A0A087Y2C7_POEFO Loading...

Transmembrane protein 209

AlphaFold DB , UniProt , Accession A0A087Y2C7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 558 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	37.1	Very low	42.6	Very low	240 Å²	240	140.8 Å²	140.8	100%	1.182	79%	0.79	S	S	*	*				0	105.4	0	-167.9	172.8	-170.9	0	0	107
2	L	31.8	Very low	44.2	Very low	173 Å²	173	140.5 Å²	140.5	91%	0.906	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-83.5	138.2	-177.7	-86.5	70.6	0	0	0	110.3
3	T	33.9	Very low	46.3	Very low	132 Å²	132	138.2 Å²	138.2	81%	0.81	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-82.2	129.9	163.4	48.4	0	0	0	0	109.6
4	P	36.3	Very low	48.2	Very low	113 Å²	113	133.7 Å²	133.7	73%	0.734	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-70.8	150.5	177	29.9	-34.9	0	0	0	111.7
5	P	34	Very low	49.8	Very low	117 Å²	117	131.8 Å²	131.8	76%	0.76	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-68.8	141.1	173.6	29.8	-34.2	0	0	0	111.1	E7	P5-E7 PolarHBondContact O-N 3.03Å
6	K	40.3	Very low	51.1	Low	208 Å²	208	125.7 Å²	125.7	90%	0.904	69%	0.692	S	S	*	*			trans	-83.5	96.2	171.1	-85	-174	172.2	179.7	0	110.6
7	E	40.1	Very low	52.4	Low	181 Å²	181	124.4 Å²	124.4	85%	0.846	68%	0.683	S	S	*	*			trans	-70.3	166.3	162.5	-63	-172.5	122.7	0	0	111.8	P5 M9	P5-E7 PolarHBondContact O-N 3.03Å; E7-M9 PolarHBondContact O-N 3.19Å
8	G	49.7	Very low	53.8	Low	77 Å²	77	126.7 Å²	126.7	79%	0.794	68%	0.68	S	S	*	*			trans	87.8	-2.4	151	0	0	0	0	0	119.3	P10	G8-P10 WeakPolarHBondContact O-CD 3.22Å
9	M	44.8	Very low	54.6	Low	176 Å²	176	123.1 Å²	123.1	87%	0.867	66%	0.659	S	S	*	*			trans	-91.1	103.8	171.2	-74.6	-72.8	-102	0	0	110.7	E7	E7-M9 PolarHBondContact O-N 3.19Å
10	P	52.1	Low	55.7	Low	79 Å²	79	125.4 Å²	125.4	51%	0.513	66%	0.658	S	S	.	*			trans	-63	144.6	172.4	28.1	-34.8	0	0	0	109.8	G8	G8-P10 WeakPolarHBondContact O-CD 3.22Å
11	S	68.3	Low	56.7	Low	53 Å²	53	128.5 Å²	128.5	37%	0.371	66%	0.661	S	S	.	*			trans	-58.8	145.1	-179.4	-177.1	0	0	0	0	110.2	I13 D14 K15	S11-I13 PolarHBondContact O-N 3.13Å; S11-I13 VanDerWaalsContact O-N 3.12Å; S11-I13 PolarHBondContact OG-N 2.99Å; S11-D14 WeakPolarHBondContact CB-OD2 3.32Å; S11-D14 PolarHBondContact N-OD2 3.27Å; S11-D14 VanDerWaalsContact N-OD2 3.09Å; S11-D14 WeakPolarHBondContact O-CB 3.28Å; S11-D14 PolarHBondContact O-N 3.36Å; S11-K15 PolarHBondContact O-N 3.43Å
12	M	62.2	Low	58.7	Low	137 Å²	137	121.3 Å²	121.3	68%	0.675	63%	0.625	S	S	*	*	H	α-helix	trans	-58.4	-25.7	171.4	-64.8	-165.4	-63.1	0	0	111.4	A16	M12-A16 WeakPolarHBondContact O-CB 3.33Å; M12-A16 PolarHBondContact O-N 3.21Å
13	I	71.9	Confident	60.9	Low	110 Å²	110	117.3 Å²	117.3	56%	0.564	60%	0.601	S	S	*	*	H	α-helix	trans	-67	-47.4	171.8	-56	174.4	0	0	0	110.7	S11 K15 A16 L17	S11-I13 PolarHBondContact O-N 3.13Å; S11-I13 VanDerWaalsContact O-N 3.12Å; S11-I13 PolarHBondContact OG-N 2.99Å; I13-K15 VanDerWaalsContact C-N 3.28Å; I13-K15 PolarHBondContact O-N 3.49Å; I13-A16 PolarHBondContact O-N 2.91Å; I13-L17 HydrophobicContact CG2-CD1 4.05Å; I13-L17 HydrophobicContact CG2-CG 4.46Å; I13-L17 WeakPolarHBondContact O-CB 3.45Å; I13-L17 VanDerWaalsContact O-CG 3.32Å; I13-L17 WeakPolarHBondContact O-CG 3.38Å; I13-L17 PolarHBondContact O-N 3.34Å
14	D	72.6	Confident	62.9	Low	76 Å²	76	116.5 Å²	116.5	41%	0.406	59%	0.588	S	S	.	*	H	α-helix	trans	-61.7	-39.5	176.3	-57.7	-42	0	0	0	111.3	S11 L17 R18	S11-D14 WeakPolarHBondContact CB-OD2 3.32Å; S11-D14 PolarHBondContact N-OD2 3.27Å; S11-D14 VanDerWaalsContact N-OD2 3.09Å; S11-D14 WeakPolarHBondContact O-CB 3.28Å; S11-D14 PolarHBondContact O-N 3.36Å; D14-L17 PolarHBondContact O-N 2.97Å; D14-R18 VanDerWaalsContact O-CG 3.32Å; D14-R18 WeakPolarHBondContact O-CG 3.47Å; D14-R18 PolarHBondContact O-N 2.98Å
15	K	71.4	Confident	65	Low	105 Å²	105	113.4 Å²	113.4	46%	0.457	57%	0.572	S	S	.	*	H	α-helix	trans	-65	-42.7	177.1	-156.6	176.6	-173.9	-169.5	0	111.2	S11 I13 R18 M19 I95	S11-K15 PolarHBondContact O-N 3.43Å; I13-K15 VanDerWaalsContact C-N 3.28Å; I13-K15 PolarHBondContact O-N 3.49Å; K15-R18 PolarHBondContact O-N 2.91Å; K15-M19 WeakPolarHBondContact O-CG 3.47Å; K15-M19 PolarHBondContact O-N 2.92Å; K15-M19 VanDerWaalsContact O-N 3.13Å; K15-I95 HydrophobicContact CD-CD1 3.82Å; K15-I95 VanDerWaalsContact CE-CD1 3.46Å; K15-I95 HydrophobicContact CG-CD1 4.25Å
16	A	70.7	Confident	67.2	Low	34 Å²	34	110.6 Å²	110.6	28%	0.281	55%	0.546	S	S	.	.	H	α-helix	trans	-65.1	-41.7	174.2	0	0	0	0	0	112.8	M12 I13 R18 M19 R20	M12-A16 WeakPolarHBondContact O-CB 3.33Å; M12-A16 PolarHBondContact O-N 3.21Å; I13-A16 PolarHBondContact O-N 2.91Å; A16-R18 PolarHBondContact O-N 2.99Å; A16-M19 PolarHBondContact O-N 3.29Å; A16-R20 PolarHBondContact O-N 2.98Å
17	L	74.3	Confident	69.1	Low	103 Å²	103	106.9 Å²	106.9	54%	0.539	53%	0.532	S	S	.	.	H	α-helix	trans	-65.2	-36.9	177	-72.6	171.6	0	0	0	112.4	I13 D14 R21	I13-L17 HydrophobicContact CG2-CD1 4.05Å; I13-L17 HydrophobicContact CG2-CG 4.46Å; I13-L17 WeakPolarHBondContact O-CB 3.45Å; I13-L17 VanDerWaalsContact O-CG 3.32Å; I13-L17 WeakPolarHBondContact O-CG 3.38Å; I13-L17 PolarHBondContact O-N 3.34Å; D14-L17 PolarHBondContact O-N 2.97Å; L17-R21 PolarHBondContact O-N 3.24Å; L17-R21 VanDerWaalsContact O-N 3.11Å
18	R	76.4	Confident	71.3	Confident	166 Å²	166	103 Å²	103	63%	0.626	52%	0.516	S	S	*	.	H	α-helix	trans	-63.2	-49.8	172.6	-73.5	175.9	-171.3	-151.3	3	111.4	D14 K15 A16 R20 R21 E22	D14-R18 VanDerWaalsContact O-CG 3.32Å; D14-R18 WeakPolarHBondContact O-CG 3.47Å; D14-R18 PolarHBondContact O-N 2.98Å; K15-R18 PolarHBondContact O-N 2.91Å; A16-R18 PolarHBondContact O-N 2.99Å; R18-R20 PolarHBondContact O-N 3.45Å; R18-R21 WeakPolarHBondContact O-CB 3.43Å; R18-R21 PolarHBondContact O-N 3.42Å; R18-R21 VanDerWaalsContact O-N 3.09Å; R18-E22 WeakPolarHBondContact O-CG 3.31Å; R18-E22 PolarHBondContact O-N 2.83Å
19	M	70.1	Confident	73	Confident	58 Å²	58	100 Å²	100	29%	0.286	48%	0.483	S	S	.	.	H	α-helix	trans	-58.1	-44.7	177.7	-69.8	-176.1	-64.2	0	0	112.3	K15 A16 R21 E22 E23 I95	K15-M19 WeakPolarHBondContact O-CG 3.47Å; K15-M19 PolarHBondContact O-N 2.92Å; K15-M19 VanDerWaalsContact O-N 3.13Å; A16-M19 PolarHBondContact O-N 3.29Å; M19-R21 VanDerWaalsContact C-N 3.31Å; M19-R21 PolarHBondContact O-N 3.32Å; M19-E22 CarbonylContact O-C 3.45Å; M19-E22 WeakPolarHBondContact O-CB 3.43Å; M19-E22 PolarHBondContact O-N 2.96Å; M19-E22 VanDerWaalsContact O-N 3.1Å; M19-E23 WeakPolarHBondContact O-CG 3.29Å; M19-E23 PolarHBondContact O-N 3.48Å; M19-I95 HydrophobicContact CE-CD1 3.68Å; M19-I95 HydrophobicContact SD-CD1 3.54Å; M19-I95 VanDerWaalsContact SD-CD1 3.54Å
20	R	75.3	Confident	75	Confident	169 Å²	169	93.8 Å²	93.8	64%	0.638	45%	0.452	S	S	*	.	H	α-helix	trans	-61.9	-36.4	176.4	-170.4	176.7	-178.4	-176.2	1	112.8	A16 R18 E23 Q24	A16-R20 PolarHBondContact O-N 2.98Å; R18-R20 PolarHBondContact O-N 3.45Å; R20-E23 PolarHBondContact O-N 3.08Å; R20-Q24 WeakPolarHBondContact O-CG 3.35Å; R20-Q24 PolarHBondContact O-N 2.76Å; R20-Q24 VanDerWaalsContact O-N 3.1Å
21	R	77.3	Confident	76.8	Confident	192 Å²	192	93 Å²	93	73%	0.725	45%	0.452	S	S	*	.	H	α-helix	trans	-68.3	-37.3	174.1	-174.7	179.7	-71.3	176.9	-3.5	111.7	L17 R18 M19 Q24 A25	L17-R21 PolarHBondContact O-N 3.24Å; L17-R21 VanDerWaalsContact O-N 3.11Å; R18-R21 WeakPolarHBondContact O-CB 3.43Å; R18-R21 PolarHBondContact O-N 3.42Å; R18-R21 VanDerWaalsContact O-N 3.09Å; M19-R21 VanDerWaalsContact C-N 3.31Å; M19-R21 PolarHBondContact O-N 3.32Å; R21-Q24 PolarHBondContact O-N 2.8Å; R21-A25 WeakPolarHBondContact O-CB 3.38Å; R21-A25 PolarHBondContact O-N 3.1Å
22	E	79.3	Confident	77.7	Confident	89 Å²	89	97.1 Å²	97.1	42%	0.416	46%	0.46	S	S	.	.	H	α-helix	trans	-69.7	-32.5	175	-69	163.9	-154.9	0	0	112.9	R18 M19 R26	R18-E22 WeakPolarHBondContact O-CG 3.31Å; R18-E22 PolarHBondContact O-N 2.83Å; M19-E22 CarbonylContact O-C 3.45Å; M19-E22 WeakPolarHBondContact O-CB 3.43Å; M19-E22 PolarHBondContact O-N 2.96Å; M19-E22 VanDerWaalsContact O-N 3.1Å; E22-R26 WeakPolarHBondContact O-CB 3.46Å; E22-R26 WeakPolarHBondContact O-CG 3.3Å; E22-R26 PolarHBondContact O-N 3.31Å; E22-R26 PolarHBondContact O-NE 3.24Å; E22-R26 VanDerWaalsContact O-NE 3.17Å; E22-R26 IonicContact OE2-NH2 3.89Å
23	E	77	Confident	79	Confident	88 Å²	88	90.6 Å²	90.6	41%	0.411	43%	0.428	S	S	.	.	H	α-helix	trans	-66.7	-45.6	170.9	-71.9	173.2	159.6	0	0	111.4	M19 R20 A25 R26 Q27	M19-E23 WeakPolarHBondContact O-CG 3.29Å; M19-E23 PolarHBondContact O-N 3.48Å; R20-E23 PolarHBondContact O-N 3.08Å; E23-A25 VanDerWaalsContact C-N 3.33Å; E23-A25 PolarHBondContact O-N 2.89Å; E23-R26 WeakPolarHBondContact O-CB 3.43Å; E23-R26 PolarHBondContact O-N 3.15Å; E23-Q27 WeakPolarHBondContact O-CG 3.42Å; E23-Q27 PolarHBondContact O-N 3.26Å
24	Q	77	Confident	79.9	Confident	116 Å²	116	89.1 Å²	89.1	54%	0.542	42%	0.424	S	S	.	.	H	α-helix	trans	-61.4	-41.1	173.9	-72	-178.5	-49.6	0	0	111.8	R20 R21 R26 Q27 I28	R20-Q24 WeakPolarHBondContact O-CG 3.35Å; R20-Q24 PolarHBondContact O-N 2.76Å; R20-Q24 VanDerWaalsContact O-N 3.1Å; R21-Q24 PolarHBondContact O-N 2.8Å; Q24-R26 PolarHBondContact O-N 2.92Å; Q24-Q27 PolarHBondContact O-N 3.3Å; Q24-I28 WeakPolarHBondContact O-CG1 3.12Å; Q24-I28 PolarHBondContact O-N 3.01Å
25	A	79.6	Confident	80.9	Confident	48 Å²	48	89.3 Å²	89.3	40%	0.397	42%	0.424	S	S	.	.	H	α-helix	trans	-63.1	-39.3	174.7	0	0	0	0	0	112.5	R21 E23 I28 V29	R21-A25 WeakPolarHBondContact O-CB 3.38Å; R21-A25 PolarHBondContact O-N 3.1Å; E23-A25 VanDerWaalsContact C-N 3.33Å; E23-A25 PolarHBondContact O-N 2.89Å; A25-I28 PolarHBondContact O-N 2.96Å; A25-V29 WeakPolarHBondContact O-CG2 3.4Å; A25-V29 PolarHBondContact O-N 3Å
26	R	80	Confident	81.8	Confident	58 Å²	58	85 Å²	85	22%	0.219	41%	0.406	C	S	.	.	H	α-helix	trans	-61.3	-44.1	174.5	-82.6	174.9	-99.7	-161	0.1	112.2	E22 E23 Q24 V29 L30 Y88	E22-R26 WeakPolarHBondContact O-CB 3.46Å; E22-R26 WeakPolarHBondContact O-CG 3.3Å; E22-R26 PolarHBondContact O-N 3.31Å; E22-R26 PolarHBondContact O-NE 3.24Å; E22-R26 VanDerWaalsContact O-NE 3.17Å; E22-R26 IonicContact OE2-NH2 3.89Å; E23-R26 WeakPolarHBondContact O-CB 3.43Å; E23-R26 PolarHBondContact O-N 3.15Å; Q24-R26 PolarHBondContact O-N 2.92Å; R26-V29 PolarHBondContact O-N 3.33Å; R26-L30 WeakPolarHBondContact O-CB 3.42Å; R26-L30 PolarHBondContact O-N 3.49Å; R26-Y88 HydrophobicContact CG-CG 4.5Å; R26-Y88 PolarHBondContact NH1-O 3.34Å
27	Q	80.9	Confident	82.9	Confident	129 Å²	129	87 Å²	87	60%	0.603	42%	0.415	S	S	*	.	H	α-helix	trans	-62.5	-41.5	175.7	-68.3	-67.4	-15.2	0	0	112.2	E23 Q24 L30 A31	E23-Q27 WeakPolarHBondContact O-CG 3.42Å; E23-Q27 PolarHBondContact O-N 3.26Å; Q24-Q27 PolarHBondContact O-N 3.3Å; Q27-L30 PolarHBondContact O-N 3.46Å; Q27-A31 PolarHBondContact O-N 3.35Å
28	I	85.5	Confident	83.7	Confident	99 Å²	99	85.4 Å²	85.4	51%	0.508	41%	0.413	S	S	.	.	H	α-helix	trans	-65.1	-45.1	177.5	-68.2	164	0	0	0	111.2	Q24 A25 L30 A31 W32	Q24-I28 WeakPolarHBondContact O-CG1 3.12Å; Q24-I28 PolarHBondContact O-N 3.01Å; A25-I28 PolarHBondContact O-N 2.96Å; I28-L30 VanDerWaalsContact C-N 3.32Å; I28-L30 PolarHBondContact O-N 3.23Å; I28-A31 PolarHBondContact O-N 3.43Å; I28-W32 PolarHBondContact O-N 3.34Å
29	V	87.3	Confident	84.4	Confident	15 Å²	15	80 Å²	80	9%	0.091	40%	0.396	C	S	.	.	H	α-helix	trans	-62.8	-39	176.8	172.7	0	0	0	0	111.5	A25 R26 W32 A33 D81 K84	A25-V29 WeakPolarHBondContact O-CG2 3.4Å; A25-V29 PolarHBondContact O-N 3Å; R26-V29 PolarHBondContact O-N 3.33Å; V29-W32 PolarHBondContact O-N 3.43Å; V29-A33 PolarHBondContact O-N 2.99Å; V29-D81 HydrophobicContact CG1-CB 4.13Å; V29-D81 WeakPolarHBondContact CG1-O 3.44Å; V29-K84 HydrophobicContact CG1-CB 4.5Å; V29-K84 HydrophobicContact CG1-CD 4.25Å; V29-K84 HydrophobicContact CG1-CG 4.33Å; V29-K84 HydrophobicContact CG2-CD 4.42Å
30	L	85.9	Confident	85.4	Confident	45 Å²	45	77.7 Å²	77.7	24%	0.236	39%	0.386	C	S	.	.	H	α-helix	trans	-63.5	-40.5	175.3	-175	62.9	0	0	0	112.1	R26 Q27 I28 A33 V34 F82 Y85	R26-L30 WeakPolarHBondContact O-CB 3.42Å; R26-L30 PolarHBondContact O-N 3.49Å; Q27-L30 PolarHBondContact O-N 3.46Å; I28-L30 VanDerWaalsContact C-N 3.32Å; I28-L30 PolarHBondContact O-N 3.23Å; L30-A33 PolarHBondContact O-N 2.94Å; L30-V34 WeakPolarHBondContact O-CG2 3.45Å; L30-V34 PolarHBondContact O-N 3.44Å; L30-F82 HydrophobicContact CD1-CE1 4.22Å; L30-Y85 HydrophobicContact CB-CD2 3.96Å; L30-Y85 HydrophobicContact CB-CE2 3.94Å; L30-Y85 HydrophobicContact CD1-CD2 4.31Å; L30-Y85 HydrophobicContact CD1-CE1 4.43Å; L30-Y85 HydrophobicContact CD1-CE2 4.21Å; L30-Y85 HydrophobicContact CD1-CG 4.47Å; L30-Y85 HydrophobicContact CD2-CE2 4.06Å; L30-Y85 HydrophobicContact CG-CE2 4.3Å
31	A	89.1	Confident	86.1	Confident	62 Å²	62	71.3 Å²	71.3	51%	0.512	37%	0.373	S	S	.	.	H	α-helix	trans	-63.5	-40.6	175.7	0	0	0	0	0	112.4	Q27 I28 L35	Q27-A31 PolarHBondContact O-N 3.35Å; I28-A31 PolarHBondContact O-N 3.43Å; A31-L35 WeakPolarHBondContact O-CB 3.35Å; A31-L35 PolarHBondContact O-N 3.45Å
32	W	87.4	Confident	86.6	Confident	141 Å²	141	67.6 Å²	67.6	53%	0.534	37%	0.365	S	S	.	.	H	α-helix	trans	-65.5	-41.5	173.2	-76.4	109.1	0	0	0	112.5	I28 V29 V34 L35 N36	I28-W32 PolarHBondContact O-N 3.34Å; V29-W32 PolarHBondContact O-N 3.43Å; W32-V34 PolarHBondContact O-N 2.91Å; W32-L35 HydrophobicContact CE3-CD2 3.96Å; W32-L35 HydrophobicContact CZ3-CD2 3.84Å; W32-L35 PolarHBondContact O-N 3.03Å; W32-N36 WeakPolarHBondContact O-CB 3.2Å; W32-N36 PolarHBondContact O-N 3.14Å; W32-N36 PolarHBondContact O-ND2 3.31Å
33	A	90.4	Very high	87	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-58.9	-46.9	175.3	0	0	0	0	0	111.9	V29 L30 N36 V37 D81 F82	V29-A33 PolarHBondContact O-N 2.99Å; L30-A33 PolarHBondContact O-N 2.94Å; A33-N36 PolarHBondContact O-N 2.7Å; A33-V37 WeakPolarHBondContact O-CG2 3.32Å; A33-V37 PolarHBondContact O-N 2.85Å; A33-D81 HydrophobicContact CB-CB 3.78Å; A33-F82 HydrophobicContact CB-CD1 4.26Å; A33-F82 HydrophobicContact CB-CD2 4.04Å; A33-F82 HydrophobicContact CB-CE1 4.12Å; A33-F82 HydrophobicContact CB-CE2 3.89Å; A33-F82 HydrophobicContact CB-CG 4.21Å; A33-F82 HydrophobicContact CB-CZ 3.93Å
34	V	90.7	Very high	87.4	Confident	79 Å²	79	68 Å²	68	48%	0.479	36%	0.362	S	S	.	.	H	α-helix	trans	-63.3	-44.8	177	172.6	0	0	0	0	111.3	L30 W32 N36 V37 S38	L30-V34 WeakPolarHBondContact O-CG2 3.45Å; L30-V34 PolarHBondContact O-N 3.44Å; W32-V34 PolarHBondContact O-N 2.91Å; V34-N36 PolarHBondContact O-N 3.03Å; V34-V37 PolarHBondContact O-N 2.88Å; V34-S38 PolarHBondContact O-N 2.76Å; V34-S38 PolarHBondContact O-OG 2.97Å
35	L	92.9	Very high	87.7	Confident	79 Å²	79	66.5 Å²	66.5	41%	0.414	36%	0.361	S	S	.	.	H	α-helix	trans	-60.7	-44.3	177.1	-179.1	62.9	0	0	0	112	A31 W32 V37 S38 L39	A31-L35 WeakPolarHBondContact O-CB 3.35Å; A31-L35 PolarHBondContact O-N 3.45Å; W32-L35 HydrophobicContact CE3-CD2 3.96Å; W32-L35 HydrophobicContact CZ3-CD2 3.84Å; W32-L35 PolarHBondContact O-N 3.03Å; L35-V37 VanDerWaalsContact C-N 3.34Å; L35-V37 PolarHBondContact O-N 3.3Å; L35-S38 PolarHBondContact O-N 3.17Å; L35-L39 HydrophobicContact CD1-CD1 4.3Å; L35-L39 HydrophobicContact CD1-CG 4.34Å; L35-L39 HydrophobicContact CG-CD1 4.11Å; L35-L39 WeakPolarHBondContact O-CG 3.35Å; L35-L39 PolarHBondContact O-N 3.43Å
36	N	91.6	Very high	87.9	Confident	15 Å²	15	65.1 Å²	65.1	8%	0.08	35%	0.346	C	S	.	.	H	α-helix	trans	-62.6	-39	177.3	-75.7	-33.7	0	0	0	111.7	W32 A33 V34 A40 A78 D81	W32-N36 WeakPolarHBondContact O-CB 3.2Å; W32-N36 PolarHBondContact O-N 3.14Å; W32-N36 PolarHBondContact O-ND2 3.31Å; A33-N36 PolarHBondContact O-N 2.7Å; V34-N36 PolarHBondContact O-N 3.03Å; N36-A40 WeakPolarHBondContact O-CB 3.41Å; N36-A40 PolarHBondContact O-N 3.44Å; N36-A78 HydrophobicContact CB-CB 3.78Å; N36-D81 PolarHBondContact ND2-OD2 2.83Å; N36-D81 VanDerWaalsContact ND2-OD2 3.11Å
37	V	92.4	Very high	87.7	Confident	75 Å²	75	63.6 Å²	63.6	46%	0.455	34%	0.342	S	S	.	.	H	α-helix	trans	-65.3	-44.2	171.6	172.3	0	0	0	0	111.9	A33 V34 L35 L39 A40 G41 A78 F82	A33-V37 WeakPolarHBondContact O-CG2 3.32Å; A33-V37 PolarHBondContact O-N 2.85Å; V34-V37 PolarHBondContact O-N 2.88Å; L35-V37 VanDerWaalsContact C-N 3.34Å; L35-V37 PolarHBondContact O-N 3.3Å; V37-L39 VanDerWaalsContact C-N 3.34Å; V37-L39 PolarHBondContact O-N 2.9Å; V37-A40 PolarHBondContact O-N 3.03Å; V37-G41 PolarHBondContact O-N 2.9Å; V37-A78 HydrophobicContact CG2-CB 3.72Å; V37-F82 HydrophobicContact CG2-CE2 3.82Å
38	S	92.2	Very high	87.5	Confident	71 Å²	71	61.2 Å²	61.2	50%	0.497	34%	0.339	S	S	.	.	H	α-helix	trans	-62.2	-40.3	178.6	-62.5	0	0	0	0	112.2	V34 L35 M42	V34-S38 PolarHBondContact O-N 2.76Å; V34-S38 PolarHBondContact O-OG 2.97Å; L35-S38 PolarHBondContact O-N 3.17Å; S38-M42 WeakPolarHBondContact O-CB 3.32Å; S38-M42 PolarHBondContact O-N 2.84Å
39	L	91.2	Very high	86.9	Confident	52 Å²	52	58.6 Å²	58.6	27%	0.272	34%	0.336	S	S	.	.	H	α-helix	trans	-68.2	-45.4	175.8	-69.5	171.9	0	0	0	111.9	L35 V37 G41 M42 I43 F74	L35-L39 HydrophobicContact CD1-CD1 4.3Å; L35-L39 HydrophobicContact CD1-CG 4.34Å; L35-L39 HydrophobicContact CG-CD1 4.11Å; L35-L39 WeakPolarHBondContact O-CG 3.35Å; L35-L39 PolarHBondContact O-N 3.43Å; V37-L39 VanDerWaalsContact C-N 3.34Å; V37-L39 PolarHBondContact O-N 2.9Å; L39-G41 VanDerWaalsContact C-N 3.32Å; L39-G41 PolarHBondContact O-N 3.16Å; L39-M42 HydrophobicContact CD2-CE 4.01Å; L39-M42 PolarHBondContact O-N 2.95Å; L39-I43 VanDerWaalsContact O-CG1 3.32Å; L39-I43 WeakPolarHBondContact O-CG1 3.33Å; L39-I43 PolarHBondContact O-N 2.92Å; L39-F74 HydrophobicContact CB-CD1 4.19Å; L39-F74 HydrophobicContact CB-CE1 4.41Å; L39-F74 HydrophobicContact CB-CG 4.28Å; L39-F74 HydrophobicContact CD1-CD1 4.17Å; L39-F74 HydrophobicContact CD1-CE1 3.76Å; L39-F74 HydrophobicContact CD1-CZ 4.23Å
40	A	90.8	Very high	86.1	Confident	9 Å²	9	64.1 Å²	64.1	7%	0.074	36%	0.359	C	S	.	.	H	α-helix	trans	-59.5	-43.1	174.6	0	0	0	0	0	111.8	N36 V37 I43 Y44 F74	N36-A40 WeakPolarHBondContact O-CB 3.41Å; N36-A40 PolarHBondContact O-N 3.44Å; V37-A40 PolarHBondContact O-N 3.03Å; A40-I43 PolarHBondContact O-N 2.97Å; A40-Y44 WeakPolarHBondContact O-CB 3.44Å; A40-Y44 PolarHBondContact O-N 2.87Å; A40-F74 HydrophobicContact CB-CB 3.9Å
41	G	88.7	Confident	85.2	Confident	35 Å²	35	67.9 Å²	67.9	36%	0.361	38%	0.379	S	S	.	.	H	α-helix	trans	-62.3	-43.6	175.8	0	0	0	0	0	112.8	V37 L39 Y44 T45	V37-G41 PolarHBondContact O-N 2.9Å; L39-G41 VanDerWaalsContact C-N 3.32Å; L39-G41 PolarHBondContact O-N 3.16Å; G41-Y44 PolarHBondContact O-N 3.32Å; G41-T45 PolarHBondContact O-N 2.88Å; G41-T45 PolarHBondContact O-OG1 2.93Å
42	M	88.6	Confident	84	Confident	115 Å²	115	69.6 Å²	69.6	57%	0.567	38%	0.379	S	S	*	.	H	α-helix	trans	-60.6	-46.3	176.3	-174.4	179.3	71.3	0	0	111.9	S38 L39 T45 E46	S38-M42 WeakPolarHBondContact O-CB 3.32Å; S38-M42 PolarHBondContact O-N 2.84Å; L39-M42 HydrophobicContact CD2-CE 4.01Å; L39-M42 PolarHBondContact O-N 2.95Å; M42-T45 WeakPolarHBondContact CA-OG1 3.26Å; M42-T45 PolarHBondContact O-N 3.11Å; M42-T45 PolarHBondContact O-OG1 3.36Å; M42-E46 PolarHBondContact O-N 2.92Å
43	I	86.9	Confident	82.9	Confident	27 Å²	27	64.9 Å²	64.9	14%	0.138	37%	0.368	C	S	.	.	H	α-helix	trans	-64.8	-41.5	177	-60.8	160.9	0	0	0	110.4	L39 A40 T45 E46 M47 E67 L70 A71 F74	L39-I43 VanDerWaalsContact O-CG1 3.32Å; L39-I43 WeakPolarHBondContact O-CG1 3.33Å; L39-I43 PolarHBondContact O-N 2.92Å; A40-I43 PolarHBondContact O-N 2.97Å; I43-T45 VanDerWaalsContact C-N 3.34Å; I43-T45 PolarHBondContact O-N 2.93Å; I43-E46 PolarHBondContact O-N 3.41Å; I43-E46 VanDerWaalsContact O-N 3.14Å; I43-M47 HydrophobicContact CG2-CG 4.47Å; I43-M47 WeakPolarHBondContact O-CG 3.24Å; I43-M47 PolarHBondContact O-N 3.46Å; I43-E67 HydrophobicContact CG2-CB 4.26Å; I43-L70 HydrophobicContact CD1-CB 4.13Å; I43-A71 HydrophobicContact CB-CB 4.36Å; I43-A71 HydrophobicContact CG2-CB 3.88Å; I43-F74 HydrophobicContact CD1-CD2 3.58Å; I43-F74 HydrophobicContact CD1-CE2 3.86Å
44	Y	86.3	Confident	81.6	Confident	159 Å²	159	75.3 Å²	75.3	62%	0.624	41%	0.407	S	S	*	.	H	α-helix	trans	-62.5	-38.6	176	-176.6	-93.1	0	0	0	112.7	A40 G41 E46 S48	A40-Y44 WeakPolarHBondContact O-CB 3.44Å; A40-Y44 PolarHBondContact O-N 2.87Å; G41-Y44 PolarHBondContact O-N 3.32Å; Y44-E46 VanDerWaalsContact C-N 3.35Å; Y44-S48 WeakPolarHBondContact O-CB 3.47Å; Y44-S48 PolarHBondContact O-N 2.89Å; Y44-S48 VanDerWaalsContact O-N 3.1Å; Y44-S48 PolarHBondContact O-OG 3.16Å
45	T	84	Confident	80.4	Confident	84 Å²	84	80.5 Å²	80.5	52%	0.515	42%	0.419	S	S	.	.	H	α-helix	trans	-67.7	-32.3	173.2	50.1	0	0	0	0	112.9	G41 M42 I43 G49	G41-T45 PolarHBondContact O-N 2.88Å; G41-T45 PolarHBondContact O-OG1 2.93Å; M42-T45 WeakPolarHBondContact CA-OG1 3.26Å; M42-T45 PolarHBondContact O-N 3.11Å; M42-T45 PolarHBondContact O-OG1 3.36Å; I43-T45 VanDerWaalsContact C-N 3.34Å; I43-T45 PolarHBondContact O-N 2.93Å; T45-G49 PolarHBondContact O-N 3.34Å
46	E	82.6	Confident	79.1	Confident	19 Å²	19	83.8 Å²	83.8	9%	0.089	43%	0.427	C	S	.	.	H	α-helix	trans	-69.8	-49	172.4	177.2	52.4	-149.9	0	0	111.5	M42 I43 Y44 S48 G49 K50 L51 L52 S53	M42-E46 PolarHBondContact O-N 2.92Å; I43-E46 PolarHBondContact O-N 3.41Å; I43-E46 VanDerWaalsContact O-N 3.14Å; Y44-E46 VanDerWaalsContact C-N 3.35Å; E46-S48 PolarHBondContact O-N 2.88Å; E46-S48 VanDerWaalsContact O-N 3.08Å; E46-G49 PolarHBondContact O-N 3.47Å; E46-G49 VanDerWaalsContact O-N 3.15Å; E46-K50 WeakPolarHBondContact O-CA 3.25Å; E46-K50 PolarHBondContact O-N 2.89Å; E46-K50 VanDerWaalsContact OE1-CA 3.3Å; E46-K50 WeakPolarHBondContact OE1-CA 3.37Å; E46-L51 VanDerWaalsContact CD-N 3.33Å; E46-L51 PolarHBondContact OE1-N 3.38Å; E46-L51 WeakPolarHBondContact OE2-CA 3.32Å; E46-L51 WeakPolarHBondContact OE2-CB 3.18Å; E46-L51 PolarHBondContact OE2-N 3.45Å; E46-L52 HydrophobicContact CG-CB 4.34Å; E46-L52 HydrophobicContact CG-CD1 3.88Å; E46-L52 WeakPolarHBondContact OE1-CB 3.45Å; E46-L52 PolarHBondContact OE1-N 3.04Å; E46-L52 PolarHBondContact OE2-N 3.24Å; E46-S53 PolarHBondContact OE1-N 3.29Å
47	M	77.3	Confident	77.7	Confident	26 Å²	26	89.5 Å²	89.5	13%	0.128	46%	0.458	C	S	.	.	H	α-helix	trans	-54.6	-32.8	176.2	-70.7	-175.5	76.3	0	0	112.7	I43 W64 E67 L68 A71	I43-M47 HydrophobicContact CG2-CG 4.47Å; I43-M47 WeakPolarHBondContact O-CG 3.24Å; I43-M47 PolarHBondContact O-N 3.46Å; M47-W64 HydrophobicContact CE-CD2 4.17Å; M47-W64 HydrophobicContact CE-CG 4.3Å; M47-W64 HydrophobicContact CE-CZ2 4.03Å; M47-E67 HydrophobicContact CE-CB 4.44Å; M47-E67 HydrophobicContact CG-CB 3.67Å; M47-E67 HydrophobicContact SD-CB 3.95Å; M47-L68 HydrophobicContact CE-CB 3.73Å; M47-L68 HydrophobicContact CE-CD1 4.09Å; M47-L68 HydrophobicContact CE-CG 4.47Å; M47-L68 HydrophobicContact SD-CB 4.44Å; M47-A71 HydrophobicContact SD-CB 4.39Å
48	S	75.9	Confident	76.3	Confident	78 Å²	78	89.7 Å²	89.7	55%	0.545	46%	0.455	S	S	.	.	H	α-helix	trans	-83.2	-40.9	178.4	-55.7	0	0	0	0	113.2	Y44 E46	Y44-S48 WeakPolarHBondContact O-CB 3.47Å; Y44-S48 PolarHBondContact O-N 2.89Å; Y44-S48 VanDerWaalsContact O-N 3.1Å; Y44-S48 PolarHBondContact O-OG 3.16Å; E46-S48 PolarHBondContact O-N 2.88Å; E46-S48 VanDerWaalsContact O-N 3.08Å
49	G	72.5	Confident	74.9	Confident	44 Å²	44	92.2 Å²	92.2	45%	0.454	47%	0.468	S	S	.	.	H	α-helix	trans	-94.8	-20.9	-172.2	0	0	0	0	0	115.5	T45 E46 L51	T45-G49 PolarHBondContact O-N 3.34Å; E46-G49 PolarHBondContact O-N 3.47Å; E46-G49 VanDerWaalsContact O-N 3.15Å; G49-L51 VanDerWaalsContact C-N 3.26Å; G49-L51 PolarHBondContact O-N 3.22Å
50	K	70.6	Confident	73.7	Confident	131 Å²	131	98.1 Å²	98.1	57%	0.57	49%	0.488	S	S	*	.			trans	52.7	37.1	-177.3	-58	-177.4	179.9	-179	0	113.6	E46 R54	E46-K50 WeakPolarHBondContact O-CA 3.25Å; E46-K50 PolarHBondContact O-N 2.89Å; E46-K50 VanDerWaalsContact OE1-CA 3.3Å; E46-K50 WeakPolarHBondContact OE1-CA 3.37Å; K50-R54 WeakPolarHBondContact O-CB 3.48Å; K50-R54 PolarHBondContact O-N 3.39Å
51	L	66.6	Low	72.6	Confident	125 Å²	125	106.8 Å²	106.8	65%	0.654	52%	0.519	S	S	*	.	H	α-helix	trans	-71.5	-47.2	-173.1	-69.6	154.8	0	0	0	111.2	E46 G49 R54 Y55	E46-L51 VanDerWaalsContact CD-N 3.33Å; E46-L51 PolarHBondContact OE1-N 3.38Å; E46-L51 WeakPolarHBondContact OE2-CA 3.32Å; E46-L51 WeakPolarHBondContact OE2-CB 3.18Å; E46-L51 PolarHBondContact OE2-N 3.45Å; G49-L51 VanDerWaalsContact C-N 3.26Å; G49-L51 PolarHBondContact O-N 3.22Å; L51-R54 PolarHBondContact O-N 2.83Å; L51-Y55 VanDerWaalsContact O-CB 3.26Å; L51-Y55 WeakPolarHBondContact O-CB 3.4Å; L51-Y55 PolarHBondContact O-N 3.46Å
52	L	65.5	Low	72.1	Confident	98 Å²	98	108.6 Å²	108.6	51%	0.513	52%	0.524	S	S	.	.	H	α-helix	trans	-64.9	-44.4	171.7	-82	117.9	0	0	0	111.6	E46 R54 Y55 Y56	E46-L52 HydrophobicContact CG-CB 4.34Å; E46-L52 HydrophobicContact CG-CD1 3.88Å; E46-L52 WeakPolarHBondContact OE1-CB 3.45Å; E46-L52 PolarHBondContact OE1-N 3.04Å; E46-L52 PolarHBondContact OE2-N 3.24Å; L52-R54 VanDerWaalsContact C-N 3.27Å; L52-R54 PolarHBondContact O-N 3.08Å; L52-Y55 PolarHBondContact O-N 3.26Å; L52-Y55 VanDerWaalsContact O-N 3.16Å; L52-Y56 HydrophobicContact CD2-CD2 4.23Å; L52-Y56 HydrophobicContact CD2-CE2 3.98Å; L52-Y56 PolarHBondContact O-N 2.98Å
53	S	63.2	Low	71.5	Confident	42 Å²	42	106 Å²	106	29%	0.294	51%	0.512	S	S	.	.	H	α-helix	trans	-59.3	-39.7	178.3	178.6	0	0	0	0	111.9	E46 N57 I58	E46-S53 PolarHBondContact OE1-N 3.29Å; S53-N57 WeakPolarHBondContact O-CA 3.47Å; S53-N57 PolarHBondContact O-N 3.4Å; S53-I58 PolarHBondContact OG-O 2.95Å
54	R	64.1	Low	71.1	Confident	218 Å²	218	110.2 Å²	110.2	82%	0.823	53%	0.526	S	S	*	.	H	α-helix	trans	-74.9	-29.5	176.3	-166.7	176.1	-166.5	170.9	4	113.7	K50 L51 L52	K50-R54 WeakPolarHBondContact O-CB 3.48Å; K50-R54 PolarHBondContact O-N 3.39Å; L51-R54 PolarHBondContact O-N 2.83Å; L52-R54 VanDerWaalsContact C-N 3.27Å; L52-R54 PolarHBondContact O-N 3.08Å
55	Y	65.2	Low	70.9	Confident	188 Å²	188	107.5 Å²	107.5	74%	0.737	52%	0.516	S	S	*	.	H	α-helix	trans	-77.1	-42.2	178.3	-169.3	-93.3	0	0	0	112.4	L51 L52	L51-Y55 VanDerWaalsContact O-CB 3.26Å; L51-Y55 WeakPolarHBondContact O-CB 3.4Å; L51-Y55 PolarHBondContact O-N 3.46Å; L52-Y55 PolarHBondContact O-N 3.26Å; L52-Y55 VanDerWaalsContact O-N 3.16Å
56	Y	66.1	Low	70.9	Confident	148 Å²	148	108.5 Å²	108.5	58%	0.58	52%	0.517	S	S	*	.	H	α-helix	trans	-89.7	-10.7	179.9	-74.3	-80.6	0	0	0	114	L52 I58	L52-Y56 HydrophobicContact CD2-CD2 4.23Å; L52-Y56 HydrophobicContact CD2-CE2 3.98Å; L52-Y56 PolarHBondContact O-N 2.98Å; Y56-I58 PolarHBondContact O-N 3.25Å
57	N	61	Low	71	Confident	136 Å²	136	109.5 Å²	109.5	73%	0.727	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	32.1	179.5	-157.4	22.9	0	0	0	113.6	S53	S53-N57 WeakPolarHBondContact O-CA 3.47Å; S53-N57 PolarHBondContact O-N 3.4Å
58	I	64.3	Low	71.4	Confident	78 Å²	78	111.8 Å²	111.8	40%	0.4	53%	0.534	S	S	.	.			trans	-101	117.3	-179.9	-58.4	176.6	0	0	0	109	S53 Y56 Y60 I63	S53-I58 PolarHBondContact OG-O 2.95Å; Y56-I58 PolarHBondContact O-N 3.25Å; I58-Y60 HydrophobicContact CG2-CD2 3.5Å; I58-Y60 HydrophobicContact CG2-CE2 4.12Å; I58-Y60 HydrophobicContact CG2-CG 4.42Å; I58-I63 HydrophobicContact CG2-CD1 3.6Å
59	T	61	Low	72.1	Confident	124 Å²	124	112.4 Å²	112.4	76%	0.761	53%	0.534	S	S	*	.			trans	-116.2	42.5	-173.9	43.5	0	0	0	0	113.1	W61	T59-W61 PolarHBondContact O-N 2.76Å
60	Y	66.3	Low	72.8	Confident	177 Å²	177	113.8 Å²	113.8	69%	0.694	53%	0.531	S	S	*	.			trans	-84.1	112	172.5	-70.6	-61.9	0	0	0	111.8	I58 P62 I63	I58-Y60 HydrophobicContact CG2-CD2 3.5Å; I58-Y60 HydrophobicContact CG2-CE2 4.12Å; I58-Y60 HydrophobicContact CG2-CG 4.42Å; Y60-P62 VanDerWaalsContact C-N 3.31Å; Y60-I63 WeakPolarHBondContact O-CB 3.38Å; Y60-I63 WeakPolarHBondContact O-CG1 3.39Å; Y60-I63 PolarHBondContact O-N 3.05Å
61	W	68.9	Low	73.7	Confident	190 Å²	190	108.1 Å²	108.1	72%	0.72	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	-36.9	177.6	-177	82.2	0	0	0	115.3	T59 I63 W64 Y65	T59-W61 PolarHBondContact O-N 2.76Å; W61-I63 PolarHBondContact O-N 2.94Å; W61-W64 PolarHBondContact O-N 3.47Å; W61-Y65 AromaticContact CD2-CE2 3.91Å; W61-Y65 HydrophobicContact CD2-CE2 3.91Å; W61-Y65 AromaticContact CE2-CE2 3.65Å; W61-Y65 HydrophobicContact CE3-CD2 4.44Å; W61-Y65 AromaticContact CE3-CE2 3.97Å; W61-Y65 HydrophobicContact CE3-CE2 3.97Å; W61-Y65 AromaticContact CH2-CE2 3.58Å; W61-Y65 HydrophobicContact CH2-CE2 3.58Å; W61-Y65 AromaticContact CH2-CZ 3.82Å; W61-Y65 AromaticContact CZ2-CE2 3.51Å; W61-Y65 HydrophobicContact CZ2-CE2 3.51Å; W61-Y65 AromaticContact CZ2-CZ 3.77Å; W61-Y65 WeakPolarHBondContact CZ2-OH 3.43Å; W61-Y65 HydrophobicContact CZ3-CD2 4.45Å; W61-Y65 AromaticContact CZ3-CE2 3.81Å; W61-Y65 HydrophobicContact CZ3-CE2 3.81Å
62	P	76.6	Confident	74.8	Confident	74 Å²	74	104.8 Å²	104.8	48%	0.481	50%	0.496	S	S	.	.	H	α-helix	trans	-60.3	-23.3	174.3	-27.8	37.1	0	0	0	116.1	Y60 W64 Y65 I66	Y60-P62 VanDerWaalsContact C-N 3.31Å; P62-W64 VanDerWaalsContact C-N 3.28Å; P62-W64 PolarHBondContact O-N 3.37Å; P62-Y65 PolarHBondContact O-N 2.89Å; P62-Y65 VanDerWaalsContact O-N 3.13Å; P62-I66 PolarHBondContact O-N 2.81Å
63	I	76.2	Confident	76.1	Confident	61 Å²	61	104 Å²	104	31%	0.313	49%	0.492	S	S	.	.	H	α-helix	trans	-61.2	-40.3	-178.2	-64.8	174.6	0	0	0	110.7	I58 Y60 W61 Y65 I66 E67	I58-I63 HydrophobicContact CG2-CD1 3.6Å; Y60-I63 WeakPolarHBondContact O-CB 3.38Å; Y60-I63 WeakPolarHBondContact O-CG1 3.39Å; Y60-I63 PolarHBondContact O-N 3.05Å; W61-I63 PolarHBondContact O-N 2.94Å; I63-Y65 VanDerWaalsContact C-N 3.26Å; I63-Y65 PolarHBondContact O-N 3.46Å; I63-I66 WeakPolarHBondContact O-CB 3.37Å; I63-I66 PolarHBondContact O-N 2.85Å; I63-E67 HydrophobicContact CG2-CG 4.29Å; I63-E67 WeakPolarHBondContact CG2-OE1 3.33Å; I63-E67 WeakPolarHBondContact O-CG 3.07Å; I63-E67 PolarHBondContact O-N 3.34Å
64	W	80	Confident	77.4	Confident	114 Å²	114	104.4 Å²	104.4	43%	0.432	49%	0.488	S	S	.	.	H	α-helix	trans	-60.6	-33.5	177.7	-175.8	82.3	0	0	0	112.9	M47 W61 P62 L68	M47-W64 HydrophobicContact CE-CD2 4.17Å; M47-W64 HydrophobicContact CE-CG 4.3Å; M47-W64 HydrophobicContact CE-CZ2 4.03Å; W61-W64 PolarHBondContact O-N 3.47Å; P62-W64 VanDerWaalsContact C-N 3.28Å; P62-W64 PolarHBondContact O-N 3.37Å; W64-L68 HydrophobicContact CH2-CD2 4Å; W64-L68 HydrophobicContact CZ3-CD2 3.96Å; W64-L68 WeakPolarHBondContact O-CB 3.4Å; W64-L68 PolarHBondContact O-N 2.94Å
65	Y	81.9	Confident	78.7	Confident	103 Å²	103	97 Å²	97	40%	0.404	47%	0.469	S	S	.	.	H	α-helix	trans	-72.7	-35.6	174.3	-72.3	-88.7	0	0	0	112.2	W61 P62 I63 L68 V69	W61-Y65 AromaticContact CD2-CE2 3.91Å; W61-Y65 HydrophobicContact CD2-CE2 3.91Å; W61-Y65 AromaticContact CE2-CE2 3.65Å; W61-Y65 HydrophobicContact CE3-CD2 4.44Å; W61-Y65 AromaticContact CE3-CE2 3.97Å; W61-Y65 HydrophobicContact CE3-CE2 3.97Å; W61-Y65 AromaticContact CH2-CE2 3.58Å; W61-Y65 HydrophobicContact CH2-CE2 3.58Å; W61-Y65 AromaticContact CH2-CZ 3.82Å; W61-Y65 AromaticContact CZ2-CE2 3.51Å; W61-Y65 HydrophobicContact CZ2-CE2 3.51Å; W61-Y65 AromaticContact CZ2-CZ 3.77Å; W61-Y65 WeakPolarHBondContact CZ2-OH 3.43Å; W61-Y65 HydrophobicContact CZ3-CD2 4.45Å; W61-Y65 AromaticContact CZ3-CE2 3.81Å; W61-Y65 HydrophobicContact CZ3-CE2 3.81Å; P62-Y65 PolarHBondContact O-N 2.89Å; P62-Y65 VanDerWaalsContact O-N 3.13Å; I63-Y65 VanDerWaalsContact C-N 3.26Å; I63-Y65 PolarHBondContact O-N 3.46Å; Y65-L68 PolarHBondContact O-N 3Å; Y65-V69 WeakPolarHBondContact O-CB 3.38Å; Y65-V69 VanDerWaalsContact O-CG2 3.28Å; Y65-V69 WeakPolarHBondContact O-CG2 3.39Å; Y65-V69 PolarHBondContact O-N 3.47Å
66	I	83.9	Confident	80	Confident	104 Å²	104	93.5 Å²	93.5	53%	0.533	46%	0.463	S	S	.	.	H	α-helix	trans	-66.8	-44.1	175.1	-63.2	168	0	0	0	109.9	P62 I63 V69 L70	P62-I66 PolarHBondContact O-N 2.81Å; I63-I66 WeakPolarHBondContact O-CB 3.37Å; I63-I66 PolarHBondContact O-N 2.85Å; I66-V69 PolarHBondContact O-N 3.33Å; I66-L70 HydrophobicContact CG2-CD1 4.05Å; I66-L70 VanDerWaalsContact O-CG 3.31Å; I66-L70 WeakPolarHBondContact O-CG 3.4Å; I66-L70 PolarHBondContact O-N 2.97Å
67	E	84.3	Confident	81.1	Confident	40 Å²	40	89.8 Å²	89.8	19%	0.187	45%	0.453	C	S	.	.	H	α-helix	trans	-59.6	-44.9	173.7	-69.2	168.3	174.2	0	0	111.7	I43 M47 I63 V69 L70 A71	I43-E67 HydrophobicContact CG2-CB 4.26Å; M47-E67 HydrophobicContact CE-CB 4.44Å; M47-E67 HydrophobicContact CG-CB 3.67Å; M47-E67 HydrophobicContact SD-CB 3.95Å; I63-E67 HydrophobicContact CG2-CG 4.29Å; I63-E67 WeakPolarHBondContact CG2-OE1 3.33Å; I63-E67 WeakPolarHBondContact O-CG 3.07Å; I63-E67 PolarHBondContact O-N 3.34Å; E67-V69 PolarHBondContact O-N 3.32Å; E67-L70 PolarHBondContact O-N 3.15Å; E67-A71 WeakPolarHBondContact O-CB 3.36Å; E67-A71 PolarHBondContact O-N 2.92Å
68	L	86	Confident	82.6	Confident	75 Å²	75	83.5 Å²	83.5	39%	0.393	42%	0.42	S	S	.	.	H	α-helix	trans	-61.4	-42.6	176.2	-177	62.6	0	0	0	112.6	M47 W64 Y65 S72	M47-L68 HydrophobicContact CE-CB 3.73Å; M47-L68 HydrophobicContact CE-CD1 4.09Å; M47-L68 HydrophobicContact CE-CG 4.47Å; M47-L68 HydrophobicContact SD-CB 4.44Å; W64-L68 HydrophobicContact CH2-CD2 4Å; W64-L68 HydrophobicContact CZ3-CD2 3.96Å; W64-L68 WeakPolarHBondContact O-CB 3.4Å; W64-L68 PolarHBondContact O-N 2.94Å; Y65-L68 PolarHBondContact O-N 3Å; L68-S72 WeakPolarHBondContact O-CB 3.37Å; L68-S72 PolarHBondContact O-N 3.19Å; L68-S72 PolarHBondContact O-OG 3.35Å
69	V	89.9	Confident	83.8	Confident	90 Å²	90	85.5 Å²	85.5	55%	0.545	43%	0.431	S	S	.	.	H	α-helix	trans	-65.5	-42.3	176.7	167.8	0	0	0	0	110.6	Y65 I66 E67 S72 L73	Y65-V69 WeakPolarHBondContact O-CB 3.38Å; Y65-V69 VanDerWaalsContact O-CG2 3.28Å; Y65-V69 WeakPolarHBondContact O-CG2 3.39Å; Y65-V69 PolarHBondContact O-N 3.47Å; I66-V69 PolarHBondContact O-N 3.33Å; E67-V69 PolarHBondContact O-N 3.32Å; V69-S72 PolarHBondContact O-OG 3.43Å; V69-L73 VanDerWaalsContact O-CB 3.29Å; V69-L73 WeakPolarHBondContact O-CB 3.39Å; V69-L73 PolarHBondContact O-N 3.01Å
70	L	87.6	Confident	85.2	Confident	74 Å²	74	85.1 Å²	85.1	39%	0.387	42%	0.419	S	S	.	.	H	α-helix	trans	-65.9	-46.1	176.5	-69.7	170.3	0	0	0	111.8	I43 I66 E67 S72 L73 F74	I43-L70 HydrophobicContact CD1-CB 4.13Å; I66-L70 HydrophobicContact CG2-CD1 4.05Å; I66-L70 VanDerWaalsContact O-CG 3.31Å; I66-L70 WeakPolarHBondContact O-CG 3.4Å; I66-L70 PolarHBondContact O-N 2.97Å; E67-L70 PolarHBondContact O-N 3.15Å; L70-S72 VanDerWaalsContact C-N 3.34Å; L70-S72 PolarHBondContact O-N 2.93Å; L70-L73 PolarHBondContact O-N 3.22Å; L70-F74 WeakPolarHBondContact O-CD2 3.48Å; L70-F74 PolarHBondContact O-N 2.97Å
71	A	88.8	Confident	86.2	Confident	11 Å²	11	77.8 Å²	77.8	9%	0.091	39%	0.392	C	S	.	.	H	α-helix	trans	-59.3	-43.3	177.5	0	0	0	0	0	112.2	I43 M47 E67 S75	I43-A71 HydrophobicContact CB-CB 4.36Å; I43-A71 HydrophobicContact CG2-CB 3.88Å; M47-A71 HydrophobicContact SD-CB 4.39Å; E67-A71 WeakPolarHBondContact O-CB 3.36Å; E67-A71 PolarHBondContact O-N 2.92Å; A71-S75 WeakPolarHBondContact O-CB 3.49Å; A71-S75 PolarHBondContact O-N 3.07Å; A71-S75 PolarHBondContact O-OG 2.86Å
72	S	90.1	Very high	87.1	Confident	56 Å²	56	71.8 Å²	71.8	39%	0.392	37%	0.371	S	S	.	.	H	α-helix	trans	-68.5	-38.2	176.7	57	0	0	0	0	112.4	L68 V69 L70 S75 L76	L68-S72 WeakPolarHBondContact O-CB 3.37Å; L68-S72 PolarHBondContact O-N 3.19Å; L68-S72 PolarHBondContact O-OG 3.35Å; V69-S72 PolarHBondContact O-OG 3.43Å; L70-S72 VanDerWaalsContact C-N 3.34Å; L70-S72 PolarHBondContact O-N 2.93Å; S72-S75 PolarHBondContact O-N 3.17Å; S72-L76 WeakPolarHBondContact O-CB 3.48Å; S72-L76 WeakPolarHBondContact O-CG 3.39Å; S72-L76 PolarHBondContact O-N 3.06Å
73	L	92.3	Very high	87.6	Confident	82 Å²	82	75.8 Å²	75.8	43%	0.429	38%	0.376	S	S	.	.	H	α-helix	trans	-63.8	-47.2	175.6	-175	152.8	0	0	0	112.4	V69 L70 S75 L76 N77	V69-L73 VanDerWaalsContact O-CB 3.29Å; V69-L73 WeakPolarHBondContact O-CB 3.39Å; V69-L73 PolarHBondContact O-N 3.01Å; L70-L73 PolarHBondContact O-N 3.22Å; L73-S75 VanDerWaalsContact C-N 3.31Å; L73-S75 PolarHBondContact O-N 3.49Å; L73-L76 PolarHBondContact O-N 2.99Å; L73-N77 WeakPolarHBondContact CD2-ND2 3.32Å; L73-N77 PolarHBondContact O-N 3.45Å
74	F	91.4	Very high	87.8	Confident	50 Å²	50	76.2 Å²	76.2	22%	0.219	38%	0.376	C	S	.	.	H	α-helix	trans	-64.8	-35.7	175.3	-76.5	-67.8	0	0	0	112.1	L39 A40 I43 L70 N77 A78	L39-F74 HydrophobicContact CB-CD1 4.19Å; L39-F74 HydrophobicContact CB-CE1 4.41Å; L39-F74 HydrophobicContact CB-CG 4.28Å; L39-F74 HydrophobicContact CD1-CD1 4.17Å; L39-F74 HydrophobicContact CD1-CE1 3.76Å; L39-F74 HydrophobicContact CD1-CZ 4.23Å; A40-F74 HydrophobicContact CB-CB 3.9Å; I43-F74 HydrophobicContact CD1-CD2 3.58Å; I43-F74 HydrophobicContact CD1-CE2 3.86Å; L70-F74 WeakPolarHBondContact O-CD2 3.48Å; L70-F74 PolarHBondContact O-N 2.97Å; F74-N77 PolarHBondContact O-N 3.34Å; F74-A78 WeakPolarHBondContact O-CB 3.44Å; F74-A78 PolarHBondContact O-N 3.05Å
75	S	90.1	Very high	88.1	Confident	61 Å²	61	73.7 Å²	73.7	43%	0.427	37%	0.367	S	S	.	.	H	α-helix	trans	-65.5	-40.9	175.2	-59.1	0	0	0	0	112.6	A71 S72 L73 L79	A71-S75 WeakPolarHBondContact O-CB 3.49Å; A71-S75 PolarHBondContact O-N 3.07Å; A71-S75 PolarHBondContact O-OG 2.86Å; S72-S75 PolarHBondContact O-N 3.17Å; L73-S75 VanDerWaalsContact C-N 3.31Å; L73-S75 PolarHBondContact O-N 3.49Å; S75-L79 WeakPolarHBondContact O-CB 3.44Å; S75-L79 PolarHBondContact O-N 3.02Å
76	L	92.4	Very high	88	Confident	116 Å²	116	74.2 Å²	74.2	61%	0.607	37%	0.371	S	S	*	.	H	α-helix	trans	-67.7	-40.8	175.8	-74.2	168.3	0	0	0	111.9	S72 L73 L79 F80	S72-L76 WeakPolarHBondContact O-CB 3.48Å; S72-L76 WeakPolarHBondContact O-CG 3.39Å; S72-L76 PolarHBondContact O-N 3.06Å; L73-L76 PolarHBondContact O-N 2.99Å; L76-L79 PolarHBondContact O-N 3.24Å; L76-F80 PolarHBondContact O-N 3.03Å
77	N	90.9	Very high	87.7	Confident	70 Å²	70	75.6 Å²	75.6	37%	0.374	37%	0.373	S	S	.	.	H	α-helix	trans	-62.8	-45.6	174.2	-74.4	-14.9	0	0	0	111.6	L73 F74 L79 F80 D81	L73-N77 WeakPolarHBondContact CD2-ND2 3.32Å; L73-N77 PolarHBondContact O-N 3.45Å; F74-N77 PolarHBondContact O-N 3.34Å; N77-L79 VanDerWaalsContact C-N 3.34Å; N77-L79 PolarHBondContact O-N 3.39Å; N77-F80 PolarHBondContact O-N 2.85Å; N77-D81 PolarHBondContact O-N 3.39Å
78	A	90.7	Very high	86.9	Confident	4 Å²	4	79.7 Å²	79.7	3%	0.033	39%	0.388	C	S	.	.	H	α-helix	trans	-56.4	-47	173.7	0	0	0	0	0	111.8	N36 V37 F74 F80 D81 F82	N36-A78 HydrophobicContact CB-CB 3.78Å; V37-A78 HydrophobicContact CG2-CB 3.72Å; F74-A78 WeakPolarHBondContact O-CB 3.44Å; F74-A78 PolarHBondContact O-N 3.05Å; A78-F80 VanDerWaalsContact C-N 3.33Å; A78-F80 PolarHBondContact O-N 2.91Å; A78-D81 PolarHBondContact O-N 3.25Å; A78-F82 WeakPolarHBondContact O-CB 3.4Å; A78-F82 WeakPolarHBondContact O-CD2 3.45Å; A78-F82 PolarHBondContact O-N 3.34Å
79	L	90.5	Very high	86.2	Confident	119 Å²	119	78.9 Å²	78.9	62%	0.623	39%	0.386	S	S	*	.	H	α-helix	trans	-62.2	-38.8	178.6	-176.4	62	0	0	0	112.2	S75 L76 N77 W83	S75-L79 WeakPolarHBondContact O-CB 3.44Å; S75-L79 PolarHBondContact O-N 3.02Å; L76-L79 PolarHBondContact O-N 3.24Å; N77-L79 VanDerWaalsContact C-N 3.34Å; N77-L79 PolarHBondContact O-N 3.39Å; L79-W83 WeakPolarHBondContact O-CB 3.41Å; L79-W83 PolarHBondContact O-N 2.78Å
80	F	89.9	Confident	85	Confident	116 Å²	116	81.9 Å²	81.9	51%	0.509	40%	0.396	S	S	.	.	H	α-helix	trans	-66.5	-45.4	175.5	-179.4	-98.4	0	0	0	112.4	L76 N77 A78 W83 K84	L76-F80 PolarHBondContact O-N 3.03Å; N77-F80 PolarHBondContact O-N 2.85Å; A78-F80 VanDerWaalsContact C-N 3.33Å; A78-F80 PolarHBondContact O-N 2.91Å; F80-W83 HydrophobicContact CD2-CE3 4.44Å; F80-W83 HydrophobicContact CE2-CE3 4.41Å; F80-W83 HydrophobicContact CE2-CZ3 4.42Å; F80-W83 PolarHBondContact O-N 3.35Å; F80-K84 HydrophobicContact CE1-CD 4.31Å; F80-K84 VanDerWaalsContact O-CB 3.25Å; F80-K84 WeakPolarHBondContact O-CB 3.49Å; F80-K84 PolarHBondContact O-N 2.89Å
81	D	88.3	Confident	83.3	Confident	24 Å²	24	82.5 Å²	82.5	13%	0.128	41%	0.407	C	S	.	.	H	α-helix	trans	-65.5	-38.3	176.8	-75.3	-39.5	0	0	0	111.8	V29 A33 N36 N77 A78 K84 Y85	V29-D81 HydrophobicContact CG1-CB 4.13Å; V29-D81 WeakPolarHBondContact CG1-O 3.44Å; A33-D81 HydrophobicContact CB-CB 3.78Å; N36-D81 PolarHBondContact ND2-OD2 2.83Å; N36-D81 VanDerWaalsContact ND2-OD2 3.11Å; N77-D81 PolarHBondContact O-N 3.39Å; A78-D81 PolarHBondContact O-N 3.25Å; D81-K84 PolarHBondContact O-N 3.1Å; D81-Y85 WeakPolarHBondContact O-CB 3.33Å; D81-Y85 PolarHBondContact O-N 2.93Å
82	F	86.9	Confident	81.6	Confident	64 Å²	64	86.1 Å²	86.1	28%	0.281	43%	0.429	S	S	.	.	H	α-helix	trans	-63.9	-46.6	171	-84	-61.6	0	0	0	112.3	L30 A33 V37 A78 K84 Y85 F86	L30-F82 HydrophobicContact CD1-CE1 4.22Å; A33-F82 HydrophobicContact CB-CD1 4.26Å; A33-F82 HydrophobicContact CB-CD2 4.04Å; A33-F82 HydrophobicContact CB-CE1 4.12Å; A33-F82 HydrophobicContact CB-CE2 3.89Å; A33-F82 HydrophobicContact CB-CG 4.21Å; A33-F82 HydrophobicContact CB-CZ 3.93Å; V37-F82 HydrophobicContact CG2-CE2 3.82Å; A78-F82 WeakPolarHBondContact O-CB 3.4Å; A78-F82 WeakPolarHBondContact O-CD2 3.45Å; A78-F82 PolarHBondContact O-N 3.34Å; F82-K84 VanDerWaalsContact C-N 3.28Å; F82-K84 PolarHBondContact O-N 3.09Å; F82-Y85 PolarHBondContact O-N 3.14Å; F82-Y85 VanDerWaalsContact O-N 3.16Å; F82-F86 VanDerWaalsContact O-CD2 3.24Å; F82-F86 WeakPolarHBondContact O-CD2 3.49Å; F82-F86 PolarHBondContact O-N 3.48Å
83	W	86.4	Confident	79.7	Confident	158 Å²	158	87.1 Å²	87.1	60%	0.598	44%	0.436	S	S	*	.	H	α-helix	trans	-59.1	-41.5	177.3	179.8	68.8	0	0	0	111.7	L79 F80 F86 K87	L79-W83 WeakPolarHBondContact O-CB 3.41Å; L79-W83 PolarHBondContact O-N 2.78Å; F80-W83 HydrophobicContact CD2-CE3 4.44Å; F80-W83 HydrophobicContact CE2-CE3 4.41Å; F80-W83 HydrophobicContact CE2-CZ3 4.42Å; F80-W83 PolarHBondContact O-N 3.35Å; W83-F86 PolarHBondContact O-N 2.93Å; W83-K87 WeakPolarHBondContact O-CB 3.26Å; W83-K87 PolarHBondContact O-N 3.46Å
84	K	82.3	Confident	77.5	Confident	70 Å²	70	89.3 Å²	89.3	30%	0.304	45%	0.453	S	S	.	.	H	α-helix	trans	-62.6	-45.6	173.8	-177.8	176.9	176.3	-173.6	0	111.8	V29 F80 D81 F82 K87 Y88	V29-K84 HydrophobicContact CG1-CB 4.5Å; V29-K84 HydrophobicContact CG1-CD 4.25Å; V29-K84 HydrophobicContact CG1-CG 4.33Å; V29-K84 HydrophobicContact CG2-CD 4.42Å; F80-K84 HydrophobicContact CE1-CD 4.31Å; F80-K84 VanDerWaalsContact O-CB 3.25Å; F80-K84 WeakPolarHBondContact O-CB 3.49Å; F80-K84 PolarHBondContact O-N 2.89Å; D81-K84 PolarHBondContact O-N 3.1Å; F82-K84 VanDerWaalsContact C-N 3.28Å; F82-K84 PolarHBondContact O-N 3.09Å; K84-K87 PolarHBondContact O-N 3.1Å; K84-Y88 HydrophobicContact CG-CD2 4.07Å; K84-Y88 HydrophobicContact CG-CE2 3.61Å; K84-Y88 WeakPolarHBondContact O-CD2 3.34Å; K84-Y88 PolarHBondContact O-N 3.48Å; K84-Y88 VanDerWaalsContact O-N 3.08Å
85	Y	84.3	Confident	75.7	Confident	61 Å²	61	89.4 Å²	89.4	24%	0.239	46%	0.456	C	S	.	.	H	α-helix	trans	-61.4	-46.4	174.8	176.9	-93.3	0	0	0	112.2	L30 D81 F82 K87 Y88 T89	L30-Y85 HydrophobicContact CB-CD2 3.96Å; L30-Y85 HydrophobicContact CB-CE2 3.94Å; L30-Y85 HydrophobicContact CD1-CD2 4.31Å; L30-Y85 HydrophobicContact CD1-CE1 4.43Å; L30-Y85 HydrophobicContact CD1-CE2 4.21Å; L30-Y85 HydrophobicContact CD1-CG 4.47Å; L30-Y85 HydrophobicContact CD2-CE2 4.06Å; L30-Y85 HydrophobicContact CG-CE2 4.3Å; D81-Y85 WeakPolarHBondContact O-CB 3.33Å; D81-Y85 PolarHBondContact O-N 2.93Å; F82-Y85 PolarHBondContact O-N 3.14Å; F82-Y85 VanDerWaalsContact O-N 3.16Å; Y85-K87 PolarHBondContact O-N 3.46Å; Y85-Y88 PolarHBondContact O-N 3.24Å; Y85-T89 WeakPolarHBondContact O-CB 3.36Å; Y85-T89 PolarHBondContact O-N 3.04Å; Y85-T89 PolarHBondContact O-OG1 2.72Å
86	F	81.6	Confident	73.5	Confident	114 Å²	114	91.6 Å²	91.6	50%	0.5	48%	0.477	S	S	.	.	H	α-helix	trans	-62	-41.7	175.7	-84.8	-68.4	0	0	0	111.8	F82 W83 Y88 T89 M90	F82-F86 VanDerWaalsContact O-CD2 3.24Å; F82-F86 WeakPolarHBondContact O-CD2 3.49Å; F82-F86 PolarHBondContact O-N 3.48Å; W83-F86 PolarHBondContact O-N 2.93Å; F86-Y88 VanDerWaalsContact C-N 3.33Å; F86-Y88 PolarHBondContact O-N 3.1Å; F86-T89 PolarHBondContact O-N 3.11Å; F86-M90 WeakPolarHBondContact O-CB 3.31Å; F86-M90 PolarHBondContact O-N 2.79Å
87	K	77.3	Confident	71.6	Confident	132 Å²	132	89.1 Å²	89.1	57%	0.574	47%	0.467	S	S	*	.	H	α-helix	trans	-60.9	-37.9	175.5	-173	174.8	-178.2	175.7	0	112.8	W83 K84 Y85	W83-K87 WeakPolarHBondContact O-CB 3.26Å; W83-K87 PolarHBondContact O-N 3.46Å; K84-K87 PolarHBondContact O-N 3.1Å; Y85-K87 PolarHBondContact O-N 3.46Å
88	Y	67.8	Low	70	Confident	127 Å²	127	89.2 Å²	89.2	50%	0.498	47%	0.47	S	S	.	.	H	α-helix	trans	-79.4	-15.1	173.2	-67.4	-56.9	0	0	0	114.2	R26 K84 Y85 F86	R26-Y88 HydrophobicContact CG-CG 4.5Å; R26-Y88 PolarHBondContact NH1-O 3.34Å; K84-Y88 HydrophobicContact CG-CD2 4.07Å; K84-Y88 HydrophobicContact CG-CE2 3.61Å; K84-Y88 WeakPolarHBondContact O-CD2 3.34Å; K84-Y88 PolarHBondContact O-N 3.48Å; K84-Y88 VanDerWaalsContact O-N 3.08Å; Y85-Y88 PolarHBondContact O-N 3.24Å; F86-Y88 VanDerWaalsContact C-N 3.33Å; F86-Y88 PolarHBondContact O-N 3.1Å
89	T	71.1	Confident	68.4	Low	58 Å²	58	94.3 Å²	94.3	36%	0.356	50%	0.503	S	S	.	.	H	α-helix	trans	-88.8	-39.5	177.1	-57.9	0	0	0	0	111.4	Y85 F86 S91	Y85-T89 WeakPolarHBondContact O-CB 3.36Å; Y85-T89 PolarHBondContact O-N 3.04Å; Y85-T89 PolarHBondContact O-OG1 2.72Å; F86-T89 PolarHBondContact O-N 3.11Å; T89-S91 VanDerWaalsContact C-N 3.27Å; T89-S91 PolarHBondContact O-N 2.89Å
90	M	64.1	Low	66.6	Low	153 Å²	153	96.6 Å²	96.6	75%	0.754	51%	0.51	S	S	*	.	S	Bend	trans	-81.3	1.6	179.2	-70.2	-65.6	179.5	0	0	114.3	F86 P92	F86-M90 WeakPolarHBondContact O-CB 3.31Å; F86-M90 PolarHBondContact O-N 2.79Å; M90-P92 WeakPolarHBondContact O-CD 3.38Å
91	S	51.8	Low	65	Low	87 Å²	87	94.5 Å²	94.5	61%	0.608	50%	0.502	S	S	*	.			trans	-118.2	62.7	170.8	-164.5	0	0	0	0	111.7	T89 S93	T89-S91 VanDerWaalsContact C-N 3.27Å; T89-S91 PolarHBondContact O-N 2.89Å; S91-S93 PolarHBondContact O-N 2.98Å
92	P	53.8	Low	63.4	Low	87 Å²	87	97.2 Å²	97.2	57%	0.565	51%	0.514	S	S	*	.			trans	-72.3	107.8	173.3	31	-32.8	0	0	0	109.4	M90 T94	M90-P92 WeakPolarHBondContact O-CD 3.38Å; P92-T94 PolarHBondContact O-N 2.8Å
93	S	50.6	Low	61.8	Low	76 Å²	76	102.2 Å²	102.2	53%	0.531	54%	0.538	S	S	.	.			trans	-72.9	77.1	173.6	45.5	0	0	0	0	110.7	S91 I95	S91-S93 PolarHBondContact O-N 2.98Å; S93-I95 PolarHBondContact O-N 3.11Å; S93-I95 VanDerWaalsContact O-N 3.14Å
94	T	45.4	Very low	60.2	Low	128 Å²	128	102 Å²	102	79%	0.785	55%	0.548	S	S	*	.			trans	-58.4	115.2	-179.9	52.9	0	0	0	0	111.2	P92	P92-T94 PolarHBondContact O-N 2.8Å
95	I	52.6	Low	59	Low	53 Å²	53	103 Å²	103	27%	0.272	56%	0.556	S	S	.	*			trans	-106.3	124.8	174.9	-65.3	166.8	0	0	0	108.1	K15 M19 S93 V97	K15-I95 HydrophobicContact CD-CD1 3.82Å; K15-I95 VanDerWaalsContact CE-CD1 3.46Å; K15-I95 HydrophobicContact CG-CD1 4.25Å; M19-I95 HydrophobicContact CE-CD1 3.68Å; M19-I95 HydrophobicContact SD-CD1 3.54Å; M19-I95 VanDerWaalsContact SD-CD1 3.54Å; S93-I95 PolarHBondContact O-N 3.11Å; S93-I95 VanDerWaalsContact O-N 3.14Å; I95-V97 HydrophobicContact CG2-CG2 3.96Å; I95-V97 PolarHBondContact O-N 3.18Å; I95-V97 VanDerWaalsContact O-N 3.15Å
96	A	44.6	Very low	57.3	Low	107 Å²	107	103 Å²	103	88%	0.884	57%	0.574	S	S	*	*			trans	-67.7	110	169.7	0	0	0	0	0	109.6
97	V	52.9	Low	55.9	Low	63 Å²	63	100.7 Å²	100.7	38%	0.382	57%	0.567	S	S	.	*			trans	-111.4	134.1	175.6	179.8	0	0	0	0	108.1	I95 Q101	I95-V97 HydrophobicContact CG2-CG2 3.96Å; I95-V97 PolarHBondContact O-N 3.18Å; I95-V97 VanDerWaalsContact O-N 3.15Å; V97-Q101 HydrophobicContact CG1-CB 3.66Å
98	T	57.4	Low	54.3	Low	73 Å²	73	105.2 Å²	105.2	45%	0.448	58%	0.58	S	S	.	*			trans	-75.3	149.3	178.5	61.1	0	0	0	0	110.9	Q100 Q101 H102	T98-Q100 PolarHBondContact O-N 3.26Å; T98-Q100 VanDerWaalsContact O-N 3.1Å; T98-Q101 VanDerWaalsContact N-OE1 3.11Å; T98-Q101 WeakPolarHBondContact O-CB 3.45Å; T98-Q101 PolarHBondContact O-N 2.8Å; T98-Q101 WeakPolarHBondContact OG1-CG 3.42Å; T98-Q101 PolarHBondContact OG1-OE1 3.35Å; T98-H102 PolarHBondContact O-N 3.05Å; T98-H102 VanDerWaalsContact O-N 3.11Å
99	P	55.8	Low	53.1	Low	111 Å²	111	106.5 Å²	106.5	72%	0.721	60%	0.596	S	S	*	*	H	α-helix	trans	-59.5	-28.4	-173.7	20.4	-32.9	0	0	0	114.1	H102 H103	P99-H102 PolarHBondContact O-N 3.43Å; P99-H103 PolarHBondContact O-N 2.93Å
100	Q	53.5	Low	51.7	Low	166 Å²	166	105.6 Å²	105.6	78%	0.776	59%	0.59	S	S	*	*	H	α-helix	trans	-68.1	-38.7	174.3	-67	178.3	-10.8	0	0	112.3	T98 H103 L104	T98-Q100 PolarHBondContact O-N 3.26Å; T98-Q100 VanDerWaalsContact O-N 3.1Å; Q100-H103 PolarHBondContact O-N 2.99Å; Q100-L104 PolarHBondContact O-N 3.44Å
101	Q	55.5	Low	50.3	Low	73 Å²	73	107 Å²	107	34%	0.341	60%	0.6	S	S	.	*	H	α-helix	trans	-70.1	-33.8	176.1	-68.2	164.8	-32.6	0	0	111.7	V97 T98 H103 L104 L105	V97-Q101 HydrophobicContact CG1-CB 3.66Å; T98-Q101 VanDerWaalsContact N-OE1 3.11Å; T98-Q101 WeakPolarHBondContact O-CB 3.45Å; T98-Q101 PolarHBondContact O-N 2.8Å; T98-Q101 WeakPolarHBondContact OG1-CG 3.42Å; T98-Q101 PolarHBondContact OG1-OE1 3.35Å; Q101-H103 VanDerWaalsContact C-N 3.35Å; Q101-H103 PolarHBondContact O-N 2.91Å; Q101-L104 PolarHBondContact O-N 3.29Å; Q101-L105 WeakPolarHBondContact O-CB 3.24Å; Q101-L105 WeakPolarHBondContact O-CG 3.45Å; Q101-L105 PolarHBondContact O-N 3.3Å
102	H	55.3	Low	49.8	Very low	80 Å²	80	107.7 Å²	107.7	37%	0.37	60%	0.596	S	S	.	*	H	α-helix	trans	-61.3	-41.1	175.6	-168.2	-76	0	0	0	112.3	T98 P99 G106 L107	T98-H102 PolarHBondContact O-N 3.05Å; T98-H102 VanDerWaalsContact O-N 3.11Å; P99-H102 PolarHBondContact O-N 3.43Å; H102-G106 PolarHBondContact O-N 3.41Å; H102-L107 PolarHBondContact CE1-O 3.13Å; H102-L107 PolarHBondContact NE2-O 2.75Å
103	H	52.8	Low	48.8	Very low	169 Å²	169	112.1 Å²	112.1	78%	0.782	61%	0.609	S	S	*	*	H	α-helix	trans	-65.8	-44.1	174.6	-172.8	70.5	0	0	0	111.8	P99 Q100 Q101 L105 G106	P99-H103 PolarHBondContact O-N 2.93Å; Q100-H103 PolarHBondContact O-N 2.99Å; Q101-H103 VanDerWaalsContact C-N 3.35Å; Q101-H103 PolarHBondContact O-N 2.91Å; H103-L105 VanDerWaalsContact C-N 3.33Å; H103-L105 PolarHBondContact O-N 3.02Å; H103-G106 PolarHBondContact O-N 3.38Å
104	L	53.8	Low	47.9	Very low	155 Å²	155	114 Å²	114	81%	0.812	62%	0.62	S	S	*	*	H	α-helix	trans	-72.1	-23.3	-175.6	-151.3	145.6	0	0	0	113.4	Q100 Q101	Q100-L104 PolarHBondContact O-N 3.44Å; Q101-L104 PolarHBondContact O-N 3.29Å
105	L	57.2	Low	47.2	Very low	90 Å²	90	113 Å²	113	47%	0.471	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.8	-5.3	176.6	-71	168.5	0	0	0	114.5	Q101 H103 L107	Q101-L105 WeakPolarHBondContact O-CB 3.24Å; Q101-L105 WeakPolarHBondContact O-CG 3.45Å; Q101-L105 PolarHBondContact O-N 3.3Å; H103-L105 VanDerWaalsContact C-N 3.33Å; H103-L105 PolarHBondContact O-N 3.02Å; L105-L107 VanDerWaalsContact C-N 3.25Å; L105-L107 HydrophobicContact CB-CD1 4.2Å; L105-L107 HydrophobicContact CB-CG 4.11Å; L105-L107 PolarHBondContact O-N 2.94Å
106	G	48.9	Very low	46.3	Very low	60 Å²	60	115.9 Å²	115.9	62%	0.619	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.7	17.7	174.7	0	0	0	0	0	115.9	H102 H103 R108	H102-G106 PolarHBondContact O-N 3.41Å; H103-G106 PolarHBondContact O-N 3.38Å; G106-R108 VanDerWaalsContact C-N 3.27Å; G106-R108 PolarHBondContact O-N 3.04Å
107	L	52.6	Low	45.9	Very low	67 Å²	67	117 Å²	117	35%	0.351	64%	0.639	S	S	.	*			trans	-74.4	69.7	-176	-65.8	173.1	0	0	0	112	H102 L105	H102-L107 PolarHBondContact CE1-O 3.13Å; H102-L107 PolarHBondContact NE2-O 2.75Å; L105-L107 VanDerWaalsContact C-N 3.25Å; L105-L107 HydrophobicContact CB-CD1 4.2Å; L105-L107 HydrophobicContact CB-CG 4.11Å; L105-L107 PolarHBondContact O-N 2.94Å
108	R	43.5	Very low	44.9	Very low	227 Å²	227	123.1 Å²	123.1	86%	0.857	66%	0.663	S	S	*	*			trans	-73.8	-28.2	-170.4	-164.8	166.5	179.5	161.6	-0.9	114.9	G106	G106-R108 VanDerWaalsContact C-N 3.27Å; G106-R108 PolarHBondContact O-N 3.04Å
109	N	43	Very low	43.5	Very low	154 Å²	154	127.6 Å²	127.6	82%	0.824	68%	0.676	S	S	*	*	S	Bend	trans	-135.7	49.9	-167.1	-66.3	-8.6	0	0	0	113.8
110	T	39.9	Very low	42.4	Very low	38 Å²	38	128.7 Å²	128.7	23%	0.233	68%	0.683	C	S	.	*			trans	-114.5	132.6	169.7	48.6	0	0	0	0	110.4	I112	T110-I112 PolarHBondContact O-N 3.17Å
111	N	35.3	Very low	41.2	Very low	183 Å²	183	128.1 Å²	128.1	98%	0.979	68%	0.681	S	S	*	*			trans	-73	62.6	179.3	-75.8	-23.7	0	0	0	112.3
112	I	41.4	Very low	39.8	Very low	102 Å²	102	134 Å²	134	52%	0.523	71%	0.705	S	S	.	*			trans	-101.8	105.3	174.3	-58.3	175.5	0	0	0	106.7	T110 P114	T110-I112 PolarHBondContact O-N 3.17Å; I112-P114 WeakPolarHBondContact O-CD 3.3Å
113	Q	32.6	Very low	38.5	Very low	179 Å²	179	137.9 Å²	137.9	84%	0.836	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-65.7	122	-177.6	-172.9	-178.2	21.4	0	0	110.6	S115	Q113-S115 PolarHBondContact O-N 3.35Å
114	P	31.5	Very low	37.3	Very low	116 Å²	116	136.2 Å²	136.2	75%	0.753	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-72.8	118.9	170.4	29.3	-31.9	0	0	0	109.3	I112	I112-P114 WeakPolarHBondContact O-CD 3.3Å
115	S	30.4	Very low	36	Very low	107 Å²	107	134.7 Å²	134.7	75%	0.748	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-69.1	141.8	171.9	49.4	0	0	0	0	110.8	Q113	Q113-S115 PolarHBondContact O-N 3.35Å
116	P	34.1	Very low	34.7	Very low	113 Å²	113	136.3 Å²	136.3	73%	0.734	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-70.3	149.9	-178.5	29	-35.1	0	0	0	111.8	Q118	P116-Q118 PolarHBondContact O-N 3.34Å
117	P	35.9	Very low	33.6	Very low	131 Å²	131	137.8 Å²	137.8	85%	0.851	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-73	121.5	-178.8	29.3	-34.1	0	0	0	111.5
118	Q	31.6	Very low	33.5	Very low	192 Å²	192	140.6 Å²	140.6	90%	0.897	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-74.3	136.9	166.9	-78.4	-175	-37.2	0	0	110.9	P116	P116-Q118 PolarHBondContact O-N 3.34Å
119	K	28.1	Very low	32.7	Very low	167 Å²	167	134 Å²	134	73%	0.726	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-59.5	138.7	168.1	-81.7	175.4	154.2	-163.4	0	110.8	E121	K119-E121 IonicContact NZ-OE2 3.7Å; K119-E121 PolarHBondContact NZ-OE2 3.38Å
120	P	34.1	Very low	32.1	Very low	133 Å²	133	135.3 Å²	135.3	86%	0.864	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-81.9	121.3	155.3	32.3	-28.9	0	0	0	109.7
121	E	28.2	Very low	31.4	Very low	155 Å²	155	137.6 Å²	137.6	72%	0.724	77%	0.768	S	S	*	*			trans	-127.6	147.5	173.4	-158	142.4	-174.4	0	0	109.5	K119	K119-E121 IonicContact NZ-OE2 3.7Å; K119-E121 PolarHBondContact NZ-OE2 3.38Å
122	K	26.3	Very low	31	Very low	196 Å²	196	134.3 Å²	134.3	85%	0.852	76%	0.76	S	S	*	*			trans	-69.7	168.7	-175.1	-69.7	172.9	175.6	172.5	0	110.6
123	K	27.1	Very low	31	Very low	162 Å²	162	134.5 Å²	134.5	70%	0.704	77%	0.767	S	S	*	*			cis	-159.1	-178.5	30.9	-137.6	170.9	178.9	-128.1	0	106.8
124	E	26.8	Very low	30.9	Very low	133 Å²	133	133.1 Å²	133.1	62%	0.621	77%	0.765	S	S	*	*			cis	-157.9	157.9	6.8	-175.4	104.6	-100	0	0	108
125	T	27.8	Very low	30.8	Very low	123 Å²	123	135.1 Å²	135.1	76%	0.755	76%	0.764	S	S	*	*			trans	-131.6	137.2	157.2	-52.2	0	0	0	0	108.9
126	P	30.6	Very low	30.8	Very low	124 Å²	124	133.6 Å²	133.6	81%	0.805	77%	0.766	S	S	*	*			trans	-66.7	161.2	176.9	-21.8	34.3	0	0	0	114.8
127	A	25.2	Very low	30.7	Very low	91 Å²	91	136.4 Å²	136.4	75%	0.752	77%	0.769	S	S	*	*			trans	-160.2	-173.6	-174.8	0	0	0	0	0	108.8
128	P	50.3	Low	30.5	Very low	127 Å²	127	136 Å²	136	83%	0.825	77%	0.769	S	S	*	*			cis	-132.4	168.6	-48.2	33.9	-18.3	0	0	0	113.7
129	A	26.3	Very low	30.5	Very low	88 Å²	88	132.1 Å²	132.1	73%	0.727	76%	0.758	S	S	*	*			trans	-177.4	156.5	149.7	0	0	0	0	0	109.5
130	Q	29.6	Very low	30.6	Very low	181 Å²	181	131 Å²	131	85%	0.846	76%	0.76	S	S	*	*			cis	-167.6	156.8	-20.4	-103	177.6	1.8	0	0	106.4
131	S	27	Very low	30.5	Very low	87 Å²	87	129.6 Å²	129.6	61%	0.608	75%	0.753	S	S	*	*			cis	-175.9	143.1	-34.1	49	0	0	0	0	110.4
132	S	26.8	Very low	30.6	Very low	114 Å²	114	132 Å²	132	80%	0.797	76%	0.761	S	S	*	*			trans	72.6	164	152.3	-60.5	0	0	0	0	119.3
133	P	40.9	Very low	30.9	Very low	106 Å²	106	128.5 Å²	128.5	69%	0.688	76%	0.761	S	S	*	*			cis	-140.3	-172.5	-35.6	34.9	-15	0	0	0	115.1
134	L	30.5	Very low	31.3	Very low	149 Å²	149	126.6 Å²	126.6	78%	0.78	77%	0.766	S	S	*	*			trans	79	139.9	160.9	-56.8	174	0	0	0	118.4
135	Q	29.2	Very low	31.5	Very low	158 Å²	158	125.8 Å²	125.8	74%	0.738	78%	0.775	S	S	*	*			cis	-158.4	135.7	-19.8	-175.4	168.7	-0.6	0	0	110
136	G	29.7	Very low	31.8	Very low	76 Å²	76	131.6 Å²	131.6	78%	0.784	78%	0.783	S	S	*	*			trans	177.4	97.2	176.8	0	0	0	0	0	110.7
137	Q	32.6	Very low	31.9	Very low	172 Å²	172	131.3 Å²	131.3	80%	0.804	78%	0.781	S	S	*	*			trans	-84.3	134.8	-166.5	-69.1	170.6	-59.1	0	0	112.8	V139	Q137-V139 HydrophobicContact CB-CG2 4.37Å
138	S	31.9	Very low	32.3	Very low	123 Å²	123	132.2 Å²	132.2	86%	0.86	79%	0.788	S	S	*	*			trans	-108.2	130.5	161.5	-178.7	0	0	0	0	108.4
139	V	32.1	Very low	31.3	Very low	110 Å²	110	131.1 Å²	131.1	67%	0.667	78%	0.784	S	S	*	*			trans	-133.9	111.5	-175.2	-176.4	0	0	0	0	111.1	Q137	Q137-V139 HydrophobicContact CB-CG2 4.37Å
140	L	29.8	Very low	31.6	Very low	144 Å²	144	132.4 Å²	132.4	75%	0.754	79%	0.787	S	S	*	*			trans	34.8	105.4	148.4	-54.5	179	0	0	0	119.5
141	S	31.2	Very low	31.7	Very low	103 Å²	103	128.8 Å²	128.8	72%	0.72	78%	0.782	S	S	*	*			trans	1.6	117.4	132.8	56	0	0	0	0	119
142	F	30	Very low	32	Very low	205 Å²	205	130.1 Å²	130.1	90%	0.899	79%	0.789	S	S	*	*			trans	-151.3	139	142.1	-97.4	-74.2	0	0	0	109.9
143	S	32.6	Very low	32.1	Very low	122 Å²	122	134.2 Å²	134.2	85%	0.853	79%	0.792	S	S	*	*			trans	-116.7	108.1	175.3	-68.2	0	0	0	0	110.4
144	P	36.4	Very low	31.6	Very low	123 Å²	123	138.8 Å²	138.8	80%	0.799	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-77.2	124.8	174.2	-14.3	30.3	0	0	0	111.5
145	S	31.1	Very low	31.5	Very low	115 Å²	115	137 Å²	137	80%	0.804	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-66.5	132.8	165.7	44.2	0	0	0	0	110.3
146	R	33.2	Very low	31.9	Very low	246 Å²	246	135.1 Å²	135.1	93%	0.928	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-81.3	127.7	174.1	-74.1	-170.9	175	-153.9	-0.6	110.6
147	P	34.3	Very low	31.7	Very low	118 Å²	118	137 Å²	137	77%	0.766	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-73.2	157.8	166.9	32	-34.5	0	0	0	111
148	A	32.3	Very low	31.5	Very low	110 Å²	110	134.6 Å²	134.6	91%	0.909	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-82	128.6	173.6	0	0	0	0	0	110.8
149	S	29.9	Very low	31.3	Very low	104 Å²	104	135.2 Å²	135.2	73%	0.727	80%	0.803	S	S	*	*			trans	-122.1	115.8	178.8	60.6	0	0	0	0	112.1
150	S	31.9	Very low	31.7	Very low	114 Å²	114	135.5 Å²	135.5	80%	0.797	81%	0.808	S	S	*	*			trans	15.4	117.9	151.3	56	0	0	0	0	118.9
151	S	31.4	Very low	31.4	Very low	106 Å²	106	133.8 Å²	133.8	74%	0.741	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-64.2	149.8	156.1	46	0	0	0	0	111.4
152	P	34.7	Very low	31.2	Very low	115 Å²	115	139.6 Å²	139.6	75%	0.747	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-72.9	136.9	-178.8	29.3	-34.6	0	0	0	112
153	K	27.9	Very low	31.2	Very low	200 Å²	200	134.7 Å²	134.7	87%	0.87	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-93.7	135.4	167.6	-66.4	-179.1	177.9	-178.8	0	109.4
154	F	30.5	Very low	31.7	Very low	202 Å²	202	134.6 Å²	134.6	89%	0.886	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-95.3	142.5	162.3	-79.6	-86.4	0	0	0	109.8
155	S	28	Very low	32.3	Very low	111 Å²	111	133.6 Å²	133.6	78%	0.776	80%	0.796	S	S	*	*			trans	-113	152.2	172.5	-66.7	0	0	0	0	110.3
156	P	38.3	Very low	32.2	Very low	119 Å²	119	136.5 Å²	136.5	77%	0.773	80%	0.802	S	S	*	*			trans	-91	-171.4	-168.1	38	-38.6	0	0	0	114.2
157	S	25.8	Very low	31.9	Very low	115 Å²	115	128.3 Å²	128.3	80%	0.804	79%	0.794	S	S	*	*			trans	82.9	140	-179.4	83.4	0	0	0	0	114.3
158	C	28.2	Very low	31.6	Very low	121 Å²	121	128.4 Å²	128.4	82%	0.818	80%	0.797	S	S	*	*			cis	-131.6	171.4	2.1	-70.2	0	0	0	0	112.3
159	T	27.6	Very low	32.2	Very low	136 Å²	136	128.8 Å²	128.8	83%	0.834	79%	0.791	S	S	*	*			trans	-122.5	-171.8	169.1	53	0	0	0	0	110.1
160	P	41	Very low	32.1	Very low	116 Å²	116	129.4 Å²	129.4	75%	0.753	80%	0.795	S	S	*	*				-121.5	175.5	-70.6	38.7	-25.3	0	0	0	112.4
161	S	22.2	Very low	32.2	Very low	108 Å²	108	130.2 Å²	130.2	76%	0.755	80%	0.795	S	S	*	*			trans	-164	137.2	166.9	-93.2	0	0	0	0	117.5
162	Y	28.5	Very low	32.8	Very low	226 Å²	226	130.6 Å²	130.6	89%	0.886	80%	0.795	S	S	*	*			trans	58.7	115.4	149.9	-77	-87.8	0	0	0	124.2
163	S	28.7	Very low	32.7	Very low	102 Å²	102	130.3 Å²	130.3	71%	0.713	80%	0.796	S	S	*	*			trans	-81.1	-164.8	142	-38.6	0	0	0	0	109.5
164	P	42.9	Very low	32.8	Very low	119 Å²	119	126.6 Å²	126.6	77%	0.773	80%	0.795	S	S	*	*			cis	-137	-129.7	8	31.9	-2.4	0	0	0	114.3
165	P	49	Very low	32.9	Very low	102 Å²	102	122 Å²	122	66%	0.662	79%	0.794	S	S	*	*				-136.5	-172.2	-90.4	41.8	-24	0	0	0	118.9
166	L	29.8	Very low	32.9	Very low	177 Å²	177	120.4 Å²	120.4	93%	0.927	80%	0.795	S	S	*	*			trans	93.6	140.1	140.5	-118.8	76.4	0	0	0	121.4
167	G	26.7	Very low	32.3	Very low	73 Å²	73	118.3 Å²	118.3	75%	0.753	80%	0.796	S	S	*	*			trans	161.2	99.3	164.4	0	0	0	0	0	117.6
168	S	27.6	Very low	33.2	Very low	120 Å²	120	117.9 Å²	117.9	84%	0.839	79%	0.79	S	S	*	*			trans	-154.5	173.5	167.9	-56.7	0	0	0	0	108.3
169	P	45	Very low	33.3	Very low	118 Å²	118	120.7 Å²	120.7	77%	0.766	79%	0.789	S	S	*	*			cis	-135	-169.2	-4.2	43.9	-27.2	0	0	0	114
170	S	28.8	Very low	33.3	Very low	117 Å²	117	120 Å²	120	82%	0.818	79%	0.785	S	S	*	*			trans	175.5	164.1	134.7	40.4	0	0	0	0	113.9
171	T	33.3	Very low	33.7	Very low	131 Å²	131	120 Å²	120	80%	0.804	78%	0.784	S	S	*	*			trans	-136.1	174.9	176.5	56.8	0	0	0	0	110.4
172	P	44.8	Very low	34	Very low	114 Å²	114	120.1 Å²	120.1	74%	0.74	79%	0.785	S	S	*	*				-154.2	137.3	108.9	36.6	-17.5	0	0	0	119
173	S	31.6	Very low	34.1	Very low	109 Å²	109	116 Å²	116	76%	0.762	78%	0.784	S	S	*	*				61.3	146.9	122.6	-52.6	0	0	0	0	126.9
174	S	30.6	Very low	34.1	Very low	123 Å²	123	115.1 Å²	115.1	86%	0.86	78%	0.782	S	S	*	*			trans	97.5	141	158.3	77	0	0	0	0	117.8
175	A	32	Very low	33.3	Very low	104 Å²	104	118.6 Å²	118.6	86%	0.86	79%	0.786	S	S	*	*			cis	-162.6	164	-22.4	0	0	0	0	0	107.5
176	G	28.7	Very low	32.3	Very low	78 Å²	78	116.7 Å²	116.7	80%	0.804	79%	0.785	S	S	*	*			cis	-170.2	-178.1	-0.8	0	0	0	0	0	110.3
177	G	26.2	Very low	32.3	Very low	76 Å²	76	117.4 Å²	117.4	78%	0.784	78%	0.78	S	S	*	*			trans	-101.1	-142.3	176.5	0	0	0	0	0	113.3
178	P	44.8	Very low	32.5	Very low	105 Å²	105	120 Å²	120	68%	0.682	78%	0.781	S	S	*	*			cis	-147.2	-171.6	-5.8	28.1	-0.8	0	0	0	116.9
179	F	29.8	Very low	32.6	Very low	181 Å²	181	121 Å²	121	79%	0.794	78%	0.776	S	S	*	*			trans	73.1	110.4	157.3	-59.1	-53.1	0	0	0	121.3
180	T	27.4	Very low	31.6	Very low	122 Å²	122	122.1 Å²	122.1	75%	0.748	78%	0.776	S	S	*	*				70.6	166	67.7	68.4	0	0	0	0	116.2
181	P	49.5	Very low	31.7	Very low	114 Å²	114	126.7 Å²	126.7	74%	0.74	78%	0.777	S	S	*	*			cis	-140.4	-179.2	-7.6	35.8	-14.5	0	0	0	118
182	S	28.6	Very low	31.5	Very low	111 Å²	111	124.7 Å²	124.7	78%	0.776	77%	0.769	S	S	*	*			trans	73.3	161.7	144.1	-118.3	0	0	0	0	120.8
183	V	30.6	Very low	30.7	Very low	140 Å²	140	128.1 Å²	128.1	85%	0.848	78%	0.775	S	S	*	*			cis	-134.1	-175.3	5.1	-160.4	0	0	0	0	110.5
184	A	28.2	Very low	30.4	Very low	83 Å²	83	128.1 Å²	128.1	69%	0.686	78%	0.775	S	S	*	*			trans	-126.2	-165.7	-170.7	0	0	0	0	0	115.8
185	F	26.6	Very low	30.4	Very low	192 Å²	192	128 Å²	128	84%	0.842	77%	0.774	S	S	*	*			trans	76.6	142.3	176	-92.2	-108.5	0	0	0	118.1
186	G	28.3	Very low	30.2	Very low	63 Å²	63	126.3 Å²	126.3	65%	0.649	77%	0.766	S	S	*	*			cis	158.3	174.3	-11.3	0	0	0	0	0	114.6
187	K	30.2	Very low	30.1	Very low	191 Å²	191	127.8 Å²	127.8	83%	0.83	76%	0.764	S	S	*	*			trans	72	152.8	165.4	-74.9	-177.2	-178.8	-179.5	0	117.8
188	V	29.3	Very low	30.6	Very low	128 Å²	128	128.7 Å²	128.7	78%	0.776	76%	0.759	S	S	*	*			cis	-160.8	158.8	-19.6	95.2	0	0	0	0	107.9
189	L	29.4	Very low	30.3	Very low	140 Å²	140	129.2 Å²	129.2	73%	0.733	76%	0.762	S	S	*	*				-173.4	-134.3	87.8	-146.9	168.1	0	0	0	110.7
190	N	25.2	Very low	30.1	Very low	143 Å²	143	130.2 Å²	130.2	77%	0.765	76%	0.762	S	S	*	*			trans	-162.7	167.4	-172.5	-93.1	-31.3	0	0	0	111.5
191	Y	29.5	Very low	29.9	Very low	212 Å²	212	133.3 Å²	133.3	83%	0.831	77%	0.768	S	S	*	*				-162.7	127.5	122.3	-116	-78.2	0	0	0	113.2
192	S	30.2	Very low	28.7	Very low	90 Å²	90	134.5 Å²	134.5	63%	0.629	77%	0.768	S	S	*	*			trans	41	148.4	149.5	56.8	0	0	0	0	124.1
193	Q	28	Very low	28.5	Very low	185 Å²	185	134.2 Å²	134.2	86%	0.864	77%	0.766	S	S	*	*			cis	-178.2	132	-28.8	-126.3	173.7	-7	0	0	111.4
194	S	26.3	Very low	28.3	Very low	109 Å²	109	135.5 Å²	135.5	76%	0.762	77%	0.766	S	S	*	*			trans	170.2	115.8	143.2	38.3	0	0	0	0	108.7
195	S	28.7	Very low	28.1	Very low	121 Å²	121	134.8 Å²	134.8	85%	0.846	77%	0.767	S	S	*	*				68.8	112.3	52.9	76.2	0	0	0	0	114.7
196	G	27.9	Very low	27.9	Very low	68 Å²	68	131.9 Å²	131.9	70%	0.701	77%	0.771	S	S	*	*			cis	174.7	162	-7	0	0	0	0	0	116
197	S	27	Very low	27.8	Very low	109 Å²	109	132.8 Å²	132.8	76%	0.762	77%	0.772	S	S	*	*			trans	30.9	128.9	141.4	53.7	0	0	0	0	121.4
198	S	36.4	Very low	27.7	Very low	95 Å²	95	133.3 Å²	133.3	66%	0.664	78%	0.778	S	S	*	*			cis	70.9	130.4	47.8	83.1	0	0	0	0	116.2
199	P	38.2	Very low	27.5	Very low	117 Å²	117	132.7 Å²	132.7	76%	0.76	78%	0.779	S	S	*	*				-138.2	139.6	110.9	26.2	-7.9	0	0	0	113.6
200	Y	25.6	Very low	27.4	Very low	202 Å²	202	131.9 Å²	131.9	79%	0.792	79%	0.785	S	S	*	*				64.2	135.2	82.6	-71.5	-68.1	0	0	0	114.6
201	Q	24.1	Very low	27.6	Very low	186 Å²	186	128 Å²	128	87%	0.869	78%	0.778	S	S	*	*				-160.9	160.1	70.3	-165.8	167.5	-29.4	0	0	114.6
202	N	23.9	Very low	27.6	Very low	140 Å²	140	126.1 Å²	126.1	75%	0.749	78%	0.782	S	S	*	*			trans	-78.2	177.5	170.7	-57.2	-30.7	0	0	0	111.1
203	S	25.4	Very low	27.7	Very low	104 Å²	104	133.4 Å²	133.4	73%	0.727	80%	0.796	S	S	*	*			cis	-159.8	158.1	13.8	-146.9	0	0	0	0	107.2
204	I	26	Very low	27.6	Very low	167 Å²	167	129.1 Å²	129.1	86%	0.856	79%	0.792	S	S	*	*				176.4	156.6	70.9	-120.9	151.5	0	0	0	107.7
205	G	23.9	Very low	27.7	Very low	68 Å²	68	135.4 Å²	135.4	70%	0.701	80%	0.799	S	S	*	*			trans	114.5	84.8	147.7	0	0	0	0	0	121.6
206	S	23.4	Very low	27.8	Very low	131 Å²	131	140.7 Å²	140.7	92%	0.916	80%	0.802	S	S	*	*			trans	66.9	161.4	138	-144.9	0	0	0	0	123.4
207	A	26.2	Very low	27.8	Very low	83 Å²	83	149.2 Å²	149.2	69%	0.686	81%	0.813	S	S	*	*			trans	76.3	100	160.8	0	0	0	0	0	121.2
208	E	26.2	Very low	27.9	Very low	202 Å²	202	150.3 Å²	150.3	94%	0.944	82%	0.815	S	S	*	*			trans	75	154.1	138.3	-60.5	-163.8	159.9	0	0	122.2
209	S	26.5	Very low	27.4	Very low	115 Å²	115	151 Å²	151	80%	0.804	82%	0.82	S	S	*	*			trans	-118	153.9	-168.4	58	0	0	0	0	111.4
210	S	27.6	Very low	27	Very low	123 Å²	123	151.3 Å²	151.3	86%	0.86	82%	0.822	S	S	*	*				-175.9	160.7	120.9	-165.9	0	0	0	0	110.6
211	G	28.2	Very low	27.1	Very low	60 Å²	60	146.4 Å²	146.4	62%	0.619	82%	0.818	S	S	*	*			trans	-119.3	162.2	176.3	0	0	0	0	0	113.4
212	L	30.8	Very low	27.4	Very low	173 Å²	173	143.5 Å²	143.5	91%	0.906	81%	0.812	S	S	*	*			trans	79.8	104.6	163.7	-50.6	178.3	0	0	0	119.2
213	R	31.1	Very low	27.6	Very low	244 Å²	244	145.5 Å²	145.5	92%	0.921	81%	0.814	S	S	*	*				83.6	91.1	120.3	-162.5	-177.3	-161.9	149.4	4.9	120.4
214	A	26.2	Very low	27.9	Very low	95 Å²	95	147.5 Å²	147.5	79%	0.785	82%	0.817	S	S	*	*			trans	-138.1	114	146.3	0	0	0	0	0	109.1
215	R	29.6	Very low	28.1	Very low	240 Å²	240	144.2 Å²	144.2	91%	0.906	81%	0.809	S	S	*	*				55.2	115.5	93.2	-68.2	-162.3	-168.6	-158.2	6.6	114.8
216	Y	29.5	Very low	28.8	Very low	233 Å²	233	147.4 Å²	147.4	91%	0.914	82%	0.817	S	S	*	*			trans	-43.8	136.1	169.9	-64.5	-97.3	0	0	0	113.9
217	R	27.1	Very low	29.6	Very low	246 Å²	246	144.8 Å²	144.8	93%	0.928	81%	0.811	S	S	*	*			trans	-132.8	120.5	151.5	-80	-170.7	170.8	-167	-1.8	108.5
218	T	30	Very low	30	Very low	132 Å²	132	144 Å²	144	81%	0.81	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-80.4	146.1	166.8	44.6	0	0	0	0	109.9
219	S	26.4	Very low	31.1	Very low	111 Å²	111	143.4 Å²	143.4	78%	0.776	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-63.4	149.1	177	-52.6	0	0	0	0	111.9	S221	S219-S221 PolarHBondContact O-N 3.3Å
220	P	29	Very low	32.1	Very low	123 Å²	123	145.2 Å²	145.2	80%	0.799	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-71.9	121.7	173.2	-9.9	26.1	0	0	0	110.3
221	S	28.8	Very low	33.2	Very low	99 Å²	99	145.7 Å²	145.7	69%	0.692	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-76.3	120.2	166.5	43	0	0	0	0	109.7	S219 F223	S219-S221 PolarHBondContact O-N 3.3Å; S221-F223 PolarHBondContact O-N 3.15Å; S221-F223 VanDerWaalsContact O-N 3.08Å
222	V	29.2	Very low	34.2	Very low	124 Å²	124	151.8 Å²	151.8	75%	0.752	79%	0.789	S	S	*	*			trans	-75.8	99.3	178.2	-177.2	0	0	0	0	109.3	N224	V222-N224 WeakPolarHBondContact CG1-OD1 3.48Å; V222-N224 PolarHBondContact O-N 3.39Å
223	F	29.8	Very low	35.5	Very low	182 Å²	182	148.2 Å²	148.2	80%	0.798	77%	0.768	S	S	*	*			trans	-75.2	102.4	161.5	-98	-90	0	0	0	108.8	S221 S225	S221-F223 PolarHBondContact O-N 3.15Å; S221-F223 VanDerWaalsContact O-N 3.08Å; F223-S225 PolarHBondContact O-N 3.39Å
224	N	30.4	Very low	36.9	Very low	147 Å²	147	145.1 Å²	145.1	79%	0.786	76%	0.764	S	S	*	*			trans	-61.7	110.5	169	-80.9	3.9	0	0	0	109.2	V222	V222-N224 WeakPolarHBondContact CG1-OD1 3.48Å; V222-N224 PolarHBondContact O-N 3.39Å
225	S	30	Very low	38.9	Very low	98 Å²	98	144.1 Å²	144.1	69%	0.685	75%	0.746	S	S	*	*			trans	-94.3	132.9	163.9	-58	0	0	0	0	108	F223 G227	F223-S225 PolarHBondContact O-N 3.39Å; S225-G227 PolarHBondContact O-N 3.13Å
226	P	39.2	Very low	40.6	Very low	135 Å²	135	139.6 Å²	139.6	88%	0.877	74%	0.739	S	S	*	*	S	Bend	trans	-64.9	108.5	178.8	26.4	-33.2	0	0	0	109.2
227	G	40.9	Very low	42.4	Very low	76 Å²	76	135.2 Å²	135.2	78%	0.784	73%	0.725	S	S	*	*			trans	-159.3	21.9	-160.7	0	0	0	0	0	115	S225	S225-G227 PolarHBondContact O-N 3.13Å
228	S	34.4	Very low	44.3	Very low	65 Å²	65	125 Å²	125	46%	0.455	69%	0.691	S	S	.	*			trans	-122.4	165	169.1	117.6	0	0	0	0	109.1	E230	S228-E230 WeakPolarHBondContact CB-OE2 3.47Å; S228-E230 PolarHBondContact OG-N 3.37Å; S228-E230 VanDerWaalsContact OG-N 3.16Å; S228-E230 PolarHBondContact OG-OE2 3.47Å
229	K	48.5	Very low	46.2	Very low	191 Å²	191	122.2 Å²	122.2	83%	0.83	67%	0.671	S	S	*	*	S	Bend	trans	-95	6.1	178.7	-90.8	-166.9	169.2	-167.4	0	113.2
230	E	48.2	Very low	48.1	Very low	153 Å²	153	121.9 Å²	121.9	72%	0.715	66%	0.657	S	S	*	*	S	Bend	trans	-101.2	-11.8	-173.7	-62.4	72.6	-152.8	0	0	112.7	S228 Y232	S228-E230 WeakPolarHBondContact CB-OE2 3.47Å; S228-E230 PolarHBondContact OG-N 3.37Å; S228-E230 VanDerWaalsContact OG-N 3.16Å; S228-E230 PolarHBondContact OG-OE2 3.47Å; E230-Y232 VanDerWaalsContact C-N 3.35Å; E230-Y232 PolarHBondContact O-N 2.96Å
231	D	50.1	Low	50.2	Low	132 Å²	132	123.5 Å²	123.5	71%	0.706	65%	0.647	S	S	*	*			trans	-89	18.8	178.8	-85.8	-28.3	0	0	0	114.3	M233	D231-M233 PolarHBondContact O-N 3.41Å
232	Y	49.8	Very low	52.3	Low	189 Å²	189	123.8 Å²	123.8	74%	0.741	64%	0.636	S	S	*	*			trans	-80.9	114.3	169.5	-101.9	-98	0	0	0	110.4	E230 E234	E230-Y232 VanDerWaalsContact C-N 3.35Å; E230-Y232 PolarHBondContact O-N 2.96Å; Y232-E234 VanDerWaalsContact C-N 3.33Å; Y232-E234 PolarHBondContact O-N 3.5Å
233	M	57.4	Low	54.4	Low	97 Å²	97	122.6 Å²	122.6	48%	0.478	63%	0.625	S	S	.	*			trans	-80	76.8	179.7	-66.3	170.6	63.9	0	0	111.1	D231 D235 L239 F242	D231-M233 PolarHBondContact O-N 3.41Å; M233-D235 VanDerWaalsContact C-N 3.33Å; M233-D235 PolarHBondContact O-N 2.86Å; M233-L239 VanDerWaalsContact CE-CA 3.48Å; M233-L239 HydrophobicContact CE-CB 4.02Å; M233-L239 HydrophobicContact CE-CD1 3.81Å; M233-F242 HydrophobicContact CE-CB 3.81Å; M233-F242 HydrophobicContact CE-CD1 4.43Å; M233-F242 HydrophobicContact CE-CG 4.14Å
234	E	59.8	Low	56.3	Low	179 Å²	179	120.9 Å²	120.9	84%	0.836	61%	0.613	S	S	*	*			trans	-78.5	-8	-174	-60.8	-174.2	161	0	0	114.9	Y232	Y232-E234 VanDerWaalsContact C-N 3.33Å; Y232-E234 PolarHBondContact O-N 3.5Å
235	D	68.3	Low	58.1	Low	74 Å²	74	115.8 Å²	115.8	40%	0.396	59%	0.589	S	S	.	*			trans	-113.5	125.4	-179.5	168.1	31.3	0	0	0	112	M233 K237 S238 L239 R241	M233-D235 VanDerWaalsContact C-N 3.33Å; M233-D235 PolarHBondContact O-N 2.86Å; D235-K237 PolarHBondContact O-N 2.94Å; D235-K237 VanDerWaalsContact O-N 3.17Å; D235-K237 PolarHBondContact OD1-N 3.03Å; D235-K237 WeakPolarHBondContact OD2-CB 3.42Å; D235-S238 PolarHBondContact O-N 3.24Å; D235-S238 PolarHBondContact O-OG 3Å; D235-S238 PolarHBondContact OD2-N 3.11Å; D235-L239 PolarHBondContact O-N 3.37Å; D235-R241 IonicContact OD2-NH2 3.3Å; D235-R241 PolarHBondContact OD2-NH2 2.68Å
236	L	65.8	Low	59.8	Low	145 Å²	145	115.2 Å²	115.2	76%	0.759	58%	0.576	S	S	*	*	H	α-helix	trans	-54	-34.2	174.4	-91.4	165.9	0	0	0	113	S238 L239 E240	L236-S238 VanDerWaalsContact C-N 3.32Å; L236-S238 PolarHBondContact O-N 2.67Å; L236-L239 PolarHBondContact O-N 3.21Å; L236-E240 PolarHBondContact O-N 3.3Å
237	K	67.4	Low	61.2	Low	141 Å²	141	114.5 Å²	114.5	61%	0.613	56%	0.561	S	S	*	*	H	α-helix	trans	-74.5	-19.9	178.4	-65.2	177	177.8	175.3	0	112.7	D235 R241	D235-K237 PolarHBondContact O-N 2.94Å; D235-K237 VanDerWaalsContact O-N 3.17Å; D235-K237 PolarHBondContact OD1-N 3.03Å; D235-K237 WeakPolarHBondContact OD2-CB 3.42Å; K237-R241 VanDerWaalsContact C-NH2 3.33Å; K237-R241 PolarHBondContact O-N 3.12Å; K237-R241 PolarHBondContact O-NE 2.94Å; K237-R241 PolarHBondContact O-NH2 3.06Å
238	S	67.9	Low	62.1	Low	33 Å²	33	117.8 Å²	117.8	23%	0.231	56%	0.555	C	S	.	*	H	α-helix	trans	-78.3	-37.8	172.9	79.4	0	0	0	0	110.7	D235 L236 R241 F242	D235-S238 PolarHBondContact O-N 3.24Å; D235-S238 PolarHBondContact O-OG 3Å; D235-S238 PolarHBondContact OD2-N 3.11Å; L236-S238 VanDerWaalsContact C-N 3.32Å; L236-S238 PolarHBondContact O-N 2.67Å; S238-R241 PolarHBondContact O-N 3.32Å; S238-F242 WeakPolarHBondContact O-CB 3.49Å; S238-F242 PolarHBondContact O-N 3.29Å
239	L	68.1	Low	63.4	Low	73 Å²	73	119.9 Å²	119.9	38%	0.382	56%	0.556	S	S	.	*	H	α-helix	trans	-59.9	-47	170.9	-179.3	61.7	0	0	0	112.4	M233 D235 L236 R241 F242 L243	M233-L239 VanDerWaalsContact CE-CA 3.48Å; M233-L239 HydrophobicContact CE-CB 4.02Å; M233-L239 HydrophobicContact CE-CD1 3.81Å; D235-L239 PolarHBondContact O-N 3.37Å; L236-L239 PolarHBondContact O-N 3.21Å; L239-R241 VanDerWaalsContact C-N 3.35Å; L239-R241 PolarHBondContact O-N 3.22Å; L239-F242 PolarHBondContact O-N 3.33Å; L239-L243 HydrophobicContact CD1-CD1 4.09Å; L239-L243 HydrophobicContact CD1-CG 4.14Å; L239-L243 HydrophobicContact CG-CD1 4.01Å; L239-L243 HydrophobicContact CG-CG 4.48Å; L239-L243 WeakPolarHBondContact O-CG 3.44Å; L239-L243 PolarHBondContact O-N 3.39Å
240	E	67.4	Low	63.4	Low	103 Å²	103	113 Å²	113	48%	0.481	53%	0.532	S	S	.	.	H	α-helix	trans	-61.9	-41.5	178.2	-160.2	-160.5	149.3	0	0	112.2	L236 R244	L236-E240 PolarHBondContact O-N 3.3Å; E240-R244 WeakPolarHBondContact O-CB 3.42Å; E240-R244 PolarHBondContact O-N 3.43Å; E240-R244 IonicContact OE1-CZ 3.78Å; E240-R244 IonicContact OE1-NH2 2.65Å; E240-R244 PolarHBondContact OE1-NH2 3.43Å
241	R	72.5	Confident	63.4	Low	157 Å²	157	110.9 Å²	110.9	59%	0.592	52%	0.522	S	S	*	.	H	α-helix	trans	-64.2	-40.6	174.5	-83.2	173.6	-78.1	153.4	-3.1	112.3	D235 K237 S238 L239 S245	D235-R241 IonicContact OD2-NH2 3.3Å; D235-R241 PolarHBondContact OD2-NH2 2.68Å; K237-R241 VanDerWaalsContact C-NH2 3.33Å; K237-R241 PolarHBondContact O-N 3.12Å; K237-R241 PolarHBondContact O-NE 2.94Å; K237-R241 PolarHBondContact O-NH2 3.06Å; S238-R241 PolarHBondContact O-N 3.32Å; L239-R241 VanDerWaalsContact C-N 3.35Å; L239-R241 PolarHBondContact O-N 3.22Å; R241-S245 WeakPolarHBondContact O-CB 3.39Å; R241-S245 PolarHBondContact O-N 3.09Å; R241-S245 VanDerWaalsContact O-N 3.12Å
242	F	74.1	Confident	63.4	Low	105 Å²	105	114.5 Å²	114.5	46%	0.461	53%	0.526	S	S	.	.	H	α-helix	trans	-64	-52	177.5	179.4	-97.4	0	0	0	111.4	M233 S238 L239 R244 S245 E246	M233-F242 HydrophobicContact CE-CB 3.81Å; M233-F242 HydrophobicContact CE-CD1 4.43Å; M233-F242 HydrophobicContact CE-CG 4.14Å; S238-F242 WeakPolarHBondContact O-CB 3.49Å; S238-F242 PolarHBondContact O-N 3.29Å; L239-F242 PolarHBondContact O-N 3.33Å; F242-R244 VanDerWaalsContact C-N 3.35Å; F242-R244 PolarHBondContact O-N 2.87Å; F242-S245 WeakPolarHBondContact O-CB 3.19Å; F242-S245 PolarHBondContact O-N 3.11Å; F242-S245 PolarHBondContact O-OG 3.16Å; F242-E246 HydrophobicContact CE1-CG 3.99Å; F242-E246 HydrophobicContact CE2-CG 4.46Å; F242-E246 HydrophobicContact CZ-CG 3.93Å; F242-E246 PolarHBondContact O-N 3.02Å
243	L	73.1	Confident	63.4	Low	100 Å²	100	109.9 Å²	109.9	52%	0.524	52%	0.521	S	S	.	.	H	α-helix	trans	-56.8	-47.1	179.1	-70.7	171	0	0	0	111.6	L239 S245 E246 E247	L239-L243 HydrophobicContact CD1-CD1 4.09Å; L239-L243 HydrophobicContact CD1-CG 4.14Å; L239-L243 HydrophobicContact CG-CD1 4.01Å; L239-L243 HydrophobicContact CG-CG 4.48Å; L239-L243 WeakPolarHBondContact O-CG 3.44Å; L239-L243 PolarHBondContact O-N 3.39Å; L243-S245 VanDerWaalsContact C-N 3.26Å; L243-S245 PolarHBondContact O-N 2.98Å; L243-E246 PolarHBondContact O-N 3.38Å; L243-E247 WeakPolarHBondContact O-CB 3.17Å; L243-E247 PolarHBondContact O-N 3.12Å
244	R	69.4	Low	62.9	Low	146 Å²	146	111.8 Å²	111.8	55%	0.551	53%	0.529	S	S	*	.	H	α-helix	trans	-60.2	-35.1	176.8	-161.4	-175.9	-61.5	-171.3	0.1	112.3	E240 F242 E248	E240-R244 WeakPolarHBondContact O-CB 3.42Å; E240-R244 PolarHBondContact O-N 3.43Å; E240-R244 IonicContact OE1-CZ 3.78Å; E240-R244 IonicContact OE1-NH2 2.65Å; E240-R244 PolarHBondContact OE1-NH2 3.43Å; F242-R244 VanDerWaalsContact C-N 3.35Å; F242-R244 PolarHBondContact O-N 2.87Å; R244-E248 WeakPolarHBondContact O-CB 3.43Å; R244-E248 PolarHBondContact O-N 2.8Å
245	S	67.1	Low	62.2	Low	39 Å²	39	110 Å²	110	27%	0.273	52%	0.524	S	S	.	.	H	α-helix	trans	-74	-29.2	177.7	81.4	0	0	0	0	114	R241 F242 L243 K249	R241-S245 WeakPolarHBondContact O-CB 3.39Å; R241-S245 PolarHBondContact O-N 3.09Å; R241-S245 VanDerWaalsContact O-N 3.12Å; F242-S245 WeakPolarHBondContact O-CB 3.19Å; F242-S245 PolarHBondContact O-N 3.11Å; F242-S245 PolarHBondContact O-OG 3.16Å; L243-S245 VanDerWaalsContact C-N 3.26Å; L243-S245 PolarHBondContact O-N 2.98Å; S245-K249 WeakPolarHBondContact O-CD 3.43Å; S245-K249 WeakPolarHBondContact O-CE 3.38Å; S245-K249 VanDerWaalsContact O-CG 3.23Å; S245-K249 WeakPolarHBondContact O-CG 3.27Å; S245-K249 PolarHBondContact O-N 3.32Å
246	E	65.7	Low	60.9	Low	86 Å²	86	109.8 Å²	109.8	40%	0.402	54%	0.539	S	S	.	.	H	α-helix	trans	-76.6	-39	171.7	-74	-61.6	118.3	0	0	111.2	F242 L243 K249 S250	F242-E246 HydrophobicContact CE1-CG 3.99Å; F242-E246 HydrophobicContact CE2-CG 4.46Å; F242-E246 HydrophobicContact CZ-CG 3.93Å; F242-E246 PolarHBondContact O-N 3.02Å; L243-E246 PolarHBondContact O-N 3.38Å; E246-K249 PolarHBondContact O-N 2.97Å; E246-K249 WeakPolarHBondContact OE1-CD 3.3Å; E246-K249 IonicContact OE1-NZ 2.61Å; E246-K249 PolarHBondContact OE1-NZ 2.8Å; E246-S250 WeakPolarHBondContact O-CB 3.47Å; E246-S250 PolarHBondContact O-N 3.38Å
247	E	69.8	Low	59.3	Low	121 Å²	121	107.4 Å²	107.4	57%	0.565	54%	0.535	S	S	*	.	H	α-helix	trans	-59.8	-46.1	173.3	-173.4	169.9	-138.2	0	0	111.3	L243 K249 S250 H251	L243-E247 WeakPolarHBondContact O-CB 3.17Å; L243-E247 PolarHBondContact O-N 3.12Å; E247-K249 PolarHBondContact O-N 2.86Å; E247-S250 WeakPolarHBondContact O-CB 3.4Å; E247-S250 PolarHBondContact O-N 3.48Å; E247-S250 VanDerWaalsContact O-N 3.12Å; E247-S250 PolarHBondContact O-OG 2.85Å; E247-H251 PolarHBondContact O-N 2.93Å
248	E	59.9	Low	58.2	Low	144 Å²	144	106.6 Å²	106.6	67%	0.673	54%	0.544	S	S	*	.	H	α-helix	trans	-63	-40.8	176	-172.1	174.7	-163.1	0	0	112.6	R244 S250 H251 R252	R244-E248 WeakPolarHBondContact O-CB 3.43Å; R244-E248 PolarHBondContact O-N 2.8Å; E248-S250 VanDerWaalsContact C-N 3.34Å; E248-H251 PolarHBondContact O-N 2.75Å; E248-R252 WeakPolarHBondContact O-CB 3.4Å; E248-R252 PolarHBondContact O-N 3.31Å
249	K	61.1	Low	56.6	Low	109 Å²	109	113.2 Å²	113.2	47%	0.474	57%	0.571	S	S	.	*	H	α-helix	trans	-62	-41.2	170.8	-72.5	167.5	-156.2	167.8	0	111.7	S245 E246 E247 R252 S253	S245-K249 WeakPolarHBondContact O-CD 3.43Å; S245-K249 WeakPolarHBondContact O-CE 3.38Å; S245-K249 VanDerWaalsContact O-CG 3.23Å; S245-K249 WeakPolarHBondContact O-CG 3.27Å; S245-K249 PolarHBondContact O-N 3.32Å; E246-K249 PolarHBondContact O-N 2.97Å; E246-K249 WeakPolarHBondContact OE1-CD 3.3Å; E246-K249 IonicContact OE1-NZ 2.61Å; E246-K249 PolarHBondContact OE1-NZ 2.8Å; E247-K249 PolarHBondContact O-N 2.86Å; K249-R252 CarbonylContact O-C 3.59Å; K249-R252 PolarHBondContact O-N 3.24Å; K249-S253 PolarHBondContact O-N 3.05Å
250	S	49.5	Very low	54.9	Low	47 Å²	47	115.2 Å²	115.2	33%	0.329	59%	0.592	S	S	.	*	H	α-helix	trans	-64.5	-43.6	179.9	85.1	0	0	0	0	111	E246 E247 E248 R252 S253 Q254	E246-S250 WeakPolarHBondContact O-CB 3.47Å; E246-S250 PolarHBondContact O-N 3.38Å; E247-S250 WeakPolarHBondContact O-CB 3.4Å; E247-S250 PolarHBondContact O-N 3.48Å; E247-S250 VanDerWaalsContact O-N 3.12Å; E247-S250 PolarHBondContact O-OG 2.85Å; E248-S250 VanDerWaalsContact C-N 3.34Å; S250-R252 PolarHBondContact O-N 3.16Å; S250-S253 WeakPolarHBondContact O-CB 3.24Å; S250-S253 PolarHBondContact O-N 3.36Å; S250-S253 VanDerWaalsContact O-N 3.08Å; S250-S253 PolarHBondContact O-OG 2.93Å; S250-Q254 PolarHBondContact O-N 3.24Å
251	H	46.5	Very low	53.3	Low	108 Å²	108	117.1 Å²	117.1	50%	0.5	61%	0.61	S	S	.	*	H	α-helix	trans	-60.3	-43.4	172.4	-101	-78.3	0	0	0	111.9	E247 E248 S253 Q254 L255	E247-H251 PolarHBondContact O-N 2.93Å; E248-H251 PolarHBondContact O-N 2.75Å; H251-S253 PolarHBondContact O-N 3.07Å; H251-Q254 PolarHBondContact O-N 3.27Å; H251-L255 PolarHBondContact O-N 2.86Å
252	R	51	Low	51.2	Low	209 Å²	209	114.8 Å²	114.8	79%	0.789	62%	0.618	S	S	*	*	H	α-helix	trans	-67.9	-14.4	176.5	-152.8	174.6	77.3	-175	5.7	113.9	E248 K249 S250	E248-R252 WeakPolarHBondContact O-CB 3.4Å; E248-R252 PolarHBondContact O-N 3.31Å; K249-R252 CarbonylContact O-C 3.59Å; K249-R252 PolarHBondContact O-N 3.24Å; S250-R252 PolarHBondContact O-N 3.16Å
253	S	49.7	Very low	49.6	Very low	91 Å²	91	116.1 Å²	116.1	64%	0.636	64%	0.637	S	S	*	*	H	α-helix	trans	-87.7	-19.3	170.4	77.8	0	0	0	0	113.9	K249 S250 H251	K249-S253 PolarHBondContact O-N 3.05Å; S250-S253 WeakPolarHBondContact O-CB 3.24Å; S250-S253 PolarHBondContact O-N 3.36Å; S250-S253 VanDerWaalsContact O-N 3.08Å; S250-S253 PolarHBondContact O-OG 2.93Å; H251-S253 PolarHBondContact O-N 3.07Å
254	Q	47.3	Very low	47.6	Very low	138 Å²	138	116.1 Å²	116.1	65%	0.645	65%	0.646	S	S	*	*	H	α-helix	trans	-86.1	-32.5	-179.7	-69.2	177.9	38.3	0	0	112.4	S250 H251 G256	S250-Q254 PolarHBondContact O-N 3.24Å; H251-Q254 PolarHBondContact O-N 3.27Å; Q254-G256 VanDerWaalsContact C-N 3.35Å; Q254-G256 PolarHBondContact O-N 3.4Å; Q254-G256 VanDerWaalsContact O-N 3.14Å
255	L	45.2	Very low	46	Very low	141 Å²	141	118.8 Å²	118.8	74%	0.738	66%	0.664	S	S	*	*	S	Bend	trans	-83.2	79.2	167.3	-73.4	97.9	0	0	0	110.5	H251 S257	H251-L255 PolarHBondContact O-N 2.86Å; L255-S257 PolarHBondContact O-N 2.62Å
256	G	39.4	Very low	44.4	Very low	69 Å²	69	121.1 Å²	121.1	71%	0.711	68%	0.68	S	S	*	*			trans	-65.1	121.8	-179.6	0	0	0	0	0	113.5	Q254	Q254-G256 VanDerWaalsContact C-N 3.35Å; Q254-G256 PolarHBondContact O-N 3.4Å; Q254-G256 VanDerWaalsContact O-N 3.14Å
257	S	33.7	Very low	43.2	Very low	96 Å²	96	122.3 Å²	122.3	67%	0.671	70%	0.695	S	S	*	*			trans	-85.7	135.2	167.4	-176	0	0	0	0	110.5	L255 E259	L255-S257 PolarHBondContact O-N 2.62Å; S257-E259 VanDerWaalsContact C-N 3.3Å; S257-E259 PolarHBondContact O-N 2.88Å
258	P	44.2	Very low	41.9	Very low	123 Å²	123	121.7 Å²	121.7	80%	0.799	70%	0.7	S	S	*	*	S	Bend	trans	-81.4	8.4	-168.8	32.6	-36.8	0	0	0	115.8
259	E	33.3	Very low	41.2	Very low	172 Å²	172	122.5 Å²	122.5	80%	0.804	70%	0.702	S	S	*	*			trans	-112.1	83.5	-172.9	-65.7	-169.2	131.1	0	0	113.5	S257	S257-E259 VanDerWaalsContact C-N 3.3Å; S257-E259 PolarHBondContact O-N 2.88Å
260	S	32.2	Very low	40.3	Very low	116 Å²	116	127 Å²	127	81%	0.811	72%	0.716	S	S	*	*			trans	-175.6	61.3	154.8	35	0	0	0	0	113
261	V	33.7	Very low	39.8	Very low	142 Å²	142	129.7 Å²	129.7	86%	0.861	73%	0.726	S	S	*	*			trans	-81	119.8	166.6	179.7	0	0	0	0	109.4
262	S	29.6	Very low	39.7	Very low	108 Å²	108	134.2 Å²	134.2	76%	0.755	74%	0.74	S	S	*	*			trans	-150.3	135.2	165	-80.4	0	0	0	0	110.7
263	P	39.9	Very low	39.3	Very low	134 Å²	134	128.6 Å²	128.6	87%	0.87	73%	0.733	S	S	*	*			trans	-92.6	119.5	-163.7	33.8	-33.9	0	0	0	113.6
264	S	31.6	Very low	39.1	Very low	100 Å²	100	132.7 Å²	132.7	70%	0.699	74%	0.735	S	S	*	*			trans	-150.4	147.3	159.7	60.3	0	0	0	0	111.5	S266	S264-S266 PolarHBondContact O-N 3.37Å
265	H	36.5	Very low	39	Very low	201 Å²	201	130.6 Å²	130.6	93%	0.931	74%	0.735	S	S	*	*			trans	-81.5	74.2	-165.1	-78.9	-95.6	0	0	0	113.9
266	S	33.1	Very low	39	Very low	89 Å²	89	129.8 Å²	129.8	62%	0.622	74%	0.736	S	S	*	*			trans	-126.5	103.4	175.8	-62.5	0	0	0	0	111.1	S264 T268	S264-S266 PolarHBondContact O-N 3.37Å; S266-T268 PolarHBondContact O-N 2.91Å
267	P	40.4	Very low	39.5	Very low	110 Å²	110	128.9 Å²	128.9	71%	0.714	73%	0.727	S	S	*	*			trans	-77.1	92	174.9	30.8	-32.7	0	0	0	110.5	F269	P267-F269 WeakPolarHBondContact O-CD2 3.4Å; P267-F269 PolarHBondContact O-N 2.72Å; P267-F269 VanDerWaalsContact O-N 3.12Å
268	T	43	Very low	40.3	Very low	108 Å²	108	129.1 Å²	129.1	66%	0.663	72%	0.72	S	S	*	*			trans	-63.5	110.9	172.1	-53.6	0	0	0	0	109.8	S266 W270	S266-T268 PolarHBondContact O-N 2.91Å; T268-W270 PolarHBondContact O-N 3.11Å
269	F	45	Very low	40.5	Very low	162 Å²	162	128.2 Å²	128.2	71%	0.711	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-11.8	-167.8	-91.5	-96.9	0	0	0	116.5	P267	P267-F269 WeakPolarHBondContact O-CD2 3.4Å; P267-F269 PolarHBondContact O-N 2.72Å; P267-F269 VanDerWaalsContact O-N 3.12Å
270	W	40.4	Very low	41.5	Very low	203 Å²	203	122.9 Å²	122.9	77%	0.769	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	21.4	-170.8	-63.9	116.3	0	0	0	114.7	T268 Y272	T268-W270 PolarHBondContact O-N 3.11Å; W270-Y272 AromaticContact CE3-CE2 3.98Å; W270-Y272 HydrophobicContact CE3-CE2 3.98Å; W270-Y272 HydrophobicContact CZ3-CE2 4.47Å; W270-Y272 PolarHBondContact O-N 2.94Å
271	N	40.9	Very low	42.4	Very low	103 Å²	103	124.9 Å²	124.9	55%	0.551	68%	0.684	S	S	*	*			trans	-86.1	90.7	177.8	-146.2	-14.9	0	0	0	110.5	S273	N271-S273 PolarHBondContact O-N 3.43Å; N271-S273 PolarHBondContact OD1-OG 3Å
272	Y	43.9	Very low	43.4	Very low	203 Å²	203	120.7 Å²	120.7	80%	0.796	66%	0.661	S	S	*	*			trans	-66.2	4.2	-173.9	-90	-88.5	0	0	0	115.8	W270	W270-Y272 AromaticContact CE3-CE2 3.98Å; W270-Y272 HydrophobicContact CE3-CE2 3.98Å; W270-Y272 HydrophobicContact CZ3-CE2 4.47Å; W270-Y272 PolarHBondContact O-N 2.94Å
273	S	43.2	Very low	44.4	Very low	91 Å²	91	120.7 Å²	120.7	64%	0.636	65%	0.652	S	S	*	*			trans	-100.2	27.4	-168	55.4	0	0	0	0	114.8	N271	N271-S273 PolarHBondContact O-N 3.43Å; N271-S273 PolarHBondContact OD1-OG 3Å
274	R	44.8	Very low	45.2	Very low	177 Å²	177	123.7 Å²	123.7	67%	0.668	65%	0.646	S	S	*	*	S	Bend	trans	-132.3	148	179.6	-73.8	-167.9	173.8	-127.1	-0.7	114.4	D278	R274-D278 IonicContact NH1-OD2 2.98Å
275	S	45.6	Very low	46.3	Very low	94 Å²	94	127.4 Å²	127.4	66%	0.657	65%	0.649	S	S	*	*			trans	-65.5	146.4	-178.1	-176.3	0	0	0	0	112.9	G277 D278	S275-G277 PolarHBondContact O-N 2.96Å; S275-G277 VanDerWaalsContact O-N 3.1Å; S275-D278 PolarHBondContact O-N 2.94Å
276	V	44.8	Very low	47	Very low	124 Å²	124	125.2 Å²	125.2	75%	0.752	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-58.9	-26.2	-174.7	-172.7	0	0	0	0	112.9	D278 Y279	V276-D278 PolarHBondContact O-N 3.12Å; V276-Y279 PolarHBondContact O-N 3.09Å
277	G	50.5	Low	47.8	Very low	51 Å²	51	127.2 Å²	127.2	53%	0.526	64%	0.64	S	S	.	*	G	3₁₀ helix	trans	-59.8	-37.2	-178.4	0	0	0	0	0	114.9	S275 Y279 A280	S275-G277 PolarHBondContact O-N 2.96Å; S275-G277 VanDerWaalsContact O-N 3.1Å; G277-Y279 VanDerWaalsContact C-N 3.27Å; G277-Y279 PolarHBondContact O-N 3.28Å; G277-A280 WeakPolarHBondContact O-CB 3.35Å; G277-A280 PolarHBondContact O-N 2.85Å
278	D	49	Very low	48.4	Very low	100 Å²	100	131.9 Å²	131.9	54%	0.535	65%	0.645	S	S	.	*	G	3₁₀ helix	trans	-65.9	-30.2	-176.3	-76.2	-4.7	0	0	0	112.3	R274 S275 V276 A280	R274-D278 IonicContact NH1-OD2 2.98Å; S275-D278 PolarHBondContact O-N 2.94Å; V276-D278 PolarHBondContact O-N 3.12Å; D278-A280 VanDerWaalsContact C-N 3.26Å; D278-A280 PolarHBondContact O-N 3.47Å
279	Y	49.4	Very low	49	Very low	105 Å²	105	134.3 Å²	134.3	41%	0.412	65%	0.649	S	S	.	*	H	α-helix	trans	-68	-23.2	179.8	-72.4	-87.7	0	0	0	113.2	V276 G277 Q281 S282 L283	V276-Y279 PolarHBondContact O-N 3.09Å; G277-Y279 VanDerWaalsContact C-N 3.27Å; G277-Y279 PolarHBondContact O-N 3.28Å; Y279-Q281 VanDerWaalsContact C-N 3.26Å; Y279-Q281 PolarHBondContact O-N 2.94Å; Y279-S282 PolarHBondContact O-N 2.77Å; Y279-S282 PolarHBondContact O-OG 3.23Å; Y279-S282 VanDerWaalsContact O-OG 3.06Å; Y279-L283 WeakPolarHBondContact O-CB 3.45Å; Y279-L283 VanDerWaalsContact O-CG 3.27Å; Y279-L283 WeakPolarHBondContact O-CG 3.33Å; Y279-L283 PolarHBondContact O-N 2.83Å
280	A	52.8	Low	48.7	Very low	60 Å²	60	131.6 Å²	131.6	50%	0.496	65%	0.648	S	S	.	*	H	α-helix	trans	-64	-29.4	-177.6	0	0	0	0	0	113.1	G277 D278 R284	G277-A280 WeakPolarHBondContact O-CB 3.35Å; G277-A280 PolarHBondContact O-N 2.85Å; D278-A280 VanDerWaalsContact C-N 3.26Å; D278-A280 PolarHBondContact O-N 3.47Å; A280-R284 WeakPolarHBondContact O-CG 3.41Å
281	Q	51.1	Low	48.5	Very low	158 Å²	158	126.7 Å²	126.7	74%	0.738	65%	0.651	S	S	*	*	H	α-helix	trans	-84	-32.6	178.2	-62.2	-159.1	23.4	0	0	113.2	Y279	Y279-Q281 VanDerWaalsContact C-N 3.26Å; Y279-Q281 PolarHBondContact O-N 2.94Å
282	S	55.3	Low	48.6	Very low	54 Å²	54	127.5 Å²	127.5	38%	0.378	66%	0.663	S	S	.	*	H	α-helix	trans	-73.9	-41.2	176	58	0	0	0	0	111.5	Y279 R284 K285 F286	Y279-S282 PolarHBondContact O-N 2.77Å; Y279-S282 PolarHBondContact O-OG 3.23Å; Y279-S282 VanDerWaalsContact O-OG 3.06Å; S282-R284 VanDerWaalsContact C-N 3.27Å; S282-R284 PolarHBondContact O-N 3.47Å; S282-K285 WeakPolarHBondContact O-CB 3.45Å; S282-K285 PolarHBondContact O-N 2.9Å; S282-F286 WeakPolarHBondContact O-CD2 3.11Å
283	L	51.3	Low	48.1	Very low	108 Å²	108	129.5 Å²	129.5	57%	0.565	67%	0.669	S	S	*	*	H	α-helix	trans	-63.9	-27.2	178.7	-70.2	171.2	0	0	0	113.5	Y279 K285 F286 L287	Y279-L283 WeakPolarHBondContact O-CB 3.45Å; Y279-L283 VanDerWaalsContact O-CG 3.27Å; Y279-L283 WeakPolarHBondContact O-CG 3.33Å; Y279-L283 PolarHBondContact O-N 2.83Å; L283-K285 PolarHBondContact O-N 3.39Å; L283-K285 VanDerWaalsContact O-N 3.16Å; L283-F286 PolarHBondContact O-N 3.4Å; L283-L287 PolarHBondContact O-N 3.43Å
284	R	56.9	Low	47.7	Very low	196 Å²	196	130.7 Å²	130.7	74%	0.74	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-24	171.8	-81.4	-179.4	-179.3	-177.8	1.4	113.6	A280 S282 F286	A280-R284 WeakPolarHBondContact O-CG 3.41Å; S282-R284 VanDerWaalsContact C-N 3.27Å; S282-R284 PolarHBondContact O-N 3.47Å; R284-F286 VanDerWaalsContact C-N 3.3Å
285	K	55.1	Low	47.5	Very low	178 Å²	178	130 Å²	130	77%	0.774	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-12.2	175.1	-62.7	-175.1	177	-178.7	0	113.7	S282 L283	S282-K285 WeakPolarHBondContact O-CB 3.45Å; S282-K285 PolarHBondContact O-N 2.9Å; L283-K285 PolarHBondContact O-N 3.39Å; L283-K285 VanDerWaalsContact O-N 3.16Å
286	F	51.5	Low	46.8	Very low	156 Å²	156	129.8 Å²	129.8	68%	0.684	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	2.3	-179.8	-58.4	-73.6	0	0	0	112.9	S282 L283 R284	S282-F286 WeakPolarHBondContact O-CD2 3.11Å; L283-F286 PolarHBondContact O-N 3.4Å; R284-F286 VanDerWaalsContact C-N 3.3Å
287	L	49.2	Very low	46.4	Very low	131 Å²	131	129.9 Å²	129.9	69%	0.686	69%	0.689	S	S	*	*	S	Bend	trans	-70.1	133.3	171.1	-163.2	73.7	0	0	0	109.3	L283 Q289	L283-L287 PolarHBondContact O-N 3.43Å; L287-Q289 PolarHBondContact O-N 2.84Å
288	Y	53.1	Low	45.8	Very low	207 Å²	207	131.9 Å²	131.9	81%	0.812	70%	0.695	S	S	*	*			trans	-62.2	105	-177.2	-178.1	-91.9	0	0	0	111.5
289	Q	55.7	Low	45.1	Very low	159 Å²	159	131.9 Å²	131.9	74%	0.743	71%	0.709	S	S	*	*			trans	-86.2	132.3	168.9	-70.2	-172.2	-24.5	0	0	109.7	L287 A291	L287-Q289 PolarHBondContact O-N 2.84Å; Q289-A291 PolarHBondContact O-N 3.44Å
290	P	39.1	Very low	44.9	Very low	106 Å²	106	134.8 Å²	134.8	69%	0.688	73%	0.726	S	S	*	*			trans	-57.6	130.7	168	-22.4	33.6	0	0	0	110.3	C292	P290-C292 PolarHBondContact O-N 2.91Å
291	A	35.6	Very low	44.1	Very low	100 Å²	100	139.9 Å²	139.9	83%	0.826	74%	0.737	S	S	*	*			trans	-69.6	104.1	179.4	0	0	0	0	0	110.7	Q289	Q289-A291 PolarHBondContact O-N 3.44Å
292	C	42	Very low	43.8	Very low	120 Å²	120	136.9 Å²	136.9	81%	0.811	73%	0.726	S	S	*	*			trans	-54.5	141.7	163.3	-65.8	0	0	0	0	109.3	P290 S294	P290-C292 PolarHBondContact O-N 2.91Å; C292-S294 PolarHBondContact O-N 2.87Å; C292-S294 VanDerWaalsContact O-N 3.16Å
293	R	33.7	Very low	43.2	Very low	245 Å²	245	141.2 Å²	141.2	93%	0.925	74%	0.74	S	S	*	*			trans	-53.4	125.7	175.1	-97.3	-175.4	168.7	-173.9	-2.9	109.3	Q295	R293-Q295 PolarHBondContact O-N 3.22Å
294	S	34.5	Very low	43.2	Very low	116 Å²	116	140.4 Å²	140.4	81%	0.811	74%	0.74	S	S	*	*			trans	-63.8	97.8	177.9	54.7	0	0	0	0	110.3	C292 A296	C292-S294 PolarHBondContact O-N 2.87Å; C292-S294 VanDerWaalsContact O-N 3.16Å; S294-A296 PolarHBondContact O-N 3.5Å
295	Q	42.3	Very low	43.1	Very low	161 Å²	161	135.6 Å²	135.6	75%	0.752	73%	0.729	S	S	*	*			trans	-60.1	116.3	154.3	-64.4	-172.8	6.5	0	0	106	R293	R293-Q295 PolarHBondContact O-N 3.22Å
296	A	30.5	Very low	43	Very low	90 Å²	90	133.6 Å²	133.6	74%	0.744	73%	0.726	S	S	*	*			trans	-62.8	126.5	-179	0	0	0	0	0	108.7	S294 S298	S294-A296 PolarHBondContact O-N 3.5Å; A296-S298 PolarHBondContact O-N 2.98Å
297	P	35.1	Very low	43.2	Very low	127 Å²	127	129 Å²	129	83%	0.825	72%	0.722	S	S	*	*			trans	-68.1	106.7	-179	26.9	-33.3	0	0	0	109.6
298	S	38.4	Very low	43.9	Very low	93 Å²	93	124.1 Å²	124.1	65%	0.65	70%	0.699	S	S	*	*			trans	-53.4	143.6	154.7	49.8	0	0	0	0	108.6	A296 H300	A296-S298 PolarHBondContact O-N 2.98Å; S298-H300 PolarHBondContact O-N 3.28Å
299	A	34.7	Very low	44.5	Very low	100 Å²	100	118.6 Å²	118.6	83%	0.826	68%	0.679	S	S	*	*	S	Bend	trans	-67.6	14.9	-163.4	0	0	0	0	0	117.1
300	H	46.1	Very low	45.2	Very low	165 Å²	165	116.9 Å²	116.9	76%	0.764	67%	0.671	S	S	*	*	S	Bend	trans	-124.9	136.9	177.1	-64.5	-71.7	0	0	0	110.9	S298	S298-H300 PolarHBondContact O-N 3.28Å
301	K	36	Very low	46.9	Very low	167 Å²	167	113.7 Å²	113.7	73%	0.726	65%	0.654	S	S	*	*			trans	-107.2	87.4	-163.4	-170.4	-164.2	-171.2	-160.1	0	110.7	E303	K301-E303 HydrophobicContact CD-CG 4.26Å; K301-E303 WeakPolarHBondContact CE-OE1 3.43Å; K301-E303 HydrophobicContact CG-CG 4.22Å; K301-E303 IonicContact NZ-OE1 3.86Å; K301-E303 PolarHBondContact NZ-OE1 3.12Å; K301-E303 PolarHBondContact O-N 3.34Å
302	D	43.5	Very low	48.8	Very low	95 Å²	95	109.7 Å²	109.7	51%	0.508	62%	0.621	S	S	.	*			trans	-74.9	105.8	174.6	-85	-2.6	0	0	0	110.2	T304 W425	D302-T304 PolarHBondContact O-N 3.06Å; D302-T304 VanDerWaalsContact O-N 3.17Å; D302-W425 PolarHBondContact OD2-NE1 2.88Å; D302-W425 VanDerWaalsContact OD2-NE1 3.12Å
303	E	42.1	Very low	50.7	Low	146 Å²	146	108.5 Å²	108.5	68%	0.682	60%	0.603	S	S	*	*			trans	-87.8	60.9	-176	-64.7	-158.4	167	0	0	114.3	K301	K301-E303 HydrophobicContact CD-CG 4.26Å; K301-E303 WeakPolarHBondContact CE-OE1 3.43Å; K301-E303 HydrophobicContact CG-CG 4.22Å; K301-E303 IonicContact NZ-OE1 3.86Å; K301-E303 PolarHBondContact NZ-OE1 3.12Å; K301-E303 PolarHBondContact O-N 3.34Å
304	T	52.5	Low	53	Low	91 Å²	91	101.9 Å²	101.9	56%	0.558	58%	0.583	S	S	*	*			trans	-131	11.5	-179.8	51.8	0	0	0	0	114.5	D302 L306 S308	D302-T304 PolarHBondContact O-N 3.06Å; D302-T304 VanDerWaalsContact O-N 3.17Å; T304-L306 PolarHBondContact O-N 3Å; T304-S308 WeakPolarHBondContact O-CB 3.27Å; T304-S308 PolarHBondContact O-OG 3.2Å
305	D	55.6	Low	55.3	Low	94 Å²	94	97.1 Å²	97.1	50%	0.503	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	14.6	-141.3	-156.1	37.3	0	0	0	117.3	K309	D305-K309 VanDerWaalsContact O-CD 3.32Å; D305-K309 WeakPolarHBondContact O-CD 3.38Å; D305-K309 VanDerWaalsContact O-CE 3.23Å; D305-K309 WeakPolarHBondContact O-CE 3.44Å; D305-K309 PolarHBondContact O-NZ 3.31Å; D305-K309 WeakPolarHBondContact OD1-CE 3.35Å; D305-K309 IonicContact OD1-NZ 3.36Å; D305-K309 PolarHBondContact OD1-NZ 3.28Å; D305-K309 IonicContact OD2-NZ 3.79Å; D305-K309 PolarHBondContact OD2-NZ 2.7Å
306	L	51.3	Low	57.3	Low	136 Å²	136	90 Å²	90	71%	0.712	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	-57.6	176.3	-71.2	175.6	0	0	0	113.3	T304 S308 K309	T304-L306 PolarHBondContact O-N 3Å; L306-S308 PolarHBondContact O-N 3.35Å; L306-K309 PolarHBondContact O-N 2.79Å; L306-K309 VanDerWaalsContact O-N 3.09Å
307	G	55.5	Low	59.8	Low	59 Å²	59	88.9 Å²	88.9	61%	0.608	51%	0.506	S	S	*	.	H	α-helix	trans	-62.1	-31.1	178.6	0	0	0	0	0	113.3	A311	G307-A311 WeakPolarHBondContact O-CB 3.44Å; G307-A311 PolarHBondContact O-N 3.32Å
308	S	64.2	Low	62	Low	30 Å²	30	90.7 Å²	90.7	21%	0.21	50%	0.496	C	S	.	.	H	α-helix	trans	-66	-33.3	174.3	57.8	0	0	0	0	113.3	T304 L306 A311 A312 P515	T304-S308 WeakPolarHBondContact O-CB 3.27Å; T304-S308 PolarHBondContact O-OG 3.2Å; L306-S308 PolarHBondContact O-N 3.35Å; S308-A311 PolarHBondContact O-N 3.17Å; S308-A312 WeakPolarHBondContact O-CB 3.45Å; S308-A312 PolarHBondContact O-N 3.2Å; S308-P515 WeakPolarHBondContact O-CG 3.5Å
309	K	66.9	Low	64	Low	90 Å²	90	87.3 Å²	87.3	39%	0.391	47%	0.471	S	S	.	.	H	α-helix	trans	-70.9	-47	-177.9	-68.9	177.9	-176.3	147.9	0	111.1	D305 L306 A311 A312 E313	D305-K309 VanDerWaalsContact O-CD 3.32Å; D305-K309 WeakPolarHBondContact O-CD 3.38Å; D305-K309 VanDerWaalsContact O-CE 3.23Å; D305-K309 WeakPolarHBondContact O-CE 3.44Å; D305-K309 PolarHBondContact O-NZ 3.31Å; D305-K309 WeakPolarHBondContact OD1-CE 3.35Å; D305-K309 IonicContact OD1-NZ 3.36Å; D305-K309 PolarHBondContact OD1-NZ 3.28Å; D305-K309 IonicContact OD2-NZ 3.79Å; D305-K309 PolarHBondContact OD2-NZ 2.7Å; L306-K309 PolarHBondContact O-N 2.79Å; L306-K309 VanDerWaalsContact O-N 3.09Å; K309-A311 VanDerWaalsContact C-N 3.35Å; K309-A311 PolarHBondContact O-N 2.99Å; K309-A312 WeakPolarHBondContact O-CB 3.36Å; K309-A312 PolarHBondContact O-N 3.09Å; K309-A312 VanDerWaalsContact O-N 3.11Å; K309-E313 WeakPolarHBondContact O-CG 3.15Å; K309-E313 PolarHBondContact O-N 3.33Å
310	H	69.1	Low	66	Low	123 Å²	123	82.9 Å²	82.9	57%	0.569	43%	0.433	S	S	*	.	H	α-helix	trans	-64	-36.7	174	-64.5	-42.6	0	0	0	113.3	A312 E313 E314	H310-A312 VanDerWaalsContact C-N 3.34Å; H310-A312 PolarHBondContact O-N 3.05Å; H310-E313 IonicContact CE1-OE2 2.79Å; H310-E313 IonicContact CG-OE2 2.88Å; H310-E313 IonicContact ND1-OE1 3.47Å; H310-E313 IonicContact ND1-OE2 2.81Å; H310-E313 PolarHBondContact ND1-OE2 2.86Å; H310-E313 PolarHBondContact O-N 3.08Å; H310-E314 PolarHBondContact O-N 3.29Å
311	A	75.1	Confident	66.9	Low	40 Å²	40	81.9 Å²	81.9	33%	0.331	44%	0.439	S	S	.	.	H	α-helix	trans	-64.7	-36.9	172.2	0	0	0	0	0	112.4	G307 S308 K309 V315 P515	G307-A311 WeakPolarHBondContact O-CB 3.44Å; G307-A311 PolarHBondContact O-N 3.32Å; S308-A311 PolarHBondContact O-N 3.17Å; K309-A311 VanDerWaalsContact C-N 3.35Å; K309-A311 PolarHBondContact O-N 2.99Å; A311-V315 WeakPolarHBondContact O-CG2 3.32Å; A311-V315 PolarHBondContact O-N 3.4Å; A311-P515 HydrophobicContact CB-CG 3.84Å
312	A	76.8	Confident	68.1	Low	15 Å²	15	77.2 Å²	77.2	12%	0.124	43%	0.427	C	S	.	.	H	α-helix	trans	-70.5	-39.6	174.6	0	0	0	0	0	112.6	S308 K309 H310 E314 V315 W316 L514	S308-A312 WeakPolarHBondContact O-CB 3.45Å; S308-A312 PolarHBondContact O-N 3.2Å; K309-A312 WeakPolarHBondContact O-CB 3.36Å; K309-A312 PolarHBondContact O-N 3.09Å; K309-A312 VanDerWaalsContact O-N 3.11Å; H310-A312 VanDerWaalsContact C-N 3.34Å; H310-A312 PolarHBondContact O-N 3.05Å; A312-E314 VanDerWaalsContact C-N 3.31Å; A312-E314 PolarHBondContact O-N 3.47Å; A312-V315 PolarHBondContact O-N 3.09Å; A312-W316 WeakPolarHBondContact O-CB 3.46Å; A312-W316 VanDerWaalsContact O-CD1 3.3Å; A312-W316 PolarHBondContact O-N 3Å; A312-L514 HydrophobicContact CB-CD2 3.78Å
313	E	80.4	Confident	69	Low	95 Å²	95	83.6 Å²	83.6	44%	0.444	44%	0.444	S	S	.	.	H	α-helix	trans	-57.8	-41.7	172.5	-73.2	164.3	-171.6	0	0	111.5	K309 H310 W316 A317	K309-E313 WeakPolarHBondContact O-CG 3.15Å; K309-E313 PolarHBondContact O-N 3.33Å; H310-E313 IonicContact CE1-OE2 2.79Å; H310-E313 IonicContact CG-OE2 2.88Å; H310-E313 IonicContact ND1-OE1 3.47Å; H310-E313 IonicContact ND1-OE2 2.81Å; H310-E313 PolarHBondContact ND1-OE2 2.86Å; H310-E313 PolarHBondContact O-N 3.08Å; E313-W316 PolarHBondContact O-N 2.83Å; E313-A317 WeakPolarHBondContact O-CB 3.37Å; E313-A317 PolarHBondContact O-N 2.94Å
314	E	82.1	Confident	69.8	Low	106 Å²	106	79.1 Å²	79.1	50%	0.495	43%	0.432	S	S	.	.	H	α-helix	trans	-65.1	-45.8	178.3	-159.1	-157.3	138.3	0	0	112.1	H310 A312 W316 A317 R318	H310-E314 PolarHBondContact O-N 3.29Å; A312-E314 VanDerWaalsContact C-N 3.31Å; A312-E314 PolarHBondContact O-N 3.47Å; E314-W316 VanDerWaalsContact C-N 3.33Å; E314-W316 PolarHBondContact O-N 3.43Å; E314-A317 PolarHBondContact O-N 3.47Å; E314-R318 WeakPolarHBondContact O-CG 3.39Å; E314-R318 PolarHBondContact O-N 3.01Å; E314-R318 VanDerWaalsContact O-N 3.16Å; E314-R318 IonicContact OE1-CZ 3.27Å; E314-R318 IonicContact OE1-NE 2.72Å; E314-R318 PolarHBondContact OE1-NE 3.39Å; E314-R318 IonicContact OE1-NH2 2.62Å; E314-R318 PolarHBondContact OE1-NH2 3.39Å
315	V	83.7	Confident	70.3	Confident	17 Å²	17	75.3 Å²	75.3	10%	0.103	41%	0.41	C	S	.	.	H	α-helix	trans	-64.8	-38.7	176.7	-177.9	0	0	0	0	110.9	A311 A312 R318 I319 Y512 L514 M527	A311-V315 WeakPolarHBondContact O-CG2 3.32Å; A311-V315 PolarHBondContact O-N 3.4Å; A312-V315 PolarHBondContact O-N 3.09Å; V315-R318 PolarHBondContact O-N 2.83Å; V315-I319 PolarHBondContact O-N 2.79Å; V315-Y512 HydrophobicContact CG1-CD1 4.11Å; V315-L514 HydrophobicContact CB-CD2 4.13Å; V315-L514 HydrophobicContact CG1-CD2 4.32Å; V315-L514 HydrophobicContact CG1-CG 4.45Å; V315-M527 HydrophobicContact CB-CE 4.31Å; V315-M527 HydrophobicContact CG1-CE 3.78Å; V315-M527 HydrophobicContact CG1-SD 4.34Å
316	W	84.1	Confident	70.9	Confident	11 Å²	11	72.9 Å²	72.9	4%	0.042	40%	0.402	C	S	.	.	H	α-helix	trans	-61.9	-43.2	172.3	-90.3	116.6	0	0	0	112.4	A312 E313 E314 R318 I319 T320 V329 H523 L526 M527	A312-W316 WeakPolarHBondContact O-CB 3.46Å; A312-W316 VanDerWaalsContact O-CD1 3.3Å; A312-W316 PolarHBondContact O-N 3Å; E313-W316 PolarHBondContact O-N 2.83Å; E314-W316 VanDerWaalsContact C-N 3.33Å; E314-W316 PolarHBondContact O-N 3.43Å; W316-R318 VanDerWaalsContact C-N 3.26Å; W316-R318 PolarHBondContact O-N 3.36Å; W316-I319 PolarHBondContact O-N 3.47Å; W316-I319 VanDerWaalsContact O-N 3.12Å; W316-T320 WeakPolarHBondContact O-CB 3.04Å; W316-T320 PolarHBondContact O-N 2.82Å; W316-V329 HydrophobicContact CD2-CG2 4.03Å; W316-V329 HydrophobicContact CG-CG2 4.34Å; W316-V329 HydrophobicContact CZ2-CG1 4.06Å; W316-V329 HydrophobicContact CZ2-CG2 4.19Å; W316-H523 HydrophobicContact CZ2-CB 4.29Å; W316-H523 AromaticContact NE1-CE1 3.98Å; W316-H523 AromaticContact NE1-CG 3.78Å; W316-H523 AromaticContact NE1-ND1 3.36Å; W316-H523 PolarHBondContact NE1-ND1 3.4Å; W316-L526 HydrophobicContact CH2-CB 3.73Å; W316-L526 HydrophobicContact CZ2-CB 3.93Å; W316-L526 HydrophobicContact CZ2-CD1 4.45Å; W316-M527 HydrophobicContact CB-CE 4.36Å; W316-M527 HydrophobicContact CD2-CE 3.49Å; W316-M527 VanDerWaalsContact CD2-CE 3.49Å; W316-M527 HydrophobicContact CD2-CG 4.25Å; W316-M527 HydrophobicContact CE3-CE 4.03Å; W316-M527 HydrophobicContact CE3-CG 4.06Å; W316-M527 HydrophobicContact CG-CE 3.63Å; W316-M527 HydrophobicContact CH2-CB 4.35Å; W316-M527 HydrophobicContact CH2-CG 3.53Å; W316-M527 HydrophobicContact CZ2-CE 4.2Å; W316-M527 HydrophobicContact CZ2-CG 3.74Å; W316-M527 HydrophobicContact CZ3-CG 3.7Å
317	A	82.4	Confident	71.9	Confident	66 Å²	66	73 Å²	73	55%	0.545	40%	0.404	S	S	.	.	H	α-helix	trans	-64.6	-27.4	178.4	0	0	0	0	0	113.5	E313 E314	E313-A317 WeakPolarHBondContact O-CB 3.37Å; E313-A317 PolarHBondContact O-N 2.94Å; E314-A317 PolarHBondContact O-N 3.47Å
318	R	82.4	Confident	73.2	Confident	166 Å²	166	73.2 Å²	73.2	63%	0.626	39%	0.389	S	S	*	.	H	α-helix	trans	-72.5	-25.8	174.1	-65.4	171.9	-174.5	-156.4	5	113.3	E314 V315 W316 Y512	E314-R318 WeakPolarHBondContact O-CG 3.39Å; E314-R318 PolarHBondContact O-N 3.01Å; E314-R318 VanDerWaalsContact O-N 3.16Å; E314-R318 IonicContact OE1-CZ 3.27Å; E314-R318 IonicContact OE1-NE 2.72Å; E314-R318 PolarHBondContact OE1-NE 3.39Å; E314-R318 IonicContact OE1-NH2 2.62Å; E314-R318 PolarHBondContact OE1-NH2 3.39Å; V315-R318 PolarHBondContact O-N 2.83Å; W316-R318 VanDerWaalsContact C-N 3.26Å; W316-R318 PolarHBondContact O-N 3.36Å; R318-Y512 HydrophobicContact CB-CE1 3.98Å
319	I	79.8	Confident	74.3	Confident	22 Å²	22	72.2 Å²	72.2	11%	0.113	38%	0.381	C	S	.	.	H	α-helix	trans	-93.8	-37.5	177.3	-65.3	176	0	0	0	110.7	V315 W316 L505 Y512 M527 Y530 V531	V315-I319 PolarHBondContact O-N 2.79Å; W316-I319 PolarHBondContact O-N 3.47Å; W316-I319 VanDerWaalsContact O-N 3.12Å; I319-L505 HydrophobicContact CD1-CD2 4.26Å; I319-Y512 HydrophobicContact CD1-CD1 3.6Å; I319-Y512 HydrophobicContact CD1-CD2 4.47Å; I319-Y512 HydrophobicContact CD1-CE1 4.07Å; I319-Y512 HydrophobicContact CD1-CG 3.82Å; I319-Y512 HydrophobicContact CG1-CD1 3.46Å; I319-Y512 VanDerWaalsContact CG1-CD1 3.46Å; I319-Y512 HydrophobicContact CG1-CE1 3.42Å; I319-Y512 VanDerWaalsContact CG1-CE1 3.42Å; I319-Y512 HydrophobicContact CG1-CG 4.12Å; I319-M527 HydrophobicContact CD1-CB 3.85Å; I319-M527 HydrophobicContact CD1-CE 4.06Å; I319-M527 HydrophobicContact CD1-CG 3.63Å; I319-M527 HydrophobicContact CD1-SD 3.55Å; I319-M527 VanDerWaalsContact CD1-SD 3.55Å; I319-Y530 HydrophobicContact CG2-CD1 3.94Å; I319-Y530 HydrophobicContact CG2-CE1 4.48Å; I319-V531 HydrophobicContact CG2-CG2 4.11Å
320	T	75.9	Confident	75.3	Confident	6 Å²	6	72.8 Å²	72.8	4%	0.037	39%	0.389	C	S	.	.			trans	-113.6	103.2	-172.7	-51.1	0	0	0	0	111	W316 S322 A325 Y530	W316-T320 WeakPolarHBondContact O-CB 3.04Å; W316-T320 PolarHBondContact O-N 2.82Å; T320-S322 PolarHBondContact O-N 2.7Å; T320-A325 HydrophobicContact CG2-CB 3.24Å; T320-Y530 HydrophobicContact CG2-CE1 4Å; T320-Y530 HydrophobicContact CG2-CE2 4.36Å; T320-Y530 VanDerWaalsContact CG2-OH 3.31Å; T320-Y530 WeakPolarHBondContact CG2-OH 3.49Å; T320-Y530 WeakPolarHBondContact OG1-CE1 3.48Å
321	T	65.8	Low	76.3	Confident	144 Å²	144	69.3 Å²	69.3	88%	0.883	38%	0.379	S	S	*	.	S	Bend	trans	-61.8	-7	-176.8	-36	0	0	0	0	114.6
322	S	60.9	Low	77.1	Confident	69 Å²	69	68.1 Å²	68.1	48%	0.483	37%	0.365	S	S	.	.			trans	-115.4	119.9	176.1	-178.8	0	0	0	0	111.5	T320 A324 A325	T320-S322 PolarHBondContact O-N 2.7Å; S322-A324 PolarHBondContact O-N 3.01Å; S322-A325 WeakPolarHBondContact O-CB 3.4Å; S322-A325 PolarHBondContact O-N 2.95Å; S322-A325 VanDerWaalsContact O-N 3.11Å
323	R	62.3	Low	77.8	Confident	230 Å²	230	67.8 Å²	67.8	87%	0.868	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-58.4	-30.1	178.2	-162.4	176.8	-166.7	166.8	6.3	113.2	A325 A326	R323-A325 PolarHBondContact O-N 2.83Å; R323-A325 VanDerWaalsContact O-N 3.16Å; R323-A326 WeakPolarHBondContact O-CB 3.37Å; R323-A326 PolarHBondContact O-N 3.27Å; R323-A326 VanDerWaalsContact O-N 3.11Å
324	A	59.4	Low	78.3	Confident	52 Å²	52	65.1 Å²	65.1	43%	0.43	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-66.2	-12	179.3	0	0	0	0	0	114	S322 H328	S322-A324 PolarHBondContact O-N 3.01Å; A324-H328 PolarHBondContact O-CD2 3.24Å
325	A	63.1	Low	78.8	Confident	11 Å²	11	61.9 Å²	61.9	9%	0.091	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-71.7	-31.1	171.5	0	0	0	0	0	112.8	T320 S322 R323 D327 H328 V329 W332	T320-A325 HydrophobicContact CG2-CB 3.24Å; S322-A325 WeakPolarHBondContact O-CB 3.4Å; S322-A325 PolarHBondContact O-N 2.95Å; S322-A325 VanDerWaalsContact O-N 3.11Å; R323-A325 PolarHBondContact O-N 2.83Å; R323-A325 VanDerWaalsContact O-N 3.16Å; A325-D327 VanDerWaalsContact C-N 3.27Å; A325-D327 PolarHBondContact O-N 3.14Å; A325-H328 PolarHBondContact O-N 3.27Å; A325-V329 PolarHBondContact O-N 2.87Å; A325-W332 HydrophobicContact CB-CH2 3.73Å; A325-W332 HydrophobicContact CB-CZ3 4.16Å
326	A	67.4	Low	79.3	Confident	42 Å²	42	61.1 Å²	61.1	35%	0.347	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-59.5	-40.8	-179.9	0	0	0	0	0	111.3	R323 H328 V329	R323-A326 WeakPolarHBondContact O-CB 3.37Å; R323-A326 PolarHBondContact O-N 3.27Å; R323-A326 VanDerWaalsContact O-N 3.11Å; A326-H328 PolarHBondContact O-N 3.37Å; A326-V329 PolarHBondContact O-N 2.89Å; A326-V329 VanDerWaalsContact O-N 3.12Å
327	D	73.2	Confident	79.7	Confident	138 Å²	138	61.5 Å²	61.5	74%	0.738	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-60.1	-17.1	176.2	-57.1	-37.2	0	0	0	113.5	A325	A325-D327 VanDerWaalsContact C-N 3.27Å; A325-D327 PolarHBondContact O-N 3.14Å
328	H	83.4	Confident	80.2	Confident	64 Å²	64	61.2 Å²	61.2	30%	0.296	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-104.9	-9.4	179.8	-65.3	-53.2	0	0	0	114.2	A324 A325 A326 D330 S331 W332 N558	A324-H328 PolarHBondContact O-CD2 3.24Å; A325-H328 PolarHBondContact O-N 3.27Å; A326-H328 PolarHBondContact O-N 3.37Å; H328-D330 VanDerWaalsContact C-N 3.33Å; H328-D330 PolarHBondContact O-N 2.82Å; H328-S331 WeakPolarHBondContact O-CA 3.45Å; H328-S331 VanDerWaalsContact O-CB 3.31Å; H328-S331 WeakPolarHBondContact O-CB 3.31Å; H328-S331 PolarHBondContact O-N 3.36Å; H328-W332 HydrophobicContact CB-CD2 4.11Å; H328-W332 HydrophobicContact CB-CH2 4.45Å; H328-W332 HydrophobicContact CB-CZ2 3.79Å; H328-W332 PolarHBondContact O-N 2.82Å; H328-N558 PolarHBondContact CE1-ND2 3.39Å; H328-N558 PolarHBondContact NE2-ND2 2.53Å
329	V	86.5	Confident	80.7	Confident	9 Å²	9	53.7 Å²	53.7	6%	0.055	30%	0.298	C	S	.	.	H	α-helix	trans	-59.3	-38.7	-175	171.7	0	0	0	0	113	W316 A325 A326 S331 W332 T333 H523	W316-V329 HydrophobicContact CD2-CG2 4.03Å; W316-V329 HydrophobicContact CG-CG2 4.34Å; W316-V329 HydrophobicContact CZ2-CG1 4.06Å; W316-V329 HydrophobicContact CZ2-CG2 4.19Å; A325-V329 PolarHBondContact O-N 2.87Å; A326-V329 PolarHBondContact O-N 2.89Å; A326-V329 VanDerWaalsContact O-N 3.12Å; V329-S331 VanDerWaalsContact C-N 3.34Å; V329-S331 PolarHBondContact O-N 3.12Å; V329-W332 HydrophobicContact CG2-CE3 4.28Å; V329-W332 HydrophobicContact CG2-CZ3 4.46Å; V329-W332 PolarHBondContact O-N 2.87Å; V329-T333 VanDerWaalsContact O-CB 3.28Å; V329-T333 WeakPolarHBondContact O-CB 3.33Å; V329-T333 PolarHBondContact O-N 2.78Å; V329-T333 PolarHBondContact O-OG1 3.44Å; V329-H523 WeakPolarHBondContact CG1-NE2 3.31Å
330	D	87.4	Confident	81.4	Confident	103 Å²	103	52.7 Å²	52.7	55%	0.551	29%	0.293	S	S	*	.	H	α-helix	trans	-65	-37.7	175	-85	-13.9	0	0	0	112	H328 T333 A334	H328-D330 VanDerWaalsContact C-N 3.33Å; H328-D330 PolarHBondContact O-N 2.82Å; D330-T333 PolarHBondContact O-N 3.3Å; D330-A334 PolarHBondContact O-N 2.84Å
331	S	90.4	Very high	82.2	Confident	50 Å²	50	52.5 Å²	52.5	35%	0.35	29%	0.292	S	S	.	.	H	α-helix	trans	-67.1	-46.9	176.1	-173	0	0	0	0	110.9	H328 V329 T333 A334 K335	H328-S331 WeakPolarHBondContact O-CA 3.45Å; H328-S331 VanDerWaalsContact O-CB 3.31Å; H328-S331 WeakPolarHBondContact O-CB 3.31Å; H328-S331 PolarHBondContact O-N 3.36Å; V329-S331 VanDerWaalsContact C-N 3.34Å; V329-S331 PolarHBondContact O-N 3.12Å; S331-T333 VanDerWaalsContact C-N 3.29Å; S331-T333 PolarHBondContact O-N 2.65Å; S331-A334 PolarHBondContact O-N 3.3Å; S331-K335 WeakPolarHBondContact O-CG 3.49Å; S331-K335 PolarHBondContact O-N 3.21Å
332	W	91.6	Very high	83.5	Confident	14 Å²	14	50 Å²	50	5%	0.053	27%	0.273	C	S	.	.	H	α-helix	trans	-62.6	-36	175.4	-58.8	-18.2	0	0	0	111.8	A325 H328 V329 K335 L336 L526 Y530 F556	A325-W332 HydrophobicContact CB-CH2 3.73Å; A325-W332 HydrophobicContact CB-CZ3 4.16Å; H328-W332 HydrophobicContact CB-CD2 4.11Å; H328-W332 HydrophobicContact CB-CH2 4.45Å; H328-W332 HydrophobicContact CB-CZ2 3.79Å; H328-W332 PolarHBondContact O-N 2.82Å; V329-W332 HydrophobicContact CG2-CE3 4.28Å; V329-W332 HydrophobicContact CG2-CZ3 4.46Å; V329-W332 PolarHBondContact O-N 2.87Å; W332-K335 PolarHBondContact O-N 3.15Å; W332-L336 WeakPolarHBondContact O-CB 3.3Å; W332-L336 PolarHBondContact O-N 2.99Å; W332-L526 HydrophobicContact CB-CD1 3.99Å; W332-L526 HydrophobicContact CB-CD2 4.01Å; W332-Y530 HydrophobicContact CH2-CD2 4.46Å; W332-Y530 HydrophobicContact CH2-CE2 4.21Å; W332-Y530 HydrophobicContact CZ3-CD2 4.32Å; W332-Y530 HydrophobicContact CZ3-CE2 4.44Å; W332-F556 AromaticContact CD2-CD1 3.66Å; W332-F556 HydrophobicContact CD2-CD1 3.66Å; W332-F556 HydrophobicContact CD2-CE1 4.2Å; W332-F556 AromaticContact CE2-CD1 3.94Å; W332-F556 AromaticContact CE3-CD1 3.72Å; W332-F556 HydrophobicContact CE3-CD1 3.72Å; W332-F556 AromaticContact CE3-CE1 3.91Å; W332-F556 HydrophobicContact CE3-CE1 3.91Å; W332-F556 HydrophobicContact CG-CD1 4.1Å; W332-F556 HydrophobicContact CH2-CD1 4.29Å; W332-F556 HydrophobicContact CZ2-CD1 4.25Å; W332-F556 HydrophobicContact CZ3-CD1 4.05Å; W332-F556 HydrophobicContact CZ3-CE1 4.33Å
333	T	91.8	Very high	85	Confident	8 Å²	8	48.9 Å²	48.9	5%	0.049	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-42.2	174.8	-63.8	0	0	0	0	111.4	V329 D330 S331 R337 F522 H523 L526	V329-T333 VanDerWaalsContact O-CB 3.28Å; V329-T333 WeakPolarHBondContact O-CB 3.33Å; V329-T333 PolarHBondContact O-N 2.78Å; V329-T333 PolarHBondContact O-OG1 3.44Å; D330-T333 PolarHBondContact O-N 3.3Å; S331-T333 VanDerWaalsContact C-N 3.29Å; S331-T333 PolarHBondContact O-N 2.65Å; T333-R337 WeakPolarHBondContact O-CB 3.23Å; T333-R337 VanDerWaalsContact O-CG 3.22Å; T333-R337 WeakPolarHBondContact O-CG 3.28Å; T333-R337 PolarHBondContact O-N 3.28Å; T333-F522 HydrophobicContact CG2-CB 3.99Å; T333-F522 HydrophobicContact CG2-CG 4.41Å; T333-H523 PolarHBondContact OG1-CD2 2.6Å; T333-L526 VanDerWaalsContact OG1-CD1 3.31Å; T333-L526 WeakPolarHBondContact OG1-CD1 3.42Å
334	A	90.9	Very high	86.5	Confident	39 Å²	39	38.2 Å²	38.2	32%	0.322	22%	0.223	S	C	.	.	H	α-helix	trans	-65.9	-43.3	173.2	0	0	0	0	0	112.3	D330 S331 R337 N338	D330-A334 PolarHBondContact O-N 2.84Å; S331-A334 PolarHBondContact O-N 3.3Å; A334-R337 PolarHBondContact O-N 3.47Å; A334-N338 PolarHBondContact O-N 3.49Å
335	K	92.7	Very high	88.2	Confident	39 Å²	39	35.7 Å²	35.7	17%	0.17	20%	0.203	C	C	.	.	H	α-helix	trans	-62.1	-43	176.4	-71	-178.6	-177.5	-167.1	0	111.8	S331 W332 N338 W339 W554 I555 E557 N558	S331-K335 WeakPolarHBondContact O-CG 3.49Å; S331-K335 PolarHBondContact O-N 3.21Å; W332-K335 PolarHBondContact O-N 3.15Å; K335-N338 PolarHBondContact O-N 3.1Å; K335-W339 WeakPolarHBondContact O-CB 3.29Å; K335-W339 PolarHBondContact O-N 3.45Å; K335-W554 HydrophobicContact CB-CZ3 4.41Å; K335-W554 HydrophobicContact CD-CZ3 4.2Å; K335-W554 HydrophobicContact CG-CZ3 4.3Å; K335-I555 HydrophobicContact CB-CB 3.88Å; K335-I555 HydrophobicContact CB-CG2 3.94Å; K335-I555 WeakPolarHBondContact CD-O 3.41Å; K335-E557 PolarHBondContact NZ-O 3.29Å; K335-N558 PolarHBondContact NZ-OXT 3.16Å
336	L	93.4	Very high	89.7	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-42.7	173.8	178.7	62.2	0	0	0	112.2	W332 W339 I340 F522 I525 L526 L529 I552 I555	W332-L336 WeakPolarHBondContact O-CB 3.3Å; W332-L336 PolarHBondContact O-N 2.99Å; L336-W339 HydrophobicContact CD1-CE3 4.43Å; L336-W339 PolarHBondContact O-N 3.41Å; L336-I340 HydrophobicContact CD1-CD1 4.04Å; L336-I340 HydrophobicContact CD1-CG1 4.16Å; L336-I340 HydrophobicContact CG-CD1 3.99Å; L336-I340 HydrophobicContact CG-CG1 4.49Å; L336-I340 WeakPolarHBondContact O-CG1 3.5Å; L336-I340 PolarHBondContact O-N 3.35Å; L336-F522 HydrophobicContact CD2-CB 4.42Å; L336-F522 HydrophobicContact CD2-CD1 4.36Å; L336-I525 HydrophobicContact CD1-CG2 4.23Å; L336-I525 HydrophobicContact CD2-CB 4.08Å; L336-I525 HydrophobicContact CD2-CG2 3.74Å; L336-L526 HydrophobicContact CB-CD2 4.06Å; L336-L526 HydrophobicContact CD2-CD2 3.91Å; L336-L526 HydrophobicContact CD2-CG 3.81Å; L336-L529 HydrophobicContact CD1-CD1 4.26Å; L336-I552 HydrophobicContact CD1-CD1 4.21Å; L336-I555 HydrophobicContact CB-CD1 4.21Å; L336-I555 HydrophobicContact CD1-CD1 4.11Å
337	R	93.2	Very high	91	Very high	20 Å²	20	37.4 Å²	37.4	8%	0.075	21%	0.209	C	C	.	.	H	α-helix	trans	-62.7	-42.6	178.3	-77.7	175.1	133.4	-111.1	-19.1	112.2	T333 A334 S341 C419 M420 F423 F522	T333-R337 WeakPolarHBondContact O-CB 3.23Å; T333-R337 VanDerWaalsContact O-CG 3.22Å; T333-R337 WeakPolarHBondContact O-CG 3.28Å; T333-R337 PolarHBondContact O-N 3.28Å; A334-R337 PolarHBondContact O-N 3.47Å; R337-S341 WeakPolarHBondContact O-CB 3.44Å; R337-S341 PolarHBondContact O-N 3.21Å; R337-S341 VanDerWaalsContact O-N 3.13Å; R337-C419 PolarHBondContact NH1-O 3.47Å; R337-M420 HydrophobicContact CB-CE 3.97Å; R337-M420 HydrophobicContact CG-CE 3.91Å; R337-M420 PolarHBondContact NH1-O 3.27Å; R337-M420 PolarHBondContact NH2-O 2.95Å; R337-F423 VanDerWaalsContact NH2-CB 3.33Å; R337-F423 VanDerWaalsContact NH2-CG 3.27Å; R337-F522 HydrophobicContact CG-CD1 3.85Å; R337-F522 HydrophobicContact CG-CE1 3.68Å; R337-F522 HydrophobicContact CG-CE2 4.45Å; R337-F522 HydrophobicContact CG-CG 4.33Å; R337-F522 HydrophobicContact CG-CZ 4.01Å; R337-F522 VanDerWaalsContact NE-CE2 3.27Å
338	N	92.6	Very high	92.1	Very high	60 Å²	60	31.4 Å²	31.4	32%	0.321	18%	0.177	S	C	.	.	H	α-helix	trans	-63.4	-45.6	171.3	-69.1	-10.7	0	0	0	111.1	A334 K335 I340 S341 D342 C419	A334-N338 PolarHBondContact O-N 3.49Å; K335-N338 PolarHBondContact O-N 3.1Å; N338-I340 PolarHBondContact O-N 3.49Å; N338-S341 WeakPolarHBondContact O-CB 3.44Å; N338-S341 PolarHBondContact O-N 2.94Å; N338-D342 WeakPolarHBondContact O-CB 3.32Å; N338-D342 PolarHBondContact O-N 2.82Å; N338-C419 WeakPolarHBondContact OD1-CA 3.43Å; N338-C419 WeakPolarHBondContact OD1-CB 3.33Å; N338-C419 PolarHBondContact OD1-N 3.33Å; N338-C419 VanDerWaalsContact OD1-N 3.15Å
339	W	93.5	Very high	92.6	Very high	8 Å²	8	29 Å²	29	3%	0.03	17%	0.166	C	C	.	.	H	α-helix	trans	-58.5	-44.2	179.4	-175.9	90.5	0	0	0	112.8	K335 L336 T343 I344 F451 Y454 V550 N551 I552 W554 I555	K335-W339 WeakPolarHBondContact O-CB 3.29Å; K335-W339 PolarHBondContact O-N 3.45Å; L336-W339 HydrophobicContact CD1-CE3 4.43Å; L336-W339 PolarHBondContact O-N 3.41Å; W339-T343 HydrophobicContact CZ2-CG2 3.98Å; W339-T343 PolarHBondContact NE1-OG1 3.13Å; W339-T343 WeakPolarHBondContact O-CA 3.42Å; W339-T343 WeakPolarHBondContact O-CB 3.25Å; W339-T343 PolarHBondContact O-N 3.09Å; W339-T343 PolarHBondContact O-OG1 3.18Å; W339-I344 HydrophobicContact CH2-CD1 4.02Å; W339-I344 HydrophobicContact CH2-CG1 4.42Å; W339-I344 HydrophobicContact CZ3-CD1 3.67Å; W339-I344 HydrophobicContact CZ3-CG1 4.28Å; W339-F451 HydrophobicContact CZ3-CD2 4.29Å; W339-F451 HydrophobicContact CZ3-CE2 4.22Å; W339-Y454 AromaticContact CH2-CD1 3.85Å; W339-Y454 HydrophobicContact CH2-CD1 3.85Å; W339-Y454 AromaticContact CH2-CE1 3.6Å; W339-Y454 HydrophobicContact CH2-CE1 3.6Å; W339-Y454 AromaticContact CZ2-CE1 3.91Å; W339-Y454 HydrophobicContact CZ2-CE1 3.91Å; W339-V550 HydrophobicContact CH2-CG1 4.45Å; W339-V550 HydrophobicContact CZ2-CG1 4.04Å; W339-N551 PolarHBondContact NE1-O 2.91Å; W339-I552 HydrophobicContact CD2-CB 4.26Å; W339-I552 HydrophobicContact CD2-CD1 3.93Å; W339-I552 HydrophobicContact CD2-CG1 3.79Å; W339-I552 HydrophobicContact CE3-CD1 3.63Å; W339-I552 HydrophobicContact CE3-CG1 4.03Å; W339-I552 HydrophobicContact CG-CG1 4.31Å; W339-I552 HydrophobicContact CH2-CB 4.37Å; W339-I552 HydrophobicContact CH2-CD1 3.72Å; W339-I552 HydrophobicContact CH2-CG1 4.32Å; W339-I552 HydrophobicContact CZ2-CB 3.78Å; W339-I552 HydrophobicContact CZ2-CD1 3.98Å; W339-I552 HydrophobicContact CZ2-CG1 4.07Å; W339-I552 HydrophobicContact CZ3-CD1 3.52Å; W339-I552 HydrophobicContact CZ3-CG1 4.29Å; W339-W554 HydrophobicContact CB-CZ2 4.33Å; W339-W554 AromaticContact CD1-NE1 3.54Å; W339-I555 HydrophobicContact CB-CG2 4.37Å
340	I	93.8	Very high	93	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-63.7	-44.4	176.2	-66.6	170	0	0	0	111.1	L336 N338 I344 L345 M420 L447 F522	L336-I340 HydrophobicContact CD1-CD1 4.04Å; L336-I340 HydrophobicContact CD1-CG1 4.16Å; L336-I340 HydrophobicContact CG-CD1 3.99Å; L336-I340 HydrophobicContact CG-CG1 4.49Å; L336-I340 WeakPolarHBondContact O-CG1 3.5Å; L336-I340 PolarHBondContact O-N 3.35Å; N338-I340 PolarHBondContact O-N 3.49Å; I340-I344 WeakPolarHBondContact O-CB 3.27Å; I340-I344 PolarHBondContact O-N 3.36Å; I340-L345 HydrophobicContact CG2-CD1 4.32Å; I340-L345 HydrophobicContact CG2-CG 4.37Å; I340-L345 PolarHBondContact O-N 3.15Å; I340-L345 VanDerWaalsContact O-N 3.09Å; I340-M420 HydrophobicContact CB-CE 4.14Å; I340-M420 HydrophobicContact CG2-CE 4.14Å; I340-M420 HydrophobicContact CG2-SD 4.28Å; I340-L447 HydrophobicContact CG2-CD2 4.21Å; I340-F522 HydrophobicContact CD1-CE1 4.34Å
341	S	93.7	Very high	93.4	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.014	18%	0.183	C	C	.	.	I	π-helix	trans	-56.7	-57.7	175.3	166.7	0	0	0	0	111.5	R337 N338 L345 V346	R337-S341 WeakPolarHBondContact O-CB 3.44Å; R337-S341 PolarHBondContact O-N 3.21Å; R337-S341 VanDerWaalsContact O-N 3.13Å; N338-S341 WeakPolarHBondContact O-CB 3.44Å; N338-S341 PolarHBondContact O-N 2.94Å; S341-L345 PolarHBondContact O-N 2.92Å; S341-V346 WeakPolarHBondContact O-CB 3.44Å; S341-V346 WeakPolarHBondContact O-CG2 3.42Å; S341-V346 PolarHBondContact O-N 3.21Å
342	D	92.6	Very high	93.6	Very high	90 Å²	90	31.6 Å²	31.6	48%	0.481	17%	0.167	S	C	.	.	I	π-helix	trans	-87	-26.5	-162	-53.8	-17.7	0	0	0	111.9	N338 P347	N338-D342 WeakPolarHBondContact O-CB 3.32Å; N338-D342 PolarHBondContact O-N 2.82Å; D342-P347 WeakPolarHBondContact O-CD 3.45Å
343	T	92.4	Very high	93.7	Very high	47 Å²	47	33.8 Å²	33.8	29%	0.288	18%	0.18	S	C	.	.	I	π-helix	trans	-93.2	-26.9	-179.6	-41.2	0	0	0	0	113	W339	W339-T343 HydrophobicContact CZ2-CG2 3.98Å; W339-T343 PolarHBondContact NE1-OG1 3.13Å; W339-T343 WeakPolarHBondContact O-CA 3.42Å; W339-T343 WeakPolarHBondContact O-CB 3.25Å; W339-T343 PolarHBondContact O-N 3.09Å; W339-T343 PolarHBondContact O-OG1 3.18Å
344	I	94.3	Very high	93.9	Very high	5 Å²	5	35.4 Å²	35.4	3%	0.026	19%	0.192	C	C	.	.	I	π-helix	trans	-121.5	-60.1	-174.7	-40.2	175.3	0	0	0	112.1	W339 I340 P347 L348 Y397 V450 Y454	W339-I344 HydrophobicContact CH2-CD1 4.02Å; W339-I344 HydrophobicContact CH2-CG1 4.42Å; W339-I344 HydrophobicContact CZ3-CD1 3.67Å; W339-I344 HydrophobicContact CZ3-CG1 4.28Å; I340-I344 WeakPolarHBondContact O-CB 3.27Å; I340-I344 PolarHBondContact O-N 3.36Å; I344-P347 WeakPolarHBondContact O-CD 3.28Å; I344-L348 WeakPolarHBondContact O-CB 3.34Å; I344-L348 PolarHBondContact O-N 3.29Å; I344-Y397 HydrophobicContact CG2-CE1 3.94Å; I344-V450 HydrophobicContact CB-CG1 4.24Å; I344-V450 HydrophobicContact CG2-CG1 3.44Å; I344-V450 VanDerWaalsContact CG2-CG1 3.44Å; I344-Y454 HydrophobicContact CB-CD2 4.41Å; I344-Y454 HydrophobicContact CD1-CD1 3.92Å; I344-Y454 HydrophobicContact CD1-CD2 4.17Å; I344-Y454 HydrophobicContact CD1-CG 3.66Å; I344-Y454 HydrophobicContact CG1-CD1 4.24Å; I344-Y454 HydrophobicContact CG1-CD2 3.8Å; I344-Y454 HydrophobicContact CG1-CE2 4.18Å; I344-Y454 HydrophobicContact CG1-CG 3.83Å; I344-Y454 HydrophobicContact CG2-CD2 3.96Å; I344-Y454 HydrophobicContact CG2-CG 4.29Å
345	L	94.8	Very high	94	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.176	C	C	.	.	I	π-helix	trans	-67.5	-48.8	-171.4	-61.6	175.7	0	0	0	112.9	I340 S341 L348 V349 I411 L414 M420 L447 V450	I340-L345 HydrophobicContact CG2-CD1 4.32Å; I340-L345 HydrophobicContact CG2-CG 4.37Å; I340-L345 PolarHBondContact O-N 3.15Å; I340-L345 VanDerWaalsContact O-N 3.09Å; S341-L345 PolarHBondContact O-N 2.92Å; L345-L348 PolarHBondContact O-N 3Å; L345-V349 WeakPolarHBondContact O-CG2 3.36Å; L345-V349 PolarHBondContact O-N 2.99Å; L345-I411 HydrophobicContact CD2-CG2 4.25Å; L345-L414 HydrophobicContact CD1-CB 3.99Å; L345-M420 HydrophobicContact CD1-CG 4.33Å; L345-M420 HydrophobicContact CD1-SD 3.66Å; L345-L447 HydrophobicContact CD1-CD2 3.95Å; L345-L447 HydrophobicContact CD2-CD2 4.36Å; L345-V450 HydrophobicContact CD2-CG1 3.99Å
346	V	94.8	Very high	94.1	Very high	37 Å²	37	31.9 Å²	31.9	22%	0.224	17%	0.169	C	C	.	.	H	α-helix	trans	-64.9	-42.1	-179.1	169.8	0	0	0	0	112.1	S341 K350	S341-V346 WeakPolarHBondContact O-CB 3.44Å; S341-V346 WeakPolarHBondContact O-CG2 3.42Å; S341-V346 PolarHBondContact O-N 3.21Å; V346-K350 HydrophobicContact CG1-CD 4.44Å; V346-K350 WeakPolarHBondContact O-CG 3.4Å; V346-K350 PolarHBondContact O-N 3.29Å
347	P	94.6	Very high	94.1	Very high	52 Å²	52	34.8 Å²	34.8	34%	0.338	19%	0.189	S	C	.	.	H	α-helix	trans	-63.2	-43.4	169.2	-27.5	38	0	0	0	113.5	D342 I344 V349 K350 E351	D342-P347 WeakPolarHBondContact O-CD 3.45Å; I344-P347 WeakPolarHBondContact O-CD 3.28Å; P347-V349 PolarHBondContact O-N 2.99Å; P347-K350 PolarHBondContact O-N 3.45Å; P347-E351 PolarHBondContact O-N 3.12Å
348	L	95.1	Very high	93.9	Very high	12 Å²	12	37.1 Å²	37.1	6%	0.063	20%	0.201	C	C	.	.	H	α-helix	trans	-60.1	-42.9	-179.8	178.3	61.3	0	0	0	112.1	I344 L345 E351 I352 I394 Y397 I411	I344-L348 WeakPolarHBondContact O-CB 3.34Å; I344-L348 PolarHBondContact O-N 3.29Å; L345-L348 PolarHBondContact O-N 3Å; L348-E351 PolarHBondContact O-N 3.31Å; L348-I352 HydrophobicContact CD1-CD1 4.13Å; L348-I352 HydrophobicContact CD1-CG1 4.36Å; L348-I352 HydrophobicContact CG-CD1 3.96Å; L348-I352 WeakPolarHBondContact O-CB 3.38Å; L348-I352 VanDerWaalsContact O-CG1 3.25Å; L348-I352 WeakPolarHBondContact O-CG1 3.41Å; L348-I352 PolarHBondContact O-N 3.01Å; L348-I394 HydrophobicContact CD1-CG1 4.46Å; L348-I394 HydrophobicContact CD1-CG2 4.25Å; L348-Y397 HydrophobicContact CD1-CD2 4.02Å; L348-Y397 HydrophobicContact CD1-CG 4.04Å; L348-Y397 HydrophobicContact CD2-CD1 4Å; L348-Y397 HydrophobicContact CD2-CG 3.96Å; L348-I411 HydrophobicContact CD2-CD1 4.29Å; L348-I411 HydrophobicContact CD2-CG2 4.22Å
349	V	95.4	Very high	93.8	Very high	13 Å²	13	34.2 Å²	34.2	8%	0.079	19%	0.186	C	C	.	.	H	α-helix	trans	-61.9	-43.7	175.1	172.3	0	0	0	0	111.5	L345 P347 E351 I352 D353 I411 R412	L345-V349 WeakPolarHBondContact O-CG2 3.36Å; L345-V349 PolarHBondContact O-N 2.99Å; P347-V349 PolarHBondContact O-N 2.99Å; V349-E351 PolarHBondContact O-N 3.13Å; V349-I352 PolarHBondContact O-N 3.45Å; V349-D353 PolarHBondContact O-N 2.91Å; V349-I411 HydrophobicContact CG2-CG2 3.76Å; V349-R412 HydrophobicContact CG1-CG 4Å; V349-R412 HydrophobicContact CG2-CG 4.06Å
350	K	95.1	Very high	93.7	Very high	137 Å²	137	40 Å²	40	60%	0.596	21%	0.207	S	C	*	.	H	α-helix	trans	-63	-40.7	177.8	-69.8	169.7	-176.2	175.8	0	112.2	V346 P347 S354	V346-K350 HydrophobicContact CG1-CD 4.44Å; V346-K350 WeakPolarHBondContact O-CG 3.4Å; V346-K350 PolarHBondContact O-N 3.29Å; P347-K350 PolarHBondContact O-N 3.45Å; K350-S354 WeakPolarHBondContact O-CB 3.34Å; K350-S354 PolarHBondContact O-N 3.29Å
351	E	94.6	Very high	93.5	Very high	78 Å²	78	50.8 Å²	50.8	36%	0.364	25%	0.248	S	C	.	.	H	α-helix	trans	-68.4	-39.1	175.5	-73.4	-58.4	131.3	0	0	112.1	P347 L348 V349 S354 V355 I394	P347-E351 PolarHBondContact O-N 3.12Å; L348-E351 PolarHBondContact O-N 3.31Å; V349-E351 PolarHBondContact O-N 3.13Å; E351-S354 PolarHBondContact O-N 3.28Å; E351-V355 WeakPolarHBondContact O-CB 3.16Å; E351-V355 WeakPolarHBondContact O-CG2 3.13Å; E351-V355 PolarHBondContact O-N 3.36Å; E351-I394 HydrophobicContact CB-CD1 3.93Å; E351-I394 HydrophobicContact CB-CG1 4.39Å
352	I	94.6	Very high	93.1	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-58.2	-49.9	172.5	-74.4	167	0	0	0	110.9	L348 V349 V355 N356 I369 I394 V408	L348-I352 HydrophobicContact CD1-CD1 4.13Å; L348-I352 HydrophobicContact CD1-CG1 4.36Å; L348-I352 HydrophobicContact CG-CD1 3.96Å; L348-I352 WeakPolarHBondContact O-CB 3.38Å; L348-I352 VanDerWaalsContact O-CG1 3.25Å; L348-I352 WeakPolarHBondContact O-CG1 3.41Å; L348-I352 PolarHBondContact O-N 3.01Å; V349-I352 PolarHBondContact O-N 3.45Å; I352-V355 PolarHBondContact O-N 2.94Å; I352-N356 VanDerWaalsContact O-CB 3.3Å; I352-N356 WeakPolarHBondContact O-CB 3.49Å; I352-N356 VanDerWaalsContact O-CG 3.31Å; I352-N356 PolarHBondContact O-N 3.49Å; I352-I369 HydrophobicContact CB-CG2 4.5Å; I352-I369 HydrophobicContact CD1-CG2 4.41Å; I352-I369 HydrophobicContact CG1-CD1 4.41Å; I352-I369 HydrophobicContact CG1-CG2 4.12Å; I352-I369 HydrophobicContact CG2-CB 4.06Å; I352-I369 HydrophobicContact CG2-CD1 4.46Å; I352-I369 HydrophobicContact CG2-CG2 3.69Å; I352-I394 HydrophobicContact CD1-CG2 4.44Å; I352-I394 HydrophobicContact CG1-CG2 3.74Å; I352-V408 HydrophobicContact CG2-CG1 4.24Å
353	D	94.8	Very high	92.8	Very high	61 Å²	61	52.6 Å²	52.6	33%	0.326	27%	0.27	S	S	.	.	H	α-helix	trans	-71.6	-30.8	-178	-65.9	-29.7	0	0	0	112	V349 S357 R412	V349-D353 PolarHBondContact O-N 2.91Å; D353-S357 WeakPolarHBondContact O-CB 3.45Å; D353-S357 PolarHBondContact O-N 2.86Å; D353-S357 PolarHBondContact O-OG 2.91Å; D353-R412 IonicContact OD1-CZ 2.8Å; D353-R412 IonicContact OD1-NH2 3.84Å; D353-R412 PolarHBondContact OD1-NH2 3.33Å
354	S	94.8	Very high	92.4	Very high	42 Å²	42	51.7 Å²	51.7	29%	0.294	27%	0.265	S	S	.	.	H	α-helix	trans	-62.9	-51.8	169.9	-179.6	0	0	0	0	111.7	K350 E351 N356 S357 Q358	K350-S354 WeakPolarHBondContact O-CB 3.34Å; K350-S354 PolarHBondContact O-N 3.29Å; E351-S354 PolarHBondContact O-N 3.28Å; S354-N356 PolarHBondContact O-N 3.31Å; S354-S357 WeakPolarHBondContact O-CA 3.49Å; S354-S357 WeakPolarHBondContact O-CB 3.39Å; S354-S357 PolarHBondContact O-N 3.02Å; S354-Q358 WeakPolarHBondContact O-CG 3.39Å; S354-Q358 PolarHBondContact O-N 3.49Å
355	V	93.2	Very high	92	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-65.7	-39.4	179.2	168.8	0	0	0	0	111.5	E351 I352 S357 Q358 L359 I369 I388 L391 I394	E351-V355 WeakPolarHBondContact O-CB 3.16Å; E351-V355 WeakPolarHBondContact O-CG2 3.13Å; E351-V355 PolarHBondContact O-N 3.36Å; I352-V355 PolarHBondContact O-N 2.94Å; V355-S357 PolarHBondContact O-N 3.41Å; V355-Q358 PolarHBondContact O-N 3.42Å; V355-Q358 VanDerWaalsContact O-N 3.16Å; V355-L359 HydrophobicContact CG1-CD1 3.78Å; V355-L359 HydrophobicContact CG1-CG 4.28Å; V355-L359 WeakPolarHBondContact O-CB 3.4Å; V355-L359 VanDerWaalsContact O-CG 3.32Å; V355-L359 WeakPolarHBondContact O-CG 3.22Å; V355-L359 PolarHBondContact O-N 2.77Å; V355-I369 HydrophobicContact CB-CD1 4.14Å; V355-I369 HydrophobicContact CG1-CD1 3.78Å; V355-I388 HydrophobicContact CB-CG2 4.4Å; V355-I388 HydrophobicContact CG1-CD1 4.16Å; V355-I388 HydrophobicContact CG1-CG2 4.04Å; V355-I388 HydrophobicContact CG2-CG2 3.58Å; V355-L391 HydrophobicContact CG1-CB 4.38Å; V355-L391 HydrophobicContact CG1-CD1 4.05Å; V355-I394 HydrophobicContact CB-CD1 4.21Å; V355-I394 HydrophobicContact CG2-CD1 3.64Å
356	N	94.2	Very high	91.6	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.016	31%	0.307	C	S	.	.	H	α-helix	trans	-61.4	-32.3	171.6	-79.8	-16.9	0	0	0	112.8	I352 S354 R360 Q368 I369	I352-N356 VanDerWaalsContact O-CB 3.3Å; I352-N356 WeakPolarHBondContact O-CB 3.49Å; I352-N356 VanDerWaalsContact O-CG 3.31Å; I352-N356 PolarHBondContact O-N 3.49Å; S354-N356 PolarHBondContact O-N 3.31Å; N356-R360 PolarHBondContact O-N 2.9Å; N356-R360 PolarHBondContact O-NE 3.34Å; N356-Q368 HydrophobicContact CB-CG 4.5Å; N356-Q368 WeakPolarHBondContact OD1-CA 3.26Å; N356-I369 PolarHBondContact ND2-O 2.94Å; N356-I369 WeakPolarHBondContact OD1-CB 3.34Å; N356-I369 PolarHBondContact OD1-N 3.32Å
357	S	93.3	Very high	91.3	Very high	61 Å²	61	59.4 Å²	59.4	43%	0.427	31%	0.305	S	S	.	.	H	α-helix	trans	-73.4	-37.6	174	-59.3	0	0	0	0	112	D353 S354 V355 R361	D353-S357 WeakPolarHBondContact O-CB 3.45Å; D353-S357 PolarHBondContact O-N 2.86Å; D353-S357 PolarHBondContact O-OG 2.91Å; S354-S357 WeakPolarHBondContact O-CA 3.49Å; S354-S357 WeakPolarHBondContact O-CB 3.39Å; S354-S357 PolarHBondContact O-N 3.02Å; V355-S357 PolarHBondContact O-N 3.41Å; S357-R361 WeakPolarHBondContact O-CG 3.32Å; S357-R361 PolarHBondContact O-N 3.11Å; S357-R361 VanDerWaalsContact O-N 3.09Å
358	Q	90.6	Very high	91.1	Very high	69 Å²	69	57.6 Å²	57.6	32%	0.322	29%	0.292	S	S	.	.	H	α-helix	trans	-68.3	-43.8	175.1	-67.2	173.7	12.5	0	0	112	S354 V355 R360 R361 M362 I388	S354-Q358 WeakPolarHBondContact O-CG 3.39Å; S354-Q358 PolarHBondContact O-N 3.49Å; V355-Q358 PolarHBondContact O-N 3.42Å; V355-Q358 VanDerWaalsContact O-N 3.16Å; Q358-R360 PolarHBondContact O-N 3.5Å; Q358-R361 PolarHBondContact O-N 2.63Å; Q358-R361 VanDerWaalsContact O-N 3.13Å; Q358-M362 WeakPolarHBondContact O-CG 3.42Å; Q358-M362 PolarHBondContact O-N 3.47Å; Q358-I388 HydrophobicContact CB-CD1 3.66Å; Q358-I388 HydrophobicContact CB-CG1 4.43Å
359	L	89.8	Confident	90.8	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60.5	-43.3	177	-73	164.9	0	0	0	112.1	V355 M362 G363 C364 L367 K384 I388	V355-L359 HydrophobicContact CG1-CD1 3.78Å; V355-L359 HydrophobicContact CG1-CG 4.28Å; V355-L359 WeakPolarHBondContact O-CB 3.4Å; V355-L359 VanDerWaalsContact O-CG 3.32Å; V355-L359 WeakPolarHBondContact O-CG 3.22Å; V355-L359 PolarHBondContact O-N 2.77Å; L359-M362 HydrophobicContact CD2-CE 3.94Å; L359-M362 PolarHBondContact O-N 3.5Å; L359-G363 PolarHBondContact O-N 3.35Å; L359-C364 PolarHBondContact O-N 3.05Å; L359-L367 WeakPolarHBondContact CD1-O 3.38Å; L359-L367 HydrophobicContact CD2-CB 4.34Å; L359-K384 HydrophobicContact CD2-CD 4.28Å; L359-I388 HydrophobicContact CD2-CD1 4.16Å; L359-I388 HydrophobicContact CG-CD1 4.04Å
360	R	90.4	Very high	90.4	Very high	129 Å²	129	57.2 Å²	57.2	49%	0.487	29%	0.292	S	S	.	.	H	α-helix	trans	-58.1	-47.4	169.8	-84.4	-174.7	-98.9	-109.5	-7.2	112.5	N356 Q358 M362 G363 P365	N356-R360 PolarHBondContact O-N 2.9Å; N356-R360 PolarHBondContact O-NE 3.34Å; Q358-R360 PolarHBondContact O-N 3.5Å; R360-M362 PolarHBondContact O-N 2.96Å; R360-G363 PolarHBondContact O-N 3.35Å; R360-P365 HydrophobicContact CG-CB 4.43Å
361	R	90.3	Very high	90.1	Very high	228 Å²	228	57.2 Å²	57.2	86%	0.86	30%	0.295	S	S	*	.	H	α-helix	trans	-65.2	-24.1	179.2	-75.2	179.5	67.3	-175	0.3	113.9	S357 Q358 G363	S357-R361 WeakPolarHBondContact O-CG 3.32Å; S357-R361 PolarHBondContact O-N 3.11Å; S357-R361 VanDerWaalsContact O-N 3.09Å; Q358-R361 PolarHBondContact O-N 2.63Å; Q358-R361 VanDerWaalsContact O-N 3.13Å; R361-G363 VanDerWaalsContact C-N 3.32Å
362	M	86.3	Confident	89.9	Confident	72 Å²	72	53.9 Å²	53.9	36%	0.355	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	6.4	172.8	-67	-173.1	-59	0	0	113.7	Q358 L359 R360 K384 L387 I388	Q358-M362 WeakPolarHBondContact O-CG 3.42Å; Q358-M362 PolarHBondContact O-N 3.47Å; L359-M362 HydrophobicContact CD2-CE 3.94Å; L359-M362 PolarHBondContact O-N 3.5Å; R360-M362 PolarHBondContact O-N 2.96Å; M362-K384 HydrophobicContact CE-CD 3.89Å; M362-L387 HydrophobicContact SD-CB 4.19Å; M362-L387 HydrophobicContact SD-CD1 3.89Å; M362-I388 HydrophobicContact CE-CD1 3.5Å; M362-I388 VanDerWaalsContact CE-CD1 3.5Å; M362-I388 HydrophobicContact CE-CG1 3.98Å
363	G	85	Confident	89.7	Confident	58 Å²	58	56.5 Å²	56.5	60%	0.598	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	19.5	177.9	0	0	0	0	0	115.2	L359 R360 R361 P365	L359-G363 PolarHBondContact O-N 3.35Å; R360-G363 PolarHBondContact O-N 3.35Å; R361-G363 VanDerWaalsContact C-N 3.32Å; G363-P365 WeakPolarHBondContact O-CD 3.3Å
364	C	85.3	Confident	89.6	Confident	27 Å²	27	54.4 Å²	54.4	18%	0.182	29%	0.287	C	S	.	.			trans	-119.4	65.1	177	-71.1	0	0	0	0	112.3	L359 E366 L367 K384	L359-C364 PolarHBondContact O-N 3.05Å; C364-E366 VanDerWaalsContact C-OE2 3.26Å; C364-E366 VanDerWaalsContact CA-OE1 3.28Å; C364-E366 WeakPolarHBondContact CA-OE1 3.35Å; C364-E366 VanDerWaalsContact CA-OE2 3.29Å; C364-E366 WeakPolarHBondContact CA-OE2 3.33Å; C364-E366 WeakPolarHBondContact CB-OE1 3.34Å; C364-E366 PolarHBondContact O-N 3.19Å; C364-E366 PolarHBondContact SG-OE1 3.32Å; C364-L367 HydrophobicContact CB-CB 4.45Å; C364-L367 HydrophobicContact CB-CD1 4.05Å; C364-L367 HydrophobicContact CB-CG 4.46Å; C364-L367 PolarHBondContact O-N 3Å; C364-K384 PolarHBondContact SG-NZ 2.66Å
365	P	85.3	Confident	89.4	Confident	62 Å²	62	56.2 Å²	56.2	40%	0.403	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-63.8	-25.3	176.5	29.1	-36.5	0	0	0	113.4	R360 G363 L367 Q368	R360-P365 HydrophobicContact CG-CB 4.43Å; G363-P365 WeakPolarHBondContact O-CD 3.3Å; P365-L367 PolarHBondContact O-N 2.83Å; P365-Q368 VanDerWaalsContact O-CG 3.25Å; P365-Q368 WeakPolarHBondContact O-CG 3.42Å; P365-Q368 PolarHBondContact O-N 2.92Å; P365-Q368 PolarHBondContact O-NE2 2.84Å
366	E	86.5	Confident	89.4	Confident	111 Å²	111	58.4 Å²	58.4	52%	0.519	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-70.1	-12.1	178.8	73.4	-62	146.3	0	0	114.4	C364	C364-E366 VanDerWaalsContact C-OE2 3.26Å; C364-E366 VanDerWaalsContact CA-OE1 3.28Å; C364-E366 WeakPolarHBondContact CA-OE1 3.35Å; C364-E366 VanDerWaalsContact CA-OE2 3.29Å; C364-E366 WeakPolarHBondContact CA-OE2 3.33Å; C364-E366 WeakPolarHBondContact CB-OE1 3.34Å; C364-E366 PolarHBondContact O-N 3.19Å; C364-E366 PolarHBondContact SG-OE1 3.32Å
367	L	87.7	Confident	89.2	Confident	31 Å²	31	58.2 Å²	58.2	16%	0.162	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-98.6	14.5	177.9	-69.5	174.9	0	0	0	113.3	L359 C364 P365 I369 L377 A380	L359-L367 WeakPolarHBondContact CD1-O 3.38Å; L359-L367 HydrophobicContact CD2-CB 4.34Å; C364-L367 HydrophobicContact CB-CB 4.45Å; C364-L367 HydrophobicContact CB-CD1 4.05Å; C364-L367 HydrophobicContact CB-CG 4.46Å; C364-L367 PolarHBondContact O-N 3Å; P365-L367 PolarHBondContact O-N 2.83Å; L367-I369 PolarHBondContact O-N 2.86Å; L367-L377 WeakPolarHBondContact O-CD2 3.43Å; L367-A380 HydrophobicContact CD1-CB 4.02Å; L367-A380 HydrophobicContact CD2-CB 4.37Å
368	Q	90.2	Very high	89.1	Confident	15 Å²	15	60.3 Å²	60.3	7%	0.07	31%	0.313	C	S	.	.			trans	-61.5	133.4	179.4	-82.2	176.6	92.7	0	0	113.4	N356 P365 G370 E371 A372	N356-Q368 HydrophobicContact CB-CG 4.5Å; N356-Q368 WeakPolarHBondContact OD1-CA 3.26Å; P365-Q368 VanDerWaalsContact O-CG 3.25Å; P365-Q368 WeakPolarHBondContact O-CG 3.42Å; P365-Q368 PolarHBondContact O-N 2.92Å; P365-Q368 PolarHBondContact O-NE2 2.84Å; Q368-G370 PolarHBondContact O-N 3.38Å; Q368-E371 HydrophobicContact CB-CB 4.27Å; Q368-E371 HydrophobicContact CB-CG 4.49Å; Q368-E371 PolarHBondContact NE2-OE2 3.16Å; Q368-E371 PolarHBondContact O-N 3.05Å; Q368-E371 VanDerWaalsContact O-N 3.08Å; Q368-A372 VanDerWaalsContact O-CB 3.29Å; Q368-A372 WeakPolarHBondContact O-CB 3.35Å; Q368-A372 PolarHBondContact O-N 3.08Å
369	I	90.1	Very high	89.1	Confident	4 Å²	4	62.9 Å²	62.9	2%	0.021	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-62.2	118.3	168.7	-61.9	159.4	0	0	0	108.9	I352 V355 N356 L367 L377 L391 I394 L398 V408	I352-I369 HydrophobicContact CB-CG2 4.5Å; I352-I369 HydrophobicContact CD1-CG2 4.41Å; I352-I369 HydrophobicContact CG1-CD1 4.41Å; I352-I369 HydrophobicContact CG1-CG2 4.12Å; I352-I369 HydrophobicContact CG2-CB 4.06Å; I352-I369 HydrophobicContact CG2-CD1 4.46Å; I352-I369 HydrophobicContact CG2-CG2 3.69Å; V355-I369 HydrophobicContact CB-CD1 4.14Å; V355-I369 HydrophobicContact CG1-CD1 3.78Å; N356-I369 PolarHBondContact ND2-O 2.94Å; N356-I369 WeakPolarHBondContact OD1-CB 3.34Å; N356-I369 PolarHBondContact OD1-N 3.32Å; L367-I369 PolarHBondContact O-N 2.86Å; I369-L377 HydrophobicContact CG1-CD1 4.28Å; I369-L377 HydrophobicContact CG1-CD2 3.83Å; I369-L391 HydrophobicContact CD1-CD1 4.14Å; I369-L391 HydrophobicContact CG1-CD1 4.47Å; I369-I394 HydrophobicContact CD1-CG2 4.02Å; I369-L398 HydrophobicContact CG1-CD1 4.37Å; I369-L398 HydrophobicContact CG2-CD1 3.62Å; I369-L398 HydrophobicContact CG2-CD2 4.28Å; I369-V408 HydrophobicContact CG2-CG2 3.74Å
370	G	87.3	Confident	89	Confident	13 Å²	13	63.1 Å²	63.1	13%	0.134	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	112.2	-35.1	-173.8	0	0	0	0	0	113	Q368 E405	Q368-G370 PolarHBondContact O-N 3.38Å; G370-E405 VanDerWaalsContact O-CA 3.23Å; G370-E405 WeakPolarHBondContact O-CA 3.39Å; G370-E405 WeakPolarHBondContact O-CB 3.5Å; G370-E405 PolarHBondContact O-N 3.29Å; G370-E405 VanDerWaalsContact O-N 3.1Å
371	E	88	Confident	89	Confident	137 Å²	137	57.2 Å²	57.2	64%	0.64	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-39.5	178.8	-64.9	173.4	-170.4	0	0	111.8	Q368	Q368-E371 HydrophobicContact CB-CB 4.27Å; Q368-E371 HydrophobicContact CB-CG 4.49Å; Q368-E371 PolarHBondContact NE2-OE2 3.16Å; Q368-E371 PolarHBondContact O-N 3.05Å; Q368-E371 VanDerWaalsContact O-N 3.08Å
372	A	90.8	Very high	89	Confident	8 Å²	8	52 Å²	52	7%	0.066	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-80.9	151.1	-178.5	0	0	0	0	0	112.9	Q368 L377	Q368-A372 VanDerWaalsContact O-CB 3.29Å; Q368-A372 WeakPolarHBondContact O-CB 3.35Å; Q368-A372 PolarHBondContact O-N 3.08Å; A372-L377 HydrophobicContact CB-CD2 4.05Å; A372-L377 HydrophobicContact CB-CG 4.11Å
373	S	91	Very high	89.1	Confident	55 Å²	55	55.1 Å²	55.1	39%	0.385	31%	0.314	S	S	.	.			trans	-68.9	149.9	175.5	85.7	0	0	0	0	112.1	S375 S376 L377	S373-S375 PolarHBondContact O-N 2.89Å; S373-S375 VanDerWaalsContact O-N 3.15Å; S373-S376 WeakPolarHBondContact O-CA 3.47Å; S373-S376 WeakPolarHBondContact O-CB 3.47Å; S373-S376 PolarHBondContact O-N 3.03Å; S373-S376 PolarHBondContact OG-N 3.36Å; S373-S376 VanDerWaalsContact OG-N 3.14Å; S373-S376 PolarHBondContact OG-OG 2.97Å; S373-L377 WeakPolarHBondContact O-CG 3.46Å; S373-L377 PolarHBondContact O-N 3.21Å
374	I	92	Very high	89.1	Confident	18 Å²	18	53.9 Å²	53.9	9%	0.092	29%	0.292	C	S	.	.	H	α-helix	trans	-56.5	-31.7	176.6	-171.6	60.2	0	0	0	112.8	R378 V395 L398 Q404	I374-R378 WeakPolarHBondContact O-CB 3.46Å; I374-R378 VanDerWaalsContact O-CG 3.3Å; I374-R378 WeakPolarHBondContact O-CG 3.36Å; I374-R378 PolarHBondContact O-N 2.86Å; I374-V395 HydrophobicContact CD1-CG1 4.17Å; I374-L398 HydrophobicContact CD1-CB 3.77Å; I374-Q404 HydrophobicContact CB-CG 4.45Å
375	S	91.2	Very high	89	Confident	80 Å²	80	54.7 Å²	54.7	56%	0.559	30%	0.301	S	S	*	.	H	α-helix	trans	-69	-41.4	174.9	-55.2	0	0	0	0	112.2	S373 R378 Q379	S373-S375 PolarHBondContact O-N 2.89Å; S373-S375 VanDerWaalsContact O-N 3.15Å; S375-R378 WeakPolarHBondContact O-CB 3.43Å; S375-R378 PolarHBondContact O-N 3.39Å; S375-Q379 PolarHBondContact O-N 3.38Å
376	S	91.4	Very high	89	Confident	45 Å²	45	57.1 Å²	57.1	32%	0.315	32%	0.319	S	S	.	.	H	α-helix	trans	-64.5	-41.7	174.3	-50.4	0	0	0	0	111.2	S373 Q379 A380	S373-S376 WeakPolarHBondContact O-CA 3.47Å; S373-S376 WeakPolarHBondContact O-CB 3.47Å; S373-S376 PolarHBondContact O-N 3.03Å; S373-S376 PolarHBondContact OG-N 3.36Å; S373-S376 VanDerWaalsContact OG-N 3.14Å; S373-S376 PolarHBondContact OG-OG 2.97Å; S376-Q379 PolarHBondContact O-N 2.94Å; S376-A380 WeakPolarHBondContact O-CB 3.31Å; S376-A380 PolarHBondContact O-N 3.46Å
377	L	90.9	Very high	89	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-65.5	-40.2	176.2	-66.3	172.3	0	0	0	112.1	L367 I369 A372 S373 A380 A381 V395 L398	L367-L377 WeakPolarHBondContact O-CD2 3.43Å; I369-L377 HydrophobicContact CG1-CD1 4.28Å; I369-L377 HydrophobicContact CG1-CD2 3.83Å; A372-L377 HydrophobicContact CB-CD2 4.05Å; A372-L377 HydrophobicContact CB-CG 4.11Å; S373-L377 WeakPolarHBondContact O-CG 3.46Å; S373-L377 PolarHBondContact O-N 3.21Å; L377-A380 PolarHBondContact O-N 2.91Å; L377-A381 WeakPolarHBondContact O-CB 3.41Å; L377-A381 PolarHBondContact O-N 3.41Å; L377-V395 HydrophobicContact CB-CG2 3.94Å; L377-L398 HydrophobicContact CD1-CD1 4.12Å
378	R	91.1	Very high	89	Confident	104 Å²	104	55.8 Å²	55.8	39%	0.392	32%	0.315	S	S	.	.	H	α-helix	trans	-59.1	-46.7	171.1	-81.3	170.2	152.4	123.9	-0.8	112.3	I374 S375 A381 V382 V395 D399	I374-R378 WeakPolarHBondContact O-CB 3.46Å; I374-R378 VanDerWaalsContact O-CG 3.3Å; I374-R378 WeakPolarHBondContact O-CG 3.36Å; I374-R378 PolarHBondContact O-N 2.86Å; S375-R378 WeakPolarHBondContact O-CB 3.43Å; S375-R378 PolarHBondContact O-N 3.39Å; R378-A381 WeakPolarHBondContact O-CB 3.28Å; R378-A381 PolarHBondContact O-N 2.91Å; R378-V382 PolarHBondContact O-N 2.98Å; R378-V395 HydrophobicContact CG-CG1 3.58Å; R378-D399 IonicContact CZ-OD1 3.3Å; R378-D399 IonicContact CZ-OD2 2.74Å; R378-D399 IonicContact NH1-OD1 2.97Å; R378-D399 PolarHBondContact NH1-OD1 3.38Å; R378-D399 IonicContact NH2-OD1 2.65Å; R378-D399 PolarHBondContact NH2-OD1 3.28Å; R378-D399 IonicContact NH2-OD2 3.31Å; R378-D399 PolarHBondContact NH2-OD2 3.45Å
379	Q	90.5	Very high	88.8	Confident	124 Å²	124	59.3 Å²	59.3	58%	0.579	34%	0.339	S	S	*	.	H	α-helix	trans	-65	-41.1	177.5	-175.3	176.2	-0.6	0	0	111.4	S375 S376 V382 M383	S375-Q379 PolarHBondContact O-N 3.38Å; S376-Q379 PolarHBondContact O-N 2.94Å; Q379-V382 PolarHBondContact O-N 3.27Å; Q379-M383 HydrophobicContact CG-CG 4.31Å; Q379-M383 HydrophobicContact CG-SD 3.74Å; Q379-M383 WeakPolarHBondContact O-CB 3.34Å; Q379-M383 WeakPolarHBondContact O-CG 3.44Å; Q379-M383 PolarHBondContact O-N 2.94Å
380	A	88.6	Confident	88.8	Confident	5 Å²	5	61.7 Å²	61.7	4%	0.041	35%	0.354	C	S	.	.	H	α-helix	trans	-63.2	-39.5	175.4	0	0	0	0	0	112.6	L367 S376 L377 V382 M383 K384 L391	L367-A380 HydrophobicContact CD1-CB 4.02Å; L367-A380 HydrophobicContact CD2-CB 4.37Å; S376-A380 WeakPolarHBondContact O-CB 3.31Å; S376-A380 PolarHBondContact O-N 3.46Å; L377-A380 PolarHBondContact O-N 2.91Å; A380-V382 PolarHBondContact O-N 3.17Å; A380-M383 PolarHBondContact O-N 3.34Å; A380-K384 VanDerWaalsContact O-CB 3.28Å; A380-K384 WeakPolarHBondContact O-CB 3.48Å; A380-K384 PolarHBondContact O-N 2.83Å; A380-L391 HydrophobicContact CB-CD2 4.07Å
381	A	89.4	Confident	88.9	Confident	5 Å²	5	61 Å²	61	4%	0.041	35%	0.348	C	S	.	.	H	α-helix	trans	-56	-46.9	173.2	0	0	0	0	0	111.9	L377 R378 A385 L391 V395	L377-A381 WeakPolarHBondContact O-CB 3.41Å; L377-A381 PolarHBondContact O-N 3.41Å; R378-A381 WeakPolarHBondContact O-CB 3.28Å; R378-A381 PolarHBondContact O-N 2.91Å; A381-A385 VanDerWaalsContact O-CA 3.3Å; A381-A385 WeakPolarHBondContact O-CA 3.43Å; A381-A385 WeakPolarHBondContact O-CB 3.2Å; A381-A385 PolarHBondContact O-N 2.8Å; A381-A385 VanDerWaalsContact O-N 3.08Å; A381-L391 HydrophobicContact CB-CD2 4.37Å; A381-L391 HydrophobicContact CB-CG 4.02Å; A381-V395 HydrophobicContact CB-CG2 4.41Å
382	V	89.8	Confident	89	Confident	118 Å²	118	57.4 Å²	57.4	72%	0.715	34%	0.335	S	S	*	.	H	α-helix	trans	-68.9	-50.4	178.1	178.7	0	0	0	0	111.3	R378 Q379 A380 K384	R378-V382 PolarHBondContact O-N 2.98Å; Q379-V382 PolarHBondContact O-N 3.27Å; A380-V382 PolarHBondContact O-N 3.17Å; V382-K384 VanDerWaalsContact C-N 3.29Å; V382-K384 PolarHBondContact O-N 3.21Å
383	M	88.3	Confident	88.9	Confident	138 Å²	138	60.1 Å²	60.1	68%	0.68	35%	0.353	S	S	*	.	H	α-helix	trans	-69.1	-24.2	-175.3	-69.6	-178.4	67.7	0	0	113.9	Q379 A380	Q379-M383 HydrophobicContact CG-CG 4.31Å; Q379-M383 HydrophobicContact CG-SD 3.74Å; Q379-M383 WeakPolarHBondContact O-CB 3.34Å; Q379-M383 WeakPolarHBondContact O-CG 3.44Å; Q379-M383 PolarHBondContact O-N 2.94Å; A380-M383 PolarHBondContact O-N 3.34Å
384	K	85.3	Confident	89	Confident	32 Å²	32	57.8 Å²	57.8	14%	0.139	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	17.2	-177.8	-53.1	-172.2	-178.5	-176.3	0	112.9	L359 M362 C364 A380 V382 S386 L387 I388	L359-K384 HydrophobicContact CD2-CD 4.28Å; M362-K384 HydrophobicContact CE-CD 3.89Å; C364-K384 PolarHBondContact SG-NZ 2.66Å; A380-K384 VanDerWaalsContact O-CB 3.28Å; A380-K384 WeakPolarHBondContact O-CB 3.48Å; A380-K384 PolarHBondContact O-N 2.83Å; V382-K384 VanDerWaalsContact C-N 3.29Å; V382-K384 PolarHBondContact O-N 3.21Å; K384-S386 PolarHBondContact O-N 2.88Å; K384-S386 VanDerWaalsContact O-N 3.12Å; K384-L387 PolarHBondContact O-N 2.87Å; K384-I388 PolarHBondContact O-N 3.42Å
385	A	84.7	Confident	89	Confident	44 Å²	44	57.5 Å²	57.5	36%	0.364	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-34.7	-176.1	0	0	0	0	0	114.2	A381 P389	A381-A385 VanDerWaalsContact O-CA 3.3Å; A381-A385 WeakPolarHBondContact O-CA 3.43Å; A381-A385 WeakPolarHBondContact O-CB 3.2Å; A381-A385 PolarHBondContact O-N 2.8Å; A381-A385 VanDerWaalsContact O-N 3.08Å; A385-P389 WeakPolarHBondContact O-CA 3.34Å
386	S	85.1	Confident	89	Confident	112 Å²	112	57.2 Å²	57.2	78%	0.783	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-17.9	177.4	52.2	0	0	0	0	114.4	K384	K384-S386 PolarHBondContact O-N 2.88Å; K384-S386 VanDerWaalsContact O-N 3.12Å
387	L	85.6	Confident	89.1	Confident	113 Å²	113	56.2 Å²	56.2	59%	0.592	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-38.3	-178.3	-61.3	173.6	0	0	0	111.7	M362 K384	M362-L387 HydrophobicContact SD-CB 4.19Å; M362-L387 HydrophobicContact SD-CD1 3.89Å; K384-L387 PolarHBondContact O-N 2.87Å
388	I	87.5	Confident	89.2	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.01	32%	0.315	C	S	.	.			trans	-133.5	79.1	176.6	-46.7	-171.2	0	0	0	109.6	V355 Q358 L359 M362 K384 T390 L391	V355-I388 HydrophobicContact CB-CG2 4.4Å; V355-I388 HydrophobicContact CG1-CD1 4.16Å; V355-I388 HydrophobicContact CG1-CG2 4.04Å; V355-I388 HydrophobicContact CG2-CG2 3.58Å; Q358-I388 HydrophobicContact CB-CD1 3.66Å; Q358-I388 HydrophobicContact CB-CG1 4.43Å; L359-I388 HydrophobicContact CD2-CD1 4.16Å; L359-I388 HydrophobicContact CG-CD1 4.04Å; M362-I388 HydrophobicContact CE-CD1 3.5Å; M362-I388 VanDerWaalsContact CE-CD1 3.5Å; M362-I388 HydrophobicContact CE-CG1 3.98Å; K384-I388 PolarHBondContact O-N 3.42Å; I388-T390 PolarHBondContact O-N 3.28Å; I388-L391 HydrophobicContact CB-CB 4.22Å; I388-L391 HydrophobicContact CG2-CB 3.78Å; I388-L391 WeakPolarHBondContact O-CB 3.38Å; I388-L391 PolarHBondContact O-N 2.86Å
389	P	85.4	Confident	89.1	Confident	89 Å²	89	53.8 Å²	53.8	58%	0.578	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-26.5	178.9	25	-34.1	0	0	0	113	A385 L391	A385-P389 WeakPolarHBondContact O-CA 3.34Å; P389-L391 VanDerWaalsContact C-N 3.31Å; P389-L391 PolarHBondContact O-N 2.68Å
390	T	90.4	Very high	89.1	Confident	53 Å²	53	50.1 Å²	50.1	33%	0.325	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-24.5	178.6	52.3	0	0	0	0	113.5	I388 T392 S393 I394	I388-T390 PolarHBondContact O-N 3.28Å; T390-T392 VanDerWaalsContact C-N 3.27Å; T390-T392 PolarHBondContact O-N 3.31Å; T390-S393 WeakPolarHBondContact O-CB 3.25Å; T390-S393 PolarHBondContact O-N 3.03Å; T390-I394 WeakPolarHBondContact O-CG1 3.46Å; T390-I394 PolarHBondContact O-N 2.99Å
391	L	89.7	Confident	89.2	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.1	-38.1	179.9	177.6	58	0	0	0	111.5	V355 I369 A380 A381 I388 P389 S393 I394 V395	V355-L391 HydrophobicContact CG1-CB 4.38Å; V355-L391 HydrophobicContact CG1-CD1 4.05Å; I369-L391 HydrophobicContact CD1-CD1 4.14Å; I369-L391 HydrophobicContact CG1-CD1 4.47Å; A380-L391 HydrophobicContact CB-CD2 4.07Å; A381-L391 HydrophobicContact CB-CD2 4.37Å; A381-L391 HydrophobicContact CB-CG 4.02Å; I388-L391 HydrophobicContact CB-CB 4.22Å; I388-L391 HydrophobicContact CG2-CB 3.78Å; I388-L391 WeakPolarHBondContact O-CB 3.38Å; I388-L391 PolarHBondContact O-N 2.86Å; P389-L391 VanDerWaalsContact C-N 3.31Å; P389-L391 PolarHBondContact O-N 2.68Å; L391-S393 VanDerWaalsContact C-N 3.25Å; L391-S393 PolarHBondContact O-N 2.88Å; L391-I394 PolarHBondContact O-N 2.9Å; L391-V395 HydrophobicContact CD1-CG2 3.95Å; L391-V395 HydrophobicContact CG-CG2 4.38Å; L391-V395 WeakPolarHBondContact O-CB 3.43Å; L391-V395 VanDerWaalsContact O-CG2 3.27Å; L391-V395 WeakPolarHBondContact O-CG2 3.13Å; L391-V395 PolarHBondContact O-N 3.08Å
392	T	89.8	Confident	89.1	Confident	61 Å²	61	55.5 Å²	55.5	37%	0.374	33%	0.327	S	S	.	.	H	α-helix	trans	-62	-30.4	176	-54.6	0	0	0	0	113.1	T390 Q396	T390-T392 VanDerWaalsContact C-N 3.27Å; T390-T392 PolarHBondContact O-N 3.31Å; T392-Q396 PolarHBondContact O-NE2 3.33Å; T392-Q396 VanDerWaalsContact O-NE2 3.13Å
393	S	89.9	Confident	89.2	Confident	64 Å²	64	52.2 Å²	52.2	45%	0.448	31%	0.306	S	S	.	.	H	α-helix	trans	-79.8	-45.4	173.5	-56.9	0	0	0	0	111.5	T390 L391 V395 Q396 Y397	T390-S393 WeakPolarHBondContact O-CB 3.25Å; T390-S393 PolarHBondContact O-N 3.03Å; L391-S393 VanDerWaalsContact C-N 3.25Å; L391-S393 PolarHBondContact O-N 2.88Å; S393-V395 VanDerWaalsContact C-N 3.31Å; S393-V395 PolarHBondContact O-N 3.26Å; S393-Q396 WeakPolarHBondContact O-CB 3.49Å; S393-Q396 PolarHBondContact O-N 2.94Å; S393-Q396 VanDerWaalsContact O-N 3.13Å; S393-Y397 WeakPolarHBondContact O-CD2 3.47Å
394	I	92.7	Very high	89.4	Confident	7 Å²	7	46 Å²	46	4%	0.036	28%	0.275	C	S	.	.	H	α-helix	trans	-59.7	-41.8	-179.7	-62.8	165.4	0	0	0	111.1	L348 E351 I352 V355 I369 T390 L391 Q396 Y397 L398	L348-I394 HydrophobicContact CD1-CG1 4.46Å; L348-I394 HydrophobicContact CD1-CG2 4.25Å; E351-I394 HydrophobicContact CB-CD1 3.93Å; E351-I394 HydrophobicContact CB-CG1 4.39Å; I352-I394 HydrophobicContact CD1-CG2 4.44Å; I352-I394 HydrophobicContact CG1-CG2 3.74Å; V355-I394 HydrophobicContact CB-CD1 4.21Å; V355-I394 HydrophobicContact CG2-CD1 3.64Å; I369-I394 HydrophobicContact CD1-CG2 4.02Å; T390-I394 WeakPolarHBondContact O-CG1 3.46Å; T390-I394 PolarHBondContact O-N 2.99Å; L391-I394 PolarHBondContact O-N 2.9Å; I394-Q396 PolarHBondContact O-N 3.27Å; I394-Q396 VanDerWaalsContact O-N 3.1Å; I394-Y397 PolarHBondContact O-N 3.37Å; I394-L398 HydrophobicContact CG2-CD1 3.87Å; I394-L398 HydrophobicContact CG2-CG 4.29Å; I394-L398 WeakPolarHBondContact O-CG 3.39Å; I394-L398 PolarHBondContact O-N 3.1Å
395	V	91.8	Very high	89.7	Confident	11 Å²	11	47.6 Å²	47.6	7%	0.067	28%	0.283	C	S	.	.	H	α-helix	trans	-55.8	-28.4	178	163.6	0	0	0	0	113.1	I374 L377 R378 A381 L391 S393 L398 D399	I374-V395 HydrophobicContact CD1-CG1 4.17Å; L377-V395 HydrophobicContact CB-CG2 3.94Å; R378-V395 HydrophobicContact CG-CG1 3.58Å; A381-V395 HydrophobicContact CB-CG2 4.41Å; L391-V395 HydrophobicContact CD1-CG2 3.95Å; L391-V395 HydrophobicContact CG-CG2 4.38Å; L391-V395 WeakPolarHBondContact O-CB 3.43Å; L391-V395 VanDerWaalsContact O-CG2 3.27Å; L391-V395 WeakPolarHBondContact O-CG2 3.13Å; L391-V395 PolarHBondContact O-N 3.08Å; S393-V395 VanDerWaalsContact C-N 3.31Å; S393-V395 PolarHBondContact O-N 3.26Å; V395-L398 PolarHBondContact O-N 3.36Å; V395-D399 PolarHBondContact O-N 3.03Å
396	Q	91.4	Very high	90	Very high	74 Å²	74	45.7 Å²	45.7	35%	0.346	27%	0.266	S	S	.	.	H	α-helix	trans	-71.6	-40.7	177	-60.3	173.3	39.9	0	0	111.6	T392 S393 I394 L398 D399 H449 T453	T392-Q396 PolarHBondContact O-NE2 3.33Å; T392-Q396 VanDerWaalsContact O-NE2 3.13Å; S393-Q396 WeakPolarHBondContact O-CB 3.49Å; S393-Q396 PolarHBondContact O-N 2.94Å; S393-Q396 VanDerWaalsContact O-N 3.13Å; I394-Q396 PolarHBondContact O-N 3.27Å; I394-Q396 VanDerWaalsContact O-N 3.1Å; Q396-L398 PolarHBondContact O-N 3.36Å; Q396-D399 WeakPolarHBondContact O-CB 3.33Å; Q396-D399 PolarHBondContact O-N 3.13Å; Q396-H449 PolarHBondContact O-NE2 3.38Å; Q396-T453 HydrophobicContact CB-CG2 3.71Å
397	Y	93	Very high	90.4	Very high	24 Å²	24	40.3 Å²	40.3	9%	0.094	23%	0.229	C	C	.	.	H	α-helix	trans	-65.1	-23.8	174.3	-67	-87.6	0	0	0	112.6	I344 L348 S393 I394 H449 V450 T453 Y454	I344-Y397 HydrophobicContact CG2-CE1 3.94Å; L348-Y397 HydrophobicContact CD1-CD2 4.02Å; L348-Y397 HydrophobicContact CD1-CG 4.04Å; L348-Y397 HydrophobicContact CD2-CD1 4Å; L348-Y397 HydrophobicContact CD2-CG 3.96Å; S393-Y397 WeakPolarHBondContact O-CD2 3.47Å; I394-Y397 PolarHBondContact O-N 3.37Å; Y397-H449 PolarHBondContact O-CD2 3.27Å; Y397-V450 HydrophobicContact CD1-CB 4.38Å; Y397-V450 HydrophobicContact CD1-CG1 4.13Å; Y397-V450 HydrophobicContact CD1-CG2 4.28Å; Y397-V450 HydrophobicContact CE1-CG1 4.27Å; Y397-T453 HydrophobicContact CD1-CG2 3.79Å; Y397-T453 HydrophobicContact CD2-CG2 3.85Å; Y397-T453 HydrophobicContact CE1-CG2 3.81Å; Y397-T453 HydrophobicContact CE2-CG2 3.85Å; Y397-T453 HydrophobicContact CG-CG2 3.81Å; Y397-Y454 WeakPolarHBondContact OH-CA 3.46Å
398	L	93	Very high	90.8	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-7.5	-178.5	-65.3	174.3	0	0	0	114.4	I369 I374 L377 I394 V395 Q396 I400 Q404 L407 V408	I369-L398 HydrophobicContact CG1-CD1 4.37Å; I369-L398 HydrophobicContact CG2-CD1 3.62Å; I369-L398 HydrophobicContact CG2-CD2 4.28Å; I374-L398 HydrophobicContact CD1-CB 3.77Å; L377-L398 HydrophobicContact CD1-CD1 4.12Å; I394-L398 HydrophobicContact CG2-CD1 3.87Å; I394-L398 HydrophobicContact CG2-CG 4.29Å; I394-L398 WeakPolarHBondContact O-CG 3.39Å; I394-L398 PolarHBondContact O-N 3.1Å; V395-L398 PolarHBondContact O-N 3.36Å; Q396-L398 PolarHBondContact O-N 3.36Å; L398-I400 PolarHBondContact O-N 3.38Å; L398-Q404 PolarHBondContact O-NE2 2.95Å; L398-L407 HydrophobicContact CB-CD2 4.35Å; L398-L407 HydrophobicContact CD2-CD2 3.94Å; L398-L407 HydrophobicContact CD2-CG 4.46Å; L398-L407 WeakPolarHBondContact O-CD2 3.45Å; L398-V408 HydrophobicContact CD2-CG2 4.05Å
399	D	90.1	Very high	91.1	Very high	53 Å²	53	38.3 Å²	38.3	28%	0.283	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	19.2	-169.4	-158.5	28.8	0	0	0	115.4	R378 V395 Q396	R378-D399 IonicContact CZ-OD1 3.3Å; R378-D399 IonicContact CZ-OD2 2.74Å; R378-D399 IonicContact NH1-OD1 2.97Å; R378-D399 PolarHBondContact NH1-OD1 3.38Å; R378-D399 IonicContact NH2-OD1 2.65Å; R378-D399 PolarHBondContact NH2-OD1 3.28Å; R378-D399 IonicContact NH2-OD2 3.31Å; R378-D399 PolarHBondContact NH2-OD2 3.45Å; V395-D399 PolarHBondContact O-N 3.03Å; Q396-D399 WeakPolarHBondContact O-CB 3.33Å; Q396-D399 PolarHBondContact O-N 3.13Å
400	I	89.9	Confident	91.4	Very high	47 Å²	47	34.4 Å²	34.4	24%	0.241	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-25.1	-179.3	-172.4	177.2	0	0	0	113.6	L398 L407 P441 A445 I446 H449	L398-I400 PolarHBondContact O-N 3.38Å; I400-L407 HydrophobicContact CG2-CD1 3.53Å; I400-L407 HydrophobicContact CG2-CD2 3.56Å; I400-L407 HydrophobicContact CG2-CG 4.2Å; I400-P441 HydrophobicContact CD1-CB 3.95Å; I400-P441 HydrophobicContact CD1-CG 4.46Å; I400-P441 HydrophobicContact CG1-CB 4.23Å; I400-P441 HydrophobicContact CG1-CG 4.47Å; I400-A445 VanDerWaalsContact CD1-C 3.44Å; I400-A445 HydrophobicContact CD1-CB 3.98Å; I400-A445 WeakPolarHBondContact CD1-O 3.43Å; I400-I446 HydrophobicContact CD1-CG1 4.15Å; I400-H449 HydrophobicContact CB-CB 4.43Å; I400-H449 HydrophobicContact CD1-CB 3.88Å; I400-H449 HydrophobicContact CG1-CB 4.48Å
401	T	89.6	Confident	91.6	Very high	13 Å²	13	31.9 Å²	31.9	8%	0.08	18%	0.177	C	C	.	.			trans	-152.9	145.4	179.4	-179.6	0	0	0	0	112.5	N403 Q404 L407 P441	T401-N403 WeakPolarHBondContact CG2-O 3.23Å; T401-N403 PolarHBondContact O-N 3.25Å; T401-N403 PolarHBondContact OG1-N 2.88Å; T401-Q404 PolarHBondContact O-NE2 3.04Å; T401-L407 HydrophobicContact CG2-CB 3.84Å; T401-L407 HydrophobicContact CG2-CD1 4.49Å; T401-L407 HydrophobicContact CG2-CD2 4.16Å; T401-L407 HydrophobicContact CG2-CG 4.39Å; T401-P441 HydrophobicContact CG2-CG 3.85Å
402	P	88.9	Confident	91.7	Very high	111 Å²	111	35 Å²	35	72%	0.721	19%	0.189	S	C	*	.	S	Bend	trans	-65.3	-21.1	169.9	27.8	-36	0	0	0	113.2	Q404	P402-Q404 PolarHBondContact O-N 3.04Å
403	N	90.9	Very high	91.8	Very high	49 Å²	49	35.3 Å²	35.3	26%	0.262	19%	0.186	S	C	.	.			trans	-81.8	82.4	177.4	-169.9	-17.9	0	0	0	110.9	T401 Y406 L407 L440	T401-N403 WeakPolarHBondContact CG2-O 3.23Å; T401-N403 PolarHBondContact O-N 3.25Å; T401-N403 PolarHBondContact OG1-N 2.88Å; N403-Y406 WeakPolarHBondContact OD1-CB 3.1Å; N403-Y406 PolarHBondContact OD1-N 2.66Å; N403-Y406 VanDerWaalsContact OD1-N 3.08Å; N403-L407 PolarHBondContact O-N 3.28Å; N403-L407 VanDerWaalsContact O-N 3.13Å; N403-L440 HydrophobicContact CB-CD2 4.14Å
404	Q	92.8	Very high	91.9	Very high	6 Å²	6	32.2 Å²	32.2	3%	0.028	17%	0.165	C	C	.	.	H	α-helix	trans	-66.9	-34.8	-177.7	-66.2	-68.2	-64	0	0	112.9	I374 L398 T401 P402 L407 V408	I374-Q404 HydrophobicContact CB-CG 4.45Å; L398-Q404 PolarHBondContact O-NE2 2.95Å; T401-Q404 PolarHBondContact O-NE2 3.04Å; P402-Q404 PolarHBondContact O-N 3.04Å; Q404-L407 PolarHBondContact O-N 3.3Å; Q404-V408 VanDerWaalsContact O-CG2 3.3Å; Q404-V408 WeakPolarHBondContact O-CG2 3.28Å; Q404-V408 PolarHBondContact O-N 2.92Å
405	E	91.3	Very high	91.8	Very high	67 Å²	67	32.7 Å²	32.7	31%	0.313	17%	0.168	S	C	.	.	H	α-helix	trans	-58.6	-53.3	176.1	-177.8	173.7	-110.2	0	0	110.5	G370 L407 D409 L431 K432	G370-E405 VanDerWaalsContact O-CA 3.23Å; G370-E405 WeakPolarHBondContact O-CA 3.39Å; G370-E405 WeakPolarHBondContact O-CB 3.5Å; G370-E405 PolarHBondContact O-N 3.29Å; G370-E405 VanDerWaalsContact O-N 3.1Å; E405-L407 PolarHBondContact O-N 3.09Å; E405-D409 PolarHBondContact O-N 3.31Å; E405-D409 VanDerWaalsContact O-N 3.15Å; E405-L431 HydrophobicContact CG-CD1 4.28Å; E405-K432 WeakPolarHBondContact OE1-CE 3.33Å; E405-K432 IonicContact OE1-NZ 2.75Å; E405-K432 PolarHBondContact OE1-NZ 3.09Å; E405-K432 WeakPolarHBondContact OE2-CE 3.34Å; E405-K432 IonicContact OE2-NZ 2.81Å; E405-K432 PolarHBondContact OE2-NZ 2.99Å
406	Y	92.3	Very high	91.4	Very high	3 Å²	3	39.4 Å²	39.4	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-57	-47.6	175.6	172.1	-102.6	0	0	0	112.2	N403 V408 D409 R410 G428 G429 L431 W436 L440 P441 I446	N403-Y406 WeakPolarHBondContact OD1-CB 3.1Å; N403-Y406 PolarHBondContact OD1-N 2.66Å; N403-Y406 VanDerWaalsContact OD1-N 3.08Å; Y406-V408 PolarHBondContact O-N 3.26Å; Y406-D409 PolarHBondContact O-N 3.37Å; Y406-R410 HydrophobicContact CD1-CG 4.21Å; Y406-R410 HydrophobicContact CD2-CG 3.97Å; Y406-R410 HydrophobicContact CE1-CG 3.75Å; Y406-R410 HydrophobicContact CE2-CG 3.5Å; Y406-R410 HydrophobicContact CG-CG 4.31Å; Y406-R410 WeakPolarHBondContact O-CB 3.48Å; Y406-R410 WeakPolarHBondContact O-CG 3.46Å; Y406-R410 PolarHBondContact O-N 3.44Å; Y406-G428 WeakPolarHBondContact OH-CA 3.42Å; Y406-G429 WeakPolarHBondContact CE2-O 3.32Å; Y406-G429 PolarHBondContact OH-N 3.4Å; Y406-L431 HydrophobicContact CD2-CB 4.33Å; Y406-W436 VanDerWaalsContact OH-CD1 3.32Å; Y406-L440 HydrophobicContact CD1-CB 4.23Å; Y406-L440 HydrophobicContact CD1-CD2 4.07Å; Y406-L440 HydrophobicContact CD2-CD1 3.9Å; Y406-L440 HydrophobicContact CE1-CB 3.83Å; Y406-L440 HydrophobicContact CE2-CB 4.39Å; Y406-L440 HydrophobicContact CE2-CD1 3.93Å; Y406-L440 HydrophobicContact CG-CD1 4.22Å; Y406-L440 HydrophobicContact CG-CD2 4.12Å; Y406-P441 HydrophobicContact CD1-CG 4.47Å; Y406-P441 HydrophobicContact CE1-CG 3.97Å; Y406-P441 PolarHBondContact OH-O 3.16Å; Y406-I446 HydrophobicContact CE1-CD1 4.27Å
407	L	93.4	Very high	90.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.8	-46.8	-175.2	-178.4	60.1	0	0	0	112.2	L398 I400 T401 N403 Q404 E405 R410 I411 I446	L398-L407 HydrophobicContact CB-CD2 4.35Å; L398-L407 HydrophobicContact CD2-CD2 3.94Å; L398-L407 HydrophobicContact CD2-CG 4.46Å; L398-L407 WeakPolarHBondContact O-CD2 3.45Å; I400-L407 HydrophobicContact CG2-CD1 3.53Å; I400-L407 HydrophobicContact CG2-CD2 3.56Å; I400-L407 HydrophobicContact CG2-CG 4.2Å; T401-L407 HydrophobicContact CG2-CB 3.84Å; T401-L407 HydrophobicContact CG2-CD1 4.49Å; T401-L407 HydrophobicContact CG2-CD2 4.16Å; T401-L407 HydrophobicContact CG2-CG 4.39Å; N403-L407 PolarHBondContact O-N 3.28Å; N403-L407 VanDerWaalsContact O-N 3.13Å; Q404-L407 PolarHBondContact O-N 3.3Å; E405-L407 PolarHBondContact O-N 3.09Å; L407-R410 PolarHBondContact O-N 2.83Å; L407-I411 HydrophobicContact CD1-CD1 3.92Å; L407-I411 HydrophobicContact CD1-CG1 4.31Å; L407-I411 HydrophobicContact CG-CD1 3.89Å; L407-I411 WeakPolarHBondContact O-CB 3.44Å; L407-I411 VanDerWaalsContact O-CG1 3.27Å; L407-I411 WeakPolarHBondContact O-CG1 3.35Å; L407-I411 PolarHBondContact O-N 2.98Å; L407-I446 HydrophobicContact CD1-CD1 4.09Å; L407-I446 HydrophobicContact CD1-CG1 3.99Å; L407-I446 HydrophobicContact CD1-CG2 4.05Å
408	V	93.7	Very high	89.2	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-66.2	-41.5	-178.4	177	0	0	0	0	110.5	I352 I369 L398 Q404 Y406 I411 R412	I352-V408 HydrophobicContact CG2-CG1 4.24Å; I369-V408 HydrophobicContact CG2-CG2 3.74Å; L398-V408 HydrophobicContact CD2-CG2 4.05Å; Q404-V408 VanDerWaalsContact O-CG2 3.3Å; Q404-V408 WeakPolarHBondContact O-CG2 3.28Å; Q404-V408 PolarHBondContact O-N 2.92Å; Y406-V408 PolarHBondContact O-N 3.26Å; V408-I411 PolarHBondContact O-N 2.87Å; V408-R412 WeakPolarHBondContact O-CG 3.26Å; V408-R412 PolarHBondContact O-N 3.31Å
409	D	92.4	Very high	88.3	Confident	71 Å²	71	40.2 Å²	40.2	38%	0.38	23%	0.226	S	C	.	.	H	α-helix	trans	-72.8	-31.1	178.5	-75.6	-7.9	0	0	0	112.9	E405 Y406 R412 E413	E405-D409 PolarHBondContact O-N 3.31Å; E405-D409 VanDerWaalsContact O-N 3.15Å; Y406-D409 PolarHBondContact O-N 3.37Å; D409-R412 PolarHBondContact O-N 3.21Å; D409-R412 IonicContact OD1-CZ 3.73Å; D409-R412 IonicContact OD1-NH1 3.71Å; D409-R412 PolarHBondContact OD1-NH1 2.75Å; D409-E413 PolarHBondContact O-N 3.24Å
410	R	92.7	Very high	88.1	Confident	6 Å²	6	37.7 Å²	37.7	2%	0.023	21%	0.212	C	C	.	.	H	α-helix	trans	-63.2	-46.7	166.9	-72.5	-47.3	-62.2	148.3	-0.9	111.9	Y406 L407 R412 E413 L414 G429 D443 I446	Y406-R410 HydrophobicContact CD1-CG 4.21Å; Y406-R410 HydrophobicContact CD2-CG 3.97Å; Y406-R410 HydrophobicContact CE1-CG 3.75Å; Y406-R410 HydrophobicContact CE2-CG 3.5Å; Y406-R410 HydrophobicContact CG-CG 4.31Å; Y406-R410 WeakPolarHBondContact O-CB 3.48Å; Y406-R410 WeakPolarHBondContact O-CG 3.46Å; Y406-R410 PolarHBondContact O-N 3.44Å; L407-R410 PolarHBondContact O-N 2.83Å; R410-R412 VanDerWaalsContact C-N 3.28Å; R410-R412 PolarHBondContact O-N 3.45Å; R410-E413 IonicContact CZ-OE1 2.6Å; R410-E413 IonicContact NH1-OE1 2.72Å; R410-E413 PolarHBondContact NH1-OE1 2.91Å; R410-E413 IonicContact NH1-OE2 3.58Å; R410-E413 PolarHBondContact NH1-OE2 3.19Å; R410-E413 IonicContact NH2-OE1 2.6Å; R410-E413 PolarHBondContact NH2-OE1 2.81Å; R410-E413 PolarHBondContact O-N 2.89Å; R410-L414 WeakPolarHBondContact O-CB 3.27Å; R410-L414 VanDerWaalsContact O-CG 3.26Å; R410-L414 WeakPolarHBondContact O-CG 3.43Å; R410-L414 PolarHBondContact O-N 3.08Å; R410-G429 VanDerWaalsContact NE-N 3.2Å; R410-D443 IonicContact CZ-OD1 2.68Å; R410-D443 VanDerWaalsContact CZ-OD1 3.3Å; R410-D443 IonicContact CZ-OD2 3.32Å; R410-D443 IonicContact NE-OD1 2.81Å; R410-D443 PolarHBondContact NE-OD1 3.31Å; R410-D443 VanDerWaalsContact NH2-CG 3.26Å; R410-D443 IonicContact NH2-OD1 2.9Å; R410-D443 PolarHBondContact NH2-OD1 2.97Å; R410-D443 IonicContact NH2-OD2 3.7Å; R410-D443 PolarHBondContact NH2-OD2 3.33Å; R410-I446 HydrophobicContact CB-CD1 3.89Å; R410-I446 HydrophobicContact CG-CD1 4.01Å
411	I	93.8	Very high	87.7	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-60.3	-41.7	178.9	-71.8	169	0	0	0	109.9	L345 L348 V349 L407 V408 S415 I446	L345-I411 HydrophobicContact CD2-CG2 4.25Å; L348-I411 HydrophobicContact CD2-CD1 4.29Å; L348-I411 HydrophobicContact CD2-CG2 4.22Å; V349-I411 HydrophobicContact CG2-CG2 3.76Å; L407-I411 HydrophobicContact CD1-CD1 3.92Å; L407-I411 HydrophobicContact CD1-CG1 4.31Å; L407-I411 HydrophobicContact CG-CD1 3.89Å; L407-I411 WeakPolarHBondContact O-CB 3.44Å; L407-I411 VanDerWaalsContact O-CG1 3.27Å; L407-I411 WeakPolarHBondContact O-CG1 3.35Å; L407-I411 PolarHBondContact O-N 2.98Å; V408-I411 PolarHBondContact O-N 2.87Å; I411-S415 WeakPolarHBondContact O-CB 3.4Å; I411-S415 PolarHBondContact O-N 3.3Å; I411-I446 HydrophobicContact CG1-CG2 4.09Å
412	R	92.6	Very high	87.5	Confident	65 Å²	65	40.5 Å²	40.5	25%	0.245	24%	0.237	C	C	.	.	H	α-helix	trans	-60.6	-52.9	171.4	-73.1	172.2	176.8	143.2	-1.2	112.3	V349 D353 V408 D409 R410 L414 S415 H416	V349-R412 HydrophobicContact CG1-CG 4Å; V349-R412 HydrophobicContact CG2-CG 4.06Å; D353-R412 IonicContact OD1-CZ 2.8Å; D353-R412 IonicContact OD1-NH2 3.84Å; D353-R412 PolarHBondContact OD1-NH2 3.33Å; V408-R412 WeakPolarHBondContact O-CG 3.26Å; V408-R412 PolarHBondContact O-N 3.31Å; D409-R412 PolarHBondContact O-N 3.21Å; D409-R412 IonicContact OD1-CZ 3.73Å; D409-R412 IonicContact OD1-NH1 3.71Å; D409-R412 PolarHBondContact OD1-NH1 2.75Å; R410-R412 VanDerWaalsContact C-N 3.28Å; R410-R412 PolarHBondContact O-N 3.45Å; R412-L414 VanDerWaalsContact C-N 3.28Å; R412-L414 PolarHBondContact O-N 2.81Å; R412-S415 PolarHBondContact O-N 3.11Å; R412-S415 VanDerWaalsContact O-N 3.09Å; R412-S415 PolarHBondContact O-OG 2.74Å; R412-S415 VanDerWaalsContact O-OG 3.08Å; R412-H416 PolarHBondContact O-N 3.46Å; R412-H416 PolarHBondContact O-ND1 2.85Å
413	E	91.7	Very high	87.5	Confident	67 Å²	67	35.2 Å²	35.2	31%	0.313	20%	0.202	S	C	.	.	H	α-helix	trans	-60.9	-37.8	-178	-167.4	-167.4	105.8	0	0	112.1	D409 R410 S422 R424	D409-E413 PolarHBondContact O-N 3.24Å; R410-E413 IonicContact CZ-OE1 2.6Å; R410-E413 IonicContact NH1-OE1 2.72Å; R410-E413 PolarHBondContact NH1-OE1 2.91Å; R410-E413 IonicContact NH1-OE2 3.58Å; R410-E413 PolarHBondContact NH1-OE2 3.19Å; R410-E413 IonicContact NH2-OE1 2.6Å; R410-E413 PolarHBondContact NH2-OE1 2.81Å; R410-E413 PolarHBondContact O-N 2.89Å; E413-S422 WeakPolarHBondContact OE1-CB 3.45Å; E413-R424 IonicContact OE1-NH2 3.93Å; E413-R424 PolarHBondContact OE1-NH2 3.21Å; E413-R424 IonicContact OE2-NH2 2.85Å
414	L	91.2	Very high	87.4	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-67.1	-37.7	174.8	-68.7	169.2	0	0	0	111.9	L345 R410 R412 F423 D443 L447	L345-L414 HydrophobicContact CD1-CB 3.99Å; R410-L414 WeakPolarHBondContact O-CB 3.27Å; R410-L414 VanDerWaalsContact O-CG 3.26Å; R410-L414 WeakPolarHBondContact O-CG 3.43Å; R410-L414 PolarHBondContact O-N 3.08Å; R412-L414 VanDerWaalsContact C-N 3.28Å; R412-L414 PolarHBondContact O-N 2.81Å; L414-F423 HydrophobicContact CD2-CB 4.02Å; L414-F423 HydrophobicContact CD2-CD2 4.38Å; L414-D443 HydrophobicContact CD1-CB 4.28Å; L414-D443 HydrophobicContact CD2-CB 4.42Å; L414-L447 HydrophobicContact CD1-CD2 4.19Å
415	S	90.4	Very high	87.2	Confident	16 Å²	16	38.2 Å²	38.2	11%	0.112	21%	0.21	C	C	.	.	H	α-helix	trans	-78.3	-24.1	178.3	85.2	0	0	0	0	114.4	I411 R412 S417	I411-S415 WeakPolarHBondContact O-CB 3.4Å; I411-S415 PolarHBondContact O-N 3.3Å; R412-S415 PolarHBondContact O-N 3.11Å; R412-S415 VanDerWaalsContact O-N 3.09Å; R412-S415 PolarHBondContact O-OG 2.74Å; R412-S415 VanDerWaalsContact O-OG 3.08Å; S415-S417 VanDerWaalsContact C-N 3.28Å; S415-S417 PolarHBondContact O-N 2.74Å
416	H	84	Confident	87	Confident	153 Å²	153	38.6 Å²	38.6	71%	0.708	21%	0.214	S	C	*	.	H	α-helix	trans	-74.4	-17.9	-178.4	-84.4	70.1	0	0	0	113.3	R412	R412-H416 PolarHBondContact O-N 3.46Å; R412-H416 PolarHBondContact O-ND1 2.85Å
417	S	70	Confident	86.7	Confident	15 Å²	15	38.8 Å²	38.8	11%	0.105	22%	0.216	C	C	.	.	S	Bend	trans	-109.3	116.5	-179.2	59	0	0	0	0	111.4	S415 C419 M420 S421	S415-S417 VanDerWaalsContact C-N 3.28Å; S415-S417 PolarHBondContact O-N 2.74Å; S417-C419 PolarHBondContact O-N 2.84Å; S417-M420 WeakPolarHBondContact O-CA 3.39Å; S417-M420 PolarHBondContact O-N 3.47Å; S417-S421 WeakPolarHBondContact CB-OG 3.4Å; S417-S421 PolarHBondContact OG-N 3.19Å; S417-S421 PolarHBondContact OG-OG 2.94Å
418	G	67.7	Low	86.3	Confident	64 Å²	64	39 Å²	39	66%	0.66	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	134.8	172.8	0	0	0	0	0	111.1	M420	G418-M420 PolarHBondContact O-N 2.96Å
419	C	75.6	Confident	85.8	Confident	35 Å²	35	38.9 Å²	38.9	24%	0.236	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	17.5	-171.5	-160.4	0	0	0	0	114.9	R337 N338 S417	R337-C419 PolarHBondContact NH1-O 3.47Å; N338-C419 WeakPolarHBondContact OD1-CA 3.43Å; N338-C419 WeakPolarHBondContact OD1-CB 3.33Å; N338-C419 PolarHBondContact OD1-N 3.33Å; N338-C419 VanDerWaalsContact OD1-N 3.15Å; S417-C419 PolarHBondContact O-N 2.84Å
420	M	84.4	Confident	85.3	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.			trans	51.3	66.5	-180	-59.9	-177.4	-72.2	0	0	113	R337 I340 L345 S417 G418 F423 L447 F522	R337-M420 HydrophobicContact CB-CE 3.97Å; R337-M420 HydrophobicContact CG-CE 3.91Å; R337-M420 PolarHBondContact NH1-O 3.27Å; R337-M420 PolarHBondContact NH2-O 2.95Å; I340-M420 HydrophobicContact CB-CE 4.14Å; I340-M420 HydrophobicContact CG2-CE 4.14Å; I340-M420 HydrophobicContact CG2-SD 4.28Å; L345-M420 HydrophobicContact CD1-CG 4.33Å; L345-M420 HydrophobicContact CD1-SD 3.66Å; S417-M420 WeakPolarHBondContact O-CA 3.39Å; S417-M420 PolarHBondContact O-N 3.47Å; G418-M420 PolarHBondContact O-N 2.96Å; M420-F423 HydrophobicContact CB-CB 4.36Å; M420-F423 WeakPolarHBondContact O-CB 3.34Å; M420-L447 HydrophobicContact CE-CD1 3.85Å; M420-L447 HydrophobicContact SD-CD1 3.69Å; M420-L447 HydrophobicContact SD-CD2 3.75Å; M420-L447 HydrophobicContact SD-CG 4.39Å; M420-F522 HydrophobicContact CE-CE1 3.79Å; M420-F522 HydrophobicContact CE-CZ 4.05Å
421	S	83	Confident	84.7	Confident	78 Å²	78	41.1 Å²	41.1	55%	0.545	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-45.9	-178.5	66	0	0	0	0	111.5	S417 F423 R518	S417-S421 WeakPolarHBondContact CB-OG 3.4Å; S417-S421 PolarHBondContact OG-N 3.19Å; S417-S421 PolarHBondContact OG-OG 2.94Å; S421-F423 PolarHBondContact O-N 3.13Å; S421-R518 PolarHBondContact O-NH2 3.16Å; S421-R518 VanDerWaalsContact O-NH2 3.16Å
422	S	84.3	Confident	83.9	Confident	41 Å²	41	48.1 Å²	48.1	29%	0.287	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-0.1	-177.2	-42.2	0	0	0	0	115.9	E413 R424	E413-S422 WeakPolarHBondContact OE1-CB 3.45Å; S422-R424 PolarHBondContact O-NE 3.03Å
423	F	90	Very high	83	Confident	1 Å²	1	53 Å²	53	0%	0.004	29%	0.292	C	S	.	.			trans	-60.5	130.5	177.1	171.5	-97.4	0	0	0	112.6	R337 L414 M420 S421 W425 D443 L447 R518 F522	R337-F423 VanDerWaalsContact NH2-CB 3.33Å; R337-F423 VanDerWaalsContact NH2-CG 3.27Å; L414-F423 HydrophobicContact CD2-CB 4.02Å; L414-F423 HydrophobicContact CD2-CD2 4.38Å; M420-F423 HydrophobicContact CB-CB 4.36Å; M420-F423 WeakPolarHBondContact O-CB 3.34Å; S421-F423 PolarHBondContact O-N 3.13Å; F423-W425 HydrophobicContact CE1-CB 3.73Å; F423-W425 HydrophobicContact CZ-CB 4.07Å; F423-D443 WeakPolarHBondContact CA-OD2 3.47Å; F423-D443 HydrophobicContact CD2-CB 3.59Å; F423-D443 HydrophobicContact CE2-CB 3.81Å; F423-L447 HydrophobicContact CD2-CD1 3.64Å; F423-L447 HydrophobicContact CE2-CD1 3.56Å; F423-L447 HydrophobicContact CE2-CG 4.37Å; F423-R518 HydrophobicContact CD1-CG 4.31Å; F423-R518 HydrophobicContact CE1-CG 4.14Å; F423-R518 PolarHBondContact O-NH1 3.09Å; F423-F522 HydrophobicContact CD1-CE2 4.06Å; F423-F522 HydrophobicContact CD1-CZ 4.41Å; F423-F522 HydrophobicContact CD2-CZ 4.33Å; F423-F522 AromaticContact CE1-CE2 3.56Å; F423-F522 HydrophobicContact CE1-CE2 3.56Å; F423-F522 HydrophobicContact CE1-CZ 4.11Å; F423-F522 HydrophobicContact CE2-CE2 4.28Å; F423-F522 HydrophobicContact CE2-CZ 4.06Å; F423-F522 HydrophobicContact CG-CZ 4.49Å; F423-F522 AromaticContact CZ-CE2 3.67Å; F423-F522 HydrophobicContact CZ-CE2 3.67Å; F423-F522 AromaticContact CZ-CZ 3.92Å; F423-F522 HydrophobicContact CZ-CZ 3.92Å
424	R	89.3	Confident	82.5	Confident	85 Å²	85	55 Å²	55	32%	0.321	30%	0.297	S	S	.	.			trans	-119.7	120.8	175.8	-76.2	165.4	-92.9	-161.5	-7	109.6	E413 S422 G428 D430 D443	E413-R424 IonicContact OE1-NH2 3.93Å; E413-R424 PolarHBondContact OE1-NH2 3.21Å; E413-R424 IonicContact OE2-NH2 2.85Å; S422-R424 PolarHBondContact O-NE 3.03Å; R424-G428 VanDerWaalsContact CD-O 3.27Å; R424-G428 WeakPolarHBondContact CD-O 3.45Å; R424-G428 PolarHBondContact NE-O 3.33Å; R424-G428 PolarHBondContact NH1-O 3.49Å; R424-D430 IonicContact NH1-OD2 2.7Å; R424-D443 PolarHBondContact N-OD2 3.07Å; R424-D443 WeakPolarHBondContact O-CB 3.21Å
425	W	87.6	Confident	82.1	Confident	33 Å²	33	63 Å²	63	13%	0.125	33%	0.332	C	S	.	.	S	Bend	trans	-81.8	-31	-165.7	73.9	-91.7	0	0	0	114	D302 F423 C444 P500 P501 K516 R518	D302-W425 PolarHBondContact OD2-NE1 2.88Å; D302-W425 VanDerWaalsContact OD2-NE1 3.12Å; F423-W425 HydrophobicContact CE1-CB 3.73Å; F423-W425 HydrophobicContact CZ-CB 4.07Å; W425-C444 WeakPolarHBondContact O-CB 3.44Å; W425-C444 PolarHBondContact O-SG 3.24Å; W425-P500 HydrophobicContact CH2-CB 4.27Å; W425-P500 HydrophobicContact CZ3-CB 4.04Å; W425-P501 WeakPolarHBondContact O-CG 3.43Å; W425-K516 HydrophobicContact CH2-CB 4.41Å; W425-K516 HydrophobicContact CZ3-CB 4.42Å; W425-R518 HydrophobicContact CB-CB 4.43Å; W425-R518 HydrophobicContact CG-CB 4.26Å
426	N	86.6	Confident	81.9	Confident	75 Å²	75	65.3 Å²	65.3	40%	0.401	34%	0.338	S	S	.	.	S	Bend	trans	-108.7	5.3	-176.5	55.4	-12.5	0	0	0	113.3	P500	N426-P500 HydrophobicContact CB-CB 4.4Å
427	G	86.3	Confident	81.9	Confident	6 Å²	6	61.3 Å²	61.3	6%	0.062	32%	0.321	C	S	.	.			trans	-156.9	-158.5	-176.9	0	0	0	0	0	110.7	T442 D443	G427-T442 CarbonylContact O-C 3.51Å; G427-T442 WeakPolarHBondContact O-CA 3.44Å; G427-T442 VanDerWaalsContact O-CB 3.27Å; G427-T442 WeakPolarHBondContact O-CB 3.4Å; G427-D443 PolarHBondContact O-N 3.29Å
428	G	85.4	Confident	82.4	Confident	4 Å²	4	65.4 Å²	65.4	4%	0.041	35%	0.346	C	S	.	.			trans	-144.7	-149.7	176.8	0	0	0	0	0	111.9	Y406 R424 W436	Y406-G428 WeakPolarHBondContact OH-CA 3.42Å; R424-G428 VanDerWaalsContact CD-O 3.27Å; R424-G428 WeakPolarHBondContact CD-O 3.45Å; R424-G428 PolarHBondContact NE-O 3.33Å; R424-G428 PolarHBondContact NH1-O 3.49Å; G428-W436 VanDerWaalsContact CA-CD1 3.46Å; G428-W436 VanDerWaalsContact N-CD1 3.35Å; G428-W436 VanDerWaalsContact N-CG 3.29Å
429	G	82.8	Confident	83.2	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.01	34%	0.343	C	S	.	.			trans	-92.9	158.1	-178.6	0	0	0	0	0	114	Y406 R410 W436	Y406-G429 WeakPolarHBondContact CE2-O 3.32Å; Y406-G429 PolarHBondContact OH-N 3.4Å; R410-G429 VanDerWaalsContact NE-N 3.2Å; G429-W436 WeakPolarHBondContact O-CB 3.41Å
430	D	82.3	Confident	83.8	Confident	94 Å²	94	66.5 Å²	66.5	50%	0.503	33%	0.334	S	S	.	.			trans	-81	126.1	170.7	-54.8	-55.3	0	0	0	109	R424 K432 R434 K435 W436	R424-D430 IonicContact NH1-OD2 2.7Å; D430-K432 PolarHBondContact O-N 2.81Å; D430-R434 CarbonylContact C-O 3.58Å; D430-K435 WeakPolarHBondContact OD1-CA 3.35Å; D430-W436 PolarHBondContact OD1-N 2.96Å
431	L	79.1	Confident	84.1	Confident	29 Å²	29	67.4 Å²	67.4	15%	0.152	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-91.5	97.7	-177.9	-178.1	64.9	0	0	0	109.8	E405 Y406 N433 R434	E405-L431 HydrophobicContact CG-CD1 4.28Å; Y406-L431 HydrophobicContact CD2-CB 4.33Å; L431-N433 PolarHBondContact O-N 3.31Å; L431-R434 PolarHBondContact N-O 2.9Å; L431-R434 PolarHBondContact O-N 3.08Å
432	K	77.2	Confident	84.5	Confident	148 Å²	148	64 Å²	64	64%	0.643	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	-90.5	-176.4	-60	164.5	178.8	162.5	0	111.5	E405 D430	E405-K432 WeakPolarHBondContact OE1-CE 3.33Å; E405-K432 IonicContact OE1-NZ 2.75Å; E405-K432 PolarHBondContact OE1-NZ 3.09Å; E405-K432 WeakPolarHBondContact OE2-CE 3.34Å; E405-K432 IonicContact OE2-NZ 2.81Å; E405-K432 PolarHBondContact OE2-NZ 2.99Å; D430-K432 PolarHBondContact O-N 2.81Å
433	N	74.1	Confident	85	Confident	169 Å²	169	62.1 Å²	62.1	90%	0.904	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-9	179.8	-65	-21.8	0	0	0	113.6	L431	L431-N433 PolarHBondContact O-N 3.31Å
434	R	81.1	Confident	85.1	Confident	109 Å²	109	62.2 Å²	62.2	41%	0.411	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-89.8	123.8	173.1	-177.5	176.9	-178.2	-171.4	3.3	108.8	D430 L431 D437 D439	D430-R434 CarbonylContact C-O 3.58Å; L431-R434 PolarHBondContact N-O 2.9Å; L431-R434 PolarHBondContact O-N 3.08Å; R434-D437 IonicContact CZ-OD2 3.12Å; R434-D437 IonicContact NE-OD2 2.7Å; R434-D437 IonicContact NH2-OD2 3.91Å; R434-D437 PolarHBondContact NH2-OD2 2.93Å; R434-D439 IonicContact CZ-OD2 3.83Å; R434-D439 VanDerWaalsContact CZ-OD2 3.32Å; R434-D439 IonicContact NH1-OD2 2.77Å; R434-D439 PolarHBondContact NH1-OD2 3.49Å; R434-D439 IonicContact NH2-OD2 3.94Å; R434-D439 PolarHBondContact NH2-OD2 3.42Å
435	K	82.4	Confident	85.2	Confident	168 Å²	168	59.3 Å²	59.3	73%	0.73	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-64.8	153.9	171.2	-69.4	-171.8	175.8	-174.6	0	111.4	D430 D437	D430-K435 WeakPolarHBondContact OD1-CA 3.35Å; K435-D437 PolarHBondContact O-N 2.92Å
436	W	87.4	Confident	85.5	Confident	63 Å²	63	57.7 Å²	57.7	24%	0.239	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-54.7	141.7	173	-175.9	78.9	0	0	0	111.7	Y406 G428 G429 D430 T438 L440 T442	Y406-W436 VanDerWaalsContact OH-CD1 3.32Å; G428-W436 VanDerWaalsContact CA-CD1 3.46Å; G428-W436 VanDerWaalsContact N-CD1 3.35Å; G428-W436 VanDerWaalsContact N-CG 3.29Å; G429-W436 WeakPolarHBondContact O-CB 3.41Å; D430-W436 PolarHBondContact OD1-N 2.96Å; W436-T438 HydrophobicContact CH2-CG2 4.37Å; W436-L440 WeakPolarHBondContact CZ2-O 3.38Å; W436-L440 PolarHBondContact NE1-O 3.3Å; W436-T442 HydrophobicContact CH2-CG2 4.09Å; W436-T442 HydrophobicContact CZ2-CG2 3.67Å
437	D	83.1	Confident	85.9	Confident	69 Å²	69	54.2 Å²	54.2	37%	0.369	27%	0.273	S	S	.	.			trans	-150.3	161.9	-171.6	-158.2	-10.8	0	0	0	109.6	R434 K435 D439 L440	R434-D437 IonicContact CZ-OD2 3.12Å; R434-D437 IonicContact NE-OD2 2.7Å; R434-D437 IonicContact NH2-OD2 3.91Å; R434-D437 PolarHBondContact NH2-OD2 2.93Å; K435-D437 PolarHBondContact O-N 2.92Å; D437-D439 PolarHBondContact O-N 3.05Å; D437-L440 PolarHBondContact O-N 3.03Å
438	T	81.7	Confident	86.3	Confident	101 Å²	101	54.1 Å²	54.1	62%	0.62	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-13.3	-169.9	48.9	0	0	0	0	115.2	W436 L440	W436-T438 HydrophobicContact CH2-CG2 4.37Å; T438-L440 PolarHBondContact O-N 3.16Å
439	D	84.8	Confident	86.6	Confident	111 Å²	111	56 Å²	56	59%	0.594	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-22.8	171.5	-57.3	-17.9	0	0	0	113.1	R434 D437	R434-D439 IonicContact CZ-OD2 3.83Å; R434-D439 VanDerWaalsContact CZ-OD2 3.32Å; R434-D439 IonicContact NH1-OD2 2.77Å; R434-D439 PolarHBondContact NH1-OD2 3.49Å; R434-D439 IonicContact NH2-OD2 3.94Å; R434-D439 PolarHBondContact NH2-OD2 3.42Å; D437-D439 PolarHBondContact O-N 3.05Å
440	L	87.9	Confident	87.2	Confident	11 Å²	11	56 Å²	56	6%	0.058	28%	0.278	C	S	.	.	S	Bend	trans	-109.3	137.1	-169.1	-61.3	176.7	0	0	0	110.9	N403 Y406 W436 D437 T438	N403-L440 HydrophobicContact CB-CD2 4.14Å; Y406-L440 HydrophobicContact CD1-CB 4.23Å; Y406-L440 HydrophobicContact CD1-CD2 4.07Å; Y406-L440 HydrophobicContact CD2-CD1 3.9Å; Y406-L440 HydrophobicContact CE1-CB 3.83Å; Y406-L440 HydrophobicContact CE2-CB 4.39Å; Y406-L440 HydrophobicContact CE2-CD1 3.93Å; Y406-L440 HydrophobicContact CG-CD1 4.22Å; Y406-L440 HydrophobicContact CG-CD2 4.12Å; W436-L440 WeakPolarHBondContact CZ2-O 3.38Å; W436-L440 PolarHBondContact NE1-O 3.3Å; D437-L440 PolarHBondContact O-N 3.03Å; T438-L440 PolarHBondContact O-N 3.16Å
441	P	90.1	Very high	87.8	Confident	20 Å²	20	51.5 Å²	51.5	13%	0.13	25%	0.254	C	S	.	.			trans	-62.4	142.9	-179.5	24.9	-32.5	0	0	0	111.7	I400 T401 Y406 A445 I446	I400-P441 HydrophobicContact CD1-CB 3.95Å; I400-P441 HydrophobicContact CD1-CG 4.46Å; I400-P441 HydrophobicContact CG1-CB 4.23Å; I400-P441 HydrophobicContact CG1-CG 4.47Å; T401-P441 HydrophobicContact CG2-CG 3.85Å; Y406-P441 HydrophobicContact CD1-CG 4.47Å; Y406-P441 HydrophobicContact CE1-CG 3.97Å; Y406-P441 PolarHBondContact OH-O 3.16Å; P441-A445 HydrophobicContact CB-CB 4.28Å; P441-I446 HydrophobicContact CB-CG1 4.13Å; P441-I446 HydrophobicContact CG-CD1 4.34Å; P441-I446 HydrophobicContact CG-CG1 4.16Å
442	T	92.3	Very high	88.4	Confident	7 Å²	7	50.3 Å²	50.3	4%	0.043	25%	0.249	C	C	.	.			trans	-71	156.6	173.4	59.7	0	0	0	0	110.7	G427 W436 C444 A445 I446	G427-T442 CarbonylContact O-C 3.51Å; G427-T442 WeakPolarHBondContact O-CA 3.44Å; G427-T442 VanDerWaalsContact O-CB 3.27Å; G427-T442 WeakPolarHBondContact O-CB 3.4Å; W436-T442 HydrophobicContact CH2-CG2 4.09Å; W436-T442 HydrophobicContact CZ2-CG2 3.67Å; T442-C444 PolarHBondContact O-N 3.33Å; T442-C444 VanDerWaalsContact O-N 3.17Å; T442-A445 PolarHBondContact O-N 3.05Å; T442-A445 PolarHBondContact OG1-N 3.06Å; T442-I446 WeakPolarHBondContact O-CG1 3.47Å; T442-I446 PolarHBondContact O-N 3.26Å
443	D	92.9	Very high	89.1	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.3	-30	175.6	-59.1	-22.2	0	0	0	111	R410 L414 F423 R424 G427 A445 I446 L447	R410-D443 IonicContact CZ-OD1 2.68Å; R410-D443 VanDerWaalsContact CZ-OD1 3.3Å; R410-D443 IonicContact CZ-OD2 3.32Å; R410-D443 IonicContact NE-OD1 2.81Å; R410-D443 PolarHBondContact NE-OD1 3.31Å; R410-D443 VanDerWaalsContact NH2-CG 3.26Å; R410-D443 IonicContact NH2-OD1 2.9Å; R410-D443 PolarHBondContact NH2-OD1 2.97Å; R410-D443 IonicContact NH2-OD2 3.7Å; R410-D443 PolarHBondContact NH2-OD2 3.33Å; L414-D443 HydrophobicContact CD1-CB 4.28Å; L414-D443 HydrophobicContact CD2-CB 4.42Å; F423-D443 WeakPolarHBondContact CA-OD2 3.47Å; F423-D443 HydrophobicContact CD2-CB 3.59Å; F423-D443 HydrophobicContact CE2-CB 3.81Å; R424-D443 PolarHBondContact N-OD2 3.07Å; R424-D443 WeakPolarHBondContact O-CB 3.21Å; G427-D443 PolarHBondContact O-N 3.29Å; D443-A445 PolarHBondContact O-N 2.98Å; D443-I446 PolarHBondContact O-N 2.95Å; D443-L447 WeakPolarHBondContact O-CB 3.3Å; D443-L447 WeakPolarHBondContact O-CG 3.39Å; D443-L447 PolarHBondContact O-N 2.75Å
444	C	92.7	Very high	90	Very high	4 Å²	4	36.3 Å²	36.3	3%	0.027	18%	0.18	C	C	.	.	H	α-helix	trans	-58.7	-41.5	171.1	-92.8	0	0	0	0	113.5	W425 T442 M448 P501 Y503 L521	W425-C444 WeakPolarHBondContact O-CB 3.44Å; W425-C444 PolarHBondContact O-SG 3.24Å; T442-C444 PolarHBondContact O-N 3.33Å; T442-C444 VanDerWaalsContact O-N 3.17Å; C444-M448 WeakPolarHBondContact O-CB 3.41Å; C444-M448 PolarHBondContact O-N 3.31Å; C444-P501 HydrophobicContact CB-CB 4.07Å; C444-P501 HydrophobicContact CB-CG 3.68Å; C444-Y503 HydrophobicContact CB-CE2 4.25Å; C444-Y503 PolarHBondContact O-OH 3.22Å; C444-L521 HydrophobicContact CB-CD2 4.36Å
445	A	92.1	Very high	90.5	Very high	23 Å²	23	31.2 Å²	31.2	19%	0.19	16%	0.161	C	C	.	.	H	α-helix	trans	-73.4	-42.4	178	0	0	0	0	0	110.9	I400 P441 T442 D443 M448 H449	I400-A445 VanDerWaalsContact CD1-C 3.44Å; I400-A445 HydrophobicContact CD1-CB 3.98Å; I400-A445 WeakPolarHBondContact CD1-O 3.43Å; P441-A445 HydrophobicContact CB-CB 4.28Å; T442-A445 PolarHBondContact O-N 3.05Å; T442-A445 PolarHBondContact OG1-N 3.06Å; D443-A445 PolarHBondContact O-N 2.98Å; A445-M448 PolarHBondContact O-N 3.36Å; A445-H449 WeakPolarHBondContact O-CB 3.42Å; A445-H449 PolarHBondContact O-N 3.36Å
446	I	93.9	Very high	90.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59.2	-50.7	176.8	-62.4	169.5	0	0	0	110.6	I400 Y406 L407 R410 I411 P441 T442 D443 M448 H449 V450	I400-I446 HydrophobicContact CD1-CG1 4.15Å; Y406-I446 HydrophobicContact CE1-CD1 4.27Å; L407-I446 HydrophobicContact CD1-CD1 4.09Å; L407-I446 HydrophobicContact CD1-CG1 3.99Å; L407-I446 HydrophobicContact CD1-CG2 4.05Å; R410-I446 HydrophobicContact CB-CD1 3.89Å; R410-I446 HydrophobicContact CG-CD1 4.01Å; I411-I446 HydrophobicContact CG1-CG2 4.09Å; P441-I446 HydrophobicContact CB-CG1 4.13Å; P441-I446 HydrophobicContact CG-CD1 4.34Å; P441-I446 HydrophobicContact CG-CG1 4.16Å; T442-I446 WeakPolarHBondContact O-CG1 3.47Å; T442-I446 PolarHBondContact O-N 3.26Å; D443-I446 PolarHBondContact O-N 2.95Å; I446-M448 PolarHBondContact O-N 3.33Å; I446-H449 PolarHBondContact O-N 2.8Å; I446-V450 HydrophobicContact CG2-CG2 4.39Å; I446-V450 WeakPolarHBondContact O-CB 3.27Å; I446-V450 VanDerWaalsContact O-CG2 3.26Å; I446-V450 WeakPolarHBondContact O-CG2 3.36Å; I446-V450 PolarHBondContact O-N 3.1Å
447	L	94.4	Very high	90.8	Very high	2 Å²	2	23.7 Å²	23.7	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-64.8	-37.5	-179.7	-70	-170.9	0	0	0	112.8	I340 L345 L414 M420 F423 D443 F451 L521 F522	I340-L447 HydrophobicContact CG2-CD2 4.21Å; L345-L447 HydrophobicContact CD1-CD2 3.95Å; L345-L447 HydrophobicContact CD2-CD2 4.36Å; L414-L447 HydrophobicContact CD1-CD2 4.19Å; M420-L447 HydrophobicContact CE-CD1 3.85Å; M420-L447 HydrophobicContact SD-CD1 3.69Å; M420-L447 HydrophobicContact SD-CD2 3.75Å; M420-L447 HydrophobicContact SD-CG 4.39Å; F423-L447 HydrophobicContact CD2-CD1 3.64Å; F423-L447 HydrophobicContact CE2-CD1 3.56Å; F423-L447 HydrophobicContact CE2-CG 4.37Å; D443-L447 WeakPolarHBondContact O-CB 3.3Å; D443-L447 WeakPolarHBondContact O-CG 3.39Å; D443-L447 PolarHBondContact O-N 2.75Å; L447-F451 VanDerWaalsContact O-CB 3.26Å; L447-F451 WeakPolarHBondContact O-CB 3.42Å; L447-F451 PolarHBondContact O-N 3.09Å; L447-L521 HydrophobicContact CB-CD2 4.02Å; L447-F522 HydrophobicContact CD1-CE1 4.04Å; L447-F522 HydrophobicContact CD1-CZ 3.81Å
448	M	93.9	Very high	91	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.015	14%	0.144	C	C	.	.	H	α-helix	trans	-68	-43.2	177.3	-166.7	64.5	-169.5	0	0	111.5	C444 A445 I446 F451 C452 F476 I493 Y503 L521 I525	C444-M448 WeakPolarHBondContact O-CB 3.41Å; C444-M448 PolarHBondContact O-N 3.31Å; A445-M448 PolarHBondContact O-N 3.36Å; I446-M448 PolarHBondContact O-N 3.33Å; M448-F451 PolarHBondContact O-N 3.46Å; M448-F451 HydrophobicContact SD-CD1 4.48Å; M448-C452 WeakPolarHBondContact O-CB 3.32Å; M448-C452 PolarHBondContact O-N 3.47Å; M448-C452 PolarHBondContact O-SG 3.03Å; M448-C452 VanDerWaalsContact O-SG 3.35Å; M448-F476 HydrophobicContact CE-CD2 3.54Å; M448-F476 HydrophobicContact CE-CE2 3.63Å; M448-F476 HydrophobicContact CG-CE2 3.85Å; M448-F476 HydrophobicContact CG-CZ 4.17Å; M448-I493 HydrophobicContact CE-CB 4.09Å; M448-I493 HydrophobicContact CE-CD1 3.84Å; M448-I493 HydrophobicContact CE-CG2 3.78Å; M448-Y503 HydrophobicContact CB-CE1 4.25Å; M448-Y503 HydrophobicContact CG-CE1 3.88Å; M448-L521 HydrophobicContact CB-CD1 4.19Å; M448-L521 HydrophobicContact CG-CD1 4.41Å; M448-L521 HydrophobicContact SD-CD1 3.69Å; M448-I525 HydrophobicContact SD-CD1 4.08Å; M448-I525 HydrophobicContact SD-CG1 4.34Å
449	H	93.6	Very high	91.1	Very high	44 Å²	44	22.8 Å²	22.8	20%	0.204	12%	0.12	C	C	.	.	H	α-helix	trans	-60.7	-45.1	175	-178.5	71.1	0	0	0	112.3	Q396 Y397 I400 A445 I446 C452 T453	Q396-H449 PolarHBondContact O-NE2 3.38Å; Y397-H449 PolarHBondContact O-CD2 3.27Å; I400-H449 HydrophobicContact CB-CB 4.43Å; I400-H449 HydrophobicContact CD1-CB 3.88Å; I400-H449 HydrophobicContact CG1-CB 4.48Å; A445-H449 WeakPolarHBondContact O-CB 3.42Å; A445-H449 PolarHBondContact O-N 3.36Å; I446-H449 PolarHBondContact O-N 2.8Å; H449-C452 PolarHBondContact O-N 3.43Å; H449-T453 PolarHBondContact NE2-OG1 2.98Å; H449-T453 WeakPolarHBondContact O-CB 3.45Å; H449-T453 PolarHBondContact O-N 3.17Å; H449-T453 PolarHBondContact O-OG1 3.49Å
450	V	94.5	Very high	90.7	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.006	11%	0.112	C	C	.	.	H	α-helix	trans	-64	-40.4	177.2	168.3	0	0	0	0	111.6	I344 L345 Y397 I446 Y454	I344-V450 HydrophobicContact CB-CG1 4.24Å; I344-V450 HydrophobicContact CG2-CG1 3.44Å; I344-V450 VanDerWaalsContact CG2-CG1 3.44Å; L345-V450 HydrophobicContact CD2-CG1 3.99Å; Y397-V450 HydrophobicContact CD1-CB 4.38Å; Y397-V450 HydrophobicContact CD1-CG1 4.13Å; Y397-V450 HydrophobicContact CD1-CG2 4.28Å; Y397-V450 HydrophobicContact CE1-CG1 4.27Å; I446-V450 HydrophobicContact CG2-CG2 4.39Å; I446-V450 WeakPolarHBondContact O-CB 3.27Å; I446-V450 VanDerWaalsContact O-CG2 3.26Å; I446-V450 WeakPolarHBondContact O-CG2 3.36Å; I446-V450 PolarHBondContact O-N 3.1Å; V450-Y454 WeakPolarHBondContact O-CB 3.27Å; V450-Y454 PolarHBondContact O-N 2.95Å
451	F	93.9	Very high	90	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.6	-46.6	175.7	178.7	-102.3	0	0	0	112.4	W339 L447 M448 Y454 L455 F471 I525 I552	W339-F451 HydrophobicContact CZ3-CD2 4.29Å; W339-F451 HydrophobicContact CZ3-CE2 4.22Å; L447-F451 VanDerWaalsContact O-CB 3.26Å; L447-F451 WeakPolarHBondContact O-CB 3.42Å; L447-F451 PolarHBondContact O-N 3.09Å; M448-F451 PolarHBondContact O-N 3.46Å; M448-F451 HydrophobicContact SD-CD1 4.48Å; F451-Y454 PolarHBondContact O-N 3.1Å; F451-L455 HydrophobicContact CD1-CD1 4.28Å; F451-L455 HydrophobicContact CE1-CD1 3.61Å; F451-L455 HydrophobicContact CE2-CD1 4.21Å; F451-L455 HydrophobicContact CZ-CD1 3.57Å; F451-L455 HydrophobicContact CZ-CG 4.4Å; F451-L455 PolarHBondContact O-N 3.17Å; F451-F471 HydrophobicContact CE1-CZ 4.38Å; F451-I525 HydrophobicContact CD1-CD1 4.25Å; F451-I525 HydrophobicContact CE1-CD1 4.5Å; F451-I525 HydrophobicContact CE1-CG1 4.36Å; F451-I525 HydrophobicContact CE1-CG2 4.12Å; F451-I525 HydrophobicContact CE2-CG2 4.01Å; F451-I525 HydrophobicContact CG-CD1 4.38Å; F451-I525 HydrophobicContact CZ-CG2 3.68Å; F451-I552 HydrophobicContact CE2-CD1 4.06Å
452	C	92.5	Very high	89	Confident	4 Å²	4	28.1 Å²	28.1	3%	0.027	16%	0.155	C	C	.	.	H	α-helix	trans	-60.3	-51.1	175.8	-74	0	0	0	0	111.9	M448 H449 Y454 L455 D456 F471 T472	M448-C452 WeakPolarHBondContact O-CB 3.32Å; M448-C452 PolarHBondContact O-N 3.47Å; M448-C452 PolarHBondContact O-SG 3.03Å; M448-C452 VanDerWaalsContact O-SG 3.35Å; H449-C452 PolarHBondContact O-N 3.43Å; C452-Y454 PolarHBondContact O-N 3.12Å; C452-L455 PolarHBondContact O-N 2.86Å; C452-L455 VanDerWaalsContact O-N 3.09Å; C452-D456 PolarHBondContact O-N 2.89Å; C452-F471 HydrophobicContact CB-CD1 4.28Å; C452-T472 WeakPolarHBondContact CB-OG1 3.39Å
453	T	92.4	Very high	87.8	Confident	8 Å²	8	33.7 Å²	33.7	5%	0.049	19%	0.191	C	C	.	.	H	α-helix	trans	-58.8	-37.4	178.5	-54.3	0	0	0	0	111.6	Q396 Y397 H449 S457	Q396-T453 HydrophobicContact CB-CG2 3.71Å; Y397-T453 HydrophobicContact CD1-CG2 3.79Å; Y397-T453 HydrophobicContact CD2-CG2 3.85Å; Y397-T453 HydrophobicContact CE1-CG2 3.81Å; Y397-T453 HydrophobicContact CE2-CG2 3.85Å; Y397-T453 HydrophobicContact CG-CG2 3.81Å; H449-T453 PolarHBondContact NE2-OG1 2.98Å; H449-T453 WeakPolarHBondContact O-CB 3.45Å; H449-T453 PolarHBondContact O-N 3.17Å; H449-T453 PolarHBondContact O-OG1 3.49Å; T453-S457 PolarHBondContact O-N 3.41Å; T453-S457 VanDerWaalsContact O-N 3.09Å
454	Y	93.1	Very high	86.6	Confident	14 Å²	14	41.4 Å²	41.4	6%	0.055	23%	0.225	C	C	.	.	H	α-helix	trans	-64.5	-48	174.5	-176.1	-95.8	0	0	0	111.8	W339 I344 Y397 V450 F451 C452 S457 R458 V550	W339-Y454 AromaticContact CH2-CD1 3.85Å; W339-Y454 HydrophobicContact CH2-CD1 3.85Å; W339-Y454 AromaticContact CH2-CE1 3.6Å; W339-Y454 HydrophobicContact CH2-CE1 3.6Å; W339-Y454 AromaticContact CZ2-CE1 3.91Å; W339-Y454 HydrophobicContact CZ2-CE1 3.91Å; I344-Y454 HydrophobicContact CB-CD2 4.41Å; I344-Y454 HydrophobicContact CD1-CD1 3.92Å; I344-Y454 HydrophobicContact CD1-CD2 4.17Å; I344-Y454 HydrophobicContact CD1-CG 3.66Å; I344-Y454 HydrophobicContact CG1-CD1 4.24Å; I344-Y454 HydrophobicContact CG1-CD2 3.8Å; I344-Y454 HydrophobicContact CG1-CE2 4.18Å; I344-Y454 HydrophobicContact CG1-CG 3.83Å; I344-Y454 HydrophobicContact CG2-CD2 3.96Å; I344-Y454 HydrophobicContact CG2-CG 4.29Å; Y397-Y454 WeakPolarHBondContact OH-CA 3.46Å; V450-Y454 WeakPolarHBondContact O-CB 3.27Å; V450-Y454 PolarHBondContact O-N 2.95Å; F451-Y454 PolarHBondContact O-N 3.1Å; C452-Y454 PolarHBondContact O-N 3.12Å; Y454-S457 PolarHBondContact O-N 2.93Å; Y454-S457 PolarHBondContact O-OG 3.07Å; Y454-R458 HydrophobicContact CD1-CG 4.37Å; Y454-R458 HydrophobicContact CE1-CG 3.99Å; Y454-R458 WeakPolarHBondContact O-CG 3.2Å; Y454-R458 PolarHBondContact O-N 2.97Å; Y454-R458 PolarHBondContact OH-NE 3.33Å; Y454-R458 PolarHBondContact OH-NH2 3.35Å; Y454-V550 HydrophobicContact CE1-CG1 3.94Å
455	L	90.2	Very high	85.6	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-66.4	-38.6	177.8	-68.6	-177.9	0	0	0	112.7	F451 C452 S457 R458 L459 F471 V550	F451-L455 HydrophobicContact CD1-CD1 4.28Å; F451-L455 HydrophobicContact CE1-CD1 3.61Å; F451-L455 HydrophobicContact CE2-CD1 4.21Å; F451-L455 HydrophobicContact CZ-CD1 3.57Å; F451-L455 HydrophobicContact CZ-CG 4.4Å; F451-L455 PolarHBondContact O-N 3.17Å; C452-L455 PolarHBondContact O-N 2.86Å; C452-L455 VanDerWaalsContact O-N 3.09Å; L455-S457 PolarHBondContact O-N 2.94Å; L455-R458 PolarHBondContact O-N 3.26Å; L455-L459 WeakPolarHBondContact O-CG 3.48Å; L455-L459 PolarHBondContact O-N 2.98Å; L455-F471 HydrophobicContact CB-CB 3.91Å; L455-F471 HydrophobicContact CB-CD1 4.04Å; L455-F471 HydrophobicContact CB-CD2 3.96Å; L455-F471 HydrophobicContact CB-CG 3.68Å; L455-F471 HydrophobicContact CD1-CD1 4.18Å; L455-F471 HydrophobicContact CD1-CD2 3.78Å; L455-F471 HydrophobicContact CD1-CE1 3.95Å; L455-F471 HydrophobicContact CD1-CE2 3.52Å; L455-F471 HydrophobicContact CD1-CG 4.11Å; L455-F471 HydrophobicContact CD1-CZ 3.62Å; L455-V550 HydrophobicContact CD2-CG1 4.31Å
456	D	89.4	Confident	84.2	Confident	12 Å²	12	49.2 Å²	49.2	6%	0.064	27%	0.266	C	S	.	.	H	α-helix	trans	-53	-43.9	170.7	-75.5	-38.9	0	0	0	110.9	C452 R458 K469 T470 F471 T472	C452-D456 PolarHBondContact O-N 2.89Å; D456-R458 VanDerWaalsContact C-N 3.25Å; D456-R458 PolarHBondContact O-N 2.77Å; D456-K469 VanDerWaalsContact OD1-CA 3.29Å; D456-K469 WeakPolarHBondContact OD1-CA 3.26Å; D456-T470 PolarHBondContact OD1-N 3.36Å; D456-F471 VanDerWaalsContact OD1-CA 3.32Å; D456-F471 WeakPolarHBondContact OD1-CA 3.4Å; D456-F471 VanDerWaalsContact OD1-CB 3.27Å; D456-F471 WeakPolarHBondContact OD1-CB 3.43Å; D456-F471 PolarHBondContact OD1-N 2.75Å; D456-T472 PolarHBondContact OD1-N 3.34Å; D456-T472 WeakPolarHBondContact OD2-CB 3.35Å; D456-T472 PolarHBondContact OD2-OG1 3.02Å
457	S	87.9	Confident	82.9	Confident	62 Å²	62	53.7 Å²	53.7	43%	0.434	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-9.4	177.9	80.6	0	0	0	0	115.4	T453 Y454 L455	T453-S457 PolarHBondContact O-N 3.41Å; T453-S457 VanDerWaalsContact O-N 3.09Å; Y454-S457 PolarHBondContact O-N 2.93Å; Y454-S457 PolarHBondContact O-OG 3.07Å; L455-S457 PolarHBondContact O-N 2.94Å
458	R	86.6	Confident	81.6	Confident	129 Å²	129	54.9 Å²	54.9	49%	0.487	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-18.3	179.2	-62.8	-51.4	-170.9	-164.7	2.4	113.8	Y454 L455 D456 V550	Y454-R458 HydrophobicContact CD1-CG 4.37Å; Y454-R458 HydrophobicContact CE1-CG 3.99Å; Y454-R458 WeakPolarHBondContact O-CG 3.2Å; Y454-R458 PolarHBondContact O-N 2.97Å; Y454-R458 PolarHBondContact OH-NE 3.33Å; Y454-R458 PolarHBondContact OH-NH2 3.35Å; L455-R458 PolarHBondContact O-N 3.26Å; D456-R458 VanDerWaalsContact C-N 3.25Å; D456-R458 PolarHBondContact O-N 2.77Å; R458-V550 HydrophobicContact CB-CG2 3.95Å; R458-V550 HydrophobicContact CG-CG2 4.23Å
459	L	83.3	Confident	81	Confident	22 Å²	22	58.2 Å²	58.2	12%	0.115	32%	0.317	C	S	.	.	S	Bend	trans	-84.1	147.3	174.7	-68.7	-172.6	0	0	0	111.2	L455 T470 F471 L540 V543	L455-L459 WeakPolarHBondContact O-CG 3.48Å; L455-L459 PolarHBondContact O-N 2.98Å; L459-T470 VanDerWaalsContact CB-OG1 3.24Å; L459-T470 WeakPolarHBondContact CB-OG1 3.5Å; L459-F471 HydrophobicContact CD1-CB 3.8Å; L459-F471 HydrophobicContact CD1-CD2 4.3Å; L459-L540 HydrophobicContact CD1-CD2 4.42Å; L459-L540 HydrophobicContact CD2-CD2 4.32Å; L459-L540 HydrophobicContact CD2-CG 4.27Å; L459-V543 HydrophobicContact CD2-CB 3.84Å; L459-V543 HydrophobicContact CD2-CG2 3.72Å
460	P	77.9	Confident	80.3	Confident	65 Å²	65	56.2 Å²	56.2	42%	0.422	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-68.1	139.4	176.6	28.3	-35	0	0	0	110.7	H462	P460-H462 PolarHBondContact O-N 3.31Å
461	P	72.6	Confident	79.9	Confident	117 Å²	117	56.1 Å²	56.1	76%	0.76	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-59.6	133.7	179	25.3	-34.3	0	0	0	110.5
462	H	68.4	Low	79.4	Confident	71 Å²	71	57.9 Å²	57.9	33%	0.329	32%	0.318	S	S	.	.			trans	-114.4	132.5	-171.5	-175.8	-104.5	0	0	0	110.6	P460 K464 Y465 T470	P460-H462 PolarHBondContact O-N 3.31Å; H462-K464 PolarHBondContact O-N 3.3Å; H462-Y465 HydrophobicContact CB-CD2 4.13Å; H462-Y465 AromaticContact ND1-CD2 3.56Å; H462-Y465 AromaticContact ND1-CE2 3.74Å; H462-Y465 CarbonylContact O-C 3.58Å; H462-Y465 PolarHBondContact O-N 3.03Å; H462-T470 HydrophobicContact CB-CG2 3.85Å
463	P	68.6	Low	78.8	Confident	125 Å²	125	60 Å²	60	81%	0.812	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-17.9	-172	-28.8	36.1	0	0	0	116.8
464	K	67.7	Low	78.1	Confident	161 Å²	161	63.5 Å²	63.5	70%	0.7	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-12.7	174	-59.3	-175.2	-172.6	176	0	114.1	H462	H462-K464 PolarHBondContact O-N 3.3Å
465	Y	71.3	Confident	77.5	Confident	61 Å²	61	64.3 Å²	64.3	24%	0.239	35%	0.353	C	S	.	.			trans	-131.7	72.8	-172.4	-53.5	-63.9	0	0	0	109.5	H462 D467 G468 S473 Q474	H462-Y465 HydrophobicContact CB-CD2 4.13Å; H462-Y465 AromaticContact ND1-CD2 3.56Å; H462-Y465 AromaticContact ND1-CE2 3.74Å; H462-Y465 CarbonylContact O-C 3.58Å; H462-Y465 PolarHBondContact O-N 3.03Å; Y465-D467 PolarHBondContact O-N 3.42Å; Y465-G468 PolarHBondContact O-N 3.25Å; Y465-G468 VanDerWaalsContact O-N 3.14Å; Y465-S473 PolarHBondContact OH-O 3.23Å; Y465-Q474 HydrophobicContact CD2-CG 4.34Å; Y465-Q474 HydrophobicContact CE2-CG 3.48Å; Y465-Q474 VanDerWaalsContact CE2-CG 3.48Å
466	P	61.8	Low	77.2	Confident	131 Å²	131	66.1 Å²	66.1	85%	0.851	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-10.3	-173.4	31	-37.1	0	0	0	113.7	G468	P466-G468 VanDerWaalsContact C-N 3.25Å
467	D	66.2	Low	76.7	Confident	93 Å²	93	66.9 Å²	66.9	50%	0.497	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-5.2	172	67.9	-24.4	0	0	0	113.3	Y465 K469	Y465-D467 PolarHBondContact O-N 3.42Å; D467-K469 VanDerWaalsContact C-N 3.25Å; D467-K469 PolarHBondContact O-N 2.87Å; D467-K469 PolarHBondContact OD1-N 2.89Å; D467-K469 WeakPolarHBondContact OD2-CB 3.47Å; D467-K469 WeakPolarHBondContact OD2-CD 3.39Å; D467-K469 WeakPolarHBondContact OD2-CG 3.46Å
468	G	68.9	Low	76.2	Confident	28 Å²	28	67.7 Å²	67.7	29%	0.289	37%	0.365	S	S	.	.	S	Bend	trans	80.7	-4.5	179.7	0	0	0	0	0	114.7	Y465 P466 T470	Y465-G468 PolarHBondContact O-N 3.25Å; Y465-G468 VanDerWaalsContact O-N 3.14Å; P466-G468 VanDerWaalsContact C-N 3.25Å; G468-T470 PolarHBondContact O-N 2.81Å
469	K	79.3	Confident	75	Confident	73 Å²	73	63.6 Å²	63.6	32%	0.317	35%	0.354	S	S	.	.			trans	-80	52.5	-175.7	-62.6	-170.1	178.3	-176.3	0	112.4	D456 D467 T472 S473	D456-K469 VanDerWaalsContact OD1-CA 3.29Å; D456-K469 WeakPolarHBondContact OD1-CA 3.26Å; D467-K469 VanDerWaalsContact C-N 3.25Å; D467-K469 PolarHBondContact O-N 2.87Å; D467-K469 PolarHBondContact OD1-N 2.89Å; D467-K469 WeakPolarHBondContact OD2-CB 3.47Å; D467-K469 WeakPolarHBondContact OD2-CD 3.39Å; D467-K469 WeakPolarHBondContact OD2-CG 3.46Å; K469-T472 PolarHBondContact O-N 2.88Å; K469-S473 VanDerWaalsContact O-CB 3.25Å; K469-S473 WeakPolarHBondContact O-CB 3.4Å; K469-S473 PolarHBondContact O-N 3.31Å; K469-S473 PolarHBondContact O-OG 2.74Å
470	T	80.1	Confident	73.5	Confident	1 Å²	1	68 Å²	68	1%	0.006	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-34.5	-169.1	60	0	0	0	0	113.8	D456 L459 H462 G468 Q474	D456-T470 PolarHBondContact OD1-N 3.36Å; L459-T470 VanDerWaalsContact CB-OG1 3.24Å; L459-T470 WeakPolarHBondContact CB-OG1 3.5Å; H462-T470 HydrophobicContact CB-CG2 3.85Å; G468-T470 PolarHBondContact O-N 2.81Å; T470-Q474 WeakPolarHBondContact O-CB 3.45Å; T470-Q474 WeakPolarHBondContact O-CG 3.3Å; T470-Q474 PolarHBondContact O-NE2 2.75Å
471	F	85.6	Confident	72.7	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-52.8	170.4	179	-98.4	0	0	0	109.9	F451 C452 L455 D456 L459 S473 Q474 H475 F528 L540	F451-F471 HydrophobicContact CE1-CZ 4.38Å; C452-F471 HydrophobicContact CB-CD1 4.28Å; L455-F471 HydrophobicContact CB-CB 3.91Å; L455-F471 HydrophobicContact CB-CD1 4.04Å; L455-F471 HydrophobicContact CB-CD2 3.96Å; L455-F471 HydrophobicContact CB-CG 3.68Å; L455-F471 HydrophobicContact CD1-CD1 4.18Å; L455-F471 HydrophobicContact CD1-CD2 3.78Å; L455-F471 HydrophobicContact CD1-CE1 3.95Å; L455-F471 HydrophobicContact CD1-CE2 3.52Å; L455-F471 HydrophobicContact CD1-CG 4.11Å; L455-F471 HydrophobicContact CD1-CZ 3.62Å; D456-F471 VanDerWaalsContact OD1-CA 3.32Å; D456-F471 WeakPolarHBondContact OD1-CA 3.4Å; D456-F471 VanDerWaalsContact OD1-CB 3.27Å; D456-F471 WeakPolarHBondContact OD1-CB 3.43Å; D456-F471 PolarHBondContact OD1-N 2.75Å; L459-F471 HydrophobicContact CD1-CB 3.8Å; L459-F471 HydrophobicContact CD1-CD2 4.3Å; F471-S473 VanDerWaalsContact C-N 3.31Å; F471-S473 PolarHBondContact O-N 3.41Å; F471-Q474 PolarHBondContact O-N 3.38Å; F471-Q474 VanDerWaalsContact O-N 3.12Å; F471-H475 HydrophobicContact CD2-CB 3.96Å; F471-H475 AromaticContact CD2-CD2 3.79Å; F471-H475 HydrophobicContact CE1-CB 4.37Å; F471-H475 HydrophobicContact CE2-CB 3.58Å; F471-H475 AromaticContact CE2-CD2 4Å; F471-H475 HydrophobicContact CZ-CB 3.81Å; F471-H475 PolarHBondContact O-N 3.49Å; F471-F528 AromaticContact CE2-CE1 3.64Å; F471-F528 HydrophobicContact CE2-CE1 3.64Å; F471-F528 AromaticContact CE2-CZ 3.59Å; F471-F528 HydrophobicContact CE2-CZ 3.59Å; F471-F528 AromaticContact CZ-CE1 3.82Å; F471-F528 HydrophobicContact CZ-CE1 3.82Å; F471-F528 AromaticContact CZ-CZ 3.88Å; F471-F528 HydrophobicContact CZ-CZ 3.88Å; F471-L540 HydrophobicContact CD2-CD2 3.91Å; F471-L540 HydrophobicContact CE2-CD2 3.98Å
472	T	83.8	Confident	72.1	Confident	36 Å²	36	73.6 Å²	73.6	22%	0.221	40%	0.396	C	S	.	.	H	α-helix	trans	-58.7	-42.3	-173.8	-63.1	0	0	0	0	111.7	C452 D456 K469 Q474 F476	C452-T472 WeakPolarHBondContact CB-OG1 3.39Å; D456-T472 PolarHBondContact OD1-N 3.34Å; D456-T472 WeakPolarHBondContact OD2-CB 3.35Å; D456-T472 PolarHBondContact OD2-OG1 3.02Å; K469-T472 PolarHBondContact O-N 2.88Å; T472-Q474 VanDerWaalsContact C-N 3.3Å; T472-Q474 PolarHBondContact O-N 3.38Å; T472-F476 HydrophobicContact CG2-CB 4.37Å; T472-F476 HydrophobicContact CG2-CD1 4.25Å; T472-F476 WeakPolarHBondContact O-CB 3.08Å; T472-F476 PolarHBondContact O-N 3.02Å
473	S	79.7	Confident	71.8	Confident	50 Å²	50	71.2 Å²	71.2	35%	0.35	39%	0.386	S	S	.	.	H	α-helix	trans	-80.3	-2.8	-178.1	-51.1	0	0	0	0	115.1	Y465 K469 F471	Y465-S473 PolarHBondContact OH-O 3.23Å; K469-S473 VanDerWaalsContact O-CB 3.25Å; K469-S473 WeakPolarHBondContact O-CB 3.4Å; K469-S473 PolarHBondContact O-N 3.31Å; K469-S473 PolarHBondContact O-OG 2.74Å; F471-S473 VanDerWaalsContact C-N 3.31Å; F471-S473 PolarHBondContact O-N 3.41Å
474	Q	77.8	Confident	71.3	Confident	81 Å²	81	69.4 Å²	69.4	38%	0.379	37%	0.37	S	S	.	.	H	α-helix	trans	-117.5	-35.9	178.2	-70.4	-179.2	89.3	0	0	112.8	Y465 T470 F471 T472	Y465-Q474 HydrophobicContact CD2-CG 4.34Å; Y465-Q474 HydrophobicContact CE2-CG 3.48Å; Y465-Q474 VanDerWaalsContact CE2-CG 3.48Å; T470-Q474 WeakPolarHBondContact O-CB 3.45Å; T470-Q474 WeakPolarHBondContact O-CG 3.3Å; T470-Q474 PolarHBondContact O-NE2 2.75Å; F471-Q474 PolarHBondContact O-N 3.38Å; F471-Q474 VanDerWaalsContact O-N 3.12Å; T472-Q474 VanDerWaalsContact C-N 3.3Å; T472-Q474 PolarHBondContact O-N 3.38Å
475	H	81.2	Confident	71	Confident	30 Å²	30	64.3 Å²	64.3	14%	0.139	35%	0.352	C	S	.	.	H	α-helix	trans	-125.2	3.5	-167.7	-59.9	-60.1	0	0	0	114.1	F471 F491 C492 I493 F528	F471-H475 HydrophobicContact CD2-CB 3.96Å; F471-H475 AromaticContact CD2-CD2 3.79Å; F471-H475 HydrophobicContact CE1-CB 4.37Å; F471-H475 HydrophobicContact CE2-CB 3.58Å; F471-H475 AromaticContact CE2-CD2 4Å; F471-H475 HydrophobicContact CZ-CB 3.81Å; F471-H475 PolarHBondContact O-N 3.49Å; H475-F491 PolarHBondContact ND1-O 3.22Å; H475-C492 CarbonylContact O-C 3.52Å; H475-C492 VanDerWaalsContact O-CA 3.28Å; H475-C492 WeakPolarHBondContact O-CA 3.5Å; H475-C492 WeakPolarHBondContact O-CB 3.35Å; H475-I493 PolarHBondContact O-N 3.39Å; H475-F528 HydrophobicContact CB-CE2 4.13Å; H475-F528 HydrophobicContact CB-CZ 3.93Å
476	F	83.4	Confident	70.3	Confident	40 Å²	40	67.3 Å²	67.3	18%	0.175	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	148.5	170.8	-170.2	-117.1	0	0	0	110.9	M448 T472 H478 I493 Q495 Y503	M448-F476 HydrophobicContact CE-CD2 3.54Å; M448-F476 HydrophobicContact CE-CE2 3.63Å; M448-F476 HydrophobicContact CG-CE2 3.85Å; M448-F476 HydrophobicContact CG-CZ 4.17Å; T472-F476 HydrophobicContact CG2-CB 4.37Å; T472-F476 HydrophobicContact CG2-CD1 4.25Å; T472-F476 WeakPolarHBondContact O-CB 3.08Å; T472-F476 PolarHBondContact O-N 3.02Å; F476-H478 HydrophobicContact CE1-CB 4.34Å; F476-I493 WeakPolarHBondContact CA-O 3.43Å; F476-I493 HydrophobicContact CD2-CB 4.36Å; F476-I493 HydrophobicContact CD2-CG2 4.38Å; F476-I493 VanDerWaalsContact CD2-O 3.31Å; F476-I493 WeakPolarHBondContact CD2-O 3.25Å; F476-I493 HydrophobicContact CE2-CG2 4.47Å; F476-Q495 HydrophobicContact CE2-CB 4.27Å; F476-Q495 HydrophobicContact CZ-CB 4.07Å; F476-Y503 HydrophobicContact CE2-CE1 4.29Å
477	S	79.4	Confident	70.4	Confident	29 Å²	29	66.5 Å²	66.5	20%	0.203	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	140.2	177.5	-52.7	0	0	0	0	109.8	I493 H494 Q495	S477-I493 PolarHBondContact N-O 2.83Å; S477-H494 CarbonylContact O-C 3.53Å; S477-H494 WeakPolarHBondContact O-CA 3.37Å; S477-Q495 PolarHBondContact O-N 3.02Å
478	H	76.5	Confident	70.1	Confident	79 Å²	79	69.6 Å²	69.6	37%	0.366	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	135.7	-171.1	-171.9	87	0	0	0	110.8	F476 D481 Q495	F476-H478 HydrophobicContact CE1-CB 4.34Å; H478-D481 PolarHBondContact O-N 3.25Å; H478-D481 VanDerWaalsContact O-N 3.11Å; H478-Q495 PolarHBondContact CE1-OE1 3.45Å; H478-Q495 VanDerWaalsContact CE1-OE1 3.24Å; H478-Q495 PolarHBondContact ND1-OE1 2.84Å
479	T	62.6	Low	69.9	Low	42 Å²	42	76.1 Å²	76.1	26%	0.258	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	134.3	173.8	46.1	0	0	0	0	111.5	Q495	T479-Q495 PolarHBondContact N-O 3.15Å
480	P	50.7	Low	69.8	Low	116 Å²	116	74.7 Å²	74.7	75%	0.753	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	cis	-86.1	-11.8	22.5	33.4	-37.5	0	0	0	115.9	K482	P480-K482 PolarHBondContact O-N 3.45Å
481	D	60.6	Low	70	Confident	125 Å²	125	75.9 Å²	75.9	67%	0.668	40%	0.401	S	S	*	.			trans	-72.7	87.9	-175.7	-69.7	-27.2	0	0	0	111.2	H478 P483	H478-D481 PolarHBondContact O-N 3.25Å; H478-D481 VanDerWaalsContact O-N 3.11Å; D481-P483 VanDerWaalsContact O-CD 3.28Å; D481-P483 WeakPolarHBondContact O-CD 3.34Å
482	K	59.8	Low	70.1	Confident	174 Å²	174	76 Å²	76	76%	0.757	40%	0.401	S	S	*	.			trans	-64.4	116	169.4	-68.7	178.3	-178.4	174.6	0	108.2	P480	P480-K482 PolarHBondContact O-N 3.45Å
483	P	62.8	Low	70.4	Confident	21 Å²	21	74.3 Å²	74.3	14%	0.136	39%	0.391	C	S	.	.			trans	-65	140.8	178.2	26.5	-34.3	0	0	0	110.9	D481 V485 L490 H494 I506	D481-P483 VanDerWaalsContact O-CD 3.28Å; D481-P483 WeakPolarHBondContact O-CD 3.34Å; P483-V485 WeakPolarHBondContact O-CG2 3.35Å; P483-V485 PolarHBondContact O-N 3.5Å; P483-L490 HydrophobicContact CB-CD1 4.27Å; P483-H494 HydrophobicContact CG-CB 4.39Å; P483-I506 HydrophobicContact CB-CD1 4.47Å; P483-I506 HydrophobicContact CG-CD1 3.41Å; P483-I506 VanDerWaalsContact CG-CD1 3.41Å
484	D	59.2	Low	70.8	Confident	87 Å²	87	72.6 Å²	72.6	47%	0.465	38%	0.377	S	S	.	.			trans	-66.2	86.2	-179	-70	-52.6	0	0	0	111.9	T486 K487 L490	D484-T486 PolarHBondContact O-N 2.99Å; D484-K487 HydrophobicContact CB-CD 3.85Å; D484-K487 HydrophobicContact CB-CG 4.13Å; D484-K487 WeakPolarHBondContact O-CB 3.37Å; D484-K487 PolarHBondContact O-N 3.42Å; D484-K487 WeakPolarHBondContact OD2-CE 3.18Å; D484-K487 IonicContact OD2-NZ 3.34Å; D484-K487 PolarHBondContact OD2-NZ 2.89Å; D484-L490 WeakPolarHBondContact O-CD1 3.28Å
485	V	61.1	Low	71.3	Confident	53 Å²	53	69.4 Å²	69.4	32%	0.321	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-18.2	-178.4	-165	0	0	0	0	113.3	P483 K487 G509 I511	P483-V485 WeakPolarHBondContact O-CG2 3.35Å; P483-V485 PolarHBondContact O-N 3.5Å; V485-K487 PolarHBondContact O-N 3.41Å; V485-G509 VanDerWaalsContact CG1-O 3.27Å; V485-G509 WeakPolarHBondContact CG1-O 3.27Å; V485-G509 WeakPolarHBondContact O-CA 3.45Å; V485-I511 HydrophobicContact CG1-CD1 4.49Å; V485-I511 HydrophobicContact CG1-CG1 4.18Å; V485-I511 HydrophobicContact CG2-CD1 4.17Å; V485-I511 HydrophobicContact CG2-CG1 4.5Å
486	T	55.7	Low	71.5	Confident	125 Å²	125	69.6 Å²	69.6	77%	0.767	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-14.7	172.4	51.2	0	0	0	0	114.6	D484 E488	D484-T486 PolarHBondContact O-N 2.99Å; T486-E488 PolarHBondContact O-N 2.8Å
487	K	64.5	Low	71.4	Confident	114 Å²	114	69.1 Å²	69.1	50%	0.496	37%	0.369	S	S	.	.			trans	-85.9	98.5	175.7	-68.2	171	-173.7	158.3	0	109.4	D484 V485 N489 L490	D484-K487 HydrophobicContact CB-CD 3.85Å; D484-K487 HydrophobicContact CB-CG 4.13Å; D484-K487 WeakPolarHBondContact O-CB 3.37Å; D484-K487 PolarHBondContact O-N 3.42Å; D484-K487 WeakPolarHBondContact OD2-CE 3.18Å; D484-K487 IonicContact OD2-NZ 3.34Å; D484-K487 PolarHBondContact OD2-NZ 2.89Å; V485-K487 PolarHBondContact O-N 3.41Å; K487-N489 PolarHBondContact O-N 2.97Å; K487-L490 HydrophobicContact CB-CD1 3.98Å; K487-L490 HydrophobicContact CB-CG 3.81Å; K487-L490 WeakPolarHBondContact O-CB 3.29Å; K487-L490 PolarHBondContact O-N 2.85Å
488	E	59.2	Low	71.5	Confident	158 Å²	158	70.9 Å²	70.9	74%	0.738	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-31.6	-176.2	-60.2	-179.6	160.4	0	0	114.1	T486 L490 Q508	T486-E488 PolarHBondContact O-N 2.8Å; E488-L490 VanDerWaalsContact C-N 3.3Å; E488-L490 PolarHBondContact O-N 3.46Å; E488-Q508 WeakPolarHBondContact O-CA 3.14Å
489	N	65.3	Low	71.7	Confident	164 Å²	164	71 Å²	71	88%	0.877	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	9.2	179	-67.1	-42.2	0	0	0	114.9	K487	K487-N489 PolarHBondContact O-N 2.97Å
490	L	76.3	Confident	72.6	Confident	43 Å²	43	71.7 Å²	71.7	23%	0.225	39%	0.39	C	S	.	.			trans	-74.6	130.6	174.8	-76.9	179.1	0	0	0	112.3	P483 D484 K487 E488 Y507 Q508	P483-L490 HydrophobicContact CB-CD1 4.27Å; D484-L490 WeakPolarHBondContact O-CD1 3.28Å; K487-L490 HydrophobicContact CB-CD1 3.98Å; K487-L490 HydrophobicContact CB-CG 3.81Å; K487-L490 WeakPolarHBondContact O-CB 3.29Å; K487-L490 PolarHBondContact O-N 2.85Å; E488-L490 VanDerWaalsContact C-N 3.3Å; E488-L490 PolarHBondContact O-N 3.46Å; L490-Y507 WeakPolarHBondContact O-CA 3.33Å; L490-Q508 PolarHBondContact O-N 2.98Å
491	F	85.1	Confident	74.4	Confident	27 Å²	27	66.3 Å²	66.3	12%	0.118	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	94.6	171.6	177	-131.8	0	0	0	109.4	H475 L505 I506 Y507 F528 V531 I532	H475-F491 PolarHBondContact ND1-O 3.22Å; F491-L505 HydrophobicContact CD2-CD1 4.24Å; F491-L505 HydrophobicContact CE2-CD1 3.94Å; F491-I506 WeakPolarHBondContact CA-O 3.48Å; F491-Y507 HydrophobicContact CB-CD2 4.3Å; F491-Y507 AromaticContact CD2-CD2 3.53Å; F491-Y507 HydrophobicContact CD2-CD2 3.53Å; F491-Y507 HydrophobicContact CD2-CE2 4.4Å; F491-Y507 HydrophobicContact CD2-CG 4.24Å; F491-Y507 HydrophobicContact CE2-CD2 4.08Å; F491-Y507 HydrophobicContact CG-CD2 4.1Å; F491-F528 AromaticContact CD1-CE2 3.86Å; F491-F528 HydrophobicContact CD1-CE2 3.86Å; F491-F528 HydrophobicContact CD1-CZ 4.43Å; F491-F528 HydrophobicContact CD2-CD2 4.21Å; F491-F528 HydrophobicContact CD2-CE2 4.22Å; F491-F528 AromaticContact CE1-CD2 3.86Å; F491-F528 HydrophobicContact CE1-CD2 3.86Å; F491-F528 AromaticContact CE1-CE2 3.38Å; F491-F528 HydrophobicContact CE1-CE2 3.38Å; F491-F528 AromaticContact CE1-CZ 3.8Å; F491-F528 HydrophobicContact CE1-CZ 3.8Å; F491-F528 AromaticContact CE2-CD2 3.51Å; F491-F528 HydrophobicContact CE2-CD2 3.51Å; F491-F528 AromaticContact CE2-CE2 3.81Å; F491-F528 HydrophobicContact CE2-CE2 3.81Å; F491-F528 HydrophobicContact CE2-CG 4.36Å; F491-F528 HydrophobicContact CG-CE2 4.26Å; F491-F528 AromaticContact CZ-CD2 3.3Å; F491-F528 HydrophobicContact CZ-CD2 3.3Å; F491-F528 AromaticContact CZ-CE2 3.36Å; F491-F528 HydrophobicContact CZ-CE2 3.36Å; F491-F528 AromaticContact CZ-CG 3.94Å; F491-F528 HydrophobicContact CZ-CG 3.94Å; F491-F528 HydrophobicContact CZ-CZ 4.05Å; F491-V531 HydrophobicContact CD2-CG1 4.43Å; F491-V531 HydrophobicContact CE2-CB 3.98Å; F491-V531 HydrophobicContact CE2-CG1 3.67Å; F491-V531 HydrophobicContact CZ-CB 4Å; F491-V531 HydrophobicContact CZ-CG1 3.76Å; F491-I532 HydrophobicContact CE1-CD1 3.98Å; F491-I532 HydrophobicContact CE1-CG1 3.66Å; F491-I532 HydrophobicContact CZ-CD1 4.23Å; F491-I532 HydrophobicContact CZ-CG1 3.85Å
492	C	87.9	Confident	75.7	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.014	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	156.4	-176.1	66.8	0	0	0	0	113.3	H475 I506	H475-C492 CarbonylContact O-C 3.52Å; H475-C492 VanDerWaalsContact O-CA 3.28Å; H475-C492 WeakPolarHBondContact O-CA 3.5Å; H475-C492 WeakPolarHBondContact O-CB 3.35Å; C492-I506 PolarHBondContact N-O 2.99Å; C492-I506 PolarHBondContact O-N 3.43Å
493	I	90.6	Very high	77.2	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	117.9	167.9	-62.9	171.1	0	0	0	108	M448 H475 F476 S477 Y503 L505 T524 I525 F528	M448-I493 HydrophobicContact CE-CB 4.09Å; M448-I493 HydrophobicContact CE-CD1 3.84Å; M448-I493 HydrophobicContact CE-CG2 3.78Å; H475-I493 PolarHBondContact O-N 3.39Å; F476-I493 WeakPolarHBondContact CA-O 3.43Å; F476-I493 HydrophobicContact CD2-CB 4.36Å; F476-I493 HydrophobicContact CD2-CG2 4.38Å; F476-I493 VanDerWaalsContact CD2-O 3.31Å; F476-I493 WeakPolarHBondContact CD2-O 3.25Å; F476-I493 HydrophobicContact CE2-CG2 4.47Å; S477-I493 PolarHBondContact N-O 2.83Å; I493-Y503 HydrophobicContact CG2-CD1 4.28Å; I493-L505 HydrophobicContact CG1-CD1 4.34Å; I493-T524 HydrophobicContact CD1-CG2 4.46Å; I493-T524 HydrophobicContact CG1-CG2 4.14Å; I493-T524 HydrophobicContact CG2-CG2 3.78Å; I493-I525 HydrophobicContact CD1-CG1 4.35Å; I493-F528 HydrophobicContact CD1-CB 3.92Å; I493-F528 HydrophobicContact CD1-CD1 4.38Å; I493-F528 HydrophobicContact CD1-CD2 4.2Å; I493-F528 HydrophobicContact CD1-CG 3.92Å; I493-F528 HydrophobicContact CG1-CB 4.21Å; I493-F528 HydrophobicContact CG1-CD2 3.98Å; I493-F528 HydrophobicContact CG1-CG 4.18Å
494	H	87.8	Confident	78.5	Confident	15 Å²	15	53.1 Å²	53.1	7%	0.069	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	121.1	178.2	172.4	-123.8	0	0	0	110.6	S477 P483 S496 Q504 I506	S477-H494 CarbonylContact O-C 3.53Å; S477-H494 WeakPolarHBondContact O-CA 3.37Å; P483-H494 HydrophobicContact CG-CB 4.39Å; H494-S496 PolarHBondContact O-N 3.08Å; H494-Q504 PolarHBondContact N-O 3.35Å; H494-Q504 PolarHBondContact ND1-OE1 3.13Å; H494-Q504 PolarHBondContact O-N 3.31Å; H494-I506 HydrophobicContact CB-CD1 3.77Å; H494-I506 HydrophobicContact CB-CG1 4.25Å
495	Q	88.3	Confident	80	Confident	14 Å²	14	49 Å²	49	7%	0.065	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	97.4	168	-173.9	174.9	0.5	0	0	109.7	F476 S477 H478 T479 S497 Y503	F476-Q495 HydrophobicContact CE2-CB 4.27Å; F476-Q495 HydrophobicContact CZ-CB 4.07Å; S477-Q495 PolarHBondContact O-N 3.02Å; H478-Q495 PolarHBondContact CE1-OE1 3.45Å; H478-Q495 VanDerWaalsContact CE1-OE1 3.24Å; H478-Q495 PolarHBondContact ND1-OE1 2.84Å; T479-Q495 PolarHBondContact N-O 3.15Å; Q495-S497 VanDerWaalsContact C-N 3.35Å; Q495-S497 WeakPolarHBondContact CG-O 3.38Å; Q495-S497 PolarHBondContact NE2-O 3.03Å; Q495-Y503 HydrophobicContact CB-CD1 3.83Å; Q495-Y503 HydrophobicContact CB-CE1 3.76Å; Q495-Y503 HydrophobicContact CG-CD1 3.98Å; Q495-Y503 HydrophobicContact CG-CE1 3.65Å
496	S	83.8	Confident	81.3	Confident	33 Å²	33	46.6 Å²	46.6	23%	0.231	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-11.7	-177.7	65.6	0	0	0	0	115	H494 H502	H494-S496 PolarHBondContact O-N 3.08Å; S496-H502 PolarHBondContact N-O 3.14Å; S496-H502 PolarHBondContact OG-CD2 3.15Å; S496-H502 PolarHBondContact OG-O 3Å
497	S	83.3	Confident	82.7	Confident	31 Å²	31	41.8 Å²	41.8	22%	0.217	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	144.7	-179.2	-162.8	0	0	0	0	110.5	Q495 P500 P501 H502	Q495-S497 VanDerWaalsContact C-N 3.35Å; Q495-S497 WeakPolarHBondContact CG-O 3.38Å; Q495-S497 PolarHBondContact NE2-O 3.03Å; S497-P500 PolarHBondContact OG-O 3.3Å; S497-P501 WeakPolarHBondContact O-CA 3.3Å; S497-H502 PolarHBondContact O-N 2.81Å; S497-H502 VanDerWaalsContact O-N 3.08Å
498	T	80.7	Confident	83.4	Confident	65 Å²	65	42 Å²	42	40%	0.399	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-43.4	176.5	44.9	0	0	0	0	112.4	P501	T498-P501 WeakPolarHBondContact O-CA 3.48Å; T498-P501 WeakPolarHBondContact O-CD 3.27Å
499	T	80.3	Confident	84.1	Confident	83 Å²	83	35.7 Å²	35.7	51%	0.509	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-137.1	110.8	-175.5	46.1	0	0	0	0	111.6
500	P	82.4	Confident	84.9	Confident	56 Å²	56	33.6 Å²	33.6	36%	0.364	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	cis	-67.2	142.4	-15.7	30.3	-34.5	0	0	0	110.9	W425 N426 S497 K516	W425-P500 HydrophobicContact CH2-CB 4.27Å; W425-P500 HydrophobicContact CZ3-CB 4.04Å; N426-P500 HydrophobicContact CB-CB 4.4Å; S497-P500 PolarHBondContact OG-O 3.3Å; P500-K516 HydrophobicContact CG-CD 4.13Å; P500-K516 PolarHBondContact O-NZ 3.08Å
501	P	86.8	Confident	85.3	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.013	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	137.6	-172.6	25.4	-34.2	0	0	0	111.3	W425 C444 S497 T498 Y503	W425-P501 WeakPolarHBondContact O-CG 3.43Å; C444-P501 HydrophobicContact CB-CB 4.07Å; C444-P501 HydrophobicContact CB-CG 3.68Å; S497-P501 WeakPolarHBondContact O-CA 3.3Å; T498-P501 WeakPolarHBondContact O-CA 3.48Å; T498-P501 WeakPolarHBondContact O-CD 3.27Å; P501-Y503 HydrophobicContact CB-CE2 4.35Å
502	H	88.4	Confident	85.4	Confident	11 Å²	11	35.7 Å²	35.7	5%	0.051	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	116.3	-179.7	-167.5	49.3	0	0	0	112.9	S496 S497 S513 L514 K516 N520	S496-H502 PolarHBondContact N-O 3.14Å; S496-H502 PolarHBondContact OG-CD2 3.15Å; S496-H502 PolarHBondContact OG-O 3Å; S497-H502 PolarHBondContact O-N 2.81Å; S497-H502 VanDerWaalsContact O-N 3.08Å; H502-S513 PolarHBondContact NE2-OG 3.43Å; H502-S513 VanDerWaalsContact NE2-OG 3.08Å; H502-L514 PolarHBondContact CE1-O 2.6Å; H502-L514 PolarHBondContact NE2-O 3.1Å; H502-K516 HydrophobicContact CB-CD 4.34Å; H502-K516 HydrophobicContact CB-CG 4.16Å; H502-K516 WeakPolarHBondContact ND1-CG 3.29Å; H502-N520 PolarHBondContact CE1-ND2 3.26Å; H502-N520 PolarHBondContact ND1-ND2 2.65Å
503	Y	90.9	Very high	85.4	Confident	1 Å²	1	37.8 Å²	37.8	0%	0.004	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	145.7	179.7	-56.5	-81.5	0	0	0	111.2	C444 M448 F476 I493 Q495 P501 N520 L521 T524	C444-Y503 HydrophobicContact CB-CE2 4.25Å; C444-Y503 PolarHBondContact O-OH 3.22Å; M448-Y503 HydrophobicContact CB-CE1 4.25Å; M448-Y503 HydrophobicContact CG-CE1 3.88Å; F476-Y503 HydrophobicContact CE2-CE1 4.29Å; I493-Y503 HydrophobicContact CG2-CD1 4.28Å; Q495-Y503 HydrophobicContact CB-CD1 3.83Å; Q495-Y503 HydrophobicContact CB-CE1 3.76Å; Q495-Y503 HydrophobicContact CG-CD1 3.98Å; Q495-Y503 HydrophobicContact CG-CE1 3.65Å; P501-Y503 HydrophobicContact CB-CE2 4.35Å; Y503-N520 PolarHBondContact N-OD1 3.45Å; Y503-N520 PolarHBondContact O-ND2 2.86Å; Y503-L521 HydrophobicContact CD2-CB 4.02Å; Y503-L521 HydrophobicContact CD2-CD1 3.82Å; Y503-L521 HydrophobicContact CD2-CG 4.49Å; Y503-L521 HydrophobicContact CE2-CB 4.15Å; Y503-L521 HydrophobicContact CE2-CD1 3.71Å; Y503-L521 HydrophobicContact CE2-CG 4.35Å; Y503-L521 HydrophobicContact CG-CD1 4.33Å; Y503-T524 PolarHBondContact O-OG1 2.91Å
504	Q	91.1	Very high	85.2	Confident	31 Å²	31	38.1 Å²	38.1	15%	0.145	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	143.8	-179.6	-58.5	177.2	-39.1	0	0	108.3	H494 I511 S513	H494-Q504 PolarHBondContact N-O 3.35Å; H494-Q504 PolarHBondContact ND1-OE1 3.13Å; H494-Q504 PolarHBondContact O-N 3.31Å; Q504-I511 HydrophobicContact CB-CG2 4.15Å; Q504-S513 VanDerWaalsContact NE2-CB 3.34Å; Q504-S513 PolarHBondContact NE2-OG 3.06Å
505	L	90	Very high	85	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	134.2	170.5	175.7	64.3	0	0	0	109.3	I319 F491 I493 Y512 T524 M527 F528 V531	I319-L505 HydrophobicContact CD1-CD2 4.26Å; F491-L505 HydrophobicContact CD2-CD1 4.24Å; F491-L505 HydrophobicContact CE2-CD1 3.94Å; I493-L505 HydrophobicContact CG1-CD1 4.34Å; L505-Y512 PolarHBondContact N-O 2.82Å; L505-Y512 VanDerWaalsContact N-O 3.15Å; L505-Y512 PolarHBondContact O-N 2.95Å; L505-T524 HydrophobicContact CB-CG2 4.31Å; L505-M527 HydrophobicContact CD2-CB 3.7Å; L505-F528 HydrophobicContact CD1-CB 4.15Å; L505-F528 HydrophobicContact CD1-CD2 3.85Å; L505-V531 HydrophobicContact CD2-CG2 4.48Å
506	I	88.5	Confident	84.8	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	126.7	170.7	-57.7	179.5	0	0	0	107.9	P483 F491 C492 H494 H510 I511	P483-I506 HydrophobicContact CB-CD1 4.47Å; P483-I506 HydrophobicContact CG-CD1 3.41Å; P483-I506 VanDerWaalsContact CG-CD1 3.41Å; F491-I506 WeakPolarHBondContact CA-O 3.48Å; C492-I506 PolarHBondContact N-O 2.99Å; C492-I506 PolarHBondContact O-N 3.43Å; H494-I506 HydrophobicContact CB-CD1 3.77Å; H494-I506 HydrophobicContact CB-CG1 4.25Å; I506-H510 WeakPolarHBondContact CA-O 3.16Å; I506-I511 HydrophobicContact CG1-CG1 4.36Å
507	Y	84.7	Confident	84.9	Confident	24 Å²	24	42 Å²	42	9%	0.094	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	131	-179.8	175.5	-109.3	0	0	0	109.4	L490 F491 G509 H510 Y512 V531 K535	L490-Y507 WeakPolarHBondContact O-CA 3.33Å; F491-Y507 HydrophobicContact CB-CD2 4.3Å; F491-Y507 AromaticContact CD2-CD2 3.53Å; F491-Y507 HydrophobicContact CD2-CD2 3.53Å; F491-Y507 HydrophobicContact CD2-CE2 4.4Å; F491-Y507 HydrophobicContact CD2-CG 4.24Å; F491-Y507 HydrophobicContact CE2-CD2 4.08Å; F491-Y507 HydrophobicContact CG-CD2 4.1Å; Y507-G509 VanDerWaalsContact C-N 3.29Å; Y507-G509 PolarHBondContact O-N 3.12Å; Y507-H510 PolarHBondContact N-O 3.29Å; Y507-H510 PolarHBondContact O-N 3.22Å; Y507-Y512 HydrophobicContact CD1-CE2 4.49Å; Y507-V531 HydrophobicContact CD2-CG1 3.87Å; Y507-V531 HydrophobicContact CE1-CG1 4.39Å; Y507-V531 HydrophobicContact CE2-CG1 3.54Å; Y507-V531 HydrophobicContact CG-CG1 4.41Å; Y507-K535 WeakPolarHBondContact OH-CG 3.36Å
508	Q	80.2	Confident	84.9	Confident	120 Å²	120	44.9 Å²	44.9	56%	0.561	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	42.6	177.1	-65.9	-175.9	-30	0	0	113.8	E488 L490 H510	E488-Q508 WeakPolarHBondContact O-CA 3.14Å; L490-Q508 PolarHBondContact O-N 2.98Å; Q508-H510 PolarHBondContact O-N 2.96Å; Q508-H510 VanDerWaalsContact O-N 3.17Å
509	G	74.3	Confident	85.3	Confident	25 Å²	25	44.5 Å²	44.5	26%	0.258	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	3.7	-177.7	0	0	0	0	0	115.3	V485 Y507	V485-G509 VanDerWaalsContact CG1-O 3.27Å; V485-G509 WeakPolarHBondContact CG1-O 3.27Å; V485-G509 WeakPolarHBondContact O-CA 3.45Å; Y507-G509 VanDerWaalsContact C-N 3.29Å; Y507-G509 PolarHBondContact O-N 3.12Å
510	H	81.5	Confident	85.9	Confident	119 Å²	119	40.9 Å²	40.9	55%	0.551	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	136.6	176.5	-67.1	-31.9	0	0	0	112	I506 Y507 Q508 Y512	I506-H510 WeakPolarHBondContact CA-O 3.16Å; Y507-H510 PolarHBondContact N-O 3.29Å; Y507-H510 PolarHBondContact O-N 3.22Å; Q508-H510 PolarHBondContact O-N 2.96Å; Q508-H510 VanDerWaalsContact O-N 3.17Å; H510-Y512 HydrophobicContact CB-CD2 4.35Å; H510-Y512 HydrophobicContact CB-CE2 3.65Å
511	I	85.4	Confident	86.4	Confident	86 Å²	86	38.3 Å²	38.3	44%	0.441	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	109.9	174.9	-50.8	176.2	0	0	0	109.1	V485 Q504 I506 S513	V485-I511 HydrophobicContact CG1-CD1 4.49Å; V485-I511 HydrophobicContact CG1-CG1 4.18Å; V485-I511 HydrophobicContact CG2-CD1 4.17Å; V485-I511 HydrophobicContact CG2-CG1 4.5Å; Q504-I511 HydrophobicContact CB-CG2 4.15Å; I506-I511 HydrophobicContact CG1-CG1 4.36Å; I511-S513 PolarHBondContact O-N 3.43Å
512	Y	86.3	Confident	86.6	Confident	29 Å²	29	38.3 Å²	38.3	11%	0.114	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	83.9	173.5	-60.1	-93.7	0	0	0	108.8	V315 R318 I319 L505 Y507 H510	V315-Y512 HydrophobicContact CG1-CD1 4.11Å; R318-Y512 HydrophobicContact CB-CE1 3.98Å; I319-Y512 HydrophobicContact CD1-CD1 3.6Å; I319-Y512 HydrophobicContact CD1-CD2 4.47Å; I319-Y512 HydrophobicContact CD1-CE1 4.07Å; I319-Y512 HydrophobicContact CD1-CG 3.82Å; I319-Y512 HydrophobicContact CG1-CD1 3.46Å; I319-Y512 VanDerWaalsContact CG1-CD1 3.46Å; I319-Y512 HydrophobicContact CG1-CE1 3.42Å; I319-Y512 VanDerWaalsContact CG1-CE1 3.42Å; I319-Y512 HydrophobicContact CG1-CG 4.12Å; L505-Y512 PolarHBondContact N-O 2.82Å; L505-Y512 VanDerWaalsContact N-O 3.15Å; L505-Y512 PolarHBondContact O-N 2.95Å; Y507-Y512 HydrophobicContact CD1-CE2 4.49Å; H510-Y512 HydrophobicContact CB-CD2 4.35Å; H510-Y512 HydrophobicContact CB-CE2 3.65Å
513	S	87.3	Confident	86.8	Confident	46 Å²	46	38.6 Å²	38.6	32%	0.322	20%	0.196	S	C	.	.			trans	-89.7	110.6	173.4	-174.4	0	0	0	0	110.8	H502 Q504 I511	H502-S513 PolarHBondContact NE2-OG 3.43Å; H502-S513 VanDerWaalsContact NE2-OG 3.08Å; Q504-S513 VanDerWaalsContact NE2-CB 3.34Å; Q504-S513 PolarHBondContact NE2-OG 3.06Å; I511-S513 PolarHBondContact O-N 3.43Å
514	L	86.8	Confident	86.9	Confident	7 Å²	7	38.6 Å²	38.6	4%	0.037	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-68.6	171.4	164	-74.1	162.9	0	0	0	111.4	A312 V315 H502 H523 M527	A312-L514 HydrophobicContact CB-CD2 3.78Å; V315-L514 HydrophobicContact CB-CD2 4.13Å; V315-L514 HydrophobicContact CG1-CD2 4.32Å; V315-L514 HydrophobicContact CG1-CG 4.45Å; H502-L514 PolarHBondContact CE1-O 2.6Å; H502-L514 PolarHBondContact NE2-O 3.1Å; L514-H523 HydrophobicContact CD1-CB 3.36Å; L514-M527 HydrophobicContact CD1-CE 3.98Å; L514-M527 HydrophobicContact CD1-SD 3.88Å; L514-M527 HydrophobicContact CD2-CE 3.77Å; L514-M527 HydrophobicContact CG-CE 4.01Å; L514-M527 HydrophobicContact CG-SD 4.22Å
515	P	84.5	Confident	87	Confident	39 Å²	39	37.2 Å²	37.2	25%	0.253	19%	0.19	S	C	.	.	P	Polyproline II helix	trans	-66	159.7	163.9	-21.9	35.6	0	0	0	112.8	S308 A311 N520	S308-P515 WeakPolarHBondContact O-CG 3.5Å; A311-P515 HydrophobicContact CB-CG 3.84Å; P515-N520 PolarHBondContact O-ND2 3.04Å
516	K	83.4	Confident	87.2	Confident	90 Å²	90	37.2 Å²	37.2	39%	0.391	19%	0.19	S	C	.	.	S	Bend	trans	-73.4	141.2	169.8	-67.7	-170.3	177.6	-148.4	0	110.5	W425 P500 H502	W425-K516 HydrophobicContact CH2-CB 4.41Å; W425-K516 HydrophobicContact CZ3-CB 4.42Å; P500-K516 HydrophobicContact CG-CD 4.13Å; P500-K516 PolarHBondContact O-NZ 3.08Å; H502-K516 HydrophobicContact CB-CD 4.34Å; H502-K516 HydrophobicContact CB-CG 4.16Å; H502-K516 WeakPolarHBondContact ND1-CG 3.29Å
517	G	85.1	Confident	87.3	Confident	15 Å²	15	37.1 Å²	37.1	16%	0.155	19%	0.189	C	C	.	.	S	Bend	trans	151.7	-178.1	176.7	0	0	0	0	0	113.8	N519 N520	G517-N519 PolarHBondContact O-N 3.05Å; G517-N520 WeakPolarHBondContact O-CB 3.38Å; G517-N520 PolarHBondContact O-N 3.05Å
518	R	85.1	Confident	87.6	Confident	91 Å²	91	36 Å²	36	34%	0.343	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-35.7	-175.2	-172.3	-179.1	-179.5	86.2	0.1	114.8	S421 F423 W425	S421-R518 PolarHBondContact O-NH2 3.16Å; S421-R518 VanDerWaalsContact O-NH2 3.16Å; F423-R518 HydrophobicContact CD1-CG 4.31Å; F423-R518 HydrophobicContact CE1-CG 4.14Å; F423-R518 PolarHBondContact O-NH1 3.09Å; W425-R518 HydrophobicContact CB-CB 4.43Å; W425-R518 HydrophobicContact CG-CB 4.26Å
519	N	88.3	Confident	88.2	Confident	56 Å²	56	30.3 Å²	30.3	30%	0.299	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-8	-174.2	-71.1	20.2	0	0	0	114	G517 L521 F522 H523	G517-N519 PolarHBondContact O-N 3.05Å; N519-L521 PolarHBondContact O-N 3.34Å; N519-F522 PolarHBondContact O-N 3.05Å; N519-H523 PolarHBondContact ND2-NE2 2.72Å; N519-H523 WeakPolarHBondContact O-CB 3.36Å; N519-H523 PolarHBondContact O-N 3.14Å
520	N	92.2	Very high	88.9	Confident	8 Å²	8	31.1 Å²	31.1	4%	0.043	15%	0.154	C	C	.	.	H	α-helix	trans	-54.5	-54.1	-174.6	170.5	-103.6	0	0	0	112.4	H502 Y503 P515 G517 F522 T524	H502-N520 PolarHBondContact CE1-ND2 3.26Å; H502-N520 PolarHBondContact ND1-ND2 2.65Å; Y503-N520 PolarHBondContact N-OD1 3.45Å; Y503-N520 PolarHBondContact O-ND2 2.86Å; P515-N520 PolarHBondContact O-ND2 3.04Å; G517-N520 WeakPolarHBondContact O-CB 3.38Å; G517-N520 PolarHBondContact O-N 3.05Å; N520-F522 PolarHBondContact O-N 2.96Å; N520-T524 WeakPolarHBondContact O-CB 3.5Å; N520-T524 PolarHBondContact O-N 2.82Å; N520-T524 PolarHBondContact O-OG1 2.72Å
521	L	92.7	Very high	89.3	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-56.5	-53	177.9	174.2	60.8	0	0	0	112.2	C444 L447 M448 Y503 N519 T524 I525	C444-L521 HydrophobicContact CB-CD2 4.36Å; L447-L521 HydrophobicContact CB-CD2 4.02Å; M448-L521 HydrophobicContact CB-CD1 4.19Å; M448-L521 HydrophobicContact CG-CD1 4.41Å; M448-L521 HydrophobicContact SD-CD1 3.69Å; Y503-L521 HydrophobicContact CD2-CB 4.02Å; Y503-L521 HydrophobicContact CD2-CD1 3.82Å; Y503-L521 HydrophobicContact CD2-CG 4.49Å; Y503-L521 HydrophobicContact CE2-CB 4.15Å; Y503-L521 HydrophobicContact CE2-CD1 3.71Å; Y503-L521 HydrophobicContact CE2-CG 4.35Å; Y503-L521 HydrophobicContact CG-CD1 4.33Å; N519-L521 PolarHBondContact O-N 3.34Å; L521-T524 PolarHBondContact O-N 3.08Å; L521-I525 HydrophobicContact CD1-CD1 3.65Å; L521-I525 HydrophobicContact CD1-CG1 4.24Å; L521-I525 HydrophobicContact CG-CD1 4.06Å; L521-I525 WeakPolarHBondContact O-CG1 3.44Å; L521-I525 PolarHBondContact O-N 2.81Å
522	F	93.1	Very high	89.4	Confident	1 Å²	1	21.6 Å²	21.6	0%	0.004	11%	0.108	C	C	.	.	H	α-helix	trans	-65.6	-42.6	-175.7	-59.1	-68.3	0	0	0	112.1	T333 L336 R337 I340 M420 F423 L447 N519 N520 I525 L526	T333-F522 HydrophobicContact CG2-CB 3.99Å; T333-F522 HydrophobicContact CG2-CG 4.41Å; L336-F522 HydrophobicContact CD2-CB 4.42Å; L336-F522 HydrophobicContact CD2-CD1 4.36Å; R337-F522 HydrophobicContact CG-CD1 3.85Å; R337-F522 HydrophobicContact CG-CE1 3.68Å; R337-F522 HydrophobicContact CG-CE2 4.45Å; R337-F522 HydrophobicContact CG-CG 4.33Å; R337-F522 HydrophobicContact CG-CZ 4.01Å; R337-F522 VanDerWaalsContact NE-CE2 3.27Å; I340-F522 HydrophobicContact CD1-CE1 4.34Å; M420-F522 HydrophobicContact CE-CE1 3.79Å; M420-F522 HydrophobicContact CE-CZ 4.05Å; F423-F522 HydrophobicContact CD1-CE2 4.06Å; F423-F522 HydrophobicContact CD1-CZ 4.41Å; F423-F522 HydrophobicContact CD2-CZ 4.33Å; F423-F522 AromaticContact CE1-CE2 3.56Å; F423-F522 HydrophobicContact CE1-CE2 3.56Å; F423-F522 HydrophobicContact CE1-CZ 4.11Å; F423-F522 HydrophobicContact CE2-CE2 4.28Å; F423-F522 HydrophobicContact CE2-CZ 4.06Å; F423-F522 HydrophobicContact CG-CZ 4.49Å; F423-F522 AromaticContact CZ-CE2 3.67Å; F423-F522 HydrophobicContact CZ-CE2 3.67Å; F423-F522 AromaticContact CZ-CZ 3.92Å; F423-F522 HydrophobicContact CZ-CZ 3.92Å; L447-F522 HydrophobicContact CD1-CE1 4.04Å; L447-F522 HydrophobicContact CD1-CZ 3.81Å; N519-F522 PolarHBondContact O-N 3.05Å; N520-F522 PolarHBondContact O-N 2.96Å; F522-I525 PolarHBondContact O-N 2.99Å; F522-L526 WeakPolarHBondContact O-CB 3.06Å; F522-L526 VanDerWaalsContact O-CG 3.3Å; F522-L526 WeakPolarHBondContact O-CG 3.23Å; F522-L526 PolarHBondContact O-N 2.98Å
523	H	91.8	Very high	89.5	Confident	18 Å²	18	23.1 Å²	23.1	8%	0.083	12%	0.115	C	C	.	.	H	α-helix	trans	-66.8	-39.3	176.7	-73.6	-162.8	0	0	0	111.5	W316 V329 T333 L514 N519 L526 M527	W316-H523 HydrophobicContact CZ2-CB 4.29Å; W316-H523 AromaticContact NE1-CE1 3.98Å; W316-H523 AromaticContact NE1-CG 3.78Å; W316-H523 AromaticContact NE1-ND1 3.36Å; W316-H523 PolarHBondContact NE1-ND1 3.4Å; V329-H523 WeakPolarHBondContact CG1-NE2 3.31Å; T333-H523 PolarHBondContact OG1-CD2 2.6Å; L514-H523 HydrophobicContact CD1-CB 3.36Å; N519-H523 PolarHBondContact ND2-NE2 2.72Å; N519-H523 WeakPolarHBondContact O-CB 3.36Å; N519-H523 PolarHBondContact O-N 3.14Å; H523-L526 PolarHBondContact O-N 2.7Å; H523-M527 WeakPolarHBondContact O-CB 3.44Å; H523-M527 VanDerWaalsContact O-CG 3.23Å; H523-M527 WeakPolarHBondContact O-CG 3.48Å; H523-M527 PolarHBondContact O-N 2.7Å
524	T	92.7	Very high	89.5	Confident	1 Å²	1	24.1 Å²	24.1	1%	0.006	12%	0.12	C	C	.	.	H	α-helix	trans	-62.7	-41.9	174.7	-63.2	0	0	0	0	111.9	I493 Y503 L505 N520 L521 M527 F528	I493-T524 HydrophobicContact CD1-CG2 4.46Å; I493-T524 HydrophobicContact CG1-CG2 4.14Å; I493-T524 HydrophobicContact CG2-CG2 3.78Å; Y503-T524 PolarHBondContact O-OG1 2.91Å; L505-T524 HydrophobicContact CB-CG2 4.31Å; N520-T524 WeakPolarHBondContact O-CB 3.5Å; N520-T524 PolarHBondContact O-N 2.82Å; N520-T524 PolarHBondContact O-OG1 2.72Å; L521-T524 PolarHBondContact O-N 3.08Å; T524-M527 PolarHBondContact O-N 3.43Å; T524-F528 PolarHBondContact O-N 3.06Å; T524-F528 VanDerWaalsContact O-N 3.08Å
525	I	93.8	Very high	89.3	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-65	-43.6	173.7	-68	170	0	0	0	111	L336 M448 F451 I493 L521 F522 M527 F528 L529	L336-I525 HydrophobicContact CD1-CG2 4.23Å; L336-I525 HydrophobicContact CD2-CB 4.08Å; L336-I525 HydrophobicContact CD2-CG2 3.74Å; M448-I525 HydrophobicContact SD-CD1 4.08Å; M448-I525 HydrophobicContact SD-CG1 4.34Å; F451-I525 HydrophobicContact CD1-CD1 4.25Å; F451-I525 HydrophobicContact CE1-CD1 4.5Å; F451-I525 HydrophobicContact CE1-CG1 4.36Å; F451-I525 HydrophobicContact CE1-CG2 4.12Å; F451-I525 HydrophobicContact CE2-CG2 4.01Å; F451-I525 HydrophobicContact CG-CD1 4.38Å; F451-I525 HydrophobicContact CZ-CG2 3.68Å; I493-I525 HydrophobicContact CD1-CG1 4.35Å; L521-I525 HydrophobicContact CD1-CD1 3.65Å; L521-I525 HydrophobicContact CD1-CG1 4.24Å; L521-I525 HydrophobicContact CG-CD1 4.06Å; L521-I525 WeakPolarHBondContact O-CG1 3.44Å; L521-I525 PolarHBondContact O-N 2.81Å; F522-I525 PolarHBondContact O-N 2.99Å; I525-M527 PolarHBondContact O-N 3.49Å; I525-F528 PolarHBondContact O-N 3.43Å; I525-L529 HydrophobicContact CG2-CD1 3.7Å; I525-L529 HydrophobicContact CG2-CG 4.32Å; I525-L529 VanDerWaalsContact O-CG 3.3Å; I525-L529 WeakPolarHBondContact O-CG 3.44Å; I525-L529 PolarHBondContact O-N 3.48Å
526	L	92.8	Very high	89.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-42.2	175.5	-74.9	175.4	0	0	0	112	W316 W332 T333 L336 F522 H523 L529 Y530 I555 F556	W316-L526 HydrophobicContact CH2-CB 3.73Å; W316-L526 HydrophobicContact CZ2-CB 3.93Å; W316-L526 HydrophobicContact CZ2-CD1 4.45Å; W332-L526 HydrophobicContact CB-CD1 3.99Å; W332-L526 HydrophobicContact CB-CD2 4.01Å; T333-L526 VanDerWaalsContact OG1-CD1 3.31Å; T333-L526 WeakPolarHBondContact OG1-CD1 3.42Å; L336-L526 HydrophobicContact CB-CD2 4.06Å; L336-L526 HydrophobicContact CD2-CD2 3.91Å; L336-L526 HydrophobicContact CD2-CG 3.81Å; F522-L526 WeakPolarHBondContact O-CB 3.06Å; F522-L526 VanDerWaalsContact O-CG 3.3Å; F522-L526 WeakPolarHBondContact O-CG 3.23Å; F522-L526 PolarHBondContact O-N 2.98Å; H523-L526 PolarHBondContact O-N 2.7Å; L526-L529 PolarHBondContact O-N 2.74Å; L526-Y530 WeakPolarHBondContact O-CB 3.43Å; L526-Y530 PolarHBondContact O-N 3.07Å; L526-I555 HydrophobicContact CD2-CD1 3.7Å; L526-I555 HydrophobicContact CD2-CG1 4.43Å; L526-F556 HydrophobicContact CD2-CE1 3.98Å; L526-F556 HydrophobicContact CD2-CZ 3.97Å; L526-F556 WeakPolarHBondContact O-CZ 3.23Å
527	M	91	Very high	89.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61	-45.2	176.9	-74.4	174.3	169.2	0	0	111.2	V315 W316 I319 L505 L514 H523 T524 I525 Y530 V531	V315-M527 HydrophobicContact CB-CE 4.31Å; V315-M527 HydrophobicContact CG1-CE 3.78Å; V315-M527 HydrophobicContact CG1-SD 4.34Å; W316-M527 HydrophobicContact CB-CE 4.36Å; W316-M527 HydrophobicContact CD2-CE 3.49Å; W316-M527 VanDerWaalsContact CD2-CE 3.49Å; W316-M527 HydrophobicContact CD2-CG 4.25Å; W316-M527 HydrophobicContact CE3-CE 4.03Å; W316-M527 HydrophobicContact CE3-CG 4.06Å; W316-M527 HydrophobicContact CG-CE 3.63Å; W316-M527 HydrophobicContact CH2-CB 4.35Å; W316-M527 HydrophobicContact CH2-CG 3.53Å; W316-M527 HydrophobicContact CZ2-CE 4.2Å; W316-M527 HydrophobicContact CZ2-CG 3.74Å; W316-M527 HydrophobicContact CZ3-CG 3.7Å; I319-M527 HydrophobicContact CD1-CB 3.85Å; I319-M527 HydrophobicContact CD1-CE 4.06Å; I319-M527 HydrophobicContact CD1-CG 3.63Å; I319-M527 HydrophobicContact CD1-SD 3.55Å; I319-M527 VanDerWaalsContact CD1-SD 3.55Å; L505-M527 HydrophobicContact CD2-CB 3.7Å; L514-M527 HydrophobicContact CD1-CE 3.98Å; L514-M527 HydrophobicContact CD1-SD 3.88Å; L514-M527 HydrophobicContact CD2-CE 3.77Å; L514-M527 HydrophobicContact CG-CE 4.01Å; L514-M527 HydrophobicContact CG-SD 4.22Å; H523-M527 WeakPolarHBondContact O-CB 3.44Å; H523-M527 VanDerWaalsContact O-CG 3.23Å; H523-M527 WeakPolarHBondContact O-CG 3.48Å; H523-M527 PolarHBondContact O-N 2.7Å; T524-M527 PolarHBondContact O-N 3.43Å; I525-M527 PolarHBondContact O-N 3.49Å; M527-Y530 PolarHBondContact O-N 3.04Å; M527-V531 WeakPolarHBondContact O-CG2 3.43Å; M527-V531 PolarHBondContact O-N 3.07Å
528	F	92.1	Very high	89.1	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58.9	-49.8	175.4	-179.4	-96.2	0	0	0	111.7	F471 H475 F491 I493 L505 T524 I525 Y530 V531 I532	F471-F528 AromaticContact CE2-CE1 3.64Å; F471-F528 HydrophobicContact CE2-CE1 3.64Å; F471-F528 AromaticContact CE2-CZ 3.59Å; F471-F528 HydrophobicContact CE2-CZ 3.59Å; F471-F528 AromaticContact CZ-CE1 3.82Å; F471-F528 HydrophobicContact CZ-CE1 3.82Å; F471-F528 AromaticContact CZ-CZ 3.88Å; F471-F528 HydrophobicContact CZ-CZ 3.88Å; H475-F528 HydrophobicContact CB-CE2 4.13Å; H475-F528 HydrophobicContact CB-CZ 3.93Å; F491-F528 AromaticContact CD1-CE2 3.86Å; F491-F528 HydrophobicContact CD1-CE2 3.86Å; F491-F528 HydrophobicContact CD1-CZ 4.43Å; F491-F528 HydrophobicContact CD2-CD2 4.21Å; F491-F528 HydrophobicContact CD2-CE2 4.22Å; F491-F528 AromaticContact CE1-CD2 3.86Å; F491-F528 HydrophobicContact CE1-CD2 3.86Å; F491-F528 AromaticContact CE1-CE2 3.38Å; F491-F528 HydrophobicContact CE1-CE2 3.38Å; F491-F528 AromaticContact CE1-CZ 3.8Å; F491-F528 HydrophobicContact CE1-CZ 3.8Å; F491-F528 AromaticContact CE2-CD2 3.51Å; F491-F528 HydrophobicContact CE2-CD2 3.51Å; F491-F528 AromaticContact CE2-CE2 3.81Å; F491-F528 HydrophobicContact CE2-CE2 3.81Å; F491-F528 HydrophobicContact CE2-CG 4.36Å; F491-F528 HydrophobicContact CG-CE2 4.26Å; F491-F528 AromaticContact CZ-CD2 3.3Å; F491-F528 HydrophobicContact CZ-CD2 3.3Å; F491-F528 AromaticContact CZ-CE2 3.36Å; F491-F528 HydrophobicContact CZ-CE2 3.36Å; F491-F528 AromaticContact CZ-CG 3.94Å; F491-F528 HydrophobicContact CZ-CG 3.94Å; F491-F528 HydrophobicContact CZ-CZ 4.05Å; I493-F528 HydrophobicContact CD1-CB 3.92Å; I493-F528 HydrophobicContact CD1-CD1 4.38Å; I493-F528 HydrophobicContact CD1-CD2 4.2Å; I493-F528 HydrophobicContact CD1-CG 3.92Å; I493-F528 HydrophobicContact CG1-CB 4.21Å; I493-F528 HydrophobicContact CG1-CD2 3.98Å; I493-F528 HydrophobicContact CG1-CG 4.18Å; L505-F528 HydrophobicContact CD1-CB 4.15Å; L505-F528 HydrophobicContact CD1-CD2 3.85Å; T524-F528 PolarHBondContact O-N 3.06Å; T524-F528 VanDerWaalsContact O-N 3.08Å; I525-F528 PolarHBondContact O-N 3.43Å; F528-Y530 VanDerWaalsContact C-N 3.33Å; F528-Y530 PolarHBondContact O-N 3.4Å; F528-V531 PolarHBondContact O-N 2.94Å; F528-I532 HydrophobicContact CD1-CD1 3.82Å; F528-I532 HydrophobicContact CE1-CD1 3.4Å; F528-I532 HydrophobicContact CZ-CD1 3.84Å; F528-I532 PolarHBondContact O-N 3.22Å; F528-I532 VanDerWaalsContact O-N 3.13Å
529	L	91.5	Very high	89.1	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-67.5	-31.4	178.6	-64.6	167.6	0	0	0	112.9	L336 I525 L526 I532 K533 L545 I552 L553 I555 F556	L336-L529 HydrophobicContact CD1-CD1 4.26Å; I525-L529 HydrophobicContact CG2-CD1 3.7Å; I525-L529 HydrophobicContact CG2-CG 4.32Å; I525-L529 VanDerWaalsContact O-CG 3.3Å; I525-L529 WeakPolarHBondContact O-CG 3.44Å; I525-L529 PolarHBondContact O-N 3.48Å; L526-L529 PolarHBondContact O-N 2.74Å; L529-I532 PolarHBondContact O-N 3.43Å; L529-K533 PolarHBondContact O-N 2.61Å; L529-L545 HydrophobicContact CD2-CD1 3.97Å; L529-I552 HydrophobicContact CD1-CD1 3.45Å; L529-I552 VanDerWaalsContact CD1-CD1 3.45Å; L529-I552 HydrophobicContact CD1-CG1 4.03Å; L529-I552 HydrophobicContact CD2-CD1 4.02Å; L529-I552 HydrophobicContact CD2-CG2 4.17Å; L529-I552 HydrophobicContact CG-CD1 4.4Å; L529-L553 HydrophobicContact CB-CD2 4.33Å; L529-I555 HydrophobicContact CD1-CD1 4.04Å; L529-F556 HydrophobicContact CB-CE2 3.76Å; L529-F556 HydrophobicContact CB-CZ 3.87Å
530	Y	90	Very high	88.8	Confident	42 Å²	42	29 Å²	29	17%	0.165	15%	0.151	C	C	.	.	H	α-helix	trans	-70	-41	176.6	-175.2	-90.7	0	0	0	111.8	I319 T320 W332 L526 M527 F528 I532 K533 T534 F556	I319-Y530 HydrophobicContact CG2-CD1 3.94Å; I319-Y530 HydrophobicContact CG2-CE1 4.48Å; T320-Y530 HydrophobicContact CG2-CE1 4Å; T320-Y530 HydrophobicContact CG2-CE2 4.36Å; T320-Y530 VanDerWaalsContact CG2-OH 3.31Å; T320-Y530 WeakPolarHBondContact CG2-OH 3.49Å; T320-Y530 WeakPolarHBondContact OG1-CE1 3.48Å; W332-Y530 HydrophobicContact CH2-CD2 4.46Å; W332-Y530 HydrophobicContact CH2-CE2 4.21Å; W332-Y530 HydrophobicContact CZ3-CD2 4.32Å; W332-Y530 HydrophobicContact CZ3-CE2 4.44Å; L526-Y530 WeakPolarHBondContact O-CB 3.43Å; L526-Y530 PolarHBondContact O-N 3.07Å; M527-Y530 PolarHBondContact O-N 3.04Å; F528-Y530 VanDerWaalsContact C-N 3.33Å; F528-Y530 PolarHBondContact O-N 3.4Å; Y530-I532 VanDerWaalsContact C-N 3.34Å; Y530-K533 PolarHBondContact O-N 3.18Å; Y530-T534 HydrophobicContact CD1-CG2 4.25Å; Y530-T534 HydrophobicContact CD2-CG2 4.49Å; Y530-T534 HydrophobicContact CE1-CG2 3.74Å; Y530-T534 HydrophobicContact CE2-CG2 4.01Å; Y530-T534 WeakPolarHBondContact O-CB 3.18Å; Y530-T534 WeakPolarHBondContact O-CG2 3.5Å; Y530-T534 PolarHBondContact O-N 3.31Å; Y530-T534 PolarHBondContact O-OG1 3.33Å; Y530-F556 HydrophobicContact CD2-CD1 4.03Å; Y530-F556 AromaticContact CD2-CE1 3.95Å; Y530-F556 HydrophobicContact CD2-CE1 3.95Å; Y530-F556 HydrophobicContact CG-CE1 4.48Å
531	V	88.9	Confident	88.2	Confident	5 Å²	5	32.2 Å²	32.2	3%	0.03	19%	0.185	C	C	.	.	H	α-helix	trans	-59.5	-46	171.2	169.9	0	0	0	0	110	I319 F491 L505 Y507 M527 F528 K533 T534 K535	I319-V531 HydrophobicContact CG2-CG2 4.11Å; F491-V531 HydrophobicContact CD2-CG1 4.43Å; F491-V531 HydrophobicContact CE2-CB 3.98Å; F491-V531 HydrophobicContact CE2-CG1 3.67Å; F491-V531 HydrophobicContact CZ-CB 4Å; F491-V531 HydrophobicContact CZ-CG1 3.76Å; L505-V531 HydrophobicContact CD2-CG2 4.48Å; Y507-V531 HydrophobicContact CD2-CG1 3.87Å; Y507-V531 HydrophobicContact CE1-CG1 4.39Å; Y507-V531 HydrophobicContact CE2-CG1 3.54Å; Y507-V531 HydrophobicContact CG-CG1 4.41Å; M527-V531 WeakPolarHBondContact O-CG2 3.43Å; M527-V531 PolarHBondContact O-N 3.07Å; F528-V531 PolarHBondContact O-N 2.94Å; V531-K533 PolarHBondContact O-N 2.93Å; V531-T534 PolarHBondContact O-N 2.86Å; V531-K535 HydrophobicContact CG1-CB 4.4Å; V531-K535 HydrophobicContact CG1-CG 4.17Å; V531-K535 VanDerWaalsContact O-CB 3.3Å; V531-K535 WeakPolarHBondContact O-CB 3.43Å; V531-K535 PolarHBondContact O-N 3.47Å
532	I	88.7	Confident	87.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.1	-45.2	175.2	-67.5	163.5	0	0	0	111.6	F491 F528 L529 Y530 T534 E536 S537 G538 M539 L540 L545	F491-I532 HydrophobicContact CE1-CD1 3.98Å; F491-I532 HydrophobicContact CE1-CG1 3.66Å; F491-I532 HydrophobicContact CZ-CD1 4.23Å; F491-I532 HydrophobicContact CZ-CG1 3.85Å; F528-I532 HydrophobicContact CD1-CD1 3.82Å; F528-I532 HydrophobicContact CE1-CD1 3.4Å; F528-I532 HydrophobicContact CZ-CD1 3.84Å; F528-I532 PolarHBondContact O-N 3.22Å; F528-I532 VanDerWaalsContact O-N 3.13Å; L529-I532 PolarHBondContact O-N 3.43Å; Y530-I532 VanDerWaalsContact C-N 3.34Å; I532-T534 VanDerWaalsContact C-N 3.3Å; I532-T534 PolarHBondContact O-N 3.12Å; I532-E536 HydrophobicContact CG2-CB 4.41Å; I532-E536 CarbonylContact O-C 3.53Å; I532-E536 PolarHBondContact O-N 2.65Å; I532-S537 PolarHBondContact O-N 3.49Å; I532-G538 WeakPolarHBondContact O-CA 3.34Å; I532-G538 PolarHBondContact O-N 3Å; I532-M539 WeakPolarHBondContact CG2-O 3.46Å; I532-L540 HydrophobicContact CD1-CD1 3.97Å; I532-L540 HydrophobicContact CD1-CD2 4.43Å; I532-L545 HydrophobicContact CD1-CD1 3.91Å; I532-L545 HydrophobicContact CG2-CD1 3.92Å; I532-L545 HydrophobicContact CG2-CG 4.47Å
533	K	88.3	Confident	87.2	Confident	61 Å²	61	44 Å²	44	27%	0.265	23%	0.232	S	C	.	.	H	α-helix	trans	-62.9	-33.5	178.9	-166.3	167.7	-168.1	170.1	0	113.1	L529 Y530 V531 L553 F556 E557	L529-K533 PolarHBondContact O-N 2.61Å; Y530-K533 PolarHBondContact O-N 3.18Å; V531-K533 PolarHBondContact O-N 2.93Å; K533-L553 HydrophobicContact CB-CD1 4.17Å; K533-L553 HydrophobicContact CB-CD2 4.13Å; K533-L553 HydrophobicContact CD-CB 4.16Å; K533-L553 HydrophobicContact CG-CD1 4.22Å; K533-L553 PolarHBondContact NZ-O 2.97Å; K533-F556 HydrophobicContact CD-CB 3.91Å; K533-F556 HydrophobicContact CD-CD2 3.83Å; K533-F556 HydrophobicContact CD-CG 4.18Å; K533-E557 IonicContact NZ-OE1 2.87Å; K533-E557 PolarHBondContact NZ-OE1 3.22Å
534	T	86.1	Confident	86.9	Confident	67 Å²	67	45.9 Å²	45.9	41%	0.411	24%	0.242	S	C	.	.	H	α-helix	trans	-106.2	-17.9	-169.8	57.7	0	0	0	0	115.7	Y530 V531 I532	Y530-T534 HydrophobicContact CD1-CG2 4.25Å; Y530-T534 HydrophobicContact CD2-CG2 4.49Å; Y530-T534 HydrophobicContact CE1-CG2 3.74Å; Y530-T534 HydrophobicContact CE2-CG2 4.01Å; Y530-T534 WeakPolarHBondContact O-CB 3.18Å; Y530-T534 WeakPolarHBondContact O-CG2 3.5Å; Y530-T534 PolarHBondContact O-N 3.31Å; Y530-T534 PolarHBondContact O-OG1 3.33Å; V531-T534 PolarHBondContact O-N 2.86Å; I532-T534 VanDerWaalsContact C-N 3.3Å; I532-T534 PolarHBondContact O-N 3.12Å
535	K	84.1	Confident	86.7	Confident	120 Å²	120	45.9 Å²	45.9	52%	0.522	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-52.1	-179.4	-55.4	-64.2	-176.2	176.9	0	111.2	Y507 V531 S537	Y507-K535 WeakPolarHBondContact OH-CG 3.36Å; V531-K535 HydrophobicContact CG1-CB 4.4Å; V531-K535 HydrophobicContact CG1-CG 4.17Å; V531-K535 VanDerWaalsContact O-CB 3.3Å; V531-K535 WeakPolarHBondContact O-CB 3.43Å; V531-K535 PolarHBondContact O-N 3.47Å; K535-S537 PolarHBondContact O-N 2.99Å
536	E	81.9	Confident	86.3	Confident	97 Å²	97	46.3 Å²	46.3	45%	0.453	25%	0.248	S	C	.	.	S	Bend	trans	-85.4	15.3	-179.8	-51	-51.8	133.6	0	0	113.4	I532 G538 M539	I532-E536 HydrophobicContact CG2-CB 4.41Å; I532-E536 CarbonylContact O-C 3.53Å; I532-E536 PolarHBondContact O-N 2.65Å; E536-G538 PolarHBondContact O-N 3.22Å; E536-M539 VanDerWaalsContact CB-O 3.24Å; E536-M539 WeakPolarHBondContact CB-O 3.35Å; E536-M539 WeakPolarHBondContact O-CB 3.43Å; E536-M539 PolarHBondContact O-N 2.93Å
537	S	82.7	Confident	85.6	Confident	108 Å²	108	52.6 Å²	52.6	76%	0.755	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	26.1	-177.9	-56.3	0	0	0	0	114.9	I532 K535	I532-S537 PolarHBondContact O-N 3.49Å; K535-S537 PolarHBondContact O-N 2.99Å
538	G	82.8	Confident	84.9	Confident	3 Å²	3	57.9 Å²	57.9	3%	0.031	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	6.5	-176.8	0	0	0	0	0	115.7	I532 E536 L545	I532-G538 WeakPolarHBondContact O-CA 3.34Å; I532-G538 PolarHBondContact O-N 3Å; E536-G538 PolarHBondContact O-N 3.22Å; G538-L545 PolarHBondContact O-N 2.98Å
539	M	84.8	Confident	84.5	Confident	65 Å²	65	60.1 Å²	60.1	32%	0.32	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	141.3	177.9	-62.5	-64.8	-65.4	0	0	111.7	I532 E536 V543 N544	I532-M539 WeakPolarHBondContact CG2-O 3.46Å; E536-M539 VanDerWaalsContact CB-O 3.24Å; E536-M539 WeakPolarHBondContact CB-O 3.35Å; E536-M539 WeakPolarHBondContact O-CB 3.43Å; E536-M539 PolarHBondContact O-N 2.93Å; M539-V543 CarbonylContact C-O 3.6Å; M539-V543 WeakPolarHBondContact CA-O 3.45Å; M539-N544 HydrophobicContact SD-CB 3.71Å
540	L	83.2	Confident	84.2	Confident	9 Å²	9	60.7 Å²	60.7	5%	0.047	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	98.1	167.2	-173.4	57.9	0	0	0	108.1	L459 F471 I532 R542 V543 L545	L459-L540 HydrophobicContact CD1-CD2 4.42Å; L459-L540 HydrophobicContact CD2-CD2 4.32Å; L459-L540 HydrophobicContact CD2-CG 4.27Å; F471-L540 HydrophobicContact CD2-CD2 3.91Å; F471-L540 HydrophobicContact CE2-CD2 3.98Å; I532-L540 HydrophobicContact CD1-CD1 3.97Å; I532-L540 HydrophobicContact CD1-CD2 4.43Å; L540-R542 PolarHBondContact O-N 3.25Å; L540-V543 PolarHBondContact N-O 3.38Å; L540-V543 PolarHBondContact O-N 3.36Å; L540-L545 HydrophobicContact CB-CD1 4.14Å; L540-L545 HydrophobicContact CB-CD2 4.28Å; L540-L545 HydrophobicContact CB-CG 4.1Å; L540-L545 HydrophobicContact CD2-CD1 4.27Å
541	G	79	Confident	84.1	Confident	74 Å²	74	61.5 Å²	61.5	76%	0.763	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	-104.5	-169.3	0	0	0	0	0	111.6
542	R	79.5	Confident	84.1	Confident	227 Å²	227	61.2 Å²	61.2	86%	0.857	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-0.8	178	-65.4	-175.3	-179.7	178.3	0.4	114.1	L540	L540-R542 PolarHBondContact O-N 3.25Å
543	V	84.9	Confident	84.1	Confident	25 Å²	25	61.5 Å²	61.5	15%	0.152	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	134.4	-173.6	180	0	0	0	0	110.8	L459 M539 L540 V550	L459-V543 HydrophobicContact CD2-CB 3.84Å; L459-V543 HydrophobicContact CD2-CG2 3.72Å; M539-V543 CarbonylContact C-O 3.6Å; M539-V543 WeakPolarHBondContact CA-O 3.45Å; L540-V543 PolarHBondContact N-O 3.38Å; L540-V543 PolarHBondContact O-N 3.36Å; V543-V550 HydrophobicContact CG1-CG2 3.82Å
544	N	87.1	Confident	84.1	Confident	56 Å²	56	62.7 Å²	62.7	30%	0.299	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	129	174.9	-165	-45.4	0	0	0	110	M539 G546 G549 V550	M539-N544 HydrophobicContact SD-CB 3.71Å; N544-G546 WeakPolarHBondContact OD1-CA 3.41Å; N544-G546 PolarHBondContact OD1-N 3.45Å; N544-G549 WeakPolarHBondContact O-CA 3.48Å; N544-V550 PolarHBondContact O-N 3.23Å
545	L	87.6	Confident	84.3	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	33%	0.334	C	S	.	.			trans	-91	-7	177.4	-61.6	-167.5	0	0	0	113.5	L529 I532 G538 L540 V550 N551 I552 L553	L529-L545 HydrophobicContact CD2-CD1 3.97Å; I532-L545 HydrophobicContact CD1-CD1 3.91Å; I532-L545 HydrophobicContact CG2-CD1 3.92Å; I532-L545 HydrophobicContact CG2-CG 4.47Å; G538-L545 PolarHBondContact O-N 2.98Å; L540-L545 HydrophobicContact CB-CD1 4.14Å; L540-L545 HydrophobicContact CB-CD2 4.28Å; L540-L545 HydrophobicContact CB-CG 4.1Å; L540-L545 HydrophobicContact CD2-CD1 4.27Å; L545-V550 HydrophobicContact CD2-CB 3.79Å; L545-V550 HydrophobicContact CD2-CG1 4.33Å; L545-V550 HydrophobicContact CD2-CG2 3.64Å; L545-N551 PolarHBondContact O-N 2.95Å; L545-I552 HydrophobicContact CB-CG2 3.84Å; L545-I552 HydrophobicContact CD1-CG2 4.39Å; L545-I552 WeakPolarHBondContact O-CG2 3.48Å; L545-I552 PolarHBondContact O-N 2.91Å; L545-L553 HydrophobicContact CB-CD1 3.83Å; L545-L553 HydrophobicContact CB-CD2 4.23Å; L545-L553 HydrophobicContact CB-CG 3.71Å; L545-L553 PolarHBondContact O-N 3.38Å; L545-L553 VanDerWaalsContact O-N 3.09Å
546	G	84.5	Confident	84.5	Confident	12 Å²	12	54.7 Å²	54.7	12%	0.124	31%	0.313	C	S	.	.	S	Bend	trans	-82.9	-161.8	171.8	0	0	0	0	0	113.7	N544 S548 G549 N551	N544-G546 WeakPolarHBondContact OD1-CA 3.41Å; N544-G546 PolarHBondContact OD1-N 3.45Å; G546-S548 PolarHBondContact O-N 3.3Å; G546-S548 VanDerWaalsContact O-N 3.1Å; G546-G549 PolarHBondContact O-N 3.45Å; G546-G549 VanDerWaalsContact O-N 3.11Å; G546-N551 VanDerWaalsContact O-CA 3.26Å; G546-N551 WeakPolarHBondContact O-CA 3.45Å; G546-N551 PolarHBondContact O-N 2.89Å
547	L	79.2	Confident	84.5	Confident	132 Å²	132	54.6 Å²	54.6	69%	0.691	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-34.3	-171.7	-66.3	166.2	0	0	0	114.3	G549	L547-G549 VanDerWaalsContact C-N 3.27Å; L547-G549 PolarHBondContact O-N 3.17Å
548	S	76.7	Confident	83.5	Confident	111 Å²	111	56.7 Å²	56.7	78%	0.776	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	9.2	-176.5	-46.2	0	0	0	0	114.8	G546	G546-S548 PolarHBondContact O-N 3.3Å; G546-S548 VanDerWaalsContact O-N 3.1Å
549	G	83.1	Confident	83.5	Confident	46 Å²	46	59.4 Å²	59.4	47%	0.474	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.4	-114.8	-176.6	0	0	0	0	0	112.8	N544 G546 L547 N551	N544-G549 WeakPolarHBondContact O-CA 3.48Å; G546-G549 PolarHBondContact O-N 3.45Å; G546-G549 VanDerWaalsContact O-N 3.11Å; L547-G549 VanDerWaalsContact C-N 3.27Å; L547-G549 PolarHBondContact O-N 3.17Å; G549-N551 PolarHBondContact O-N 3.33Å
550	V	84.6	Confident	83.4	Confident	13 Å²	13	59.1 Å²	59.1	8%	0.079	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-19	-174.4	-178.3	0	0	0	0	112.8	W339 Y454 L455 R458 V543 N544 L545 I552	W339-V550 HydrophobicContact CH2-CG1 4.45Å; W339-V550 HydrophobicContact CZ2-CG1 4.04Å; Y454-V550 HydrophobicContact CE1-CG1 3.94Å; L455-V550 HydrophobicContact CD2-CG1 4.31Å; R458-V550 HydrophobicContact CB-CG2 3.95Å; R458-V550 HydrophobicContact CG-CG2 4.23Å; V543-V550 HydrophobicContact CG1-CG2 3.82Å; N544-V550 PolarHBondContact O-N 3.23Å; L545-V550 HydrophobicContact CD2-CB 3.79Å; L545-V550 HydrophobicContact CD2-CG1 4.33Å; L545-V550 HydrophobicContact CD2-CG2 3.64Å; V550-I552 HydrophobicContact CG1-CG2 4.28Å; V550-I552 PolarHBondContact O-N 3.32Å
551	N	88	Confident	83.5	Confident	59 Å²	59	61.9 Å²	61.9	32%	0.316	35%	0.346	S	S	.	.			trans	47.3	57.6	178.7	-163.6	25.5	0	0	0	113.9	W339 L545 G546 G549 W554	W339-N551 PolarHBondContact NE1-O 2.91Å; L545-N551 PolarHBondContact O-N 2.95Å; G546-N551 VanDerWaalsContact O-CA 3.26Å; G546-N551 WeakPolarHBondContact O-CA 3.45Å; G546-N551 PolarHBondContact O-N 2.89Å; G549-N551 PolarHBondContact O-N 3.33Å; N551-W554 PolarHBondContact O-NE1 3Å; N551-W554 VanDerWaalsContact OD1-CD1 3.26Å
552	I	89.2	Confident	83.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.322	C	S	.	.			trans	-110.4	-26.9	171.8	-172.2	172.1	0	0	0	111.8	L336 W339 F451 L529 L545 V550 W554 I555	L336-I552 HydrophobicContact CD1-CD1 4.21Å; W339-I552 HydrophobicContact CD2-CB 4.26Å; W339-I552 HydrophobicContact CD2-CD1 3.93Å; W339-I552 HydrophobicContact CD2-CG1 3.79Å; W339-I552 HydrophobicContact CE3-CD1 3.63Å; W339-I552 HydrophobicContact CE3-CG1 4.03Å; W339-I552 HydrophobicContact CG-CG1 4.31Å; W339-I552 HydrophobicContact CH2-CB 4.37Å; W339-I552 HydrophobicContact CH2-CD1 3.72Å; W339-I552 HydrophobicContact CH2-CG1 4.32Å; W339-I552 HydrophobicContact CZ2-CB 3.78Å; W339-I552 HydrophobicContact CZ2-CD1 3.98Å; W339-I552 HydrophobicContact CZ2-CG1 4.07Å; W339-I552 HydrophobicContact CZ3-CD1 3.52Å; W339-I552 HydrophobicContact CZ3-CG1 4.29Å; F451-I552 HydrophobicContact CE2-CD1 4.06Å; L529-I552 HydrophobicContact CD1-CD1 3.45Å; L529-I552 VanDerWaalsContact CD1-CD1 3.45Å; L529-I552 HydrophobicContact CD1-CG1 4.03Å; L529-I552 HydrophobicContact CD2-CD1 4.02Å; L529-I552 HydrophobicContact CD2-CG2 4.17Å; L529-I552 HydrophobicContact CG-CD1 4.4Å; L545-I552 HydrophobicContact CB-CG2 3.84Å; L545-I552 HydrophobicContact CD1-CG2 4.39Å; L545-I552 WeakPolarHBondContact O-CG2 3.48Å; L545-I552 PolarHBondContact O-N 2.91Å; V550-I552 HydrophobicContact CG1-CG2 4.28Å; V550-I552 PolarHBondContact O-N 3.32Å; I552-W554 PolarHBondContact O-N 3.25Å; I552-W554 VanDerWaalsContact O-N 3.12Å; I552-I555 HydrophobicContact CG1-CD1 4.17Å; I552-I555 VanDerWaalsContact O-CG1 3.27Å; I552-I555 WeakPolarHBondContact O-CG1 3.43Å; I552-I555 WeakPolarHBondContact O-CG2 3.47Å; I552-I555 PolarHBondContact O-N 2.75Å
553	L	88.8	Confident	84	Confident	6 Å²	6	50.8 Å²	50.8	3%	0.031	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-70.6	-9.8	-174	-62.9	-175.9	0	0	0	115.3	L529 K533 L545 I555 F556	L529-L553 HydrophobicContact CB-CD2 4.33Å; K533-L553 HydrophobicContact CB-CD1 4.17Å; K533-L553 HydrophobicContact CB-CD2 4.13Å; K533-L553 HydrophobicContact CD-CB 4.16Å; K533-L553 HydrophobicContact CG-CD1 4.22Å; K533-L553 PolarHBondContact NZ-O 2.97Å; L545-L553 HydrophobicContact CB-CD1 3.83Å; L545-L553 HydrophobicContact CB-CD2 4.23Å; L545-L553 HydrophobicContact CB-CG 3.71Å; L545-L553 PolarHBondContact O-N 3.38Å; L545-L553 VanDerWaalsContact O-N 3.09Å; L553-I555 PolarHBondContact O-N 3.36Å; L553-F556 HydrophobicContact CD2-CD2 4.35Å; L553-F556 HydrophobicContact CD2-CE2 4.12Å; L553-F556 PolarHBondContact O-N 3.06Å
554	W	88.8	Confident	83.9	Confident	85 Å²	85	52.5 Å²	52.5	32%	0.322	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-64.5	-18.9	171.8	70.6	-91	0	0	0	112.9	K335 W339 N551 I552 F556 E557	K335-W554 HydrophobicContact CB-CZ3 4.41Å; K335-W554 HydrophobicContact CD-CZ3 4.2Å; K335-W554 HydrophobicContact CG-CZ3 4.3Å; W339-W554 HydrophobicContact CB-CZ2 4.33Å; W339-W554 AromaticContact CD1-NE1 3.54Å; N551-W554 PolarHBondContact O-NE1 3Å; N551-W554 VanDerWaalsContact OD1-CD1 3.26Å; I552-W554 PolarHBondContact O-N 3.25Å; I552-W554 VanDerWaalsContact O-N 3.12Å; W554-F556 PolarHBondContact O-N 3.12Å; W554-E557 WeakPolarHBondContact O-CB 3.17Å; W554-E557 PolarHBondContact O-N 3.08Å
555	I	90.5	Very high	83.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-58.9	-21.9	175.8	68.2	-172.4	0	0	0	112.8	K335 L336 W339 L526 L529 I552 L553	K335-I555 HydrophobicContact CB-CB 3.88Å; K335-I555 HydrophobicContact CB-CG2 3.94Å; K335-I555 WeakPolarHBondContact CD-O 3.41Å; L336-I555 HydrophobicContact CB-CD1 4.21Å; L336-I555 HydrophobicContact CD1-CD1 4.11Å; W339-I555 HydrophobicContact CB-CG2 4.37Å; L526-I555 HydrophobicContact CD2-CD1 3.7Å; L526-I555 HydrophobicContact CD2-CG1 4.43Å; L529-I555 HydrophobicContact CD1-CD1 4.04Å; I552-I555 HydrophobicContact CG1-CD1 4.17Å; I552-I555 VanDerWaalsContact O-CG1 3.27Å; I552-I555 WeakPolarHBondContact O-CG1 3.43Å; I552-I555 WeakPolarHBondContact O-CG2 3.47Å; I552-I555 PolarHBondContact O-N 2.75Å; L553-I555 PolarHBondContact O-N 3.36Å
556	F	87.3	Confident	83.4	Confident	19 Å²	19	56.2 Å²	56.2	8%	0.083	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-94.6	-3.7	176.5	-57.4	-75.4	0	0	0	114.2	W332 L526 L529 Y530 K533 L553 W554	W332-F556 AromaticContact CD2-CD1 3.66Å; W332-F556 HydrophobicContact CD2-CD1 3.66Å; W332-F556 HydrophobicContact CD2-CE1 4.2Å; W332-F556 AromaticContact CE2-CD1 3.94Å; W332-F556 AromaticContact CE3-CD1 3.72Å; W332-F556 HydrophobicContact CE3-CD1 3.72Å; W332-F556 AromaticContact CE3-CE1 3.91Å; W332-F556 HydrophobicContact CE3-CE1 3.91Å; W332-F556 HydrophobicContact CG-CD1 4.1Å; W332-F556 HydrophobicContact CH2-CD1 4.29Å; W332-F556 HydrophobicContact CZ2-CD1 4.25Å; W332-F556 HydrophobicContact CZ3-CD1 4.05Å; W332-F556 HydrophobicContact CZ3-CE1 4.33Å; L526-F556 HydrophobicContact CD2-CE1 3.98Å; L526-F556 HydrophobicContact CD2-CZ 3.97Å; L526-F556 WeakPolarHBondContact O-CZ 3.23Å; L529-F556 HydrophobicContact CB-CE2 3.76Å; L529-F556 HydrophobicContact CB-CZ 3.87Å; Y530-F556 HydrophobicContact CD2-CD1 4.03Å; Y530-F556 AromaticContact CD2-CE1 3.95Å; Y530-F556 HydrophobicContact CD2-CE1 3.95Å; Y530-F556 HydrophobicContact CG-CE1 4.48Å; K533-F556 HydrophobicContact CD-CB 3.91Å; K533-F556 HydrophobicContact CD-CD2 3.83Å; K533-F556 HydrophobicContact CD-CG 4.18Å; L553-F556 HydrophobicContact CD2-CD2 4.35Å; L553-F556 HydrophobicContact CD2-CE2 4.12Å; L553-F556 PolarHBondContact O-N 3.06Å; W554-F556 PolarHBondContact O-N 3.12Å
557	E	82.9	Confident	83.3	Confident	96 Å²	96	59.9 Å²	59.9	45%	0.449	34%	0.336	S	S	.	.			trans	-77.6	153.6	164.4	-77.1	126.8	-123.6	0	0	109.4	K335 K533 W554	K335-E557 PolarHBondContact NZ-O 3.29Å; K533-E557 IonicContact NZ-OE1 2.87Å; K533-E557 PolarHBondContact NZ-OE1 3.22Å; W554-E557 WeakPolarHBondContact O-CB 3.17Å; W554-E557 PolarHBondContact O-N 3.08Å
558	N	60.5	Low	83.7	Confident	152 Å²	152	53.4 Å²	53.4	81%	0.813	30%	0.304	S	S	*	.			trans	-88.9	0	-170.5	-89.5	-10	0	0	0	112.8	H328 K335	H328-N558 PolarHBondContact CE1-ND2 3.39Å; H328-N558 PolarHBondContact NE2-ND2 2.53Å; K335-N558 PolarHBondContact NZ-OXT 3.16Å

Retrieved 558 of 558 residues in 463.7 ms (Link to these results)

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