66%	0.66	54%	0.543	S	S	*	.	H	α-helix	trans	-63.5	-43	178	-174.9	79.6	0	0	0	112.6	K277 E278 V279	L275-K277 VanDerWaalsContact C-N 3.29Å; L275-K277 PolarHBondContact O-N 2.7Å; L275-E278 PolarHBondContact O-N 2.66Å; L275-V279 PolarHBondContact O-N 2.83Å
276	W	56.8	Low	63.7	Low	186 Å²	186	96.6 Å²	96.6	71%	0.705	53%	0.527	S	S	*	.	H	α-helix	trans	-69.6	-28.4	178	-75.9	91.9	0	0	0	112.3	S273 A280	S273-W276 WeakPolarHBondContact OG-CB 3.21Å; W276-A280 WeakPolarHBondContact O-CB 3.49Å; W276-A280 PolarHBondContact O-N 2.72Å
277	K	59.9	Low	64.1	Low	154 Å²	154	96.3 Å²	96.3	67%	0.67	52%	0.517	S	S	*	.	H	α-helix	trans	-69.2	-34.1	176.9	-166.1	175.7	-177.2	176.7	0	112.5	S273 V274 L275 G281	S273-K277 PolarHBondContact O-N 3.4Å; V274-K277 WeakPolarHBondContact O-CB 3.3Å; V274-K277 PolarHBondContact O-N 3.16Å; L275-K277 VanDerWaalsContact C-N 3.29Å; L275-K277 PolarHBondContact O-N 2.7Å; K277-G281 PolarHBondContact O-N 3.28Å
278	E	60.4	Low	64.8	Low	140 Å²	140	96.4 Å²	96.4	65%	0.654	52%	0.517	S	S	*	.	H	α-helix	trans	-74.9	-47.9	178.5	-146.9	167.5	-163.4	0	0	111	V274 L275 G281 D282	V274-E278 PolarHBondContact O-N 3.11Å; L275-E278 PolarHBondContact O-N 2.66Å; E278-G281 PolarHBondContact O-N 3.36Å; E278-D282 PolarHBondContact O-N 2.94Å
279	V	57.6	Low	65.7	Low	80 Å²	80	96.4 Å²	96.4	49%	0.485	51%	0.513	S	S	.	.	H	α-helix	trans	-65.8	-39.9	176	178.2	0	0	0	0	112.1	L275 G281 N283	L275-V279 PolarHBondContact O-N 2.83Å; V279-G281 VanDerWaalsContact C-N 3.32Å; V279-N283 PolarHBondContact O-N 3.41Å
280	A	58.9	Low	66.3	Low	21 Å²	21	95.1 Å²	95.1	17%	0.174	51%	0.505	C	S	.	.	H	α-helix	trans	-72.8	-25.5	176.9	0	0	0	0	0	113.1	L267 W276 D284	L267-A280 HydrophobicContact CD1-CB 3.97Å; L267-A280 HydrophobicContact CD2-CB 4.31Å; L267-A280 HydrophobicContact CG-CB 4.23Å; W276-A280 WeakPolarHBondContact O-CB 3.49Å; W276-A280 PolarHBondContact O-N 2.72Å; A280-D284 WeakPolarHBondContact O-CB 3.17Å; A280-D284 PolarHBondContact O-N 3.15Å; A280-D284 VanDerWaalsContact O-N 3.07Å
281	G	61.9	Low	67.5	Low	16 Å²	16	88.8 Å²	88.8	17%	0.165	47%	0.471	C	S	.	.	H	α-helix	trans	-84.9	-6.1	178.2	0	0	0	0	0	115.6	K277 E278 V279 D284 K285	K277-G281 PolarHBondContact O-N 3.28Å; E278-G281 PolarHBondContact O-N 3.36Å; V279-G281 VanDerWaalsContact C-N 3.32Å; G281-D284 WeakPolarHBondContact CA-OD1 3.38Å; G281-K285 WeakPolarHBondContact O-CD 3.35Å; G281-K285 WeakPolarHBondContact O-CE 3.34Å
282	D	64.1	Low	69.2	Low	101 Å²	101	87.6 Å²	87.6	54%	0.54	46%	0.456	S	S	.	.	H	α-helix	trans	-98	-34.3	163.9	-79	-18.2	0	0	0	111.1	E278 A286	E278-D282 PolarHBondContact O-N 2.94Å; D282-A286 WeakPolarHBondContact O-CB 3.48Å; D282-A286 PolarHBondContact O-N 3.16Å
283	N	68.9	Low	70.6	Confident	82 Å²	82	83 Å²	83	44%	0.439	44%	0.435	S	S	.	.	H	α-helix	trans	-68.1	-34.6	176	-75.5	-7.9	0	0	0	112.6	V279 A286 L287	V279-N283 PolarHBondContact O-N 3.41Å; N283-A286 PolarHBondContact O-N 3.49Å; N283-L287 WeakPolarHBondContact O-CB 3.29Å; N283-L287 VanDerWaalsContact O-CG 3.27Å; N283-L287 WeakPolarHBondContact O-CG 3.42Å; N283-L287 PolarHBondContact O-N 3.5Å
284	D	75.9	Confident	71.9	Confident	46 Å²	46	81.4 Å²	81.4	25%	0.246	43%	0.425	C	S	.	.	H	α-helix	trans	-66.8	-43.1	176.1	72.2	-35.9	0	0	0	111.8	A280 G281 L287 L288	A280-D284 WeakPolarHBondContact O-CB 3.17Å; A280-D284 PolarHBondContact O-N 3.15Å; A280-D284 VanDerWaalsContact O-N 3.07Å; G281-D284 WeakPolarHBondContact CA-OD1 3.38Å; D284-L287 PolarHBondContact O-N 3.42Å; D284-L288 VanDerWaalsContact O-CB 3.32Å; D284-L288 WeakPolarHBondContact O-CB 3.31Å; D284-L288 PolarHBondContact O-N 2.91Å
285	K	76.8	Confident	73.4	Confident	127 Å²	127	77.7 Å²	77.7	55%	0.552	40%	0.402	S	S	*	.	H	α-helix	trans	-63.1	-43.7	173.8	-69.3	176.4	-168.4	160	0	110.6	G281 L288 V289	G281-K285 WeakPolarHBondContact O-CD 3.35Å; G281-K285 WeakPolarHBondContact O-CE 3.34Å; K285-L288 PolarHBondContact O-N 3.24Å; K285-V289 WeakPolarHBondContact O-CB 3.49Å; K285-V289 VanDerWaalsContact O-CG2 3.25Å; K285-V289 WeakPolarHBondContact O-CG2 3.29Å; K285-V289 PolarHBondContact O-N 3.32Å
286	A	74.9	Confident	75.2	Confident	34 Å²	34	76.8 Å²	76.8	28%	0.281	40%	0.397	S	S	.	.	H	α-helix	trans	-62.6	-47.4	176.4	0	0	0	0	0	111.6	D282 N283 L288 V289 Y290	D282-A286 WeakPolarHBondContact O-CB 3.48Å; D282-A286 PolarHBondContact O-N 3.16Å; N283-A286 PolarHBondContact O-N 3.49Å; A286-L288 VanDerWaalsContact C-N 3.35Å; A286-L288 PolarHBondContact O-N 3.21Å; A286-V289 PolarHBondContact O-N 3.21Å; A286-Y290 HydrophobicContact CB-CE2 4.1Å; A286-Y290 WeakPolarHBondContact O-CB 3.43Å; A286-Y290 WeakPolarHBondContact O-CD2 3.4Å; A286-Y290 VanDerWaalsContact O-CG 3.24Å; A286-Y290 PolarHBondContact O-N 2.72Å
287	L	81	Confident	76.6	Confident	30 Å²	30	73.7 Å²	73.7	16%	0.157	39%	0.389	C	S	.	.	H	α-helix	trans	-63.3	-38.2	177	-76	172	0	0	0	112.6	Y260 Q263 N283 D284 Y290 S291	Y260-L287 HydrophobicContact CD2-CB 4.29Å; Q263-L287 HydrophobicContact CB-CD1 4.48Å; N283-L287 WeakPolarHBondContact O-CB 3.29Å; N283-L287 VanDerWaalsContact O-CG 3.27Å; N283-L287 WeakPolarHBondContact O-CG 3.42Å; N283-L287 PolarHBondContact O-N 3.5Å; D284-L287 PolarHBondContact O-N 3.42Å; L287-Y290 PolarHBondContact O-N 3.32Å; L287-S291 VanDerWaalsContact O-CB 3.28Å; L287-S291 WeakPolarHBondContact O-CB 3.1Å; L287-S291 PolarHBondContact O-N 3.45Å; L287-S291 PolarHBondContact O-OG 3.31Å
288	L	84.5	Confident	78	Confident	62 Å²	62	67 Å²	67	33%	0.325	36%	0.361	S	S	.	.	H	α-helix	trans	-61.4	-49.1	173.1	-173.8	92.9	0	0	0	110.7	Y260 D284 K285 A286 Y290 S291 I292	Y260-L288 HydrophobicContact CD2-CB 4.23Å; Y260-L288 HydrophobicContact CD2-CD1 4.41Å; Y260-L288 HydrophobicContact CE1-CD1 3.98Å; Y260-L288 HydrophobicContact CE2-CB 3.89Å; Y260-L288 HydrophobicContact CE2-CD1 3.69Å; Y260-L288 HydrophobicContact CE2-CG 4.43Å; Y260-L288 VanDerWaalsContact CZ-CD1 3.45Å; D284-L288 VanDerWaalsContact O-CB 3.32Å; D284-L288 WeakPolarHBondContact O-CB 3.31Å; D284-L288 PolarHBondContact O-N 2.91Å; K285-L288 PolarHBondContact O-N 3.24Å; A286-L288 VanDerWaalsContact C-N 3.35Å; A286-L288 PolarHBondContact O-N 3.21Å; L288-Y290 PolarHBondContact O-N 2.76Å; L288-S291 PolarHBondContact O-N 3.29Å; L288-I292 HydrophobicContact CD2-CD1 4.2Å; L288-I292 HydrophobicContact CG-CD1 3.96Å; L288-I292 WeakPolarHBondContact O-CG1 3.47Å; L288-I292 PolarHBondContact O-N 2.81Å
289	V	86.1	Confident	79.4	Confident	93 Å²	93	64 Å²	64	56%	0.564	35%	0.352	S	S	*	.	H	α-helix	trans	-61.1	-44.1	178.4	170.2	0	0	0	0	110.9	K285 A286 G293	K285-V289 WeakPolarHBondContact O-CB 3.49Å; K285-V289 VanDerWaalsContact O-CG2 3.25Å; K285-V289 WeakPolarHBondContact O-CG2 3.29Å; K285-V289 PolarHBondContact O-N 3.32Å; A286-V289 PolarHBondContact O-N 3.21Å; V289-G293 PolarHBondContact O-N 3.47Å
290	Y	81.7	Confident	80.8	Confident	149 Å²	149	63.7 Å²	63.7	58%	0.584	35%	0.35	S	S	*	.	H	α-helix	trans	-64.8	-39.8	176.5	-64.8	-37.6	0	0	0	112.6	A286 L287 L288 G293 A294	A286-Y290 HydrophobicContact CB-CE2 4.1Å; A286-Y290 WeakPolarHBondContact O-CB 3.43Å; A286-Y290 WeakPolarHBondContact O-CD2 3.4Å; A286-Y290 VanDerWaalsContact O-CG 3.24Å; A286-Y290 PolarHBondContact O-N 2.72Å; L287-Y290 PolarHBondContact O-N 3.32Å; L288-Y290 PolarHBondContact O-N 2.76Å; Y290-G293 PolarHBondContact O-N 2.92Å; Y290-A294 VanDerWaalsContact O-CB 3.25Å; Y290-A294 WeakPolarHBondContact O-CB 3.34Å; Y290-A294 PolarHBondContact O-N 3.35Å
291	S	86.6	Confident	82	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-67.8	-42.9	179.1	-58	0	0	0	0	112.1	L256 L287 L288 T295	L256-S291 PolarHBondContact O-OG 3.43Å; L287-S291 VanDerWaalsContact O-CB 3.28Å; L287-S291 WeakPolarHBondContact O-CB 3.1Å; L287-S291 PolarHBondContact O-N 3.45Å; L287-S291 PolarHBondContact O-OG 3.31Å; L288-S291 PolarHBondContact O-N 3.29Å; S291-T295 WeakPolarHBondContact O-CB 3.48Å; S291-T295 PolarHBondContact O-N 3.44Å; S291-T295 PolarHBondContact O-OG1 3.46Å
292	I	90.1	Very high	83.1	Confident	78 Å²	78	65.5 Å²	65.5	40%	0.4	35%	0.353	S	S	.	.	H	α-helix	trans	-63.9	-46.2	174.3	-66.5	169	0	0	0	110	L288 A294 T295 I296	L288-I292 HydrophobicContact CD2-CD1 4.2Å; L288-I292 HydrophobicContact CG-CD1 3.96Å; L288-I292 WeakPolarHBondContact O-CG1 3.47Å; L288-I292 PolarHBondContact O-N 2.81Å; I292-A294 PolarHBondContact O-N 2.89Å; I292-T295 PolarHBondContact O-N 3.45Å; I292-I296 HydrophobicContact CG2-CD1 3.98Å; I292-I296 WeakPolarHBondContact O-CG1 3.27Å; I292-I296 PolarHBondContact O-N 2.79Å
293	G	85.5	Confident	84.2	Confident	38 Å²	38	65.2 Å²	65.2	39%	0.392	35%	0.351	S	S	.	.	H	α-helix	trans	-59.6	-45.2	177.5	0	0	0	0	0	112.9	V289 Y290 T295 I296 F297	V289-G293 PolarHBondContact O-N 3.47Å; Y290-G293 PolarHBondContact O-N 2.92Å; G293-T295 VanDerWaalsContact C-N 3.35Å; G293-T295 PolarHBondContact O-N 3.08Å; G293-I296 PolarHBondContact O-N 2.78Å; G293-F297 WeakPolarHBondContact O-CB 3.06Å; G293-F297 PolarHBondContact O-N 2.85Å
294	A	85.9	Confident	84.7	Confident	21 Å²	21	65.1 Å²	65.1	17%	0.174	35%	0.35	C	S	.	.	H	α-helix	trans	-61.5	-42.4	175.4	0	0	0	0	0	111.5	L256 Y290 I292 F297 T298	L256-A294 HydrophobicContact CD1-CB 3.62Å; Y290-A294 VanDerWaalsContact O-CB 3.25Å; Y290-A294 WeakPolarHBondContact O-CB 3.34Å; Y290-A294 PolarHBondContact O-N 3.35Å; I292-A294 PolarHBondContact O-N 2.89Å; A294-F297 PolarHBondContact O-N 3.38Å; A294-T298 WeakPolarHBondContact O-CB 3.06Å; A294-T298 PolarHBondContact O-N 3.04Å; A294-T298 PolarHBondContact O-OG1 3.11Å
295	T	91	Very high	85	Confident	47 Å²	47	64 Å²	64	29%	0.288	34%	0.343	S	S	.	.	H	α-helix	trans	-61.9	-46.9	177.6	-52	0	0	0	0	111.8	W257 S291 I292 G293 F297 T298 V299	W257-T295 PolarHBondContact NE1-OG1 2.86Å; S291-T295 WeakPolarHBondContact O-CB 3.48Å; S291-T295 PolarHBondContact O-N 3.44Å; S291-T295 PolarHBondContact O-OG1 3.46Å; I292-T295 PolarHBondContact O-N 3.45Å; G293-T295 VanDerWaalsContact C-N 3.35Å; G293-T295 PolarHBondContact O-N 3.08Å; T295-F297 VanDerWaalsContact C-N 3.33Å; T295-F297 PolarHBondContact O-N 2.8Å; T295-T298 PolarHBondContact O-N 2.89Å; T295-V299 WeakPolarHBondContact O-CG2 3.23Å; T295-V299 PolarHBondContact O-N 2.94Å
296	I	90.9	Very high	85.3	Confident	107 Å²	107	64.6 Å²	64.6	55%	0.549	35%	0.346	S	S	.	.	H	α-helix	trans	-60.1	-46.2	176.4	-66.6	168.3	0	0	0	110.2	I292 G293 V299 V300	I292-I296 HydrophobicContact CG2-CD1 3.98Å; I292-I296 WeakPolarHBondContact O-CG1 3.27Å; I292-I296 PolarHBondContact O-N 2.79Å; G293-I296 PolarHBondContact O-N 2.78Å; I296-V299 PolarHBondContact O-N 3.3Å; I296-V300 HydrophobicContact CG2-CG2 4.39Å; I296-V300 VanDerWaalsContact O-CG2 3.32Å; I296-V300 WeakPolarHBondContact O-CG2 3.29Å; I296-V300 PolarHBondContact O-N 3.34Å
297	F	86.1	Confident	85.5	Confident	122 Å²	122	69.8 Å²	69.8	54%	0.535	36%	0.363	S	S	.	.	H	α-helix	trans	-60.4	-46.3	177.7	178	-98.2	0	0	0	112.1	G293 A294 T295 V299 V300 L301	G293-F297 WeakPolarHBondContact O-CB 3.06Å; G293-F297 PolarHBondContact O-N 2.85Å; A294-F297 PolarHBondContact O-N 3.38Å; T295-F297 VanDerWaalsContact C-N 3.33Å; T295-F297 PolarHBondContact O-N 2.8Å; F297-V299 PolarHBondContact O-N 3.23Å; F297-V300 PolarHBondContact O-N 2.79Å; F297-L301 HydrophobicContact CE1-CD1 3.78Å; F297-L301 HydrophobicContact CZ-CD1 3.78Å; F297-L301 VanDerWaalsContact O-CB 3.23Å; F297-L301 WeakPolarHBondContact O-CB 3.3Å; F297-L301 PolarHBondContact O-N 3.5Å
298	T	88.6	Confident	85.2	Confident	12 Å²	12	69.1 Å²	69.1	7%	0.074	36%	0.359	C	S	.	.	H	α-helix	trans	-59.3	-45.7	176.4	-58.3	0	0	0	0	111.3	S249 V250 T253 A294 T295 L301 L302	S249-T298 PolarHBondContact O-OG1 3.47Å; S249-T298 WeakPolarHBondContact OG-CA 3.11Å; S249-T298 WeakPolarHBondContact OG-CB 3.36Å; S249-T298 WeakPolarHBondContact OG-CG2 3.43Å; S249-T298 PolarHBondContact OG-OG1 3.42Å; V250-T298 HydrophobicContact CG2-CG2 4.24Å; T253-T298 PolarHBondContact OG1-OG1 2.83Å; A294-T298 WeakPolarHBondContact O-CB 3.06Å; A294-T298 PolarHBondContact O-N 3.04Å; A294-T298 PolarHBondContact O-OG1 3.11Å; T295-T298 PolarHBondContact O-N 2.89Å; T298-L301 PolarHBondContact O-N 2.94Å; T298-L302 HydrophobicContact CG2-CD1 4Å; T298-L302 HydrophobicContact CG2-CG 4.37Å; T298-L302 WeakPolarHBondContact O-CB 3.32Å; T298-L302 VanDerWaalsContact O-CG 3.28Å; T298-L302 WeakPolarHBondContact O-CG 3.38Å; T298-L302 PolarHBondContact O-N 3.44Å
299	V	91.1	Very high	84.9	Confident	78 Å²	78	75.3 Å²	75.3	47%	0.473	38%	0.378	S	S	.	.	H	α-helix	trans	-62.9	-47.9	178.9	171.5	0	0	0	0	111.3	T295 I296 F297 L301 L302 L303	T295-V299 WeakPolarHBondContact O-CG2 3.23Å; T295-V299 PolarHBondContact O-N 2.94Å; I296-V299 PolarHBondContact O-N 3.3Å; F297-V299 PolarHBondContact O-N 3.23Å; V299-L301 VanDerWaalsContact C-N 3.31Å; V299-L301 PolarHBondContact O-N 2.88Å; V299-L302 PolarHBondContact O-N 2.98Å; V299-L303 HydrophobicContact CG1-CD1 4.03Å; V299-L303 HydrophobicContact CG1-CG 4.48Å; V299-L303 WeakPolarHBondContact O-CB 3.44Å; V299-L303 WeakPolarHBondContact O-CG 3.45Å; V299-L303 PolarHBondContact O-N 3.41Å
300	V	86.6	Confident	84.4	Confident	74 Å²	74	78.9 Å²	78.9	45%	0.448	39%	0.386	S	S	.	.	H	α-helix	trans	-59.6	-44.6	177.5	170.3	0	0	0	0	110.7	I296 F297 L303 L304	I296-V300 HydrophobicContact CG2-CG2 4.39Å; I296-V300 VanDerWaalsContact O-CG2 3.32Å; I296-V300 WeakPolarHBondContact O-CG2 3.29Å; I296-V300 PolarHBondContact O-N 3.34Å; F297-V300 PolarHBondContact O-N 2.79Å; V300-L303 PolarHBondContact O-N 2.7Å; V300-L304 HydrophobicContact CG1-CD1 4.07Å; V300-L304 HydrophobicContact CG1-CG 4.47Å; V300-L304 VanDerWaalsContact O-CG 3.32Å; V300-L304 WeakPolarHBondContact O-CG 3.42Å; V300-L304 PolarHBondContact O-N 2.86Å
301	L	83.6	Confident	84.1	Confident	9 Å²	9	74.4 Å²	74.4	5%	0.047	37%	0.37	C	S	.	.	H	α-helix	trans	-63.3	-44.9	179.8	-171.5	148.9	0	0	0	111.6	V245 F297 T298 V299 L303 L304 M305	V245-L301 HydrophobicContact CG1-CD1 3.74Å; V245-L301 HydrophobicContact CG1-CD2 3.54Å; V245-L301 HydrophobicContact CG1-CG 4.25Å; F297-L301 HydrophobicContact CE1-CD1 3.78Å; F297-L301 HydrophobicContact CZ-CD1 3.78Å; F297-L301 VanDerWaalsContact O-CB 3.23Å; F297-L301 WeakPolarHBondContact O-CB 3.3Å; F297-L301 PolarHBondContact O-N 3.5Å; T298-L301 PolarHBondContact O-N 2.94Å; V299-L301 VanDerWaalsContact C-N 3.31Å; V299-L301 PolarHBondContact O-N 2.88Å; L301-L303 PolarHBondContact O-N 2.87Å; L301-L304 PolarHBondContact O-N 3.35Å; L301-M305 HydrophobicContact CD2-CG 4.18Å; L301-M305 HydrophobicContact CD2-SD 3.35Å; L301-M305 WeakPolarHBondContact CD2-SD 3.49Å; L301-M305 HydrophobicContact CG-SD 4.47Å; L301-M305 VanDerWaalsContact O-CG 3.27Å; L301-M305 WeakPolarHBondContact O-CG 3.3Å; L301-M305 PolarHBondContact O-N 3.35Å
302	L	86.2	Confident	83.6	Confident	65 Å²	65	76.1 Å²	76.1	34%	0.34	38%	0.381	S	S	.	.	H	α-helix	trans	-64.2	-39.9	177.3	-70.6	175.7	0	0	0	112.3	I246 T298 V299 M305 F306	I246-L302 HydrophobicContact CG1-CD2 3.87Å; I246-L302 HydrophobicContact CG2-CD2 4.24Å; T298-L302 HydrophobicContact CG2-CD1 4Å; T298-L302 HydrophobicContact CG2-CG 4.37Å; T298-L302 WeakPolarHBondContact O-CB 3.32Å; T298-L302 VanDerWaalsContact O-CG 3.28Å; T298-L302 WeakPolarHBondContact O-CG 3.38Å; T298-L302 PolarHBondContact O-N 3.44Å; V299-L302 PolarHBondContact O-N 2.98Å; L302-M305 PolarHBondContact O-N 3.49Å; L302-F306 PolarHBondContact O-N 3.41Å
303	L	85.6	Confident	83	Confident	95 Å²	95	75.2 Å²	75.2	50%	0.497	38%	0.381	S	S	.	.	H	α-helix	trans	-61.8	-47.7	174.4	-73.7	172.8	0	0	0	111.3	V299 V300 L301 M305 F306 F307	V299-L303 HydrophobicContact CG1-CD1 4.03Å; V299-L303 HydrophobicContact CG1-CG 4.48Å; V299-L303 WeakPolarHBondContact O-CB 3.44Å; V299-L303 WeakPolarHBondContact O-CG 3.45Å; V299-L303 PolarHBondContact O-N 3.41Å; V300-L303 PolarHBondContact O-N 2.7Å; L301-L303 PolarHBondContact O-N 2.87Å; L303-M305 VanDerWaalsContact C-N 3.33Å; L303-M305 PolarHBondContact O-N 2.95Å; L303-F306 PolarHBondContact O-N 3.11Å; L303-F307 WeakPolarHBondContact O-CD2 3.28Å; L303-F307 PolarHBondContact O-N 2.95Å; L303-F307 VanDerWaalsContact O-N 3.1Å
304	L	81.2	Confident	82.5	Confident	80 Å²	80	74 Å²	74	42%	0.419	37%	0.366	S	S	.	.	H	α-helix	trans	-55.5	-49.5	175	-72.4	171.5	0	0	0	110.4	V300 L301 F306 F307 L308	V300-L304 HydrophobicContact CG1-CD1 4.07Å; V300-L304 HydrophobicContact CG1-CG 4.47Å; V300-L304 VanDerWaalsContact O-CG 3.32Å; V300-L304 WeakPolarHBondContact O-CG 3.42Å; V300-L304 PolarHBondContact O-N 2.86Å; L301-L304 PolarHBondContact O-N 3.35Å; L304-F306 VanDerWaalsContact C-N 3.32Å; L304-F306 PolarHBondContact O-N 3.02Å; L304-F307 PolarHBondContact O-N 3.21Å; L304-L308 HydrophobicContact CB-CD1 4.39Å; L304-L308 WeakPolarHBondContact O-CB 3.45Å; L304-L308 WeakPolarHBondContact O-CG 3.43Å; L304-L308 PolarHBondContact O-N 3.32Å
305	M	80.2	Confident	82	Confident	23 Å²	23	73.1 Å²	73.1	11%	0.113	36%	0.359	C	S	.	.	H	α-helix	trans	-60.4	-38.6	179.2	-68.4	178.4	75.8	0	0	113.3	T242 I246 L301 L302 L303 L308 R309 F537	T242-M305 HydrophobicContact CG2-CE 3.03Å; T242-M305 WeakPolarHBondContact O-CE 3.24Å; I246-M305 HydrophobicContact CD1-CE 3.63Å; I246-M305 HydrophobicContact CD1-SD 4.26Å; I246-M305 HydrophobicContact CG1-CE 3.71Å; I246-M305 HydrophobicContact CG1-SD 3.82Å; L301-M305 HydrophobicContact CD2-CG 4.18Å; L301-M305 HydrophobicContact CD2-SD 3.35Å; L301-M305 WeakPolarHBondContact CD2-SD 3.49Å; L301-M305 HydrophobicContact CG-SD 4.47Å; L301-M305 VanDerWaalsContact O-CG 3.27Å; L301-M305 WeakPolarHBondContact O-CG 3.3Å; L301-M305 PolarHBondContact O-N 3.35Å; L302-M305 PolarHBondContact O-N 3.49Å; L303-M305 VanDerWaalsContact C-N 3.33Å; L303-M305 PolarHBondContact O-N 2.95Å; M305-L308 PolarHBondContact O-N 3.35Å; M305-R309 PolarHBondContact O-N 3.09Å; M305-F537 HydrophobicContact CG-CE1 4.24Å; M305-F537 HydrophobicContact CG-CZ 4.13Å
306	F	83.4	Confident	81.5	Confident	140 Å²	140	72.2 Å²	72.2	61%	0.614	35%	0.351	S	S	*	.	H	α-helix	trans	-62.4	-44.9	176.5	-179.1	-98.1	0	0	0	112.2	L302 L303 L304 R309	L302-F306 PolarHBondContact O-N 3.41Å; L303-F306 PolarHBondContact O-N 3.11Å; L304-F306 VanDerWaalsContact C-N 3.32Å; L304-F306 PolarHBondContact O-N 3.02Å; F306-R309 WeakPolarHBondContact O-CB 3.49Å
307	F	79.9	Confident	80.9	Confident	143 Å²	143	67.4 Å²	67.4	63%	0.627	33%	0.328	S	S	*	.	H	α-helix	trans	-68.2	-42	176.9	-74.3	-66.5	0	0	0	112.2	L303 L304 R309	L303-F307 WeakPolarHBondContact O-CD2 3.28Å; L303-F307 PolarHBondContact O-N 2.95Å; L303-F307 VanDerWaalsContact O-N 3.1Å; L304-F307 PolarHBondContact O-N 3.21Å; F307-R309 VanDerWaalsContact C-N 3.26Å; F307-R309 PolarHBondContact O-N 3.32Å
308	L	74.4	Confident	80.6	Confident	16 Å²	16	62 Å²	62	8%	0.084	30%	0.304	C	S	.	.	H	α-helix	trans	-69.8	-23.3	-177.7	-63	172	0	0	0	112.1	L304 M305 K310 H311 V312 T533 V534 F537	L304-L308 HydrophobicContact CB-CD1 4.39Å; L304-L308 WeakPolarHBondContact O-CB 3.45Å; L304-L308 WeakPolarHBondContact O-CG 3.43Å; L304-L308 PolarHBondContact O-N 3.32Å; M305-L308 PolarHBondContact O-N 3.35Å; L308-K310 PolarHBondContact O-N 3.29Å; L308-H311 PolarHBondContact O-N 2.97Å; L308-V312 WeakPolarHBondContact O-CG2 3.26Å; L308-V312 PolarHBondContact O-N 3.48Å; L308-T533 HydrophobicContact CD2-CG2 4.36Å; L308-V534 HydrophobicContact CB-CG2 4.03Å; L308-V534 HydrophobicContact CD2-CB 4.26Å; L308-V534 HydrophobicContact CD2-CG2 3.29Å; L308-V534 HydrophobicContact CG-CG2 4.12Å; L308-F537 HydrophobicContact CD1-CB 4.39Å; L308-F537 HydrophobicContact CD1-CD1 4.19Å; L308-F537 HydrophobicContact CD1-CG 4.22Å
309	R	78.8	Confident	80.3	Confident	192 Å²	192	61.6 Å²	61.6	73%	0.725	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.5	-39.8	-179.2	-175.5	179.1	176.7	-178.7	0.7	113.9	M305 F306 F307 H311	M305-R309 PolarHBondContact O-N 3.09Å; F306-R309 WeakPolarHBondContact O-CB 3.49Å; F307-R309 VanDerWaalsContact C-N 3.26Å; F307-R309 PolarHBondContact O-N 3.32Å; R309-H311 PolarHBondContact O-N 3.04Å
310	K	74.3	Confident	79.9	Confident	168 Å²	168	60.8 Å²	60.8	73%	0.73	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-22.9	-177.6	-66.6	-174.8	-179.7	-179.8	0	113.3	L308	L308-K310 PolarHBondContact O-N 3.29Å
311	H	75.8	Confident	79.8	Confident	54 Å²	54	57.8 Å²	57.8	25%	0.25	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-9.6	-175.8	-65.8	-90.4	0	0	0	113.3	L308 R309 S313 L314 T315 V530 V534	L308-H311 PolarHBondContact O-N 2.97Å; R309-H311 PolarHBondContact O-N 3.04Å; H311-S313 VanDerWaalsContact C-N 3.27Å; H311-S313 PolarHBondContact O-N 2.83Å; H311-L314 PolarHBondContact O-N 3.34Å; H311-T315 PolarHBondContact O-N 3.42Å; H311-T315 VanDerWaalsContact O-N 3.15Å; H311-T315 PolarHBondContact O-OG1 2.84Å; H311-V530 HydrophobicContact CB-CG1 3.92Å; H311-V530 WeakPolarHBondContact CD2-CG1 3.37Å; H311-V534 HydrophobicContact CB-CG2 3.86Å
312	V	76.9	Confident	79.9	Confident	37 Å²	37	57.4 Å²	57.4	22%	0.224	27%	0.272	C	S	.	.	H	α-helix	trans	-52.3	-43	177.7	174	0	0	0	0	112.2	V238 L308 L314 T315 I316	V238-V312 HydrophobicContact CG1-CG1 3.53Å; L308-V312 WeakPolarHBondContact O-CG2 3.26Å; L308-V312 PolarHBondContact O-N 3.48Å; V312-L314 VanDerWaalsContact C-N 3.28Å; V312-L314 PolarHBondContact O-N 2.92Å; V312-T315 PolarHBondContact O-N 3.45Å; V312-I316 HydrophobicContact CG1-CD1 3.53Å; V312-I316 HydrophobicContact CG1-CG1 4.19Å; V312-I316 WeakPolarHBondContact O-CB 3.34Å; V312-I316 WeakPolarHBondContact O-CD1 3.23Å; V312-I316 VanDerWaalsContact O-CG1 3.22Å; V312-I316 WeakPolarHBondContact O-CG1 3.37Å; V312-I316 PolarHBondContact O-N 3.21Å
313	S	76.5	Confident	79.9	Confident	58 Å²	58	54.4 Å²	54.4	41%	0.406	26%	0.257	S	S	.	.	H	α-helix	trans	-59.8	-38.8	179.8	-164.9	0	0	0	0	112.6	H311 S317 H624	H311-S313 VanDerWaalsContact C-N 3.27Å; H311-S313 PolarHBondContact O-N 2.83Å; S313-S317 PolarHBondContact O-N 3.07Å; S313-S317 PolarHBondContact O-OG 3.35Å; S313-H624 PolarHBondContact OG-CD2 2.77Å
314	L	74.7	Confident	79.8	Confident	14 Å²	14	53.3 Å²	53.3	7%	0.073	25%	0.248	C	C	.	.	H	α-helix	trans	-72.8	-42.4	-179.6	-177.1	63.1	0	0	0	111.1	H311 V312 I316 S317 L318 I531 L621 H624 I625	H311-L314 PolarHBondContact O-N 3.34Å; V312-L314 VanDerWaalsContact C-N 3.28Å; V312-L314 PolarHBondContact O-N 2.92Å; L314-I316 VanDerWaalsContact C-N 3.31Å; L314-I316 PolarHBondContact O-N 3.1Å; L314-S317 PolarHBondContact O-N 2.97Å; L314-L318 PolarHBondContact O-N 3.37Å; L314-I531 HydrophobicContact CD2-CD1 3.4Å; L314-I531 HydrophobicContact CD2-CG1 3.77Å; L314-I531 HydrophobicContact CG-CD1 4.42Å; L314-L621 HydrophobicContact CD1-CD1 3.95Å; L314-H624 HydrophobicContact CD1-CB 4.45Å; L314-I625 HydrophobicContact CD1-CG1 3.65Å
315	T	77.3	Confident	80.1	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.012	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-36.9	175	-55.6	0	0	0	0	111.9	H311 V312 L318 F319 V534	H311-T315 PolarHBondContact O-N 3.42Å; H311-T315 VanDerWaalsContact O-N 3.15Å; H311-T315 PolarHBondContact O-OG1 2.84Å; V312-T315 PolarHBondContact O-N 3.45Å; T315-L318 PolarHBondContact O-N 2.89Å; T315-F319 HydrophobicContact CG2-CD1 4.49Å; T315-F319 HydrophobicContact CG2-CD2 3.97Å; T315-F319 HydrophobicContact CG2-CE1 4.2Å; T315-F319 HydrophobicContact CG2-CE2 3.55Å; T315-F319 HydrophobicContact CG2-CG 4.46Å; T315-F319 HydrophobicContact CG2-CZ 3.74Å; T315-F319 WeakPolarHBondContact O-CG 3.42Å; T315-F319 PolarHBondContact O-N 2.85Å; T315-V534 HydrophobicContact CG2-CG1 4.02Å; T315-V534 WeakPolarHBondContact OG1-CB 3.35Å; T315-V534 VanDerWaalsContact OG1-CG1 3.26Å; T315-V534 WeakPolarHBondContact OG1-CG1 3.32Å
316	I	79.8	Confident	80.5	Confident	27 Å²	27	48.9 Å²	48.9	14%	0.138	23%	0.225	C	C	.	.	H	α-helix	trans	-59.8	-48.7	173.9	-73.5	162.5	0	0	0	110.6	K235 V238 V312 L314 L318 F319 H320	K235-I316 HydrophobicContact CB-CD1 4.4Å; K235-I316 HydrophobicContact CB-CG2 3.92Å; K235-I316 HydrophobicContact CG-CD1 4.27Å; V238-I316 HydrophobicContact CB-CD1 4.36Å; V238-I316 HydrophobicContact CB-CG1 4.2Å; V238-I316 HydrophobicContact CG2-CG1 3.99Å; V312-I316 HydrophobicContact CG1-CD1 3.53Å; V312-I316 HydrophobicContact CG1-CG1 4.19Å; V312-I316 WeakPolarHBondContact O-CB 3.34Å; V312-I316 WeakPolarHBondContact O-CD1 3.23Å; V312-I316 VanDerWaalsContact O-CG1 3.22Å; V312-I316 WeakPolarHBondContact O-CG1 3.37Å; V312-I316 PolarHBondContact O-N 3.21Å; L314-I316 VanDerWaalsContact C-N 3.31Å; L314-I316 PolarHBondContact O-N 3.1Å; I316-L318 VanDerWaalsContact C-N 3.31Å; I316-L318 PolarHBondContact O-N 2.88Å; I316-F319 PolarHBondContact O-N 2.67Å; I316-H320 WeakPolarHBondContact O-CB 3.5Å; I316-H320 PolarHBondContact O-N 3.32Å
317	S	78.4	Confident	80.5	Confident	7 Å²	7	45.2 Å²	45.2	5%	0.049	21%	0.214	C	C	.	.	H	α-helix	trans	-62.5	-39.9	178.2	-58	0	0	0	0	111.6	S313 L314 H320 V321 L621	S313-S317 PolarHBondContact O-N 3.07Å; S313-S317 PolarHBondContact O-OG 3.35Å; L314-S317 PolarHBondContact O-N 2.97Å; S317-H320 PolarHBondContact O-N 3.24Å; S317-V321 WeakPolarHBondContact O-CG2 3.4Å; S317-V321 PolarHBondContact O-N 3.48Å; S317-L621 VanDerWaalsContact CB-CD1 3.46Å
318	L	78.6	Confident	80.8	Confident	8 Å²	8	41.1 Å²	41.1	4%	0.042	20%	0.203	C	C	.	.	H	α-helix	trans	-61.2	-47.9	176.3	-174.6	55.7	0	0	0	111.6	L314 T315 I316 H320 V321 T322 I531 V593 L596 Y600	L314-L318 PolarHBondContact O-N 3.37Å; T315-L318 PolarHBondContact O-N 2.89Å; I316-L318 VanDerWaalsContact C-N 3.31Å; I316-L318 PolarHBondContact O-N 2.88Å; L318-H320 PolarHBondContact O-N 3.5Å; L318-V321 PolarHBondContact O-N 2.82Å; L318-T322 PolarHBondContact O-N 3.43Å; L318-T322 PolarHBondContact O-OG1 2.9Å; L318-I531 HydrophobicContact CD2-CG2 3.97Å; L318-V593 HydrophobicContact CD2-CG1 3.52Å; L318-V593 HydrophobicContact CG-CG1 3.91Å; L318-L596 HydrophobicContact CD1-CB 4.25Å; L318-Y600 HydrophobicContact CD1-CD2 4.05Å; L318-Y600 HydrophobicContact CD1-CE2 3.46Å; L318-Y600 VanDerWaalsContact CD1-CE2 3.46Å
319	F	83.3	Confident	81.5	Confident	3 Å²	3	40.8 Å²	40.8	1%	0.013	20%	0.201	C	C	.	.	H	α-helix	trans	-65.5	-36	177.2	-69.8	-16.2	0	0	0	113.6	I230 T315 I316 T322 G323 V538 L539 F589 V593	I230-F319 HydrophobicContact CG2-CB 4.26Å; T315-F319 HydrophobicContact CG2-CD1 4.49Å; T315-F319 HydrophobicContact CG2-CD2 3.97Å; T315-F319 HydrophobicContact CG2-CE1 4.2Å; T315-F319 HydrophobicContact CG2-CE2 3.55Å; T315-F319 HydrophobicContact CG2-CG 4.46Å; T315-F319 HydrophobicContact CG2-CZ 3.74Å; T315-F319 WeakPolarHBondContact O-CG 3.42Å; T315-F319 PolarHBondContact O-N 2.85Å; I316-F319 PolarHBondContact O-N 2.67Å; F319-T322 PolarHBondContact O-N 3.32Å; F319-G323 PolarHBondContact O-N 3.08Å; F319-V538 HydrophobicContact CD2-CG1 4.44Å; F319-V538 HydrophobicContact CE2-CB 3.73Å; F319-V538 HydrophobicContact CE2-CG1 3.6Å; F319-V538 HydrophobicContact CE2-CG2 4.25Å; F319-V538 HydrophobicContact CZ-CB 4.2Å; F319-V538 HydrophobicContact CZ-CG1 4.4Å; F319-L539 HydrophobicContact CZ-CD2 4.35Å; F319-L539 HydrophobicContact CZ-CG 4.11Å; F319-F589 HydrophobicContact CB-CE1 4.23Å; F319-F589 HydrophobicContact CB-CZ 4.29Å; F319-F589 HydrophobicContact CD1-CD1 4.28Å; F319-F589 AromaticContact CD1-CE1 3.41Å; F319-F589 HydrophobicContact CD1-CE1 3.41Å; F319-F589 VanDerWaalsContact CD1-CE1 3.41Å; F319-F589 HydrophobicContact CD1-CZ 4.27Å; F319-F589 HydrophobicContact CE1-CD1 4.24Å; F319-F589 AromaticContact CE1-CE1 3.81Å; F319-F589 HydrophobicContact CE1-CE1 3.81Å; F319-F589 AromaticContact CG-CE1 3.94Å; F319-F589 HydrophobicContact CG-CE1 3.94Å; F319-F589 HydrophobicContact CG-CZ 4.48Å; F319-V593 HydrophobicContact CD1-CG2 3.79Å; F319-V593 HydrophobicContact CE1-CG1 4.36Å; F319-V593 HydrophobicContact CE1-CG2 3.77Å
320	H	83.2	Confident	81.9	Confident	61 Å²	61	35.4 Å²	35.4	28%	0.282	19%	0.192	S	C	.	.	H	α-helix	trans	-61.6	-45.8	173.4	178	-114.3	0	0	0	111.1	I316 S317 L318 G323 K324	I316-H320 WeakPolarHBondContact O-CB 3.5Å; I316-H320 PolarHBondContact O-N 3.32Å; S317-H320 PolarHBondContact O-N 3.24Å; L318-H320 PolarHBondContact O-N 3.5Å; H320-G323 PolarHBondContact O-N 2.94Å; H320-G323 VanDerWaalsContact O-N 3.16Å; H320-K324 PolarHBondContact O-N 3.24Å
321	V	83.4	Confident	82.6	Confident	12 Å²	12	30.3 Å²	30.3	7%	0.073	17%	0.172	C	C	.	.	H	α-helix	trans	-66.4	-41.3	176.2	-178.5	0	0	0	0	111.5	S317 L318 G323 K324 V325 Y600 L621	S317-V321 WeakPolarHBondContact O-CG2 3.4Å; S317-V321 PolarHBondContact O-N 3.48Å; L318-V321 PolarHBondContact O-N 2.82Å; V321-G323 PolarHBondContact O-N 3.48Å; V321-K324 WeakPolarHBondContact O-CA 3.45Å; V321-K324 WeakPolarHBondContact O-CB 3.28Å; V321-K324 PolarHBondContact O-N 3.03Å; V321-V325 PolarHBondContact O-N 2.93Å; V321-Y600 WeakPolarHBondContact CB-OH 3.46Å; V321-Y600 WeakPolarHBondContact CG1-OH 3.45Å; V321-L621 HydrophobicContact CG2-CD2 4.41Å
322	T	86.6	Confident	83.2	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-54.2	-41.3	171.5	-58.4	0	0	0	0	111.4	L318 F319 K324 V325 F326 F589 V592 V593 L596	L318-T322 PolarHBondContact O-N 3.43Å; L318-T322 PolarHBondContact O-OG1 2.9Å; F319-T322 PolarHBondContact O-N 3.32Å; T322-K324 VanDerWaalsContact C-N 3.33Å; T322-K324 PolarHBondContact O-N 3.15Å; T322-V325 WeakPolarHBondContact O-CB 3.33Å; T322-V325 PolarHBondContact O-N 2.99Å; T322-V325 VanDerWaalsContact O-N 3.15Å; T322-F326 HydrophobicContact CG2-CD2 3.82Å; T322-F326 HydrophobicContact CG2-CE2 3.57Å; T322-F326 VanDerWaalsContact O-CD2 3.28Å; T322-F326 WeakPolarHBondContact O-CD2 3.49Å; T322-F326 PolarHBondContact O-N 3.09Å; T322-F326 VanDerWaalsContact O-N 3.09Å; T322-F589 VanDerWaalsContact CB-CZ 3.46Å; T322-F589 HydrophobicContact CG2-CD1 4.05Å; T322-F589 HydrophobicContact CG2-CD2 3.86Å; T322-F589 HydrophobicContact CG2-CE1 3.59Å; T322-F589 HydrophobicContact CG2-CE2 3.39Å; T322-F589 HydrophobicContact CG2-CG 4.17Å; T322-F589 HydrophobicContact CG2-CZ 3.23Å; T322-V592 HydrophobicContact CG2-CB 4.08Å; T322-V592 HydrophobicContact CG2-CG1 3.72Å; T322-V593 HydrophobicContact CG2-CG2 4.02Å; T322-V593 VanDerWaalsContact OG1-CG2 3.31Å; T322-V593 WeakPolarHBondContact OG1-CG2 3.34Å; T322-L596 VanDerWaalsContact OG1-CD1 3.28Å; T322-L596 WeakPolarHBondContact OG1-CD1 3.33Å
323	G	85.3	Confident	83.5	Confident	2 Å²	2	29.1 Å²	29.1	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-59.1	-38.2	173.8	0	0	0	0	0	113.9	F319 H320 V321 F326 T327	F319-G323 PolarHBondContact O-N 3.08Å; H320-G323 PolarHBondContact O-N 2.94Å; H320-G323 VanDerWaalsContact O-N 3.16Å; V321-G323 PolarHBondContact O-N 3.48Å; G323-F326 PolarHBondContact O-N 3.47Å; G323-T327 PolarHBondContact O-N 3.32Å; G323-T327 VanDerWaalsContact O-N 3.15Å; G323-T327 PolarHBondContact O-OG1 2.83Å
324	K	84.3	Confident	84	Confident	72 Å²	72	30.3 Å²	30.3	31%	0.313	17%	0.165	S	C	.	.	H	α-helix	trans	-65.9	-39.4	173.2	-65.9	-174.9	-177.4	176.4	0	112.1	H320 V321 T322 F326 T327 S328 D618	H320-K324 PolarHBondContact O-N 3.24Å; V321-K324 WeakPolarHBondContact O-CA 3.45Å; V321-K324 WeakPolarHBondContact O-CB 3.28Å; V321-K324 PolarHBondContact O-N 3.03Å; T322-K324 VanDerWaalsContact C-N 3.33Å; T322-K324 PolarHBondContact O-N 3.15Å; K324-F326 PolarHBondContact O-N 3.44Å; K324-T327 WeakPolarHBondContact O-CB 3.44Å; K324-T327 PolarHBondContact O-N 2.93Å; K324-S328 PolarHBondContact O-N 3.33Å; K324-S328 PolarHBondContact O-OG 3.17Å; K324-D618 IonicContact NZ-OD1 3.82Å; K324-D618 IonicContact NZ-OD2 2.73Å; K324-D618 PolarHBondContact NZ-OD2 3.11Å
325	V	88.2	Confident	84.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.1	-49.9	175.2	-179.2	0	0	0	0	110.3	V321 T322 T327 S328 L329 L332 V410 Y413 V592 L596	V321-V325 PolarHBondContact O-N 2.93Å; T322-V325 WeakPolarHBondContact O-CB 3.33Å; T322-V325 PolarHBondContact O-N 2.99Å; T322-V325 VanDerWaalsContact O-N 3.15Å; V325-T327 VanDerWaalsContact C-N 3.26Å; V325-T327 PolarHBondContact O-N 3.43Å; V325-S328 PolarHBondContact O-N 3.18Å; V325-S328 VanDerWaalsContact O-N 3.15Å; V325-L329 HydrophobicContact CG1-CD1 3.91Å; V325-L329 HydrophobicContact CG1-CG 4.47Å; V325-L329 WeakPolarHBondContact O-CB 3.47Å; V325-L329 PolarHBondContact O-N 2.99Å; V325-L332 HydrophobicContact CG1-CD1 4.02Å; V325-V410 HydrophobicContact CG1-CG1 4.48Å; V325-V410 HydrophobicContact CG1-CG2 4.13Å; V325-Y413 HydrophobicContact CB-CD1 4.37Å; V325-Y413 HydrophobicContact CB-CE1 4.3Å; V325-Y413 HydrophobicContact CG1-CD1 4.28Å; V325-Y413 HydrophobicContact CG2-CD1 3.7Å; V325-Y413 HydrophobicContact CG2-CE1 3.55Å; V325-V592 HydrophobicContact CB-CG1 4.45Å; V325-V592 HydrophobicContact CG1-CG1 4.2Å; V325-L596 HydrophobicContact CG2-CD1 3.94Å; V325-L596 HydrophobicContact CG2-CD2 4Å; V325-L596 HydrophobicContact CG2-CG 4.41Å
326	F	86.9	Confident	84.9	Confident	10 Å²	10	31.1 Å²	31.1	4%	0.044	17%	0.169	C	C	.	.	H	α-helix	trans	-63.9	-29.8	179.5	-81.6	-69.4	0	0	0	113.8	T322 G323 K324 L329 P330 L332 F333 L588 F589 V592	T322-F326 HydrophobicContact CG2-CD2 3.82Å; T322-F326 HydrophobicContact CG2-CE2 3.57Å; T322-F326 VanDerWaalsContact O-CD2 3.28Å; T322-F326 WeakPolarHBondContact O-CD2 3.49Å; T322-F326 PolarHBondContact O-N 3.09Å; T322-F326 VanDerWaalsContact O-N 3.09Å; G323-F326 PolarHBondContact O-N 3.47Å; K324-F326 PolarHBondContact O-N 3.44Å; F326-L329 CarbonylContact O-C 3.17Å; F326-P330 WeakPolarHBondContact O-CA 3.5Å; F326-L332 HydrophobicContact CD1-CB 3.92Å; F326-L332 HydrophobicContact CD1-CD1 4.24Å; F326-L332 HydrophobicContact CE1-CB 3.72Å; F326-L332 HydrophobicContact CE1-CD1 4.22Å; F326-F333 HydrophobicContact CB-CE2 3.82Å; F326-F333 HydrophobicContact CB-CZ 3.59Å; F326-F333 AromaticContact CD1-CD1 3.98Å; F326-F333 HydrophobicContact CD1-CD1 3.98Å; F326-F333 HydrophobicContact CD1-CD2 4.19Å; F326-F333 AromaticContact CD1-CE1 3.37Å; F326-F333 HydrophobicContact CD1-CE1 3.37Å; F326-F333 AromaticContact CD1-CE2 3.67Å; F326-F333 HydrophobicContact CD1-CE2 3.67Å; F326-F333 HydrophobicContact CD1-CG 4.34Å; F326-F333 AromaticContact CD1-CZ 3.23Å; F326-F333 HydrophobicContact CD1-CZ 3.23Å; F326-F333 HydrophobicContact CD2-CZ 4.33Å; F326-F333 AromaticContact CE1-CD1 3.99Å; F326-F333 HydrophobicContact CE1-CD1 3.99Å; F326-F333 AromaticContact CE1-CE1 3.57Å; F326-F333 HydrophobicContact CE1-CE1 3.57Å; F326-F333 AromaticContact CE1-CZ 3.95Å; F326-F333 HydrophobicContact CE1-CZ 3.95Å; F326-F333 AromaticContact CG-CE1 3.93Å; F326-F333 HydrophobicContact CG-CE1 3.93Å; F326-F333 HydrophobicContact CG-CE2 4.05Å; F326-F333 AromaticContact CG-CZ 3.47Å; F326-F333 HydrophobicContact CG-CZ 3.47Å; F326-F333 VanDerWaalsContact CG-CZ 3.47Å; F326-F333 HydrophobicContact CZ-CE1 4.27Å; F326-L588 HydrophobicContact CE1-CD2 3.84Å; F326-L588 HydrophobicContact CE1-CG 4.17Å; F326-L588 HydrophobicContact CZ-CD2 4.2Å; F326-L588 HydrophobicContact CZ-CG 4.08Å; F326-F589 AromaticContact CD2-CD2 3.92Å; F326-F589 HydrophobicContact CD2-CD2 3.92Å; F326-F589 AromaticContact CD2-CE2 3.91Å; F326-F589 HydrophobicContact CD2-CE2 3.91Å; F326-F589 AromaticContact CE2-CD2 3.38Å; F326-F589 HydrophobicContact CE2-CD2 3.38Å; F326-F589 AromaticContact CE2-CE2 3.79Å; F326-F589 HydrophobicContact CE2-CE2 3.79Å; F326-F589 HydrophobicContact CE2-CG 4.15Å; F326-F589 HydrophobicContact CZ-CD2 4.23Å; F326-V592 HydrophobicContact CE1-CG2 4.35Å; F326-V592 HydrophobicContact CE2-CB 4.19Å; F326-V592 HydrophobicContact CE2-CG1 4.36Å; F326-V592 HydrophobicContact CE2-CG2 4.04Å; F326-V592 HydrophobicContact CZ-CB 4.25Å; F326-V592 HydrophobicContact CZ-CG2 3.62Å
327	T	83.8	Confident	85.1	Confident	64 Å²	64	35.5 Å²	35.5	39%	0.393	19%	0.187	S	C	.	.	H	α-helix	trans	-69.3	-41.2	174.6	-54	0	0	0	0	111.2	R231 G323 K324 V325	R231-T327 PolarHBondContact NE-OG1 3.25Å; R231-T327 VanDerWaalsContact NH2-CG2 3.25Å; R231-T327 PolarHBondContact NH2-OG1 3.22Å; G323-T327 PolarHBondContact O-N 3.32Å; G323-T327 VanDerWaalsContact O-N 3.15Å; G323-T327 PolarHBondContact O-OG1 2.83Å; K324-T327 WeakPolarHBondContact O-CB 3.44Å; K324-T327 PolarHBondContact O-N 2.93Å; V325-T327 VanDerWaalsContact C-N 3.26Å; V325-T327 PolarHBondContact O-N 3.43Å
328	S	86.7	Confident	85.6	Confident	57 Å²	57	42.3 Å²	42.3	40%	0.399	21%	0.212	S	C	.	.	H	α-helix	trans	-78.8	-26.8	-179	-50	0	0	0	0	111.9	K324 V325 P330 Y413	K324-S328 PolarHBondContact O-N 3.33Å; K324-S328 PolarHBondContact O-OG 3.17Å; V325-S328 PolarHBondContact O-N 3.18Å; V325-S328 VanDerWaalsContact O-N 3.15Å; S328-P330 VanDerWaalsContact C-CD 3.44Å; S328-P330 WeakPolarHBondContact O-CD 3.12Å; S328-Y413 VanDerWaalsContact OG-CE2 3.29Å; S328-Y413 WeakPolarHBondContact OG-CE2 3.23Å
329	L	89.1	Confident	86.1	Confident	8 Å²	8	42.6 Å²	42.6	4%	0.042	21%	0.214	C	C	.	.			trans	-123.9	64.7	-177.9	-57	-177.5	0	0	0	111.4	V325 F326 L331 L332 A409 Y413 T426 V427	V325-L329 HydrophobicContact CG1-CD1 3.91Å; V325-L329 HydrophobicContact CG1-CG 4.47Å; V325-L329 WeakPolarHBondContact O-CB 3.47Å; V325-L329 PolarHBondContact O-N 2.99Å; F326-L329 CarbonylContact O-C 3.17Å; L329-L331 PolarHBondContact O-N 3.36Å; L329-L331 VanDerWaalsContact O-N 3.13Å; L329-L332 HydrophobicContact CB-CD1 3.7Å; L329-L332 HydrophobicContact CB-CG 3.9Å; L329-L332 HydrophobicContact CD1-CD1 3.95Å; L329-L332 HydrophobicContact CG-CD1 4.5Å; L329-L332 WeakPolarHBondContact O-CB 3.32Å; L329-L332 WeakPolarHBondContact O-CG 3.33Å; L329-L332 PolarHBondContact O-N 3.4Å; L329-A409 HydrophobicContact CD1-CB 4.27Å; L329-Y413 HydrophobicContact CD1-CG 4.41Å; L329-Y413 HydrophobicContact CG-CD2 4.49Å; L329-T426 HydrophobicContact CD2-CG2 3.81Å; L329-V427 HydrophobicContact CB-CG2 4.37Å
330	P	86.2	Confident	86.3	Confident	80 Å²	80	48.9 Å²	48.9	52%	0.519	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-62	-26	-175	24.6	-34.6	0	0	0	113.4	F326 S328 L332 F333	F326-P330 WeakPolarHBondContact O-CA 3.5Å; S328-P330 VanDerWaalsContact C-CD 3.44Å; S328-P330 WeakPolarHBondContact O-CD 3.12Å; P330-L332 PolarHBondContact O-N 3.4Å; P330-L332 VanDerWaalsContact O-N 3.14Å; P330-F333 PolarHBondContact O-N 3.45Å
331	L	89.1	Confident	86.5	Confident	60 Å²	60	48.8 Å²	48.8	31%	0.314	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-64	-14.5	176.6	-66.7	-179.1	0	0	0	114	L329 F333 L334 F425 V427 V428	L329-L331 PolarHBondContact O-N 3.36Å; L329-L331 VanDerWaalsContact O-N 3.13Å; L331-F333 PolarHBondContact O-N 3.42Å; L331-L334 HydrophobicContact CD2-CD1 3.99Å; L331-L334 PolarHBondContact O-N 2.83Å; L331-F425 HydrophobicContact CD1-CD1 3.88Å; L331-V427 HydrophobicContact CB-CB 4.02Å; L331-V427 HydrophobicContact CB-CG1 4.42Å; L331-V427 HydrophobicContact CB-CG2 3.98Å; L331-V428 HydrophobicContact CD1-CG2 4.22Å
332	L	89.1	Confident	86.9	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-61.3	-33	173.3	-71	175.4	0	0	0	111.7	V325 F326 L329 P330 L334 H335 I406 A409 V410 V427 L588 V592	V325-L332 HydrophobicContact CG1-CD1 4.02Å; F326-L332 HydrophobicContact CD1-CB 3.92Å; F326-L332 HydrophobicContact CD1-CD1 4.24Å; F326-L332 HydrophobicContact CE1-CB 3.72Å; F326-L332 HydrophobicContact CE1-CD1 4.22Å; L329-L332 HydrophobicContact CB-CD1 3.7Å; L329-L332 HydrophobicContact CB-CG 3.9Å; L329-L332 HydrophobicContact CD1-CD1 3.95Å; L329-L332 HydrophobicContact CG-CD1 4.5Å; L329-L332 WeakPolarHBondContact O-CB 3.32Å; L329-L332 WeakPolarHBondContact O-CG 3.33Å; L329-L332 PolarHBondContact O-N 3.4Å; P330-L332 PolarHBondContact O-N 3.4Å; P330-L332 VanDerWaalsContact O-N 3.14Å; L332-L334 PolarHBondContact O-N 3.38Å; L332-H335 WeakPolarHBondContact O-CB 3.32Å; L332-H335 PolarHBondContact O-N 3.04Å; L332-H335 VanDerWaalsContact O-N 3.15Å; L332-I406 HydrophobicContact CD2-CG1 4.37Å; L332-A409 HydrophobicContact CD2-CB 4.28Å; L332-V410 HydrophobicContact CD1-CG2 4.29Å; L332-V427 HydrophobicContact CD2-CG1 4.5Å; L332-V427 HydrophobicContact CD2-CG2 3.75Å; L332-V427 HydrophobicContact CG-CG2 3.88Å; L332-L588 WeakPolarHBondContact O-CD2 3Å; L332-V592 HydrophobicContact CD1-CG2 4.42Å
333	F	84.1	Confident	87.1	Confident	66 Å²	66	51.3 Å²	51.3	29%	0.289	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-66.3	-23.4	178.3	-68.5	-57.9	0	0	0	113.8	T227 F326 P330 L331 H335 L588	T227-F333 HydrophobicContact CG2-CD1 4.22Å; T227-F333 HydrophobicContact CG2-CE1 3.21Å; T227-F333 HydrophobicContact CG2-CZ 3.48Å; T227-F333 VanDerWaalsContact CG2-CZ 3.48Å; F326-F333 HydrophobicContact CB-CE2 3.82Å; F326-F333 HydrophobicContact CB-CZ 3.59Å; F326-F333 AromaticContact CD1-CD1 3.98Å; F326-F333 HydrophobicContact CD1-CD1 3.98Å; F326-F333 HydrophobicContact CD1-CD2 4.19Å; F326-F333 AromaticContact CD1-CE1 3.37Å; F326-F333 HydrophobicContact CD1-CE1 3.37Å; F326-F333 AromaticContact CD1-CE2 3.67Å; F326-F333 HydrophobicContact CD1-CE2 3.67Å; F326-F333 HydrophobicContact CD1-CG 4.34Å; F326-F333 AromaticContact CD1-CZ 3.23Å; F326-F333 HydrophobicContact CD1-CZ 3.23Å; F326-F333 HydrophobicContact CD2-CZ 4.33Å; F326-F333 AromaticContact CE1-CD1 3.99Å; F326-F333 HydrophobicContact CE1-CD1 3.99Å; F326-F333 AromaticContact CE1-CE1 3.57Å; F326-F333 HydrophobicContact CE1-CE1 3.57Å; F326-F333 AromaticContact CE1-CZ 3.95Å; F326-F333 HydrophobicContact CE1-CZ 3.95Å; F326-F333 AromaticContact CG-CE1 3.93Å; F326-F333 HydrophobicContact CG-CE1 3.93Å; F326-F333 HydrophobicContact CG-CE2 4.05Å; F326-F333 AromaticContact CG-CZ 3.47Å; F326-F333 HydrophobicContact CG-CZ 3.47Å; F326-F333 VanDerWaalsContact CG-CZ 3.47Å; F326-F333 HydrophobicContact CZ-CE1 4.27Å; P330-F333 PolarHBondContact O-N 3.45Å; L331-F333 PolarHBondContact O-N 3.42Å; F333-H335 VanDerWaalsContact C-N 3.35Å; F333-L588 HydrophobicContact CD1-CD2 4.13Å
334	L	85.4	Confident	87.2	Confident	84 Å²	84	56.1 Å²	56.1	44%	0.44	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-83.9	-11.5	177.8	-63.7	177.7	0	0	0	112.7	L331 L332 F337 W338	L331-L334 HydrophobicContact CD2-CD1 3.99Å; L331-L334 PolarHBondContact O-N 2.83Å; L332-L334 PolarHBondContact O-N 3.38Å; L334-F337 WeakPolarHBondContact O-CB 3.35Å; L334-F337 PolarHBondContact O-N 2.95Å; L334-W338 PolarHBondContact O-N 2.85Å; L334-W338 VanDerWaalsContact O-N 3.11Å
335	H	86.7	Confident	87.6	Confident	16 Å²	16	58.1 Å²	58.1	7%	0.074	30%	0.296	C	S	.	.	H	α-helix	trans	-59	-49.4	-178.2	-110.5	48.4	0	0	0	114.1	L332 F333 F337 W338 T339 T405 V427	L332-H335 WeakPolarHBondContact O-CB 3.32Å; L332-H335 PolarHBondContact O-N 3.04Å; L332-H335 VanDerWaalsContact O-N 3.15Å; F333-H335 VanDerWaalsContact C-N 3.35Å; H335-F337 PolarHBondContact O-N 3.28Å; H335-W338 PolarHBondContact O-N 2.75Å; H335-W338 VanDerWaalsContact O-N 3.12Å; H335-T339 PolarHBondContact O-N 2.86Å; H335-T339 PolarHBondContact O-OG1 2.79Å; H335-T339 VanDerWaalsContact O-OG1 3.13Å; H335-T405 WeakPolarHBondContact NE2-CB 3.32Å; H335-T405 WeakPolarHBondContact NE2-CG2 3.21Å; H335-V427 WeakPolarHBondContact CE1-CG1 3.45Å
336	P	84.4	Confident	87.9	Confident	16 Å²	16	59.1 Å²	59.1	10%	0.104	30%	0.3	C	S	.	.	H	α-helix	trans	-58.9	-33.7	178.7	-24.1	34	0	0	0	113.1	F340 C584 L588	P336-F340 VanDerWaalsContact O-CB 3.27Å; P336-F340 WeakPolarHBondContact O-CB 3.21Å; P336-F340 PolarHBondContact O-N 3.29Å; P336-C584 WeakPolarHBondContact CB-SG 3.48Å; P336-L588 HydrophobicContact CG-CB 4.11Å; P336-L588 HydrophobicContact CG-CD1 4.16Å; P336-L588 HydrophobicContact CG-CD2 3.92Å; P336-L588 HydrophobicContact CG-CG 4.28Å
337	F	84.7	Confident	88.1	Confident	120 Å²	120	65.7 Å²	65.7	53%	0.526	33%	0.325	S	S	.	.	H	α-helix	trans	-66.2	-46.6	175.5	176.9	-97.4	0	0	0	111.6	L334 H335 T339 F340 L341	L334-F337 WeakPolarHBondContact O-CB 3.35Å; L334-F337 PolarHBondContact O-N 2.95Å; H335-F337 PolarHBondContact O-N 3.28Å; F337-T339 PolarHBondContact O-N 2.9Å; F337-F340 PolarHBondContact O-N 3.12Å; F337-L341 WeakPolarHBondContact O-CB 3.49Å; F337-L341 PolarHBondContact O-N 2.99Å
338	W	88.1	Confident	88.2	Confident	149 Å²	149	66.6 Å²	66.6	56%	0.564	33%	0.33	S	S	*	.	H	α-helix	trans	-63.5	-40.9	176.5	-66.8	122.2	0	0	0	112.7	L334 H335 L341 G342	L334-W338 PolarHBondContact O-N 2.85Å; L334-W338 VanDerWaalsContact O-N 3.11Å; H335-W338 PolarHBondContact O-N 2.75Å; H335-W338 VanDerWaalsContact O-N 3.12Å; W338-L341 HydrophobicContact CE3-CD2 3.92Å; W338-L341 HydrophobicContact CZ3-CD2 3.82Å; W338-L341 PolarHBondContact O-N 3.18Å; W338-G342 PolarHBondContact O-N 3.4Å
339	T	90.2	Very high	88.5	Confident	15 Å²	15	67.4 Å²	67.4	9%	0.092	33%	0.325	C	S	.	.	H	α-helix	trans	-63	-45	174.1	-54.1	0	0	0	0	111.1	H335 F337 L341 G342 L343 I398 L399 Q402	H335-T339 PolarHBondContact O-N 2.86Å; H335-T339 PolarHBondContact O-OG1 2.79Å; H335-T339 VanDerWaalsContact O-OG1 3.13Å; F337-T339 PolarHBondContact O-N 2.9Å; T339-L341 PolarHBondContact O-N 2.84Å; T339-G342 PolarHBondContact O-N 3.06Å; T339-L343 HydrophobicContact CG2-CD1 4.08Å; T339-L343 HydrophobicContact CG2-CG 4.44Å; T339-L343 WeakPolarHBondContact O-CB 3.36Å; T339-L343 WeakPolarHBondContact O-CG 3.46Å; T339-L343 PolarHBondContact O-N 2.99Å; T339-I398 HydrophobicContact CG2-CG2 3.95Å; T339-L399 HydrophobicContact CG2-CD2 3.94Å; T339-Q402 HydrophobicContact CG2-CB 4.48Å; T339-Q402 WeakPolarHBondContact OG1-CG 3.23Å; T339-Q402 PolarHBondContact OG1-OE1 3.46Å
340	F	86.6	Confident	88.8	Confident	134 Å²	134	68 Å²	68	59%	0.588	33%	0.327	S	S	*	.	H	α-helix	trans	-60.5	-45.8	177.8	178.9	-96.5	0	0	0	111.4	P336 F337 G342 L343 M344	P336-F340 VanDerWaalsContact O-CB 3.27Å; P336-F340 WeakPolarHBondContact O-CB 3.21Å; P336-F340 PolarHBondContact O-N 3.29Å; F337-F340 PolarHBondContact O-N 3.12Å; F340-G342 VanDerWaalsContact C-N 3.34Å; F340-G342 PolarHBondContact O-N 3.13Å; F340-L343 PolarHBondContact O-N 3.01Å; F340-M344 HydrophobicContact CE1-SD 4.19Å; F340-M344 VanDerWaalsContact O-CB 3.3Å; F340-M344 WeakPolarHBondContact O-CB 3.48Å; F340-M344 PolarHBondContact O-N 3.45Å
341	L	88.7	Confident	88.8	Confident	59 Å²	59	66.2 Å²	66.2	31%	0.309	31%	0.314	S	S	.	.	H	α-helix	trans	-59.8	-45.1	175.7	-177.7	63	0	0	0	111.2	F337 W338 T339 M344 M345	F337-L341 WeakPolarHBondContact O-CB 3.49Å; F337-L341 PolarHBondContact O-N 2.99Å; W338-L341 HydrophobicContact CE3-CD2 3.92Å; W338-L341 HydrophobicContact CZ3-CD2 3.82Å; W338-L341 PolarHBondContact O-N 3.18Å; T339-L341 PolarHBondContact O-N 2.84Å; L341-M344 PolarHBondContact O-N 2.85Å; L341-M345 HydrophobicContact CD1-CG 4.47Å; L341-M345 HydrophobicContact CG-CE 4.04Å; L341-M345 HydrophobicContact CG-SD 4.44Å; L341-M345 WeakPolarHBondContact O-CG 3.34Å; L341-M345 PolarHBondContact O-N 2.95Å
342	G	91.3	Very high	88.7	Confident	21 Å²	21	65.1 Å²	65.1	22%	0.216	31%	0.314	C	S	.	.	H	α-helix	trans	-59.4	-47.6	175.9	0	0	0	0	0	113.1	W338 T339 F340 M345 F346	W338-G342 PolarHBondContact O-N 3.4Å; T339-G342 PolarHBondContact O-N 3.06Å; F340-G342 VanDerWaalsContact C-N 3.34Å; F340-G342 PolarHBondContact O-N 3.13Å; G342-M345 PolarHBondContact O-N 3.06Å; G342-F346 WeakPolarHBondContact O-CB 3.12Å; G342-F346 PolarHBondContact O-N 2.83Å
343	L	90.4	Very high	88.7	Confident	44 Å²	44	65.3 Å²	65.3	23%	0.23	32%	0.315	C	S	.	.	H	α-helix	trans	-63.8	-40.2	175.9	-73.2	172.1	0	0	0	112	T339 F340 F346 W347 I398 L399	T339-L343 HydrophobicContact CG2-CD1 4.08Å; T339-L343 HydrophobicContact CG2-CG 4.44Å; T339-L343 WeakPolarHBondContact O-CB 3.36Å; T339-L343 WeakPolarHBondContact O-CG 3.46Å; T339-L343 PolarHBondContact O-N 2.99Å; F340-L343 PolarHBondContact O-N 3.01Å; L343-F346 PolarHBondContact O-N 3.42Å; L343-W347 VanDerWaalsContact O-CB 3.27Å; L343-W347 WeakPolarHBondContact O-CB 3.39Å; L343-W347 PolarHBondContact O-N 2.91Å; L343-I398 HydrophobicContact CD2-CB 4.04Å; L343-I398 HydrophobicContact CD2-CD1 3.99Å; L343-I398 HydrophobicContact CD2-CG2 3.99Å; L343-I398 HydrophobicContact CG-CG2 3.93Å; L343-L399 HydrophobicContact CD1-CD2 4.06Å
344	M	86.6	Confident	88.9	Confident	103 Å²	103	64.8 Å²	64.8	51%	0.507	32%	0.315	S	S	.	.	H	α-helix	trans	-64.7	-47.1	178.1	-178.4	177.3	179.4	0	0	111.5	F340 L341 F346 W347 V348	F340-M344 HydrophobicContact CE1-SD 4.19Å; F340-M344 VanDerWaalsContact O-CB 3.3Å; F340-M344 WeakPolarHBondContact O-CB 3.48Å; F340-M344 PolarHBondContact O-N 3.45Å; L341-M344 PolarHBondContact O-N 2.85Å; M344-F346 VanDerWaalsContact C-N 3.34Å; M344-F346 PolarHBondContact O-N 3.42Å; M344-W347 PolarHBondContact O-N 3.34Å; M344-V348 WeakPolarHBondContact O-CG2 3.34Å; M344-V348 PolarHBondContact O-N 2.96Å
345	M	92.8	Very high	88.8	Confident	115 Å²	115	65 Å²	65	57%	0.567	32%	0.316	S	S	*	.	H	α-helix	trans	-60.3	-44.7	175.5	-71.2	-175.7	-61.2	0	0	111.4	L341 G342 W347 V348 Y349	L341-M345 HydrophobicContact CD1-CG 4.47Å; L341-M345 HydrophobicContact CG-CE 4.04Å; L341-M345 HydrophobicContact CG-SD 4.44Å; L341-M345 WeakPolarHBondContact O-CG 3.34Å; L341-M345 PolarHBondContact O-N 2.95Å; G342-M345 PolarHBondContact O-N 3.06Å; M345-W347 VanDerWaalsContact C-N 3.35Å; M345-W347 PolarHBondContact O-N 3.28Å; M345-V348 PolarHBondContact O-N 2.04Å; M345-Y349 WeakPolarHBondContact O-CB 3.49Å; M345-Y349 PolarHBondContact O-N 2.88Å
346	F	94.9	Very high	88.6	Confident	21 Å²	21	66.8 Å²	66.8	9%	0.092	32%	0.324	C	S	.	.	H	α-helix	trans	-62	-41.7	175.7	173.9	-115.1	0	0	0	112.1	G342 L343 M344 Y349 W350 G390 L391 I394 I398	G342-F346 WeakPolarHBondContact O-CB 3.12Å; G342-F346 PolarHBondContact O-N 2.83Å; L343-F346 PolarHBondContact O-N 3.42Å; M344-F346 VanDerWaalsContact C-N 3.34Å; M344-F346 PolarHBondContact O-N 3.42Å; F346-Y349 AromaticContact CD2-CD1 3.98Å; F346-Y349 HydrophobicContact CD2-CD1 3.98Å; F346-Y349 HydrophobicContact CE2-CD1 4.08Å; F346-Y349 HydrophobicContact CE2-CE1 4.29Å; F346-Y349 WeakPolarHBondContact O-CB 3.32Å; F346-Y349 PolarHBondContact O-N 3.39Å; F346-W350 HydrophobicContact CZ-CB 4.45Å; F346-W350 VanDerWaalsContact O-CB 3.23Å; F346-W350 WeakPolarHBondContact O-CB 3.39Å; F346-W350 PolarHBondContact O-N 3.24Å; F346-G390 WeakPolarHBondContact CZ-O 3.37Å; F346-L391 HydrophobicContact CE1-CD1 4.04Å; F346-I394 HydrophobicContact CD1-CG2 4.17Å; F346-I394 HydrophobicContact CD2-CB 4.46Å; F346-I394 HydrophobicContact CD2-CG2 3.76Å; F346-I394 HydrophobicContact CE1-CB 3.96Å; F346-I394 HydrophobicContact CE1-CG2 4.04Å; F346-I394 HydrophobicContact CE2-CB 3.85Å; F346-I394 HydrophobicContact CE2-CD1 3.64Å; F346-I394 HydrophobicContact CE2-CG1 4.34Å; F346-I394 HydrophobicContact CE2-CG2 3.63Å; F346-I394 HydrophobicContact CG-CG2 4.04Å; F346-I394 HydrophobicContact CZ-CB 3.57Å; F346-I394 HydrophobicContact CZ-CD1 3.91Å; F346-I394 HydrophobicContact CZ-CG1 4.28Å; F346-I394 HydrophobicContact CZ-CG2 3.79Å; F346-I398 HydrophobicContact CB-CD1 4.06Å; F346-I398 HydrophobicContact CD1-CD1 4.46Å; F346-I398 HydrophobicContact CG-CD1 4.32Å
347	W	91.5	Very high	88.5	Confident	148 Å²	148	66 Å²	66	56%	0.561	32%	0.319	S	S	*	.	H	α-helix	trans	-65.4	-43	179.2	-169.4	87.1	0	0	0	112	L343 M344 M345 W350 V351	L343-W347 VanDerWaalsContact O-CB 3.27Å; L343-W347 WeakPolarHBondContact O-CB 3.39Å; L343-W347 PolarHBondContact O-N 2.91Å; M344-W347 PolarHBondContact O-N 3.34Å; M345-W347 VanDerWaalsContact C-N 3.35Å; M345-W347 PolarHBondContact O-N 3.28Å; W347-W350 PolarHBondContact O-N 3.3Å; W347-V351 HydrophobicContact CD2-CG2 3.86Å; W347-V351 HydrophobicContact CE3-CG2 3.97Å; W347-V351 HydrophobicContact CH2-CG2 3.85Å; W347-V351 HydrophobicContact CZ2-CG2 3.72Å; W347-V351 HydrophobicContact CZ3-CG2 3.97Å; W347-V351 WeakPolarHBondContact O-CB 3.26Å; W347-V351 WeakPolarHBondContact O-CG2 3.46Å; W347-V351 PolarHBondContact O-N 3.45Å
348	V	86.6	Confident	88.2	Confident	82 Å²	82	62.6 Å²	62.6	50%	0.497	32%	0.317	S	S	.	.	H	α-helix	trans	-60.4	-48.3	174.2	171.1	0	0	0	0	110.7	M344 M345 W350 V351 A352	M344-V348 WeakPolarHBondContact O-CG2 3.34Å; M344-V348 PolarHBondContact O-N 2.96Å; M345-V348 PolarHBondContact O-N 2.04Å; V348-W350 VanDerWaalsContact C-N 3.32Å; V348-W350 PolarHBondContact O-N 3.1Å; V348-V351 PolarHBondContact O-N 3.37Å; V348-A352 WeakPolarHBondContact O-CB 3.48Å; V348-A352 PolarHBondContact O-N 2.71Å
349	Y	92.5	Very high	87.8	Confident	74 Å²	74	56.4 Å²	56.4	29%	0.29	30%	0.296	S	S	.	.	H	α-helix	trans	-54.7	-49.2	173.3	160.4	-97.9	0	0	0	111.4	M37 C41 M345 F346 A352 V353	M37-Y349 HydrophobicContact CE-CE1 4.5Å; M37-Y349 PolarHBondContact O-OH 3.49Å; C41-Y349 HydrophobicContact CB-CE2 4.11Å; M345-Y349 WeakPolarHBondContact O-CB 3.49Å; M345-Y349 PolarHBondContact O-N 2.88Å; F346-Y349 AromaticContact CD2-CD1 3.98Å; F346-Y349 HydrophobicContact CD2-CD1 3.98Å; F346-Y349 HydrophobicContact CE2-CD1 4.08Å; F346-Y349 HydrophobicContact CE2-CE1 4.29Å; F346-Y349 WeakPolarHBondContact O-CB 3.32Å; F346-Y349 PolarHBondContact O-N 3.39Å; Y349-A352 PolarHBondContact O-N 3.3Å; Y349-V353 HydrophobicContact CD2-CG2 4.05Å; Y349-V353 HydrophobicContact CE2-CG2 3.64Å; Y349-V353 WeakPolarHBondContact O-CG2 3.39Å; Y349-V353 PolarHBondContact O-N 2.9Å
350	W	94.3	Very high	87.4	Confident	22 Å²	22	56.5 Å²	56.5	8%	0.083	30%	0.297	C	S	.	.	H	α-helix	trans	-64.1	-45.4	-175.5	-175.1	92.1	0	0	0	112.1	F346 W347 V348 V353 L354 H387 L388 L391	F346-W350 HydrophobicContact CZ-CB 4.45Å; F346-W350 VanDerWaalsContact O-CB 3.23Å; F346-W350 WeakPolarHBondContact O-CB 3.39Å; F346-W350 PolarHBondContact O-N 3.24Å; W347-W350 PolarHBondContact O-N 3.3Å; V348-W350 VanDerWaalsContact C-N 3.32Å; V348-W350 PolarHBondContact O-N 3.1Å; W350-V353 PolarHBondContact O-N 3.02Å; W350-L354 HydrophobicContact CE3-CD2 4.45Å; W350-L354 HydrophobicContact CH2-CD2 3.53Å; W350-L354 HydrophobicContact CZ2-CD2 4.33Å; W350-L354 HydrophobicContact CZ3-CB 4.44Å; W350-L354 HydrophobicContact CZ3-CD2 3.59Å; W350-L354 WeakPolarHBondContact O-CB 3.48Å; W350-L354 PolarHBondContact O-N 3.47Å; W350-H387 AromaticContact CD1-CD2 3.73Å; W350-H387 AromaticContact CD1-CE1 3.43Å; W350-H387 VanDerWaalsContact CD1-CE1 3.43Å; W350-H387 AromaticContact CD1-ND1 3.99Å; W350-H387 AromaticContact CD1-NE2 3.25Å; W350-H387 VanDerWaalsContact CD1-NE2 3.25Å; W350-H387 AromaticContact CD2-NE2 3.77Å; W350-H387 AromaticContact CE2-CD2 3.55Å; W350-H387 AromaticContact CE2-NE2 3.66Å; W350-H387 AromaticContact CG-CE1 3.98Å; W350-H387 AromaticContact CG-NE2 3.52Å; W350-H387 AromaticContact NE1-CD2 3.24Å; W350-H387 PolarHBondContact NE1-CD2 3.43Å; W350-H387 AromaticContact NE1-CE1 3.74Å; W350-H387 AromaticContact NE1-CG 3.68Å; W350-H387 AromaticContact NE1-ND1 3.99Å; W350-H387 AromaticContact NE1-NE2 3.29Å; W350-H387 PolarHBondContact NE1-NE2 2.87Å; W350-H387 PolarHBondContact NE1-O 2.89Å; W350-H387 PolarHBondContact O-NE2 3.44Å; W350-L388 HydrophobicContact CH2-CD2 3.97Å; W350-L388 HydrophobicContact CZ2-CD2 3.65Å; W350-L391 HydrophobicContact CD2-CB 4.4Å; W350-L391 HydrophobicContact CD2-CD1 3.86Å; W350-L391 HydrophobicContact CD2-CD2 4.44Å; W350-L391 HydrophobicContact CD2-CG 4.45Å; W350-L391 HydrophobicContact CE3-CD1 4.29Å; W350-L391 HydrophobicContact CG-CD1 3.95Å; W350-L391 HydrophobicContact CH2-CD2 3.91Å; W350-L391 HydrophobicContact CZ2-CB 4.01Å; W350-L391 HydrophobicContact CZ2-CD2 3.79Å; W350-L391 HydrophobicContact CZ2-CG 4.35Å; W350-L391 HydrophobicContact CZ3-CD2 4.32Å
351	V	86.9	Confident	87.2	Confident	41 Å²	41	50.4 Å²	50.4	25%	0.248	27%	0.272	C	S	.	.	H	α-helix	trans	-63.8	-44.4	176.6	170.9	0	0	0	0	110.6	W347 V348 V353 L354 L355	W347-V351 HydrophobicContact CD2-CG2 3.86Å; W347-V351 HydrophobicContact CE3-CG2 3.97Å; W347-V351 HydrophobicContact CH2-CG2 3.85Å; W347-V351 HydrophobicContact CZ2-CG2 3.72Å; W347-V351 HydrophobicContact CZ3-CG2 3.97Å; W347-V351 WeakPolarHBondContact O-CB 3.26Å; W347-V351 WeakPolarHBondContact O-CG2 3.46Å; W347-V351 PolarHBondContact O-N 3.45Å; V348-V351 PolarHBondContact O-N 3.37Å; V351-V353 PolarHBondContact O-N 3.5Å; V351-L354 PolarHBondContact O-N 3.28Å; V351-L355 HydrophobicContact CG1-CD1 3.92Å; V351-L355 HydrophobicContact CG1-CG 4.27Å; V351-L355 WeakPolarHBondContact O-CB 3.5Å; V351-L355 VanDerWaalsContact O-CG 3.28Å; V351-L355 WeakPolarHBondContact O-CG 3.43Å; V351-L355 PolarHBondContact O-N 3.26Å
352	A	86.8	Confident	86.9	Confident	37 Å²	37	50.2 Å²	50.2	31%	0.306	28%	0.276	S	S	.	.	H	α-helix	trans	-59	-47.8	178.2	0	0	0	0	0	111.7	V348 Y349 L354 L355 F356	V348-A352 WeakPolarHBondContact O-CB 3.48Å; V348-A352 PolarHBondContact O-N 2.71Å; Y349-A352 PolarHBondContact O-N 3.3Å; A352-L354 PolarHBondContact O-N 3.1Å; A352-L355 PolarHBondContact O-N 3.03Å; A352-F356 VanDerWaalsContact O-CG 3.32Å; A352-F356 WeakPolarHBondContact O-CG 3.38Å; A352-F356 PolarHBondContact O-N 2.99Å
353	V	89.7	Confident	86.6	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.024	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-41.2	177.1	174.3	0	0	0	0	111.4	I40 C41 Y349 W350 V351 L355 F356 L357 H387	I40-V353 HydrophobicContact CG2-CG1 4.23Å; C41-V353 HydrophobicContact CB-CG1 4.44Å; C41-V353 HydrophobicContact CB-CG2 3.77Å; Y349-V353 HydrophobicContact CD2-CG2 4.05Å; Y349-V353 HydrophobicContact CE2-CG2 3.64Å; Y349-V353 WeakPolarHBondContact O-CG2 3.39Å; Y349-V353 PolarHBondContact O-N 2.9Å; W350-V353 PolarHBondContact O-N 3.02Å; V351-V353 PolarHBondContact O-N 3.5Å; V353-L355 VanDerWaalsContact C-N 3.34Å; V353-L355 PolarHBondContact O-N 3.36Å; V353-F356 PolarHBondContact O-N 3.4Å; V353-L357 VanDerWaalsContact O-CB 3.25Å; V353-L357 WeakPolarHBondContact O-CB 3.29Å; V353-L357 PolarHBondContact O-N 2.95Å; V353-H387 VanDerWaalsContact CG1-CE1 3.43Å; V353-H387 WeakPolarHBondContact CG1-CE1 3.43Å
354	L	87.3	Confident	86.4	Confident	56 Å²	56	52 Å²	52	29%	0.293	29%	0.285	S	S	.	.	H	α-helix	trans	-62.1	-42.6	177.4	-178.8	68.9	0	0	0	111.5	W350 V351 A352 L357 G358	W350-L354 HydrophobicContact CE3-CD2 4.45Å; W350-L354 HydrophobicContact CH2-CD2 3.53Å; W350-L354 HydrophobicContact CZ2-CD2 4.33Å; W350-L354 HydrophobicContact CZ3-CB 4.44Å; W350-L354 HydrophobicContact CZ3-CD2 3.59Å; W350-L354 WeakPolarHBondContact O-CB 3.48Å; W350-L354 PolarHBondContact O-N 3.47Å; V351-L354 PolarHBondContact O-N 3.28Å; A352-L354 PolarHBondContact O-N 3.1Å; L354-L357 PolarHBondContact O-N 2.95Å; L354-G358 PolarHBondContact O-N 3.28Å
355	L	84	Confident	86.3	Confident	88 Å²	88	51.3 Å²	51.3	46%	0.461	28%	0.279	S	S	.	.	H	α-helix	trans	-63.1	-44.5	177	-71.5	173	0	0	0	111.2	L53 V351 A352 V353 G358 T359	L53-L355 HydrophobicContact CD2-CB 3.93Å; L53-L355 HydrophobicContact CD2-CD1 4.48Å; V351-L355 HydrophobicContact CG1-CD1 3.92Å; V351-L355 HydrophobicContact CG1-CG 4.27Å; V351-L355 WeakPolarHBondContact O-CB 3.5Å; V351-L355 VanDerWaalsContact O-CG 3.28Å; V351-L355 WeakPolarHBondContact O-CG 3.43Å; V351-L355 PolarHBondContact O-N 3.26Å; A352-L355 PolarHBondContact O-N 3.03Å; V353-L355 VanDerWaalsContact C-N 3.34Å; V353-L355 PolarHBondContact O-N 3.36Å; L355-G358 WeakPolarHBondContact O-CA 3.23Å; L355-G358 PolarHBondContact O-N 2.99Å; L355-T359 PolarHBondContact O-N 2.88Å; L355-T359 PolarHBondContact O-OG1 2.93Å
356	F	82.6	Confident	85.9	Confident	54 Å²	54	47.9 Å²	47.9	24%	0.237	26%	0.263	C	S	.	.	H	α-helix	trans	-65	-44.9	176.8	-64.9	-19.4	0	0	0	112	A44 I45 A50 L53 A352 V353 G358 T359 S360	A44-F356 HydrophobicContact CB-CB 3.9Å; I45-F356 HydrophobicContact CG1-CD2 4.06Å; I45-F356 HydrophobicContact CG1-CE2 4.3Å; A50-F356 HydrophobicContact CB-CD1 3.79Å; A50-F356 HydrophobicContact CB-CE1 3.58Å; A50-F356 HydrophobicContact CB-CG 4.37Å; A50-F356 HydrophobicContact CB-CZ 4Å; L53-F356 HydrophobicContact CD2-CD1 4.27Å; L53-F356 HydrophobicContact CD2-CE1 4.23Å; A352-F356 VanDerWaalsContact O-CG 3.32Å; A352-F356 WeakPolarHBondContact O-CG 3.38Å; A352-F356 PolarHBondContact O-N 2.99Å; V353-F356 PolarHBondContact O-N 3.4Å; F356-G358 VanDerWaalsContact C-N 3.27Å; F356-G358 PolarHBondContact O-N 3.01Å; F356-T359 WeakPolarHBondContact O-CA 3.35Å; F356-T359 PolarHBondContact O-N 3.33Å; F356-T359 PolarHBondContact O-OG1 3.08Å; F356-S360 PolarHBondContact O-N 3.25Å; F356-S360 VanDerWaalsContact O-N 3.16Å; F356-S360 PolarHBondContact O-OG 3.06Å
357	L	82.9	Confident	85.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.5	-40	175.5	-170.3	64	0	0	0	111.1	I40 A44 V353 L354 T359 S360 M376 L380 M383 V384	I40-L357 HydrophobicContact CG2-CD1 4.46Å; I40-L357 HydrophobicContact CG2-CD2 4.3Å; A44-L357 HydrophobicContact CB-CB 4.46Å; V353-L357 VanDerWaalsContact O-CB 3.25Å; V353-L357 WeakPolarHBondContact O-CB 3.29Å; V353-L357 PolarHBondContact O-N 2.95Å; L354-L357 PolarHBondContact O-N 2.95Å; L357-T359 PolarHBondContact O-N 3.29Å; L357-T359 VanDerWaalsContact O-N 3.13Å; L357-S360 PolarHBondContact O-N 3.3Å; L357-M376 WeakPolarHBondContact O-CE 3.44Å; L357-L380 HydrophobicContact CD1-CG 4.37Å; L357-M383 HydrophobicContact CD1-CB 4.17Å; L357-M383 HydrophobicContact CD1-SD 4.29Å; L357-M383 HydrophobicContact CD2-CB 4.09Å; L357-V384 HydrophobicContact CD2-CB 4.27Å; L357-V384 HydrophobicContact CD2-CG2 3.54Å; L357-V384 HydrophobicContact CG-CG2 4.02Å
358	G	78.3	Confident	84.5	Confident	47 Å²	47	52.7 Å²	52.7	49%	0.485	31%	0.31	S	S	.	.	H	α-helix	trans	-46.1	-36.2	168.9	0	0	0	0	0	114.1	L354 L355 F356 M376	L354-G358 PolarHBondContact O-N 3.28Å; L355-G358 WeakPolarHBondContact O-CA 3.23Å; L355-G358 PolarHBondContact O-N 2.99Å; F356-G358 VanDerWaalsContact C-N 3.27Å; F356-G358 PolarHBondContact O-N 3.01Å; G358-M376 VanDerWaalsContact O-CE 3.31Å; G358-M376 WeakPolarHBondContact O-CE 3.26Å
359	T	79.4	Confident	83.9	Confident	20 Å²	20	52.7 Å²	52.7	12%	0.123	31%	0.31	C	S	.	.	H	α-helix	trans	-98.3	-8.5	-176.8	54.5	0	0	0	0	114.5	G49 R52 L53 L355 F356 L357 G361	G49-T359 WeakPolarHBondContact CA-OG1 3.08Å; G49-T359 WeakPolarHBondContact O-CB 3.48Å; G49-T359 PolarHBondContact O-OG1 3Å; G49-T359 VanDerWaalsContact O-OG1 3.05Å; R52-T359 PolarHBondContact NH1-O 2.88Å; L53-T359 HydrophobicContact CB-CG2 4.08Å; L53-T359 HydrophobicContact CD1-CG2 4.09Å; L355-T359 PolarHBondContact O-N 2.88Å; L355-T359 PolarHBondContact O-OG1 2.93Å; F356-T359 WeakPolarHBondContact O-CA 3.35Å; F356-T359 PolarHBondContact O-N 3.33Å; F356-T359 PolarHBondContact O-OG1 3.08Å; L357-T359 PolarHBondContact O-N 3.29Å; L357-T359 VanDerWaalsContact O-N 3.13Å; T359-G361 PolarHBondContact O-N 3.22Å
360	S	82.4	Confident	83	Confident	16 Å²	16	50.9 Å²	50.9	11%	0.112	31%	0.314	C	S	.	.			trans	-78.8	5.2	-178.6	-65.8	0	0	0	0	114.6	T47 F356 L357 L380	T47-S360 WeakPolarHBondContact OG1-CB 3.35Å; T47-S360 PolarHBondContact OG1-OG 3.34Å; F356-S360 PolarHBondContact O-N 3.25Å; F356-S360 VanDerWaalsContact O-N 3.16Å; F356-S360 PolarHBondContact O-OG 3.06Å; L357-S360 PolarHBondContact O-N 3.3Å; S360-L380 WeakPolarHBondContact O-CD2 3.02Å
361	G	81.2	Confident	82.4	Confident	7 Å²	7	51.5 Å²	51.5	7%	0.072	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-56.7	155.3	176.2	0	0	0	0	0	112.7	T359 Y374 Q375	T359-G361 PolarHBondContact O-N 3.22Å; G361-Y374 WeakPolarHBondContact O-CD1 3.36Å; G361-Q375 WeakPolarHBondContact CA-O 3.29Å
362	S	82.9	Confident	82.3	Confident	55 Å²	55	49.8 Å²	49.8	39%	0.385	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	143	176.6	53.5	0	0	0	0	111.1	Y374 Q375	S362-Y374 VanDerWaalsContact O-CA 3.31Å; S362-Y374 WeakPolarHBondContact O-CA 3.19Å; S362-Q375 PolarHBondContact N-O 3.5Å; S362-Q375 VanDerWaalsContact N-O 3.14Å; S362-Q375 PolarHBondContact O-N 2.84Å
363	P	85.3	Confident	82	Confident	53 Å²	53	49.8 Å²	49.8	34%	0.344	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	129.4	177.3	28.1	-30.8	0	0	0	110.6	I73 V372 Y374	I73-P363 HydrophobicContact CD1-CB 3.67Å; I73-P363 HydrophobicContact CD1-CG 4.04Å; I73-P363 HydrophobicContact CG1-CB 4.18Å; I73-P363 HydrophobicContact CG1-CG 4.04Å; I73-P363 HydrophobicContact CG2-CB 4.45Å; P363-V372 HydrophobicContact CB-CG1 3.57Å; P363-Y374 HydrophobicContact CB-CD1 4.03Å; P363-Y374 HydrophobicContact CB-CE1 3.57Å; P363-Y374 HydrophobicContact CG-CE1 4.06Å
364	V	85.3	Confident	81.5	Confident	48 Å²	48	51.9 Å²	51.9	29%	0.291	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	132.4	175.9	-176.6	0	0	0	0	108.5	N366 E373 Q375	V364-N366 PolarHBondContact O-N 3.39Å; V364-E373 PolarHBondContact N-O 3.48Å; V364-E373 PolarHBondContact O-N 3.23Å; V364-E373 VanDerWaalsContact O-O 3.12Å; V364-Q375 HydrophobicContact CG2-CB 4.46Å; V364-Q375 HydrophobicContact CG2-CG 4.49Å
365	K	85.6	Confident	81	Confident	90 Å²	90	52.8 Å²	52.8	39%	0.391	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	124.7	173.6	-175.1	-176.4	-176.3	176.7	0	109.7	G75 V76	G75-K365 WeakPolarHBondContact O-CD 3.48Å; G75-K365 PolarHBondContact O-NZ 3.06Å; V76-K365 HydrophobicContact CG2-CB 3.98Å; V76-K365 HydrophobicContact CG2-CD 4.03Å; V76-K365 HydrophobicContact CG2-CG 4.1Å
366	N	82.6	Confident	80.5	Confident	42 Å²	42	51.4 Å²	51.4	23%	0.225	31%	0.306	C	S	.	.			trans	-79.2	122.7	172.2	-176.3	-22.8	0	0	0	109.8	V364 S368 T369 G370 V371 E373	V364-N366 PolarHBondContact O-N 3.39Å; N366-S368 VanDerWaalsContact C-N 3.3Å; N366-S368 PolarHBondContact O-N 3.29Å; N366-S368 PolarHBondContact OD1-N 3.06Å; N366-T369 VanDerWaalsContact CB-OG1 3.28Å; N366-T369 WeakPolarHBondContact CB-OG1 3.33Å; N366-T369 PolarHBondContact ND2-OG1 2.62Å; N366-G370 VanDerWaalsContact O-CA 3.29Å; N366-G370 WeakPolarHBondContact O-CA 3.15Å; N366-G370 PolarHBondContact O-N 2.88Å; N366-V371 PolarHBondContact N-O 3.45Å; N366-E373 HydrophobicContact CB-CG 4.34Å; N366-E373 PolarHBondContact ND2-OE1 3.04Å
367	N	80.9	Confident	80	Confident	154 Å²	154	54 Å²	54	82%	0.824	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-25.9	-177.8	-69.7	-16.2	0	0	0	113.6
368	S	77.6	Confident	79.8	Confident	116 Å²	116	55.8 Å²	55.8	81%	0.811	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-33.2	-178.2	-56	0	0	0	0	113.2	N366	N366-S368 VanDerWaalsContact C-N 3.3Å; N366-S368 PolarHBondContact O-N 3.29Å; N366-S368 PolarHBondContact OD1-N 3.06Å
369	T	73.7	Confident	79.9	Confident	82 Å²	82	58.2 Å²	58.2	50%	0.503	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-15.8	-174.4	51.9	0	0	0	0	113.2	N366 V371	N366-T369 VanDerWaalsContact CB-OG1 3.28Å; N366-T369 WeakPolarHBondContact CB-OG1 3.33Å; N366-T369 PolarHBondContact ND2-OG1 2.62Å; T369-V371 PolarHBondContact O-N 3.42Å; T369-V371 WeakPolarHBondContact OG1-CG2 3.38Å
370	G	74.1	Confident	79.9	Confident	36 Å²	36	58.2 Å²	58.2	37%	0.371	34%	0.343	S	S	.	.			trans	73.7	-1.7	-178	0	0	0	0	0	115	N366	N366-G370 VanDerWaalsContact O-CA 3.29Å; N366-G370 WeakPolarHBondContact O-CA 3.15Å; N366-G370 PolarHBondContact O-N 2.88Å
371	V	80.4	Confident	80	Confident	35 Å²	35	62.3 Å²	62.3	21%	0.212	36%	0.36	C	S	.	.	S	Bend	trans	-93.4	160.6	-178.2	-52.8	0	0	0	0	112.2	S59 N366 T369 E373	S59-V371 WeakPolarHBondContact O-CA 3.41Å; S59-V371 WeakPolarHBondContact O-CB 3.36Å; N366-V371 PolarHBondContact N-O 3.45Å; T369-V371 PolarHBondContact O-N 3.42Å; T369-V371 WeakPolarHBondContact OG1-CG2 3.38Å; V371-E373 HydrophobicContact CG2-CG 4.49Å
372	V	84.6	Confident	80.3	Confident	5 Å²	5	70.4 Å²	70.4	3%	0.03	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	121.6	175.5	176.6	0	0	0	0	110.2	S59 Y60 I73 V76 P363 Y374	S59-V372 PolarHBondContact O-N 2.95Å; Y60-V372 WeakPolarHBondContact O-CG2 3.44Å; I73-V372 HydrophobicContact CD1-CG1 4.05Å; I73-V372 HydrophobicContact CD1-CG2 4.07Å; V76-V372 HydrophobicContact CB-CG2 4.47Å; V76-V372 HydrophobicContact CG1-CG2 4.06Å; V76-V372 HydrophobicContact CG2-CG2 3.87Å; P363-V372 HydrophobicContact CB-CG1 3.57Å; V372-Y374 HydrophobicContact CG1-CE2 4.11Å
373	E	80.6	Confident	80.6	Confident	37 Å²	37	69.9 Å²	69.9	17%	0.173	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	141.9	170.3	-67.9	-168.6	-154.2	0	0	110.3	K103 V364 N366 V371	K103-E373 IonicContact NZ-OE2 3.32Å; K103-E373 PolarHBondContact NZ-OE2 2.88Å; V364-E373 PolarHBondContact N-O 3.48Å; V364-E373 PolarHBondContact O-N 3.23Å; V364-E373 VanDerWaalsContact O-O 3.12Å; N366-E373 HydrophobicContact CB-CG 4.34Å; N366-E373 PolarHBondContact ND2-OE1 3.04Å; V371-E373 HydrophobicContact CG2-CG 4.49Å
374	Y	79.4	Confident	80.6	Confident	49 Å²	49	68.9 Å²	68.9	19%	0.192	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	117.6	175.7	-70.9	-89.8	0	0	0	109.7	R52 Y57 G61 G361 S362 P363 V372	R52-Y374 VanDerWaalsContact CZ-CE2 3.43Å; R52-Y374 VanDerWaalsContact NH2-CD1 3.31Å; Y57-Y374 HydrophobicContact CD1-CE2 4.24Å; Y57-Y374 HydrophobicContact CD2-CD2 4.31Å; Y57-Y374 AromaticContact CD2-CE2 3.58Å; Y57-Y374 HydrophobicContact CD2-CE2 3.58Å; Y57-Y374 HydrophobicContact CE1-CD2 4.09Å; Y57-Y374 HydrophobicContact CE1-CE2 4.08Å; Y57-Y374 AromaticContact CE2-CD2 3.71Å; Y57-Y374 HydrophobicContact CE2-CD2 3.71Å; Y57-Y374 AromaticContact CE2-CE2 3.44Å; Y57-Y374 HydrophobicContact CE2-CE2 3.44Å; Y57-Y374 VanDerWaalsContact CE2-CE2 3.44Å; Y57-Y374 HydrophobicContact CG-CE2 4.01Å; Y57-Y374 AromaticContact CZ-CD2 3.58Å; Y57-Y374 AromaticContact CZ-CE2 3.7Å; G61-Y374 PolarHBondContact O-OH 3.11Å; G361-Y374 WeakPolarHBondContact O-CD1 3.36Å; S362-Y374 VanDerWaalsContact O-CA 3.31Å; S362-Y374 WeakPolarHBondContact O-CA 3.19Å; P363-Y374 HydrophobicContact CB-CD1 4.03Å; P363-Y374 HydrophobicContact CB-CE1 3.57Å; P363-Y374 HydrophobicContact CG-CE1 4.06Å; V372-Y374 HydrophobicContact CG1-CE2 4.11Å
375	Q	76.7	Confident	80.8	Confident	74 Å²	74	74.6 Å²	74.6	35%	0.346	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	139.1	-179.1	-61.4	-170.6	3.8	0	0	109.9	G361 S362 V364 Q377	G361-Q375 WeakPolarHBondContact CA-O 3.29Å; S362-Q375 PolarHBondContact N-O 3.5Å; S362-Q375 VanDerWaalsContact N-O 3.14Å; S362-Q375 PolarHBondContact O-N 2.84Å; V364-Q375 HydrophobicContact CG2-CB 4.46Å; V364-Q375 HydrophobicContact CG2-CG 4.49Å; Q375-Q377 HydrophobicContact CB-CG 4.08Å; Q375-Q377 PolarHBondContact O-N 3.3Å
376	M	74.1	Confident	81.1	Confident	59 Å²	59	73.6 Å²	73.6	29%	0.291	39%	0.386	S	S	.	.			trans	-87.5	99.1	169.3	-67.3	-163.5	170.7	0	0	108.3	L357 G358 L380 Q381 V384	L357-M376 WeakPolarHBondContact O-CE 3.44Å; G358-M376 VanDerWaalsContact O-CE 3.31Å; G358-M376 WeakPolarHBondContact O-CE 3.26Å; M376-L380 HydrophobicContact CG-CD2 4.3Å; M376-Q381 HydrophobicContact CB-CG 4.4Å; M376-Q381 PolarHBondContact O-NE2 2.98Å; M376-V384 HydrophobicContact SD-CG2 4.12Å
377	Q	71.6	Confident	81.6	Confident	110 Å²	110	71.6 Å²	71.6	51%	0.514	38%	0.375	S	S	.	.			trans	-116.1	145.9	177.4	-61.9	-174.6	8.2	0	0	110.7	Q375	Q375-Q377 HydrophobicContact CB-CG 4.08Å; Q375-Q377 PolarHBondContact O-N 3.3Å
378	G	78.9	Confident	82	Confident	37 Å²	37	67.1 Å²	67.1	38%	0.381	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	-133.3	172.1	0	0	0	0	0	114.6	L380 Q381	G378-L380 PolarHBondContact O-N 3.27Å; G378-L380 VanDerWaalsContact O-N 3.07Å; G378-Q381 PolarHBondContact O-N 3.5Å; G378-Q381 VanDerWaalsContact O-N 3.12Å
379	P	81.2	Confident	82.8	Confident	97 Å²	97	64 Å²	64	63%	0.63	33%	0.327	S	S	*	.	H	α-helix	trans	-54	-29.9	-172	-28.3	35.4	0	0	0	115.7	Q381 Y382 M383	P379-Q381 VanDerWaalsContact C-N 3.28Å; P379-Q381 PolarHBondContact O-N 2.77Å; P379-Y382 PolarHBondContact O-N 2.99Å; P379-M383 PolarHBondContact O-N 2.92Å; P379-M383 VanDerWaalsContact O-N 3.17Å
380	L	79.8	Confident	83.8	Confident	21 Å²	21	60.1 Å²	60.1	11%	0.11	30%	0.303	C	S	.	.	H	α-helix	trans	-60.4	-35.6	179.5	-112.5	75.2	0	0	0	113	F43 L357 S360 M376 G378 Y382 M383 V384	F43-L380 HydrophobicContact CE1-CD1 3.58Å; F43-L380 HydrophobicContact CZ-CD1 3.78Å; L357-L380 HydrophobicContact CD1-CG 4.37Å; S360-L380 WeakPolarHBondContact O-CD2 3.02Å; M376-L380 HydrophobicContact CG-CD2 4.3Å; G378-L380 PolarHBondContact O-N 3.27Å; G378-L380 VanDerWaalsContact O-N 3.07Å; L380-Y382 VanDerWaalsContact C-N 3.33Å; L380-Y382 PolarHBondContact O-N 3.41Å; L380-M383 HydrophobicContact CD1-SD 4.47Å; L380-M383 WeakPolarHBondContact O-CB 3.39Å; L380-M383 PolarHBondContact O-N 2.86Å; L380-V384 PolarHBondContact O-N 3.31Å; L380-V384 VanDerWaalsContact O-N 3.14Å
381	Q	82.7	Confident	84.8	Confident	101 Å²	101	60.5 Å²	60.5	47%	0.472	30%	0.296	S	S	.	.	H	α-helix	trans	-65.5	-39.9	179.7	-65.4	-175.7	-5	0	0	111.1	M376 G378 P379 M383 V384 W385	M376-Q381 HydrophobicContact CB-CG 4.4Å; M376-Q381 PolarHBondContact O-NE2 2.98Å; G378-Q381 PolarHBondContact O-N 3.5Å; G378-Q381 VanDerWaalsContact O-N 3.12Å; P379-Q381 VanDerWaalsContact C-N 3.28Å; P379-Q381 PolarHBondContact O-N 2.77Å; Q381-M383 VanDerWaalsContact C-N 3.34Å; Q381-V384 PolarHBondContact O-N 2.92Å; Q381-W385 VanDerWaalsContact O-CD1 3.28Å; Q381-W385 PolarHBondContact O-N 3.49Å
382	Y	87.6	Confident	85.5	Confident	178 Å²	178	60.3 Å²	60.3	70%	0.698	29%	0.293	S	S	*	.	H	α-helix	trans	-67	-36.1	175.9	-62.5	-75.7	0	0	0	111.8	P379 L380 V384 W385 Y386	P379-Y382 PolarHBondContact O-N 2.99Å; L380-Y382 VanDerWaalsContact C-N 3.33Å; L380-Y382 PolarHBondContact O-N 3.41Å; Y382-V384 VanDerWaalsContact C-N 3.32Å; Y382-V384 PolarHBondContact O-N 3.34Å; Y382-W385 PolarHBondContact O-N 2.89Å; Y382-Y386 VanDerWaalsContact O-CB 3.3Å; Y382-Y386 WeakPolarHBondContact O-CB 3.34Å; Y382-Y386 PolarHBondContact O-N 3.42Å
383	M	89.8	Confident	86.1	Confident	43 Å²	43	60.4 Å²	60.4	21%	0.212	29%	0.293	C	S	.	.	H	α-helix	trans	-61.5	-39.2	174.1	-65.6	177.8	178	0	0	112	I40 F43 L357 P379 L380 Q381 Y386 H387	I40-M383 HydrophobicContact CD1-CB 4.17Å; I40-M383 HydrophobicContact CD1-CG 4.34Å; I40-M383 HydrophobicContact CG1-CB 4.28Å; I40-M383 HydrophobicContact CG1-CG 4.12Å; I40-M383 HydrophobicContact CG2-CB 4.37Å; F43-M383 HydrophobicContact CD1-CE 4.1Å; F43-M383 HydrophobicContact CD1-SD 3.74Å; F43-M383 HydrophobicContact CE1-CE 4.18Å; F43-M383 HydrophobicContact CE1-SD 3.83Å; F43-M383 HydrophobicContact CG-CE 4.35Å; F43-M383 HydrophobicContact CG-SD 4.5Å; F43-M383 HydrophobicContact CZ-CE 4.48Å; L357-M383 HydrophobicContact CD1-CB 4.17Å; L357-M383 HydrophobicContact CD1-SD 4.29Å; L357-M383 HydrophobicContact CD2-CB 4.09Å; P379-M383 PolarHBondContact O-N 2.92Å; P379-M383 VanDerWaalsContact O-N 3.17Å; L380-M383 HydrophobicContact CD1-SD 4.47Å; L380-M383 WeakPolarHBondContact O-CB 3.39Å; L380-M383 PolarHBondContact O-N 2.86Å; Q381-M383 VanDerWaalsContact C-N 3.34Å; M383-Y386 PolarHBondContact O-N 3.36Å; M383-H387 VanDerWaalsContact O-CB 3.3Å; M383-H387 WeakPolarHBondContact O-CB 3.43Å; M383-H387 PolarHBondContact O-N 2.97Å
384	V	85.6	Confident	86.9	Confident	33 Å²	33	59.7 Å²	59.7	20%	0.2	29%	0.291	C	S	.	.	H	α-helix	trans	-63.2	-48.3	175.9	174.9	0	0	0	0	110.4	L357 M376 L380 Q381 Y382 Y386 H387 L388	L357-V384 HydrophobicContact CD2-CB 4.27Å; L357-V384 HydrophobicContact CD2-CG2 3.54Å; L357-V384 HydrophobicContact CG-CG2 4.02Å; M376-V384 HydrophobicContact SD-CG2 4.12Å; L380-V384 PolarHBondContact O-N 3.31Å; L380-V384 VanDerWaalsContact O-N 3.14Å; Q381-V384 PolarHBondContact O-N 2.92Å; Y382-V384 VanDerWaalsContact C-N 3.32Å; Y382-V384 PolarHBondContact O-N 3.34Å; V384-Y386 PolarHBondContact O-N 2.95Å; V384-H387 PolarHBondContact O-N 2.97Å; V384-L388 HydrophobicContact CG1-CD1 4.28Å; V384-L388 HydrophobicContact CG1-CG 4.47Å; V384-L388 WeakPolarHBondContact O-CG 3.48Å; V384-L388 PolarHBondContact O-N 3.33Å
385	W	88.6	Confident	87.6	Confident	167 Å²	167	58.7 Å²	58.7	63%	0.633	29%	0.29	S	S	*	.	H	α-helix	trans	-62.1	-42.2	177.4	-78	112.9	0	0	0	112.7	Q381 Y382 H387 L388 V389	Q381-W385 VanDerWaalsContact O-CD1 3.28Å; Q381-W385 PolarHBondContact O-N 3.49Å; Y382-W385 PolarHBondContact O-N 2.89Å; W385-H387 VanDerWaalsContact C-N 3.34Å; W385-H387 PolarHBondContact O-N 3.48Å; W385-L388 HydrophobicContact CD2-CD1 4.41Å; W385-L388 HydrophobicContact CE3-CD1 3.82Å; W385-L388 HydrophobicContact CZ3-CD1 4.01Å; W385-L388 WeakPolarHBondContact O-CB 3.22Å; W385-L388 PolarHBondContact O-N 3.24Å; W385-V389 WeakPolarHBondContact O-CG2 3.32Å; W385-V389 PolarHBondContact O-N 3.05Å
386	Y	93.5	Very high	88.5	Confident	70 Å²	70	55.9 Å²	55.9	28%	0.275	28%	0.277	S	S	.	.	H	α-helix	trans	-59.1	-46.1	174.9	-172.7	-83.4	0	0	0	111.5	F33 M37 I40 Y382 M383 V384 L388 V389 G390	F33-Y386 VanDerWaalsContact CA-OH 3.23Å; F33-Y386 WeakPolarHBondContact CA-OH 3.32Å; F33-Y386 HydrophobicContact CD2-CE1 4.21Å; F33-Y386 AromaticContact CD2-CE2 3.78Å; F33-Y386 HydrophobicContact CD2-CE2 3.78Å; F33-Y386 AromaticContact CD2-CZ 3.51Å; F33-Y386 WeakPolarHBondContact CD2-OH 3.25Å; F33-Y386 HydrophobicContact CE2-CD1 4.33Å; F33-Y386 HydrophobicContact CE2-CD2 4.15Å; F33-Y386 AromaticContact CE2-CE1 3.86Å; F33-Y386 HydrophobicContact CE2-CE1 3.86Å; F33-Y386 AromaticContact CE2-CE2 3.65Å; F33-Y386 HydrophobicContact CE2-CE2 3.65Å; F33-Y386 HydrophobicContact CE2-CG 4.48Å; F33-Y386 AromaticContact CE2-CZ 3.5Å; F33-Y386 HydrophobicContact CZ-CD1 4.39Å; F33-Y386 HydrophobicContact CZ-CE1 4.02Å; F33-Y386 PolarHBondContact O-OH 3.13Å; M37-Y386 HydrophobicContact CG-CD1 4.46Å; M37-Y386 HydrophobicContact CG-CE1 3.81Å; M37-Y386 HydrophobicContact SD-CD1 3.68Å; M37-Y386 HydrophobicContact SD-CE1 3.64Å; I40-Y386 HydrophobicContact CD1-CD1 3.34Å; I40-Y386 HydrophobicContact CD1-CE1 3.95Å; I40-Y386 HydrophobicContact CD1-CG 3.96Å; Y382-Y386 VanDerWaalsContact O-CB 3.3Å; Y382-Y386 WeakPolarHBondContact O-CB 3.34Å; Y382-Y386 PolarHBondContact O-N 3.42Å; M383-Y386 PolarHBondContact O-N 3.36Å; V384-Y386 PolarHBondContact O-N 2.95Å; Y386-L388 PolarHBondContact O-N 2.94Å; Y386-V389 PolarHBondContact O-N 3.36Å; Y386-G390 PolarHBondContact O-N 3.41Å
387	H	91.5	Very high	89.7	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.4	-38.8	177	-163.9	64.1	0	0	0	112.1	M37 W350 V353 M383 V384 W385 G390 L391	M37-H387 WeakPolarHBondContact CE-ND1 3.45Å; W350-H387 AromaticContact CD1-CD2 3.73Å; W350-H387 AromaticContact CD1-CE1 3.43Å; W350-H387 VanDerWaalsContact CD1-CE1 3.43Å; W350-H387 AromaticContact CD1-ND1 3.99Å; W350-H387 AromaticContact CD1-NE2 3.25Å; W350-H387 VanDerWaalsContact CD1-NE2 3.25Å; W350-H387 AromaticContact CD2-NE2 3.77Å; W350-H387 AromaticContact CE2-CD2 3.55Å; W350-H387 AromaticContact CE2-NE2 3.66Å; W350-H387 AromaticContact CG-CE1 3.98Å; W350-H387 AromaticContact CG-NE2 3.52Å; W350-H387 AromaticContact NE1-CD2 3.24Å; W350-H387 PolarHBondContact NE1-CD2 3.43Å; W350-H387 AromaticContact NE1-CE1 3.74Å; W350-H387 AromaticContact NE1-CG 3.68Å; W350-H387 AromaticContact NE1-ND1 3.99Å; W350-H387 AromaticContact NE1-NE2 3.29Å; W350-H387 PolarHBondContact NE1-NE2 2.87Å; W350-H387 PolarHBondContact NE1-O 2.89Å; W350-H387 PolarHBondContact O-NE2 3.44Å; V353-H387 VanDerWaalsContact CG1-CE1 3.43Å; V353-H387 WeakPolarHBondContact CG1-CE1 3.43Å; M383-H387 VanDerWaalsContact O-CB 3.3Å; M383-H387 WeakPolarHBondContact O-CB 3.43Å; M383-H387 PolarHBondContact O-N 2.97Å; V384-H387 PolarHBondContact O-N 2.97Å; W385-H387 VanDerWaalsContact C-N 3.34Å; W385-H387 PolarHBondContact O-N 3.48Å; H387-G390 PolarHBondContact O-N 3.33Å; H387-L391 PolarHBondContact O-N 3.38Å
388	L	89.8	Confident	90.8	Very high	60 Å²	60	50.4 Å²	50.4	31%	0.314	25%	0.252	S	S	.	.	H	α-helix	trans	-63.5	-43.5	174.1	-72.3	174.5	0	0	0	112.3	W350 V384 W385 Y386 G390 L391	W350-L388 HydrophobicContact CH2-CD2 3.97Å; W350-L388 HydrophobicContact CZ2-CD2 3.65Å; V384-L388 HydrophobicContact CG1-CD1 4.28Å; V384-L388 HydrophobicContact CG1-CG 4.47Å; V384-L388 WeakPolarHBondContact O-CG 3.48Å; V384-L388 PolarHBondContact O-N 3.33Å; W385-L388 HydrophobicContact CD2-CD1 4.41Å; W385-L388 HydrophobicContact CE3-CD1 3.82Å; W385-L388 HydrophobicContact CZ3-CD1 4.01Å; W385-L388 WeakPolarHBondContact O-CB 3.22Å; W385-L388 PolarHBondContact O-N 3.24Å; Y386-L388 PolarHBondContact O-N 2.94Å; L388-G390 VanDerWaalsContact C-N 3.25Å; L388-G390 PolarHBondContact O-N 3.48Å; L388-L391 VanDerWaalsContact O-CB 3.31Å; L388-L391 WeakPolarHBondContact O-CB 3.28Å; L388-L391 PolarHBondContact O-N 2.8Å
389	V	94.4	Very high	91.5	Very high	50 Å²	50	51.7 Å²	51.7	30%	0.303	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-39.2	173.6	172.5	0	0	0	0	110.2	F33 W385 Y386 L391 I392 W393 I454	F33-V389 HydrophobicContact CE2-CG1 4.36Å; F33-V389 HydrophobicContact CZ-CG1 4.29Å; W385-V389 WeakPolarHBondContact O-CG2 3.32Å; W385-V389 PolarHBondContact O-N 3.05Å; Y386-V389 PolarHBondContact O-N 3.36Å; V389-L391 VanDerWaalsContact C-N 3.3Å; V389-L391 PolarHBondContact O-N 2.62Å; V389-I392 PolarHBondContact O-N 3.35Å; V389-I392 VanDerWaalsContact O-N 3.15Å; V389-W393 PolarHBondContact O-N 3.46Å; V389-I454 HydrophobicContact CG1-CD1 4.2Å; V389-I454 HydrophobicContact CG2-CD1 4.13Å
390	G	94.9	Very high	92.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-35	176.6	0	0	0	0	0	113.7	F346 Y386 H387 L388 I392 I394	F346-G390 WeakPolarHBondContact CZ-O 3.37Å; Y386-G390 PolarHBondContact O-N 3.41Å; H387-G390 PolarHBondContact O-N 3.33Å; L388-G390 VanDerWaalsContact C-N 3.25Å; L388-G390 PolarHBondContact O-N 3.48Å; G390-I392 VanDerWaalsContact C-N 3.29Å; G390-I392 PolarHBondContact O-N 3.31Å; G390-I394 VanDerWaalsContact O-CB 3.29Å; G390-I394 WeakPolarHBondContact O-CB 3.32Å; G390-I394 WeakPolarHBondContact O-CG1 3.38Å; G390-I394 PolarHBondContact O-N 2.97Å
391	L	94.4	Very high	92.9	Very high	44 Å²	44	48.3 Å²	48.3	23%	0.23	22%	0.224	C	C	.	.	H	α-helix	trans	-54.6	-47.7	173.5	-177.1	59.7	0	0	0	111.2	F346 W350 H387 L388 V389 S395	F346-L391 HydrophobicContact CE1-CD1 4.04Å; W350-L391 HydrophobicContact CD2-CB 4.4Å; W350-L391 HydrophobicContact CD2-CD1 3.86Å; W350-L391 HydrophobicContact CD2-CD2 4.44Å; W350-L391 HydrophobicContact CD2-CG 4.45Å; W350-L391 HydrophobicContact CE3-CD1 4.29Å; W350-L391 HydrophobicContact CG-CD1 3.95Å; W350-L391 HydrophobicContact CH2-CD2 3.91Å; W350-L391 HydrophobicContact CZ2-CB 4.01Å; W350-L391 HydrophobicContact CZ2-CD2 3.79Å; W350-L391 HydrophobicContact CZ2-CG 4.35Å; W350-L391 HydrophobicContact CZ3-CD2 4.32Å; H387-L391 PolarHBondContact O-N 3.38Å; L388-L391 VanDerWaalsContact O-CB 3.31Å; L388-L391 WeakPolarHBondContact O-CB 3.28Å; L388-L391 PolarHBondContact O-N 2.8Å; V389-L391 VanDerWaalsContact C-N 3.3Å; V389-L391 PolarHBondContact O-N 2.62Å; L391-S395 WeakPolarHBondContact O-CB 3.09Å; L391-S395 PolarHBondContact O-N 3.37Å; L391-S395 PolarHBondContact O-OG 2.95Å
392	I	94.9	Very high	93.5	Very high	31 Å²	31	44.6 Å²	44.6	16%	0.159	21%	0.207	C	C	.	.	H	α-helix	trans	-76.2	-52.2	-174.3	-58.7	168.7	0	0	0	109.2	V389 G390 I394 S395 E396 T450 K453 I454 I457	V389-I392 PolarHBondContact O-N 3.35Å; V389-I392 VanDerWaalsContact O-N 3.15Å; G390-I392 VanDerWaalsContact C-N 3.29Å; G390-I392 PolarHBondContact O-N 3.31Å; I392-I394 PolarHBondContact O-N 3.48Å; I392-S395 PolarHBondContact O-N 2.9Å; I392-E396 HydrophobicContact CG2-CG 4.42Å; I392-E396 WeakPolarHBondContact O-CG 3.4Å; I392-E396 PolarHBondContact O-N 2.85Å; I392-T450 HydrophobicContact CB-CG2 4.26Å; I392-T450 HydrophobicContact CG2-CG2 3.83Å; I392-K453 HydrophobicContact CG2-CB 4.38Å; I392-K453 HydrophobicContact CG2-CD 4.04Å; I392-K453 HydrophobicContact CG2-CG 4.28Å; I392-I454 HydrophobicContact CD1-CD1 4.45Å; I392-I454 HydrophobicContact CD1-CG1 3.59Å; I392-I457 HydrophobicContact CD1-CD1 3.98Å
393	W	97.4	Very high	93.8	Very high	8 Å²	8	37.5 Å²	37.5	3%	0.03	18%	0.18	C	C	.	.	H	α-helix	trans	-64.1	-45.1	-173.6	-167.3	8.8	0	0	0	112.9	I29 F30 F33 V389 S395 E396 F397 A443 S446 F447 T450	I29-W393 HydrophobicContact CG2-CH2 4.06Å; F30-W393 HydrophobicContact CB-CH2 4.38Å; F30-W393 HydrophobicContact CB-CZ2 4.2Å; F30-W393 HydrophobicContact CD2-CD2 4.09Å; F30-W393 AromaticContact CD2-CE2 3.64Å; F30-W393 HydrophobicContact CD2-CE3 4.48Å; F30-W393 HydrophobicContact CD2-CH2 4.11Å; F30-W393 AromaticContact CD2-CZ2 3.66Å; F30-W393 HydrophobicContact CD2-CZ2 3.66Å; F30-W393 HydrophobicContact CD2-CZ3 4.49Å; F30-W393 AromaticContact CD2-NE1 4Å; F30-W393 HydrophobicContact CE2-CD2 4.32Å; F30-W393 HydrophobicContact CG-CZ2 4.41Å; F33-W393 HydrophobicContact CB-CE3 4.37Å; F33-W393 HydrophobicContact CB-CH2 4.4Å; F33-W393 HydrophobicContact CB-CZ3 3.74Å; F33-W393 AromaticContact CD1-CE3 3.76Å; F33-W393 HydrophobicContact CD1-CE3 3.76Å; F33-W393 HydrophobicContact CD1-CZ3 4.01Å; F33-W393 AromaticContact CD2-CE3 3.89Å; F33-W393 HydrophobicContact CD2-CE3 3.89Å; F33-W393 AromaticContact CD2-CZ3 3.67Å; F33-W393 HydrophobicContact CD2-CZ3 3.67Å; F33-W393 AromaticContact CE1-CE3 4Å; F33-W393 HydrophobicContact CE1-CE3 4Å; F33-W393 HydrophobicContact CE2-CE3 4.11Å; F33-W393 HydrophobicContact CE2-CZ3 4.31Å; F33-W393 AromaticContact CG-CE3 3.72Å; F33-W393 HydrophobicContact CG-CE3 3.72Å; F33-W393 AromaticContact CG-CZ3 3.51Å; F33-W393 HydrophobicContact CG-CZ3 3.51Å; F33-W393 HydrophobicContact CZ-CE3 4.17Å; V389-W393 PolarHBondContact O-N 3.46Å; W393-S395 VanDerWaalsContact C-N 3.34Å; W393-S395 PolarHBondContact O-N 3.14Å; W393-E396 PolarHBondContact O-N 2.99Å; W393-F397 WeakPolarHBondContact O-CB 3.33Å; W393-F397 PolarHBondContact O-N 3.25Å; W393-A443 PolarHBondContact NE1-O 3.5Å; W393-S446 PolarHBondContact NE1-OG 3.23Å; W393-F447 AromaticContact CD2-CD2 3.83Å; W393-F447 HydrophobicContact CD2-CD2 3.83Å; W393-F447 AromaticContact CE2-CD2 3.53Å; W393-F447 HydrophobicContact CE3-CD2 4.12Å; W393-F447 HydrophobicContact CE3-CE2 4.48Å; W393-F447 HydrophobicContact CG-CD2 4.46Å; W393-F447 AromaticContact CH2-CD2 3.86Å; W393-F447 HydrophobicContact CH2-CD2 3.86Å; W393-F447 HydrophobicContact CH2-CE2 4.29Å; W393-F447 HydrophobicContact CZ2-CB 3.84Å; W393-F447 AromaticContact CZ2-CD2 3.56Å; W393-F447 HydrophobicContact CZ2-CD2 3.56Å; W393-F447 HydrophobicContact CZ2-CE2 4.42Å; W393-F447 AromaticContact CZ2-CG 3.97Å; W393-F447 HydrophobicContact CZ2-CG 3.97Å; W393-F447 HydrophobicContact CZ3-CD2 4.13Å; W393-F447 HydrophobicContact CZ3-CE2 4.32Å; W393-T450 WeakPolarHBondContact CA-OG1 3.38Å; W393-T450 HydrophobicContact CB-CG2 4.06Å
394	I	97.1	Very high	94.1	Very high	22 Å²	22	35.5 Å²	35.5	11%	0.113	17%	0.17	C	C	.	.	H	α-helix	trans	-69.1	-35.8	-179.7	-62.7	170.3	0	0	0	110.7	F30 F33 M37 F346 G390 I392 F397 I398	F30-I394 HydrophobicContact CE2-CG1 4.37Å; F30-I394 HydrophobicContact CZ-CG1 4.46Å; F33-I394 HydrophobicContact CE1-CD1 4.41Å; M37-I394 HydrophobicContact CE-CD1 4.32Å; M37-I394 HydrophobicContact CG-CD1 4.24Å; F346-I394 HydrophobicContact CD1-CG2 4.17Å; F346-I394 HydrophobicContact CD2-CB 4.46Å; F346-I394 HydrophobicContact CD2-CG2 3.76Å; F346-I394 HydrophobicContact CE1-CB 3.96Å; F346-I394 HydrophobicContact CE1-CG2 4.04Å; F346-I394 HydrophobicContact CE2-CB 3.85Å; F346-I394 HydrophobicContact CE2-CD1 3.64Å; F346-I394 HydrophobicContact CE2-CG1 4.34Å; F346-I394 HydrophobicContact CE2-CG2 3.63Å; F346-I394 HydrophobicContact CG-CG2 4.04Å; F346-I394 HydrophobicContact CZ-CB 3.57Å; F346-I394 HydrophobicContact CZ-CD1 3.91Å; F346-I394 HydrophobicContact CZ-CG1 4.28Å; F346-I394 HydrophobicContact CZ-CG2 3.79Å; G390-I394 VanDerWaalsContact O-CB 3.29Å; G390-I394 WeakPolarHBondContact O-CB 3.32Å; G390-I394 WeakPolarHBondContact O-CG1 3.38Å; G390-I394 PolarHBondContact O-N 2.97Å; I392-I394 PolarHBondContact O-N 3.48Å; I394-F397 WeakPolarHBondContact O-CB 3.32Å; I394-F397 PolarHBondContact O-N 3.32Å; I394-I398 HydrophobicContact CG2-CD1 4.01Å; I394-I398 HydrophobicContact CG2-CG1 4.45Å; I394-I398 VanDerWaalsContact O-CG1 3.3Å; I394-I398 WeakPolarHBondContact O-CG1 3.35Å; I394-I398 PolarHBondContact O-N 3.39Å
395	S	95.4	Very high	94.5	Very high	27 Å²	27	34 Å²	34	19%	0.189	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-46	174	-60.9	0	0	0	0	111.7	L391 I392 W393 F397 I398 L399	L391-S395 WeakPolarHBondContact O-CB 3.09Å; L391-S395 PolarHBondContact O-N 3.37Å; L391-S395 PolarHBondContact O-OG 2.95Å; I392-S395 PolarHBondContact O-N 2.9Å; W393-S395 VanDerWaalsContact C-N 3.34Å; W393-S395 PolarHBondContact O-N 3.14Å; S395-F397 VanDerWaalsContact C-N 3.28Å; S395-F397 PolarHBondContact O-N 3.25Å; S395-I398 PolarHBondContact O-N 3.21Å; S395-L399 WeakPolarHBondContact O-CG 3.29Å; S395-L399 PolarHBondContact O-N 3.01Å; S395-L399 VanDerWaalsContact O-N 3.09Å
396	E	96.1	Very high	94.8	Very high	15 Å²	15	26 Å²	26	7%	0.07	13%	0.131	C	C	.	.	H	α-helix	trans	-63.1	-35.7	174.4	-67.9	-54.4	142	0	0	111.8	I392 W393 L399 A400 I449 K453	I392-E396 HydrophobicContact CG2-CG 4.42Å; I392-E396 WeakPolarHBondContact O-CG 3.4Å; I392-E396 PolarHBondContact O-N 2.85Å; W393-E396 PolarHBondContact O-N 2.99Å; E396-L399 PolarHBondContact O-N 3.34Å; E396-A400 WeakPolarHBondContact O-CB 3.25Å; E396-A400 PolarHBondContact O-N 2.81Å; E396-I449 HydrophobicContact CG-CG2 4.15Å; E396-K453 WeakPolarHBondContact OE1-CD 3.31Å; E396-K453 IonicContact OE1-NZ 3.31Å; E396-K453 PolarHBondContact OE1-NZ 3.37Å
397	F	97.5	Very high	94.9	Very high	21 Å²	21	22.7 Å²	22.7	9%	0.092	12%	0.118	C	C	.	.	H	α-helix	trans	-63.5	-45.2	175.5	-178.4	-88.1	0	0	0	111.8	F30 W393 I394 S395 L399 A400 F401 M439 V442 A443	F30-F397 HydrophobicContact CD1-CD2 4.16Å; F30-F397 AromaticContact CD1-CE2 3.9Å; F30-F397 HydrophobicContact CD1-CE2 3.9Å; F30-F397 HydrophobicContact CD1-CZ 4.28Å; F30-F397 HydrophobicContact CD2-CD2 4.38Å; F30-F397 AromaticContact CE1-CD1 3.95Å; F30-F397 HydrophobicContact CE1-CD1 3.95Å; F30-F397 AromaticContact CE1-CD2 3.67Å; F30-F397 HydrophobicContact CE1-CD2 3.67Å; F30-F397 AromaticContact CE1-CE1 3.88Å; F30-F397 HydrophobicContact CE1-CE1 3.88Å; F30-F397 AromaticContact CE1-CE2 3.6Å; F30-F397 HydrophobicContact CE1-CE2 3.6Å; F30-F397 AromaticContact CE1-CG 3.85Å; F30-F397 HydrophobicContact CE1-CG 3.85Å; F30-F397 AromaticContact CE1-CZ 3.71Å; F30-F397 HydrophobicContact CE1-CZ 3.71Å; F30-F397 HydrophobicContact CE2-CB 4.06Å; F30-F397 AromaticContact CE2-CD2 3.9Å; F30-F397 HydrophobicContact CE2-CD2 3.9Å; F30-F397 AromaticContact CE2-CG 3.97Å; F30-F397 HydrophobicContact CE2-CG 3.97Å; F30-F397 HydrophobicContact CG-CD2 4.49Å; F30-F397 HydrophobicContact CZ-CB 3.84Å; F30-F397 AromaticContact CZ-CD1 3.72Å; F30-F397 HydrophobicContact CZ-CD1 3.72Å; F30-F397 AromaticContact CZ-CD2 3.52Å; F30-F397 HydrophobicContact CZ-CD2 3.52Å; F30-F397 HydrophobicContact CZ-CE1 4.15Å; F30-F397 AromaticContact CZ-CE2 3.98Å; F30-F397 HydrophobicContact CZ-CE2 3.98Å; F30-F397 AromaticContact CZ-CG 3.39Å; F30-F397 HydrophobicContact CZ-CG 3.39Å; F30-F397 HydrophobicContact CZ-CZ 4.27Å; W393-F397 WeakPolarHBondContact O-CB 3.33Å; W393-F397 PolarHBondContact O-N 3.25Å; I394-F397 WeakPolarHBondContact O-CB 3.32Å; I394-F397 PolarHBondContact O-N 3.32Å; S395-F397 VanDerWaalsContact C-N 3.28Å; S395-F397 PolarHBondContact O-N 3.25Å; F397-L399 VanDerWaalsContact C-N 3.34Å; F397-L399 PolarHBondContact O-N 3.39Å; F397-A400 PolarHBondContact O-N 3.04Å; F397-F401 WeakPolarHBondContact O-CB 3.12Å; F397-F401 PolarHBondContact O-N 3.3Å; F397-M439 HydrophobicContact CZ-CE 3.89Å; F397-V442 HydrophobicContact CD2-CG1 3.82Å; F397-V442 HydrophobicContact CE2-CB 4.07Å; F397-V442 HydrophobicContact CE2-CG1 3.66Å; F397-V442 HydrophobicContact CG-CG1 4.36Å; F397-V442 HydrophobicContact CZ-CG1 4.08Å; F397-A443 HydrophobicContact CD2-CB 4.27Å; F397-A443 HydrophobicContact CE2-CB 4.03Å
398	I	95.9	Very high	95	Very high	34 Å²	34	22.7 Å²	22.7	17%	0.174	12%	0.118	C	C	.	.	H	α-helix	trans	-61.8	-43	177.5	-67.8	163.6	0	0	0	110.5	T339 L343 F346 I394 S395 F401 Q402	T339-I398 HydrophobicContact CG2-CG2 3.95Å; L343-I398 HydrophobicContact CD2-CB 4.04Å; L343-I398 HydrophobicContact CD2-CD1 3.99Å; L343-I398 HydrophobicContact CD2-CG2 3.99Å; L343-I398 HydrophobicContact CG-CG2 3.93Å; F346-I398 HydrophobicContact CB-CD1 4.06Å; F346-I398 HydrophobicContact CD1-CD1 4.46Å; F346-I398 HydrophobicContact CG-CD1 4.32Å; I394-I398 HydrophobicContact CG2-CD1 4.01Å; I394-I398 HydrophobicContact CG2-CG1 4.45Å; I394-I398 VanDerWaalsContact O-CG1 3.3Å; I394-I398 WeakPolarHBondContact O-CG1 3.35Å; I394-I398 PolarHBondContact O-N 3.39Å; S395-I398 PolarHBondContact O-N 3.21Å; I398-F401 PolarHBondContact O-N 3.03Å; I398-Q402 PolarHBondContact O-N 3.49Å
399	L	93.7	Very high	95.2	Very high	63 Å²	63	19.9 Å²	19.9	33%	0.33	10%	0.103	S	C	.	.	H	α-helix	trans	-65.8	-43.7	175.9	-67.5	173.6	0	0	0	112.2	T339 L343 S395 E396 F397 F401 Q402 Q403	T339-L399 HydrophobicContact CG2-CD2 3.94Å; L343-L399 HydrophobicContact CD1-CD2 4.06Å; S395-L399 WeakPolarHBondContact O-CG 3.29Å; S395-L399 PolarHBondContact O-N 3.01Å; S395-L399 VanDerWaalsContact O-N 3.09Å; E396-L399 PolarHBondContact O-N 3.34Å; F397-L399 VanDerWaalsContact C-N 3.34Å; F397-L399 PolarHBondContact O-N 3.39Å; L399-F401 VanDerWaalsContact C-N 3.3Å; L399-F401 PolarHBondContact O-N 3.39Å; L399-Q402 WeakPolarHBondContact O-CB 3.3Å; L399-Q402 PolarHBondContact O-N 3.28Å; L399-Q403 PolarHBondContact O-N 3.1Å; L399-Q403 VanDerWaalsContact O-N 3.08Å
400	A	95.3	Very high	95.2	Very high	2 Å²	2	17.5 Å²	17.5	2%	0.017	9%	0.089	C	C	.	.	H	α-helix	trans	-64.5	-34.5	176.9	0	0	0	0	0	112.4	E396 F397 Q402 Q403 M404 V442 Y500	E396-A400 WeakPolarHBondContact O-CB 3.25Å; E396-A400 PolarHBondContact O-N 2.81Å; F397-A400 PolarHBondContact O-N 3.04Å; A400-Q402 VanDerWaalsContact C-N 3.34Å; A400-Q403 PolarHBondContact O-N 3.14Å; A400-M404 WeakPolarHBondContact O-CB 3.43Å; A400-M404 PolarHBondContact O-N 2.8Å; A400-V442 HydrophobicContact CB-CG1 3.7Å; A400-Y500 HydrophobicContact CB-CE2 3.97Å; A400-Y500 WeakPolarHBondContact CB-OH 3.3Å
401	F	95.8	Very high	95.1	Very high	46 Å²	46	17.7 Å²	17.7	20%	0.202	9%	0.09	C	C	.	.	H	α-helix	trans	-62.9	-41.8	174.5	-176.7	-89.3	0	0	0	111.5	F397 I398 L399 T405 T434 L435 V442	F397-F401 WeakPolarHBondContact O-CB 3.12Å; F397-F401 PolarHBondContact O-N 3.3Å; I398-F401 PolarHBondContact O-N 3.03Å; L399-F401 VanDerWaalsContact C-N 3.3Å; L399-F401 PolarHBondContact O-N 3.39Å; F401-T405 WeakPolarHBondContact O-CB 3.46Å; F401-T405 PolarHBondContact O-N 3.33Å; F401-T405 PolarHBondContact O-OG1 3.31Å; F401-T434 HydrophobicContact CD2-CG2 3.63Å; F401-T434 HydrophobicContact CE2-CG2 3.52Å; F401-T434 HydrophobicContact CZ-CG2 4.34Å; F401-L435 HydrophobicContact CE2-CD2 3.57Å; F401-L435 HydrophobicContact CE2-CG 3.72Å; F401-L435 HydrophobicContact CZ-CD1 4.37Å; F401-L435 HydrophobicContact CZ-CD2 3.95Å; F401-L435 HydrophobicContact CZ-CG 3.8Å; F401-V442 HydrophobicContact CB-CG1 4.23Å
402	Q	94	Very high	94.9	Very high	22 Å²	22	16.9 Å²	16.9	10%	0.103	9%	0.087	C	C	.	.	H	α-helix	trans	-60.5	-48.5	173.4	-174.4	-165.7	-31.5	0	0	110.9	T339 I398 L399 A400 T405 I406	T339-Q402 HydrophobicContact CG2-CB 4.48Å; T339-Q402 WeakPolarHBondContact OG1-CG 3.23Å; T339-Q402 PolarHBondContact OG1-OE1 3.46Å; I398-Q402 PolarHBondContact O-N 3.49Å; L399-Q402 WeakPolarHBondContact O-CB 3.3Å; L399-Q402 PolarHBondContact O-N 3.28Å; A400-Q402 VanDerWaalsContact C-N 3.34Å; Q402-T405 PolarHBondContact O-N 2.89Å; Q402-I406 HydrophobicContact CG-CD1 3.87Å; Q402-I406 WeakPolarHBondContact O-CG1 3.4Å; Q402-I406 PolarHBondContact O-N 2.98Å
403	Q	93.9	Very high	94.7	Very high	30 Å²	30	16.4 Å²	16.4	14%	0.14	8%	0.083	C	C	.	.	H	α-helix	trans	-58.8	-48.9	180	-75	-179.7	-28.8	0	0	112.2	L399 A400 T405 I406 A407 Y500	L399-Q403 PolarHBondContact O-N 3.1Å; L399-Q403 VanDerWaalsContact O-N 3.08Å; A400-Q403 PolarHBondContact O-N 3.14Å; Q403-T405 VanDerWaalsContact C-N 3.31Å; Q403-T405 PolarHBondContact O-N 3.3Å; Q403-I406 PolarHBondContact O-N 3.47Å; Q403-A407 VanDerWaalsContact O-CB 3.3Å; Q403-A407 WeakPolarHBondContact O-CB 3.42Å; Q403-A407 PolarHBondContact O-N 3.14Å; Q403-Y500 HydrophobicContact CB-CD2 3.89Å; Q403-Y500 HydrophobicContact CB-CE2 4.28Å
404	M	95.3	Very high	94.4	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.005	8%	0.084	C	C	.	.	H	α-helix	trans	-62.3	-38.4	177.4	-175.1	61.2	-170.7	0	0	112.2	A400 A407 G408 T434 H438 V442 Y500 T503 A504	A400-M404 WeakPolarHBondContact O-CB 3.43Å; A400-M404 PolarHBondContact O-N 2.8Å; M404-A407 PolarHBondContact O-N 3.01Å; M404-G408 PolarHBondContact O-N 3.25Å; M404-T434 HydrophobicContact CB-CG2 4.07Å; M404-T434 HydrophobicContact CG-CG2 3.7Å; M404-H438 HydrophobicContact CE-CB 3.75Å; M404-V442 HydrophobicContact CB-CG2 3.84Å; M404-V442 HydrophobicContact CG-CG2 3.95Å; M404-Y500 HydrophobicContact CB-CG 4.45Å; M404-Y500 HydrophobicContact SD-CD1 4.29Å; M404-Y500 HydrophobicContact SD-CG 4.3Å; M404-Y500 VanDerWaalsContact SD-O 3.41Å; M404-T503 HydrophobicContact CE-CG2 3.63Å; M404-A504 HydrophobicContact CE-CB 4.23Å
405	T	95.1	Very high	94	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-68	-44	178.8	-61.1	0	0	0	0	111.9	H335 F401 Q402 Q403 A407 G408 A409 V427 S430 S431	H335-T405 WeakPolarHBondContact NE2-CB 3.32Å; H335-T405 WeakPolarHBondContact NE2-CG2 3.21Å; F401-T405 WeakPolarHBondContact O-CB 3.46Å; F401-T405 PolarHBondContact O-N 3.33Å; F401-T405 PolarHBondContact O-OG1 3.31Å; Q402-T405 PolarHBondContact O-N 2.89Å; Q403-T405 VanDerWaalsContact C-N 3.31Å; Q403-T405 PolarHBondContact O-N 3.3Å; T405-A407 VanDerWaalsContact C-N 3.34Å; T405-G408 PolarHBondContact O-N 3.39Å; T405-A409 WeakPolarHBondContact O-CB 3.36Å; T405-A409 PolarHBondContact O-N 3.24Å; T405-V427 HydrophobicContact CG2-CG1 4.49Å; T405-S430 PolarHBondContact O-OG 2.87Å; T405-S431 WeakPolarHBondContact CG2-OG 3.43Å
406	I	94.6	Very high	93.6	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-61.6	-46.9	174.9	-67	164.9	0	0	0	109.4	L332 Q402 Q403 G408 A409 V410 L588 V592	L332-I406 HydrophobicContact CD2-CG1 4.37Å; Q402-I406 HydrophobicContact CG-CD1 3.87Å; Q402-I406 WeakPolarHBondContact O-CG1 3.4Å; Q402-I406 PolarHBondContact O-N 2.98Å; Q403-I406 PolarHBondContact O-N 3.47Å; I406-G408 VanDerWaalsContact C-N 3.34Å; I406-G408 PolarHBondContact O-N 3.01Å; I406-A409 PolarHBondContact O-N 2.84Å; I406-V410 HydrophobicContact CG2-CG2 4.03Å; I406-V410 WeakPolarHBondContact O-CB 3.37Å; I406-V410 VanDerWaalsContact O-CG2 3.25Å; I406-V410 WeakPolarHBondContact O-CG2 3.33Å; I406-V410 PolarHBondContact O-N 3.18Å; I406-L588 HydrophobicContact CD1-CD1 3.53Å; I406-L588 HydrophobicContact CG1-CD1 4.37Å; I406-V592 HydrophobicContact CG2-CG2 3.85Å
407	A	95.1	Very high	93	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-55.4	-47.9	177.9	0	0	0	0	0	112.1	Q403 M404 T405 S411 A504 V595	Q403-A407 VanDerWaalsContact O-CB 3.3Å; Q403-A407 WeakPolarHBondContact O-CB 3.42Å; Q403-A407 PolarHBondContact O-N 3.14Å; M404-A407 PolarHBondContact O-N 3.01Å; T405-A407 VanDerWaalsContact C-N 3.34Å; A407-S411 VanDerWaalsContact O-CB 3.23Å; A407-S411 WeakPolarHBondContact O-CB 3.31Å; A407-S411 PolarHBondContact O-N 2.06Å; A407-S411 PolarHBondContact O-OG 3.37Å; A407-A504 HydrophobicContact CB-CB 4.05Å; A407-V595 HydrophobicContact CB-CG2 3.96Å
408	G	93.9	Very high	92.4	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.01	12%	0.117	C	C	.	.	H	α-helix	trans	-64.4	-38.5	176.7	0	0	0	0	0	114.7	M404 T405 I406 S411 T412 S430	M404-G408 PolarHBondContact O-N 3.25Å; T405-G408 PolarHBondContact O-N 3.39Å; I406-G408 VanDerWaalsContact C-N 3.34Å; I406-G408 PolarHBondContact O-N 3.01Å; G408-S411 PolarHBondContact O-OG 2.88Å; G408-T412 VanDerWaalsContact O-CB 3.27Å; G408-T412 WeakPolarHBondContact O-CB 3.27Å; G408-T412 PolarHBondContact O-N 3.49Å; G408-T412 VanDerWaalsContact O-N 3.1Å; G408-T412 PolarHBondContact O-OG1 3.44Å; G408-S430 VanDerWaalsContact C-OG 3.28Å; G408-S430 VanDerWaalsContact CA-OG 3.28Å; G408-S430 WeakPolarHBondContact CA-OG 3.41Å
409	A	93.9	Very high	91.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-71	-45.2	-180	0	0	0	0	0	111.2	L329 L332 T405 I406 T412 Y413 T426 V427 S430	L329-A409 HydrophobicContact CD1-CB 4.27Å; L332-A409 HydrophobicContact CD2-CB 4.28Å; T405-A409 WeakPolarHBondContact O-CB 3.36Å; T405-A409 PolarHBondContact O-N 3.24Å; I406-A409 PolarHBondContact O-N 2.84Å; A409-T412 PolarHBondContact O-N 3.43Å; A409-Y413 PolarHBondContact O-N 2.98Å; A409-T426 HydrophobicContact CB-CG2 4.38Å; A409-V427 HydrophobicContact CB-CG2 4.1Å; A409-S430 PolarHBondContact N-OG 3.18Å; A409-S430 VanDerWaalsContact N-OG 3.13Å
410	V	93.9	Very high	91.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-70.6	-41.5	-178.9	176.9	0	0	0	0	110.9	V325 L332 I406 Y413 F414 V592 V595 L596	V325-V410 HydrophobicContact CG1-CG1 4.48Å; V325-V410 HydrophobicContact CG1-CG2 4.13Å; L332-V410 HydrophobicContact CD1-CG2 4.29Å; I406-V410 HydrophobicContact CG2-CG2 4.03Å; I406-V410 WeakPolarHBondContact O-CB 3.37Å; I406-V410 VanDerWaalsContact O-CG2 3.25Å; I406-V410 WeakPolarHBondContact O-CG2 3.33Å; I406-V410 PolarHBondContact O-N 3.18Å; V410-Y413 PolarHBondContact O-N 3.41Å; V410-F414 VanDerWaalsContact O-CB 3.29Å; V410-F414 WeakPolarHBondContact O-CB 3.45Å; V410-F414 PolarHBondContact O-N 2.92Å; V410-V592 HydrophobicContact CG1-CG1 4.16Å; V410-V592 HydrophobicContact CG2-CB 4.43Å; V410-V592 HydrophobicContact CG2-CG1 3.84Å; V410-V592 HydrophobicContact CG2-CG2 4.1Å; V410-V595 HydrophobicContact CB-CB 4.3Å; V410-V595 HydrophobicContact CB-CG1 3.63Å; V410-V595 HydrophobicContact CG1-CB 4.09Å; V410-V595 HydrophobicContact CG1-CG1 3.56Å; V410-L596 HydrophobicContact CG1-CD2 3.63Å; V410-L596 HydrophobicContact CG1-CG 3.72Å
411	S	93.1	Very high	90.6	Very high	4 Å²	4	36.3 Å²	36.3	3%	0.028	18%	0.176	C	C	.	.	H	α-helix	trans	-64.1	-40.6	175.5	70.8	0	0	0	0	111.9	A407 G408 F414 F415	A407-S411 VanDerWaalsContact O-CB 3.23Å; A407-S411 WeakPolarHBondContact O-CB 3.31Å; A407-S411 PolarHBondContact O-N 2.06Å; A407-S411 PolarHBondContact O-OG 3.37Å; G408-S411 PolarHBondContact O-OG 2.88Å; S411-F414 WeakPolarHBondContact O-CB 3.46Å; S411-F414 PolarHBondContact O-N 3.41Å; S411-F415 WeakPolarHBondContact O-CD2 3.28Å; S411-F415 PolarHBondContact O-N 3Å
412	T	91.1	Very high	90	Very high	28 Å²	28	35.5 Å²	35.5	17%	0.172	17%	0.174	C	C	.	.	H	α-helix	trans	-62.2	-46.9	174.8	-57.6	0	0	0	0	110.8	G408 A409 F414 T416 L422 T426	G408-T412 VanDerWaalsContact O-CB 3.27Å; G408-T412 WeakPolarHBondContact O-CB 3.27Å; G408-T412 PolarHBondContact O-N 3.49Å; G408-T412 VanDerWaalsContact O-N 3.1Å; G408-T412 PolarHBondContact O-OG1 3.44Å; A409-T412 PolarHBondContact O-N 3.43Å; T412-F414 VanDerWaalsContact C-N 3.3Å; T412-F414 PolarHBondContact O-N 2.89Å; T412-T416 WeakPolarHBondContact O-CB 3.34Å; T412-T416 PolarHBondContact O-N 3.37Å; T412-T416 VanDerWaalsContact O-N 3.17Å; T412-T416 PolarHBondContact O-OG1 3.19Å; T412-L422 HydrophobicContact CG2-CD2 4.42Å; T412-T426 HydrophobicContact CG2-CG2 4.29Å
413	Y	91.5	Very high	89.3	Confident	20 Å²	20	37.2 Å²	37.2	8%	0.078	19%	0.187	C	C	.	.	H	α-helix	trans	-58.3	-43	174.4	169.9	-90.2	0	0	0	112.1	V325 S328 L329 A409 V410 K419 L422	V325-Y413 HydrophobicContact CB-CD1 4.37Å; V325-Y413 HydrophobicContact CB-CE1 4.3Å; V325-Y413 HydrophobicContact CG1-CD1 4.28Å; V325-Y413 HydrophobicContact CG2-CD1 3.7Å; V325-Y413 HydrophobicContact CG2-CE1 3.55Å; S328-Y413 VanDerWaalsContact OG-CE2 3.29Å; S328-Y413 WeakPolarHBondContact OG-CE2 3.23Å; L329-Y413 HydrophobicContact CD1-CG 4.41Å; L329-Y413 HydrophobicContact CG-CD2 4.49Å; A409-Y413 PolarHBondContact O-N 2.98Å; V410-Y413 PolarHBondContact O-N 3.41Å; Y413-K419 HydrophobicContact CD2-CD 4.34Å; Y413-K419 HydrophobicContact CE2-CD 3.93Å; Y413-K419 PolarHBondContact O-NZ 3.38Å; Y413-L422 HydrophobicContact CD2-CD1 3.67Å; Y413-L422 HydrophobicContact CE2-CD1 4.27Å
414	F	90.1	Very high	88.4	Confident	9 Å²	9	44.3 Å²	44.3	4%	0.039	22%	0.22	C	C	.	.	H	α-helix	trans	-63.3	-54	-177.1	-172.3	-85.5	0	0	0	112.4	V410 S411 T412 T416 L596 C599 Y600 D603 M617	V410-F414 VanDerWaalsContact O-CB 3.29Å; V410-F414 WeakPolarHBondContact O-CB 3.45Å; V410-F414 PolarHBondContact O-N 2.92Å; S411-F414 WeakPolarHBondContact O-CB 3.46Å; S411-F414 PolarHBondContact O-N 3.41Å; T412-F414 VanDerWaalsContact C-N 3.3Å; T412-F414 PolarHBondContact O-N 2.89Å; F414-T416 VanDerWaalsContact C-N 3.3Å; F414-T416 PolarHBondContact O-N 3.43Å; F414-L596 HydrophobicContact CD2-CD2 3.71Å; F414-L596 HydrophobicContact CE2-CD2 4.36Å; F414-C599 HydrophobicContact CB-CB 4.28Å; F414-C599 HydrophobicContact CD1-CB 3.68Å; F414-C599 HydrophobicContact CD2-CB 3.79Å; F414-C599 HydrophobicContact CE1-CB 3.87Å; F414-C599 HydrophobicContact CE2-CB 3.93Å; F414-C599 HydrophobicContact CG-CB 3.64Å; F414-C599 HydrophobicContact CZ-CB 4Å; F414-Y600 HydrophobicContact CD2-CE1 4.38Å; F414-Y600 AromaticContact CE2-CD1 3.46Å; F414-Y600 HydrophobicContact CE2-CD1 3.46Å; F414-Y600 VanDerWaalsContact CE2-CD1 3.46Å; F414-Y600 AromaticContact CE2-CE1 3.19Å; F414-Y600 HydrophobicContact CE2-CE1 3.19Å; F414-Y600 HydrophobicContact CE2-CE2 4.37Å; F414-Y600 HydrophobicContact CE2-CG 4.14Å; F414-Y600 AromaticContact CE2-CZ 3.67Å; F414-Y600 AromaticContact CZ-CD1 3.45Å; F414-Y600 HydrophobicContact CZ-CD1 3.45Å; F414-Y600 VanDerWaalsContact CZ-CD1 3.45Å; F414-Y600 AromaticContact CZ-CE1 3.62Å; F414-Y600 HydrophobicContact CZ-CE1 3.62Å; F414-Y600 HydrophobicContact CZ-CG 4.23Å; F414-D603 HydrophobicContact CE1-CB 3.97Å; F414-D603 HydrophobicContact CZ-CB 4.23Å; F414-M617 HydrophobicContact CZ-CB 4.33Å
415	F	88.7	Confident	87.9	Confident	10 Å²	10	50 Å²	50	4%	0.044	25%	0.245	C	C	.	.	H	α-helix	trans	-84.7	2.5	-174	-69.1	-71.5	0	0	0	114	P15 T16 S411 I505 C599 V602 Y616	P15-F415 HydrophobicContact CB-CB 4.14Å; P15-F415 HydrophobicContact CB-CD1 3.81Å; P15-F415 HydrophobicContact CB-CD2 4.12Å; P15-F415 HydrophobicContact CB-CE1 4.24Å; P15-F415 HydrophobicContact CB-CG 3.75Å; P15-F415 HydrophobicContact CG-CD1 3.92Å; P15-F415 HydrophobicContact CG-CE1 3.9Å; P15-F415 HydrophobicContact CG-CG 4.32Å; P15-F415 HydrophobicContact CG-CZ 4.29Å; T16-F415 HydrophobicContact CG2-CB 4.28Å; S411-F415 WeakPolarHBondContact O-CD2 3.28Å; S411-F415 PolarHBondContact O-N 3Å; F415-I505 HydrophobicContact CE2-CD1 3.97Å; F415-I505 HydrophobicContact CE2-CG1 3.88Å; F415-I505 HydrophobicContact CE2-CG2 4.04Å; F415-I505 HydrophobicContact CZ-CG2 4.45Å; F415-C599 HydrophobicContact CE2-CB 3.94Å; F415-C599 HydrophobicContact CZ-CB 4.17Å; F415-V602 HydrophobicContact CZ-CB 4.33Å; F415-V602 HydrophobicContact CZ-CG1 4.11Å; F415-Y616 HydrophobicContact CD1-CD1 4.43Å; F415-Y616 HydrophobicContact CD1-CD2 4.1Å; F415-Y616 HydrophobicContact CD1-CE2 4.39Å; F415-Y616 HydrophobicContact CD1-CG 4.13Å; F415-Y616 WeakPolarHBondContact O-CE1 3.21Å
416	T	87.5	Confident	87.6	Confident	27 Å²	27	50.3 Å²	50.3	17%	0.166	25%	0.247	C	C	.	.			trans	-89.2	116.3	169.4	-55.6	0	0	0	0	109.2	T412 F414 D418 K419 N421 L422	T412-T416 WeakPolarHBondContact O-CB 3.34Å; T412-T416 PolarHBondContact O-N 3.37Å; T412-T416 VanDerWaalsContact O-N 3.17Å; T412-T416 PolarHBondContact O-OG1 3.19Å; F414-T416 VanDerWaalsContact C-N 3.3Å; F414-T416 PolarHBondContact O-N 3.43Å; T416-D418 WeakPolarHBondContact CG2-O 3.31Å; T416-K419 PolarHBondContact O-NZ 2.78Å; T416-N421 HydrophobicContact CG2-CB 4.41Å; T416-L422 HydrophobicContact CG2-CD2 3.94Å; T416-L422 HydrophobicContact CG2-CG 4.25Å
417	R	83.8	Confident	87.5	Confident	146 Å²	146	50.5 Å²	50.5	55%	0.551	25%	0.248	S	C	*	.	S	Bend	trans	-66.1	-54.6	-178.7	-68.2	-162.6	172.6	173.4	0.9	112.2	P614 Y616	R417-P614 PolarHBondContact NH2-O 3.48Å; R417-Y616 HydrophobicContact CG-CD1 3.77Å; R417-Y616 HydrophobicContact CG-CE1 3.41Å; R417-Y616 VanDerWaalsContact CG-CE1 3.41Å
418	D	83.4	Confident	87.2	Confident	75 Å²	75	53.8 Å²	53.8	40%	0.401	27%	0.268	S	S	.	.	S	Bend	trans	-92.4	113	179.5	179.3	2.8	0	0	0	109.7	T416 D420 N421	T416-D418 WeakPolarHBondContact CG2-O 3.31Å; D418-D420 PolarHBondContact O-N 3.48Å; D418-D420 WeakPolarHBondContact OD1-CB 3.44Å; D418-D420 PolarHBondContact OD1-N 2.84Å; D418-N421 WeakPolarHBondContact CB-ND2 3.49Å; D418-N421 PolarHBondContact O-N 2.96Å; D418-N421 VanDerWaalsContact O-N 3.11Å; D418-N421 PolarHBondContact OD2-ND2 3.06Å
419	K	84.2	Confident	87.1	Confident	77 Å²	77	55.7 Å²	55.7	34%	0.335	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-69.7	-16	-174.4	-53.7	-52.3	-178.3	-166.3	0	112.5	Y413 T416 N421 L422	Y413-K419 HydrophobicContact CD2-CD 4.34Å; Y413-K419 HydrophobicContact CE2-CD 3.93Å; Y413-K419 PolarHBondContact O-NZ 3.38Å; T416-K419 PolarHBondContact O-NZ 2.78Å; K419-N421 VanDerWaalsContact C-N 3.26Å; K419-N421 PolarHBondContact O-N 3.4Å; K419-L422 HydrophobicContact CB-CD1 4.14Å; K419-L422 HydrophobicContact CD-CD1 4.17Å; K419-L422 WeakPolarHBondContact O-CB 3.14Å; K419-L422 WeakPolarHBondContact O-CD1 3.28Å; K419-L422 WeakPolarHBondContact O-CG 3.49Å; K419-L422 PolarHBondContact O-N 3.21Å
420	D	80.9	Confident	87	Confident	148 Å²	148	55.8 Å²	55.8	79%	0.791	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-73	-21.6	174.3	-63.9	-27.3	0	0	0	112	D418 L422	D418-D420 PolarHBondContact O-N 3.48Å; D418-D420 WeakPolarHBondContact OD1-CB 3.44Å; D418-D420 PolarHBondContact OD1-N 2.84Å; D420-L422 PolarHBondContact O-N 3.39Å
421	N	83	Confident	87	Confident	118 Å²	118	56.9 Å²	56.9	63%	0.631	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-83.6	5.4	174.9	-67.9	-48.7	0	0	0	113.6	T416 D418 K419	T416-N421 HydrophobicContact CG2-CB 4.41Å; D418-N421 WeakPolarHBondContact CB-ND2 3.49Å; D418-N421 PolarHBondContact O-N 2.96Å; D418-N421 VanDerWaalsContact O-N 3.11Å; D418-N421 PolarHBondContact OD2-ND2 3.06Å; K419-N421 VanDerWaalsContact C-N 3.26Å; K419-N421 PolarHBondContact O-N 3.4Å
422	L	83.9	Confident	86.9	Confident	29 Å²	29	60.6 Å²	60.6	15%	0.152	31%	0.308	C	S	.	.	S	Bend	trans	-70.8	139	175.4	-71.6	170.9	0	0	0	110.7	T412 Y413 T416 K419 D420 Q424	T412-L422 HydrophobicContact CG2-CD2 4.42Å; Y413-L422 HydrophobicContact CD2-CD1 3.67Å; Y413-L422 HydrophobicContact CE2-CD1 4.27Å; T416-L422 HydrophobicContact CG2-CD2 3.94Å; T416-L422 HydrophobicContact CG2-CG 4.25Å; K419-L422 HydrophobicContact CB-CD1 4.14Å; K419-L422 HydrophobicContact CD-CD1 4.17Å; K419-L422 WeakPolarHBondContact O-CB 3.14Å; K419-L422 WeakPolarHBondContact O-CD1 3.28Å; K419-L422 WeakPolarHBondContact O-CG 3.49Å; K419-L422 PolarHBondContact O-N 3.21Å; D420-L422 PolarHBondContact O-N 3.39Å; L422-Q424 PolarHBondContact O-N 3.49Å
423	P	78.8	Confident	86.9	Confident	58 Å²	58	60.7 Å²	60.7	38%	0.377	31%	0.308	S	S	.	.			trans	-54.8	131.8	170.1	-22.9	31.3	0	0	0	110.6	F425 T426	P423-F425 PolarHBondContact O-N 3.45Å; P423-T426 WeakPolarHBondContact CD-OG1 3.25Å; P423-T426 PolarHBondContact O-N 3.49Å; P423-T426 PolarHBondContact O-OG1 2.92Å
424	Q	74.8	Confident	87	Confident	179 Å²	179	59.9 Å²	59.9	84%	0.836	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	-32.9	-178.4	-170.6	177.4	1.3	0	0	113	L422	L422-Q424 PolarHBondContact O-N 3.49Å
425	F	84.7	Confident	87.2	Confident	120 Å²	120	63.9 Å²	63.9	53%	0.526	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	63.8	171.9	-57.5	-69.3	0	0	0	111.7	L331 P423 V427 V428 S429	L331-F425 HydrophobicContact CD1-CD1 3.88Å; P423-F425 PolarHBondContact O-N 3.45Å; F425-V427 VanDerWaalsContact C-N 3.27Å; F425-V427 PolarHBondContact O-N 3.03Å; F425-V428 HydrophobicContact CB-CB 3.9Å; F425-V428 HydrophobicContact CB-CG2 3.99Å; F425-V428 PolarHBondContact O-N 3.03Å; F425-S429 PolarHBondContact O-N 2.93Å
426	T	89.3	Confident	87.3	Confident	7 Å²	7	70.3 Å²	70.3	4%	0.043	35%	0.35	C	S	.	.	H	α-helix	trans	-53.4	-39.5	-177.4	-67.2	0	0	0	0	113.3	L329 A409 T412 P423 S429 S430	L329-T426 HydrophobicContact CD2-CG2 3.81Å; A409-T426 HydrophobicContact CB-CG2 4.38Å; T412-T426 HydrophobicContact CG2-CG2 4.29Å; P423-T426 WeakPolarHBondContact CD-OG1 3.25Å; P423-T426 PolarHBondContact O-N 3.49Å; P423-T426 PolarHBondContact O-OG1 2.92Å; T426-S429 PolarHBondContact O-N 3.05Å; T426-S430 WeakPolarHBondContact O-CB 3.48Å; T426-S430 PolarHBondContact O-N 2.72Å
427	V	91.1	Very high	87.5	Confident	5 Å²	5	71.7 Å²	71.7	3%	0.03	35%	0.352	C	S	.	.	H	α-helix	trans	-64.7	-43.6	177.2	178.4	0	0	0	0	111.5	L329 L331 L332 H335 T405 A409 F425 S430 S431	L329-V427 HydrophobicContact CB-CG2 4.37Å; L331-V427 HydrophobicContact CB-CB 4.02Å; L331-V427 HydrophobicContact CB-CG1 4.42Å; L331-V427 HydrophobicContact CB-CG2 3.98Å; L332-V427 HydrophobicContact CD2-CG1 4.5Å; L332-V427 HydrophobicContact CD2-CG2 3.75Å; L332-V427 HydrophobicContact CG-CG2 3.88Å; H335-V427 WeakPolarHBondContact CE1-CG1 3.45Å; T405-V427 HydrophobicContact CG2-CG1 4.49Å; A409-V427 HydrophobicContact CB-CG2 4.1Å; F425-V427 VanDerWaalsContact C-N 3.27Å; F425-V427 PolarHBondContact O-N 3.03Å; V427-S430 WeakPolarHBondContact O-CB 3.45Å; V427-S430 PolarHBondContact O-N 3.47Å; V427-S431 PolarHBondContact O-N 3.31Å; V427-S431 PolarHBondContact O-OG 2.96Å; V427-S431 VanDerWaalsContact O-OG 3.1Å
428	V	90.2	Very high	88	Confident	69 Å²	69	64.7 Å²	64.7	42%	0.418	33%	0.326	S	S	.	.	H	α-helix	trans	-67.8	-41.8	178.3	-179.9	0	0	0	0	110.6	L331 F425 S430 S431 I432	L331-V428 HydrophobicContact CD1-CG2 4.22Å; F425-V428 HydrophobicContact CB-CB 3.9Å; F425-V428 HydrophobicContact CB-CG2 3.99Å; F425-V428 PolarHBondContact O-N 3.03Å; V428-S430 VanDerWaalsContact C-N 3.29Å; V428-S430 PolarHBondContact O-N 2.85Å; V428-S431 WeakPolarHBondContact O-CB 3.24Å; V428-S431 PolarHBondContact O-N 3.04Å; V428-S431 VanDerWaalsContact O-N 3.12Å; V428-I432 HydrophobicContact CG1-CD1 3.99Å; V428-I432 HydrophobicContact CG1-CG1 4.47Å; V428-I432 WeakPolarHBondContact O-CG1 3.21Å; V428-I432 PolarHBondContact O-N 3.47Å
429	S	90.4	Very high	88.6	Confident	41 Å²	41	63.3 Å²	63.3	29%	0.287	32%	0.318	S	S	.	.	H	α-helix	trans	-57.5	-43.4	173	-177.8	0	0	0	0	111.4	F425 T426 S431 I432 N433	F425-S429 PolarHBondContact O-N 2.93Å; T426-S429 PolarHBondContact O-N 3.05Å; S429-S431 PolarHBondContact O-N 3.22Å; S429-I432 PolarHBondContact O-N 3.33Å; S429-N433 WeakPolarHBondContact O-CB 3.4Å; S429-N433 VanDerWaalsContact O-CG 3.22Å; S429-N433 PolarHBondContact O-N 3.47Å; S429-N433 PolarHBondContact O-ND2 3.21Å
430	S	92.9	Very high	89.1	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.014	30%	0.302	C	S	.	.	H	α-helix	trans	-60.4	-44.3	173.2	-173.1	0	0	0	0	111.9	T405 G408 A409 T426 V427 V428 I432 N433 T434	T405-S430 PolarHBondContact O-OG 2.87Å; G408-S430 VanDerWaalsContact C-OG 3.28Å; G408-S430 VanDerWaalsContact CA-OG 3.28Å; G408-S430 WeakPolarHBondContact CA-OG 3.41Å; A409-S430 PolarHBondContact N-OG 3.18Å; A409-S430 VanDerWaalsContact N-OG 3.13Å; T426-S430 WeakPolarHBondContact O-CB 3.48Å; T426-S430 PolarHBondContact O-N 2.72Å; V427-S430 WeakPolarHBondContact O-CB 3.45Å; V427-S430 PolarHBondContact O-N 3.47Å; V428-S430 VanDerWaalsContact C-N 3.29Å; V428-S430 PolarHBondContact O-N 2.85Å; S430-I432 VanDerWaalsContact C-N 3.35Å; S430-I432 PolarHBondContact O-N 3.33Å; S430-N433 PolarHBondContact O-N 2.7Å; S430-T434 PolarHBondContact O-N 3.49Å; S430-T434 PolarHBondContact O-OG1 3.49Å; S430-T434 VanDerWaalsContact O-OG1 3.04Å
431	S	92.9	Very high	89.9	Confident	22 Å²	22	52.7 Å²	52.7	15%	0.154	27%	0.265	C	S	.	.	H	α-helix	trans	-60	-44.7	176.2	-54.8	0	0	0	0	111.9	T405 V427 V428 S429 N433 T434 L435	T405-S431 WeakPolarHBondContact CG2-OG 3.43Å; V427-S431 PolarHBondContact O-N 3.31Å; V427-S431 PolarHBondContact O-OG 2.96Å; V427-S431 VanDerWaalsContact O-OG 3.1Å; V428-S431 WeakPolarHBondContact O-CB 3.24Å; V428-S431 PolarHBondContact O-N 3.04Å; V428-S431 VanDerWaalsContact O-N 3.12Å; S429-S431 PolarHBondContact O-N 3.22Å; S431-N433 VanDerWaalsContact C-N 3.35Å; S431-T434 WeakPolarHBondContact O-CB 3.45Å; S431-T434 PolarHBondContact O-N 3.27Å; S431-L435 WeakPolarHBondContact O-CG 3.46Å; S431-L435 PolarHBondContact O-N 2.82Å
432	I	91.8	Very high	90.5	Very high	83 Å²	83	47 Å²	47	43%	0.426	24%	0.235	S	C	.	.	H	α-helix	trans	-63.6	-42.4	177.7	-67.6	167.4	0	0	0	110.4	V428 S429 S430 T434 L435 R436	V428-I432 HydrophobicContact CG1-CD1 3.99Å; V428-I432 HydrophobicContact CG1-CG1 4.47Å; V428-I432 WeakPolarHBondContact O-CG1 3.21Å; V428-I432 PolarHBondContact O-N 3.47Å; S429-I432 PolarHBondContact O-N 3.33Å; S430-I432 VanDerWaalsContact C-N 3.35Å; S430-I432 PolarHBondContact O-N 3.33Å; I432-T434 VanDerWaalsContact C-N 3.34Å; I432-T434 PolarHBondContact O-N 3.41Å; I432-L435 PolarHBondContact O-N 2.99Å; I432-R436 VanDerWaalsContact O-CB 3.31Å; I432-R436 WeakPolarHBondContact O-CB 3.48Å; I432-R436 PolarHBondContact O-N 3.46Å
433	N	90.9	Very high	91.2	Very high	30 Å²	30	45.7 Å²	45.7	16%	0.16	23%	0.227	C	C	.	.	H	α-helix	trans	-63.7	-39.5	176.1	-72	-27.5	0	0	0	111.9	S429 S430 S431 R436 Y437	S429-N433 WeakPolarHBondContact O-CB 3.4Å; S429-N433 VanDerWaalsContact O-CG 3.22Å; S429-N433 PolarHBondContact O-N 3.47Å; S429-N433 PolarHBondContact O-ND2 3.21Å; S430-N433 PolarHBondContact O-N 2.7Å; S431-N433 VanDerWaalsContact C-N 3.35Å; N433-R436 PolarHBondContact O-N 3.46Å; N433-Y437 HydrophobicContact CB-CD2 4.45Å; N433-Y437 PolarHBondContact O-N 3.4Å
434	T	93.8	Very high	92	Very high	2 Å²	2	44 Å²	44	1%	0.012	21%	0.214	C	C	.	.	I	π-helix	trans	-61.5	-46.6	173.9	-60.1	0	0	0	0	111	F401 M404 S430 S431 I432 H438 M439 V442	F401-T434 HydrophobicContact CD2-CG2 3.63Å; F401-T434 HydrophobicContact CE2-CG2 3.52Å; F401-T434 HydrophobicContact CZ-CG2 4.34Å; M404-T434 HydrophobicContact CB-CG2 4.07Å; M404-T434 HydrophobicContact CG-CG2 3.7Å; S430-T434 PolarHBondContact O-N 3.49Å; S430-T434 PolarHBondContact O-OG1 3.49Å; S430-T434 VanDerWaalsContact O-OG1 3.04Å; S431-T434 WeakPolarHBondContact O-CB 3.45Å; S431-T434 PolarHBondContact O-N 3.27Å; I432-T434 VanDerWaalsContact C-N 3.34Å; I432-T434 PolarHBondContact O-N 3.41Å; T434-H438 CarbonylContact O-C 3.54Å; T434-H438 PolarHBondContact O-N 2.85Å; T434-M439 PolarHBondContact O-N 2.95Å; T434-V442 HydrophobicContact CG2-CG2 3.97Å
435	L	93.3	Very high	93	Very high	94 Å²	94	35.4 Å²	35.4	49%	0.492	17%	0.174	S	C	.	.	I	π-helix	trans	-63.3	-41	177	-72.6	170.1	0	0	0	112.4	F401 S431 I432 M439	F401-L435 HydrophobicContact CE2-CD2 3.57Å; F401-L435 HydrophobicContact CE2-CG 3.72Å; F401-L435 HydrophobicContact CZ-CD1 4.37Å; F401-L435 HydrophobicContact CZ-CD2 3.95Å; F401-L435 HydrophobicContact CZ-CG 3.8Å; S431-L435 WeakPolarHBondContact O-CG 3.46Å; S431-L435 PolarHBondContact O-N 2.82Å; I432-L435 PolarHBondContact O-N 2.99Å; L435-M439 HydrophobicContact CD2-CG 4.5Å; L435-M439 HydrophobicContact CD2-SD 4.06Å; L435-M439 WeakPolarHBondContact O-CG 3.27Å; L435-M439 VanDerWaalsContact O-SD 3.4Å
436	R	92.1	Very high	93.6	Very high	145 Å²	145	29.7 Å²	29.7	55%	0.547	15%	0.149	S	C	.	.	I	π-helix	trans	-77.5	-46.3	-175.3	-176.1	173.2	-76	173.6	-3.4	112.5	Y21 I432 N433	Y21-R436 VanDerWaalsContact CD1-O 3.26Å; Y21-R436 WeakPolarHBondContact CD1-O 3.36Å; Y21-R436 WeakPolarHBondContact CE1-O 3.03Å; I432-R436 VanDerWaalsContact O-CB 3.31Å; I432-R436 WeakPolarHBondContact O-CB 3.48Å; I432-R436 PolarHBondContact O-N 3.46Å; N433-R436 PolarHBondContact O-N 3.46Å
437	Y	91.4	Very high	93.9	Very high	55 Å²	55	31.7 Å²	31.7	22%	0.216	16%	0.157	C	C	.	.	I	π-helix	trans	-110.3	-30.1	-167	-60.7	-69.9	0	0	0	114	R19 Y21 T22 N433	R19-Y437 HydrophobicContact CB-CD1 4.32Å; R19-Y437 HydrophobicContact CB-CD2 3.94Å; R19-Y437 HydrophobicContact CB-CE2 4.21Å; R19-Y437 HydrophobicContact CB-CG 3.99Å; Y21-Y437 WeakPolarHBondContact CA-O 3.05Å; Y21-Y437 HydrophobicContact CD1-CD1 4.31Å; Y21-Y437 HydrophobicContact CE1-CD1 4.3Å; Y21-Y437 HydrophobicContact CE2-CD1 4.49Å; Y21-Y437 HydrophobicContact CE2-CE1 4.41Å; Y21-Y437 HydrophobicContact CG-CD1 4.43Å; T22-Y437 PolarHBondContact N-O 3.07Å; T22-Y437 PolarHBondContact OG1-O 3.07Å; N433-Y437 HydrophobicContact CB-CD2 4.45Å; N433-Y437 PolarHBondContact O-N 3.4Å
438	H	94.8	Very high	94.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.167	C	C	.	.	I	π-helix	trans	-121.1	9.8	-162	-55.6	-56.1	0	0	0	115.8	R19 T22 M404 T434 G440 T441 V442	R19-H438 PolarHBondContact NH1-NE2 3.15Å; T22-H438 WeakPolarHBondContact OG1-CA 3.26Å; T22-H438 PolarHBondContact OG1-ND1 3.49Å; M404-H438 HydrophobicContact CE-CB 3.75Å; T434-H438 CarbonylContact O-C 3.54Å; T434-H438 PolarHBondContact O-N 2.85Å; H438-G440 PolarHBondContact O-N 3.03Å; H438-T441 WeakPolarHBondContact O-CB 3.25Å; H438-T441 PolarHBondContact O-N 3.37Å; H438-T441 VanDerWaalsContact O-N 3.11Å; H438-V442 WeakPolarHBondContact O-CG2 3.47Å; H438-V442 PolarHBondContact O-N 3.29Å; H438-V442 VanDerWaalsContact O-N 3.11Å
439	M	95.1	Very high	94.3	Very high	46 Å²	46	30.6 Å²	30.6	23%	0.227	15%	0.148	C	C	.	.	H	α-helix	trans	-58.1	-33.7	177	-72.1	-173.3	72.4	0	0	113.1	L27 F397 T434 L435 V442 A443	L27-M439 HydrophobicContact CD1-CB 3.56Å; L27-M439 HydrophobicContact CD1-CE 4.2Å; L27-M439 HydrophobicContact CD1-SD 4.34Å; L27-M439 HydrophobicContact CD2-CB 4.36Å; F397-M439 HydrophobicContact CZ-CE 3.89Å; T434-M439 PolarHBondContact O-N 2.95Å; L435-M439 HydrophobicContact CD2-CG 4.5Å; L435-M439 HydrophobicContact CD2-SD 4.06Å; L435-M439 WeakPolarHBondContact O-CG 3.27Å; L435-M439 VanDerWaalsContact O-SD 3.4Å; M439-V442 PolarHBondContact O-N 2.59Å; M439-A443 WeakPolarHBondContact O-CB 3.45Å; M439-A443 PolarHBondContact O-N 2.68Å
440	G	95.6	Very high	94.5	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-64	-41.8	176.3	0	0	0	0	0	112.6	D23 H438 A443 K444	D23-G440 WeakPolarHBondContact O-CA 3.48Å; H438-G440 PolarHBondContact O-N 3.03Å; G440-A443 PolarHBondContact O-N 3.33Å; G440-K444 WeakPolarHBondContact O-CB 3.2Å; G440-K444 PolarHBondContact O-N 3.47Å
441	T	96.3	Very high	94.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.3	-43	176.6	-59.1	0	0	0	0	110.9	T22 D23 H438 K444 G445 Y500 T503 F510	T22-T441 WeakPolarHBondContact CB-OG1 3.3Å; T22-T441 PolarHBondContact OG1-OG1 2.99Å; D23-T441 PolarHBondContact OD2-OG1 3.43Å; H438-T441 WeakPolarHBondContact O-CB 3.25Å; H438-T441 PolarHBondContact O-N 3.37Å; H438-T441 VanDerWaalsContact O-N 3.11Å; T441-K444 PolarHBondContact O-N 2.62Å; T441-G445 PolarHBondContact O-N 3.31Å; T441-Y500 HydrophobicContact CG2-CD1 4.18Å; T441-Y500 HydrophobicContact CG2-CE1 4.31Å; T441-T503 HydrophobicContact CG2-CG2 4.15Å; T441-F510 HydrophobicContact CG2-CB 3.86Å; T441-F510 HydrophobicContact CG2-CD2 3.82Å; T441-F510 HydrophobicContact CG2-CG 4.35Å
442	V	97.4	Very high	94.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.7	-43.7	175.1	178.1	0	0	0	0	111.1	F397 A400 F401 M404 T434 H438 M439 S446	F397-V442 HydrophobicContact CD2-CG1 3.82Å; F397-V442 HydrophobicContact CE2-CB 4.07Å; F397-V442 HydrophobicContact CE2-CG1 3.66Å; F397-V442 HydrophobicContact CG-CG1 4.36Å; F397-V442 HydrophobicContact CZ-CG1 4.08Å; A400-V442 HydrophobicContact CB-CG1 3.7Å; F401-V442 HydrophobicContact CB-CG1 4.23Å; M404-V442 HydrophobicContact CB-CG2 3.84Å; M404-V442 HydrophobicContact CG-CG2 3.95Å; T434-V442 HydrophobicContact CG2-CG2 3.97Å; H438-V442 WeakPolarHBondContact O-CG2 3.47Å; H438-V442 PolarHBondContact O-N 3.29Å; H438-V442 VanDerWaalsContact O-N 3.11Å; M439-V442 PolarHBondContact O-N 2.59Å; V442-S446 WeakPolarHBondContact O-CB 3.3Å; V442-S446 PolarHBondContact O-N 2.92Å; V442-S446 PolarHBondContact O-OG 3.32Å
443	A	97.3	Very high	94.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.6	-45.3	176.5	0	0	0	0	0	112.4	W26 F30 W393 F397 M439 G440 S446 F447	W26-A443 HydrophobicContact CB-CB 4.49Å; F30-A443 HydrophobicContact CB-CB 3.76Å; F30-A443 HydrophobicContact CD1-CB 4.49Å; F30-A443 HydrophobicContact CG-CB 4.03Å; W393-A443 PolarHBondContact NE1-O 3.5Å; F397-A443 HydrophobicContact CD2-CB 4.27Å; F397-A443 HydrophobicContact CE2-CB 4.03Å; M439-A443 WeakPolarHBondContact O-CB 3.45Å; M439-A443 PolarHBondContact O-N 2.68Å; G440-A443 PolarHBondContact O-N 3.33Å; A443-S446 PolarHBondContact O-OG 3.01Å; A443-F447 VanDerWaalsContact O-CB 3.26Å; A443-F447 WeakPolarHBondContact O-CB 3.49Å; A443-F447 PolarHBondContact O-N 3.46Å
444	K	96.1	Very high	94.7	Very high	22 Å²	22	32.4 Å²	32.4	10%	0.096	15%	0.151	C	C	.	.	H	α-helix	trans	-65	-47.6	178.5	-175.7	176.2	175.7	-174.5	0	112.2	D23 W26 G440 T441 F447 I448 F510 C511	D23-K444 VanDerWaalsContact OD1-CD 3.3Å; D23-K444 WeakPolarHBondContact OD1-CD 3.18Å; D23-K444 IonicContact OD1-NZ 3.88Å; D23-K444 PolarHBondContact OD1-NZ 3.39Å; W26-K444 HydrophobicContact CB-CB 4.04Å; W26-K444 HydrophobicContact CD2-CB 3.9Å; W26-K444 HydrophobicContact CD2-CD 4.45Å; W26-K444 HydrophobicContact CD2-CG 3.95Å; W26-K444 HydrophobicContact CE3-CB 4.49Å; W26-K444 HydrophobicContact CG-CB 3.68Å; W26-K444 HydrophobicContact CG-CD 4.12Å; W26-K444 HydrophobicContact CG-CG 3.98Å; W26-K444 HydrophobicContact CZ2-CG 4.41Å; G440-K444 WeakPolarHBondContact O-CB 3.2Å; G440-K444 PolarHBondContact O-N 3.47Å; T441-K444 PolarHBondContact O-N 2.62Å; K444-F447 PolarHBondContact O-N 3.34Å; K444-I448 HydrophobicContact CG-CD1 4.22Å; K444-I448 WeakPolarHBondContact O-CG1 3.17Å; K444-I448 PolarHBondContact O-N 3.5Å; K444-I448 VanDerWaalsContact O-N 3.1Å; K444-F510 HydrophobicContact CD-CB 3.74Å; K444-F510 HydrophobicContact CD-CD1 4Å; K444-F510 HydrophobicContact CD-CG 4.05Å; K444-F510 HydrophobicContact CG-CB 4.47Å; K444-F510 HydrophobicContact CG-CD1 4.22Å; K444-F510 HydrophobicContact CG-CG 4.33Å; K444-C511 PolarHBondContact NZ-SG 3.18Å; K444-C511 VanDerWaalsContact NZ-SG 3.36Å
445	G	95.1	Very high	94.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.7	-46.9	180	0	0	0	0	0	112.3	T441 F447 I448 I449 N496 Y500	T441-G445 PolarHBondContact O-N 3.31Å; G445-F447 VanDerWaalsContact C-N 3.31Å; G445-F447 PolarHBondContact O-N 2.9Å; G445-I448 PolarHBondContact O-N 3.26Å; G445-I449 PolarHBondContact O-N 2.91Å; G445-N496 WeakPolarHBondContact CA-ND2 3.11Å; G445-N496 PolarHBondContact O-ND2 2.92Å; G445-Y500 VanDerWaalsContact CA-OH 3.31Å; G445-Y500 WeakPolarHBondContact CA-OH 3.45Å
446	S	96.8	Very high	94.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.3	-34.8	175.6	56.1	0	0	0	0	113.4	W393 V442 A443 T450 Y500	W393-S446 PolarHBondContact NE1-OG 3.23Å; V442-S446 WeakPolarHBondContact O-CB 3.3Å; V442-S446 PolarHBondContact O-N 2.92Å; V442-S446 PolarHBondContact O-OG 3.32Å; A443-S446 PolarHBondContact O-OG 3.01Å; S446-T450 WeakPolarHBondContact O-CB 3.36Å; S446-T450 PolarHBondContact O-N 3.31Å; S446-T450 PolarHBondContact O-OG1 3.49Å; S446-Y500 PolarHBondContact N-OH 3.43Å
447	F	96.5	Very high	94.5	Very high	48 Å²	48	30.4 Å²	30.4	21%	0.211	15%	0.149	C	C	.	.	H	α-helix	trans	-66	-42.6	175.7	-175.7	-108.1	0	0	0	112.3	W26 W393 A443 K444 G445 I449 T450 L451	W26-F447 HydrophobicContact CE3-CD1 4.4Å; W26-F447 AromaticContact CH2-CD1 3.36Å; W26-F447 HydrophobicContact CH2-CD1 3.36Å; W26-F447 AromaticContact CH2-CE1 3.57Å; W26-F447 HydrophobicContact CH2-CE1 3.57Å; W26-F447 HydrophobicContact CH2-CG 4.25Å; W26-F447 HydrophobicContact CZ3-CB 4.06Å; W26-F447 AromaticContact CZ3-CD1 3.25Å; W26-F447 HydrophobicContact CZ3-CD1 3.25Å; W26-F447 HydrophobicContact CZ3-CD2 4.46Å; W26-F447 AromaticContact CZ3-CE1 3.69Å; W26-F447 HydrophobicContact CZ3-CE1 3.69Å; W26-F447 AromaticContact CZ3-CG 3.68Å; W26-F447 HydrophobicContact CZ3-CG 3.68Å; W26-F447 HydrophobicContact CZ3-CZ 4.46Å; W393-F447 AromaticContact CD2-CD2 3.83Å; W393-F447 HydrophobicContact CD2-CD2 3.83Å; W393-F447 AromaticContact CE2-CD2 3.53Å; W393-F447 HydrophobicContact CE3-CD2 4.12Å; W393-F447 HydrophobicContact CE3-CE2 4.48Å; W393-F447 HydrophobicContact CG-CD2 4.46Å; W393-F447 AromaticContact CH2-CD2 3.86Å; W393-F447 HydrophobicContact CH2-CD2 3.86Å; W393-F447 HydrophobicContact CH2-CE2 4.29Å; W393-F447 HydrophobicContact CZ2-CB 3.84Å; W393-F447 AromaticContact CZ2-CD2 3.56Å; W393-F447 HydrophobicContact CZ2-CD2 3.56Å; W393-F447 HydrophobicContact CZ2-CE2 4.42Å; W393-F447 AromaticContact CZ2-CG 3.97Å; W393-F447 HydrophobicContact CZ2-CG 3.97Å; W393-F447 HydrophobicContact CZ3-CD2 4.13Å; W393-F447 HydrophobicContact CZ3-CE2 4.32Å; A443-F447 VanDerWaalsContact O-CB 3.26Å; A443-F447 WeakPolarHBondContact O-CB 3.49Å; A443-F447 PolarHBondContact O-N 3.46Å; K444-F447 PolarHBondContact O-N 3.34Å; G445-F447 VanDerWaalsContact C-N 3.31Å; G445-F447 PolarHBondContact O-N 2.9Å; F447-I449 VanDerWaalsContact C-N 3.31Å; F447-I449 PolarHBondContact O-N 2.82Å; F447-T450 WeakPolarHBondContact O-CA 3.18Å; F447-T450 WeakPolarHBondContact O-CB 3.46Å; F447-T450 PolarHBondContact O-N 3.29Å; F447-L451 HydrophobicContact CD1-CD1 3.94Å; F447-L451 HydrophobicContact CD1-CG 4.1Å; F447-L451 HydrophobicContact CE1-CD1 3.55Å; F447-L451 HydrophobicContact CE1-CD2 3.97Å; F447-L451 HydrophobicContact CE1-CG 3.75Å; F447-L451 HydrophobicContact CE2-CD2 4.35Å; F447-L451 HydrophobicContact CZ-CD1 4.22Å; F447-L451 HydrophobicContact CZ-CD2 3.75Å; F447-L451 HydrophobicContact CZ-CG 3.98Å; F447-L451 PolarHBondContact O-N 3.24Å
448	I	94.9	Very high	94.4	Very high	47 Å²	47	31.8 Å²	31.8	24%	0.241	16%	0.159	C	C	.	.	H	α-helix	trans	-60.5	-41.4	178.7	-69.2	164.7	0	0	0	111.1	K444 G445 L451 L492 F510	K444-I448 HydrophobicContact CG-CD1 4.22Å; K444-I448 WeakPolarHBondContact O-CG1 3.17Å; K444-I448 PolarHBondContact O-N 3.5Å; K444-I448 VanDerWaalsContact O-N 3.1Å; G445-I448 PolarHBondContact O-N 3.26Å; I448-L451 PolarHBondContact O-N 2.81Å; I448-L492 HydrophobicContact CG2-CD1 3.98Å; I448-L492 HydrophobicContact CG2-CD2 3.81Å; I448-L492 HydrophobicContact CG2-CG 4.42Å; I448-F510 HydrophobicContact CD1-CD1 4.24Å; I448-F510 HydrophobicContact CD1-CE1 3.56Å; I448-F510 HydrophobicContact CD1-CZ 4.12Å
449	I	94.6	Very high	94.2	Very high	5 Å²	5	33.9 Å²	33.9	3%	0.026	17%	0.17	C	C	.	.	H	α-helix	trans	-62.7	-45.7	173.4	-65.4	168.7	0	0	0	110	E396 G445 F447 L451 V452 K453 L492 V493 N496	E396-I449 HydrophobicContact CG-CG2 4.15Å; G445-I449 PolarHBondContact O-N 2.91Å; F447-I449 VanDerWaalsContact C-N 3.31Å; F447-I449 PolarHBondContact O-N 2.82Å; I449-L451 VanDerWaalsContact C-N 3.3Å; I449-L451 PolarHBondContact O-N 3.46Å; I449-V452 PolarHBondContact O-N 3.47Å; I449-V452 VanDerWaalsContact O-N 3.13Å; I449-K453 WeakPolarHBondContact O-CB 3.35Å; I449-K453 PolarHBondContact O-N 3.26Å; I449-L492 HydrophobicContact CG1-CB 4.48Å; I449-V493 HydrophobicContact CD1-CG2 4Å; I449-V493 HydrophobicContact CG1-CG2 4.41Å; I449-N496 HydrophobicContact CD1-CB 4.41Å; I449-N496 WeakPolarHBondContact CD1-ND2 3.33Å; I449-N496 WeakPolarHBondContact CG1-ND2 3.47Å
450	T	94.8	Very high	93.8	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.012	18%	0.175	C	C	.	.	H	α-helix	trans	-57.4	-41	179.9	-60.3	0	0	0	0	112.5	I392 W393 S446 F447 V452 K453 I454	I392-T450 HydrophobicContact CB-CG2 4.26Å; I392-T450 HydrophobicContact CG2-CG2 3.83Å; W393-T450 WeakPolarHBondContact CA-OG1 3.38Å; W393-T450 HydrophobicContact CB-CG2 4.06Å; S446-T450 WeakPolarHBondContact O-CB 3.36Å; S446-T450 PolarHBondContact O-N 3.31Å; S446-T450 PolarHBondContact O-OG1 3.49Å; F447-T450 WeakPolarHBondContact O-CA 3.18Å; F447-T450 WeakPolarHBondContact O-CB 3.46Å; F447-T450 PolarHBondContact O-N 3.29Å; T450-V452 VanDerWaalsContact C-N 3.25Å; T450-V452 PolarHBondContact O-N 2.86Å; T450-K453 PolarHBondContact O-N 3.05Å; T450-I454 HydrophobicContact CG2-CD1 3.7Å; T450-I454 HydrophobicContact CG2-CG1 4.25Å; T450-I454 PolarHBondContact O-N 3.44Å
451	L	94.1	Very high	93.3	Very high	97 Å²	97	41.1 Å²	41.1	51%	0.508	20%	0.202	S	C	.	.	H	α-helix	trans	-60.1	-31.2	178.3	-76.3	-179.9	0	0	0	113.7	F447 I448 I449 P455	F447-L451 HydrophobicContact CD1-CD1 3.94Å; F447-L451 HydrophobicContact CD1-CG 4.1Å; F447-L451 HydrophobicContact CE1-CD1 3.55Å; F447-L451 HydrophobicContact CE1-CD2 3.97Å; F447-L451 HydrophobicContact CE1-CG 3.75Å; F447-L451 HydrophobicContact CE2-CD2 4.35Å; F447-L451 HydrophobicContact CZ-CD1 4.22Å; F447-L451 HydrophobicContact CZ-CD2 3.75Å; F447-L451 HydrophobicContact CZ-CG 3.98Å; F447-L451 PolarHBondContact O-N 3.24Å; I448-L451 PolarHBondContact O-N 2.81Å; I449-L451 VanDerWaalsContact C-N 3.3Å; I449-L451 PolarHBondContact O-N 3.46Å; L451-P455 WeakPolarHBondContact O-CD 3.49Å; L451-P455 VanDerWaalsContact O-CG 3.29Å; L451-P455 WeakPolarHBondContact O-CG 3.46Å
452	V	93.8	Very high	92.9	Very high	19 Å²	19	44.3 Å²	44.3	12%	0.115	22%	0.218	C	C	.	.	H	α-helix	trans	-90.1	-34.4	177.4	176.3	0	0	0	0	111.2	I449 T450 P455 R456 L485 L488 E489 L492	I449-V452 PolarHBondContact O-N 3.47Å; I449-V452 VanDerWaalsContact O-N 3.13Å; T450-V452 VanDerWaalsContact C-N 3.25Å; T450-V452 PolarHBondContact O-N 2.86Å; V452-P455 WeakPolarHBondContact O-CD 3.29Å; V452-R456 WeakPolarHBondContact O-CB 3.42Å; V452-R456 PolarHBondContact O-N 3.37Å; V452-L485 HydrophobicContact CG1-CD2 4.1Å; V452-L488 HydrophobicContact CG1-CB 4.24Å; V452-L488 HydrophobicContact CG1-CD2 3.95Å; V452-L488 HydrophobicContact CG1-CG 4.04Å; V452-L488 HydrophobicContact CG2-CD2 3.75Å; V452-L488 HydrophobicContact CG2-CG 4.15Å; V452-E489 HydrophobicContact CG1-CB 4.21Å; V452-L492 HydrophobicContact CB-CD1 4.07Å; V452-L492 HydrophobicContact CG2-CD1 3.43Å; V452-L492 VanDerWaalsContact CG2-CD1 3.43Å
453	K	93	Very high	92.3	Very high	55 Å²	55	46.6 Å²	46.6	24%	0.239	23%	0.228	C	C	.	.	H	α-helix	trans	-66.3	-39.6	-178.3	-164.9	163.2	-177.4	169.3	0	112.5	I392 E396 I449 T450 R456 I457	I392-K453 HydrophobicContact CG2-CB 4.38Å; I392-K453 HydrophobicContact CG2-CD 4.04Å; I392-K453 HydrophobicContact CG2-CG 4.28Å; E396-K453 WeakPolarHBondContact OE1-CD 3.31Å; E396-K453 IonicContact OE1-NZ 3.31Å; E396-K453 PolarHBondContact OE1-NZ 3.37Å; I449-K453 WeakPolarHBondContact O-CB 3.35Å; I449-K453 PolarHBondContact O-N 3.26Å; T450-K453 PolarHBondContact O-N 3.05Å; K453-R456 PolarHBondContact O-N 2.92Å; K453-I457 HydrophobicContact CG-CD1 4.01Å; K453-I457 VanDerWaalsContact O-CG1 3.29Å; K453-I457 WeakPolarHBondContact O-CG1 3.09Å; K453-I457 PolarHBondContact O-N 3.32Å
454	I	93	Very high	91.5	Very high	43 Å²	43	50.7 Å²	50.7	22%	0.221	25%	0.254	C	S	.	.	H	α-helix	trans	-61.4	-56.6	178.3	-71.3	166.8	0	0	0	111.8	V389 I392 T450 R456 I457 I458	V389-I454 HydrophobicContact CG1-CD1 4.2Å; V389-I454 HydrophobicContact CG2-CD1 4.13Å; I392-I454 HydrophobicContact CD1-CD1 4.45Å; I392-I454 HydrophobicContact CD1-CG1 3.59Å; T450-I454 HydrophobicContact CG2-CD1 3.7Å; T450-I454 HydrophobicContact CG2-CG1 4.25Å; T450-I454 PolarHBondContact O-N 3.44Å; I454-R456 VanDerWaalsContact C-N 3.27Å; I454-R456 PolarHBondContact O-N 3.26Å; I454-I457 PolarHBondContact O-N 3.13Å; I454-I458 HydrophobicContact CG2-CD1 3.73Å; I454-I458 WeakPolarHBondContact O-CG1 3.42Å; I454-I458 PolarHBondContact O-N 3.15Å
455	P	92.4	Very high	90.8	Very high	51 Å²	51	54.9 Å²	54.9	33%	0.331	27%	0.274	S	S	.	.	H	α-helix	trans	-56.8	-38.7	175.7	-26.8	34.5	0	0	0	113.4	L451 V452 I458 L459 L485	L451-P455 WeakPolarHBondContact O-CD 3.49Å; L451-P455 VanDerWaalsContact O-CG 3.29Å; L451-P455 WeakPolarHBondContact O-CG 3.46Å; V452-P455 WeakPolarHBondContact O-CD 3.29Å; P455-I458 PolarHBondContact O-N 3.48Å; P455-L459 WeakPolarHBondContact O-CB 3.49Å; P455-L459 WeakPolarHBondContact O-CG 3.42Å; P455-L459 PolarHBondContact O-N 2.86Å; P455-L485 HydrophobicContact CB-CD1 4.19Å
456	R	91.9	Very high	90.2	Very high	60 Å²	60	58.2 Å²	58.2	23%	0.226	29%	0.291	C	S	.	.	H	α-helix	trans	-61.2	-46.3	177.4	-175.1	-170.2	165.7	-152.3	-7.4	111.5	V452 K453 I454 T460 L485 E489	V452-R456 WeakPolarHBondContact O-CB 3.42Å; V452-R456 PolarHBondContact O-N 3.37Å; K453-R456 PolarHBondContact O-N 2.92Å; I454-R456 VanDerWaalsContact C-N 3.27Å; I454-R456 PolarHBondContact O-N 3.26Å; R456-T460 VanDerWaalsContact O-CB 3.32Å; R456-T460 WeakPolarHBondContact O-CB 3.33Å; R456-T460 PolarHBondContact O-N 2.85Å; R456-T460 PolarHBondContact O-OG1 3.42Å; R456-L485 HydrophobicContact CB-CB 4.03Å; R456-L485 HydrophobicContact CB-CD1 4.29Å; R456-L485 HydrophobicContact CG-CB 4.17Å; R456-E489 WeakPolarHBondContact CD-OE2 3.23Å; R456-E489 IonicContact CZ-OE2 2.72Å; R456-E489 IonicContact NE-OE2 2.71Å; R456-E489 IonicContact NH1-OE1 3.14Å; R456-E489 PolarHBondContact NH1-OE1 2.93Å; R456-E489 IonicContact NH1-OE2 2.78Å; R456-E489 PolarHBondContact NH1-OE2 3.22Å
457	I	89.1	Confident	89.4	Confident	87 Å²	87	66 Å²	66	45%	0.446	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-46.3	177.6	-69.8	167	0	0	0	110.2	I392 K453 I454 L459 T460 Y461	I392-I457 HydrophobicContact CD1-CD1 3.98Å; K453-I457 HydrophobicContact CG-CD1 4.01Å; K453-I457 VanDerWaalsContact O-CG1 3.29Å; K453-I457 WeakPolarHBondContact O-CG1 3.09Å; K453-I457 PolarHBondContact O-N 3.32Å; I454-I457 PolarHBondContact O-N 3.13Å; I457-L459 PolarHBondContact O-N 3.46Å; I457-T460 PolarHBondContact O-N 3.15Å; I457-Y461 WeakPolarHBondContact O-CB 3.37Å; I457-Y461 PolarHBondContact O-N 3.46Å
458	I	90.3	Very high	88.5	Confident	84 Å²	84	67 Å²	67	43%	0.431	35%	0.348	S	S	.	.	H	α-helix	trans	-60.6	-48.1	179.3	-66.6	168.6	0	0	0	111	I454 P455 T460 Y461 I462	I454-I458 HydrophobicContact CG2-CD1 3.73Å; I454-I458 WeakPolarHBondContact O-CG1 3.42Å; I454-I458 PolarHBondContact O-N 3.15Å; P455-I458 PolarHBondContact O-N 3.48Å; I458-T460 VanDerWaalsContact C-N 3.35Å; I458-T460 PolarHBondContact O-N 3.13Å; I458-Y461 WeakPolarHBondContact O-CB 3.44Å; I458-Y461 PolarHBondContact O-N 3.5Å; I458-I462 HydrophobicContact CG2-CD1 3.83Å; I458-I462 HydrophobicContact CG2-CG1 4.49Å; I458-I462 WeakPolarHBondContact O-CG1 3.49Å; I458-I462 PolarHBondContact O-N 3.27Å
459	L	89.4	Confident	87.9	Confident	44 Å²	44	73.5 Å²	73.5	23%	0.23	38%	0.375	C	S	.	.	H	α-helix	trans	-66	-37.2	179	-74.8	169.9	0	0	0	112.5	P455 I457 Y461 I462 H463 L478 C481 V482 L485	P455-L459 WeakPolarHBondContact O-CB 3.49Å; P455-L459 WeakPolarHBondContact O-CG 3.42Å; P455-L459 PolarHBondContact O-N 2.86Å; I457-L459 PolarHBondContact O-N 3.46Å; L459-Y461 VanDerWaalsContact C-N 3.33Å; L459-I462 PolarHBondContact O-N 2.93Å; L459-H463 VanDerWaalsContact O-CB 3.32Å; L459-H463 WeakPolarHBondContact O-CB 3.26Å; L459-H463 PolarHBondContact O-N 3.29Å; L459-L478 HydrophobicContact CD2-CD2 3.96Å; L459-C481 HydrophobicContact CD1-CB 4.22Å; L459-V482 HydrophobicContact CB-CG2 3.99Å; L459-L485 HydrophobicContact CD1-CD1 3.47Å; L459-L485 VanDerWaalsContact CD1-CD1 3.47Å
460	T	87.5	Confident	87.3	Confident	54 Å²	54	74.2 Å²	74.2	33%	0.331	38%	0.378	S	S	.	.	H	α-helix	trans	-64.2	-40.7	174.7	-56.1	0	0	0	0	110.9	R456 I457 I458 T464	R456-T460 VanDerWaalsContact O-CB 3.32Å; R456-T460 WeakPolarHBondContact O-CB 3.33Å; R456-T460 PolarHBondContact O-N 2.85Å; R456-T460 PolarHBondContact O-OG1 3.42Å; I457-T460 PolarHBondContact O-N 3.15Å; I458-T460 VanDerWaalsContact C-N 3.35Å; I458-T460 PolarHBondContact O-N 3.13Å; T460-T464 WeakPolarHBondContact O-CB 3.49Å; T460-T464 PolarHBondContact O-N 3.45Å; T460-T464 PolarHBondContact O-OG1 3.46Å
461	Y	85.8	Confident	87	Confident	146 Å²	146	80.4 Å²	80.4	57%	0.573	41%	0.411	S	S	*	.	H	α-helix	trans	-63.4	-48	174.5	177.9	-100.7	0	0	0	111.6	I457 I458 L459 H463 T464 Q465	I457-Y461 WeakPolarHBondContact O-CB 3.37Å; I457-Y461 PolarHBondContact O-N 3.46Å; I458-Y461 WeakPolarHBondContact O-CB 3.44Å; I458-Y461 PolarHBondContact O-N 3.5Å; L459-Y461 VanDerWaalsContact C-N 3.33Å; Y461-H463 PolarHBondContact O-N 3.23Å; Y461-T464 WeakPolarHBondContact O-CB 3.48Å; Y461-T464 PolarHBondContact O-N 2.97Å; Y461-T464 VanDerWaalsContact O-N 3.16Å; Y461-Q465 HydrophobicContact CD1-CG 4.27Å; Y461-Q465 HydrophobicContact CD2-CG 4.48Å; Y461-Q465 HydrophobicContact CE1-CG 3.86Å; Y461-Q465 HydrophobicContact CE2-CG 4.09Å; Y461-Q465 WeakPolarHBondContact O-CG 3.49Å; Y461-Q465 PolarHBondContact O-N 3.28Å; Y461-Q465 PolarHBondContact OH-NE2 2.91Å; Y461-Q465 VanDerWaalsContact OH-NE2 3.1Å
462	I	86.7	Confident	86.7	Confident	66 Å²	66	79.6 Å²	79.6	34%	0.338	42%	0.418	S	S	.	.	H	α-helix	trans	-59.2	-48.6	177.3	-69	167.8	0	0	0	110.9	I458 L459 T464 Q465 L466 L478	I458-I462 HydrophobicContact CG2-CD1 3.83Å; I458-I462 HydrophobicContact CG2-CG1 4.49Å; I458-I462 WeakPolarHBondContact O-CG1 3.49Å; I458-I462 PolarHBondContact O-N 3.27Å; L459-I462 PolarHBondContact O-N 2.93Å; I462-T464 PolarHBondContact O-N 2.91Å; I462-Q465 PolarHBondContact O-N 3.06Å; I462-Q465 VanDerWaalsContact O-N 3.12Å; I462-L466 HydrophobicContact CG2-CD1 3.57Å; I462-L466 HydrophobicContact CG2-CG 4.18Å; I462-L466 WeakPolarHBondContact O-CB 3.04Å; I462-L466 WeakPolarHBondContact O-CG 3.35Å; I462-L466 PolarHBondContact O-N 3.32Å; I462-L478 HydrophobicContact CG2-CD1 4.47Å; I462-L478 HydrophobicContact CG2-CD2 4.46Å
463	H	84.9	Confident	86.3	Confident	48 Å²	48	83.5 Å²	83.5	22%	0.222	45%	0.445	C	S	.	.	H	α-helix	trans	-57.9	-38.8	176.7	173.3	-100.5	0	0	0	112	L459 Y461 K467 L478	L459-H463 VanDerWaalsContact O-CB 3.32Å; L459-H463 WeakPolarHBondContact O-CB 3.26Å; L459-H463 PolarHBondContact O-N 3.29Å; Y461-H463 PolarHBondContact O-N 3.23Å; H463-K467 PolarHBondContact O-N 3.46Å; H463-L478 HydrophobicContact CB-CB 4.33Å; H463-L478 HydrophobicContact CB-CD1 4.37Å
464	T	81.3	Confident	85.9	Confident	87 Å²	87	82.6 Å²	82.6	53%	0.534	45%	0.449	S	S	.	.	H	α-helix	trans	-68	-39.4	177.2	-53.9	0	0	0	0	111.7	T460 Y461 I462 K467	T460-T464 WeakPolarHBondContact O-CB 3.49Å; T460-T464 PolarHBondContact O-N 3.45Å; T460-T464 PolarHBondContact O-OG1 3.46Å; Y461-T464 WeakPolarHBondContact O-CB 3.48Å; Y461-T464 PolarHBondContact O-N 2.97Å; Y461-T464 VanDerWaalsContact O-N 3.16Å; I462-T464 PolarHBondContact O-N 2.91Å; T464-K467 WeakPolarHBondContact O-CB 3.43Å
465	Q	81.8	Confident	85.6	Confident	110 Å²	110	86.2 Å²	86.2	51%	0.514	46%	0.459	S	S	.	.	H	α-helix	trans	-73	-30.5	178.8	-69.9	-65.4	-3.6	0	0	113.7	Y461 I462 K467	Y461-Q465 HydrophobicContact CD1-CG 4.27Å; Y461-Q465 HydrophobicContact CD2-CG 4.48Å; Y461-Q465 HydrophobicContact CE1-CG 3.86Å; Y461-Q465 HydrophobicContact CE2-CG 4.09Å; Y461-Q465 WeakPolarHBondContact O-CG 3.49Å; Y461-Q465 PolarHBondContact O-N 3.28Å; Y461-Q465 PolarHBondContact OH-NE2 2.91Å; Y461-Q465 VanDerWaalsContact OH-NE2 3.1Å; I462-Q465 PolarHBondContact O-N 3.06Å; I462-Q465 VanDerWaalsContact O-N 3.12Å; Q465-K467 VanDerWaalsContact C-N 3.34Å
466	L	82.3	Confident	85.2	Confident	70 Å²	70	88 Å²	88	37%	0.366	47%	0.472	S	S	.	.	H	α-helix	trans	-87.2	-4.8	178.7	-66.2	178.4	0	0	0	113.4	I462 G468 K469 E470 L478	I462-L466 HydrophobicContact CG2-CD1 3.57Å; I462-L466 HydrophobicContact CG2-CG 4.18Å; I462-L466 WeakPolarHBondContact O-CB 3.04Å; I462-L466 WeakPolarHBondContact O-CG 3.35Å; I462-L466 PolarHBondContact O-N 3.32Å; L466-G468 PolarHBondContact O-N 2.85Å; L466-K469 PolarHBondContact O-N 2.74Å; L466-E470 HydrophobicContact CB-CB 4.32Å; L466-E470 PolarHBondContact O-N 2.87Å; L466-L478 HydrophobicContact CD1-CD1 4.01Å
467	K	79.7	Confident	85.1	Confident	163 Å²	163	90.7 Å²	90.7	71%	0.709	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	112.3	-179.5	-166	178.2	-179.3	-175.1	0	110.2	H463 T464 Q465	H463-K467 PolarHBondContact O-N 3.46Å; T464-K467 WeakPolarHBondContact O-CB 3.43Å; Q465-K467 VanDerWaalsContact C-N 3.34Å
468	G	78.1	Confident	85	Confident	68 Å²	68	87.3 Å²	87.3	70%	0.701	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	95	-6.5	-178.9	0	0	0	0	0	115.8	L466	L466-G468 PolarHBondContact O-N 2.85Å
469	K	82.3	Confident	84.9	Confident	184 Å²	184	90.3 Å²	90.3	80%	0.8	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.9	-3.1	178.5	-62.8	-178	-178.6	177.5	0	114.1	L466	L466-K469 PolarHBondContact O-N 2.74Å
470	E	82.1	Confident	84.9	Confident	20 Å²	20	90.5 Å²	90.5	9%	0.093	49%	0.489	C	S	.	.	S	Bend	trans	-100.2	149	-174.3	63.9	-174.1	175.8	0	0	113.8	L466 A474 R475	L466-E470 HydrophobicContact CB-CB 4.32Å; L466-E470 PolarHBondContact O-N 2.87Å; E470-A474 HydrophobicContact CB-CB 4.32Å; E470-R475 HydrophobicContact CG-CB 4.06Å; E470-R475 VanDerWaalsContact OE1-CB 3.25Å; E470-R475 WeakPolarHBondContact OE1-CB 2.97Å; E470-R475 WeakPolarHBondContact OE1-CG 3.29Å; E470-R475 IonicContact OE1-NE 3.67Å; E470-R475 PolarHBondContact OE1-NE 3.19Å; E470-R475 VanDerWaalsContact OE1-NE 3.07Å
471	N	87.9	Confident	85	Confident	133 Å²	133	90.4 Å²	90.4	71%	0.711	49%	0.49	S	S	*	.			trans	-71	156.4	169.6	-66.8	-14.5	0	0	0	111.2	C473 A474 R475	N471-C473 VanDerWaalsContact C-N 3.26Å; N471-C473 PolarHBondContact O-N 3.38Å; N471-C473 VanDerWaalsContact O-N 3.16Å; N471-A474 PolarHBondContact O-N 2.83Å; N471-A474 VanDerWaalsContact O-N 3.13Å; N471-R475 PolarHBondContact O-N 2.88Å; N471-R475 VanDerWaalsContact O-N 3.16Å
472	A	87.4	Confident	85.2	Confident	79 Å²	79	84.9 Å²	84.9	65%	0.653	47%	0.471	S	S	*	.	H	α-helix	trans	-55.4	-36.5	-175.7	0	0	0	0	0	114.3	C476	A472-C476 WeakPolarHBondContact O-CB 3.3Å; A472-C476 PolarHBondContact O-N 3.16Å
473	C	85.2	Confident	85.3	Confident	101 Å²	101	85 Å²	85	68%	0.682	48%	0.478	S	S	*	.	H	α-helix	trans	-65	-47.2	177.6	-177.1	0	0	0	0	112.4	N471 R475 C476 M477	N471-C473 VanDerWaalsContact C-N 3.26Å; N471-C473 PolarHBondContact O-N 3.38Å; N471-C473 VanDerWaalsContact O-N 3.16Å; C473-R475 VanDerWaalsContact C-N 3.32Å; C473-R475 PolarHBondContact O-N 3.39Å; C473-C476 PolarHBondContact O-N 2.99Å; C473-M477 WeakPolarHBondContact O-CB 3.45Å; C473-M477 PolarHBondContact O-N 3.12Å
474	A	84.8	Confident	85.6	Confident	37 Å²	37	86.9 Å²	86.9	31%	0.306	50%	0.495	S	S	.	.	H	α-helix	trans	-62.1	-41.1	178.3	0	0	0	0	0	111.5	E470 N471 C476 M477 L478	E470-A474 HydrophobicContact CB-CB 4.32Å; N471-A474 PolarHBondContact O-N 2.83Å; N471-A474 VanDerWaalsContact O-N 3.13Å; A474-C476 PolarHBondContact O-N 2.84Å; A474-M477 PolarHBondContact O-N 2.97Å; A474-L478 WeakPolarHBondContact O-CB 3.32Å; A474-L478 WeakPolarHBondContact O-CG 3.38Å; A474-L478 PolarHBondContact O-N 3.02Å
475	R	85.9	Confident	86.1	Confident	119 Å²	119	84.4 Å²	84.4	45%	0.449	48%	0.478	S	S	.	.	H	α-helix	trans	-58.3	-48	173.6	-174.3	177.5	-57.7	156.3	11.2	112.2	E470 N471 C473 K479	E470-R475 HydrophobicContact CG-CB 4.06Å; E470-R475 VanDerWaalsContact OE1-CB 3.25Å; E470-R475 WeakPolarHBondContact OE1-CB 2.97Å; E470-R475 WeakPolarHBondContact OE1-CG 3.29Å; E470-R475 IonicContact OE1-NE 3.67Å; E470-R475 PolarHBondContact OE1-NE 3.19Å; E470-R475 VanDerWaalsContact OE1-NE 3.07Å; N471-R475 PolarHBondContact O-N 2.88Å; N471-R475 VanDerWaalsContact O-N 3.16Å; C473-R475 VanDerWaalsContact C-N 3.32Å; C473-R475 PolarHBondContact O-N 3.39Å; R475-K479 VanDerWaalsContact O-CB 3.3Å; R475-K479 WeakPolarHBondContact O-CB 3.25Å; R475-K479 PolarHBondContact O-N 3.49Å
476	C	86	Confident	86.5	Confident	88 Å²	88	83.9 Å²	83.9	60%	0.595	47%	0.472	S	S	*	.	H	α-helix	trans	-62.7	-48	-179.9	-171.3	0	0	0	0	111.1	A472 C473 A474 K479 A480	A472-C476 WeakPolarHBondContact O-CB 3.3Å; A472-C476 PolarHBondContact O-N 3.16Å; C473-C476 PolarHBondContact O-N 2.99Å; A474-C476 PolarHBondContact O-N 2.84Å; C476-K479 PolarHBondContact O-N 2.95Å; C476-A480 WeakPolarHBondContact O-CB 3.48Å; C476-A480 PolarHBondContact O-N 3.35Å
477	M	88.6	Confident	86.8	Confident	117 Å²	117	84 Å²	84	58%	0.576	48%	0.478	S	S	*	.	H	α-helix	trans	-62.7	-47	-179.6	-168.7	-178.3	77.7	0	0	112	C473 A474 K479 A480 C481	C473-M477 WeakPolarHBondContact O-CB 3.45Å; C473-M477 PolarHBondContact O-N 3.12Å; A474-M477 PolarHBondContact O-N 2.97Å; M477-K479 PolarHBondContact O-N 3.4Å; M477-A480 PolarHBondContact O-N 2.85Å; M477-C481 WeakPolarHBondContact O-CB 3.48Å; M477-C481 PolarHBondContact O-N 2.7Å; M477-C481 PolarHBondContact O-SG 2.99Å
478	L	87.3	Confident	87.4	Confident	16 Å²	16	79.9 Å²	79.9	8%	0.084	46%	0.464	C	S	.	.	H	α-helix	trans	-61.3	-44.2	177.7	-74.6	172	0	0	0	111.5	L459 I462 H463 L466 A474 A480 C481 V482	L459-L478 HydrophobicContact CD2-CD2 3.96Å; I462-L478 HydrophobicContact CG2-CD1 4.47Å; I462-L478 HydrophobicContact CG2-CD2 4.46Å; H463-L478 HydrophobicContact CB-CB 4.33Å; H463-L478 HydrophobicContact CB-CD1 4.37Å; L466-L478 HydrophobicContact CD1-CD1 4.01Å; A474-L478 WeakPolarHBondContact O-CB 3.32Å; A474-L478 WeakPolarHBondContact O-CG 3.38Å; A474-L478 PolarHBondContact O-N 3.02Å; L478-A480 VanDerWaalsContact C-N 3.35Å; L478-A480 PolarHBondContact O-N 3.38Å; L478-C481 PolarHBondContact O-N 2.86Å; L478-V482 WeakPolarHBondContact O-CB 3.18Å; L478-V482 VanDerWaalsContact O-CG2 3.23Å; L478-V482 WeakPolarHBondContact O-CG2 3.18Å; L478-V482 PolarHBondContact O-N 2.95Å
479	K	87.5	Confident	88	Confident	146 Å²	146	77.5 Å²	77.5	64%	0.635	43%	0.434	S	S	*	.	H	α-helix	trans	-63	-41.4	177.3	-169.8	175.8	-178.4	-177	0	111.8	R475 C476 M477 C483	R475-K479 VanDerWaalsContact O-CB 3.3Å; R475-K479 WeakPolarHBondContact O-CB 3.25Å; R475-K479 PolarHBondContact O-N 3.49Å; C476-K479 PolarHBondContact O-N 2.95Å; M477-K479 PolarHBondContact O-N 3.4Å; K479-C483 WeakPolarHBondContact O-CB 2.94Å; K479-C483 PolarHBondContact O-N 3.48Å
480	A	89.1	Confident	88.2	Confident	48 Å²	48	73.9 Å²	73.9	40%	0.397	42%	0.418	S	S	.	.	H	α-helix	trans	-64.2	-48.6	176	0	0	0	0	0	111.6	C476 M477 L478 V482 C483 C484	C476-A480 WeakPolarHBondContact O-CB 3.48Å; C476-A480 PolarHBondContact O-N 3.35Å; M477-A480 PolarHBondContact O-N 2.85Å; L478-A480 VanDerWaalsContact C-N 3.35Å; L478-A480 PolarHBondContact O-N 3.38Å; A480-V482 PolarHBondContact O-N 2.98Å; A480-C483 WeakPolarHBondContact O-CB 3.02Å; A480-C483 PolarHBondContact O-N 2.82Å; A480-C484 PolarHBondContact O-N 3.09Å; A480-C484 PolarHBondContact O-SG 3.47Å
481	C	89.8	Confident	88.5	Confident	52 Å²	52	76 Å²	76	35%	0.351	43%	0.434	S	S	.	.	H	α-helix	trans	-61.3	-43.6	177.9	-69.2	0	0	0	0	112.5	L459 M477 L478 C483 C484 L485	L459-C481 HydrophobicContact CD1-CB 4.22Å; M477-C481 WeakPolarHBondContact O-CB 3.48Å; M477-C481 PolarHBondContact O-N 2.7Å; M477-C481 PolarHBondContact O-SG 2.99Å; L478-C481 PolarHBondContact O-N 2.86Å; C481-C483 VanDerWaalsContact C-N 3.31Å; C481-C483 PolarHBondContact O-N 3.43Å; C481-C484 PolarHBondContact O-N 3.43Å; C481-L485 WeakPolarHBondContact O-CB 3.33Å; C481-L485 WeakPolarHBondContact O-CG 3.29Å; C481-L485 PolarHBondContact O-N 3.49Å
482	V	90.3	Very high	88.7	Confident	30 Å²	30	71 Å²	71	18%	0.182	41%	0.407	C	S	.	.	H	α-helix	trans	-61.5	-41.7	176.1	170.1	0	0	0	0	110.8	L459 L478 A480 Y486	L459-V482 HydrophobicContact CB-CG2 3.99Å; L478-V482 WeakPolarHBondContact O-CB 3.18Å; L478-V482 VanDerWaalsContact O-CG2 3.23Å; L478-V482 WeakPolarHBondContact O-CG2 3.18Å; L478-V482 PolarHBondContact O-N 2.95Å; A480-V482 PolarHBondContact O-N 2.98Å; V482-Y486 WeakPolarHBondContact O-CB 3.29Å; V482-Y486 PolarHBondContact O-N 3.28Å
483	C	90.1	Very high	88.8	Confident	70 Å²	70	69.6 Å²	69.6	47%	0.473	39%	0.391	S	S	.	.	H	α-helix	trans	-63.1	-48.7	175.2	-171.7	0	0	0	0	111.7	K479 A480 C481 L485 Y486 C487	K479-C483 WeakPolarHBondContact O-CB 2.94Å; K479-C483 PolarHBondContact O-N 3.48Å; A480-C483 WeakPolarHBondContact O-CB 3.02Å; A480-C483 PolarHBondContact O-N 2.82Å; C481-C483 VanDerWaalsContact C-N 3.31Å; C481-C483 PolarHBondContact O-N 3.43Å; C483-L485 PolarHBondContact O-N 2.88Å; C483-Y486 WeakPolarHBondContact O-CB 3.44Å; C483-Y486 PolarHBondContact O-N 3.48Å; C483-C487 PolarHBondContact O-N 2.98Å; C483-C487 PolarHBondContact O-SG 3.13Å
484	C	91.2	Very high	88.9	Confident	86 Å²	86	68.4 Å²	68.4	58%	0.581	37%	0.374	S	S	*	.	H	α-helix	trans	-60.7	-43.8	179.3	-68.5	0	0	0	0	112.3	A480 C481 Y486 C487 L488	A480-C484 PolarHBondContact O-N 3.09Å; A480-C484 PolarHBondContact O-SG 3.47Å; C481-C484 PolarHBondContact O-N 3.43Å; C484-Y486 VanDerWaalsContact C-N 3.34Å; C484-C487 PolarHBondContact O-N 2.96Å; C484-L488 WeakPolarHBondContact O-CB 3.42Å; C484-L488 PolarHBondContact O-N 2.9Å
485	L	91.1	Very high	89.1	Confident	35 Å²	35	68.3 Å²	68.3	18%	0.183	37%	0.368	C	S	.	.	H	α-helix	trans	-68.3	-33.9	176.9	-70.7	174	0	0	0	112.2	V452 P455 R456 L459 C481 C483 L488 E489	V452-L485 HydrophobicContact CG1-CD2 4.1Å; P455-L485 HydrophobicContact CB-CD1 4.19Å; R456-L485 HydrophobicContact CB-CB 4.03Å; R456-L485 HydrophobicContact CB-CD1 4.29Å; R456-L485 HydrophobicContact CG-CB 4.17Å; L459-L485 HydrophobicContact CD1-CD1 3.47Å; L459-L485 VanDerWaalsContact CD1-CD1 3.47Å; C481-L485 WeakPolarHBondContact O-CB 3.33Å; C481-L485 WeakPolarHBondContact O-CG 3.29Å; C481-L485 PolarHBondContact O-N 3.49Å; C483-L485 PolarHBondContact O-N 2.88Å; L485-L488 HydrophobicContact CD2-CD2 4.48Å; L485-L488 PolarHBondContact O-N 3Å; L485-E489 WeakPolarHBondContact O-CB 3.27Å; L485-E489 PolarHBondContact O-N 2.04Å
486	Y	90.6	Very high	89.5	Confident	100 Å²	100	62.7 Å²	62.7	39%	0.392	35%	0.347	S	S	.	.	H	α-helix	trans	-63.5	-47.1	171.7	178.4	-116.9	0	0	0	111.9	V482 C483 C484 L488 E489 K490	V482-Y486 WeakPolarHBondContact O-CB 3.29Å; V482-Y486 PolarHBondContact O-N 3.28Å; C483-Y486 WeakPolarHBondContact O-CB 3.44Å; C483-Y486 PolarHBondContact O-N 3.48Å; C484-Y486 VanDerWaalsContact C-N 3.34Å; Y486-L488 VanDerWaalsContact C-N 3.32Å; Y486-L488 PolarHBondContact O-N 2.97Å; Y486-E489 PolarHBondContact O-N 2.92Å; Y486-K490 HydrophobicContact CD2-CG 4.41Å; Y486-K490 HydrophobicContact CE1-CG 4.39Å; Y486-K490 HydrophobicContact CE2-CD 4.4Å; Y486-K490 VanDerWaalsContact CE2-CE 3.5Å; Y486-K490 HydrophobicContact CE2-CG 4.12Å; Y486-K490 WeakPolarHBondContact O-CG 3.27Å; Y486-K490 PolarHBondContact O-N 2.73Å; Y486-K490 WeakPolarHBondContact OH-CE 3.4Å
487	C	88.9	Confident	89.8	Confident	72 Å²	72	58.8 Å²	58.8	49%	0.486	32%	0.32	S	S	.	.	H	α-helix	trans	-61.5	-41.6	175.9	-66.6	0	0	0	0	111.5	C483 C484 K490 C491	C483-C487 PolarHBondContact O-N 2.98Å; C483-C487 PolarHBondContact O-SG 3.13Å; C484-C487 PolarHBondContact O-N 2.96Å; C487-K490 PolarHBondContact O-N 2.82Å; C487-C491 WeakPolarHBondContact O-CB 3.31Å; C487-C491 PolarHBondContact O-N 2.89Å
488	L	90.5	Very high	89.9	Confident	77 Å²	77	53.5 Å²	53.5	40%	0.403	29%	0.294	S	S	.	.	H	α-helix	trans	-63.6	-45.4	176.4	-178.6	61.3	0	0	0	111.5	V452 C484 L485 Y486 K490 C491 L492	V452-L488 HydrophobicContact CG1-CB 4.24Å; V452-L488 HydrophobicContact CG1-CD2 3.95Å; V452-L488 HydrophobicContact CG1-CG 4.04Å; V452-L488 HydrophobicContact CG2-CD2 3.75Å; V452-L488 HydrophobicContact CG2-CG 4.15Å; C484-L488 WeakPolarHBondContact O-CB 3.42Å; C484-L488 PolarHBondContact O-N 2.9Å; L485-L488 HydrophobicContact CD2-CD2 4.48Å; L485-L488 PolarHBondContact O-N 3Å; Y486-L488 VanDerWaalsContact C-N 3.32Å; Y486-L488 PolarHBondContact O-N 2.97Å; L488-K490 VanDerWaalsContact C-N 3.33Å; L488-K490 PolarHBondContact O-N 3.1Å; L488-C491 PolarHBondContact O-N 2.99Å; L488-L492 HydrophobicContact CD1-CD1 4.36Å; L488-L492 HydrophobicContact CD1-CG 4.25Å; L488-L492 HydrophobicContact CG-CD1 4.12Å; L488-L492 HydrophobicContact CG-CG 4.43Å; L488-L492 WeakPolarHBondContact O-CB 3.26Å; L488-L492 VanDerWaalsContact O-CG 3.29Å; L488-L492 WeakPolarHBondContact O-CG 3.27Å; L488-L492 PolarHBondContact O-N 2.96Å
489	E	91.8	Very high	90.3	Very high	17 Å²	17	52.7 Å²	52.7	8%	0.079	29%	0.29	C	S	.	.	H	α-helix	trans	-57.4	-46.6	175.1	-178	-175.9	137.8	0	0	111	V452 R456 L485 Y486 C491 L492 V493	V452-E489 HydrophobicContact CG1-CB 4.21Å; R456-E489 WeakPolarHBondContact CD-OE2 3.23Å; R456-E489 IonicContact CZ-OE2 2.72Å; R456-E489 IonicContact NE-OE2 2.71Å; R456-E489 IonicContact NH1-OE1 3.14Å; R456-E489 PolarHBondContact NH1-OE1 2.93Å; R456-E489 IonicContact NH1-OE2 2.78Å; R456-E489 PolarHBondContact NH1-OE2 3.22Å; L485-E489 WeakPolarHBondContact O-CB 3.27Å; L485-E489 PolarHBondContact O-N 2.04Å; Y486-E489 PolarHBondContact O-N 2.92Å; E489-C491 PolarHBondContact O-N 2.84Å; E489-L492 PolarHBondContact O-N 3.24Å; E489-V493 WeakPolarHBondContact O-CG2 3.33Å; E489-V493 PolarHBondContact O-N 3.23Å
490	K	86.8	Confident	90.6	Very high	109 Å²	109	45.8 Å²	45.8	47%	0.474	26%	0.26	S	S	.	.	H	α-helix	trans	-62.6	-42.5	177.6	-69.9	-61.4	-174.9	179.5	0	112.8	Y486 C487 L488 V493 F494	Y486-K490 HydrophobicContact CD2-CG 4.41Å; Y486-K490 HydrophobicContact CE1-CG 4.39Å; Y486-K490 HydrophobicContact CE2-CD 4.4Å; Y486-K490 VanDerWaalsContact CE2-CE 3.5Å; Y486-K490 HydrophobicContact CE2-CG 4.12Å; Y486-K490 WeakPolarHBondContact O-CG 3.27Å; Y486-K490 PolarHBondContact O-N 2.73Å; Y486-K490 WeakPolarHBondContact OH-CE 3.4Å; C487-K490 PolarHBondContact O-N 2.82Å; L488-K490 VanDerWaalsContact C-N 3.33Å; L488-K490 PolarHBondContact O-N 3.1Å; K490-V493 PolarHBondContact O-N 2.86Å; K490-F494 PolarHBondContact O-N 2.89Å
491	C	87.6	Confident	90.9	Very high	63 Å²	63	43.5 Å²	43.5	43%	0.426	24%	0.241	S	C	.	.	H	α-helix	trans	-61.7	-43.6	174.7	-176	0	0	0	0	111.6	C487 L488 E489 F494 L495	C487-C491 WeakPolarHBondContact O-CB 3.31Å; C487-C491 PolarHBondContact O-N 2.89Å; L488-C491 PolarHBondContact O-N 2.99Å; E489-C491 PolarHBondContact O-N 2.84Å; C491-F494 PolarHBondContact O-N 3.13Å; C491-L495 WeakPolarHBondContact O-CB 3.47Å; C491-L495 WeakPolarHBondContact O-CG 3.45Å; C491-L495 PolarHBondContact O-N 2.97Å
492	L	91.3	Very high	91	Very high	28 Å²	28	41 Å²	41	15%	0.147	23%	0.225	C	C	.	.	H	α-helix	trans	-65.9	-40	177.9	-71.8	175.2	0	0	0	112.5	I448 I449 V452 L488 E489 F494 L495 N496	I448-L492 HydrophobicContact CG2-CD1 3.98Å; I448-L492 HydrophobicContact CG2-CD2 3.81Å; I448-L492 HydrophobicContact CG2-CG 4.42Å; I449-L492 HydrophobicContact CG1-CB 4.48Å; V452-L492 HydrophobicContact CB-CD1 4.07Å; V452-L492 HydrophobicContact CG2-CD1 3.43Å; V452-L492 VanDerWaalsContact CG2-CD1 3.43Å; L488-L492 HydrophobicContact CD1-CD1 4.36Å; L488-L492 HydrophobicContact CD1-CG 4.25Å; L488-L492 HydrophobicContact CG-CD1 4.12Å; L488-L492 HydrophobicContact CG-CG 4.43Å; L488-L492 WeakPolarHBondContact O-CB 3.26Å; L488-L492 VanDerWaalsContact O-CG 3.29Å; L488-L492 WeakPolarHBondContact O-CG 3.27Å; L488-L492 PolarHBondContact O-N 2.96Å; E489-L492 PolarHBondContact O-N 3.24Å; L492-F494 VanDerWaalsContact C-N 3.34Å; L492-F494 PolarHBondContact O-N 3.2Å; L492-L495 PolarHBondContact O-N 2.9Å; L492-N496 VanDerWaalsContact O-CB 3.26Å; L492-N496 WeakPolarHBondContact O-CB 3.46Å; L492-N496 PolarHBondContact O-N 3.35Å; L492-N496 PolarHBondContact O-OD1 2.95Å
493	V	90.3	Very high	91.2	Very high	50 Å²	50	39.6 Å²	39.6	30%	0.303	22%	0.216	S	C	.	.	H	α-helix	trans	-60.5	-45.5	174.1	170.1	0	0	0	0	110.6	I449 E489 K490 N496 Q497	I449-V493 HydrophobicContact CD1-CG2 4Å; I449-V493 HydrophobicContact CG1-CG2 4.41Å; E489-V493 WeakPolarHBondContact O-CG2 3.33Å; E489-V493 PolarHBondContact O-N 3.23Å; K490-V493 PolarHBondContact O-N 2.86Å; V493-N496 PolarHBondContact O-N 3.18Å; V493-Q497 PolarHBondContact O-N 3.31Å
494	F	87.2	Confident	91.3	Very high	76 Å²	76	36.5 Å²	36.5	33%	0.333	20%	0.195	S	C	.	.	H	α-helix	trans	-61.6	-48	176.1	175.1	-98.2	0	0	0	112.1	K490 C491 L492 N496 Q497 N498 L521	K490-F494 PolarHBondContact O-N 2.89Å; C491-F494 PolarHBondContact O-N 3.13Å; L492-F494 VanDerWaalsContact C-N 3.34Å; L492-F494 PolarHBondContact O-N 3.2Å; F494-N496 VanDerWaalsContact C-N 3.34Å; F494-N496 PolarHBondContact O-N 3.43Å; F494-Q497 PolarHBondContact O-N 3.02Å; F494-N498 WeakPolarHBondContact CE2-ND2 3.45Å; F494-N498 VanDerWaalsContact CZ-ND2 3.3Å; F494-N498 WeakPolarHBondContact CZ-ND2 3.43Å; F494-N498 PolarHBondContact O-N 3.07Å; F494-N498 PolarHBondContact O-ND2 2.98Å; F494-L521 HydrophobicContact CE1-CD1 4.07Å; F494-L521 HydrophobicContact CZ-CD1 4.08Å
495	L	90	Very high	91.3	Very high	35 Å²	35	32.8 Å²	32.8	18%	0.183	17%	0.169	C	C	.	.	H	α-helix	trans	-62.7	-40.8	178.3	-73	174.5	0	0	0	111.9	C491 L492 N498 A499 F518	C491-L495 WeakPolarHBondContact O-CB 3.47Å; C491-L495 WeakPolarHBondContact O-CG 3.45Å; C491-L495 PolarHBondContact O-N 2.97Å; L492-L495 PolarHBondContact O-N 2.9Å; L495-N498 PolarHBondContact O-N 3.27Å; L495-A499 VanDerWaalsContact O-CB 3.29Å; L495-A499 WeakPolarHBondContact O-CB 3.45Å; L495-A499 PolarHBondContact O-N 3.32Å; L495-F518 HydrophobicContact CD2-CD2 3.93Å
496	N	93.3	Very high	91.1	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.011	17%	0.167	C	C	.	.	H	α-helix	trans	-61.8	-45.8	177.2	-80	19.9	0	0	0	111.7	G445 I449 L492 V493 F494 N498 A499 Y500 F510	G445-N496 WeakPolarHBondContact CA-ND2 3.11Å; G445-N496 PolarHBondContact O-ND2 2.92Å; I449-N496 HydrophobicContact CD1-CB 4.41Å; I449-N496 WeakPolarHBondContact CD1-ND2 3.33Å; I449-N496 WeakPolarHBondContact CG1-ND2 3.47Å; L492-N496 VanDerWaalsContact O-CB 3.26Å; L492-N496 WeakPolarHBondContact O-CB 3.46Å; L492-N496 PolarHBondContact O-N 3.35Å; L492-N496 PolarHBondContact O-OD1 2.95Å; V493-N496 PolarHBondContact O-N 3.18Å; F494-N496 VanDerWaalsContact C-N 3.34Å; F494-N496 PolarHBondContact O-N 3.43Å; N496-N498 VanDerWaalsContact C-N 3.31Å; N496-N498 PolarHBondContact O-N 3.07Å; N496-A499 WeakPolarHBondContact O-CB 3.08Å; N496-A499 PolarHBondContact O-N 3.03Å; N496-Y500 HydrophobicContact CB-CE2 3.97Å; N496-Y500 WeakPolarHBondContact O-CD2 3.46Å; N496-Y500 PolarHBondContact O-N 3.08Å; N496-F510 VanDerWaalsContact OD1-CZ 3.29Å; N496-F510 WeakPolarHBondContact OD1-CZ 3.4Å
497	Q	91.9	Very high	91	Very high	6 Å²	6	28.2 Å²	28.2	3%	0.028	16%	0.155	C	C	.	.	H	α-helix	trans	-59.3	-44	178.7	-177	61.4	16.6	0	0	111.7	V493 F494 T501 D594	V493-Q497 PolarHBondContact O-N 3.31Å; F494-Q497 PolarHBondContact O-N 3.02Å; Q497-T501 PolarHBondContact O-N 3.41Å; Q497-T501 VanDerWaalsContact O-N 3.1Å; Q497-T501 PolarHBondContact O-OG1 2.96Å; Q497-D594 HydrophobicContact CG-CB 4.48Å
498	N	92.1	Very high	91.1	Very high	5 Å²	5	26.4 Å²	26.4	3%	0.027	14%	0.142	C	C	.	.	H	α-helix	trans	-68.4	-37.9	176.8	-74.5	-75.1	0	0	0	112.1	F494 L495 N496 T501 A502 A517 L521 L598	F494-N498 WeakPolarHBondContact CE2-ND2 3.45Å; F494-N498 VanDerWaalsContact CZ-ND2 3.3Å; F494-N498 WeakPolarHBondContact CZ-ND2 3.43Å; F494-N498 PolarHBondContact O-N 3.07Å; F494-N498 PolarHBondContact O-ND2 2.98Å; L495-N498 PolarHBondContact O-N 3.27Å; N496-N498 VanDerWaalsContact C-N 3.31Å; N496-N498 PolarHBondContact O-N 3.07Å; N498-T501 PolarHBondContact O-N 2.67Å; N498-A502 PolarHBondContact O-N 3.32Å; N498-A517 HydrophobicContact CB-CB 4.09Å; N498-L521 HydrophobicContact CB-CD1 4.18Å; N498-L598 WeakPolarHBondContact O-CD2 3.33Å
499	A	94.1	Very high	91.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.2	-45.5	175.3	0	0	0	0	0	112.1	L495 N496 T501 A502 T503 F510 S513 V514	L495-A499 VanDerWaalsContact O-CB 3.29Å; L495-A499 WeakPolarHBondContact O-CB 3.45Å; L495-A499 PolarHBondContact O-N 3.32Å; N496-A499 WeakPolarHBondContact O-CB 3.08Å; N496-A499 PolarHBondContact O-N 3.03Å; A499-T501 PolarHBondContact O-N 3.3Å; A499-A502 PolarHBondContact O-N 2.82Å; A499-T503 WeakPolarHBondContact O-CB 3.5Å; A499-T503 PolarHBondContact O-N 2.99Å; A499-T503 PolarHBondContact O-OG1 2.85Å; A499-F510 HydrophobicContact CB-CD2 4.29Å; A499-F510 HydrophobicContact CB-CE2 3.95Å; A499-F510 HydrophobicContact CB-CZ 4.35Å; A499-S513 WeakPolarHBondContact O-CB 3.16Å; A499-V514 HydrophobicContact CB-CB 4.36Å; A499-V514 HydrophobicContact CB-CG2 3.43Å; A499-V514 VanDerWaalsContact CB-CG2 3.43Å
500	Y	95.4	Very high	91.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.5	-38	175.5	-61.2	-34.5	0	0	0	111.6	A400 Q403 M404 T441 G445 S446 N496 T503 A504 F510	A400-Y500 HydrophobicContact CB-CE2 3.97Å; A400-Y500 WeakPolarHBondContact CB-OH 3.3Å; Q403-Y500 HydrophobicContact CB-CD2 3.89Å; Q403-Y500 HydrophobicContact CB-CE2 4.28Å; M404-Y500 HydrophobicContact CB-CG 4.45Å; M404-Y500 HydrophobicContact SD-CD1 4.29Å; M404-Y500 HydrophobicContact SD-CG 4.3Å; M404-Y500 VanDerWaalsContact SD-O 3.41Å; T441-Y500 HydrophobicContact CG2-CD1 4.18Å; T441-Y500 HydrophobicContact CG2-CE1 4.31Å; G445-Y500 VanDerWaalsContact CA-OH 3.31Å; G445-Y500 WeakPolarHBondContact CA-OH 3.45Å; S446-Y500 PolarHBondContact N-OH 3.43Å; N496-Y500 HydrophobicContact CB-CE2 3.97Å; N496-Y500 WeakPolarHBondContact O-CD2 3.46Å; N496-Y500 PolarHBondContact O-N 3.08Å; Y500-T503 PolarHBondContact O-N 3.05Å; Y500-A504 WeakPolarHBondContact O-CB 3.4Å; Y500-A504 PolarHBondContact O-N 3.36Å; Y500-F510 HydrophobicContact CE1-CD2 4.12Å; Y500-F510 AromaticContact CE1-CE2 3.92Å; Y500-F510 HydrophobicContact CE1-CE2 3.92Å
501	T	94.1	Very high	91.3	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.006	12%	0.122	C	C	.	.	H	α-helix	trans	-64.8	-46	173.8	-53.4	0	0	0	0	112.1	Q497 N498 A499 T503 A504 I505 V595 L598	Q497-T501 PolarHBondContact O-N 3.41Å; Q497-T501 VanDerWaalsContact O-N 3.1Å; Q497-T501 PolarHBondContact O-OG1 2.96Å; N498-T501 PolarHBondContact O-N 2.67Å; A499-T501 PolarHBondContact O-N 3.3Å; T501-T503 VanDerWaalsContact C-N 3.35Å; T501-T503 PolarHBondContact O-N 3.13Å; T501-A504 WeakPolarHBondContact O-CB 3.39Å; T501-A504 PolarHBondContact O-N 3.46Å; T501-A504 VanDerWaalsContact O-N 3.17Å; T501-I505 HydrophobicContact CG2-CD1 4.1Å; T501-I505 VanDerWaalsContact O-CG1 3.3Å; T501-I505 WeakPolarHBondContact O-CG1 3.32Å; T501-I505 PolarHBondContact O-N 3.39Å; T501-V595 HydrophobicContact CG2-CB 4.3Å; T501-V595 HydrophobicContact CG2-CG1 3.78Å; T501-V595 HydrophobicContact CG2-CG2 4.46Å; T501-V595 WeakPolarHBondContact OG1-CG2 3.36Å; T501-L598 HydrophobicContact CG2-CB 3.89Å; T501-L598 HydrophobicContact CG2-CD2 3.65Å; T501-L598 HydrophobicContact CG2-CG 4.24Å
502	A	92.8	Very high	91.4	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-62.7	-40.6	175.6	0	0	0	0	0	112.5	W13 N498 A499 A504 I505 N506 S513 A517 L598	W13-A502 HydrophobicContact CH2-CB 3.64Å; W13-A502 HydrophobicContact CZ3-CB 3.93Å; N498-A502 PolarHBondContact O-N 3.32Å; A499-A502 PolarHBondContact O-N 2.82Å; A502-A504 VanDerWaalsContact C-N 3.32Å; A502-A504 PolarHBondContact O-N 3.3Å; A502-I505 PolarHBondContact O-N 3.19Å; A502-N506 PolarHBondContact O-N 3.05Å; A502-S513 WeakPolarHBondContact CB-O 3.34Å; A502-A517 HydrophobicContact CB-CB 4.09Å; A502-L598 HydrophobicContact CB-CD2 4.32Å
503	T	93.4	Very high	91.5	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62.1	-41.2	172.9	-58.3	0	0	0	0	110.9	M404 T441 A499 Y500 T501 I505 G507 T508 S513	M404-T503 HydrophobicContact CE-CG2 3.63Å; T441-T503 HydrophobicContact CG2-CG2 4.15Å; A499-T503 WeakPolarHBondContact O-CB 3.5Å; A499-T503 PolarHBondContact O-N 2.99Å; A499-T503 PolarHBondContact O-OG1 2.85Å; Y500-T503 PolarHBondContact O-N 3.05Å; T501-T503 VanDerWaalsContact C-N 3.35Å; T501-T503 PolarHBondContact O-N 3.13Å; T503-I505 VanDerWaalsContact C-N 3.26Å; T503-I505 PolarHBondContact O-N 3.01Å; T503-G507 WeakPolarHBondContact O-CA 3.47Å; T503-G507 PolarHBondContact O-N 2.99Å; T503-T508 WeakPolarHBondContact CG2-O 3.4Å; T503-T508 PolarHBondContact OG1-O 2.76Å; T503-S513 VanDerWaalsContact CA-OG 3.27Å; T503-S513 WeakPolarHBondContact CA-OG 3.23Å; T503-S513 PolarHBondContact N-OG 3.45Å; T503-S513 VanDerWaalsContact N-OG 3.15Å; T503-S513 VanDerWaalsContact OG1-CB 3.24Å; T503-S513 WeakPolarHBondContact OG1-CB 3.23Å; T503-S513 PolarHBondContact OG1-OG 2.96Å
504	A	93	Very high	91.5	Very high	5 Å²	5	16 Å²	16	4%	0.041	9%	0.09	C	C	.	.	H	α-helix	trans	-65.3	-28.8	178.5	0	0	0	0	0	113.2	M404 A407 Y500 T501 A502	M404-A504 HydrophobicContact CE-CB 4.23Å; A407-A504 HydrophobicContact CB-CB 4.05Å; Y500-A504 WeakPolarHBondContact O-CB 3.4Å; Y500-A504 PolarHBondContact O-N 3.36Å; T501-A504 WeakPolarHBondContact O-CB 3.39Å; T501-A504 PolarHBondContact O-N 3.46Å; T501-A504 VanDerWaalsContact O-N 3.17Å; A502-A504 VanDerWaalsContact C-N 3.32Å; A502-A504 PolarHBondContact O-N 3.3Å
505	I	90.9	Very high	91.6	Very high	7 Å²	7	12.5 Å²	12.5	4%	0.036	8%	0.075	C	C	.	.	H	α-helix	trans	-82.4	-53.2	177.5	-63	166.5	0	0	0	111.1	W13 P15 F415 T501 A502 T503 V602	W13-I505 HydrophobicContact CE3-CB 4.37Å; W13-I505 HydrophobicContact CE3-CG2 3.92Å; W13-I505 HydrophobicContact CZ3-CB 4.24Å; W13-I505 HydrophobicContact CZ3-CD1 4.14Å; W13-I505 HydrophobicContact CZ3-CG2 4.28Å; P15-I505 HydrophobicContact CB-CG2 4.15Å; P15-I505 HydrophobicContact CG-CG2 4.09Å; F415-I505 HydrophobicContact CE2-CD1 3.97Å; F415-I505 HydrophobicContact CE2-CG1 3.88Å; F415-I505 HydrophobicContact CE2-CG2 4.04Å; F415-I505 HydrophobicContact CZ-CG2 4.45Å; T501-I505 HydrophobicContact CG2-CD1 4.1Å; T501-I505 VanDerWaalsContact O-CG1 3.3Å; T501-I505 WeakPolarHBondContact O-CG1 3.32Å; T501-I505 PolarHBondContact O-N 3.39Å; A502-I505 PolarHBondContact O-N 3.19Å; T503-I505 VanDerWaalsContact C-N 3.26Å; T503-I505 PolarHBondContact O-N 3.01Å; I505-V602 HydrophobicContact CD1-CG2 4.2Å
506	N	87.8	Confident	91.5	Very high	25 Å²	25	11.6 Å²	11.6	13%	0.134	7%	0.07	C	C	.	.	H	α-helix	trans	-97.7	-13.7	-170	-70.3	-19.6	0	0	0	114.5	W13 K14 A502 T508	W13-N506 VanDerWaalsContact CE3-CG 3.46Å; W13-N506 VanDerWaalsContact CE3-OD1 3.32Å; W13-N506 WeakPolarHBondContact CZ3-ND2 3.42Å; K14-N506 PolarHBondContact N-OD1 3.32Å; A502-N506 PolarHBondContact O-N 3.05Å; N506-T508 VanDerWaalsContact C-N 3.29Å; N506-T508 HydrophobicContact CB-CG2 3.88Å; N506-T508 PolarHBondContact O-N 2.95Å
507	G	88.2	Confident	91.3	Very high	14 Å²	14	11.6 Å²	11.6	14%	0.144	7%	0.07	C	C	.	.			trans	66.2	24.9	-174	0	0	0	0	0	114.6	T22 T503	T22-G507 WeakPolarHBondContact CG2-O 3.45Å; T503-G507 WeakPolarHBondContact O-CA 3.47Å; T503-G507 PolarHBondContact O-N 2.99Å
508	T	89.9	Confident	91.1	Very high	34 Å²	34	15.6 Å²	15.6	21%	0.209	9%	0.088	C	C	.	.			trans	-91.7	164.6	-177.8	59.1	0	0	0	0	112.9	T22 T503 N506 S513	T22-T508 WeakPolarHBondContact CG2-O 3.37Å; T503-T508 WeakPolarHBondContact CG2-O 3.4Å; T503-T508 PolarHBondContact OG1-O 2.76Å; N506-T508 VanDerWaalsContact C-N 3.29Å; N506-T508 HydrophobicContact CB-CG2 3.88Å; N506-T508 PolarHBondContact O-N 2.95Å; T508-S513 PolarHBondContact OG1-OG 3.26Å
509	N	91.1	Very high	90.9	Very high	61 Å²	61	18.8 Å²	18.8	33%	0.326	10%	0.102	S	C	.	.			trans	-66.2	164.5	176.1	71.4	62	0	0	0	112.2	D23 C511 S512 S513	D23-N509 WeakPolarHBondContact OD2-CA 3.4Å; N509-C511 PolarHBondContact O-N 3.25Å; N509-C511 PolarHBondContact OD1-N 3.26Å; N509-S512 PolarHBondContact ND2-OG 2.86Å; N509-S512 PolarHBondContact O-N 3.31Å; N509-S512 PolarHBondContact OD1-N 2.9Å; N509-S512 PolarHBondContact OD1-OG 3.47Å; N509-S513 WeakPolarHBondContact O-CB 3.46Å; N509-S513 PolarHBondContact O-N 3.21Å; N509-S513 PolarHBondContact O-OG 2.86Å
510	F	92.8	Very high	90.4	Very high	6 Å²	6	19 Å²	19	3%	0.026	10%	0.103	C	C	.	.	H	α-helix	trans	-55.2	-44.2	-175.8	-174.4	-93.5	0	0	0	113.7	D23 T441 K444 I448 N496 A499 Y500 S513 V514	D23-F510 WeakPolarHBondContact OD2-CB 3.31Å; D23-F510 PolarHBondContact OD2-N 3.07Å; T441-F510 HydrophobicContact CG2-CB 3.86Å; T441-F510 HydrophobicContact CG2-CD2 3.82Å; T441-F510 HydrophobicContact CG2-CG 4.35Å; K444-F510 HydrophobicContact CD-CB 3.74Å; K444-F510 HydrophobicContact CD-CD1 4Å; K444-F510 HydrophobicContact CD-CG 4.05Å; K444-F510 HydrophobicContact CG-CB 4.47Å; K444-F510 HydrophobicContact CG-CD1 4.22Å; K444-F510 HydrophobicContact CG-CG 4.33Å; I448-F510 HydrophobicContact CD1-CD1 4.24Å; I448-F510 HydrophobicContact CD1-CE1 3.56Å; I448-F510 HydrophobicContact CD1-CZ 4.12Å; N496-F510 VanDerWaalsContact OD1-CZ 3.29Å; N496-F510 WeakPolarHBondContact OD1-CZ 3.4Å; A499-F510 HydrophobicContact CB-CD2 4.29Å; A499-F510 HydrophobicContact CB-CE2 3.95Å; A499-F510 HydrophobicContact CB-CZ 4.35Å; Y500-F510 HydrophobicContact CE1-CD2 4.12Å; Y500-F510 AromaticContact CE1-CE2 3.92Å; Y500-F510 HydrophobicContact CE1-CE2 3.92Å; F510-S513 PolarHBondContact O-N 3.31Å; F510-V514 HydrophobicContact CD1-CG2 3.94Å; F510-V514 HydrophobicContact CE1-CG2 3.53Å; F510-V514 HydrophobicContact CE2-CG2 4.41Å; F510-V514 HydrophobicContact CZ-CG2 3.78Å; F510-V514 VanDerWaalsContact O-CG2 3.27Å; F510-V514 WeakPolarHBondContact O-CG2 3.19Å; F510-V514 PolarHBondContact O-N 3.16Å
511	C	90.7	Very high	89.8	Confident	28 Å²	28	19.6 Å²	19.6	19%	0.189	11%	0.106	C	C	.	.	H	α-helix	trans	-69.1	-45.5	-175	-94.3	0	0	0	0	111.3	C3 K444 N509 S513 V514 C515	C3-C511 HydrophobicContact CB-CB 3.44Å; C3-C511 VanDerWaalsContact CB-CB 3.44Å; C3-C511 WeakPolarHBondContact CB-SG 3.32Å; C3-C511 WeakPolarHBondContact SG-CA 3.32Å; C3-C511 WeakPolarHBondContact SG-CB 3.46Å; C3-C511 CovalentContact SG-SG 2.06Å; C3-C511 PolarHBondContact SG-SG 3.11Å; K444-C511 PolarHBondContact NZ-SG 3.18Å; K444-C511 VanDerWaalsContact NZ-SG 3.36Å; N509-C511 PolarHBondContact O-N 3.25Å; N509-C511 PolarHBondContact OD1-N 3.26Å; C511-S513 VanDerWaalsContact C-N 3.32Å; C511-S513 PolarHBondContact O-N 3.45Å; C511-V514 PolarHBondContact O-N 3.17Å; C511-C515 PolarHBondContact O-N 3.35Å; C511-C515 VanDerWaalsContact O-N 3.1Å; C511-C515 PolarHBondContact O-SG 3.24Å
512	S	89.5	Confident	89.2	Confident	7 Å²	7	24.2 Å²	24.2	5%	0.049	13%	0.13	C	C	.	.	H	α-helix	trans	-58.3	-47.6	174.4	-60	0	0	0	0	110.5	R11 N509 V514 C515 D516	R11-S512 PolarHBondContact NH1-OG 2.9Å; R11-S512 VanDerWaalsContact NH2-CB 3.31Å; N509-S512 PolarHBondContact ND2-OG 2.86Å; N509-S512 PolarHBondContact O-N 3.31Å; N509-S512 PolarHBondContact OD1-N 2.9Å; N509-S512 PolarHBondContact OD1-OG 3.47Å; S512-V514 PolarHBondContact O-N 3.48Å; S512-C515 PolarHBondContact O-N 3.21Å; S512-C515 VanDerWaalsContact O-N 3.16Å; S512-D516 PolarHBondContact O-N 3.32Å
513	S	92.3	Very high	88.7	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.8	-42.1	178	-72.7	0	0	0	0	113.7	A499 A502 T503 T508 N509 F510 C511 C515 A517	A499-S513 WeakPolarHBondContact O-CB 3.16Å; A502-S513 WeakPolarHBondContact CB-O 3.34Å; T503-S513 VanDerWaalsContact CA-OG 3.27Å; T503-S513 WeakPolarHBondContact CA-OG 3.23Å; T503-S513 PolarHBondContact N-OG 3.45Å; T503-S513 VanDerWaalsContact N-OG 3.15Å; T503-S513 VanDerWaalsContact OG1-CB 3.24Å; T503-S513 WeakPolarHBondContact OG1-CB 3.23Å; T503-S513 PolarHBondContact OG1-OG 2.96Å; T508-S513 PolarHBondContact OG1-OG 3.26Å; N509-S513 WeakPolarHBondContact O-CB 3.46Å; N509-S513 PolarHBondContact O-N 3.21Å; N509-S513 PolarHBondContact O-OG 2.86Å; F510-S513 PolarHBondContact O-N 3.31Å; C511-S513 VanDerWaalsContact C-N 3.32Å; C511-S513 PolarHBondContact O-N 3.45Å; S513-C515 VanDerWaalsContact C-N 3.34Å; S513-C515 PolarHBondContact O-N 3.14Å; S513-A517 VanDerWaalsContact O-CB 3.27Å; S513-A517 WeakPolarHBondContact O-CB 3.39Å; S513-A517 PolarHBondContact O-N 2.87Å
514	V	91.6	Very high	87.8	Confident	24 Å²	24	32.4 Å²	32.4	15%	0.145	17%	0.17	C	C	.	.	H	α-helix	trans	-59.3	-46.4	173.8	168.3	0	0	0	0	110.4	A499 F510 C511 S512 F518	A499-V514 HydrophobicContact CB-CB 4.36Å; A499-V514 HydrophobicContact CB-CG2 3.43Å; A499-V514 VanDerWaalsContact CB-CG2 3.43Å; F510-V514 HydrophobicContact CD1-CG2 3.94Å; F510-V514 HydrophobicContact CE1-CG2 3.53Å; F510-V514 HydrophobicContact CE2-CG2 4.41Å; F510-V514 HydrophobicContact CZ-CG2 3.78Å; F510-V514 VanDerWaalsContact O-CG2 3.27Å; F510-V514 WeakPolarHBondContact O-CG2 3.19Å; F510-V514 PolarHBondContact O-N 3.16Å; C511-V514 PolarHBondContact O-N 3.17Å; S512-V514 PolarHBondContact O-N 3.48Å; V514-F518 WeakPolarHBondContact O-CB 3.48Å; V514-F518 PolarHBondContact O-N 2.95Å
515	C	89.3	Confident	86.9	Confident	3 Å²	3	34.3 Å²	34.3	2%	0.02	19%	0.186	C	C	.	.	H	α-helix	trans	-66.4	-44.7	-178	-65.7	0	0	0	0	112.3	C3 C4 C511 S512 S513 F518 K519	C3-C515 PolarHBondContact O-SG 3.29Å; C4-C515 WeakPolarHBondContact CA-SG 3.48Å; C4-C515 HydrophobicContact CB-CB 4.05Å; C4-C515 WeakPolarHBondContact CB-SG 3.48Å; C4-C515 PolarHBondContact N-SG 3.34Å; C4-C515 VanDerWaalsContact SG-CA 3.53Å; C4-C515 WeakPolarHBondContact SG-CB 3.39Å; C4-C515 CovalentContact SG-SG 2.04Å; C4-C515 PolarHBondContact SG-SG 2.94Å; C511-C515 PolarHBondContact O-N 3.35Å; C511-C515 VanDerWaalsContact O-N 3.1Å; C511-C515 PolarHBondContact O-SG 3.24Å; S512-C515 PolarHBondContact O-N 3.21Å; S512-C515 VanDerWaalsContact O-N 3.16Å; S513-C515 VanDerWaalsContact C-N 3.34Å; S513-C515 PolarHBondContact O-N 3.14Å; C515-F518 PolarHBondContact O-N 3.46Å; C515-K519 WeakPolarHBondContact O-CB 3.35Å; C515-K519 WeakPolarHBondContact O-CG 3.43Å; C515-K519 PolarHBondContact O-N 2.87Å
516	D	87.5	Confident	85.9	Confident	15 Å²	15	37.8 Å²	37.8	8%	0.08	22%	0.216	C	C	.	.	H	α-helix	trans	-62.7	-46.2	179.3	-60.9	-16	0	0	0	110.3	R11 W13 S512 L520	R11-D516 IonicContact NE-OD1 2.71Å; R11-D516 IonicContact NE-OD2 2.76Å; R11-D516 IonicContact NH2-OD1 3.07Å; R11-D516 PolarHBondContact NH2-OD1 3.3Å; R11-D516 IonicContact NH2-OD2 3.19Å; W13-D516 HydrophobicContact CH2-CB 4.17Å; W13-D516 HydrophobicContact CZ2-CB 3.73Å; S512-D516 PolarHBondContact O-N 3.32Å; D516-L520 WeakPolarHBondContact O-CB 3.05Å; D516-L520 PolarHBondContact O-N 3.43Å
517	A	89.5	Confident	85	Confident	2 Å²	2	38.8 Å²	38.8	2%	0.017	22%	0.22	C	C	.	.	H	α-helix	trans	-64.8	-45.1	176.5	0	0	0	0	0	112.2	N498 A502 S513 L520 L521 L598	N498-A517 HydrophobicContact CB-CB 4.09Å; A502-A517 HydrophobicContact CB-CB 4.09Å; S513-A517 VanDerWaalsContact O-CB 3.27Å; S513-A517 WeakPolarHBondContact O-CB 3.39Å; S513-A517 PolarHBondContact O-N 2.87Å; A517-L520 PolarHBondContact O-N 3.24Å; A517-L521 WeakPolarHBondContact O-CB 2.94Å; A517-L521 WeakPolarHBondContact O-CG 3.49Å; A517-L521 PolarHBondContact O-N 3.45Å; A517-L598 HydrophobicContact CB-CD2 4.24Å
518	F	87.8	Confident	84.3	Confident	91 Å²	91	38.9 Å²	38.9	40%	0.399	22%	0.217	S	C	.	.	H	α-helix	trans	-65.2	-43.1	-177.6	-176.6	-109.3	0	0	0	112.4	L495 V514 C515 L520 L521 L522	L495-F518 HydrophobicContact CD2-CD2 3.93Å; V514-F518 WeakPolarHBondContact O-CB 3.48Å; V514-F518 PolarHBondContact O-N 2.95Å; C515-F518 PolarHBondContact O-N 3.46Å; F518-L520 VanDerWaalsContact C-N 3.34Å; F518-L520 PolarHBondContact O-N 2.95Å; F518-L521 PolarHBondContact O-N 3.43Å; F518-L522 HydrophobicContact CD1-CD1 3.76Å; F518-L522 HydrophobicContact CD1-CG 4.26Å; F518-L522 HydrophobicContact CD2-CG 4.43Å; F518-L522 HydrophobicContact CE1-CD1 3.19Å; F518-L522 HydrophobicContact CE1-CG 3.91Å; F518-L522 HydrophobicContact CE2-CD1 4.22Å; F518-L522 HydrophobicContact CE2-CD2 4.26Å; F518-L522 HydrophobicContact CE2-CG 4.08Å; F518-L522 HydrophobicContact CG-CD1 4.49Å; F518-L522 HydrophobicContact CZ-CD1 3.46Å; F518-L522 VanDerWaalsContact CZ-CD1 3.46Å; F518-L522 HydrophobicContact CZ-CD2 4.05Å; F518-L522 HydrophobicContact CZ-CG 3.81Å; F518-L522 WeakPolarHBondContact O-CB 3.48Å; F518-L522 WeakPolarHBondContact O-CG 3Å; F518-L522 PolarHBondContact O-N 3.18Å
519	K	86.5	Confident	83.4	Confident	72 Å²	72	39.9 Å²	39.9	31%	0.313	23%	0.229	S	C	.	.	H	α-helix	trans	-57.3	-48.3	173.9	-75.8	177.6	175.5	-174.4	0	111	D10 C515 L521 L522 E523	D10-K519 IonicContact OD1-NZ 3.34Å; D10-K519 PolarHBondContact OD1-NZ 2.73Å; C515-K519 WeakPolarHBondContact O-CB 3.35Å; C515-K519 WeakPolarHBondContact O-CG 3.43Å; C515-K519 PolarHBondContact O-N 2.87Å; K519-L521 VanDerWaalsContact C-N 3.35Å; K519-L521 PolarHBondContact O-N 2.97Å; K519-L522 PolarHBondContact O-N 3.06Å; K519-E523 WeakPolarHBondContact O-CG 3.38Å; K519-E523 PolarHBondContact O-N 2.91Å
520	L	84.2	Confident	82.4	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-40.5	-179.7	-175	64	0	0	0	112.7	W13 D516 A517 F518 L598 A601 V602 K605	W13-L520 HydrophobicContact CZ2-CD2 4.07Å; D516-L520 WeakPolarHBondContact O-CB 3.05Å; D516-L520 PolarHBondContact O-N 3.43Å; A517-L520 PolarHBondContact O-N 3.24Å; F518-L520 VanDerWaalsContact C-N 3.34Å; F518-L520 PolarHBondContact O-N 2.95Å; L520-L598 HydrophobicContact CD2-CD1 3.92Å; L520-A601 HydrophobicContact CD1-CB 4.33Å; L520-A601 HydrophobicContact CD2-CB 3.66Å; L520-A601 HydrophobicContact CG-CB 3.92Å; L520-V602 HydrophobicContact CD2-CG2 3.6Å; L520-K605 HydrophobicContact CD1-CB 4.33Å; L520-K605 HydrophobicContact CD1-CD 3.72Å
521	L	82.8	Confident	81.6	Confident	13 Å²	13	39.4 Å²	39.4	7%	0.068	23%	0.228	C	C	.	.	H	α-helix	trans	-71.1	-37.7	177.6	-66.3	170	0	0	0	111.9	F494 N498 A517 F518 K519 N524 A525 V528 F597 L598	F494-L521 HydrophobicContact CE1-CD1 4.07Å; F494-L521 HydrophobicContact CZ-CD1 4.08Å; N498-L521 HydrophobicContact CB-CD1 4.18Å; A517-L521 WeakPolarHBondContact O-CB 2.94Å; A517-L521 WeakPolarHBondContact O-CG 3.49Å; A517-L521 PolarHBondContact O-N 3.45Å; F518-L521 PolarHBondContact O-N 3.43Å; K519-L521 VanDerWaalsContact C-N 3.35Å; K519-L521 PolarHBondContact O-N 2.97Å; L521-N524 CarbonylContact O-C 3.51Å; L521-N524 PolarHBondContact O-N 3.26Å; L521-A525 WeakPolarHBondContact O-CA 3.39Å; L521-A525 PolarHBondContact O-N 2.82Å; L521-V528 HydrophobicContact CD2-CG1 3.82Å; L521-V528 HydrophobicContact CD2-CG2 3.97Å; L521-F597 HydrophobicContact CD2-CD1 4.43Å; L521-F597 HydrophobicContact CD2-CE1 3.81Å; L521-L598 HydrophobicContact CD2-CD1 4.25Å; L521-L598 HydrophobicContact CG-CD1 4.41Å
522	L	81.8	Confident	80.9	Confident	98 Å²	98	40.2 Å²	40.2	51%	0.513	23%	0.231	S	C	.	.	H	α-helix	trans	-66.4	-39.5	177.3	-80.4	-175.3	0	0	0	112.9	F518 K519 N524 A525	F518-L522 HydrophobicContact CD1-CD1 3.76Å; F518-L522 HydrophobicContact CD1-CG 4.26Å; F518-L522 HydrophobicContact CD2-CG 4.43Å; F518-L522 HydrophobicContact CE1-CD1 3.19Å; F518-L522 HydrophobicContact CE1-CG 3.91Å; F518-L522 HydrophobicContact CE2-CD1 4.22Å; F518-L522 HydrophobicContact CE2-CD2 4.26Å; F518-L522 HydrophobicContact CE2-CG 4.08Å; F518-L522 HydrophobicContact CG-CD1 4.49Å; F518-L522 HydrophobicContact CZ-CD1 3.46Å; F518-L522 VanDerWaalsContact CZ-CD1 3.46Å; F518-L522 HydrophobicContact CZ-CD2 4.05Å; F518-L522 HydrophobicContact CZ-CG 3.81Å; F518-L522 WeakPolarHBondContact O-CB 3.48Å; F518-L522 WeakPolarHBondContact O-CG 3Å; F518-L522 PolarHBondContact O-N 3.18Å; K519-L522 PolarHBondContact O-N 3.06Å; L522-N524 PolarHBondContact O-N 3.29Å; L522-N524 VanDerWaalsContact O-N 3.1Å; L522-A525 PolarHBondContact O-N 3.15Å
523	E	82.3	Confident	80.4	Confident	109 Å²	109	43.4 Å²	43.4	51%	0.509	25%	0.25	S	C	.	.	H	α-helix	trans	-56	-27.1	176.2	-75.3	170.1	-166.6	0	0	112.3	K519 K605	K519-E523 WeakPolarHBondContact O-CG 3.38Å; K519-E523 PolarHBondContact O-N 2.91Å; E523-K605 IonicContact OE1-NZ 3.73Å; E523-K605 PolarHBondContact OE1-NZ 3.3Å; E523-K605 IonicContact OE2-NZ 3.69Å; E523-K605 PolarHBondContact OE2-NZ 3.49Å
524	N	74.6	Confident	79.8	Confident	62 Å²	62	43.5 Å²	43.5	33%	0.332	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.3	29	-178.8	-61.8	-82.8	0	0	0	113.1	L521 L522 A526 Q527 V528	L521-N524 CarbonylContact O-C 3.51Å; L521-N524 PolarHBondContact O-N 3.26Å; L522-N524 PolarHBondContact O-N 3.29Å; L522-N524 VanDerWaalsContact O-N 3.1Å; N524-A526 VanDerWaalsContact C-N 3.34Å; N524-A526 PolarHBondContact O-N 2.99Å; N524-A526 VanDerWaalsContact O-N 3.15Å; N524-Q527 PolarHBondContact O-N 2.65Å; N524-V528 HydrophobicContact CB-CG2 4.27Å; N524-V528 WeakPolarHBondContact O-CG2 3.42Å; N524-V528 PolarHBondContact O-N 2.82Å
525	A	73.3	Confident	79.3	Confident	45 Å²	45	42.6 Å²	42.6	37%	0.372	25%	0.246	S	C	.	.	H	α-helix	trans	-53.5	-42.6	-166.1	0	0	0	0	0	114.8	L521 L522 Q527 V528 A529	L521-A525 WeakPolarHBondContact O-CA 3.39Å; L521-A525 PolarHBondContact O-N 2.82Å; L522-A525 PolarHBondContact O-N 3.15Å; A525-Q527 PolarHBondContact O-N 3Å; A525-V528 PolarHBondContact O-N 3.09Å; A525-A529 WeakPolarHBondContact O-CB 3.4Å; A525-A529 PolarHBondContact O-N 3.32Å
526	A	70.3	Confident	79	Confident	81 Å²	81	44.9 Å²	44.9	67%	0.669	26%	0.258	S	S	*	.	H	α-helix	trans	-64.8	-40.6	-179.6	0	0	0	0	0	112.2	N524 V530	N524-A526 VanDerWaalsContact C-N 3.34Å; N524-A526 PolarHBondContact O-N 2.99Å; N524-A526 VanDerWaalsContact O-N 3.15Å; A526-V530 VanDerWaalsContact O-CG2 3.22Å; A526-V530 WeakPolarHBondContact O-CG2 3.37Å; A526-V530 PolarHBondContact O-N 2.82Å
527	Q	70.1	Confident	78.8	Confident	46 Å²	46	46 Å²	46	22%	0.215	26%	0.262	C	S	.	.	H	α-helix	trans	-69.7	-42.1	177.9	-178.9	169.2	7.1	0	0	110.9	N524 A525 I531 S628	N524-Q527 PolarHBondContact O-N 2.65Å; A525-Q527 PolarHBondContact O-N 3Å; Q527-I531 HydrophobicContact CG-CD1 3.65Å; Q527-I531 WeakPolarHBondContact O-CD1 3.13Å; Q527-I531 VanDerWaalsContact O-CG1 3.23Å; Q527-I531 WeakPolarHBondContact O-CG1 3.02Å; Q527-I531 PolarHBondContact O-N 3.02Å; Q527-S628 PolarHBondContact NE2-OG 3.1Å
528	V	72.2	Confident	78.5	Confident	15 Å²	15	46.4 Å²	46.4	9%	0.091	27%	0.265	C	S	.	.	H	α-helix	trans	-57.7	-55	176.2	174.7	0	0	0	0	110.7	L521 N524 A525 V530 I531 N532 F597	L521-V528 HydrophobicContact CD2-CG1 3.82Å; L521-V528 HydrophobicContact CD2-CG2 3.97Å; N524-V528 HydrophobicContact CB-CG2 4.27Å; N524-V528 WeakPolarHBondContact O-CG2 3.42Å; N524-V528 PolarHBondContact O-N 2.82Å; A525-V528 PolarHBondContact O-N 3.09Å; V528-V530 VanDerWaalsContact C-N 3.3Å; V528-V530 PolarHBondContact O-N 3.49Å; V528-I531 PolarHBondContact O-N 2.66Å; V528-N532 PolarHBondContact O-N 2.93Å; V528-F597 HydrophobicContact CB-CE1 4.11Å; V528-F597 HydrophobicContact CB-CZ 3.96Å; V528-F597 HydrophobicContact CG1-CE1 3.78Å; V528-F597 HydrophobicContact CG1-CZ 4.12Å; V528-F597 HydrophobicContact CG2-CE1 3.71Å; V528-F597 HydrophobicContact CG2-CZ 3.52Å
529	A	71.6	Confident	78.4	Confident	55 Å²	55	42.2 Å²	42.2	46%	0.455	25%	0.246	S	C	.	.	H	α-helix	trans	-59.9	-41.6	-175.9	0	0	0	0	0	111.7	A525 T533	A525-A529 WeakPolarHBondContact O-CB 3.4Å; A525-A529 PolarHBondContact O-N 3.32Å; A529-T533 WeakPolarHBondContact O-CB 3.45Å; A529-T533 PolarHBondContact O-N 3.48Å; A529-T533 VanDerWaalsContact O-N 3.08Å; A529-T533 PolarHBondContact O-OG1 2.78Å
530	V	70.9	Confident	78.4	Confident	47 Å²	47	43.3 Å²	43.3	29%	0.285	25%	0.251	S	S	.	.	H	α-helix	trans	-67.4	-45	178.9	176.3	0	0	0	0	111.3	H311 A526 V528 N532 T533 V534	H311-V530 HydrophobicContact CB-CG1 3.92Å; H311-V530 WeakPolarHBondContact CD2-CG1 3.37Å; A526-V530 VanDerWaalsContact O-CG2 3.22Å; A526-V530 WeakPolarHBondContact O-CG2 3.37Å; A526-V530 PolarHBondContact O-N 2.82Å; V528-V530 VanDerWaalsContact C-N 3.3Å; V528-V530 PolarHBondContact O-N 3.49Å; V530-N532 PolarHBondContact O-N 3.45Å; V530-T533 PolarHBondContact O-N 3.08Å; V530-V534 HydrophobicContact CG1-CG2 4.21Å; V530-V534 WeakPolarHBondContact O-CG2 3.45Å; V530-V534 PolarHBondContact O-N 2.82Å
531	I	74.3	Confident	78.3	Confident	10 Å²	10	43.8 Å²	43.8	5%	0.051	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-45.7	-179.1	-68.6	163.6	0	0	0	111.4	L314 L318 Q527 V528 T533 V534 G535 F597	L314-I531 HydrophobicContact CD2-CD1 3.4Å; L314-I531 HydrophobicContact CD2-CG1 3.77Å; L314-I531 HydrophobicContact CG-CD1 4.42Å; L318-I531 HydrophobicContact CD2-CG2 3.97Å; Q527-I531 HydrophobicContact CG-CD1 3.65Å; Q527-I531 WeakPolarHBondContact O-CD1 3.13Å; Q527-I531 VanDerWaalsContact O-CG1 3.23Å; Q527-I531 WeakPolarHBondContact O-CG1 3.02Å; Q527-I531 PolarHBondContact O-N 3.02Å; V528-I531 PolarHBondContact O-N 2.66Å; I531-T533 VanDerWaalsContact C-N 3.34Å; I531-T533 PolarHBondContact O-N 3.2Å; I531-V534 PolarHBondContact O-N 2.74Å; I531-G535 PolarHBondContact O-N 2.04Å; I531-F597 HydrophobicContact CD1-CD2 4.47Å; I531-F597 HydrophobicContact CD1-CE2 3.72Å; I531-F597 HydrophobicContact CG2-CD2 4.23Å; I531-F597 HydrophobicContact CG2-CE2 4.36Å
532	N	77.4	Confident	78.6	Confident	46 Å²	46	43.1 Å²	43.1	25%	0.246	25%	0.25	C	S	.	.	H	α-helix	trans	-59.2	-47.7	177.3	-156.8	85.4	0	0	0	110.6	V528 V530 V534 G535 D536 D594	V528-N532 PolarHBondContact O-N 2.93Å; V530-N532 PolarHBondContact O-N 3.45Å; N532-V534 PolarHBondContact O-N 3.01Å; N532-G535 PolarHBondContact O-N 3.03Å; N532-D536 PolarHBondContact ND2-OD2 2.9Å; N532-D536 WeakPolarHBondContact O-CB 3.41Å; N532-D536 PolarHBondContact O-N 3.24Å; N532-D594 PolarHBondContact OD1-OD1 3.01Å
533	T	77.3	Confident	79	Confident	73 Å²	73	39.3 Å²	39.3	45%	0.448	23%	0.229	S	C	.	.	H	α-helix	trans	-61	-42	-180	-55.1	0	0	0	0	112.4	L308 A529 V530 I531 F537	L308-T533 HydrophobicContact CD2-CG2 4.36Å; A529-T533 WeakPolarHBondContact O-CB 3.45Å; A529-T533 PolarHBondContact O-N 3.48Å; A529-T533 VanDerWaalsContact O-N 3.08Å; A529-T533 PolarHBondContact O-OG1 2.78Å; V530-T533 PolarHBondContact O-N 3.08Å; I531-T533 VanDerWaalsContact C-N 3.34Å; I531-T533 PolarHBondContact O-N 3.2Å; T533-F537 VanDerWaalsContact O-CB 3.29Å; T533-F537 WeakPolarHBondContact O-CB 3.32Å; T533-F537 PolarHBondContact O-N 2.7Å; T533-F537 VanDerWaalsContact O-N 3.07Å
534	V	80.1	Confident	79.3	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-66.3	-44	176.9	-177.2	0	0	0	0	110.6	L308 H311 T315 V530 I531 N532 F537 V538	L308-V534 HydrophobicContact CB-CG2 4.03Å; L308-V534 HydrophobicContact CD2-CB 4.26Å; L308-V534 HydrophobicContact CD2-CG2 3.29Å; L308-V534 HydrophobicContact CG-CG2 4.12Å; H311-V534 HydrophobicContact CB-CG2 3.86Å; T315-V534 HydrophobicContact CG2-CG1 4.02Å; T315-V534 WeakPolarHBondContact OG1-CB 3.35Å; T315-V534 VanDerWaalsContact OG1-CG1 3.26Å; T315-V534 WeakPolarHBondContact OG1-CG1 3.32Å; V530-V534 HydrophobicContact CG1-CG2 4.21Å; V530-V534 WeakPolarHBondContact O-CG2 3.45Å; V530-V534 PolarHBondContact O-N 2.82Å; I531-V534 PolarHBondContact O-N 2.74Å; N532-V534 PolarHBondContact O-N 3.01Å; V534-F537 PolarHBondContact O-N 3.02Å; V534-V538 WeakPolarHBondContact O-CG2 3.09Å; V534-V538 PolarHBondContact O-N 3.47Å
535	G	80.9	Confident	79.9	Confident	4 Å²	4	36.3 Å²	36.3	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-60.2	-51.9	179.4	0	0	0	0	0	111.8	I531 N532 F537 V538 L539	I531-G535 PolarHBondContact O-N 2.04Å; N532-G535 PolarHBondContact O-N 3.03Å; G535-F537 VanDerWaalsContact C-N 3.27Å; G535-F537 PolarHBondContact O-N 2.91Å; G535-V538 PolarHBondContact O-N 3.31Å; G535-V538 VanDerWaalsContact O-N 3.16Å; G535-L539 WeakPolarHBondContact O-CG 3.1Å; G535-L539 PolarHBondContact O-N 2.87Å
536	D	83.3	Confident	80.8	Confident	52 Å²	52	34.5 Å²	34.5	28%	0.278	20%	0.202	S	C	.	.	H	α-helix	trans	-57.6	-42	177.5	-64.9	-15.3	0	0	0	111.4	N532 L539 F540	N532-D536 PolarHBondContact ND2-OD2 2.9Å; N532-D536 WeakPolarHBondContact O-CB 3.41Å; N532-D536 PolarHBondContact O-N 3.24Å; D536-L539 PolarHBondContact O-N 2.9Å; D536-F540 VanDerWaalsContact O-CB 3.23Å; D536-F540 WeakPolarHBondContact O-CB 3.44Å; D536-F540 PolarHBondContact O-N 2.92Å
537	F	82.9	Confident	81.9	Confident	37 Å²	37	32 Å²	32	16%	0.162	18%	0.179	C	C	.	.	H	α-helix	trans	-61.8	-46.1	177.4	178.9	-100.9	0	0	0	112	M305 L308 T533 V534 G535 F540 M541	M305-F537 HydrophobicContact CG-CE1 4.24Å; M305-F537 HydrophobicContact CG-CZ 4.13Å; L308-F537 HydrophobicContact CD1-CB 4.39Å; L308-F537 HydrophobicContact CD1-CD1 4.19Å; L308-F537 HydrophobicContact CD1-CG 4.22Å; T533-F537 VanDerWaalsContact O-CB 3.29Å; T533-F537 WeakPolarHBondContact O-CB 3.32Å; T533-F537 PolarHBondContact O-N 2.7Å; T533-F537 VanDerWaalsContact O-N 3.07Å; V534-F537 PolarHBondContact O-N 3.02Å; G535-F537 VanDerWaalsContact C-N 3.27Å; G535-F537 PolarHBondContact O-N 2.91Å; F537-F540 PolarHBondContact O-N 3.46Å; F537-M541 HydrophobicContact CD1-CG 4.34Å; F537-M541 HydrophobicContact CE1-CG 3.91Å; F537-M541 HydrophobicContact CE2-CE 4.09Å; F537-M541 HydrophobicContact CE2-CG 4.25Å; F537-M541 HydrophobicContact CE2-SD 4.38Å; F537-M541 HydrophobicContact CZ-CE 4.4Å; F537-M541 HydrophobicContact CZ-CG 3.87Å; F537-M541 HydrophobicContact CZ-SD 4.1Å; F537-M541 WeakPolarHBondContact O-CG 3.15Å; F537-M541 PolarHBondContact O-N 3.33Å
538	V	83.1	Confident	82.8	Confident	12 Å²	12	32.7 Å²	32.7	7%	0.073	19%	0.189	C	C	.	.	H	α-helix	trans	-64.8	-42.7	178.4	176	0	0	0	0	111.2	V238 L241 F319 V534 G535 F540 M541 G542	V238-V538 HydrophobicContact CG1-CG2 4.42Å; V238-V538 HydrophobicContact CG2-CG1 3.98Å; V238-V538 HydrophobicContact CG2-CG2 4.23Å; L241-V538 HydrophobicContact CD1-CG1 4.13Å; F319-V538 HydrophobicContact CD2-CG1 4.44Å; F319-V538 HydrophobicContact CE2-CB 3.73Å; F319-V538 HydrophobicContact CE2-CG1 3.6Å; F319-V538 HydrophobicContact CE2-CG2 4.25Å; F319-V538 HydrophobicContact CZ-CB 4.2Å; F319-V538 HydrophobicContact CZ-CG1 4.4Å; V534-V538 WeakPolarHBondContact O-CG2 3.09Å; V534-V538 PolarHBondContact O-N 3.47Å; G535-V538 PolarHBondContact O-N 3.31Å; G535-V538 VanDerWaalsContact O-N 3.16Å; V538-F540 VanDerWaalsContact C-N 3.33Å; V538-F540 PolarHBondContact O-N 2.93Å; V538-M541 PolarHBondContact O-N 3.5Å; V538-G542 PolarHBondContact O-N 3.21Å
539	L	86.3	Confident	83.6	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-65.8	-38.2	177.6	-65.1	171.7	0	0	0	111.2	I230 F319 G535 D536 G542 K543 L586 F589 E590	I230-L539 HydrophobicContact CD1-CD2 4.31Å; F319-L539 HydrophobicContact CZ-CD2 4.35Å; F319-L539 HydrophobicContact CZ-CG 4.11Å; G535-L539 WeakPolarHBondContact O-CG 3.1Å; G535-L539 PolarHBondContact O-N 2.87Å; D536-L539 PolarHBondContact O-N 2.9Å; L539-G542 PolarHBondContact O-N 2.87Å; L539-K543 WeakPolarHBondContact O-CG 3.46Å; L539-K543 PolarHBondContact O-N 3.27Å; L539-K543 VanDerWaalsContact O-N 3.07Å; L539-L586 HydrophobicContact CD2-CB 4.44Å; L539-L586 HydrophobicContact CD2-CD2 4.15Å; L539-F589 HydrophobicContact CD1-CD1 4.48Å; L539-F589 HydrophobicContact CD2-CB 4.28Å; L539-F589 HydrophobicContact CD2-CD1 3.78Å; L539-F589 HydrophobicContact CD2-CG 4.31Å; L539-E590 HydrophobicContact CD1-CB 3.73Å; L539-E590 HydrophobicContact CD1-CG 4.05Å
540	F	86.6	Confident	84.6	Confident	96 Å²	96	32 Å²	32	42%	0.421	18%	0.181	S	C	.	.	H	α-helix	trans	-61.6	-44.6	172.7	175.4	-111.2	0	0	0	112	D536 F537 V538 G542 K543 V544	D536-F540 VanDerWaalsContact O-CB 3.23Å; D536-F540 WeakPolarHBondContact O-CB 3.44Å; D536-F540 PolarHBondContact O-N 2.92Å; F537-F540 PolarHBondContact O-N 3.46Å; V538-F540 VanDerWaalsContact C-N 3.33Å; V538-F540 PolarHBondContact O-N 2.93Å; F540-G542 VanDerWaalsContact C-N 3.27Å; F540-G542 PolarHBondContact O-N 3.4Å; F540-K543 WeakPolarHBondContact O-CB 2.99Å; F540-K543 PolarHBondContact O-N 3.49Å; F540-K543 VanDerWaalsContact O-N 3.1Å; F540-V544 HydrophobicContact CE1-CG2 4.09Å; F540-V544 HydrophobicContact CE2-CG2 4.15Å; F540-V544 HydrophobicContact CZ-CG2 3.86Å; F540-V544 WeakPolarHBondContact O-CG2 3.48Å; F540-V544 PolarHBondContact O-N 3.14Å
541	M	83.1	Confident	85.5	Confident	13 Å²	13	30.9 Å²	30.9	6%	0.064	18%	0.176	C	C	.	.	H	α-helix	trans	-60.9	-37.1	174	-69.9	-62.8	102.9	0	0	112.2	V245 F537 V538 K543 V544 L545	V245-M541 HydrophobicContact CB-SD 4.13Å; V245-M541 HydrophobicContact CG1-SD 3.79Å; V245-M541 HydrophobicContact CG2-CG 4.2Å; V245-M541 HydrophobicContact CG2-SD 3.24Å; V245-M541 WeakPolarHBondContact CG2-SD 3.24Å; F537-M541 HydrophobicContact CD1-CG 4.34Å; F537-M541 HydrophobicContact CE1-CG 3.91Å; F537-M541 HydrophobicContact CE2-CE 4.09Å; F537-M541 HydrophobicContact CE2-CG 4.25Å; F537-M541 HydrophobicContact CE2-SD 4.38Å; F537-M541 HydrophobicContact CZ-CE 4.4Å; F537-M541 HydrophobicContact CZ-CG 3.87Å; F537-M541 HydrophobicContact CZ-SD 4.1Å; F537-M541 WeakPolarHBondContact O-CG 3.15Å; F537-M541 PolarHBondContact O-N 3.33Å; V538-M541 PolarHBondContact O-N 3.5Å; M541-K543 PolarHBondContact O-N 2.86Å; M541-V544 HydrophobicContact CE-CG2 4.35Å; M541-V544 PolarHBondContact O-N 3.46Å; M541-L545 PolarHBondContact O-N 2.94Å
542	G	87.3	Confident	86.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-57.2	-44.9	171	0	0	0	0	0	113.3	V538 L539 F540 L545 I546	V538-G542 PolarHBondContact O-N 3.21Å; L539-G542 PolarHBondContact O-N 2.87Å; F540-G542 VanDerWaalsContact C-N 3.27Å; F540-G542 PolarHBondContact O-N 3.4Å; G542-L545 PolarHBondContact O-N 2.86Å; G542-I546 WeakPolarHBondContact O-CG1 3.34Å; G542-I546 PolarHBondContact O-N 3.07Å; G542-I546 VanDerWaalsContact O-N 3.15Å
543	K	90.4	Very high	86.8	Confident	17 Å²	17	36.3 Å²	36.3	7%	0.074	20%	0.203	C	C	.	.	H	α-helix	trans	-61.4	-45.6	175.9	-61.4	169.7	-165.4	-178.7	0	110.9	L539 F540 M541 L545 I546 V547 A582 N583 L586	L539-K543 WeakPolarHBondContact O-CG 3.46Å; L539-K543 PolarHBondContact O-N 3.27Å; L539-K543 VanDerWaalsContact O-N 3.07Å; F540-K543 WeakPolarHBondContact O-CB 2.99Å; F540-K543 PolarHBondContact O-N 3.49Å; F540-K543 VanDerWaalsContact O-N 3.1Å; M541-K543 PolarHBondContact O-N 2.86Å; K543-L545 PolarHBondContact O-N 3.35Å; K543-I546 PolarHBondContact O-N 2.78Å; K543-V547 WeakPolarHBondContact O-CG2 3.47Å; K543-V547 PolarHBondContact O-N 3.45Å; K543-V547 VanDerWaalsContact O-N 3.11Å; K543-A582 HydrophobicContact CB-CB 4.33Å; K543-A582 HydrophobicContact CG-CB 4.26Å; K543-N583 HydrophobicContact CD-CB 4.44Å; K543-N583 PolarHBondContact NZ-OD1 3.1Å; K543-L586 HydrophobicContact CB-CD1 4.43Å; K543-L586 HydrophobicContact CG-CB 4.38Å; K543-L586 HydrophobicContact CG-CD1 3.58Å
544	V	88.6	Confident	87.4	Confident	57 Å²	57	32.8 Å²	32.8	35%	0.345	18%	0.182	S	C	.	.	H	α-helix	trans	-62.4	-41.8	178.6	174.1	0	0	0	0	111.6	F540 M541 V547 S548	F540-V544 HydrophobicContact CE1-CG2 4.09Å; F540-V544 HydrophobicContact CE2-CG2 4.15Å; F540-V544 HydrophobicContact CZ-CG2 3.86Å; F540-V544 WeakPolarHBondContact O-CG2 3.48Å; F540-V544 PolarHBondContact O-N 3.14Å; M541-V544 HydrophobicContact CE-CG2 4.35Å; M541-V544 PolarHBondContact O-N 3.46Å; V544-V547 PolarHBondContact O-N 3.14Å; V544-S548 VanDerWaalsContact O-CB 3.3Å; V544-S548 WeakPolarHBondContact O-CB 3.4Å; V544-S548 PolarHBondContact O-N 3.49Å; V544-S548 PolarHBondContact O-OG 3.49Å
545	L	88.1	Confident	87.7	Confident	51 Å²	51	35.1 Å²	35.1	27%	0.267	20%	0.196	S	C	.	.	H	α-helix	trans	-61.8	-47.1	178.1	-177.1	67.1	0	0	0	111.5	L241 L244 M541 G542 K543 V547 S548 C549	L241-L545 HydrophobicContact CD2-CB 4.12Å; L241-L545 HydrophobicContact CD2-CD2 3.64Å; L241-L545 HydrophobicContact CD2-CG 4.4Å; L244-L545 HydrophobicContact CD1-CD1 4.12Å; M541-L545 PolarHBondContact O-N 2.94Å; G542-L545 PolarHBondContact O-N 2.86Å; K543-L545 PolarHBondContact O-N 3.35Å; L545-V547 VanDerWaalsContact C-N 3.34Å; L545-V547 PolarHBondContact O-N 3.12Å; L545-S548 PolarHBondContact O-N 2.82Å; L545-C549 WeakPolarHBondContact O-CB 3.48Å; L545-C549 PolarHBondContact O-N 3.44Å; L545-C549 PolarHBondContact O-SG 3.33Å; L545-C549 VanDerWaalsContact O-SG 3.39Å
546	I	92.4	Very high	87.9	Confident	7 Å²	7	39.8 Å²	39.8	4%	0.036	22%	0.219	C	C	.	.	H	α-helix	trans	-59.5	-46.7	178.6	-66.4	160.5	0	0	0	110.7	L222 M226 G542 K543 S548 T550 A582 L586	L222-I546 HydrophobicContact CB-CG2 4.18Å; M226-I546 HydrophobicContact CB-CD1 3.88Å; M226-I546 HydrophobicContact CB-CG1 4.29Å; M226-I546 HydrophobicContact CG-CD1 4.01Å; M226-I546 HydrophobicContact CG-CG1 4.5Å; G542-I546 WeakPolarHBondContact O-CG1 3.34Å; G542-I546 PolarHBondContact O-N 3.07Å; G542-I546 VanDerWaalsContact O-N 3.15Å; K543-I546 PolarHBondContact O-N 2.78Å; I546-S548 VanDerWaalsContact C-N 3.35Å; I546-S548 PolarHBondContact O-N 3.27Å; I546-T550 WeakPolarHBondContact O-CB 3.43Å; I546-T550 PolarHBondContact O-N 3.12Å; I546-T550 PolarHBondContact O-OG1 3.22Å; I546-A582 HydrophobicContact CB-CB 4.16Å; I546-A582 HydrophobicContact CD1-CB 3.61Å; I546-A582 HydrophobicContact CG2-CB 4.11Å; I546-L586 HydrophobicContact CD1-CD1 4.2Å
547	V	92.2	Very high	88	Confident	30 Å²	30	39.1 Å²	39.1	18%	0.182	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-42.7	178	175.5	0	0	0	0	110.8	K543 V544 L545 T550 A551 C575 A578 Y579	K543-V547 WeakPolarHBondContact O-CG2 3.47Å; K543-V547 PolarHBondContact O-N 3.45Å; K543-V547 VanDerWaalsContact O-N 3.11Å; V544-V547 PolarHBondContact O-N 3.14Å; L545-V547 VanDerWaalsContact C-N 3.34Å; L545-V547 PolarHBondContact O-N 3.12Å; V547-T550 PolarHBondContact O-N 3.07Å; V547-A551 VanDerWaalsContact O-CB 3.25Å; V547-A551 WeakPolarHBondContact O-CB 3.24Å; V547-A551 PolarHBondContact O-N 2.99Å; V547-C575 HydrophobicContact CG1-CB 4.09Å; V547-A578 HydrophobicContact CG2-CB 4.29Å; V547-Y579 HydrophobicContact CG2-CD2 4.35Å
548	S	89.1	Confident	87.9	Confident	60 Å²	60	37.5 Å²	37.5	42%	0.42	21%	0.214	S	C	.	.	H	α-helix	trans	-66.7	-43.5	-179	-56.3	0	0	0	0	112.2	V544 L545 I546 T550 A551 F552	V544-S548 VanDerWaalsContact O-CB 3.3Å; V544-S548 WeakPolarHBondContact O-CB 3.4Å; V544-S548 PolarHBondContact O-N 3.49Å; V544-S548 PolarHBondContact O-OG 3.49Å; L545-S548 PolarHBondContact O-N 2.82Å; I546-S548 VanDerWaalsContact C-N 3.35Å; I546-S548 PolarHBondContact O-N 3.27Å; S548-T550 VanDerWaalsContact C-N 3.34Å; S548-A551 PolarHBondContact O-N 3.13Å; S548-F552 WeakPolarHBondContact O-CB 3.18Å; S548-F552 PolarHBondContact O-N 3.11Å
549	C	90.7	Very high	87.6	Confident	54 Å²	54	41.8 Å²	41.8	37%	0.365	24%	0.237	S	C	.	.	H	α-helix	trans	-62	-42.3	174	-72.4	0	0	0	0	111.7	L222 L545 F552 A553	L222-C549 HydrophobicContact CD1-CB 3.8Å; L545-C549 WeakPolarHBondContact O-CB 3.48Å; L545-C549 PolarHBondContact O-N 3.44Å; L545-C549 PolarHBondContact O-SG 3.33Å; L545-C549 VanDerWaalsContact O-SG 3.39Å; C549-F552 PolarHBondContact O-N 3.41Å; C549-A553 WeakPolarHBondContact O-CB 3.25Å; C549-A553 PolarHBondContact O-N 3.41Å
550	T	92.4	Very high	86.9	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-66.2	-41.7	176.7	-51.4	0	0	0	0	111.2	L215 A219 I546 V547 S548 A553 G554 A578	L215-T550 HydrophobicContact CB-CG2 4.22Å; L215-T550 HydrophobicContact CD2-CG2 4.4Å; A219-T550 HydrophobicContact CB-CG2 4.19Å; I546-T550 WeakPolarHBondContact O-CB 3.43Å; I546-T550 PolarHBondContact O-N 3.12Å; I546-T550 PolarHBondContact O-OG1 3.22Å; V547-T550 PolarHBondContact O-N 3.07Å; S548-T550 VanDerWaalsContact C-N 3.34Å; T550-A553 PolarHBondContact O-N 3.46Å; T550-G554 PolarHBondContact O-N 3.03Å; T550-A578 HydrophobicContact CG2-CB 4.05Å
551	A	89.5	Confident	86	Confident	24 Å²	24	51 Å²	51	20%	0.198	27%	0.274	C	S	.	.	H	α-helix	trans	-62.9	-44.7	176.7	0	0	0	0	0	111.1	V547 S548 G554 V555 C575	V547-A551 VanDerWaalsContact O-CB 3.25Å; V547-A551 WeakPolarHBondContact O-CB 3.24Å; V547-A551 PolarHBondContact O-N 2.99Å; S548-A551 PolarHBondContact O-N 3.13Å; A551-G554 CarbonylContact O-C 3.53Å; A551-G554 PolarHBondContact O-N 3.26Å; A551-V555 WeakPolarHBondContact O-CG2 3.26Å; A551-V555 PolarHBondContact O-N 2.9Å; A551-C575 VanDerWaalsContact CB-SG 3.53Å
552	F	88.9	Confident	84.6	Confident	140 Å²	140	59.1 Å²	59.1	61%	0.614	31%	0.311	S	S	*	.	H	α-helix	trans	-61.4	-48.7	177.6	179.8	-104.7	0	0	0	111.7	S548 C549 G554 V555 L556	S548-F552 WeakPolarHBondContact O-CB 3.18Å; S548-F552 PolarHBondContact O-N 3.11Å; C549-F552 PolarHBondContact O-N 3.41Å; F552-G554 VanDerWaalsContact C-N 3.27Å; F552-G554 PolarHBondContact O-N 3.07Å; F552-V555 PolarHBondContact O-N 3.29Å; F552-L556 HydrophobicContact CD1-CD1 4.03Å; F552-L556 HydrophobicContact CE1-CD1 3.49Å; F552-L556 VanDerWaalsContact CE1-CD1 3.49Å; F552-L556 HydrophobicContact CE1-CG 4.38Å; F552-L556 HydrophobicContact CE2-CD1 4.44Å; F552-L556 HydrophobicContact CZ-CD1 3.73Å; F552-L556 HydrophobicContact CZ-CG 4.32Å; F552-L556 WeakPolarHBondContact O-CG 3.35Å; F552-L556 PolarHBondContact O-N 3.28Å
553	A	90.1	Very high	83.2	Confident	29 Å²	29	66 Å²	66	24%	0.24	35%	0.348	C	S	.	.	H	α-helix	trans	-60	-39	174.1	0	0	0	0	0	111.9	L215 L218 C549 T550 L556 A557	L215-A553 HydrophobicContact CD2-CB 4.13Å; L218-A553 HydrophobicContact CD2-CB 3.55Å; C549-A553 WeakPolarHBondContact O-CB 3.25Å; C549-A553 PolarHBondContact O-N 3.41Å; T550-A553 PolarHBondContact O-N 3.46Å; A553-L556 PolarHBondContact O-N 3.27Å; A553-A557 WeakPolarHBondContact O-CB 3.33Å; A553-A557 PolarHBondContact O-N 2.61Å
554	G	88.4	Confident	81.5	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-66	-41.6	177.1	0	0	0	0	0	113.2	T550 A551 F552 A557 L558	T550-G554 PolarHBondContact O-N 3.03Å; A551-G554 CarbonylContact O-C 3.53Å; A551-G554 PolarHBondContact O-N 3.26Å; F552-G554 VanDerWaalsContact C-N 3.27Å; F552-G554 PolarHBondContact O-N 3.07Å; G554-A557 PolarHBondContact O-N 2.78Å; G554-L558 WeakPolarHBondContact O-CB 3.39Å; G554-L558 WeakPolarHBondContact O-CD1 3.32Å; G554-L558 VanDerWaalsContact O-CG 3.23Å; G554-L558 WeakPolarHBondContact O-CG 3.5Å; G554-L558 PolarHBondContact O-N 3.02Å
555	V	86.6	Confident	79.9	Confident	52 Å²	52	71 Å²	71	32%	0.315	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-46.5	173.3	171.5	0	0	0	0	110	A551 F552 A557 N559 W567 L571	A551-V555 WeakPolarHBondContact O-CG2 3.26Å; A551-V555 PolarHBondContact O-N 2.9Å; F552-V555 PolarHBondContact O-N 3.29Å; V555-A557 PolarHBondContact O-N 2.8Å; V555-N559 WeakPolarHBondContact O-CB 3.3Å; V555-N559 PolarHBondContact O-N 3.46Å; V555-W567 HydrophobicContact CG2-CZ3 4.29Å; V555-L571 HydrophobicContact CG2-CD1 4.44Å; V555-L571 HydrophobicContact CG2-CD2 3.56Å
556	L	86.2	Confident	78.7	Confident	101 Å²	101	71.1 Å²	71.1	53%	0.529	38%	0.379	S	S	.	.	H	α-helix	trans	-62.3	-45.1	178.4	-67.7	177.3	0	0	0	112.2	F552 A553 Y560	F552-L556 HydrophobicContact CD1-CD1 4.03Å; F552-L556 HydrophobicContact CE1-CD1 3.49Å; F552-L556 VanDerWaalsContact CE1-CD1 3.49Å; F552-L556 HydrophobicContact CE1-CG 4.38Å; F552-L556 HydrophobicContact CE2-CD1 4.44Å; F552-L556 HydrophobicContact CZ-CD1 3.73Å; F552-L556 HydrophobicContact CZ-CG 4.32Å; F552-L556 WeakPolarHBondContact O-CG 3.35Å; F552-L556 PolarHBondContact O-N 3.28Å; A553-L556 PolarHBondContact O-N 3.27Å; L556-Y560 WeakPolarHBondContact O-CB 3.38Å; L556-Y560 PolarHBondContact O-N 3.22Å
557	A	85.6	Confident	77.7	Confident	39 Å²	39	75 Å²	75	32%	0.322	39%	0.393	S	S	.	.	H	α-helix	trans	-70	-41.3	-178.4	0	0	0	0	0	113	I211 A553 G554 V555	I211-A557 HydrophobicContact CG2-CB 3.97Å; A553-A557 WeakPolarHBondContact O-CB 3.33Å; A553-A557 PolarHBondContact O-N 2.61Å; G554-A557 PolarHBondContact O-N 2.78Å; V555-A557 PolarHBondContact O-N 2.8Å
558	L	79.7	Confident	76.8	Confident	3 Å²	3	77.2 Å²	77.2	2%	0.016	41%	0.407	C	S	.	.	H	α-helix	trans	-80.9	-32.2	-177.4	-66.6	167.1	0	0	0	112.6	I211 G554 Y560 W567 P570 L571	I211-L558 HydrophobicContact CB-CD2 4.28Å; I211-L558 HydrophobicContact CD1-CD2 3.93Å; I211-L558 HydrophobicContact CG2-CD2 3.82Å; I211-L558 HydrophobicContact CG2-CG 4.1Å; G554-L558 WeakPolarHBondContact O-CB 3.39Å; G554-L558 WeakPolarHBondContact O-CD1 3.32Å; G554-L558 VanDerWaalsContact O-CG 3.23Å; G554-L558 WeakPolarHBondContact O-CG 3.5Å; G554-L558 PolarHBondContact O-N 3.02Å; L558-Y560 VanDerWaalsContact C-N 3.34Å; L558-W567 HydrophobicContact CB-CB 4.06Å; L558-P570 HydrophobicContact CD1-CB 4.33Å; L558-L571 HydrophobicContact CD1-CB 3.86Å; L558-L571 HydrophobicContact CD1-CD1 4.39Å
559	N	76.6	Confident	75.9	Confident	102 Å²	102	76 Å²	76	55%	0.545	40%	0.395	S	S	.	.	H	α-helix	trans	-74.7	-24.9	176.9	-168.7	35	0	0	0	112.5	V555 Q561	V555-N559 WeakPolarHBondContact O-CB 3.3Å; V555-N559 PolarHBondContact O-N 3.46Å; N559-Q561 VanDerWaalsContact C-N 3.28Å; N559-Q561 PolarHBondContact O-N 3.34Å
560	Y	72.8	Confident	75.2	Confident	204 Å²	204	73.6 Å²	73.6	80%	0.8	38%	0.379	S	S	*	.	H	α-helix	trans	-67.9	-27.1	176.3	-173.6	-102.4	0	0	0	112.9	L556 L558	L556-Y560 WeakPolarHBondContact O-CB 3.38Å; L556-Y560 PolarHBondContact O-N 3.22Å; L558-Y560 VanDerWaalsContact C-N 3.34Å
561	Q	66.6	Low	74.9	Confident	87 Å²	87	74.5 Å²	74.5	41%	0.407	38%	0.384	S	S	.	.			trans	-100	95.3	177	-67	-148.8	-34.4	0	0	110.1	N559 D563 Y564	N559-Q561 VanDerWaalsContact C-N 3.28Å; N559-Q561 PolarHBondContact O-N 3.34Å; Q561-D563 PolarHBondContact O-N 2.72Å; Q561-Y564 HydrophobicContact CB-CD2 3.71Å; Q561-Y564 HydrophobicContact CB-CE2 3.36Å; Q561-Y564 HydrophobicContact CG-CE2 4.16Å; Q561-Y564 WeakPolarHBondContact O-CD2 3.32Å; Q561-Y564 PolarHBondContact O-N 2.99Å; Q561-Y564 PolarHBondContact OE1-OH 3.19Å
562	Q	55.1	Low	74.5	Confident	183 Å²	183	78.4 Å²	78.4	86%	0.855	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-8.6	-175.9	-73.4	-166.6	-21.7	0	0	115.2	Y564	Q562-Y564 VanDerWaalsContact C-N 3.3Å; Q562-Y564 PolarHBondContact O-N 3.22Å
563	D	56.8	Low	74.1	Confident	146 Å²	146	74.5 Å²	74.5	78%	0.781	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-14.3	-177.6	-63.5	-39	0	0	0	113.9	Q561 T565	Q561-D563 PolarHBondContact O-N 2.72Å; D563-T565 PolarHBondContact O-N 3.46Å
564	Y	56.1	Low	74	Confident	40 Å²	40	73.1 Å²	73.1	16%	0.157	37%	0.374	C	S	.	.			trans	-90.6	88.6	-178	-55.2	-67.3	0	0	0	112.2	T207 I211 Q561 Q562 V566	T207-Y564 HydrophobicContact CG2-CD1 4.18Å; T207-Y564 HydrophobicContact CG2-CE1 3.52Å; T207-Y564 PolarHBondContact O-OH 3.13Å; I211-Y564 HydrophobicContact CD1-CE2 4.07Å; Q561-Y564 HydrophobicContact CB-CD2 3.71Å; Q561-Y564 HydrophobicContact CB-CE2 3.36Å; Q561-Y564 HydrophobicContact CG-CE2 4.16Å; Q561-Y564 WeakPolarHBondContact O-CD2 3.32Å; Q561-Y564 PolarHBondContact O-N 2.99Å; Q561-Y564 PolarHBondContact OE1-OH 3.19Å; Q562-Y564 VanDerWaalsContact C-N 3.3Å; Q562-Y564 PolarHBondContact O-N 3.22Å; Y564-V566 PolarHBondContact O-N 2.55Å
565	T	53.7	Low	74	Confident	138 Å²	138	74.2 Å²	74.2	85%	0.847	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-9.5	174.5	54.7	0	0	0	0	114.4	D563	D563-T565 PolarHBondContact O-N 3.46Å
566	V	64.2	Low	74	Confident	54 Å²	54	76.9 Å²	76.9	33%	0.327	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.9	59.7	178.3	-164.5	0	0	0	0	111.5	Y564 L569 P570	Y564-V566 PolarHBondContact O-N 2.55Å; V566-L569 HydrophobicContact CG1-CB 4.31Å; V566-P570 WeakPolarHBondContact O-CD 3.18Å
567	W	69.8	Low	74	Confident	89 Å²	89	76.1 Å²	76.1	34%	0.337	39%	0.386	S	S	.	.			trans	-77.3	-22.7	-178.1	58.5	-94.7	0	0	0	115.2	V555 L558 L569 P570 L571	V555-W567 HydrophobicContact CG2-CZ3 4.29Å; L558-W567 HydrophobicContact CB-CB 4.06Å; W567-L569 PolarHBondContact O-N 2.67Å; W567-P570 WeakPolarHBondContact O-CD 3.32Å; W567-L571 HydrophobicContact CE3-CD2 4.35Å; W567-L571 HydrophobicContact CZ3-CD2 4Å; W567-L571 PolarHBondContact O-N 3.41Å
568	V	73.6	Confident	74.3	Confident	76 Å²	76	74.2 Å²	74.2	46%	0.461	37%	0.371	S	S	.	.	H	α-helix	trans	-59.9	-35.4	-178.7	176.6	0	0	0	0	111.8	L571 L572	V568-L571 WeakPolarHBondContact O-CB 3.37Å; V568-L571 PolarHBondContact O-N 3.1Å; V568-L572 HydrophobicContact CG1-CD1 4.29Å; V568-L572 HydrophobicContact CG1-CG 4.48Å; V568-L572 WeakPolarHBondContact O-CG 3.47Å; V568-L572 PolarHBondContact O-N 3.44Å
569	L	70.6	Confident	74.9	Confident	33 Å²	33	78.7 Å²	78.7	17%	0.173	39%	0.388	C	S	.	.	H	α-helix	trans	-77.5	-48.1	-172.9	178.1	75.1	0	0	0	113.4	V201 V566 W567 L571 L572 I573	V201-L569 HydrophobicContact CB-CD2 3.66Å; V201-L569 HydrophobicContact CG1-CD2 4.09Å; V201-L569 HydrophobicContact CG2-CD1 4.17Å; V201-L569 HydrophobicContact CG2-CD2 3.25Å; V201-L569 HydrophobicContact CG2-CG 4.23Å; V566-L569 HydrophobicContact CG1-CB 4.31Å; W567-L569 PolarHBondContact O-N 2.67Å; L569-L571 PolarHBondContact O-N 3.46Å; L569-L572 PolarHBondContact O-N 3.43Å; L569-L572 VanDerWaalsContact O-N 3.11Å; L569-I573 WeakPolarHBondContact O-CG1 3.44Å; L569-I573 PolarHBondContact O-N 2.74Å
570	P	76.6	Confident	75.4	Confident	4 Å²	4	78.6 Å²	78.6	3%	0.026	39%	0.387	C	S	.	.	H	α-helix	trans	-49.9	-42.6	166.2	-31.2	36.7	0	0	0	113	S208 I212 L558 V566 W567 L572 I573 S574	S208-P570 WeakPolarHBondContact OG-CB 3.2Å; S208-P570 WeakPolarHBondContact OG-CG 3.37Å; I212-P570 HydrophobicContact CD1-CB 4.15Å; I212-P570 HydrophobicContact CG1-CB 4.28Å; L558-P570 HydrophobicContact CD1-CB 4.33Å; V566-P570 WeakPolarHBondContact O-CD 3.18Å; W567-P570 WeakPolarHBondContact O-CD 3.32Å; P570-L572 PolarHBondContact O-N 2.9Å; P570-I573 PolarHBondContact O-N 2.83Å; P570-S574 PolarHBondContact O-N 2.87Å; P570-S574 PolarHBondContact O-OG 2.83Å
571	L	84.6	Confident	76.2	Confident	21 Å²	21	69.7 Å²	69.7	11%	0.11	35%	0.353	C	S	.	.	H	α-helix	trans	-59.5	-46.5	176	-178.2	66.5	0	0	0	112	V555 L558 W567 V568 L569 I573 S574 C575	V555-L571 HydrophobicContact CG2-CD1 4.44Å; V555-L571 HydrophobicContact CG2-CD2 3.56Å; L558-L571 HydrophobicContact CD1-CB 3.86Å; L558-L571 HydrophobicContact CD1-CD1 4.39Å; W567-L571 HydrophobicContact CE3-CD2 4.35Å; W567-L571 HydrophobicContact CZ3-CD2 4Å; W567-L571 PolarHBondContact O-N 3.41Å; V568-L571 WeakPolarHBondContact O-CB 3.37Å; V568-L571 PolarHBondContact O-N 3.1Å; L569-L571 PolarHBondContact O-N 3.46Å; L571-I573 VanDerWaalsContact C-N 3.31Å; L571-I573 PolarHBondContact O-N 3.34Å; L571-S574 PolarHBondContact O-N 3.18Å; L571-C575 WeakPolarHBondContact O-CB 3.34Å; L571-C575 PolarHBondContact O-N 2.91Å; L571-C575 PolarHBondContact O-SG 3.08Å
572	L	81	Confident	77.4	Confident	106 Å²	106	65.5 Å²	65.5	56%	0.555	33%	0.334	S	S	*	.	H	α-helix	trans	-60.8	-39.5	176.5	-72.9	175	0	0	0	112.4	V568 L569 P570 C575 L576	V568-L572 HydrophobicContact CG1-CD1 4.29Å; V568-L572 HydrophobicContact CG1-CG 4.48Å; V568-L572 WeakPolarHBondContact O-CG 3.47Å; V568-L572 PolarHBondContact O-N 3.44Å; L569-L572 PolarHBondContact O-N 3.43Å; L569-L572 VanDerWaalsContact O-N 3.11Å; P570-L572 PolarHBondContact O-N 2.9Å; L572-C575 PolarHBondContact O-N 2.03Å; L572-L576 WeakPolarHBondContact O-CB 3.49Å; L572-L576 PolarHBondContact O-N 2.76Å
573	I	81.4	Confident	79	Confident	57 Å²	57	59.4 Å²	59.4	29%	0.292	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-46.4	176.3	-65.9	169.2	0	0	0	110.3	V201 V205 L569 P570 L571 C575 L576 F577	V201-I573 HydrophobicContact CG1-CD1 4.22Å; V205-I573 HydrophobicContact CG2-CD1 3.52Å; L569-I573 WeakPolarHBondContact O-CG1 3.44Å; L569-I573 PolarHBondContact O-N 2.74Å; P570-I573 PolarHBondContact O-N 2.83Å; L571-I573 VanDerWaalsContact C-N 3.31Å; L571-I573 PolarHBondContact O-N 3.34Å; I573-C575 PolarHBondContact O-N 3.14Å; I573-L576 PolarHBondContact O-N 2.78Å; I573-F577 PolarHBondContact O-N 3.43Å
574	S	87.6	Confident	80.4	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.007	29%	0.289	C	S	.	.	H	α-helix	trans	-62.6	-40.5	176.1	-65.7	0	0	0	0	112.3	P570 L571 F577 A578	P570-S574 PolarHBondContact O-N 2.87Å; P570-S574 PolarHBondContact O-OG 2.83Å; L571-S574 PolarHBondContact O-N 3.18Å; S574-F577 PolarHBondContact O-N 3.12Å; S574-A578 WeakPolarHBondContact O-CB 3.39Å; S574-A578 PolarHBondContact O-N 3.05Å
575	C	88.3	Confident	81.8	Confident	22 Å²	22	54.6 Å²	54.6	15%	0.149	29%	0.287	C	S	.	.	H	α-helix	trans	-64.2	-41.3	175.3	-71.4	0	0	0	0	112.4	V547 A551 L571 L572 I573 A578 Y579	V547-C575 HydrophobicContact CG1-CB 4.09Å; A551-C575 VanDerWaalsContact CB-SG 3.53Å; L571-C575 WeakPolarHBondContact O-CB 3.34Å; L571-C575 PolarHBondContact O-N 2.91Å; L571-C575 PolarHBondContact O-SG 3.08Å; L572-C575 PolarHBondContact O-N 2.03Å; I573-C575 PolarHBondContact O-N 3.14Å; C575-A578 PolarHBondContact O-N 2.99Å; C575-Y579 PolarHBondContact O-N 2.75Å
576	L	86.6	Confident	83.4	Confident	108 Å²	108	48.1 Å²	48.1	57%	0.565	25%	0.247	S	C	*	.	H	α-helix	trans	-61.3	-46.6	174.8	176.5	63.2	0	0	0	110.7	L572 I573 Y579 L580	L572-L576 WeakPolarHBondContact O-CB 3.49Å; L572-L576 PolarHBondContact O-N 2.76Å; I573-L576 PolarHBondContact O-N 2.78Å; L576-Y579 WeakPolarHBondContact O-CB 3.39Å; L576-Y579 PolarHBondContact O-N 3.33Å; L576-L580 HydrophobicContact CG-CD1 4.49Å; L576-L580 WeakPolarHBondContact O-CG 3.45Å; L576-L580 PolarHBondContact O-N 2.77Å
577	F	86.8	Confident	84.5	Confident	85 Å²	85	47.3 Å²	47.3	37%	0.373	24%	0.244	S	C	.	.	H	α-helix	trans	-60.4	-46	175.8	-178	-95.3	0	0	0	111.7	C216 I573 S574 Y579 L580 V581	C216-F577 HydrophobicContact CB-CD1 3.65Å; C216-F577 HydrophobicContact CB-CE1 3.43Å; C216-F577 VanDerWaalsContact CB-CE1 3.43Å; C216-F577 HydrophobicContact CB-CZ 4.17Å; C216-F577 WeakPolarHBondContact SG-CD1 3.49Å; I573-F577 PolarHBondContact O-N 3.43Å; S574-F577 PolarHBondContact O-N 3.12Å; F577-Y579 VanDerWaalsContact C-N 3.28Å; F577-Y579 PolarHBondContact O-N 2.91Å; F577-L580 WeakPolarHBondContact O-CB 3.43Å; F577-L580 PolarHBondContact O-N 3.2Å; F577-L580 VanDerWaalsContact O-N 3.09Å; F577-V581 HydrophobicContact CD1-CG2 3.94Å; F577-V581 HydrophobicContact CE1-CG2 3.45Å; F577-V581 VanDerWaalsContact CE1-CG2 3.45Å; F577-V581 HydrophobicContact CE2-CG2 4.15Å; F577-V581 HydrophobicContact CG-CG2 4.49Å; F577-V581 HydrophobicContact CZ-CG2 3.58Å; F577-V581 WeakPolarHBondContact O-CG2 3.31Å; F577-V581 PolarHBondContact O-N 3.47Å
578	A	92.1	Very high	85.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.7	-41.3	177.3	0	0	0	0	0	112.2	A219 V547 T550 S574 C575 V581 A582	A219-A578 HydrophobicContact CB-CB 3.58Å; V547-A578 HydrophobicContact CG2-CB 4.29Å; T550-A578 HydrophobicContact CG2-CB 4.05Å; S574-A578 WeakPolarHBondContact O-CB 3.39Å; S574-A578 PolarHBondContact O-N 3.05Å; C575-A578 PolarHBondContact O-N 2.99Å; A578-V581 PolarHBondContact O-N 3.44Å; A578-A582 VanDerWaalsContact O-CB 3.26Å; A578-A582 WeakPolarHBondContact O-CB 3.46Å; A578-A582 PolarHBondContact O-N 3.4Å
579	Y	92.7	Very high	86	Confident	97 Å²	97	39.7 Å²	39.7	38%	0.38	21%	0.207	S	C	.	.	H	α-helix	trans	-62.8	-43.7	175	177.4	-96.2	0	0	0	112.1	V547 C575 L576 F577 A582 N583	V547-Y579 HydrophobicContact CG2-CD2 4.35Å; C575-Y579 PolarHBondContact O-N 2.75Å; L576-Y579 WeakPolarHBondContact O-CB 3.39Å; L576-Y579 PolarHBondContact O-N 3.33Å; F577-Y579 VanDerWaalsContact C-N 3.28Å; F577-Y579 PolarHBondContact O-N 2.91Å; Y579-A582 PolarHBondContact O-N 2.83Å; Y579-N583 WeakPolarHBondContact O-CB 3.32Å; Y579-N583 PolarHBondContact O-N 2.97Å
580	L	87.1	Confident	86.8	Confident	99 Å²	99	40.6 Å²	40.6	52%	0.518	21%	0.21	S	C	.	.	H	α-helix	trans	-62.7	-44.7	179	-68.4	173.5	0	0	0	111.7	L576 F577 N583 C584	L576-L580 HydrophobicContact CG-CD1 4.49Å; L576-L580 WeakPolarHBondContact O-CG 3.45Å; L576-L580 PolarHBondContact O-N 2.77Å; F577-L580 WeakPolarHBondContact O-CB 3.43Å; F577-L580 PolarHBondContact O-N 3.2Å; F577-L580 VanDerWaalsContact O-N 3.09Å; L580-N583 PolarHBondContact O-N 2.83Å; L580-C584 PolarHBondContact O-N 2.95Å
581	V	88.8	Confident	87.3	Confident	17 Å²	17	41.4 Å²	41.4	10%	0.103	22%	0.215	C	C	.	.	H	α-helix	trans	-64.8	-49.5	177.7	179.3	0	0	0	0	110.7	F220 F577 A578 N583 C584 F585	F220-V581 HydrophobicContact CB-CG1 4.43Å; F220-V581 HydrophobicContact CD2-CG1 4.11Å; F577-V581 HydrophobicContact CD1-CG2 3.94Å; F577-V581 HydrophobicContact CE1-CG2 3.45Å; F577-V581 VanDerWaalsContact CE1-CG2 3.45Å; F577-V581 HydrophobicContact CE2-CG2 4.15Å; F577-V581 HydrophobicContact CG-CG2 4.49Å; F577-V581 HydrophobicContact CZ-CG2 3.58Å; F577-V581 WeakPolarHBondContact O-CG2 3.31Å; F577-V581 PolarHBondContact O-N 3.47Å; A578-V581 PolarHBondContact O-N 3.44Å; V581-N583 VanDerWaalsContact C-N 3.27Å; V581-N583 PolarHBondContact O-N 3.28Å; V581-C584 WeakPolarHBondContact O-CB 3.43Å; V581-C584 PolarHBondContact O-N 3.12Å; V581-C584 VanDerWaalsContact O-N 3.09Å; V581-F585 HydrophobicContact CG1-CD2 3.93Å; V581-F585 HydrophobicContact CG1-CE2 3.81Å; V581-F585 WeakPolarHBondContact O-CD2 3.18Å; V581-F585 PolarHBondContact O-N 3.19Å
582	A	91.1	Very high	87.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-57.8	-41.5	176.8	0	0	0	0	0	111.9	K543 I546 A578 Y579 C584 L586	K543-A582 HydrophobicContact CB-CB 4.33Å; K543-A582 HydrophobicContact CG-CB 4.26Å; I546-A582 HydrophobicContact CB-CB 4.16Å; I546-A582 HydrophobicContact CD1-CB 3.61Å; I546-A582 HydrophobicContact CG2-CB 4.11Å; A578-A582 VanDerWaalsContact O-CB 3.26Å; A578-A582 WeakPolarHBondContact O-CB 3.46Å; A578-A582 PolarHBondContact O-N 3.4Å; Y579-A582 PolarHBondContact O-N 2.83Å; A582-C584 VanDerWaalsContact C-N 3.34Å; A582-C584 PolarHBondContact O-N 3.3Å; A582-L586 VanDerWaalsContact O-CB 3.29Å; A582-L586 WeakPolarHBondContact O-CB 3.32Å; A582-L586 WeakPolarHBondContact O-CG 3.27Å; A582-L586 PolarHBondContact O-N 3.43Å
583	N	89.4	Confident	88	Confident	54 Å²	54	36 Å²	36	29%	0.289	19%	0.186	S	C	.	.	H	α-helix	trans	-63.8	-39	177.1	-174.1	67.6	0	0	0	112.2	K543 Y579 L580 V581 S587	K543-N583 HydrophobicContact CD-CB 4.44Å; K543-N583 PolarHBondContact NZ-OD1 3.1Å; Y579-N583 WeakPolarHBondContact O-CB 3.32Å; Y579-N583 PolarHBondContact O-N 2.97Å; L580-N583 PolarHBondContact O-N 2.83Å; V581-N583 VanDerWaalsContact C-N 3.27Å; V581-N583 PolarHBondContact O-N 3.28Å; N583-S587 WeakPolarHBondContact O-CB 3.21Å; N583-S587 PolarHBondContact O-N 3.3Å
584	C	86.6	Confident	88.3	Confident	58 Å²	58	34.4 Å²	34.4	39%	0.392	18%	0.179	S	C	.	.	H	α-helix	trans	-60.4	-50.4	177.9	-172.8	0	0	0	0	112	P336 L580 V581 A582 L588	P336-C584 WeakPolarHBondContact CB-SG 3.48Å; L580-C584 PolarHBondContact O-N 2.95Å; V581-C584 WeakPolarHBondContact O-CB 3.43Å; V581-C584 PolarHBondContact O-N 3.12Å; V581-C584 VanDerWaalsContact O-N 3.09Å; A582-C584 VanDerWaalsContact C-N 3.34Å; A582-C584 PolarHBondContact O-N 3.3Å; C584-L588 PolarHBondContact O-N 3.16Å
585	F	86.1	Confident	88.5	Confident	28 Å²	28	34.3 Å²	34.3	12%	0.123	18%	0.178	C	C	.	.	H	α-helix	trans	-70.8	-44.5	-179.5	-75.8	-78.9	0	0	0	112.9	F220 L224 V581 L588 F589	F220-F585 AromaticContact CD2-CE2 3.96Å; F220-F585 HydrophobicContact CD2-CE2 3.96Å; F220-F585 HydrophobicContact CD2-CZ 4.24Å; F220-F585 AromaticContact CE2-CE2 3.8Å; F220-F585 HydrophobicContact CE2-CE2 3.8Å; F220-F585 AromaticContact CE2-CZ 3.62Å; F220-F585 HydrophobicContact CE2-CZ 3.62Å; F220-F585 HydrophobicContact CZ-CZ 4.19Å; L224-F585 HydrophobicContact CD2-CD1 4.32Å; L224-F585 HydrophobicContact CD2-CE1 3.58Å; L224-F585 HydrophobicContact CD2-CZ 3.77Å; L224-F585 HydrophobicContact CG-CZ 4.39Å; V581-F585 HydrophobicContact CG1-CD2 3.93Å; V581-F585 HydrophobicContact CG1-CE2 3.81Å; V581-F585 WeakPolarHBondContact O-CD2 3.18Å; V581-F585 PolarHBondContact O-N 3.19Å; F585-L588 WeakPolarHBondContact O-CB 3.48Å; F585-L588 PolarHBondContact O-N 3.36Å; F585-F589 PolarHBondContact O-N 3.06Å
586	L	87.3	Confident	88.6	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-77.2	-27.8	-175.5	-63.9	175.8	0	0	0	112.8	M226 I230 L539 K543 I546 A582 L588 F589 E590	M226-L586 HydrophobicContact CG-CD2 4.27Å; I230-L586 HydrophobicContact CD1-CD2 3.52Å; L539-L586 HydrophobicContact CD2-CB 4.44Å; L539-L586 HydrophobicContact CD2-CD2 4.15Å; K543-L586 HydrophobicContact CB-CD1 4.43Å; K543-L586 HydrophobicContact CG-CB 4.38Å; K543-L586 HydrophobicContact CG-CD1 3.58Å; I546-L586 HydrophobicContact CD1-CD1 4.2Å; A582-L586 VanDerWaalsContact O-CB 3.29Å; A582-L586 WeakPolarHBondContact O-CB 3.32Å; A582-L586 WeakPolarHBondContact O-CG 3.27Å; A582-L586 PolarHBondContact O-N 3.43Å; L586-L588 VanDerWaalsContact C-N 3.34Å; L586-F589 WeakPolarHBondContact O-CB 3.21Å; L586-F589 PolarHBondContact O-N 3.45Å; L586-E590 PolarHBondContact O-N 2.91Å
587	S	85.9	Confident	88.5	Confident	38 Å²	38	30 Å²	30	27%	0.266	15%	0.152	S	C	.	.	H	α-helix	trans	-69	-31.6	171.6	-179.7	0	0	0	0	112.3	N583 F589 E590 N591	N583-S587 WeakPolarHBondContact O-CB 3.21Å; N583-S587 PolarHBondContact O-N 3.3Å; S587-F589 VanDerWaalsContact C-N 3.27Å; S587-F589 PolarHBondContact O-N 3.47Å; S587-E590 WeakPolarHBondContact O-CB 3.21Å; S587-E590 PolarHBondContact O-N 2.86Å; S587-N591 PolarHBondContact O-N 2.87Å; S587-N591 VanDerWaalsContact O-N 3.09Å; S587-N591 PolarHBondContact O-ND2 3.48Å; S587-N591 VanDerWaalsContact O-ND2 3.08Å
588	L	87.9	Confident	88.5	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-61.5	-41.2	170.3	178.4	68.9	0	0	0	111	F326 L332 F333 P336 I406 C584 F585 L586 N591 V592	F326-L588 HydrophobicContact CE1-CD2 3.84Å; F326-L588 HydrophobicContact CE1-CG 4.17Å; F326-L588 HydrophobicContact CZ-CD2 4.2Å; F326-L588 HydrophobicContact CZ-CG 4.08Å; L332-L588 WeakPolarHBondContact O-CD2 3Å; F333-L588 HydrophobicContact CD1-CD2 4.13Å; P336-L588 HydrophobicContact CG-CB 4.11Å; P336-L588 HydrophobicContact CG-CD1 4.16Å; P336-L588 HydrophobicContact CG-CD2 3.92Å; P336-L588 HydrophobicContact CG-CG 4.28Å; I406-L588 HydrophobicContact CD1-CD1 3.53Å; I406-L588 HydrophobicContact CG1-CD1 4.37Å; C584-L588 PolarHBondContact O-N 3.16Å; F585-L588 WeakPolarHBondContact O-CB 3.48Å; F585-L588 PolarHBondContact O-N 3.36Å; L586-L588 VanDerWaalsContact C-N 3.34Å; L588-N591 PolarHBondContact O-N 2.88Å; L588-V592 PolarHBondContact O-N 3.39Å
589	F	87.5	Confident	88.4	Confident	3 Å²	3	25.9 Å²	25.9	1%	0.013	13%	0.134	C	C	.	.	H	α-helix	trans	-64.2	-42.6	177.8	-159.2	-84.5	0	0	0	111.8	I230 F319 T322 F326 L539 F585 L586 S587 N591 V592 V593	I230-F589 HydrophobicContact CB-CE2 4.46Å; I230-F589 HydrophobicContact CB-CZ 4.45Å; I230-F589 HydrophobicContact CG2-CD2 4.4Å; I230-F589 HydrophobicContact CG2-CE1 3.71Å; I230-F589 HydrophobicContact CG2-CE2 3.6Å; I230-F589 HydrophobicContact CG2-CZ 3.19Å; F319-F589 HydrophobicContact CB-CE1 4.23Å; F319-F589 HydrophobicContact CB-CZ 4.29Å; F319-F589 HydrophobicContact CD1-CD1 4.28Å; F319-F589 AromaticContact CD1-CE1 3.41Å; F319-F589 HydrophobicContact CD1-CE1 3.41Å; F319-F589 VanDerWaalsContact CD1-CE1 3.41Å; F319-F589 HydrophobicContact CD1-CZ 4.27Å; F319-F589 HydrophobicContact CE1-CD1 4.24Å; F319-F589 AromaticContact CE1-CE1 3.81Å; F319-F589 HydrophobicContact CE1-CE1 3.81Å; F319-F589 AromaticContact CG-CE1 3.94Å; F319-F589 HydrophobicContact CG-CE1 3.94Å; F319-F589 HydrophobicContact CG-CZ 4.48Å; T322-F589 VanDerWaalsContact CB-CZ 3.46Å; T322-F589 HydrophobicContact CG2-CD1 4.05Å; T322-F589 HydrophobicContact CG2-CD2 3.86Å; T322-F589 HydrophobicContact CG2-CE1 3.59Å; T322-F589 HydrophobicContact CG2-CE2 3.39Å; T322-F589 HydrophobicContact CG2-CG 4.17Å; T322-F589 HydrophobicContact CG2-CZ 3.23Å; F326-F589 AromaticContact CD2-CD2 3.92Å; F326-F589 HydrophobicContact CD2-CD2 3.92Å; F326-F589 AromaticContact CD2-CE2 3.91Å; F326-F589 HydrophobicContact CD2-CE2 3.91Å; F326-F589 AromaticContact CE2-CD2 3.38Å; F326-F589 HydrophobicContact CE2-CD2 3.38Å; F326-F589 AromaticContact CE2-CE2 3.79Å; F326-F589 HydrophobicContact CE2-CE2 3.79Å; F326-F589 HydrophobicContact CE2-CG 4.15Å; F326-F589 HydrophobicContact CZ-CD2 4.23Å; L539-F589 HydrophobicContact CD1-CD1 4.48Å; L539-F589 HydrophobicContact CD2-CB 4.28Å; L539-F589 HydrophobicContact CD2-CD1 3.78Å; L539-F589 HydrophobicContact CD2-CG 4.31Å; F585-F589 PolarHBondContact O-N 3.06Å; L586-F589 WeakPolarHBondContact O-CB 3.21Å; L586-F589 PolarHBondContact O-N 3.45Å; S587-F589 VanDerWaalsContact C-N 3.27Å; S587-F589 PolarHBondContact O-N 3.47Å; F589-N591 PolarHBondContact O-N 3.27Å; F589-V592 PolarHBondContact O-N 2.92Å; F589-V593 HydrophobicContact CD1-CG2 3.77Å; F589-V593 HydrophobicContact CE1-CG2 3.71Å; F589-V593 VanDerWaalsContact O-CG2 3.25Å; F589-V593 WeakPolarHBondContact O-CG2 3.03Å; F589-V593 PolarHBondContact O-N 3.33Å
590	E	87	Confident	88	Confident	51 Å²	51	21.8 Å²	21.8	24%	0.238	12%	0.118	C	C	.	.	H	α-helix	trans	-52.1	-52.5	172	-160.5	177.2	144.4	0	0	111.2	L539 L586 S587 V592 V593 D594	L539-E590 HydrophobicContact CD1-CB 3.73Å; L539-E590 HydrophobicContact CD1-CG 4.05Å; L586-E590 PolarHBondContact O-N 2.91Å; S587-E590 WeakPolarHBondContact O-CB 3.21Å; S587-E590 PolarHBondContact O-N 2.86Å; E590-V592 VanDerWaalsContact C-N 3.32Å; E590-V592 PolarHBondContact O-N 3.32Å; E590-V593 WeakPolarHBondContact O-CB 3.42Å; E590-V593 PolarHBondContact O-N 2.96Å; E590-V593 VanDerWaalsContact O-N 3.1Å; E590-D594 PolarHBondContact O-N 2.95Å
591	N	87.8	Confident	87.8	Confident	22 Å²	22	18.1 Å²	18.1	12%	0.118	10%	0.102	C	C	.	.	H	α-helix	trans	-60	-38.1	179.8	-68.4	-44.7	0	0	0	113.5	S587 L588 F589 V595	S587-N591 PolarHBondContact O-N 2.87Å; S587-N591 VanDerWaalsContact O-N 3.09Å; S587-N591 PolarHBondContact O-ND2 3.48Å; S587-N591 VanDerWaalsContact O-ND2 3.08Å; L588-N591 PolarHBondContact O-N 2.88Å; F589-N591 PolarHBondContact O-N 3.27Å; N591-V595 VanDerWaalsContact O-CG2 3.24Å; N591-V595 WeakPolarHBondContact O-CG2 3.36Å; N591-V595 PolarHBondContact O-N 3.03Å
592	V	91.3	Very high	87.7	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-70.1	-39.3	177.8	176.4	0	0	0	0	110.8	T322 V325 F326 L332 I406 V410 L588 F589 E590 D594 V595 L596	T322-V592 HydrophobicContact CG2-CB 4.08Å; T322-V592 HydrophobicContact CG2-CG1 3.72Å; V325-V592 HydrophobicContact CB-CG1 4.45Å; V325-V592 HydrophobicContact CG1-CG1 4.2Å; F326-V592 HydrophobicContact CE1-CG2 4.35Å; F326-V592 HydrophobicContact CE2-CB 4.19Å; F326-V592 HydrophobicContact CE2-CG1 4.36Å; F326-V592 HydrophobicContact CE2-CG2 4.04Å; F326-V592 HydrophobicContact CZ-CB 4.25Å; F326-V592 HydrophobicContact CZ-CG2 3.62Å; L332-V592 HydrophobicContact CD1-CG2 4.42Å; I406-V592 HydrophobicContact CG2-CG2 3.85Å; V410-V592 HydrophobicContact CG1-CG1 4.16Å; V410-V592 HydrophobicContact CG2-CB 4.43Å; V410-V592 HydrophobicContact CG2-CG1 3.84Å; V410-V592 HydrophobicContact CG2-CG2 4.1Å; L588-V592 PolarHBondContact O-N 3.39Å; F589-V592 PolarHBondContact O-N 2.92Å; E590-V592 VanDerWaalsContact C-N 3.32Å; E590-V592 PolarHBondContact O-N 3.32Å; V592-D594 VanDerWaalsContact C-N 3.35Å; V592-V595 PolarHBondContact O-N 2.7Å; V592-L596 HydrophobicContact CG1-CD1 4.11Å; V592-L596 HydrophobicContact CG1-CG 4.34Å; V592-L596 WeakPolarHBondContact O-CB 3.38Å; V592-L596 WeakPolarHBondContact O-CG 3.49Å; V592-L596 PolarHBondContact O-N 2.93Å
593	V	88.1	Confident	87.5	Confident	12 Å²	12	17.3 Å²	17.3	7%	0.073	10%	0.097	C	C	.	.	H	α-helix	trans	-60.6	-44.7	176.1	168.7	0	0	0	0	110.8	L318 F319 T322 F589 E590 V595 L596 F597	L318-V593 HydrophobicContact CD2-CG1 3.52Å; L318-V593 HydrophobicContact CG-CG1 3.91Å; F319-V593 HydrophobicContact CD1-CG2 3.79Å; F319-V593 HydrophobicContact CE1-CG1 4.36Å; F319-V593 HydrophobicContact CE1-CG2 3.77Å; T322-V593 HydrophobicContact CG2-CG2 4.02Å; T322-V593 VanDerWaalsContact OG1-CG2 3.31Å; T322-V593 WeakPolarHBondContact OG1-CG2 3.34Å; F589-V593 HydrophobicContact CD1-CG2 3.77Å; F589-V593 HydrophobicContact CE1-CG2 3.71Å; F589-V593 VanDerWaalsContact O-CG2 3.25Å; F589-V593 WeakPolarHBondContact O-CG2 3.03Å; F589-V593 PolarHBondContact O-N 3.33Å; E590-V593 WeakPolarHBondContact O-CB 3.42Å; E590-V593 PolarHBondContact O-N 2.96Å; E590-V593 VanDerWaalsContact O-N 3.1Å; V593-V595 PolarHBondContact O-N 3.29Å; V593-L596 PolarHBondContact O-N 2.85Å; V593-F597 WeakPolarHBondContact O-CB 3.35Å; V593-F597 PolarHBondContact O-N 3.05Å
594	D	87.4	Confident	87.1	Confident	24 Å²	24	19 Å²	19	13%	0.128	10%	0.102	C	C	.	.	H	α-helix	trans	-61.4	-43.9	177.3	-67.7	-12.7	0	0	0	112.2	Q497 N532 E590 V592 F597 L598	Q497-D594 HydrophobicContact CG-CB 4.48Å; N532-D594 PolarHBondContact OD1-OD1 3.01Å; E590-D594 PolarHBondContact O-N 2.95Å; V592-D594 VanDerWaalsContact C-N 3.35Å; D594-F597 WeakPolarHBondContact O-CB 3.5Å; D594-F597 PolarHBondContact O-N 3.42Å; D594-L598 PolarHBondContact O-N 2.98Å; D594-L598 VanDerWaalsContact O-N 3.12Å
595	V	92.3	Very high	86.9	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.6	-48.1	178	172.2	0	0	0	0	110.8	A407 V410 T501 N591 V592 V593 F597 L598 C599	A407-V595 HydrophobicContact CB-CG2 3.96Å; V410-V595 HydrophobicContact CB-CB 4.3Å; V410-V595 HydrophobicContact CB-CG1 3.63Å; V410-V595 HydrophobicContact CG1-CB 4.09Å; V410-V595 HydrophobicContact CG1-CG1 3.56Å; T501-V595 HydrophobicContact CG2-CB 4.3Å; T501-V595 HydrophobicContact CG2-CG1 3.78Å; T501-V595 HydrophobicContact CG2-CG2 4.46Å; T501-V595 WeakPolarHBondContact OG1-CG2 3.36Å; N591-V595 VanDerWaalsContact O-CG2 3.24Å; N591-V595 WeakPolarHBondContact O-CG2 3.36Å; N591-V595 PolarHBondContact O-N 3.03Å; V592-V595 PolarHBondContact O-N 2.7Å; V593-V595 PolarHBondContact O-N 3.29Å; V595-F597 VanDerWaalsContact C-N 3.26Å; V595-F597 PolarHBondContact O-N 2.82Å; V595-L598 PolarHBondContact O-N 3.31Å; V595-C599 PolarHBondContact O-N 3.15Å; V595-C599 PolarHBondContact O-SG 3.2Å
596	L	89.9	Confident	86.8	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-59.4	-42	177.4	-77.1	174.9	0	0	0	111.1	L318 T322 V325 V410 F414 V592 V593 L598 C599 Y600	L318-L596 HydrophobicContact CD1-CB 4.25Å; T322-L596 VanDerWaalsContact OG1-CD1 3.28Å; T322-L596 WeakPolarHBondContact OG1-CD1 3.33Å; V325-L596 HydrophobicContact CG2-CD1 3.94Å; V325-L596 HydrophobicContact CG2-CD2 4Å; V325-L596 HydrophobicContact CG2-CG 4.41Å; V410-L596 HydrophobicContact CG1-CD2 3.63Å; V410-L596 HydrophobicContact CG1-CG 3.72Å; F414-L596 HydrophobicContact CD2-CD2 3.71Å; F414-L596 HydrophobicContact CE2-CD2 4.36Å; V592-L596 HydrophobicContact CG1-CD1 4.11Å; V592-L596 HydrophobicContact CG1-CG 4.34Å; V592-L596 WeakPolarHBondContact O-CB 3.38Å; V592-L596 WeakPolarHBondContact O-CG 3.49Å; V592-L596 PolarHBondContact O-N 2.93Å; V593-L596 PolarHBondContact O-N 2.85Å; L596-L598 PolarHBondContact O-N 3.18Å; L596-C599 CarbonylContact O-C 3.6Å; L596-C599 WeakPolarHBondContact O-CB 3.33Å; L596-C599 PolarHBondContact O-N 3.49Å; L596-C599 VanDerWaalsContact O-N 3.14Å; L596-Y600 HydrophobicContact CB-CD2 4.37Å; L596-Y600 HydrophobicContact CB-CE2 3.83Å; L596-Y600 WeakPolarHBondContact O-CD2 3.18Å; L596-Y600 PolarHBondContact O-N 2.79Å
597	F	85.4	Confident	86.6	Confident	38 Å²	38	22 Å²	22	17%	0.167	11%	0.111	C	C	.	.	H	α-helix	trans	-56.7	-48.2	177.6	179.4	-98.2	0	0	0	111.9	L521 V528 I531 V593 D594 V595 C599 Y600 A601	L521-F597 HydrophobicContact CD2-CD1 4.43Å; L521-F597 HydrophobicContact CD2-CE1 3.81Å; V528-F597 HydrophobicContact CB-CE1 4.11Å; V528-F597 HydrophobicContact CB-CZ 3.96Å; V528-F597 HydrophobicContact CG1-CE1 3.78Å; V528-F597 HydrophobicContact CG1-CZ 4.12Å; V528-F597 HydrophobicContact CG2-CE1 3.71Å; V528-F597 HydrophobicContact CG2-CZ 3.52Å; I531-F597 HydrophobicContact CD1-CD2 4.47Å; I531-F597 HydrophobicContact CD1-CE2 3.72Å; I531-F597 HydrophobicContact CG2-CD2 4.23Å; I531-F597 HydrophobicContact CG2-CE2 4.36Å; V593-F597 WeakPolarHBondContact O-CB 3.35Å; V593-F597 PolarHBondContact O-N 3.05Å; D594-F597 WeakPolarHBondContact O-CB 3.5Å; D594-F597 PolarHBondContact O-N 3.42Å; V595-F597 VanDerWaalsContact C-N 3.26Å; V595-F597 PolarHBondContact O-N 2.82Å; F597-C599 VanDerWaalsContact C-N 3.35Å; F597-C599 PolarHBondContact O-N 3.2Å; F597-Y600 PolarHBondContact O-N 2.81Å; F597-A601 PolarHBondContact O-N 3.07Å
598	L	87.4	Confident	86.4	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.6	-39	176.1	-165.7	67.4	0	0	0	111.7	N498 T501 A502 A517 L520 L521 D594 V595 L596 Y600 A601 V602	N498-L598 WeakPolarHBondContact O-CD2 3.33Å; T501-L598 HydrophobicContact CG2-CB 3.89Å; T501-L598 HydrophobicContact CG2-CD2 3.65Å; T501-L598 HydrophobicContact CG2-CG 4.24Å; A502-L598 HydrophobicContact CB-CD2 4.32Å; A517-L598 HydrophobicContact CB-CD2 4.24Å; L520-L598 HydrophobicContact CD2-CD1 3.92Å; L521-L598 HydrophobicContact CD2-CD1 4.25Å; L521-L598 HydrophobicContact CG-CD1 4.41Å; D594-L598 PolarHBondContact O-N 2.98Å; D594-L598 VanDerWaalsContact O-N 3.12Å; V595-L598 PolarHBondContact O-N 3.31Å; L596-L598 PolarHBondContact O-N 3.18Å; L598-Y600 VanDerWaalsContact C-N 3.32Å; L598-Y600 PolarHBondContact O-N 3.32Å; L598-A601 PolarHBondContact O-N 3.32Å; L598-V602 WeakPolarHBondContact O-CG2 3.32Å; L598-V602 PolarHBondContact O-N 3.19Å
599	C	89.3	Confident	85.9	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.2	-41.8	174.9	-64.2	0	0	0	0	112	F414 F415 V595 L596 F597 V602 D603	F414-C599 HydrophobicContact CB-CB 4.28Å; F414-C599 HydrophobicContact CD1-CB 3.68Å; F414-C599 HydrophobicContact CD2-CB 3.79Å; F414-C599 HydrophobicContact CE1-CB 3.87Å; F414-C599 HydrophobicContact CE2-CB 3.93Å; F414-C599 HydrophobicContact CG-CB 3.64Å; F414-C599 HydrophobicContact CZ-CB 4Å; F415-C599 HydrophobicContact CE2-CB 3.94Å; F415-C599 HydrophobicContact CZ-CB 4.17Å; V595-C599 PolarHBondContact O-N 3.15Å; V595-C599 PolarHBondContact O-SG 3.2Å; L596-C599 CarbonylContact O-C 3.6Å; L596-C599 WeakPolarHBondContact O-CB 3.33Å; L596-C599 PolarHBondContact O-N 3.49Å; L596-C599 VanDerWaalsContact O-N 3.14Å; F597-C599 VanDerWaalsContact C-N 3.35Å; F597-C599 PolarHBondContact O-N 3.2Å; C599-V602 PolarHBondContact O-N 3.21Å; C599-D603 WeakPolarHBondContact O-CB 3.47Å; C599-D603 PolarHBondContact O-N 2.76Å
600	Y	84.8	Confident	85.6	Confident	11 Å²	11	29 Å²	29	4%	0.043	16%	0.159	C	C	.	.	H	α-helix	trans	-63.9	-42.6	174.6	-68.6	-55.7	0	0	0	112.5	L318 V321 F414 L596 F597 L598 V602 D603 K604 M617 L621	L318-Y600 HydrophobicContact CD1-CD2 4.05Å; L318-Y600 HydrophobicContact CD1-CE2 3.46Å; L318-Y600 VanDerWaalsContact CD1-CE2 3.46Å; V321-Y600 WeakPolarHBondContact CB-OH 3.46Å; V321-Y600 WeakPolarHBondContact CG1-OH 3.45Å; F414-Y600 HydrophobicContact CD2-CE1 4.38Å; F414-Y600 AromaticContact CE2-CD1 3.46Å; F414-Y600 HydrophobicContact CE2-CD1 3.46Å; F414-Y600 VanDerWaalsContact CE2-CD1 3.46Å; F414-Y600 AromaticContact CE2-CE1 3.19Å; F414-Y600 HydrophobicContact CE2-CE1 3.19Å; F414-Y600 HydrophobicContact CE2-CE2 4.37Å; F414-Y600 HydrophobicContact CE2-CG 4.14Å; F414-Y600 AromaticContact CE2-CZ 3.67Å; F414-Y600 AromaticContact CZ-CD1 3.45Å; F414-Y600 HydrophobicContact CZ-CD1 3.45Å; F414-Y600 VanDerWaalsContact CZ-CD1 3.45Å; F414-Y600 AromaticContact CZ-CE1 3.62Å; F414-Y600 HydrophobicContact CZ-CE1 3.62Å; F414-Y600 HydrophobicContact CZ-CG 4.23Å; L596-Y600 HydrophobicContact CB-CD2 4.37Å; L596-Y600 HydrophobicContact CB-CE2 3.83Å; L596-Y600 WeakPolarHBondContact O-CD2 3.18Å; L596-Y600 PolarHBondContact O-N 2.79Å; F597-Y600 PolarHBondContact O-N 2.81Å; L598-Y600 VanDerWaalsContact C-N 3.32Å; L598-Y600 PolarHBondContact O-N 3.32Å; Y600-V602 VanDerWaalsContact C-N 3.28Å; Y600-V602 PolarHBondContact O-N 3.36Å; Y600-D603 PolarHBondContact O-N 3.04Å; Y600-K604 WeakPolarHBondContact O-CB 3.45Å; Y600-K604 PolarHBondContact O-N 3.03Å; Y600-M617 HydrophobicContact CD1-CB 3.66Å; Y600-M617 HydrophobicContact CD1-CE 4.07Å; Y600-M617 HydrophobicContact CD1-SD 4.16Å; Y600-M617 HydrophobicContact CE1-CB 3.52Å; Y600-L621 HydrophobicContact CD1-CD2 3.77Å; Y600-L621 HydrophobicContact CD2-CD2 4.12Å; Y600-L621 HydrophobicContact CE1-CD2 3.13Å; Y600-L621 HydrophobicContact CE1-CG 4.49Å; Y600-L621 HydrophobicContact CE2-CD2 3.59Å; Y600-L621 HydrophobicContact CG-CD2 4.24Å; Y600-L621 WeakPolarHBondContact OH-CD2 3.25Å
601	A	83.5	Confident	85.1	Confident	21 Å²	21	32.8 Å²	32.8	17%	0.174	19%	0.191	C	C	.	.	H	α-helix	trans	-62	-39.9	178.2	0	0	0	0	0	111.1	L520 F597 L598 K605	L520-A601 HydrophobicContact CD1-CB 4.33Å; L520-A601 HydrophobicContact CD2-CB 3.66Å; L520-A601 HydrophobicContact CG-CB 3.92Å; F597-A601 PolarHBondContact O-N 3.07Å; L598-A601 PolarHBondContact O-N 3.32Å; A601-K605 PolarHBondContact O-N 3.06Å
602	V	86	Confident	84.6	Confident	0 Å²	0	35 Å²	35	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.3	-46.7	175.1	173.4	0	0	0	0	111.3	W13 F415 I505 L520 L598 C599 Y600 K604 K605 L606	W13-V602 HydrophobicContact CB-CG1 3.84Å; W13-V602 HydrophobicContact CD2-CB 4.37Å; W13-V602 HydrophobicContact CD2-CG1 3.78Å; W13-V602 HydrophobicContact CD2-CG2 3.65Å; W13-V602 HydrophobicContact CE3-CB 4.28Å; W13-V602 HydrophobicContact CE3-CG1 3.74Å; W13-V602 HydrophobicContact CE3-CG2 3.45Å; W13-V602 VanDerWaalsContact CE3-CG2 3.45Å; W13-V602 HydrophobicContact CG-CG1 3.85Å; W13-V602 HydrophobicContact CG-CG2 4.45Å; W13-V602 HydrophobicContact CH2-CG2 3.73Å; W13-V602 HydrophobicContact CZ2-CG2 3.89Å; W13-V602 HydrophobicContact CZ3-CG2 3.51Å; F415-V602 HydrophobicContact CZ-CB 4.33Å; F415-V602 HydrophobicContact CZ-CG1 4.11Å; I505-V602 HydrophobicContact CD1-CG2 4.2Å; L520-V602 HydrophobicContact CD2-CG2 3.6Å; L598-V602 WeakPolarHBondContact O-CG2 3.32Å; L598-V602 PolarHBondContact O-N 3.19Å; C599-V602 PolarHBondContact O-N 3.21Å; Y600-V602 VanDerWaalsContact C-N 3.28Å; Y600-V602 PolarHBondContact O-N 3.36Å; V602-K604 VanDerWaalsContact C-N 3.3Å; V602-K604 PolarHBondContact O-N 3.46Å; V602-K605 PolarHBondContact O-N 3.23Å; V602-L606 HydrophobicContact CG1-CD1 3.84Å; V602-L606 HydrophobicContact CG1-CG 4.28Å; V602-L606 PolarHBondContact O-N 3.16Å
603	D	86.4	Confident	84.2	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-58.4	-42.8	178.1	-169.5	29.8	0	0	0	111.5	F414 C599 Y600 K605 L606 N607 Y616 M617	F414-D603 HydrophobicContact CE1-CB 3.97Å; F414-D603 HydrophobicContact CZ-CB 4.23Å; C599-D603 WeakPolarHBondContact O-CB 3.47Å; C599-D603 PolarHBondContact O-N 2.76Å; Y600-D603 PolarHBondContact O-N 3.04Å; D603-K605 VanDerWaalsContact C-N 3.3Å; D603-K605 PolarHBondContact O-N 2.03Å; D603-L606 PolarHBondContact O-N 2.86Å; D603-N607 WeakPolarHBondContact O-CB 3.45Å; D603-N607 PolarHBondContact O-N 3.49Å; D603-N607 PolarHBondContact OD1-ND2 2.86Å; D603-Y616 WeakPolarHBondContact OD1-CD2 3.5Å; D603-Y616 PolarHBondContact OD1-N 3.16Å; D603-Y616 PolarHBondContact OD2-N 3.42Å; D603-M617 HydrophobicContact CB-CE 4.1Å; D603-M617 WeakPolarHBondContact OD2-CE 3.47Å; D603-M617 PolarHBondContact OD2-N 3.05Å
604	K	80.7	Confident	84	Confident	90 Å²	90	43.7 Å²	43.7	39%	0.391	26%	0.255	S	S	.	.	H	α-helix	trans	-62.4	-33.8	175.1	-171.6	-179	175.1	-170	0	113.3	Y600 V602 I625	Y600-K604 WeakPolarHBondContact O-CB 3.45Å; Y600-K604 PolarHBondContact O-N 3.03Å; V602-K604 VanDerWaalsContact C-N 3.3Å; V602-K604 PolarHBondContact O-N 3.46Å; K604-I625 HydrophobicContact CD-CG2 4.39Å
605	K	83.3	Confident	83.8	Confident	90 Å²	90	44.8 Å²	44.8	39%	0.391	26%	0.258	S	S	.	.	H	α-helix	trans	-78.3	-35.4	179.7	-173.8	162.8	-175.6	157.3	0	112	L520 E523 A601 V602 D603	L520-K605 HydrophobicContact CD1-CB 4.33Å; L520-K605 HydrophobicContact CD1-CD 3.72Å; E523-K605 IonicContact OE1-NZ 3.73Å; E523-K605 PolarHBondContact OE1-NZ 3.3Å; E523-K605 IonicContact OE2-NZ 3.69Å; E523-K605 PolarHBondContact OE2-NZ 3.49Å; A601-K605 PolarHBondContact O-N 3.06Å; V602-K605 PolarHBondContact O-N 3.23Å; D603-K605 VanDerWaalsContact C-N 3.3Å; D603-K605 PolarHBondContact O-N 2.03Å
606	L	83.4	Confident	83.5	Confident	40 Å²	40	48.5 Å²	48.5	21%	0.209	27%	0.273	C	S	.	.	H	α-helix	trans	-86.7	-36.4	-176.4	-73.1	-178.4	0	0	0	114.2	W13 P15 V602 D603	W13-L606 HydrophobicContact CB-CD1 3.68Å; W13-L606 HydrophobicContact CB-CD2 3.9Å; W13-L606 HydrophobicContact CB-CG 3.96Å; P15-L606 HydrophobicContact CG-CD1 3.91Å; V602-L606 HydrophobicContact CG1-CD1 3.84Å; V602-L606 HydrophobicContact CG1-CG 4.28Å; V602-L606 PolarHBondContact O-N 3.16Å; D603-L606 PolarHBondContact O-N 2.86Å
607	N	84.3	Confident	82.9	Confident	21 Å²	21	49.1 Å²	49.1	11%	0.112	28%	0.275	C	S	.	.			trans	-112	147.2	-172.3	-64.2	-54.8	0	0	0	110.7	D603 R613 Y615	D603-N607 WeakPolarHBondContact O-CB 3.45Å; D603-N607 PolarHBondContact O-N 3.49Å; D603-N607 PolarHBondContact OD1-ND2 2.86Å; N607-R613 WeakPolarHBondContact CB-O 3.37Å; N607-Y615 VanDerWaalsContact C-CE1 3.47Å; N607-Y615 HydrophobicContact CB-CD1 3.63Å; N607-Y615 HydrophobicContact CB-CE1 3.78Å; N607-Y615 HydrophobicContact CB-CG 4.37Å; N607-Y615 WeakPolarHBondContact O-CE1 3.26Å; N607-Y615 PolarHBondContact O-OH 2.9Å
608	D	81.8	Confident	82.3	Confident	102 Å²	102	50.4 Å²	50.4	55%	0.545	28%	0.284	S	S	.	.			trans	-115.5	-0.6	-179	62.9	-0.9	0	0	0	112.5	S610 R613 Y615	D608-S610 VanDerWaalsContact C-N 3.28Å; D608-S610 PolarHBondContact O-N 3.2Å; D608-S610 WeakPolarHBondContact OD1-CB 3.45Å; D608-S610 PolarHBondContact OD1-N 3.41Å; D608-S610 PolarHBondContact OD1-OG 2.75Å; D608-R613 PolarHBondContact N-O 3.43Å; D608-Y615 WeakPolarHBondContact CA-OH 3.36Å
609	G	76.4	Confident	81.4	Confident	41 Å²	41	58.5 Å²	58.5	42%	0.423	32%	0.319	S	S	.	.	S	Bend	trans	82	2.8	-178.3	0	0	0	0	0	113.9	R613	G609-R613 PolarHBondContact N-O 3.35Å; G609-R613 VanDerWaalsContact N-O 3.12Å
610	S	80.5	Confident	80.2	Confident	46 Å²	46	63.5 Å²	63.5	32%	0.322	34%	0.343	S	S	.	.	S	Bend	trans	-66.2	161.2	173.1	67.5	0	0	0	0	111.6	D608 G612 R613 P614	D608-S610 VanDerWaalsContact C-N 3.28Å; D608-S610 PolarHBondContact O-N 3.2Å; D608-S610 WeakPolarHBondContact OD1-CB 3.45Å; D608-S610 PolarHBondContact OD1-N 3.41Å; D608-S610 PolarHBondContact OD1-OG 2.75Å; S610-G612 PolarHBondContact O-N 3.12Å; S610-G612 VanDerWaalsContact O-N 3.15Å; S610-R613 CarbonylContact O-C 3.49Å; S610-R613 PolarHBondContact O-N 3Å; S610-R613 VanDerWaalsContact O-N 3.09Å; S610-R613 PolarHBondContact OG-N 2.88Å; S610-R613 VanDerWaalsContact OG-N 3.16Å; S610-P614 WeakPolarHBondContact O-CA 3.28Å; S610-P614 WeakPolarHBondContact O-CD 3.18Å
611	S	78.3	Confident	79.3	Confident	131 Å²	131	63.1 Å²	63.1	92%	0.916	34%	0.342	S	S	*	.	S	Bend	trans	-59.8	-24.3	175.7	28.8	0	0	0	0	113.3
612	G	77.1	Confident	78.5	Confident	67 Å²	67	64.1 Å²	64.1	69%	0.691	34%	0.343	S	S	*	.	S	Bend	trans	-83.9	-30	173.8	0	0	0	0	0	114.4	S610	S610-G612 PolarHBondContact O-N 3.12Å; S610-G612 VanDerWaalsContact O-N 3.15Å
613	R	81.3	Confident	77.6	Confident	156 Å²	156	70.6 Å²	70.6	59%	0.589	37%	0.373	S	S	*	.	S	Bend	trans	-133.8	64.9	179.8	-63.6	-176.6	-176.8	-172.3	1.6	111.5	N607 D608 G609 S610	N607-R613 WeakPolarHBondContact CB-O 3.37Å; D608-R613 PolarHBondContact N-O 3.43Å; G609-R613 PolarHBondContact N-O 3.35Å; G609-R613 VanDerWaalsContact N-O 3.12Å; S610-R613 CarbonylContact O-C 3.49Å; S610-R613 PolarHBondContact O-N 3Å; S610-R613 VanDerWaalsContact O-N 3.09Å; S610-R613 PolarHBondContact OG-N 2.88Å; S610-R613 VanDerWaalsContact OG-N 3.16Å
614	P	84.3	Confident	76.6	Confident	40 Å²	40	73.2 Å²	73.2	26%	0.26	39%	0.385	S	S	.	.			trans	-74.7	145.1	179.3	29.8	-32.2	0	0	0	109.9	R417 S610	R417-P614 PolarHBondContact NH2-O 3.48Å; S610-P614 WeakPolarHBondContact O-CA 3.28Å; S610-P614 WeakPolarHBondContact O-CD 3.18Å
615	Y	84.8	Confident	75.8	Confident	46 Å²	46	70 Å²	70	18%	0.18	37%	0.372	C	S	.	.			trans	-58.6	147.4	175.8	-70.6	-62.9	0	0	0	112.7	N607 D608 M617 M622	N607-Y615 VanDerWaalsContact C-CE1 3.47Å; N607-Y615 HydrophobicContact CB-CD1 3.63Å; N607-Y615 HydrophobicContact CB-CE1 3.78Å; N607-Y615 HydrophobicContact CB-CG 4.37Å; N607-Y615 WeakPolarHBondContact O-CE1 3.26Å; N607-Y615 PolarHBondContact O-OH 2.9Å; D608-Y615 WeakPolarHBondContact CA-OH 3.36Å; Y615-M617 HydrophobicContact CD1-CE 4.13Å; Y615-M622 HydrophobicContact CD2-CE 3.42Å; Y615-M622 VanDerWaalsContact CD2-CE 3.42Å; Y615-M622 HydrophobicContact CD2-CG 4.05Å; Y615-M622 HydrophobicContact CD2-SD 3.59Å; Y615-M622 VanDerWaalsContact CD2-SD 3.59Å; Y615-M622 HydrophobicContact CE2-CE 4.49Å; Y615-M622 HydrophobicContact CE2-CG 4.36Å; Y615-M622 HydrophobicContact CE2-SD 4.15Å; Y615-M622 HydrophobicContact CG-CE 3.83Å
616	Y	84.2	Confident	74.9	Confident	79 Å²	79	70.1 Å²	70.1	31%	0.31	37%	0.374	S	S	.	.	S	Bend	trans	-82.7	-24.8	170.7	-73.1	-96.9	0	0	0	112.1	F415 R417 D603	F415-Y616 HydrophobicContact CD1-CD1 4.43Å; F415-Y616 HydrophobicContact CD1-CD2 4.1Å; F415-Y616 HydrophobicContact CD1-CE2 4.39Å; F415-Y616 HydrophobicContact CD1-CG 4.13Å; F415-Y616 WeakPolarHBondContact O-CE1 3.21Å; R417-Y616 HydrophobicContact CG-CD1 3.77Å; R417-Y616 HydrophobicContact CG-CE1 3.41Å; R417-Y616 VanDerWaalsContact CG-CE1 3.41Å; D603-Y616 WeakPolarHBondContact OD1-CD2 3.5Å; D603-Y616 PolarHBondContact OD1-N 3.16Å; D603-Y616 PolarHBondContact OD2-N 3.42Å
617	M	78	Confident	73.9	Confident	12 Å²	12	75.2 Å²	75.2	6%	0.059	40%	0.395	C	S	.	.	S	Bend	trans	-68.4	148.4	179.1	72.4	-179.2	81.1	0	0	114.1	F414 Y600 D603 Y615 M622 I625	F414-M617 HydrophobicContact CZ-CB 4.33Å; Y600-M617 HydrophobicContact CD1-CB 3.66Å; Y600-M617 HydrophobicContact CD1-CE 4.07Å; Y600-M617 HydrophobicContact CD1-SD 4.16Å; Y600-M617 HydrophobicContact CE1-CB 3.52Å; D603-M617 HydrophobicContact CB-CE 4.1Å; D603-M617 WeakPolarHBondContact OD2-CE 3.47Å; D603-M617 PolarHBondContact OD2-N 3.05Å; Y615-M617 HydrophobicContact CD1-CE 4.13Å; M617-M622 HydrophobicContact CG-CB 4.14Å; M617-M622 HydrophobicContact CG-CE 4.46Å; M617-M622 HydrophobicContact SD-CB 4.12Å; M617-I625 HydrophobicContact SD-CD1 3.97Å
618	D	72.2	Confident	72.5	Confident	66 Å²	66	76 Å²	76	35%	0.353	40%	0.402	S	S	.	.			trans	-55.6	139.5	174.3	-89.6	-34.2	0	0	0	111.7	K324 E620 L621 M622	K324-D618 IonicContact NZ-OD1 3.82Å; K324-D618 IonicContact NZ-OD2 2.73Å; K324-D618 PolarHBondContact NZ-OD2 3.11Å; D618-E620 VanDerWaalsContact C-N 3.26Å; D618-E620 PolarHBondContact O-N 3.42Å; D618-L621 PolarHBondContact O-N 2.95Å; D618-M622 PolarHBondContact O-N 3.21Å; D618-M622 VanDerWaalsContact O-N 3.11Å
619	K	68.8	Low	71.2	Confident	169 Å²	169	72.3 Å²	72.3	74%	0.735	39%	0.388	S	S	*	.	H	α-helix	trans	-54.2	-39.6	-178.8	-67.8	-175.6	178.9	-178.5	0	113.3	L621 M622 E623	K619-L621 VanDerWaalsContact C-N 3.33Å; K619-L621 PolarHBondContact O-N 3.41Å; K619-M622 WeakPolarHBondContact O-CB 3.25Å; K619-M622 PolarHBondContact O-N 3.48Å; K619-E623 PolarHBondContact O-N 2.94Å; K619-E623 VanDerWaalsContact O-N 3.13Å
620	E	65.1	Low	70	Confident	105 Å²	105	77.1 Å²	77.1	49%	0.491	40%	0.397	S	S	.	.	H	α-helix	trans	-60.4	-41.8	178.9	-171.9	-177.1	-178.4	0	0	111.7	D618 H624	D618-E620 VanDerWaalsContact C-N 3.26Å; D618-E620 PolarHBondContact O-N 3.42Å; E620-H624 PolarHBondContact O-ND1 2.84Å
621	L	65.7	Low	68.3	Low	4 Å²	4	81.4 Å²	81.4	2%	0.021	41%	0.414	C	S	.	.	H	α-helix	trans	-75.2	-36.4	179.4	-178.2	68.4	0	0	0	111.9	L314 S317 V321 Y600 D618 K619 E623 H624 I625	L314-L621 HydrophobicContact CD1-CD1 3.95Å; S317-L621 VanDerWaalsContact CB-CD1 3.46Å; V321-L621 HydrophobicContact CG2-CD2 4.41Å; Y600-L621 HydrophobicContact CD1-CD2 3.77Å; Y600-L621 HydrophobicContact CD2-CD2 4.12Å; Y600-L621 HydrophobicContact CE1-CD2 3.13Å; Y600-L621 HydrophobicContact CE1-CG 4.49Å; Y600-L621 HydrophobicContact CE2-CD2 3.59Å; Y600-L621 HydrophobicContact CG-CD2 4.24Å; Y600-L621 WeakPolarHBondContact OH-CD2 3.25Å; D618-L621 PolarHBondContact O-N 2.95Å; K619-L621 VanDerWaalsContact C-N 3.33Å; K619-L621 PolarHBondContact O-N 3.41Å; L621-E623 PolarHBondContact O-N 2.71Å; L621-H624 PolarHBondContact O-N 3.41Å; L621-I625 HydrophobicContact CD1-CD1 4.23Å; L621-I625 HydrophobicContact CD1-CG1 4.37Å; L621-I625 HydrophobicContact CD2-CD1 4.28Å; L621-I625 HydrophobicContact CG-CD1 3.84Å; L621-I625 HydrophobicContact CG-CG1 4.34Å; L621-I625 WeakPolarHBondContact O-CG1 3.29Å; L621-I625 PolarHBondContact O-N 3.22Å
622	M	66.4	Low	66.6	Low	42 Å²	42	77.5 Å²	77.5	21%	0.207	40%	0.395	C	S	.	.	H	α-helix	trans	-55.7	-50.5	175.7	-174.8	-165.7	-54.7	0	0	111.7	Y615 M617 D618 K619 H624 I625 E626	Y615-M622 HydrophobicContact CD2-CE 3.42Å; Y615-M622 VanDerWaalsContact CD2-CE 3.42Å; Y615-M622 HydrophobicContact CD2-CG 4.05Å; Y615-M622 HydrophobicContact CD2-SD 3.59Å; Y615-M622 VanDerWaalsContact CD2-SD 3.59Å; Y615-M622 HydrophobicContact CE2-CE 4.49Å; Y615-M622 HydrophobicContact CE2-CG 4.36Å; Y615-M622 HydrophobicContact CE2-SD 4.15Å; Y615-M622 HydrophobicContact CG-CE 3.83Å; M617-M622 HydrophobicContact CG-CB 4.14Å; M617-M622 HydrophobicContact CG-CE 4.46Å; M617-M622 HydrophobicContact SD-CB 4.12Å; D618-M622 PolarHBondContact O-N 3.21Å; D618-M622 VanDerWaalsContact O-N 3.11Å; K619-M622 WeakPolarHBondContact O-CB 3.25Å; K619-M622 PolarHBondContact O-N 3.48Å; M622-H624 VanDerWaalsContact C-N 3.27Å; M622-H624 PolarHBondContact O-N 2.92Å; M622-I625 PolarHBondContact O-N 3.21Å; M622-E626 PolarHBondContact O-N 3.02Å
623	E	66.5	Low	65	Low	135 Å²	135	82.9 Å²	82.9	63%	0.631	40%	0.399	S	S	*	.	H	α-helix	trans	-59.1	-38	179.1	-73.1	-179.8	-178	0	0	112.2	K619 L621 K627	K619-E623 PolarHBondContact O-N 2.94Å; K619-E623 VanDerWaalsContact O-N 3.13Å; L621-E623 PolarHBondContact O-N 2.71Å; E623-K627 VanDerWaalsContact O-CB 3.29Å; E623-K627 WeakPolarHBondContact O-CB 3.43Å; E623-K627 PolarHBondContact O-N 3.45Å
624	H	66.1	Low	63	Low	55 Å²	55	85.7 Å²	85.7	26%	0.255	41%	0.411	S	S	.	.	H	α-helix	trans	-72.4	-40	178.4	-74	86.3	0	0	0	112.7	S313 L314 E620 L621 M622 K627 S628	S313-H624 PolarHBondContact OG-CD2 2.77Å; L314-H624 HydrophobicContact CD1-CB 4.45Å; E620-H624 PolarHBondContact O-ND1 2.84Å; L621-H624 PolarHBondContact O-N 3.41Å; M622-H624 VanDerWaalsContact C-N 3.27Å; M622-H624 PolarHBondContact O-N 2.92Å; H624-K627 PolarHBondContact O-N 3.48Å; H624-S628 WeakPolarHBondContact O-CB 3.28Å; H624-S628 PolarHBondContact O-N 2.85Å; H624-S628 PolarHBondContact O-OG 2.89Å
625	I	63.5	Low	60.6	Low	24 Å²	24	91.8 Å²	91.8	12%	0.123	43%	0.433	C	S	.	.	H	α-helix	trans	-64.6	-45	176.3	-70.7	173.9	0	0	0	110.1	L314 K604 M617 L621 M622 K627 S628 G629	L314-I625 HydrophobicContact CD1-CG1 3.65Å; K604-I625 HydrophobicContact CD-CG2 4.39Å; M617-I625 HydrophobicContact SD-CD1 3.97Å; L621-I625 HydrophobicContact CD1-CD1 4.23Å; L621-I625 HydrophobicContact CD1-CG1 4.37Å; L621-I625 HydrophobicContact CD2-CD1 4.28Å; L621-I625 HydrophobicContact CG-CD1 3.84Å; L621-I625 HydrophobicContact CG-CG1 4.34Å; L621-I625 WeakPolarHBondContact O-CG1 3.29Å; L621-I625 PolarHBondContact O-N 3.22Å; M622-I625 PolarHBondContact O-N 3.21Å; I625-K627 PolarHBondContact O-N 3.34Å; I625-S628 PolarHBondContact O-N 3.27Å; I625-S628 PolarHBondContact O-OG 3.32Å; I625-G629 PolarHBondContact O-N 2.92Å
626	E	64.8	Low	57.9	Low	92 Å²	92	94.1 Å²	94.1	43%	0.43	46%	0.456	S	S	.	.	H	α-helix	trans	-61.3	-43.9	175.9	-75.8	-165.5	179.3	0	0	112.6	M622 S628 G629 K630	M622-E626 PolarHBondContact O-N 3.02Å; E626-S628 VanDerWaalsContact C-N 3.33Å; E626-S628 PolarHBondContact O-N 2.65Å; E626-G629 PolarHBondContact O-N 3.01Å; E626-K630 WeakPolarHBondContact O-CG 3.45Å; E626-K630 PolarHBondContact O-N 3.34Å; E626-K630 IonicContact OE2-NZ 3.6Å
627	K	61.5	Low	55.6	Low	147 Å²	147	96.1 Å²	96.1	64%	0.639	48%	0.479	S	S	*	.	H	α-helix	trans	-62.4	-40.2	177.1	-170.3	174.8	-177.5	175.5	0	111.8	E623 H624 I625 M631	E623-K627 VanDerWaalsContact O-CB 3.29Å; E623-K627 WeakPolarHBondContact O-CB 3.43Å; E623-K627 PolarHBondContact O-N 3.45Å; H624-K627 PolarHBondContact O-N 3.48Å; I625-K627 PolarHBondContact O-N 3.34Å; K627-M631 PolarHBondContact O-N 2.78Å
628	S	55.2	Low	53.4	Low	37 Å²	37	104.7 Å²	104.7	26%	0.259	52%	0.519	S	S	.	.	H	α-helix	trans	-67.4	-38.4	176	75.2	0	0	0	0	112.7	Q527 H624 I625 E626 M631 G632	Q527-S628 PolarHBondContact NE2-OG 3.1Å; H624-S628 WeakPolarHBondContact O-CB 3.28Å; H624-S628 PolarHBondContact O-N 2.85Å; H624-S628 PolarHBondContact O-OG 2.89Å; I625-S628 PolarHBondContact O-N 3.27Å; I625-S628 PolarHBondContact O-OG 3.32Å; E626-S628 VanDerWaalsContact C-N 3.33Å; E626-S628 PolarHBondContact O-N 2.65Å; S628-M631 PolarHBondContact O-N 3.32Å; S628-G632 PolarHBondContact O-N 3.21Å
629	G	54.1	Low	51.6	Low	25 Å²	25	105.1 Å²	105.1	26%	0.258	54%	0.539	S	S	.	.	H	α-helix	trans	-68.8	-37.9	177.3	0	0	0	0	0	113.3	I625 E626 G632 K633	I625-G629 PolarHBondContact O-N 2.92Å; E626-G629 PolarHBondContact O-N 3.01Å; G629-G632 PolarHBondContact O-N 2.72Å; G629-K633 PolarHBondContact O-N 2.93Å
630	K	51.6	Low	49.9	Very low	142 Å²	142	101.5 Å²	101.5	62%	0.617	54%	0.54	S	S	*	.	H	α-helix	trans	-66	-37.4	174.7	-73.4	172.4	-179.5	167	0	112	E626 G632 K633 Y634	E626-K630 WeakPolarHBondContact O-CG 3.45Å; E626-K630 PolarHBondContact O-N 3.34Å; E626-K630 IonicContact OE2-NZ 3.6Å; K630-G632 VanDerWaalsContact C-N 3.3Å; K630-G632 PolarHBondContact O-N 3.17Å; K630-K633 PolarHBondContact O-N 3.16Å; K630-Y634 PolarHBondContact O-N 3.17Å
631	M	44.5	Very low	48.4	Very low	135 Å²	135	100.2 Å²	100.2	67%	0.665	56%	0.555	S	S	*	*	H	α-helix	trans	-68.4	-27.9	177.1	-149.4	91.5	86.8	0	0	113.1	K627 S628	K627-M631 PolarHBondContact O-N 2.78Å; S628-M631 PolarHBondContact O-N 3.32Å
632	G	42.9	Very low	46.9	Very low	50 Å²	50	108.6 Å²	108.6	52%	0.515	59%	0.594	S	S	.	*	H	α-helix	trans	-76.2	-39.1	174.4	0	0	0	0	0	113.4	S628 G629 K630 K635	S628-G632 PolarHBondContact O-N 3.21Å; G629-G632 PolarHBondContact O-N 2.72Å; K630-G632 VanDerWaalsContact C-N 3.3Å; K630-G632 PolarHBondContact O-N 3.17Å; G632-K635 PolarHBondContact O-N 3.16Å
633	K	42.8	Very low	45.3	Very low	179 Å²	179	115.3 Å²	115.3	78%	0.778	63%	0.625	S	S	*	*	H	α-helix	trans	-68	-33	177.7	-80.5	-173.1	174.5	-176	0	113.5	G629 K630 K635 S636	G629-K633 PolarHBondContact O-N 2.93Å; K630-K633 PolarHBondContact O-N 3.16Å; K633-K635 PolarHBondContact O-N 2.71Å; K633-K635 VanDerWaalsContact O-N 3.1Å; K633-S636 PolarHBondContact O-N 3.13Å
634	Y	40.2	Very low	43.7	Very low	215 Å²	215	117.7 Å²	117.7	84%	0.843	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-5.5	177.2	-149.8	-95.6	0	0	0	113.8	K630	K630-Y634 PolarHBondContact O-N 3.17Å
635	K	34.4	Very low	42.1	Very low	168 Å²	168	123.9 Å²	123.9	73%	0.73	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	0.4	179	-88.2	-170.3	170.1	-163.2	0	115.1	G632 K633 P637	G632-K635 PolarHBondContact O-N 3.16Å; K633-K635 PolarHBondContact O-N 2.71Å; K633-K635 VanDerWaalsContact O-N 3.1Å; K635-P637 WeakPolarHBondContact O-CD 3.48Å
636	S	27.6	Very low	40.6	Very low	95 Å²	95	128.6 Å²	128.6	66%	0.664	70%	0.697	S	S	*	*	S	Bend	trans	-83	115.5	159.9	-98.8	0	0	0	0	107.4	K633 E638	K633-S636 PolarHBondContact O-N 3.13Å; S636-E638 PolarHBondContact O-N 3.14Å
637	P	34.7	Very low	39.1	Very low	121 Å²	121	133.3 Å²	133.3	79%	0.786	72%	0.721	S	S	*	*			trans	-64.3	121.7	168.2	7.1	4.9	0	0	0	106.8	K635 G639	K635-P637 WeakPolarHBondContact O-CD 3.48Å; P637-G639 VanDerWaalsContact C-N 3.34Å; P637-G639 PolarHBondContact O-N 3.23Å
638	E	33.9	Very low	37.9	Very low	193 Å²	193	138.2 Å²	138.2	90%	0.902	74%	0.736	S	S	*	*			trans	-49.8	105.4	155.8	-71.1	175.2	152.3	0	0	106.9	S636 A640	S636-E638 PolarHBondContact O-N 3.14Å; E638-A640 PolarHBondContact O-N 2.84Å; E638-A640 VanDerWaalsContact O-N 3.11Å
639	G	34	Very low	36.8	Very low	74 Å²	74	140.1 Å²	140.1	76%	0.763	76%	0.761	S	S	*	*			trans	-59.2	115	165.2	0	0	0	0	0	106.7	P637 G641	P637-G639 VanDerWaalsContact C-N 3.34Å; P637-G639 PolarHBondContact O-N 3.23Å; G639-G641 PolarHBondContact O-N 3.32Å; G639-G641 VanDerWaalsContact O-N 3.12Å
640	A	32.3	Very low	35.8	Very low	93 Å²	93	142.6 Å²	142.6	77%	0.769	79%	0.787	S	S	*	*			trans	-43.8	117.5	177.3	0	0	0	0	0	110.8	E638 Q642	E638-A640 PolarHBondContact O-N 2.84Å; E638-A640 VanDerWaalsContact O-N 3.11Å; A640-Q642 VanDerWaalsContact C-N 3.33Å; A640-Q642 PolarHBondContact O-N 3.38Å
641	G	33.7	Very low	34.9	Very low	78 Å²	78	139 Å²	139	80%	0.804	79%	0.79	S	S	*	*			trans	-63.8	97.9	159	0	0	0	0	0	108.4	G639	G639-G641 PolarHBondContact O-N 3.32Å; G639-G641 VanDerWaalsContact O-N 3.12Å
642	Q	34	Very low	34.5	Very low	181 Å²	181	139.2 Å²	139.2	85%	0.846	80%	0.799	S	S	*	*			trans	-92	96.7	151.2	-94.7	-174.4	-16.2	0	0	107.2	A640 M644	A640-Q642 VanDerWaalsContact C-N 3.33Å; A640-Q642 PolarHBondContact O-N 3.38Å; Q642-M644 PolarHBondContact O-N 2.91Å; Q642-M644 VanDerWaalsContact O-N 3.14Å
643	E	32.2	Very low	34.1	Very low	182 Å²	182	142.6 Å²	142.6	85%	0.85	82%	0.815	S	S	*	*			trans	-51.8	112.3	156.9	-68.6	-177.9	125.4	0	0	108.7	K645	E643-K645 PolarHBondContact O-N 2.92Å; E643-K645 VanDerWaalsContact O-N 3.13Å
644	M	32.8	Very low	33.6	Very low	186 Å²	186	142.7 Å²	142.7	92%	0.916	85%	0.849	S	S	*	*			trans	-72	102.7	162.2	-77	-176.7	-179.9	0	0	107.9	Q642	Q642-M644 PolarHBondContact O-N 2.91Å; Q642-M644 VanDerWaalsContact O-N 3.14Å
645	K	32.8	Very low	33.2	Very low	185 Å²	185	139.1 Å²	139.1	80%	0.804	85%	0.849	S	S	*	*			trans	-56.5	134.8	166.2	-82.5	178.4	174.3	175.4	0	110	E643 M647	E643-K645 PolarHBondContact O-N 2.92Å; E643-K645 VanDerWaalsContact O-N 3.13Å; K645-M647 PolarHBondContact O-N 3.22Å
646	P	32.3	Very low	33.2	Very low	122 Å²	122	137.5 Å²	137.5	79%	0.792	86%	0.855	S	S	*	*			trans	-72	127.5	165.9	3.7	10.4	0	0	0	109.3	R648	P646-R648 PolarHBondContact O-N 3.41Å
647	M	33.6	Very low	33.5	Very low	192 Å²	192	139.9 Å²	139.9	95%	0.946	87%	0.866	S	S	*	*			trans	-63.6	114.5	166	-77	-168	-160	0	0	109.2	K645 G649	K645-M647 PolarHBondContact O-N 3.22Å; M647-G649 PolarHBondContact O-N 3.43Å
648	R	35.4	Very low	33.4	Very low	250 Å²	250	141 Å²	141	94%	0.943	87%	0.871	S	S	*	*			trans	-70	112.7	157	-98.1	-179.4	176.4	-170.9	-1.2	107.8	P646 G650	P646-R648 PolarHBondContact O-N 3.41Å; R648-G650 PolarHBondContact O-N 3.21Å
649	G	33.9	Very low	33.4	Very low	77 Å²	77	137.8 Å²	137.8	79%	0.794	87%	0.869	S	S	*	*	P	Polyproline II helix	trans	-68.2	118.8	158.7	0	0	0	0	0	109.2	M647	M647-G649 PolarHBondContact O-N 3.43Å
650	G	31.8	Very low	33.3	Very low	77 Å²	77	142 Å²	142	79%	0.794	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-83.9	119.7	162.2	0	0	0	0	0	109.4	R648	R648-G650 PolarHBondContact O-N 3.21Å
651	G	33.7	Very low	33.4	Very low	67 Å²	67	145.5 Å²	145.5	69%	0.691	88%	0.884	S	S	*	*	P	Polyproline II helix	trans	-72.6	155.5	143.9	0	0	0	0	0	107.9
652	T	35.8	Very low	33.4	Very low	138 Å²	138	150.7 Å²	150.7	85%	0.847	89%	0.89	S	S	*	*			cis	-171.1	158	27.3	27.2	0	0	0	0	107.2
653	S	33.8	Very low	33.3	Very low	121 Å²	121	148.2 Å²	148.2	85%	0.846	89%	0.893	S	S	*	*			trans	145.1	95.5	139.2	-72.1	0	0	0	0	112.9
654	A	31.7	Very low	33.4	Very low	181 Å²	181	145.1 Å²	145.1	100%	1.496	90%	0.897	S	S	*	*				170.5	0	129.4	0	0	0	0	0	108.8

Retrieved 654 of 654 residues in 755.7 ms (Link to these results)

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