A0A087X659_POEFO Loading...

N-terminal EF-hand calcium binding protein 2

AlphaFold DB , UniProt , Accession A0A087X659, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 431 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	39.7	Very low	41.5	Very low	212 Å²	212	111.2 Å²	111.2	100%	1.044	57%	0.568	S	S	*	*				0	-49.9	0	-75.6	-62.7	-109.7	0	0	114.3	E3 Q4	M1-E3 VanDerWaalsContact C-N 3.28Å; M1-E3 PolarHBondContact O-N 3.49Å; M1-Q4 PolarHBondContact O-N 2.77Å
2	C	38.9	Very low	42.3	Very low	111 Å²	111	104.5 Å²	104.5	75%	0.75	55%	0.547	S	S	*	.	H	α-helix	trans	-49.5	-36.5	-170	-58.2	0	0	0	0	116.3	Q4 A5 A6	C2-Q4 VanDerWaalsContact C-N 3.31Å; C2-Q4 PolarHBondContact O-N 2.85Å; C2-A5 PolarHBondContact O-N 3.47Å; C2-A6 WeakPolarHBondContact O-CB 3.4Å; C2-A6 PolarHBondContact O-N 3.24Å
3	E	38.1	Very low	43.1	Very low	113 Å²	113	102.8 Å²	102.8	53%	0.528	54%	0.544	S	S	.	.	H	α-helix	trans	-61.8	-36.1	-179.8	-127.8	-125.5	111.1	0	0	113.1	M1 A6 R7	M1-E3 VanDerWaalsContact C-N 3.28Å; M1-E3 PolarHBondContact O-N 3.49Å; E3-A6 PolarHBondContact O-N 3.49Å; E3-R7 VanDerWaalsContact O-CG 3.26Å; E3-R7 WeakPolarHBondContact O-CG 3.35Å; E3-R7 PolarHBondContact O-N 3.3Å; E3-R7 IonicContact OE1-CZ 3.19Å; E3-R7 IonicContact OE1-NE 2.8Å; E3-R7 PolarHBondContact OE1-NE 3.02Å; E3-R7 IonicContact OE1-NH2 2.69Å; E3-R7 PolarHBondContact OE1-NH2 2.76Å; E3-R7 IonicContact OE2-CZ 3.58Å; E3-R7 IonicContact OE2-NE 3.84Å; E3-R7 IonicContact OE2-NH2 2.79Å; E3-R7 PolarHBondContact OE2-NH2 3.33Å
4	Q	34.8	Very low	44.1	Very low	93 Å²	93	103.7 Å²	103.7	44%	0.435	54%	0.543	S	S	.	.	H	α-helix	trans	-74.2	-36.5	179.6	-166.8	64.8	10.8	0	0	111.6	M1 C2 R7 Y8	M1-Q4 PolarHBondContact O-N 2.77Å; C2-Q4 VanDerWaalsContact C-N 3.31Å; C2-Q4 PolarHBondContact O-N 2.85Å; Q4-R7 PolarHBondContact O-N 2.67Å; Q4-Y8 HydrophobicContact CG-CD2 4.18Å; Q4-Y8 HydrophobicContact CG-CE2 4Å; Q4-Y8 WeakPolarHBondContact O-CD2 3.17Å; Q4-Y8 PolarHBondContact O-N 3.49Å
5	A	36.8	Very low	45.1	Very low	57 Å²	57	105.8 Å²	105.8	47%	0.471	55%	0.546	S	S	.	.	H	α-helix	trans	-62.8	-44.5	169.6	0	0	0	0	0	111	C2 R7 Y8 C9	C2-A5 PolarHBondContact O-N 3.47Å; A5-R7 PolarHBondContact O-N 3.01Å; A5-Y8 PolarHBondContact O-N 3.03Å; A5-C9 WeakPolarHBondContact O-CB 3.08Å; A5-C9 PolarHBondContact O-N 2.69Å; A5-C9 PolarHBondContact O-SG 3.14Å; A5-C9 VanDerWaalsContact O-SG 3.39Å
6	A	41.8	Very low	45.3	Very low	44 Å²	44	106.3 Å²	106.3	36%	0.364	55%	0.549	S	S	.	.	H	α-helix	trans	-65.3	-22.5	175.5	0	0	0	0	0	113.7	C2 E3 R10	C2-A6 WeakPolarHBondContact O-CB 3.4Å; C2-A6 PolarHBondContact O-N 3.24Å; E3-A6 PolarHBondContact O-N 3.49Å; A6-R10 WeakPolarHBondContact O-CG 3.21Å; A6-R10 PolarHBondContact O-N 3.18Å; A6-R10 PolarHBondContact O-NE 2.81Å
7	R	43.5	Very low	45.7	Very low	121 Å²	121	105.3 Å²	105.3	46%	0.457	54%	0.544	S	S	.	.	H	α-helix	trans	-76.9	-50.2	169.5	-71.9	166.2	-172.3	-161.7	3.9	110.8	E3 Q4 A5 C9 R10 D11	E3-R7 VanDerWaalsContact O-CG 3.26Å; E3-R7 WeakPolarHBondContact O-CG 3.35Å; E3-R7 PolarHBondContact O-N 3.3Å; E3-R7 IonicContact OE1-CZ 3.19Å; E3-R7 IonicContact OE1-NE 2.8Å; E3-R7 PolarHBondContact OE1-NE 3.02Å; E3-R7 IonicContact OE1-NH2 2.69Å; E3-R7 PolarHBondContact OE1-NH2 2.76Å; E3-R7 IonicContact OE2-CZ 3.58Å; E3-R7 IonicContact OE2-NE 3.84Å; E3-R7 IonicContact OE2-NH2 2.79Å; E3-R7 PolarHBondContact OE2-NH2 3.33Å; Q4-R7 PolarHBondContact O-N 2.67Å; A5-R7 PolarHBondContact O-N 3.01Å; R7-C9 VanDerWaalsContact C-N 3.33Å; R7-C9 PolarHBondContact O-N 3.37Å; R7-R10 PolarHBondContact O-N 3.02Å; R7-R10 VanDerWaalsContact O-N 3.14Å; R7-D11 PolarHBondContact O-N 2.95Å
8	Y	38.3	Very low	46.2	Very low	164 Å²	164	105.1 Å²	105.1	64%	0.643	54%	0.544	S	S	*	.	H	α-helix	trans	-58.5	-40	176.3	-82.1	-61.5	0	0	0	113.4	Q4 A5 D11 G12	Q4-Y8 HydrophobicContact CG-CD2 4.18Å; Q4-Y8 HydrophobicContact CG-CE2 4Å; Q4-Y8 WeakPolarHBondContact O-CD2 3.17Å; Q4-Y8 PolarHBondContact O-N 3.49Å; A5-Y8 PolarHBondContact O-N 3.03Å; Y8-D11 PolarHBondContact O-N 2.9Å; Y8-G12 PolarHBondContact O-N 2.79Å
9	C	41.5	Very low	46.9	Very low	89 Å²	89	107.3 Å²	107.3	60%	0.601	55%	0.549	S	S	*	.	H	α-helix	trans	-64.4	-42	174.8	-70.3	0	0	0	0	112.4	A5 R7 G12 V13	A5-C9 WeakPolarHBondContact O-CB 3.08Å; A5-C9 PolarHBondContact O-N 2.69Å; A5-C9 PolarHBondContact O-SG 3.14Å; A5-C9 VanDerWaalsContact O-SG 3.39Å; R7-C9 VanDerWaalsContact C-N 3.33Å; R7-C9 PolarHBondContact O-N 3.37Å; C9-G12 PolarHBondContact O-N 3.45Å; C9-V13 WeakPolarHBondContact O-CG2 3.43Å; C9-V13 PolarHBondContact O-N 3.34Å
10	R	54.1	Low	47.2	Very low	139 Å²	139	107.9 Å²	107.9	53%	0.525	55%	0.549	S	S	.	.	H	α-helix	trans	-63	-43.2	174.2	-83.5	180	-78.8	-176.5	-3.5	111.8	A6 R7 G12 V13 H14	A6-R10 WeakPolarHBondContact O-CG 3.21Å; A6-R10 PolarHBondContact O-N 3.18Å; A6-R10 PolarHBondContact O-NE 2.81Å; R7-R10 PolarHBondContact O-N 3.02Å; R7-R10 VanDerWaalsContact O-N 3.14Å; R10-G12 PolarHBondContact O-N 3.37Å; R10-V13 PolarHBondContact O-N 3.44Å; R10-H14 PolarHBondContact O-CD2 2.92Å; R10-H14 PolarHBondContact O-N 2.91Å
11	D	49	Very low	47.4	Very low	80 Å²	80	107.1 Å²	107.1	43%	0.428	54%	0.544	S	S	.	.	H	α-helix	trans	-62.2	-41.1	176.8	-114.4	49	0	0	0	112.6	R7 Y8 K15	R7-D11 PolarHBondContact O-N 2.95Å; Y8-D11 PolarHBondContact O-N 2.9Å; D11-K15 WeakPolarHBondContact O-CB 3.2Å; D11-K15 WeakPolarHBondContact O-CD 3.36Å; D11-K15 VanDerWaalsContact O-CG 3.26Å; D11-K15 WeakPolarHBondContact O-CG 3.02Å; D11-K15 PolarHBondContact O-N 2.81Å; D11-K15 IonicContact OD2-NZ 2.77Å; D11-K15 PolarHBondContact OD2-NZ 3.01Å
12	G	51.6	Low	48.3	Very low	31 Å²	31	100 Å²	100	32%	0.32	52%	0.518	S	S	.	.	H	α-helix	trans	-61.9	-47.1	173.7	0	0	0	0	0	112.2	Y8 C9 R10 K15 L16	Y8-G12 PolarHBondContact O-N 2.79Å; C9-G12 PolarHBondContact O-N 3.45Å; R10-G12 PolarHBondContact O-N 3.37Å; G12-K15 PolarHBondContact O-N 3.29Å; G12-L16 WeakPolarHBondContact O-CG 3.48Å; G12-L16 PolarHBondContact O-N 2.96Å
13	V	52.8	Low	49.2	Very low	83 Å²	83	101.3 Å²	101.3	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-44.6	176.9	169.5	0	0	0	0	111.7	C9 R10 K15 L16 L17	C9-V13 WeakPolarHBondContact O-CG2 3.43Å; C9-V13 PolarHBondContact O-N 3.34Å; R10-V13 PolarHBondContact O-N 3.44Å; V13-K15 PolarHBondContact O-N 2.62Å; V13-L16 PolarHBondContact O-N 2.97Å; V13-L17 HydrophobicContact CG1-CD1 4.09Å; V13-L17 PolarHBondContact O-N 3.32Å
14	H	57.1	Low	49.8	Very low	115 Å²	115	100.8 Å²	100.8	53%	0.532	51%	0.512	S	S	.	.	H	α-helix	trans	-63.1	-40.2	175.8	-88.3	-74	0	0	0	112.9	R10 L16 L17 N18	R10-H14 PolarHBondContact O-CD2 2.92Å; R10-H14 PolarHBondContact O-N 2.91Å; H14-L16 VanDerWaalsContact C-N 3.33Å; H14-L16 PolarHBondContact O-N 3.41Å; H14-L17 PolarHBondContact O-N 3.37Å; H14-N18 WeakPolarHBondContact O-CB 3.48Å; H14-N18 PolarHBondContact O-N 3.06Å
15	K	58.1	Low	50.7	Low	135 Å²	135	104.2 Å²	104.2	59%	0.587	52%	0.521	S	S	*	.	H	α-helix	trans	-65.4	-35.3	176	-75.2	162.7	-176.3	150.4	0	112	D11 G12 V13 K19	D11-K15 WeakPolarHBondContact O-CB 3.2Å; D11-K15 WeakPolarHBondContact O-CD 3.36Å; D11-K15 VanDerWaalsContact O-CG 3.26Å; D11-K15 WeakPolarHBondContact O-CG 3.02Å; D11-K15 PolarHBondContact O-N 2.81Å; D11-K15 IonicContact OD2-NZ 2.77Å; D11-K15 PolarHBondContact OD2-NZ 3.01Å; G12-K15 PolarHBondContact O-N 3.29Å; V13-K15 PolarHBondContact O-N 2.62Å; K15-K19 VanDerWaalsContact O-CB 3.3Å; K15-K19 WeakPolarHBondContact O-CB 3.39Å; K15-K19 PolarHBondContact O-N 3.04Å
16	L	49.4	Very low	51.5	Low	114 Å²	114	104.6 Å²	104.6	60%	0.597	52%	0.524	S	S	*	.	H	α-helix	trans	-71.1	-46.9	174.6	-71.6	169.2	0	0	0	112.3	G12 V13 H14 N18 K19 E20	G12-L16 WeakPolarHBondContact O-CG 3.48Å; G12-L16 PolarHBondContact O-N 2.96Å; V13-L16 PolarHBondContact O-N 2.97Å; H14-L16 VanDerWaalsContact C-N 3.33Å; H14-L16 PolarHBondContact O-N 3.41Å; L16-N18 PolarHBondContact O-N 2.9Å; L16-K19 WeakPolarHBondContact O-CB 3.35Å; L16-K19 PolarHBondContact O-N 2.87Å; L16-K19 VanDerWaalsContact O-N 3.08Å; L16-E20 PolarHBondContact O-N 2.79Å
17	L	52.1	Low	51.8	Low	89 Å²	89	107.7 Å²	107.7	47%	0.466	53%	0.531	S	S	.	.	H	α-helix	trans	-55.6	-47.9	176	-93.9	162	0	0	0	112.3	V13 H14 K19 E20 Q21	V13-L17 HydrophobicContact CG1-CD1 4.09Å; V13-L17 PolarHBondContact O-N 3.32Å; H14-L17 PolarHBondContact O-N 3.37Å; L17-K19 VanDerWaalsContact C-N 3.28Å; L17-K19 PolarHBondContact O-N 3.16Å; L17-E20 PolarHBondContact O-N 3.44Å; L17-Q21 WeakPolarHBondContact O-CG 3.37Å; L17-Q21 PolarHBondContact O-N 2.98Å
18	N	53.5	Low	52.1	Low	102 Å²	102	108.4 Å²	108.4	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-64.9	-32.7	177.6	-72.9	-12.6	0	0	0	112.3	H14 L16 A22	H14-N18 WeakPolarHBondContact O-CB 3.48Å; H14-N18 PolarHBondContact O-N 3.06Å; L16-N18 PolarHBondContact O-N 2.9Å; N18-A22 WeakPolarHBondContact O-CB 3.5Å; N18-A22 PolarHBondContact O-N 2.73Å
19	K	60.4	Low	52.6	Low	147 Å²	147	105.5 Å²	105.5	64%	0.639	54%	0.543	S	S	*	.	H	α-helix	trans	-72.6	-32.6	177.5	-168.3	174.6	-175.5	177.9	0	112.6	K15 L16 L17 K23	K15-K19 VanDerWaalsContact O-CB 3.3Å; K15-K19 WeakPolarHBondContact O-CB 3.39Å; K15-K19 PolarHBondContact O-N 3.04Å; L16-K19 WeakPolarHBondContact O-CB 3.35Å; L16-K19 PolarHBondContact O-N 2.87Å; L16-K19 VanDerWaalsContact O-N 3.08Å; L17-K19 VanDerWaalsContact C-N 3.28Å; L17-K19 PolarHBondContact O-N 3.16Å; K19-K23 PolarHBondContact O-N 3.2Å
20	E	52.5	Low	52.9	Low	118 Å²	118	111.9 Å²	111.9	55%	0.551	55%	0.554	S	S	*	*	H	α-helix	trans	-74.3	-43.8	171	-67.8	-136.1	121.7	0	0	112.2	L16 L17 A22 K23 L24	L16-E20 PolarHBondContact O-N 2.79Å; L17-E20 PolarHBondContact O-N 3.44Å; E20-A22 VanDerWaalsContact C-N 3.25Å; E20-A22 PolarHBondContact O-N 3.29Å; E20-K23 WeakPolarHBondContact O-CA 3.4Å; E20-K23 WeakPolarHBondContact O-CB 3.48Å; E20-K23 PolarHBondContact O-N 2.8Å; E20-L24 WeakPolarHBondContact O-CG 3.46Å; E20-L24 PolarHBondContact O-N 3.05Å
21	Q	51.9	Low	52.5	Low	93 Å²	93	112 Å²	112	44%	0.435	56%	0.561	S	S	.	*	H	α-helix	trans	-60.6	-35	175.3	-71.6	-172.4	3.7	0	0	112.6	L17 R25	L17-Q21 WeakPolarHBondContact O-CG 3.37Å; L17-Q21 PolarHBondContact O-N 2.98Å; Q21-R25 WeakPolarHBondContact O-CG 3.3Å; Q21-R25 PolarHBondContact O-N 3.32Å; Q21-R25 VanDerWaalsContact O-N 3.14Å
22	A	59	Low	52.1	Low	61 Å²	61	116.6 Å²	116.6	50%	0.504	58%	0.58	S	S	.	*	H	α-helix	trans	-65.2	-39.1	172	0	0	0	0	0	112.7	N18 E20 A26	N18-A22 WeakPolarHBondContact O-CB 3.5Å; N18-A22 PolarHBondContact O-N 2.73Å; E20-A22 VanDerWaalsContact C-N 3.25Å; E20-A22 PolarHBondContact O-N 3.29Å; A22-A26 WeakPolarHBondContact O-CB 3.45Å; A22-A26 PolarHBondContact O-N 2.86Å
23	K	57.1	Low	51.5	Low	139 Å²	139	120.7 Å²	120.7	60%	0.604	60%	0.601	S	S	*	*	H	α-helix	trans	-65.4	-46.1	173.4	-82.6	-175.8	170.3	-173.1	0	112.3	K19 E20 R25 A26 Q27	K19-K23 PolarHBondContact O-N 3.2Å; E20-K23 WeakPolarHBondContact O-CA 3.4Å; E20-K23 WeakPolarHBondContact O-CB 3.48Å; E20-K23 PolarHBondContact O-N 2.8Å; K23-R25 PolarHBondContact O-N 2.75Å; K23-A26 CarbonylContact O-C 3.55Å; K23-A26 WeakPolarHBondContact O-CB 3.35Å; K23-A26 PolarHBondContact O-N 2.83Å; K23-A26 VanDerWaalsContact O-N 3.14Å; K23-Q27 PolarHBondContact O-N 3.09Å
24	L	50.3	Low	50.9	Low	103 Å²	103	126.1 Å²	126.1	54%	0.539	62%	0.617	S	S	.	*	H	α-helix	trans	-61.2	-46.4	-177.9	-70.3	167.8	0	0	0	111.2	E20 A26 Q27 E28	E20-L24 WeakPolarHBondContact O-CG 3.46Å; E20-L24 PolarHBondContact O-N 3.05Å; L24-A26 VanDerWaalsContact C-N 3.31Å; L24-A26 PolarHBondContact O-N 3.26Å; L24-Q27 WeakPolarHBondContact O-CA 3.3Å; L24-Q27 WeakPolarHBondContact O-CB 3.16Å; L24-Q27 PolarHBondContact O-N 2.94Å; L24-E28 PolarHBondContact O-N 3.44Å
25	R	53.7	Low	49.8	Very low	165 Å²	165	126.6 Å²	126.6	62%	0.623	63%	0.631	S	S	*	*	H	α-helix	trans	-61.4	-37	173.8	-72.1	177.3	177.6	153.6	3.1	112.9	Q21 K23 Q27 S29	Q21-R25 WeakPolarHBondContact O-CG 3.3Å; Q21-R25 PolarHBondContact O-N 3.32Å; Q21-R25 VanDerWaalsContact O-N 3.14Å; K23-R25 PolarHBondContact O-N 2.75Å; R25-Q27 VanDerWaalsContact C-N 3.25Å; R25-Q27 PolarHBondContact O-N 3.18Å; R25-S29 WeakPolarHBondContact O-CB 3.15Å; R25-S29 PolarHBondContact O-N 3.5Å; R25-S29 VanDerWaalsContact O-N 3.09Å; R25-S29 PolarHBondContact O-OG 2.88Å
26	A	53.7	Low	48.7	Very low	65 Å²	65	127.2 Å²	127.2	54%	0.537	65%	0.646	S	S	.	*	H	α-helix	trans	-70.1	-21.6	175.1	0	0	0	0	0	113.2	A22 K23 L24	A22-A26 WeakPolarHBondContact O-CB 3.45Å; A22-A26 PolarHBondContact O-N 2.86Å; K23-A26 CarbonylContact O-C 3.55Å; K23-A26 WeakPolarHBondContact O-CB 3.35Å; K23-A26 PolarHBondContact O-N 2.83Å; K23-A26 VanDerWaalsContact O-N 3.14Å; L24-A26 VanDerWaalsContact C-N 3.31Å; L24-A26 PolarHBondContact O-N 3.26Å
27	Q	49.1	Very low	47.8	Very low	108 Å²	108	125.9 Å²	125.9	51%	0.505	65%	0.651	S	S	.	*	H	α-helix	trans	-84.6	-45.4	175.2	-171.3	167.2	-19.6	0	0	111.9	K23 L24 R25 S29 R30 E31	K23-Q27 PolarHBondContact O-N 3.09Å; L24-Q27 WeakPolarHBondContact O-CA 3.3Å; L24-Q27 WeakPolarHBondContact O-CB 3.16Å; L24-Q27 PolarHBondContact O-N 2.94Å; R25-Q27 VanDerWaalsContact C-N 3.25Å; R25-Q27 PolarHBondContact O-N 3.18Å; Q27-S29 PolarHBondContact O-N 3.14Å; Q27-R30 WeakPolarHBondContact O-CA 3.4Å; Q27-R30 WeakPolarHBondContact O-CB 3.39Å; Q27-R30 PolarHBondContact O-N 3.02Å; Q27-E31 PolarHBondContact O-N 3.29Å
28	E	48.1	Very low	46.6	Very low	137 Å²	137	126.5 Å²	126.5	64%	0.64	66%	0.662	S	S	*	*	H	α-helix	trans	-54.8	-39.5	170.1	-71.4	-179	114.4	0	0	111.7	L24 R30 E31	L24-E28 PolarHBondContact O-N 3.44Å; E28-R30 PolarHBondContact O-N 3.28Å; E28-E31 PolarHBondContact O-N 3.01Å
29	S	49.3	Very low	45.5	Very low	103 Å²	103	129 Å²	129	72%	0.72	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-10	175.1	-60.3	0	0	0	0	114.5	R25 Q27	R25-S29 WeakPolarHBondContact O-CB 3.15Å; R25-S29 PolarHBondContact O-N 3.5Å; R25-S29 VanDerWaalsContact O-N 3.09Å; R25-S29 PolarHBondContact O-OG 2.88Å; Q27-S29 PolarHBondContact O-N 3.14Å
30	R	49.1	Very low	43.9	Very low	223 Å²	223	128.2 Å²	128.2	84%	0.842	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	-10.4	-174.9	-155.1	176.4	-173.3	-175.3	1.4	113.7	Q27 E28	Q27-R30 WeakPolarHBondContact O-CA 3.4Å; Q27-R30 WeakPolarHBondContact O-CB 3.39Å; Q27-R30 PolarHBondContact O-N 3.02Å; E28-R30 PolarHBondContact O-N 3.28Å
31	E	45.8	Very low	42.9	Very low	140 Å²	140	126.4 Å²	126.4	65%	0.654	67%	0.673	S	S	*	*			trans	-116.1	24.3	-170.4	-66	-175.7	156.3	0	0	113.7	Q27 E28 P33	Q27-E31 PolarHBondContact O-N 3.29Å; E28-E31 PolarHBondContact O-N 3.01Å; E31-P33 VanDerWaalsContact O-CD 3.29Å; E31-P33 WeakPolarHBondContact O-CD 3.46Å
32	Q	38.8	Very low	41.8	Very low	177 Å²	177	130.3 Å²	130.3	83%	0.827	69%	0.691	S	S	*	*			trans	-86.5	115.4	168.9	-72.7	-168.1	-1.7	0	0	112.4
33	P	40.6	Very low	40.4	Very low	118 Å²	118	132.8 Å²	132.8	77%	0.766	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-77	152.9	166	32.6	-34	0	0	0	111.3	E31	E31-P33 VanDerWaalsContact O-CD 3.29Å; E31-P33 WeakPolarHBondContact O-CD 3.46Å
34	K	39.2	Very low	39	Very low	196 Å²	196	130.7 Å²	130.7	85%	0.852	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-68.3	143	174	-72.9	-179.1	175.5	179.4	0	111.3
35	P	34.9	Very low	37.9	Very low	125 Å²	125	132.7 Å²	132.7	81%	0.812	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-74.6	146.7	175.4	31.4	-35	0	0	0	112.1
36	V	33.6	Very low	36.6	Very low	149 Å²	149	129.3 Å²	129.3	90%	0.903	74%	0.738	S	S	*	*			trans	-112.4	144.6	157.9	178.9	0	0	0	0	106.7
37	A	31.1	Very low	35.2	Very low	85 Å²	85	131.2 Å²	131.2	70%	0.702	75%	0.753	S	S	*	*			trans	-103.3	178.5	-161.8	0	0	0	0	0	114.4
38	C	26.1	Very low	34.1	Very low	103 Å²	103	135.3 Å²	135.3	70%	0.696	77%	0.773	S	S	*	*			trans	83.2	110.7	171.7	-61.5	0	0	0	0	115.7
39	Q	30.7	Very low	33.1	Very low	155 Å²	155	134.4 Å²	134.4	72%	0.724	78%	0.782	S	S	*	*				87.8	145.2	80.6	-78	-177.4	-81.2	0	0	111.1
40	D	27.7	Very low	31.9	Very low	129 Å²	129	132.8 Å²	132.8	69%	0.69	78%	0.781	S	S	*	*			cis	-167.5	157.4	-8.3	-92.8	-16	0	0	0	106.7
41	S	32.2	Very low	30.8	Very low	81 Å²	81	129.7 Å²	129.7	57%	0.566	78%	0.781	S	S	*	*			cis	-156	168.3	-6.1	-148.7	0	0	0	0	112.8
42	E	28.2	Very low	29.9	Very low	174 Å²	174	128.8 Å²	128.8	81%	0.813	79%	0.79	S	S	*	*			trans	34.3	116.8	143.9	-68.4	159.3	118.4	0	0	124.7
43	S	28.9	Very low	29.5	Very low	114 Å²	114	124 Å²	124	80%	0.797	79%	0.789	S	S	*	*				176.5	104.2	114.2	57.4	0	0	0	0	109.8
44	A	28.4	Very low	28.9	Very low	95 Å²	95	123.2 Å²	123.2	79%	0.785	79%	0.792	S	S	*	*				57.1	126.5	85.7	0	0	0	0	0	113.6
45	T	27.1	Very low	28.6	Very low	145 Å²	145	122.9 Å²	122.9	89%	0.89	79%	0.794	S	S	*	*			cis	-149.1	158.4	37.6	-56.4	0	0	0	0	114
46	A	25.5	Very low	28.7	Very low	93 Å²	93	122.6 Å²	122.6	77%	0.769	79%	0.792	S	S	*	*			trans	-53.1	154.3	-167.8	0	0	0	0	0	120.9
47	A	25.8	Very low	28.8	Very low	105 Å²	105	119.2 Å²	119.2	87%	0.868	79%	0.787	S	S	*	*			trans	-144.3	120.1	140.5	0	0	0	0	0	111.3
48	Q	25.7	Very low	29.1	Very low	194 Å²	194	118 Å²	118	91%	0.907	78%	0.782	S	S	*	*			trans	-117.8	161.8	166.5	-85.1	-174.8	10.5	0	0	106.7
49	S	25.7	Very low	30.2	Very low	119 Å²	119	119.3 Å²	119.3	83%	0.832	78%	0.781	S	S	*	*			cis	-165.3	165.5	-6.1	168.5	0	0	0	0	107.4
50	G	24.2	Very low	31.1	Very low	68 Å²	68	116.8 Å²	116.8	70%	0.701	77%	0.772	S	S	*	*			trans	124.3	89.4	170.2	0	0	0	0	0	113.2
51	N	26.3	Very low	32	Very low	158 Å²	158	112.9 Å²	112.9	85%	0.845	76%	0.763	S	S	*	*				80.9	99.6	59.8	-174.4	51.9	0	0	0	114.9
52	S	26.9	Very low	32.7	Very low	122 Å²	122	113.6 Å²	113.6	85%	0.853	76%	0.76	S	S	*	*			trans	-150.1	126.5	146.3	53.1	0	0	0	0	108.8
53	G	31.3	Very low	33.8	Very low	77 Å²	77	108 Å²	108	79%	0.794	74%	0.737	S	S	*	*			trans	-111.8	146.5	-176.6	0	0	0	0	0	112.3
54	A	28.3	Very low	35	Very low	101 Å²	101	109.8 Å²	109.8	84%	0.835	73%	0.727	S	S	*	*			trans	-137.7	123.6	171.2	0	0	0	0	0	110
55	Q	31.9	Very low	36.1	Very low	189 Å²	189	112.6 Å²	112.6	88%	0.883	72%	0.717	S	S	*	*			trans	-88.5	131.5	176.2	-76.6	-165.7	-44	0	0	111.7	G57	Q55-G57 VanDerWaalsContact C-N 3.32Å; Q55-G57 PolarHBondContact O-N 2.96Å
56	P	36.5	Very low	37.3	Very low	119 Å²	119	106.8 Å²	106.8	77%	0.773	68%	0.68	S	S	*	*			trans	-82.2	73.7	169.4	33.4	-33.3	0	0	0	110.9
57	G	35.6	Very low	38.4	Very low	78 Å²	78	106.5 Å²	106.5	80%	0.804	67%	0.669	S	S	*	*			trans	-102.5	27.2	-164.4	0	0	0	0	0	118.3	Q55	Q55-G57 VanDerWaalsContact C-N 3.32Å; Q55-G57 PolarHBondContact O-N 2.96Å
58	G	37.8	Very low	39.5	Very low	58 Å²	58	105 Å²	105	60%	0.598	65%	0.649	S	S	*	*	S	Bend	trans	-140.3	-25	-176.7	0	0	0	0	0	117.4
59	I	49.3	Very low	40.5	Very low	132 Å²	132	101.2 Å²	101.2	68%	0.677	63%	0.629	S	S	*	*	H	α-helix	trans	-82.6	-28.1	-170.8	49.2	174.5	0	0	0	114.8	G61 L62 V63	I59-G61 VanDerWaalsContact C-N 3.34Å; I59-G61 PolarHBondContact O-N 2.95Å; I59-L62 PolarHBondContact O-N 3.38Å; I59-V63 PolarHBondContact O-N 3.08Å
60	D	49.9	Very low	41.1	Very low	101 Å²	101	97.7 Å²	97.7	54%	0.54	60%	0.601	S	S	.	*	H	α-helix	trans	-61.7	-43.2	175.9	-173.2	81.5	0	0	0	111.3	L62 V63 R64	D60-L62 VanDerWaalsContact C-N 3.33Å; D60-L62 PolarHBondContact O-N 3.3Å; D60-V63 PolarHBondContact O-N 3.22Å; D60-R64 VanDerWaalsContact O-CB 3.23Å; D60-R64 WeakPolarHBondContact O-CB 3.38Å; D60-R64 PolarHBondContact O-N 3.06Å; D60-R64 IonicContact OD1-NH1 3.94Å; D60-R64 IonicContact OD2-CZ 3.9Å; D60-R64 IonicContact OD2-NH1 2.77Å; D60-R64 PolarHBondContact OD2-NH1 3.32Å
61	G	47	Very low	42.1	Very low	47 Å²	47	97.7 Å²	97.7	49%	0.485	59%	0.59	S	S	.	*	H	α-helix	trans	-58.9	-39.7	-178.6	0	0	0	0	0	113.7	I59 W65	I59-G61 VanDerWaalsContact C-N 3.34Å; I59-G61 PolarHBondContact O-N 2.95Å; G61-W65 WeakPolarHBondContact O-CB 3.41Å; G61-W65 PolarHBondContact O-N 2.99Å
62	L	46.9	Very low	42.8	Very low	97 Å²	97	94.9 Å²	94.9	51%	0.508	58%	0.575	S	S	.	*	H	α-helix	trans	-69.9	-44.5	177.7	-177.4	62.3	0	0	0	111.8	I59 D60 R64 W65 I66	I59-L62 PolarHBondContact O-N 3.38Å; D60-L62 VanDerWaalsContact C-N 3.33Å; D60-L62 PolarHBondContact O-N 3.3Å; L62-R64 VanDerWaalsContact C-N 3.32Å; L62-R64 PolarHBondContact O-N 2.92Å; L62-W65 PolarHBondContact O-N 3.49Å; L62-I66 HydrophobicContact CD1-CD1 4.47Å; L62-I66 HydrophobicContact CG-CD1 4.26Å; L62-I66 WeakPolarHBondContact O-CG1 3.37Å; L62-I66 PolarHBondContact O-N 2.77Å
63	V	50.8	Low	43.4	Very low	57 Å²	57	93.8 Å²	93.8	35%	0.345	56%	0.559	S	S	.	*	H	α-helix	trans	-61.6	-43.7	176	175.4	0	0	0	0	110.4	I59 D60 I66 V67 Y197	I59-V63 PolarHBondContact O-N 3.08Å; D60-V63 PolarHBondContact O-N 3.22Å; V63-I66 PolarHBondContact O-N 3.42Å; V63-V67 WeakPolarHBondContact O-CG2 3.39Å; V63-V67 PolarHBondContact O-N 3.27Å; V63-Y197 HydrophobicContact CG2-CE1 4.24Å
64	R	53.9	Low	43.8	Very low	151 Å²	151	98.2 Å²	98.2	57%	0.57	56%	0.557	S	S	*	*	H	α-helix	trans	-61.7	-43.3	177.3	-158	176.7	-148.5	110	-1.1	111.8	D60 L62 V67 T68	D60-R64 VanDerWaalsContact O-CB 3.23Å; D60-R64 WeakPolarHBondContact O-CB 3.38Å; D60-R64 PolarHBondContact O-N 3.06Å; D60-R64 IonicContact OD1-NH1 3.94Å; D60-R64 IonicContact OD2-CZ 3.9Å; D60-R64 IonicContact OD2-NH1 2.77Å; D60-R64 PolarHBondContact OD2-NH1 3.32Å; L62-R64 VanDerWaalsContact C-N 3.32Å; L62-R64 PolarHBondContact O-N 2.92Å; R64-V67 PolarHBondContact O-N 3.49Å; R64-T68 PolarHBondContact O-N 3.48Å; R64-T68 PolarHBondContact O-OG1 3.23Å; R64-T68 VanDerWaalsContact O-OG1 3.11Å
65	W	51.8	Low	44.3	Very low	153 Å²	153	101.2 Å²	101.2	58%	0.58	56%	0.559	S	S	*	*	H	α-helix	trans	-62.3	-44.7	176.2	-177.6	90	0	0	0	112.6	G61 L62 T68 K69	G61-W65 WeakPolarHBondContact O-CB 3.41Å; G61-W65 PolarHBondContact O-N 2.99Å; L62-W65 PolarHBondContact O-N 3.49Å; W65-T68 PolarHBondContact O-N 3.4Å; W65-K69 HydrophobicContact CD2-CG 4.44Å; W65-K69 HydrophobicContact CZ2-CG 4.15Å; W65-K69 PolarHBondContact O-N 3.24Å
66	I	51.5	Low	44.6	Very low	23 Å²	23	98 Å²	98	12%	0.118	55%	0.546	C	S	.	.	H	α-helix	trans	-60.5	-46.6	175.8	-66.2	167.7	0	0	0	110.5	L62 V63 T68 K69 M70 M190 L212	L62-I66 HydrophobicContact CD1-CD1 4.47Å; L62-I66 HydrophobicContact CG-CD1 4.26Å; L62-I66 WeakPolarHBondContact O-CG1 3.37Å; L62-I66 PolarHBondContact O-N 2.77Å; V63-I66 PolarHBondContact O-N 3.42Å; I66-T68 PolarHBondContact O-N 2.91Å; I66-K69 PolarHBondContact O-N 2.85Å; I66-M70 HydrophobicContact CG2-CE 4.24Å; I66-M70 HydrophobicContact CG2-SD 4.09Å; I66-M70 WeakPolarHBondContact O-CB 3.33Å; I66-M70 WeakPolarHBondContact O-CG 3.22Å; I66-M70 PolarHBondContact O-N 2.99Å; I66-M190 HydrophobicContact CD1-CE 4.34Å; I66-M190 HydrophobicContact CD1-SD 4.43Å; I66-M190 HydrophobicContact CG1-SD 4.33Å; I66-L212 HydrophobicContact CD1-CD2 4.46Å
67	V	49.8	Very low	44.7	Very low	88 Å²	88	96.9 Å²	96.9	53%	0.533	54%	0.541	S	S	.	.	H	α-helix	trans	-63.9	-39.4	178.8	171.4	0	0	0	0	112	V63 R64 S71	V63-V67 WeakPolarHBondContact O-CG2 3.39Å; V63-V67 PolarHBondContact O-N 3.27Å; R64-V67 PolarHBondContact O-N 3.49Å; V67-S71 PolarHBondContact O-N 3.49Å; V67-S71 PolarHBondContact O-OG 2.64Å
68	T	47.9	Very low	44.4	Very low	74 Å²	74	98.4 Å²	98.4	45%	0.454	54%	0.54	S	S	.	.	H	α-helix	trans	-63.4	-54.5	173.9	-63.4	0	0	0	0	111.1	R64 W65 I66 M70 S71 D72	R64-T68 PolarHBondContact O-N 3.48Å; R64-T68 PolarHBondContact O-OG1 3.23Å; R64-T68 VanDerWaalsContact O-OG1 3.11Å; W65-T68 PolarHBondContact O-N 3.4Å; I66-T68 PolarHBondContact O-N 2.91Å; T68-M70 VanDerWaalsContact C-N 3.27Å; T68-M70 PolarHBondContact O-N 3.38Å; T68-S71 WeakPolarHBondContact O-CA 3.44Å; T68-S71 VanDerWaalsContact O-CB 3.29Å; T68-S71 WeakPolarHBondContact O-CB 3.27Å; T68-S71 PolarHBondContact O-N 3.11Å; T68-D72 PolarHBondContact O-N 2.75Å
69	K	46.1	Very low	44.4	Very low	113 Å²	113	106.9 Å²	106.9	49%	0.491	55%	0.554	S	S	.	*	H	α-helix	trans	-62.7	-30.8	-177.3	-81.2	-64.5	-174.8	-171	0	114	W65 I66 S71	W65-K69 HydrophobicContact CD2-CG 4.44Å; W65-K69 HydrophobicContact CZ2-CG 4.15Å; W65-K69 PolarHBondContact O-N 3.24Å; I66-K69 PolarHBondContact O-N 2.85Å; K69-S71 VanDerWaalsContact C-N 3.33Å
70	M	40.2	Very low	43.8	Very low	46 Å²	46	108 Å²	108	23%	0.227	56%	0.556	C	S	.	*	H	α-helix	trans	-76.9	-15.3	171.6	-71.8	-175.8	169.4	0	0	114.3	I66 T68 M190 K194	I66-M70 HydrophobicContact CG2-CE 4.24Å; I66-M70 HydrophobicContact CG2-SD 4.09Å; I66-M70 WeakPolarHBondContact O-CB 3.33Å; I66-M70 WeakPolarHBondContact O-CG 3.22Å; I66-M70 PolarHBondContact O-N 2.99Å; T68-M70 VanDerWaalsContact C-N 3.27Å; T68-M70 PolarHBondContact O-N 3.38Å; M70-M190 HydrophobicContact CE-CB 3.76Å; M70-K194 HydrophobicContact CE-CB 4.45Å; M70-K194 HydrophobicContact SD-CB 4.25Å; M70-K194 HydrophobicContact SD-CD 3.61Å; M70-K194 HydrophobicContact SD-CG 4.49Å
71	S	44.6	Very low	43.1	Very low	68 Å²	68	113.3 Å²	113.3	48%	0.476	57%	0.57	S	S	.	*	H	α-helix	trans	-80.5	-36	174.3	-61.7	0	0	0	0	111.7	V67 T68 K69	V67-S71 PolarHBondContact O-N 3.49Å; V67-S71 PolarHBondContact O-OG 2.64Å; T68-S71 WeakPolarHBondContact O-CA 3.44Å; T68-S71 VanDerWaalsContact O-CB 3.29Å; T68-S71 WeakPolarHBondContact O-CB 3.27Å; T68-S71 PolarHBondContact O-N 3.11Å; K69-S71 VanDerWaalsContact C-N 3.33Å
72	D	40	Very low	42.3	Very low	99 Å²	99	115.5 Å²	115.5	53%	0.529	58%	0.584	S	S	.	*	H	α-helix	trans	-68.3	-40	177.9	-53.7	-29.8	0	0	0	111.6	T68 K74	T68-D72 PolarHBondContact O-N 2.75Å; D72-K74 PolarHBondContact O-N 2.93Å
73	N	40.6	Very low	41.6	Very low	99 Å²	99	113.8 Å²	113.8	53%	0.529	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-68.7	9.6	-179	-86	4.5	0	0	0	115.7	N75 I76	N73-N75 PolarHBondContact O-N 3.41Å; N73-I76 PolarHBondContact O-N 3.19Å
74	K	39.8	Very low	40.9	Very low	170 Å²	170	115.5 Å²	115.5	74%	0.739	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-62	-16.5	-174.9	-109	-178	176.4	178.8	0	115.6	D72	D72-K74 PolarHBondContact O-N 2.93Å
75	N	37.8	Very low	40	Very low	163 Å²	163	117.4 Å²	117.4	87%	0.872	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-88.8	-8.6	-175.1	-142.5	17	0	0	0	114.4	N73	N73-N75 PolarHBondContact O-N 3.41Å
76	I	38.5	Very low	39	Very low	121 Å²	121	118.7 Å²	118.7	62%	0.621	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-41.3	-175.5	-66.1	170	0	0	0	111.7	N73 S78	N73-I76 PolarHBondContact O-N 3.19Å; I76-S78 PolarHBondContact O-N 3.36Å
77	S	38.5	Very low	38	Very low	96 Å²	96	123.6 Å²	123.6	67%	0.671	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-0.9	-164.8	-172.5	0	0	0	0	116.6
78	S	30.6	Very low	37.3	Very low	110 Å²	110	125.9 Å²	125.9	77%	0.769	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	-4.9	-164.2	-62.4	0	0	0	0	116.7	I76	I76-S78 PolarHBondContact O-N 3.36Å
79	R	36.1	Very low	36.5	Very low	236 Å²	236	126.6 Å²	126.6	89%	0.891	67%	0.669	S	S	*	*	S	Bend	trans	-110.3	-18.9	-173.8	-144	173.4	83	150.6	2.7	116.5
80	E	36.5	Very low	35.9	Very low	157 Å²	157	127.6 Å²	127.6	73%	0.734	68%	0.684	S	S	*	*	S	Bend	trans	-101.7	-23.1	-171.4	-63.3	-178	124.2	0	0	114.5	A82	E80-A82 VanDerWaalsContact C-N 3.29Å; E80-A82 PolarHBondContact O-N 3.26Å
81	Y	36.1	Very low	35.6	Very low	212 Å²	212	129.6 Å²	129.6	83%	0.831	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	8.2	-171	-102.3	-81.2	0	0	0	116.2
82	A	30	Very low	35	Very low	93 Å²	93	135 Å²	135	77%	0.769	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-28.7	178.7	0	0	0	0	0	114.2	E80 S84	E80-A82 VanDerWaalsContact C-N 3.29Å; E80-A82 PolarHBondContact O-N 3.26Å; A82-S84 PolarHBondContact O-N 3.02Å
83	S	32.8	Very low	34.6	Very low	61 Å²	61	138.3 Å²	138.3	43%	0.427	74%	0.738	S	S	.	*	S	Bend	trans	-74.2	-27.6	-170.2	-124.2	0	0	0	0	114.4	K85 E86 E87	S83-K85 PolarHBondContact O-N 2.84Å; S83-E86 PolarHBondContact O-N 3.39Å; S83-E87 WeakPolarHBondContact CB-OE2 3.24Å; S83-E87 PolarHBondContact OG-OE2 2.93Å
84	S	35.5	Very low	34	Very low	92 Å²	92	142.1 Å²	142.1	64%	0.643	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	23.7	-164.1	61.2	0	0	0	0	116.8	A82	A82-S84 PolarHBondContact O-N 3.02Å
85	K	35.1	Very low	33.5	Very low	191 Å²	191	143.4 Å²	143.4	83%	0.83	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.9	-15	174.6	-81.1	-165.7	172.5	-173.8	0	116.6	S83	S83-K85 PolarHBondContact O-N 2.84Å
86	E	31.3	Very low	33.2	Very low	180 Å²	180	145.9 Å²	145.9	84%	0.841	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113	-21.3	-179.7	-91.1	172.6	139.1	0	0	114.1	S83 V88	S83-E86 PolarHBondContact O-N 3.39Å; E86-V88 PolarHBondContact O-N 3.27Å
87	E	31	Very low	32.7	Very low	126 Å²	126	144.3 Å²	144.3	59%	0.589	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-79	4.7	-177.8	-66.7	179.8	115.4	0	0	115	S83 A89	S83-E87 WeakPolarHBondContact CB-OE2 3.24Å; S83-E87 PolarHBondContact OG-OE2 2.93Å; E87-A89 PolarHBondContact O-N 2.95Å; E87-A89 VanDerWaalsContact O-N 3.12Å
88	V	33.9	Very low	32.5	Very low	137 Å²	137	145.5 Å²	145.5	83%	0.83	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-71.1	-4.5	179.5	-170	0	0	0	0	112.8	E86	E86-V88 PolarHBondContact O-N 3.27Å
89	A	32.4	Very low	32.8	Very low	89 Å²	89	148 Å²	148	74%	0.736	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-122.5	-9	-175.1	0	0	0	0	0	115.9	E87	E87-A89 PolarHBondContact O-N 2.95Å; E87-A89 VanDerWaalsContact O-N 3.12Å
90	V	32.8	Very low	33.7	Very low	133 Å²	133	142.3 Å²	142.3	81%	0.806	77%	0.766	S	S	*	*	S	Bend	trans	-138	51.6	-169.7	-159.7	0	0	0	0	112.4
91	A	32.5	Very low	34.9	Very low	89 Å²	89	141.4 Å²	141.4	74%	0.736	76%	0.755	S	S	*	*			trans	-139.7	27	172.1	0	0	0	0	0	112.9
92	Q	32.8	Very low	36.4	Very low	182 Å²	182	139 Å²	139	85%	0.85	75%	0.745	S	S	*	*			trans	-80.7	126.4	165.2	-173.1	168.8	-12	0	0	108.1
93	E	32	Very low	38.1	Very low	168 Å²	168	134.6 Å²	134.6	79%	0.785	71%	0.708	S	S	*	*	S	Bend	trans	71.2	86.4	-174.2	-56.5	-177.2	-169.5	0	0	117.1
94	Q	28.9	Very low	40.2	Very low	178 Å²	178	133.8 Å²	133.8	83%	0.832	70%	0.699	S	S	*	*				-170.3	123.3	119.2	-102.4	154.2	82.6	0	0	113.8
95	F	28	Very low	42.2	Very low	198 Å²	198	131.7 Å²	131.7	87%	0.868	68%	0.684	S	S	*	*			trans	51.8	141.3	159.9	-74.9	-93	0	0	0	121.7	A97	F95-A97 PolarHBondContact O-N 3.08Å; F95-A97 VanDerWaalsContact O-N 3.14Å
96	F	32.1	Very low	44.4	Very low	215 Å²	215	124.1 Å²	124.1	94%	0.943	65%	0.654	S	S	*	*			trans	-67	105.6	173.1	-74.7	-104.8	0	0	0	111.2
97	A	28	Very low	46.7	Very low	88 Å²	88	115.7 Å²	115.7	73%	0.727	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-91.3	130.8	152.2	0	0	0	0	0	108.4	F95	F95-A97 PolarHBondContact O-N 3.08Å; F95-A97 VanDerWaalsContact O-N 3.14Å
98	P	33.6	Very low	49.1	Very low	120 Å²	120	112.9 Å²	112.9	78%	0.779	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-66.9	148.9	170.4	29.7	-33.8	0	0	0	110
99	E	38.1	Very low	51.4	Low	162 Å²	162	108.6 Å²	108.6	76%	0.757	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-57.9	143.3	171.4	-70.5	-162	158.9	0	0	110.4	R101	E99-R101 PolarHBondContact O-N 3.44Å
100	P	53.5	Low	53.8	Low	118 Å²	118	106.1 Å²	106.1	77%	0.766	55%	0.55	S	S	*	.			trans	-56.5	114.7	169.8	-21.8	32.9	0	0	0	109.4	R102	P100-R102 PolarHBondContact O-N 3Å
101	R	62.6	Low	56.2	Low	137 Å²	137	100.1 Å²	100.1	52%	0.517	51%	0.513	S	S	.	.			trans	-63.6	135.7	179.9	-59.1	-170.9	-174.8	-176.3	4.3	109.5	E99 I104 A166	E99-R101 PolarHBondContact O-N 3.44Å; R101-I104 HydrophobicContact CB-CD1 3.8Å; R101-I104 HydrophobicContact CB-CG1 4.22Å; R101-I104 HydrophobicContact CG-CD1 4.48Å; R101-I104 WeakPolarHBondContact O-CB 3.37Å; R101-I104 VanDerWaalsContact O-CG1 3.26Å; R101-I104 WeakPolarHBondContact O-CG1 3.39Å; R101-I104 PolarHBondContact O-N 3.05Å; R101-A166 PolarHBondContact NH1-O 3.37Å
102	R	66.9	Low	58.6	Low	163 Å²	163	103.5 Å²	103.5	62%	0.615	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	142.7	-176.6	-57.1	-177.4	-164.7	-178.7	6.2	109.9	P100 A177 E180	P100-R102 PolarHBondContact O-N 3Å; R102-A177 HydrophobicContact CB-CB 3.49Å; R102-A177 VanDerWaalsContact CB-CB 3.49Å; R102-E180 VanDerWaalsContact CA-OE2 3.23Å; R102-E180 WeakPolarHBondContact CA-OE2 3.44Å
103	G	66.4	Low	61	Low	0 Å²	0	100.7 Å²	100.7	0%	0	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.7	-10.2	-172.6	0	0	0	0	0	114.4	S105 V106 E180	G103-S105 PolarHBondContact O-N 2.95Å; G103-V106 WeakPolarHBondContact O-CB 3.47Å; G103-V106 PolarHBondContact O-N 3.32Å; G103-E180 PolarHBondContact N-OE1 3.42Å; G103-E180 PolarHBondContact N-OE2 2.94Å
104	I	77.3	Confident	63.4	Low	44 Å²	44	92.7 Å²	92.7	23%	0.226	45%	0.451	C	S	.	.	H	α-helix	trans	-58.2	-35.9	174.3	-74.2	176.6	0	0	0	111.2	R101 V106 I107 L108	R101-I104 HydrophobicContact CB-CD1 3.8Å; R101-I104 HydrophobicContact CB-CG1 4.22Å; R101-I104 HydrophobicContact CG-CD1 4.48Å; R101-I104 WeakPolarHBondContact O-CB 3.37Å; R101-I104 VanDerWaalsContact O-CG1 3.26Å; R101-I104 WeakPolarHBondContact O-CG1 3.39Å; R101-I104 PolarHBondContact O-N 3.05Å; I104-V106 PolarHBondContact O-N 2.9Å; I104-V106 VanDerWaalsContact O-N 3.09Å; I104-I107 HydrophobicContact CB-CD1 4.34Å; I104-I107 HydrophobicContact CG1-CD1 3.98Å; I104-I107 WeakPolarHBondContact O-CA 3.47Å; I104-I107 WeakPolarHBondContact O-CB 3.42Å; I104-I107 PolarHBondContact O-N 2.86Å; I104-L108 HydrophobicContact CG2-CD1 4.4Å; I104-L108 HydrophobicContact CG2-CG 4.28Å; I104-L108 PolarHBondContact O-N 3.31Å
105	S	77.6	Confident	66.1	Low	48 Å²	48	85 Å²	85	34%	0.336	42%	0.415	S	S	.	.	H	α-helix	trans	-60	-24.1	176.9	-172.7	0	0	0	0	113.3	G103 D109 E180	G103-S105 PolarHBondContact O-N 2.95Å; S105-D109 PolarHBondContact O-N 3.24Å; S105-E180 WeakPolarHBondContact CB-OE1 3.29Å; S105-E180 PolarHBondContact N-OE1 3.39Å
106	V	80	Confident	68.7	Low	31 Å²	31	82 Å²	82	19%	0.188	40%	0.402	C	S	.	.	H	α-helix	trans	-77.7	-33.6	176.1	-169.6	0	0	0	0	110.8	G103 I104 D109 I110 L176 L179 E180	G103-V106 WeakPolarHBondContact O-CB 3.47Å; G103-V106 PolarHBondContact O-N 3.32Å; I104-V106 PolarHBondContact O-N 2.9Å; I104-V106 VanDerWaalsContact O-N 3.09Å; V106-D109 PolarHBondContact O-N 2.85Å; V106-I110 WeakPolarHBondContact O-CG1 3.39Å; V106-I110 PolarHBondContact O-N 3.3Å; V106-L176 HydrophobicContact CB-CD2 4Å; V106-L176 HydrophobicContact CG1-CD2 3.7Å; V106-L176 HydrophobicContact CG2-CD2 4.41Å; V106-L179 HydrophobicContact CG2-CB 4.29Å; V106-E180 HydrophobicContact CG2-CB 4.33Å
107	I	80.9	Confident	71.2	Confident	3 Å²	3	77.2 Å²	77.2	2%	0.015	39%	0.386	C	S	.	.	H	α-helix	trans	-65.6	-43.4	172	-38.7	166.8	0	0	0	110.3	I104 D109 I110 F111 L161 C162 F165 M169	I104-I107 HydrophobicContact CB-CD1 4.34Å; I104-I107 HydrophobicContact CG1-CD1 3.98Å; I104-I107 WeakPolarHBondContact O-CA 3.47Å; I104-I107 WeakPolarHBondContact O-CB 3.42Å; I104-I107 PolarHBondContact O-N 2.86Å; I107-D109 VanDerWaalsContact C-N 3.25Å; I107-D109 PolarHBondContact O-N 3.15Å; I107-I110 CarbonylContact O-C 3.57Å; I107-I110 WeakPolarHBondContact O-CA 3.49Å; I107-I110 WeakPolarHBondContact O-CB 3.49Å; I107-I110 PolarHBondContact O-N 3.38Å; I107-F111 PolarHBondContact O-N 2.86Å; I107-L161 HydrophobicContact CG2-CD2 4.36Å; I107-L161 HydrophobicContact CG2-CG 4.44Å; I107-C162 HydrophobicContact CD1-CB 4.22Å; I107-F165 HydrophobicContact CD1-CB 4.01Å; I107-F165 HydrophobicContact CG1-CB 4.39Å; I107-F165 HydrophobicContact CG2-CB 4.34Å; I107-F165 HydrophobicContact CG2-CD2 3.91Å; I107-F165 HydrophobicContact CG2-CG 4.44Å; I107-M169 HydrophobicContact CD1-CE 3.42Å; I107-M169 VanDerWaalsContact CD1-CE 3.42Å; I107-M169 HydrophobicContact CG1-CE 3.65Å
108	L	81.6	Confident	73.7	Confident	67 Å²	67	79.8 Å²	79.8	35%	0.351	39%	0.387	S	S	.	.	H	α-helix	trans	-59.4	-39.3	175.9	-61.4	178.8	0	0	0	111.3	I104 I110 F111 R112 T158	I104-L108 HydrophobicContact CG2-CD1 4.4Å; I104-L108 HydrophobicContact CG2-CG 4.28Å; I104-L108 PolarHBondContact O-N 3.31Å; L108-I110 VanDerWaalsContact C-N 3.34Å; L108-F111 WeakPolarHBondContact O-CB 3.43Å; L108-F111 PolarHBondContact O-N 3.41Å; L108-R112 WeakPolarHBondContact O-CG 3.37Å; L108-R112 PolarHBondContact O-N 3.26Å; L108-R112 VanDerWaalsContact O-N 3.08Å; L108-T158 HydrophobicContact CD2-CG2 3.34Å
109	D	80.9	Confident	76.1	Confident	48 Å²	48	78.7 Å²	78.7	26%	0.257	38%	0.375	S	S	.	.	H	α-helix	trans	-73.2	-21.1	173.6	-97.4	-0.5	0	0	0	113.9	S105 V106 I107 R112 R113	S105-D109 PolarHBondContact O-N 3.24Å; V106-D109 PolarHBondContact O-N 2.85Å; I107-D109 VanDerWaalsContact C-N 3.25Å; I107-D109 PolarHBondContact O-N 3.15Å; D109-R112 IonicContact OD1-CZ 3.41Å; D109-R112 IonicContact OD1-NE 3.3Å; D109-R112 PolarHBondContact OD1-NE 3.1Å; D109-R112 IonicContact OD1-NH2 3.97Å; D109-R112 PolarHBondContact OD1-NH2 3.4Å; D109-R113 VanDerWaalsContact C-NH1 3.35Å; D109-R113 VanDerWaalsContact O-CG 3.3Å; D109-R113 WeakPolarHBondContact O-CG 3.3Å; D109-R113 PolarHBondContact O-NE 2.98Å; D109-R113 PolarHBondContact O-NH1 3.27Å
110	I	83	Confident	78.1	Confident	37 Å²	37	72.7 Å²	72.7	19%	0.19	36%	0.357	C	S	.	.	H	α-helix	trans	-71.6	-48.1	166.8	-71.1	163.5	0	0	0	109.8	V106 I107 L108 R112 R113 A114 F130 F131	V106-I110 WeakPolarHBondContact O-CG1 3.39Å; V106-I110 PolarHBondContact O-N 3.3Å; I107-I110 CarbonylContact O-C 3.57Å; I107-I110 WeakPolarHBondContact O-CA 3.49Å; I107-I110 WeakPolarHBondContact O-CB 3.49Å; I107-I110 PolarHBondContact O-N 3.38Å; L108-I110 VanDerWaalsContact C-N 3.34Å; I110-R112 PolarHBondContact O-N 2.98Å; I110-R113 VanDerWaalsContact CG1-NH2 3.28Å; I110-R113 WeakPolarHBondContact O-CA 3.34Å; I110-R113 WeakPolarHBondContact O-CB 3.29Å; I110-R113 PolarHBondContact O-N 2.69Å; I110-A114 PolarHBondContact O-N 3.13Å; I110-F130 HydrophobicContact CG2-CE1 3.8Å; I110-F130 HydrophobicContact CG2-CZ 4.37Å; I110-F131 HydrophobicContact CG2-CE1 4.18Å; I110-F131 HydrophobicContact CG2-CZ 3.88Å
111	F	82.4	Confident	79.8	Confident	6 Å²	6	70.5 Å²	70.5	3%	0.026	34%	0.335	C	S	.	.	H	α-helix	trans	-53.2	-54.3	178.8	-171.2	-78.5	0	0	0	111.1	I107 L108 R113 A114 D115 G120 L122 T158 L161	I107-F111 PolarHBondContact O-N 2.86Å; L108-F111 WeakPolarHBondContact O-CB 3.43Å; L108-F111 PolarHBondContact O-N 3.41Å; F111-R113 PolarHBondContact O-N 3.09Å; F111-A114 PolarHBondContact O-N 3.42Å; F111-D115 HydrophobicContact CD1-CB 4.39Å; F111-D115 HydrophobicContact CE1-CB 4.25Å; F111-D115 WeakPolarHBondContact O-CB 3.35Å; F111-D115 PolarHBondContact O-N 3.25Å; F111-G120 WeakPolarHBondContact CZ-O 3.39Å; F111-L122 HydrophobicContact CD2-CD1 3.97Å; F111-L122 HydrophobicContact CD2-CG 4.12Å; F111-L122 HydrophobicContact CE2-CD1 3.99Å; F111-L122 HydrophobicContact CE2-CD2 4.47Å; F111-L122 HydrophobicContact CE2-CG 3.72Å; F111-L122 HydrophobicContact CZ-CD2 4.48Å; F111-L122 HydrophobicContact CZ-CG 4.04Å; F111-T158 HydrophobicContact CB-CG2 4.44Å; F111-T158 HydrophobicContact CD1-CG2 4.32Å; F111-T158 HydrophobicContact CD2-CG2 4.04Å; F111-T158 WeakPolarHBondContact CE1-OG1 3.39Å; F111-T158 HydrophobicContact CE2-CG2 4.41Å; F111-T158 VanDerWaalsContact CE2-N 3.34Å; F111-T158 HydrophobicContact CG-CG2 4.01Å; F111-T158 WeakPolarHBondContact CZ-OG1 3.26Å; F111-L161 HydrophobicContact CB-CD2 4.16Å; F111-L161 HydrophobicContact CD2-CB 4.3Å; F111-L161 HydrophobicContact CD2-CD2 3.7Å; F111-L161 HydrophobicContact CG-CD2 4.42Å
112	R	84.1	Confident	80.8	Confident	161 Å²	161	64 Å²	64	61%	0.608	31%	0.311	S	S	*	.	H	α-helix	trans	-67.3	6.8	176.1	-57.9	-174.2	-39.1	105.5	0.7	115.3	L108 D109 I110	L108-R112 WeakPolarHBondContact O-CG 3.37Å; L108-R112 PolarHBondContact O-N 3.26Å; L108-R112 VanDerWaalsContact O-N 3.08Å; D109-R112 IonicContact OD1-CZ 3.41Å; D109-R112 IonicContact OD1-NE 3.3Å; D109-R112 PolarHBondContact OD1-NE 3.1Å; D109-R112 IonicContact OD1-NH2 3.97Å; D109-R112 PolarHBondContact OD1-NH2 3.4Å; I110-R112 PolarHBondContact O-N 2.98Å
113	R	82.2	Confident	81.8	Confident	123 Å²	123	57.8 Å²	57.8	46%	0.464	29%	0.293	S	S	.	.	H	α-helix	trans	-114.9	-19.8	168.4	-70.5	-172.8	-53.5	-101.1	9.4	112.4	D109 I110 F111 K116 F130	D109-R113 VanDerWaalsContact C-NH1 3.35Å; D109-R113 VanDerWaalsContact O-CG 3.3Å; D109-R113 WeakPolarHBondContact O-CG 3.3Å; D109-R113 PolarHBondContact O-NE 2.98Å; D109-R113 PolarHBondContact O-NH1 3.27Å; I110-R113 VanDerWaalsContact CG1-NH2 3.28Å; I110-R113 WeakPolarHBondContact O-CA 3.34Å; I110-R113 WeakPolarHBondContact O-CB 3.29Å; I110-R113 PolarHBondContact O-N 2.69Å; F111-R113 PolarHBondContact O-N 3.09Å; R113-K116 PolarHBondContact O-NZ 2.75Å; R113-F130 HydrophobicContact CB-CE2 3.67Å; R113-F130 HydrophobicContact CB-CZ 4Å; R113-F130 VanDerWaalsContact O-CD2 3.29Å; R113-F130 WeakPolarHBondContact O-CD2 3.43Å; R113-F130 WeakPolarHBondContact O-CE2 3.17Å
114	A	82.9	Confident	82.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-80.5	-53.7	172	0	0	0	0	0	109.7	I110 F111 K116 L122 F130 F131	I110-A114 PolarHBondContact O-N 3.13Å; F111-A114 PolarHBondContact O-N 3.42Å; A114-K116 VanDerWaalsContact O-CD 3.3Å; A114-K116 WeakPolarHBondContact O-CD 3.3Å; A114-K116 WeakPolarHBondContact O-CE 3.35Å; A114-K116 WeakPolarHBondContact O-CG 3.29Å; A114-K116 PolarHBondContact O-N 3.3Å; A114-L122 HydrophobicContact CB-CD1 4.03Å; A114-L122 HydrophobicContact CB-CD2 3.47Å; A114-L122 VanDerWaalsContact CB-CD2 3.47Å; A114-L122 HydrophobicContact CB-CG 4.43Å; A114-F130 HydrophobicContact CB-CB 3.76Å; A114-F130 HydrophobicContact CB-CD1 3.83Å; A114-F130 HydrophobicContact CB-CD2 3.99Å; A114-F130 HydrophobicContact CB-CE1 4.49Å; A114-F130 HydrophobicContact CB-CG 3.55Å; A114-F131 HydrophobicContact CB-CE2 4.38Å
115	D	85.4	Confident	82.9	Confident	16 Å²	16	63.7 Å²	63.7	9%	0.086	32%	0.324	C	S	.	.			trans	-49.4	126.5	170.2	-179.1	-19.2	0	0	0	110.3	F111 D118 G120 L122	F111-D115 HydrophobicContact CD1-CB 4.39Å; F111-D115 HydrophobicContact CE1-CB 4.25Å; F111-D115 WeakPolarHBondContact O-CB 3.35Å; F111-D115 PolarHBondContact O-N 3.25Å; D115-D118 WeakPolarHBondContact OD1-CA 3.19Å; D115-D118 PolarHBondContact OD1-N 3.49Å; D115-G120 PolarHBondContact OD2-N 2.83Å; D115-L122 HydrophobicContact CB-CD2 3.89Å
116	K	83.9	Confident	83.3	Confident	134 Å²	134	62.5 Å²	62.5	58%	0.583	31%	0.313	S	S	*	.	S	Bend	trans	-115.7	-24.2	-173.8	-61.3	-49.5	-178.8	-158.9	0	115.2	R113 A114 E126	R113-K116 PolarHBondContact O-NZ 2.75Å; A114-K116 VanDerWaalsContact O-CD 3.3Å; A114-K116 WeakPolarHBondContact O-CD 3.3Å; A114-K116 WeakPolarHBondContact O-CE 3.35Å; A114-K116 WeakPolarHBondContact O-CG 3.29Å; A114-K116 PolarHBondContact O-N 3.3Å; K116-E126 WeakPolarHBondContact CB-OE1 3.37Å; K116-E126 HydrophobicContact CG-CG 4.14Å; K116-E126 PolarHBondContact N-OE1 3.01Å
117	D	83.8	Confident	83.5	Confident	115 Å²	115	61.1 Å²	61.1	62%	0.615	31%	0.305	S	S	*	.	S	Bend	trans	-109.9	4.7	179	65.3	1	0	0	0	113.8	D119	D117-D119 VanDerWaalsContact C-N 3.29Å; D117-D119 PolarHBondContact O-N 2.78Å; D117-D119 PolarHBondContact OD1-N 3.22Å
118	D	80.9	Confident	83.6	Confident	142 Å²	142	62.7 Å²	62.7	76%	0.759	31%	0.312	S	S	*	.			trans	61.1	30.3	179.6	-68.7	-71.9	0	0	0	112.5	D115 G120	D115-D118 WeakPolarHBondContact OD1-CA 3.19Å; D115-D118 PolarHBondContact OD1-N 3.49Å; D118-G120 VanDerWaalsContact C-N 3.34Å
119	D	83.3	Confident	83.6	Confident	98 Å²	98	63.1 Å²	63.1	52%	0.524	33%	0.325	S	S	.	.	S	Bend	trans	-74.9	-19.4	178.1	115.9	-44.7	0	0	0	113.9	D117 K121	D117-D119 VanDerWaalsContact C-N 3.29Å; D117-D119 PolarHBondContact O-N 2.78Å; D117-D119 PolarHBondContact OD1-N 3.22Å; D119-K121 WeakPolarHBondContact OD1-CA 3.41Å; D119-K121 WeakPolarHBondContact OD1-CB 3.47Å; D119-K121 PolarHBondContact OD1-N 3.36Å
120	G	81.3	Confident	83.7	Confident	36 Å²	36	64.1 Å²	64.1	37%	0.371	33%	0.328	S	S	.	.	S	Bend	trans	90.8	12.3	179.3	0	0	0	0	0	115.1	F111 D115 D118	F111-G120 WeakPolarHBondContact CZ-O 3.39Å; D115-G120 PolarHBondContact OD2-N 2.83Å; D118-G120 VanDerWaalsContact C-N 3.34Å
121	K	87.4	Confident	83.5	Confident	71 Å²	71	64.4 Å²	64.4	31%	0.309	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	178.8	172.1	-58.3	-174	163.3	-132.4	0	110.2	D119 N155	D119-K121 WeakPolarHBondContact OD1-CA 3.41Å; D119-K121 WeakPolarHBondContact OD1-CB 3.47Å; D119-K121 PolarHBondContact OD1-N 3.36Å; K121-N155 HydrophobicContact CB-CB 4.21Å; K121-N155 HydrophobicContact CD-CB 3.86Å
122	L	85.4	Confident	83.2	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	117.4	164.5	-60.9	176.7	0	0	0	109	F111 A114 D115 F127 F131 F145 N155 V156 L161	F111-L122 HydrophobicContact CD2-CD1 3.97Å; F111-L122 HydrophobicContact CD2-CG 4.12Å; F111-L122 HydrophobicContact CE2-CD1 3.99Å; F111-L122 HydrophobicContact CE2-CD2 4.47Å; F111-L122 HydrophobicContact CE2-CG 3.72Å; F111-L122 HydrophobicContact CZ-CD2 4.48Å; F111-L122 HydrophobicContact CZ-CG 4.04Å; A114-L122 HydrophobicContact CB-CD1 4.03Å; A114-L122 HydrophobicContact CB-CD2 3.47Å; A114-L122 VanDerWaalsContact CB-CD2 3.47Å; A114-L122 HydrophobicContact CB-CG 4.43Å; D115-L122 HydrophobicContact CB-CD2 3.89Å; L122-F127 HydrophobicContact CD1-CD2 4.35Å; L122-F131 HydrophobicContact CD1-CE2 4.43Å; L122-F145 WeakPolarHBondContact O-CE2 3.37Å; L122-N155 WeakPolarHBondContact O-CA 3.44Å; L122-V156 HydrophobicContact CB-CB 4.34Å; L122-V156 PolarHBondContact N-O 3.3Å; L122-V156 PolarHBondContact O-N 2.58Å; L122-L161 HydrophobicContact CD1-CD2 4.05Å
123	S	87	Confident	82.6	Confident	34 Å²	34	64.8 Å²	64.8	24%	0.238	35%	0.348	C	S	.	.			trans	-69.3	163.1	166.3	66.2	0	0	0	0	111.1	D125 E126 F127	S123-D125 VanDerWaalsContact C-N 3.3Å; S123-D125 PolarHBondContact O-N 3.18Å; S123-E126 WeakPolarHBondContact CB-OE2 3.23Å; S123-E126 PolarHBondContact N-OE2 2.92Å; S123-E126 PolarHBondContact O-N 2.9Å; S123-E126 VanDerWaalsContact OG-CG 3.3Å; S123-E126 WeakPolarHBondContact OG-CG 3.39Å; S123-E126 PolarHBondContact OG-N 3.36Å; S123-E126 PolarHBondContact OG-OE2 3.14Å; S123-F127 WeakPolarHBondContact O-CB 3.09Å; S123-F127 PolarHBondContact O-N 2.78Å
124	L	82.9	Confident	81.6	Confident	43 Å²	43	62.6 Å²	62.6	23%	0.225	36%	0.363	C	S	.	.	H	α-helix	trans	-59.3	-41.9	176.2	-179.3	63.5	0	0	0	111.6	E126 F127 Q128 E142 F145	L124-E126 PolarHBondContact O-N 2.8Å; L124-F127 PolarHBondContact O-N 3.14Å; L124-Q128 HydrophobicContact CD1-CG 4.21Å; L124-Q128 HydrophobicContact CG-CG 4.4Å; L124-Q128 WeakPolarHBondContact O-CB 3.39Å; L124-Q128 WeakPolarHBondContact O-CG 3.38Å; L124-Q128 PolarHBondContact O-N 3.44Å; L124-E142 HydrophobicContact CD1-CG 4.16Å; L124-E142 HydrophobicContact CD2-CG 4.18Å; L124-F145 HydrophobicContact CB-CE1 4.37Å; L124-F145 HydrophobicContact CB-CE2 4.33Å; L124-F145 HydrophobicContact CB-CZ 4.15Å; L124-F145 HydrophobicContact CD1-CB 3.91Å; L124-F145 HydrophobicContact CD1-CD1 4Å; L124-F145 HydrophobicContact CD1-CD2 4.01Å; L124-F145 HydrophobicContact CD1-CE1 4.48Å; L124-F145 HydrophobicContact CD1-CE2 4.48Å; L124-F145 HydrophobicContact CD1-CG 3.73Å
125	D	84.6	Confident	80.6	Confident	124 Å²	124	66.9 Å²	66.9	66%	0.663	39%	0.389	S	S	*	.	H	α-helix	trans	-60.5	-42.4	179.5	-68.3	5.7	0	0	0	111.7	S123 A129	S123-D125 VanDerWaalsContact C-N 3.3Å; S123-D125 PolarHBondContact O-N 3.18Å; D125-A129 WeakPolarHBondContact O-CB 3.49Å; D125-A129 PolarHBondContact O-N 3.12Å
126	E	85.8	Confident	80	Confident	23 Å²	23	69.8 Å²	69.8	11%	0.107	41%	0.405	C	S	.	.	H	α-helix	trans	-73.1	-39	177.8	-67.9	167.3	112	0	0	112.5	K116 S123 L124 A129 F130	K116-E126 WeakPolarHBondContact CB-OE1 3.37Å; K116-E126 HydrophobicContact CG-CG 4.14Å; K116-E126 PolarHBondContact N-OE1 3.01Å; S123-E126 WeakPolarHBondContact CB-OE2 3.23Å; S123-E126 PolarHBondContact N-OE2 2.92Å; S123-E126 PolarHBondContact O-N 2.9Å; S123-E126 VanDerWaalsContact OG-CG 3.3Å; S123-E126 WeakPolarHBondContact OG-CG 3.39Å; S123-E126 PolarHBondContact OG-N 3.36Å; S123-E126 PolarHBondContact OG-OE2 3.14Å; L124-E126 PolarHBondContact O-N 2.8Å; E126-A129 PolarHBondContact O-N 3.3Å; E126-F130 VanDerWaalsContact O-CB 3.3Å; E126-F130 WeakPolarHBondContact O-CB 3.43Å; E126-F130 PolarHBondContact O-N 3.23Å
127	F	84	Confident	79.6	Confident	2 Å²	2	67 Å²	67	1%	0.009	40%	0.396	C	S	.	.	H	α-helix	trans	-62	-47.3	175.2	-172.3	-91.8	0	0	0	110.4	L122 S123 L124 F130 F131 L141 L144 F145 I148 L161	L122-F127 HydrophobicContact CD1-CD2 4.35Å; S123-F127 WeakPolarHBondContact O-CB 3.09Å; S123-F127 PolarHBondContact O-N 2.78Å; L124-F127 PolarHBondContact O-N 3.14Å; F127-F130 PolarHBondContact O-N 2.96Å; F127-F131 HydrophobicContact CD1-CD2 4.28Å; F127-F131 AromaticContact CD2-CD2 3.45Å; F127-F131 HydrophobicContact CD2-CD2 3.45Å; F127-F131 VanDerWaalsContact CD2-CD2 3.45Å; F127-F131 AromaticContact CD2-CE2 3.57Å; F127-F131 HydrophobicContact CD2-CE2 3.57Å; F127-F131 HydrophobicContact CE1-CB 4.5Å; F127-F131 HydrophobicContact CE1-CD2 4.34Å; F127-F131 AromaticContact CE2-CD2 3.5Å; F127-F131 HydrophobicContact CE2-CD2 3.5Å; F127-F131 AromaticContact CE2-CE2 3.58Å; F127-F131 HydrophobicContact CE2-CE2 3.58Å; F127-F131 HydrophobicContact CE2-CG 4.27Å; F127-F131 HydrophobicContact CE2-CZ 4.38Å; F127-F131 AromaticContact CG-CD2 3.85Å; F127-F131 HydrophobicContact CG-CD2 3.85Å; F127-F131 HydrophobicContact CG-CE2 4.39Å; F127-F131 AromaticContact CZ-CD2 3.95Å; F127-F131 HydrophobicContact CZ-CD2 3.95Å; F127-F131 HydrophobicContact CZ-CE2 4.4Å; F127-F131 HydrophobicContact CZ-CG 4.32Å; F127-F131 WeakPolarHBondContact O-CB 3.48Å; F127-F131 WeakPolarHBondContact O-CD2 3.41Å; F127-F131 PolarHBondContact O-N 3.26Å; F127-L141 HydrophobicContact CD1-CD1 4.29Å; F127-L141 HydrophobicContact CD1-CG 4.29Å; F127-L141 HydrophobicContact CE1-CD1 3.77Å; F127-L141 HydrophobicContact CE1-CG 4.19Å; F127-L144 HydrophobicContact CE1-CD2 4.27Å; F127-L144 HydrophobicContact CE1-CG 4.27Å; F127-L144 HydrophobicContact CZ-CD2 4.04Å; F127-L144 HydrophobicContact CZ-CG 4.03Å; F127-F145 HydrophobicContact CB-CD2 3.68Å; F127-F145 HydrophobicContact CB-CE2 3.96Å; F127-F145 HydrophobicContact CD1-CB 4.08Å; F127-F145 AromaticContact CD1-CD2 3.87Å; F127-F145 HydrophobicContact CD1-CD2 3.87Å; F127-F145 HydrophobicContact CD1-CG 4.48Å; F127-F145 HydrophobicContact CD2-CD2 4.08Å; F127-F145 HydrophobicContact CE1-CB 4.16Å; F127-F145 AromaticContact CG-CD2 3.62Å; F127-F145 HydrophobicContact CG-CD2 3.62Å; F127-F145 HydrophobicContact CG-CE2 4.32Å; F127-I148 HydrophobicContact CE2-CD1 3.71Å; F127-I148 HydrophobicContact CZ-CD1 3.57Å; F127-L161 HydrophobicContact CE2-CD1 4.2Å
128	Q	82.9	Confident	79.4	Confident	37 Å²	37	67.9 Å²	67.9	17%	0.173	40%	0.396	C	S	.	.	H	α-helix	trans	-59.3	-50.7	172.8	-72.9	-177.7	-6.4	0	0	111.3	L124 F130 S132 L141	L124-Q128 HydrophobicContact CD1-CG 4.21Å; L124-Q128 HydrophobicContact CG-CG 4.4Å; L124-Q128 WeakPolarHBondContact O-CB 3.39Å; L124-Q128 WeakPolarHBondContact O-CG 3.38Å; L124-Q128 PolarHBondContact O-N 3.44Å; Q128-F130 PolarHBondContact O-N 3.28Å; Q128-S132 WeakPolarHBondContact O-CB 3.47Å; Q128-S132 PolarHBondContact O-N 3.35Å; Q128-S132 PolarHBondContact O-OG 2.89Å; Q128-L141 HydrophobicContact CB-CD2 4.27Å; Q128-L141 HydrophobicContact CG-CD2 4.15Å; Q128-L141 HydrophobicContact CG-CG 4.4Å
129	A	82.6	Confident	79.3	Confident	76 Å²	76	67.1 Å²	67.1	63%	0.628	39%	0.388	S	S	*	.	H	α-helix	trans	-67.9	-14.8	-177.1	0	0	0	0	0	115.1	D125 E126	D125-A129 WeakPolarHBondContact O-CB 3.49Å; D125-A129 PolarHBondContact O-N 3.12Å; E126-A129 PolarHBondContact O-N 3.3Å
130	F	82.1	Confident	79.2	Confident	69 Å²	69	66.3 Å²	66.3	30%	0.303	38%	0.382	S	S	.	.	H	α-helix	trans	-103.5	-38.1	176.1	-170.1	-89	0	0	0	113.7	I110 R113 A114 E126 F127 Q128	I110-F130 HydrophobicContact CG2-CE1 3.8Å; I110-F130 HydrophobicContact CG2-CZ 4.37Å; R113-F130 HydrophobicContact CB-CE2 3.67Å; R113-F130 HydrophobicContact CB-CZ 4Å; R113-F130 VanDerWaalsContact O-CD2 3.29Å; R113-F130 WeakPolarHBondContact O-CD2 3.43Å; R113-F130 WeakPolarHBondContact O-CE2 3.17Å; A114-F130 HydrophobicContact CB-CB 3.76Å; A114-F130 HydrophobicContact CB-CD1 3.83Å; A114-F130 HydrophobicContact CB-CD2 3.99Å; A114-F130 HydrophobicContact CB-CE1 4.49Å; A114-F130 HydrophobicContact CB-CG 3.55Å; E126-F130 VanDerWaalsContact O-CB 3.3Å; E126-F130 WeakPolarHBondContact O-CB 3.43Å; E126-F130 PolarHBondContact O-N 3.23Å; F127-F130 PolarHBondContact O-N 2.96Å; Q128-F130 PolarHBondContact O-N 3.28Å
131	F	79.6	Confident	79.3	Confident	43 Å²	43	65 Å²	65	19%	0.189	37%	0.366	C	S	.	.	H	α-helix	trans	-98.6	0.9	-175.5	-66.6	-79.2	0	0	0	114.3	I110 A114 L122 F127 D133 L141 F165	I110-F131 HydrophobicContact CG2-CE1 4.18Å; I110-F131 HydrophobicContact CG2-CZ 3.88Å; A114-F131 HydrophobicContact CB-CE2 4.38Å; L122-F131 HydrophobicContact CD1-CE2 4.43Å; F127-F131 HydrophobicContact CD1-CD2 4.28Å; F127-F131 AromaticContact CD2-CD2 3.45Å; F127-F131 HydrophobicContact CD2-CD2 3.45Å; F127-F131 VanDerWaalsContact CD2-CD2 3.45Å; F127-F131 AromaticContact CD2-CE2 3.57Å; F127-F131 HydrophobicContact CD2-CE2 3.57Å; F127-F131 HydrophobicContact CE1-CB 4.5Å; F127-F131 HydrophobicContact CE1-CD2 4.34Å; F127-F131 AromaticContact CE2-CD2 3.5Å; F127-F131 HydrophobicContact CE2-CD2 3.5Å; F127-F131 AromaticContact CE2-CE2 3.58Å; F127-F131 HydrophobicContact CE2-CE2 3.58Å; F127-F131 HydrophobicContact CE2-CG 4.27Å; F127-F131 HydrophobicContact CE2-CZ 4.38Å; F127-F131 AromaticContact CG-CD2 3.85Å; F127-F131 HydrophobicContact CG-CD2 3.85Å; F127-F131 HydrophobicContact CG-CE2 4.39Å; F127-F131 AromaticContact CZ-CD2 3.95Å; F127-F131 HydrophobicContact CZ-CD2 3.95Å; F127-F131 HydrophobicContact CZ-CE2 4.4Å; F127-F131 HydrophobicContact CZ-CG 4.32Å; F127-F131 WeakPolarHBondContact O-CB 3.48Å; F127-F131 WeakPolarHBondContact O-CD2 3.41Å; F127-F131 PolarHBondContact O-N 3.26Å; F131-D133 PolarHBondContact O-N 2.94Å; F131-L141 HydrophobicContact CB-CD1 4.06Å; F131-F165 HydrophobicContact CE1-CE2 4.38Å; F131-F165 HydrophobicContact CE1-CZ 4.09Å; F131-F165 HydrophobicContact CZ-CE2 4.45Å
132	S	75.4	Confident	79.2	Confident	76 Å²	76	65.2 Å²	65.2	53%	0.531	37%	0.368	S	S	.	.			trans	-66.4	97.7	170.6	65	0	0	0	0	111.4	Q128	Q128-S132 WeakPolarHBondContact O-CB 3.47Å; Q128-S132 PolarHBondContact O-N 3.35Å; Q128-S132 PolarHBondContact O-OG 2.89Å
133	D	71.8	Confident	79.1	Confident	99 Å²	99	70.5 Å²	70.5	53%	0.529	39%	0.391	S	S	.	.			trans	-83.7	-19.8	174.7	72.2	-25.7	0	0	0	113	F131 T135 L136	F131-D133 PolarHBondContact O-N 2.94Å; D133-T135 PolarHBondContact OD1-N 3.3Å; D133-T135 WeakPolarHBondContact OD2-CB 3.4Å; D133-T135 PolarHBondContact OD2-OG1 2.89Å; D133-L136 PolarHBondContact OD1-N 3.34Å
134	G	61.6	Low	79	Confident	76 Å²	76	70.8 Å²	70.8	78%	0.784	39%	0.39	S	S	*	.	S	Bend	trans	92.3	-2	-174.3	0	0	0	0	0	114.2
135	T	61.8	Low	79.1	Confident	90 Å²	90	69 Å²	69	55%	0.552	38%	0.38	S	S	*	.	S	Bend	trans	-92.1	-43.9	172.6	-39.3	0	0	0	0	110.8	D133	D133-T135 PolarHBondContact OD1-N 3.3Å; D133-T135 WeakPolarHBondContact OD2-CB 3.4Å; D133-T135 PolarHBondContact OD2-OG1 2.89Å
136	L	71.3	Confident	79.2	Confident	78 Å²	78	68.4 Å²	68.4	41%	0.408	37%	0.373	S	S	.	.	S	Bend	trans	-81.5	141.1	177.9	-68.6	167.6	0	0	0	111.2	D133 E140 L141	D133-L136 PolarHBondContact OD1-N 3.34Å; L136-E140 HydrophobicContact CD2-CB 4.13Å; L136-L141 HydrophobicContact CD1-CD1 4.36Å
137	N	77.1	Confident	79.2	Confident	74 Å²	74	71.6 Å²	71.6	40%	0.396	39%	0.394	S	S	.	.			trans	-85.6	163	171.1	62.4	66	0	0	0	112.5	E139 E140 L141	N137-E139 VanDerWaalsContact C-N 3.28Å; N137-E139 PolarHBondContact O-N 3.37Å; N137-E139 PolarHBondContact OD1-N 2.93Å; N137-E140 VanDerWaalsContact CG-CD 3.45Å; N137-E140 PolarHBondContact N-OE2 3.04Å; N137-E140 PolarHBondContact ND2-OE1 3.39Å; N137-E140 PolarHBondContact ND2-OE2 2.91Å; N137-E140 WeakPolarHBondContact O-CB 3.33Å; N137-E140 PolarHBondContact O-N 3.39Å; N137-E140 WeakPolarHBondContact OD1-CG 3.11Å; N137-E140 PolarHBondContact OD1-N 3.04Å; N137-L141 PolarHBondContact O-N 2.77Å
138	E	77.9	Confident	79.3	Confident	134 Å²	134	71.6 Å²	71.6	63%	0.626	39%	0.394	S	S	*	.	H	α-helix	trans	-53.8	-43.1	-177.1	-164.3	168.9	-160.8	0	0	111.9	E140 L141 E142	E138-E140 VanDerWaalsContact C-N 3.34Å; E138-E140 PolarHBondContact O-N 2.91Å; E138-L141 PolarHBondContact O-N 3.01Å; E138-E142 WeakPolarHBondContact O-CG 3.34Å; E138-E142 PolarHBondContact O-N 3.01Å
139	E	80.4	Confident	79.5	Confident	126 Å²	126	70.1 Å²	70.1	59%	0.589	39%	0.387	S	S	*	.	H	α-helix	trans	-70.3	-25.7	177.4	-44.1	-178.8	-171.1	0	0	113.9	N137 K143	N137-E139 VanDerWaalsContact C-N 3.28Å; N137-E139 PolarHBondContact O-N 3.37Å; N137-E139 PolarHBondContact OD1-N 2.93Å; E139-K143 VanDerWaalsContact C-NZ 3.33Å; E139-K143 WeakPolarHBondContact O-CB 3.26Å; E139-K143 VanDerWaalsContact O-CD 3.23Å; E139-K143 WeakPolarHBondContact O-CD 3.43Å; E139-K143 WeakPolarHBondContact O-CE 3.5Å; E139-K143 WeakPolarHBondContact O-CG 3.35Å; E139-K143 PolarHBondContact O-N 3.33Å; E139-K143 PolarHBondContact O-NZ 3.48Å; E139-K143 IonicContact OE2-NZ 3.15Å; E139-K143 PolarHBondContact OE2-NZ 3.04Å; E139-K143 VanDerWaalsContact OE2-NZ 3.15Å
140	E	81.5	Confident	79.4	Confident	82 Å²	82	70.7 Å²	70.7	38%	0.383	39%	0.387	S	S	.	.	H	α-helix	trans	-78.5	-36.3	174.6	-78.7	160.1	-173.6	0	0	110.9	L136 N137 E138 K143 L144	L136-E140 HydrophobicContact CD2-CB 4.13Å; N137-E140 VanDerWaalsContact CG-CD 3.45Å; N137-E140 PolarHBondContact N-OE2 3.04Å; N137-E140 PolarHBondContact ND2-OE1 3.39Å; N137-E140 PolarHBondContact ND2-OE2 2.91Å; N137-E140 WeakPolarHBondContact O-CB 3.33Å; N137-E140 PolarHBondContact O-N 3.39Å; N137-E140 WeakPolarHBondContact OD1-CG 3.11Å; N137-E140 PolarHBondContact OD1-N 3.04Å; E138-E140 VanDerWaalsContact C-N 3.34Å; E138-E140 PolarHBondContact O-N 2.91Å; E140-K143 PolarHBondContact O-N 3.34Å; E140-L144 WeakPolarHBondContact O-CB 3.23Å; E140-L144 PolarHBondContact O-N 3.18Å
141	L	82.9	Confident	79.4	Confident	7 Å²	7	72.1 Å²	72.1	4%	0.037	40%	0.398	C	S	.	.	H	α-helix	trans	-71.2	-36.7	177	-159.4	55.7	0	0	0	111.3	F127 Q128 F131 L136 N137 E138 L144 F145	F127-L141 HydrophobicContact CD1-CD1 4.29Å; F127-L141 HydrophobicContact CD1-CG 4.29Å; F127-L141 HydrophobicContact CE1-CD1 3.77Å; F127-L141 HydrophobicContact CE1-CG 4.19Å; Q128-L141 HydrophobicContact CB-CD2 4.27Å; Q128-L141 HydrophobicContact CG-CD2 4.15Å; Q128-L141 HydrophobicContact CG-CG 4.4Å; F131-L141 HydrophobicContact CB-CD1 4.06Å; L136-L141 HydrophobicContact CD1-CD1 4.36Å; N137-L141 PolarHBondContact O-N 2.77Å; E138-L141 PolarHBondContact O-N 3.01Å; L141-L144 HydrophobicContact CD1-CD2 4.25Å; L141-L144 PolarHBondContact O-N 3.44Å; L141-F145 PolarHBondContact O-N 2.93Å
142	E	84.4	Confident	79.5	Confident	76 Å²	76	75.6 Å²	75.6	36%	0.355	42%	0.419	S	S	.	.	H	α-helix	trans	-60.8	-46.8	166.1	-78.2	-178.2	173.1	0	0	112.4	L124 E138 L144 F145 H146	L124-E142 HydrophobicContact CD1-CG 4.16Å; L124-E142 HydrophobicContact CD2-CG 4.18Å; E138-E142 WeakPolarHBondContact O-CG 3.34Å; E138-E142 PolarHBondContact O-N 3.01Å; E142-L144 VanDerWaalsContact C-N 3.27Å; E142-L144 PolarHBondContact O-N 3Å; E142-F145 WeakPolarHBondContact O-CB 3.3Å; E142-F145 PolarHBondContact O-N 2.94Å; E142-H146 PolarHBondContact O-N 3.39Å; E142-H146 PolarHBondContact O-ND1 3.35Å
143	K	83.9	Confident	79.7	Confident	111 Å²	111	74.8 Å²	74.8	48%	0.483	41%	0.41	S	S	.	.	H	α-helix	trans	-62.7	-35.7	176.9	-72.5	166.1	-160.5	104.8	0	111.5	E139 E140 T147	E139-K143 VanDerWaalsContact C-NZ 3.33Å; E139-K143 WeakPolarHBondContact O-CB 3.26Å; E139-K143 VanDerWaalsContact O-CD 3.23Å; E139-K143 WeakPolarHBondContact O-CD 3.43Å; E139-K143 WeakPolarHBondContact O-CE 3.5Å; E139-K143 WeakPolarHBondContact O-CG 3.35Å; E139-K143 PolarHBondContact O-N 3.33Å; E139-K143 PolarHBondContact O-NZ 3.48Å; E139-K143 IonicContact OE2-NZ 3.15Å; E139-K143 PolarHBondContact OE2-NZ 3.04Å; E139-K143 VanDerWaalsContact OE2-NZ 3.15Å; E140-K143 PolarHBondContact O-N 3.34Å; K143-T147 WeakPolarHBondContact O-CB 3.42Å; K143-T147 PolarHBondContact O-N 2.89Å; K143-T147 VanDerWaalsContact O-N 3.09Å; K143-T147 PolarHBondContact O-OG1 2.99Å
144	L	85.3	Confident	80.2	Confident	41 Å²	41	74 Å²	74	22%	0.215	41%	0.412	C	S	.	.	H	α-helix	trans	-65.5	-46.9	174	178.6	59.2	0	0	0	111.2	F127 E140 L141 E142 H146 T147 I148 Y164	F127-L144 HydrophobicContact CE1-CD2 4.27Å; F127-L144 HydrophobicContact CE1-CG 4.27Å; F127-L144 HydrophobicContact CZ-CD2 4.04Å; F127-L144 HydrophobicContact CZ-CG 4.03Å; E140-L144 WeakPolarHBondContact O-CB 3.23Å; E140-L144 PolarHBondContact O-N 3.18Å; L141-L144 HydrophobicContact CD1-CD2 4.25Å; L141-L144 PolarHBondContact O-N 3.44Å; E142-L144 VanDerWaalsContact C-N 3.27Å; E142-L144 PolarHBondContact O-N 3Å; L144-H146 PolarHBondContact O-N 3.2Å; L144-T147 WeakPolarHBondContact O-CA 3.44Å; L144-T147 WeakPolarHBondContact O-CB 3.42Å; L144-T147 PolarHBondContact O-N 2.9Å; L144-I148 HydrophobicContact CD1-CD1 4.05Å; L144-I148 HydrophobicContact CD1-CG1 4.37Å; L144-I148 HydrophobicContact CG-CD1 3.99Å; L144-I148 WeakPolarHBondContact O-CG1 3.46Å; L144-I148 PolarHBondContact O-N 2.97Å; L144-I148 VanDerWaalsContact O-N 3.1Å; L144-Y164 HydrophobicContact CD1-CE1 4.1Å; L144-Y164 HydrophobicContact CD1-CE2 4.2Å; L144-Y164 VanDerWaalsContact CD1-OH 3.27Å; L144-Y164 WeakPolarHBondContact CD1-OH 2.84Å
145	F	85.1	Confident	81.3	Confident	4 Å²	4	72.7 Å²	72.7	2%	0.018	39%	0.388	C	S	.	.	H	α-helix	trans	-54.2	-50.8	174.5	-175.5	-90.9	0	0	0	111.5	L122 L124 F127 L141 E142 T147 I148 D149 V156	L122-F145 WeakPolarHBondContact O-CE2 3.37Å; L124-F145 HydrophobicContact CB-CE1 4.37Å; L124-F145 HydrophobicContact CB-CE2 4.33Å; L124-F145 HydrophobicContact CB-CZ 4.15Å; L124-F145 HydrophobicContact CD1-CB 3.91Å; L124-F145 HydrophobicContact CD1-CD1 4Å; L124-F145 HydrophobicContact CD1-CD2 4.01Å; L124-F145 HydrophobicContact CD1-CE1 4.48Å; L124-F145 HydrophobicContact CD1-CE2 4.48Å; L124-F145 HydrophobicContact CD1-CG 3.73Å; F127-F145 HydrophobicContact CB-CD2 3.68Å; F127-F145 HydrophobicContact CB-CE2 3.96Å; F127-F145 HydrophobicContact CD1-CB 4.08Å; F127-F145 AromaticContact CD1-CD2 3.87Å; F127-F145 HydrophobicContact CD1-CD2 3.87Å; F127-F145 HydrophobicContact CD1-CG 4.48Å; F127-F145 HydrophobicContact CD2-CD2 4.08Å; F127-F145 HydrophobicContact CE1-CB 4.16Å; F127-F145 AromaticContact CG-CD2 3.62Å; F127-F145 HydrophobicContact CG-CD2 3.62Å; F127-F145 HydrophobicContact CG-CE2 4.32Å; L141-F145 PolarHBondContact O-N 2.93Å; E142-F145 WeakPolarHBondContact O-CB 3.3Å; E142-F145 PolarHBondContact O-N 2.94Å; F145-T147 PolarHBondContact O-N 3.18Å; F145-T147 VanDerWaalsContact O-N 3.16Å; F145-I148 PolarHBondContact O-N 2.69Å; F145-D149 WeakPolarHBondContact O-CB 3.47Å; F145-D149 PolarHBondContact O-N 2.8Å; F145-V156 HydrophobicContact CD2-CG2 3.78Å; F145-V156 HydrophobicContact CE2-CB 4.3Å; F145-V156 HydrophobicContact CE2-CG2 3.77Å; F145-V156 HydrophobicContact CG-CG2 4.28Å; F145-V156 HydrophobicContact CZ-CG2 4.23Å
146	H	86.3	Confident	82.4	Confident	113 Å²	113	68.4 Å²	68.4	52%	0.523	36%	0.361	S	S	.	.	H	α-helix	trans	-69.2	-7	176.2	-68.2	76.1	0	0	0	114.6	E142 L144	E142-H146 PolarHBondContact O-N 3.39Å; E142-H146 PolarHBondContact O-ND1 3.35Å; L144-H146 PolarHBondContact O-N 3.2Å
147	T	85.8	Confident	83.1	Confident	90 Å²	90	67.5 Å²	67.5	55%	0.552	36%	0.357	S	S	*	.	H	α-helix	trans	-94.7	-19.9	171.9	-58.2	0	0	0	0	111.6	K143 L144 F145 Y164	K143-T147 WeakPolarHBondContact O-CB 3.42Å; K143-T147 PolarHBondContact O-N 2.89Å; K143-T147 VanDerWaalsContact O-N 3.09Å; K143-T147 PolarHBondContact O-OG1 2.99Å; L144-T147 WeakPolarHBondContact O-CA 3.44Å; L144-T147 WeakPolarHBondContact O-CB 3.42Å; L144-T147 PolarHBondContact O-N 2.9Å; F145-T147 PolarHBondContact O-N 3.18Å; F145-T147 VanDerWaalsContact O-N 3.16Å; T147-Y164 HydrophobicContact CG2-CE2 4.2Å
148	I	85.4	Confident	83.3	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-91.4	-49.4	175.8	-59.2	160.9	0	0	0	109.7	F127 L144 F145 S150 V156 E160 L161 Y164	F127-I148 HydrophobicContact CE2-CD1 3.71Å; F127-I148 HydrophobicContact CZ-CD1 3.57Å; L144-I148 HydrophobicContact CD1-CD1 4.05Å; L144-I148 HydrophobicContact CD1-CG1 4.37Å; L144-I148 HydrophobicContact CG-CD1 3.99Å; L144-I148 WeakPolarHBondContact O-CG1 3.46Å; L144-I148 PolarHBondContact O-N 2.97Å; L144-I148 VanDerWaalsContact O-N 3.1Å; F145-I148 PolarHBondContact O-N 2.69Å; I148-S150 VanDerWaalsContact C-N 3.32Å; I148-S150 PolarHBondContact O-N 3.04Å; I148-S150 PolarHBondContact O-OG 3.36Å; I148-V156 HydrophobicContact CB-CG1 4.47Å; I148-V156 HydrophobicContact CB-CG2 3.95Å; I148-V156 HydrophobicContact CG2-CB 4.34Å; I148-V156 HydrophobicContact CG2-CG1 3.5Å; I148-V156 HydrophobicContact CG2-CG2 3.85Å; I148-E160 HydrophobicContact CG2-CB 4.13Å; I148-L161 HydrophobicContact CD1-CD1 4.28Å; I148-L161 HydrophobicContact CG2-CD1 4.33Å; I148-Y164 HydrophobicContact CD1-CD1 4.29Å; I148-Y164 HydrophobicContact CD1-CG 4.38Å; I148-Y164 HydrophobicContact CG1-CD1 4.04Å; I148-Y164 HydrophobicContact CG1-CD2 3.68Å; I148-Y164 HydrophobicContact CG1-CE1 4.46Å; I148-Y164 HydrophobicContact CG1-CE2 4.13Å; I148-Y164 HydrophobicContact CG1-CG 3.65Å
149	D	87.3	Confident	83.5	Confident	5 Å²	5	66.6 Å²	66.6	3%	0.027	35%	0.351	C	S	.	.			trans	-59.6	90.4	170.7	179.5	3.8	0	0	0	109.5	F145 N152 T153 S154 V156	F145-D149 WeakPolarHBondContact O-CB 3.47Å; F145-D149 PolarHBondContact O-N 2.8Å; D149-N152 WeakPolarHBondContact OD1-CA 3.42Å; D149-N152 PolarHBondContact OD1-N 2.98Å; D149-T153 PolarHBondContact OD1-N 2.97Å; D149-S154 WeakPolarHBondContact OD2-CA 3.35Å; D149-S154 PolarHBondContact OD2-N 3.28Å; D149-V156 HydrophobicContact CB-CG2 4.12Å
150	S	80.6	Confident	83.8	Confident	89 Å²	89	61.6 Å²	61.6	62%	0.622	33%	0.328	S	S	*	.	S	Bend	trans	-92.1	-24.8	-170.8	-62.2	0	0	0	0	111.2	I148 E160	I148-S150 VanDerWaalsContact C-N 3.32Å; I148-S150 PolarHBondContact O-N 3.04Å; I148-S150 PolarHBondContact O-OG 3.36Å; S150-E160 WeakPolarHBondContact CA-OE1 3.43Å; S150-E160 WeakPolarHBondContact CB-OE1 3.39Å; S150-E160 PolarHBondContact N-OE1 3.47Å
151	D	82.3	Confident	83.9	Confident	99 Å²	99	57.8 Å²	57.8	53%	0.529	31%	0.31	S	S	.	.	S	Bend	trans	-92	-6.5	173.8	83.2	-3.7	0	0	0	114.3	T153 E160	D151-T153 VanDerWaalsContact C-N 3.33Å; D151-T153 VanDerWaalsContact CG-CG2 3.48Å; D151-T153 WeakPolarHBondContact OD1-CB 3.38Å; D151-T153 WeakPolarHBondContact OD1-CG2 3.34Å; D151-T153 PolarHBondContact OD1-N 2.96Å; D151-T153 PolarHBondContact OD1-OG1 2.99Å; D151-T153 WeakPolarHBondContact OD2-CG2 3.5Å; D151-E160 PolarHBondContact N-OE1 2.84Å
152	N	80.4	Confident	83.9	Confident	116 Å²	116	58 Å²	58	62%	0.62	31%	0.312	S	S	*	.			trans	64.3	32.3	179.3	-68.5	-128.5	0	0	0	112.6	D149 S154	D149-N152 WeakPolarHBondContact OD1-CA 3.42Å; D149-N152 PolarHBondContact OD1-N 2.98Å; N152-S154 PolarHBondContact O-N 3.09Å
153	T	81.3	Confident	83.9	Confident	58 Å²	58	58.1 Å²	58.1	36%	0.356	32%	0.315	S	S	.	.			trans	-78.7	6.8	175.2	56	0	0	0	0	114.1	D149 D151 N155	D149-T153 PolarHBondContact OD1-N 2.97Å; D151-T153 VanDerWaalsContact C-N 3.33Å; D151-T153 VanDerWaalsContact CG-CG2 3.48Å; D151-T153 WeakPolarHBondContact OD1-CB 3.38Å; D151-T153 WeakPolarHBondContact OD1-CG2 3.34Å; D151-T153 PolarHBondContact OD1-N 2.96Å; D151-T153 PolarHBondContact OD1-OG1 2.99Å; D151-T153 WeakPolarHBondContact OD2-CG2 3.5Å; T153-N155 PolarHBondContact O-N 3.01Å; T153-N155 PolarHBondContact O-ND2 3.47Å; T153-N155 PolarHBondContact OG1-O 3.47Å
154	S	82.1	Confident	84	Confident	82 Å²	82	55 Å²	55	57%	0.573	30%	0.301	S	S	*	.	S	Bend	trans	61.6	21.1	179.7	-48	0	0	0	0	113.6	D149 N152	D149-S154 WeakPolarHBondContact OD2-CA 3.35Å; D149-S154 PolarHBondContact OD2-N 3.28Å; N152-S154 PolarHBondContact O-N 3.09Å
155	N	84.6	Confident	83.8	Confident	50 Å²	50	55.9 Å²	55.9	27%	0.267	30%	0.303	S	S	.	.	S	Bend	trans	-152.4	126.5	-177.3	-64.7	-90.5	0	0	0	107.6	K121 L122 T153	K121-N155 HydrophobicContact CB-CB 4.21Å; K121-N155 HydrophobicContact CD-CB 3.86Å; L122-N155 WeakPolarHBondContact O-CA 3.44Å; T153-N155 PolarHBondContact O-N 3.01Å; T153-N155 PolarHBondContact O-ND2 3.47Å; T153-N155 PolarHBondContact OG1-O 3.47Å
156	V	85.5	Confident	83.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	123.2	178.5	165.6	0	0	0	0	109.9	L122 F145 I148 D149 E160 L161	L122-V156 HydrophobicContact CB-CB 4.34Å; L122-V156 PolarHBondContact N-O 3.3Å; L122-V156 PolarHBondContact O-N 2.58Å; F145-V156 HydrophobicContact CD2-CG2 3.78Å; F145-V156 HydrophobicContact CE2-CB 4.3Å; F145-V156 HydrophobicContact CE2-CG2 3.77Å; F145-V156 HydrophobicContact CG-CG2 4.28Å; F145-V156 HydrophobicContact CZ-CG2 4.23Å; I148-V156 HydrophobicContact CB-CG1 4.47Å; I148-V156 HydrophobicContact CB-CG2 3.95Å; I148-V156 HydrophobicContact CG2-CB 4.34Å; I148-V156 HydrophobicContact CG2-CG1 3.5Å; I148-V156 HydrophobicContact CG2-CG2 3.85Å; D149-V156 HydrophobicContact CB-CG2 4.12Å; V156-E160 HydrophobicContact CG1-CB 4.46Å; V156-L161 HydrophobicContact CG1-CB 3.91Å; V156-L161 HydrophobicContact CG1-CD1 3.98Å
157	D	85.3	Confident	83.5	Confident	59 Å²	59	58.2 Å²	58.2	32%	0.316	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	163.9	175.7	107.3	-7.8	0	0	0	112.7	K159 E160 L161	D157-K159 PolarHBondContact O-N 3.41Å; D157-K159 VanDerWaalsContact OD1-CA 3.27Å; D157-K159 WeakPolarHBondContact OD1-CA 3.27Å; D157-K159 VanDerWaalsContact OD1-CB 3.24Å; D157-K159 WeakPolarHBondContact OD1-CB 3.06Å; D157-K159 PolarHBondContact OD1-N 3.04Å; D157-E160 PolarHBondContact N-OE2 3.47Å; D157-E160 PolarHBondContact O-N 3.25Å; D157-E160 PolarHBondContact OD1-N 3.24Å; D157-L161 PolarHBondContact O-N 2.9Å
158	T	80.7	Confident	83.3	Confident	44 Å²	44	59.4 Å²	59.4	27%	0.27	31%	0.314	S	S	.	.	H	α-helix	trans	-60.7	-34	-177.8	-44.4	0	0	0	0	113.1	L108 F111 C162	L108-T158 HydrophobicContact CD2-CG2 3.34Å; F111-T158 HydrophobicContact CB-CG2 4.44Å; F111-T158 HydrophobicContact CD1-CG2 4.32Å; F111-T158 HydrophobicContact CD2-CG2 4.04Å; F111-T158 WeakPolarHBondContact CE1-OG1 3.39Å; F111-T158 HydrophobicContact CE2-CG2 4.41Å; F111-T158 VanDerWaalsContact CE2-N 3.34Å; F111-T158 HydrophobicContact CG-CG2 4.01Å; F111-T158 WeakPolarHBondContact CZ-OG1 3.26Å; T158-C162 WeakPolarHBondContact O-CB 3.26Å; T158-C162 PolarHBondContact O-N 2.86Å; T158-C162 VanDerWaalsContact O-N 3.13Å; T158-C162 PolarHBondContact O-SG 3.48Å
159	K	82.9	Confident	83	Confident	144 Å²	144	60.2 Å²	60.2	63%	0.626	32%	0.318	S	S	*	.	H	α-helix	trans	-74.7	-42.6	179.5	-179.5	-165.6	167	-157.7	0	110.5	D157 C162 D163	D157-K159 PolarHBondContact O-N 3.41Å; D157-K159 VanDerWaalsContact OD1-CA 3.27Å; D157-K159 WeakPolarHBondContact OD1-CA 3.27Å; D157-K159 VanDerWaalsContact OD1-CB 3.24Å; D157-K159 WeakPolarHBondContact OD1-CB 3.06Å; D157-K159 PolarHBondContact OD1-N 3.04Å; K159-C162 CarbonylContact O-C 3.55Å; K159-C162 PolarHBondContact O-N 3.34Å; K159-D163 WeakPolarHBondContact CE-OD2 3.41Å; K159-D163 WeakPolarHBondContact O-CB 3.11Å; K159-D163 PolarHBondContact O-N 3.36Å
160	E	85.9	Confident	82.8	Confident	22 Å²	22	62.7 Å²	62.7	10%	0.103	35%	0.345	C	S	.	.	H	α-helix	trans	-60.4	-46	175.8	-68.3	-175.5	131.8	0	0	111.7	I148 S150 D151 V156 D157 C162 D163 Y164	I148-E160 HydrophobicContact CG2-CB 4.13Å; S150-E160 WeakPolarHBondContact CA-OE1 3.43Å; S150-E160 WeakPolarHBondContact CB-OE1 3.39Å; S150-E160 PolarHBondContact N-OE1 3.47Å; D151-E160 PolarHBondContact N-OE1 2.84Å; V156-E160 HydrophobicContact CG1-CB 4.46Å; D157-E160 PolarHBondContact N-OE2 3.47Å; D157-E160 PolarHBondContact O-N 3.25Å; D157-E160 PolarHBondContact OD1-N 3.24Å; E160-C162 VanDerWaalsContact C-N 3.33Å; E160-C162 PolarHBondContact O-N 3.31Å; E160-D163 PolarHBondContact O-N 2.79Å; E160-Y164 WeakPolarHBondContact O-CB 3.42Å; E160-Y164 PolarHBondContact O-N 2.8Å
161	L	83.8	Confident	82.9	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-59.9	-43.6	175.2	-162.4	74.9	0	0	0	111.3	I107 F111 L122 F127 I148 V156 D157 Y164 F165	I107-L161 HydrophobicContact CG2-CD2 4.36Å; I107-L161 HydrophobicContact CG2-CG 4.44Å; F111-L161 HydrophobicContact CB-CD2 4.16Å; F111-L161 HydrophobicContact CD2-CB 4.3Å; F111-L161 HydrophobicContact CD2-CD2 3.7Å; F111-L161 HydrophobicContact CG-CD2 4.42Å; L122-L161 HydrophobicContact CD1-CD2 4.05Å; F127-L161 HydrophobicContact CE2-CD1 4.2Å; I148-L161 HydrophobicContact CD1-CD1 4.28Å; I148-L161 HydrophobicContact CG2-CD1 4.33Å; V156-L161 HydrophobicContact CG1-CB 3.91Å; V156-L161 HydrophobicContact CG1-CD1 3.98Å; D157-L161 PolarHBondContact O-N 2.9Å; L161-Y164 PolarHBondContact O-N 3.24Å; L161-F165 HydrophobicContact CD1-CD2 4.22Å; L161-F165 HydrophobicContact CD1-CE2 3.8Å; L161-F165 HydrophobicContact CD2-CE2 4.47Å; L161-F165 HydrophobicContact CG-CD2 3.95Å; L161-F165 HydrophobicContact CG-CE2 3.94Å; L161-F165 WeakPolarHBondContact O-CD2 3.33Å; L161-F165 PolarHBondContact O-N 3.1Å
162	C	82.8	Confident	82.8	Confident	13 Å²	13	69.2 Å²	69.2	9%	0.088	36%	0.361	C	S	.	.	H	α-helix	trans	-65.5	-44.9	175.3	-75.3	0	0	0	0	113.1	I107 T158 K159 E160 Y164 F165 A166	I107-C162 HydrophobicContact CD1-CB 4.22Å; T158-C162 WeakPolarHBondContact O-CB 3.26Å; T158-C162 PolarHBondContact O-N 2.86Å; T158-C162 VanDerWaalsContact O-N 3.13Å; T158-C162 PolarHBondContact O-SG 3.48Å; K159-C162 CarbonylContact O-C 3.55Å; K159-C162 PolarHBondContact O-N 3.34Å; E160-C162 VanDerWaalsContact C-N 3.33Å; E160-C162 PolarHBondContact O-N 3.31Å; C162-Y164 VanDerWaalsContact C-N 3.27Å; C162-Y164 PolarHBondContact O-N 3.04Å; C162-F165 PolarHBondContact O-N 2.94Å; C162-A166 WeakPolarHBondContact O-CB 3.34Å; C162-A166 PolarHBondContact O-N 2.96Å
163	D	84.3	Confident	83	Confident	77 Å²	77	68.1 Å²	68.1	41%	0.412	35%	0.352	S	S	.	.	H	α-helix	trans	-68.5	-24.7	178.8	-87	-23.8	0	0	0	111.8	K159 E160 K167	K159-D163 WeakPolarHBondContact CE-OD2 3.41Å; K159-D163 WeakPolarHBondContact O-CB 3.11Å; K159-D163 PolarHBondContact O-N 3.36Å; E160-D163 PolarHBondContact O-N 2.79Å; D163-K167 WeakPolarHBondContact O-CD 3.18Å; D163-K167 WeakPolarHBondContact O-CE 3.28Å; D163-K167 VanDerWaalsContact O-CG 3.28Å; D163-K167 WeakPolarHBondContact O-CG 3.09Å; D163-K167 PolarHBondContact O-NZ 3.13Å
164	Y	85.5	Confident	83	Confident	46 Å²	46	67.6 Å²	67.6	18%	0.18	36%	0.358	C	S	.	.	H	α-helix	trans	-73.7	-60.4	169	-177.8	-91.8	0	0	0	110.9	L144 T147 I148 E160 L161 C162 A166 K167 H168	L144-Y164 HydrophobicContact CD1-CE1 4.1Å; L144-Y164 HydrophobicContact CD1-CE2 4.2Å; L144-Y164 VanDerWaalsContact CD1-OH 3.27Å; L144-Y164 WeakPolarHBondContact CD1-OH 2.84Å; T147-Y164 HydrophobicContact CG2-CE2 4.2Å; I148-Y164 HydrophobicContact CD1-CD1 4.29Å; I148-Y164 HydrophobicContact CD1-CG 4.38Å; I148-Y164 HydrophobicContact CG1-CD1 4.04Å; I148-Y164 HydrophobicContact CG1-CD2 3.68Å; I148-Y164 HydrophobicContact CG1-CE1 4.46Å; I148-Y164 HydrophobicContact CG1-CE2 4.13Å; I148-Y164 HydrophobicContact CG1-CG 3.65Å; E160-Y164 WeakPolarHBondContact O-CB 3.42Å; E160-Y164 PolarHBondContact O-N 2.8Å; L161-Y164 PolarHBondContact O-N 3.24Å; C162-Y164 VanDerWaalsContact C-N 3.27Å; C162-Y164 PolarHBondContact O-N 3.04Å; Y164-A166 VanDerWaalsContact C-N 3.28Å; Y164-A166 PolarHBondContact O-N 2.67Å; Y164-K167 WeakPolarHBondContact O-CB 3.42Å; Y164-K167 PolarHBondContact O-N 3.06Å; Y164-H168 AromaticContact CD1-CD2 3.97Å; Y164-H168 AromaticContact CD2-CD2 3.71Å; Y164-H168 HydrophobicContact CE1-CB 4.26Å; Y164-H168 AromaticContact CE1-CD2 3.68Å; Y164-H168 AromaticContact CE2-CD2 3.42Å; Y164-H168 VanDerWaalsContact CE2-CD2 3.42Å; Y164-H168 WeakPolarHBondContact CE2-CD2 3.07Å; Y164-H168 AromaticContact CE2-NE2 3.5Å; Y164-H168 AromaticContact CG-CD2 3.96Å; Y164-H168 AromaticContact CZ-CD2 3.39Å; Y164-H168 AromaticContact CZ-CG 3.96Å; Y164-H168 AromaticContact CZ-NE2 3.77Å; Y164-H168 PolarHBondContact O-CD2 3.13Å; Y164-H168 VanDerWaalsContact O-CD2 3.3Å; Y164-H168 PolarHBondContact O-N 2.84Å
165	F	82.3	Confident	83.2	Confident	60 Å²	60	67.2 Å²	67.2	26%	0.263	35%	0.353	S	S	.	.	H	α-helix	trans	-60.4	-36.5	-177.2	-82	-69.4	0	0	0	112.4	I107 F131 L161 C162 K167 H168 M169	I107-F165 HydrophobicContact CD1-CB 4.01Å; I107-F165 HydrophobicContact CG1-CB 4.39Å; I107-F165 HydrophobicContact CG2-CB 4.34Å; I107-F165 HydrophobicContact CG2-CD2 3.91Å; I107-F165 HydrophobicContact CG2-CG 4.44Å; F131-F165 HydrophobicContact CE1-CE2 4.38Å; F131-F165 HydrophobicContact CE1-CZ 4.09Å; F131-F165 HydrophobicContact CZ-CE2 4.45Å; L161-F165 HydrophobicContact CD1-CD2 4.22Å; L161-F165 HydrophobicContact CD1-CE2 3.8Å; L161-F165 HydrophobicContact CD2-CE2 4.47Å; L161-F165 HydrophobicContact CG-CD2 3.95Å; L161-F165 HydrophobicContact CG-CE2 3.94Å; L161-F165 WeakPolarHBondContact O-CD2 3.33Å; L161-F165 PolarHBondContact O-N 3.1Å; C162-F165 PolarHBondContact O-N 2.94Å; F165-K167 PolarHBondContact O-N 3.12Å; F165-H168 CarbonylContact O-C 3.57Å; F165-H168 PolarHBondContact O-N 3.31Å; F165-M169 HydrophobicContact CB-CE 4.35Å; F165-M169 VanDerWaalsContact O-CG 3.32Å; F165-M169 WeakPolarHBondContact O-CG 3.39Å; F165-M169 PolarHBondContact O-N 3.24Å
166	A	81.3	Confident	83.2	Confident	18 Å²	18	66.5 Å²	66.5	15%	0.149	35%	0.349	C	S	.	.	H	α-helix	trans	-63.4	-11.7	174.5	0	0	0	0	0	114.6	R101 C162 Y164	R101-A166 PolarHBondContact NH1-O 3.37Å; C162-A166 WeakPolarHBondContact O-CB 3.34Å; C162-A166 PolarHBondContact O-N 2.96Å; Y164-A166 VanDerWaalsContact C-N 3.28Å; Y164-A166 PolarHBondContact O-N 2.67Å
167	K	82.9	Confident	83.2	Confident	148 Å²	148	67.3 Å²	67.3	64%	0.643	36%	0.355	S	S	*	.	H	α-helix	trans	-97.2	-22.3	169.3	-62.2	165.5	-167.3	127.4	0	112.6	D163 Y164 F165	D163-K167 WeakPolarHBondContact O-CD 3.18Å; D163-K167 WeakPolarHBondContact O-CE 3.28Å; D163-K167 VanDerWaalsContact O-CG 3.28Å; D163-K167 WeakPolarHBondContact O-CG 3.09Å; D163-K167 PolarHBondContact O-NZ 3.13Å; Y164-K167 WeakPolarHBondContact O-CB 3.42Å; Y164-K167 PolarHBondContact O-N 3.06Å; F165-K167 PolarHBondContact O-N 3.12Å
168	H	82.8	Confident	83.2	Confident	114 Å²	114	68.1 Å²	68.1	53%	0.528	37%	0.365	S	S	.	.	H	α-helix	trans	-113.7	-5.2	-168.5	-71.6	-71.8	0	0	0	115.7	Y164 F165 G170	Y164-H168 AromaticContact CD1-CD2 3.97Å; Y164-H168 AromaticContact CD2-CD2 3.71Å; Y164-H168 HydrophobicContact CE1-CB 4.26Å; Y164-H168 AromaticContact CE1-CD2 3.68Å; Y164-H168 AromaticContact CE2-CD2 3.42Å; Y164-H168 VanDerWaalsContact CE2-CD2 3.42Å; Y164-H168 WeakPolarHBondContact CE2-CD2 3.07Å; Y164-H168 AromaticContact CE2-NE2 3.5Å; Y164-H168 AromaticContact CG-CD2 3.96Å; Y164-H168 AromaticContact CZ-CD2 3.39Å; Y164-H168 AromaticContact CZ-CG 3.96Å; Y164-H168 AromaticContact CZ-NE2 3.77Å; Y164-H168 PolarHBondContact O-CD2 3.13Å; Y164-H168 VanDerWaalsContact O-CD2 3.3Å; Y164-H168 PolarHBondContact O-N 2.84Å; F165-H168 CarbonylContact O-C 3.57Å; F165-H168 PolarHBondContact O-N 3.31Å; H168-G170 VanDerWaalsContact C-N 3.34Å; H168-G170 PolarHBondContact O-N 3.45Å
169	M	78.8	Confident	83.5	Confident	20 Å²	20	70 Å²	70	10%	0.099	37%	0.373	C	S	.	.			trans	-56.7	-39.6	177.5	-80.9	173.7	-165.6	0	0	114.7	I107 F165 D171 Y172 E173 L176	I107-M169 HydrophobicContact CD1-CE 3.42Å; I107-M169 VanDerWaalsContact CD1-CE 3.42Å; I107-M169 HydrophobicContact CG1-CE 3.65Å; F165-M169 HydrophobicContact CB-CE 4.35Å; F165-M169 VanDerWaalsContact O-CG 3.32Å; F165-M169 WeakPolarHBondContact O-CG 3.39Å; F165-M169 PolarHBondContact O-N 3.24Å; M169-D171 PolarHBondContact O-N 3.41Å; M169-Y172 WeakPolarHBondContact O-CB 3.35Å; M169-Y172 PolarHBondContact O-N 3.02Å; M169-Y172 VanDerWaalsContact O-N 3.15Å; M169-E173 HydrophobicContact CB-CB 4.19Å; M169-E173 HydrophobicContact SD-CB 4.22Å; M169-E173 HydrophobicContact SD-CG 4.37Å; M169-L176 HydrophobicContact CE-CD1 3.71Å; M169-L176 HydrophobicContact CG-CD1 3.73Å; M169-L176 HydrophobicContact SD-CD1 3.65Å
170	G	82.6	Confident	83.6	Confident	57 Å²	57	64.6 Å²	64.6	59%	0.588	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	-134.6	-171.4	0	0	0	0	0	112.2	H168 Y172 E173	H168-G170 VanDerWaalsContact C-N 3.34Å; H168-G170 PolarHBondContact O-N 3.45Å; G170-Y172 PolarHBondContact O-N 3.44Å; G170-E173 WeakPolarHBondContact O-CB 3.44Å; G170-E173 PolarHBondContact O-N 3.28Å
171	D	82.2	Confident	83.7	Confident	161 Å²	161	67 Å²	67	86%	0.861	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-18.3	-179.1	-60.5	-49.8	0	0	0	114.1	M169 E173	M169-D171 PolarHBondContact O-N 3.41Å; D171-E173 VanDerWaalsContact C-N 3.26Å; D171-E173 PolarHBondContact O-N 3.43Å
172	Y	81.1	Confident	83.8	Confident	164 Å²	164	70.4 Å²	70.4	64%	0.643	39%	0.385	S	S	*	.	H	α-helix	trans	-72.7	-12.3	175	-66.3	-80.3	0	0	0	113.9	M169 G170 G174 V175 L176	M169-Y172 WeakPolarHBondContact O-CB 3.35Å; M169-Y172 PolarHBondContact O-N 3.02Å; M169-Y172 VanDerWaalsContact O-N 3.15Å; G170-Y172 PolarHBondContact O-N 3.44Å; Y172-G174 VanDerWaalsContact C-N 3.26Å; Y172-G174 PolarHBondContact O-N 3.39Å; Y172-V175 HydrophobicContact CD1-CG2 4.35Å; Y172-V175 WeakPolarHBondContact O-CB 3.37Å; Y172-V175 PolarHBondContact O-N 3.16Å; Y172-L176 WeakPolarHBondContact O-CG 3.39Å; Y172-L176 PolarHBondContact O-N 3.16Å
173	E	83.9	Confident	84	Confident	92 Å²	92	72.9 Å²	72.9	43%	0.43	40%	0.397	S	S	.	.	H	α-helix	trans	-55.6	-43.6	174.9	-176.4	176.2	-159.4	0	0	110.9	M169 G170 D171 V175 L176 A177	M169-E173 HydrophobicContact CB-CB 4.19Å; M169-E173 HydrophobicContact SD-CB 4.22Å; M169-E173 HydrophobicContact SD-CG 4.37Å; G170-E173 WeakPolarHBondContact O-CB 3.44Å; G170-E173 PolarHBondContact O-N 3.28Å; D171-E173 VanDerWaalsContact C-N 3.26Å; D171-E173 PolarHBondContact O-N 3.43Å; E173-V175 VanDerWaalsContact C-N 3.32Å; E173-V175 PolarHBondContact O-N 2.91Å; E173-L176 PolarHBondContact O-N 3.27Å; E173-A177 VanDerWaalsContact O-CB 3.24Å; E173-A177 WeakPolarHBondContact O-CB 3.47Å; E173-A177 PolarHBondContact O-N 2.98Å
174	G	82.7	Confident	84	Confident	47 Å²	47	73.3 Å²	73.3	49%	0.485	40%	0.399	S	S	.	.	H	α-helix	trans	-65.1	-32.7	176.6	0	0	0	0	0	113.7	Y172 S178	Y172-G174 VanDerWaalsContact C-N 3.26Å; Y172-G174 PolarHBondContact O-N 3.39Å; G174-S178 WeakPolarHBondContact O-CB 3.41Å; G174-S178 PolarHBondContact O-N 3.22Å; G174-S178 VanDerWaalsContact O-N 3.15Å; G174-S178 PolarHBondContact O-OG 2.83Å
175	V	85.9	Confident	84.1	Confident	75 Å²	75	74 Å²	74	46%	0.455	41%	0.41	S	S	.	.	H	α-helix	trans	-71.6	-47.4	176.7	-177.1	0	0	0	0	110.2	Y172 E173 S178 L179	Y172-V175 HydrophobicContact CD1-CG2 4.35Å; Y172-V175 WeakPolarHBondContact O-CB 3.37Å; Y172-V175 PolarHBondContact O-N 3.16Å; E173-V175 VanDerWaalsContact C-N 3.32Å; E173-V175 PolarHBondContact O-N 2.91Å; V175-S178 WeakPolarHBondContact O-CB 3.44Å; V175-S178 PolarHBondContact O-N 2.99Å; V175-S178 VanDerWaalsContact O-N 3.15Å; V175-L179 HydrophobicContact CG1-CD1 4.21Å; V175-L179 WeakPolarHBondContact O-CG 3.41Å; V175-L179 PolarHBondContact O-N 2.89Å
176	L	85	Confident	84.3	Confident	35 Å²	35	73.9 Å²	73.9	18%	0.183	41%	0.412	C	S	.	.	H	α-helix	trans	-67.6	-39.9	-178.9	-65.1	167.4	0	0	0	111.8	V106 M169 Y172 E173 S178 L179 E180	V106-L176 HydrophobicContact CB-CD2 4Å; V106-L176 HydrophobicContact CG1-CD2 3.7Å; V106-L176 HydrophobicContact CG2-CD2 4.41Å; M169-L176 HydrophobicContact CE-CD1 3.71Å; M169-L176 HydrophobicContact CG-CD1 3.73Å; M169-L176 HydrophobicContact SD-CD1 3.65Å; Y172-L176 WeakPolarHBondContact O-CG 3.39Å; Y172-L176 PolarHBondContact O-N 3.16Å; E173-L176 PolarHBondContact O-N 3.27Å; L176-S178 VanDerWaalsContact C-N 3.29Å; L176-S178 PolarHBondContact O-N 3.31Å; L176-L179 HydrophobicContact CD2-CD1 4.42Å; L176-L179 PolarHBondContact O-N 3.07Å; L176-E180 WeakPolarHBondContact O-CB 3.38Å; L176-E180 PolarHBondContact O-N 3.35Å
177	A	84.3	Confident	84.6	Confident	16 Å²	16	77.2 Å²	77.2	13%	0.132	43%	0.427	C	S	.	.	H	α-helix	trans	-61.9	-34.6	171.1	0	0	0	0	0	112.9	R102 E173 T181	R102-A177 HydrophobicContact CB-CB 3.49Å; R102-A177 VanDerWaalsContact CB-CB 3.49Å; E173-A177 VanDerWaalsContact O-CB 3.24Å; E173-A177 WeakPolarHBondContact O-CB 3.47Å; E173-A177 PolarHBondContact O-N 2.98Å; A177-T181 WeakPolarHBondContact O-CB 3.32Å; A177-T181 PolarHBondContact O-N 2.78Å; A177-T181 PolarHBondContact O-OG1 3.03Å
178	S	86	Confident	84.7	Confident	76 Å²	76	78.6 Å²	78.6	53%	0.531	43%	0.428	S	S	.	.	H	α-helix	trans	-71.3	-40.5	175	-61.3	0	0	0	0	111.8	G174 V175 L176 T181 L182	G174-S178 WeakPolarHBondContact O-CB 3.41Å; G174-S178 PolarHBondContact O-N 3.22Å; G174-S178 VanDerWaalsContact O-N 3.15Å; G174-S178 PolarHBondContact O-OG 2.83Å; V175-S178 WeakPolarHBondContact O-CB 3.44Å; V175-S178 PolarHBondContact O-N 2.99Å; V175-S178 VanDerWaalsContact O-N 3.15Å; L176-S178 VanDerWaalsContact C-N 3.29Å; L176-S178 PolarHBondContact O-N 3.31Å; S178-T181 PolarHBondContact O-N 3.06Å; S178-L182 WeakPolarHBondContact O-CB 3.23Å; S178-L182 PolarHBondContact O-N 2.92Å
179	L	85.8	Confident	84.9	Confident	83 Å²	83	75.4 Å²	75.4	44%	0.435	42%	0.421	S	S	.	.	H	α-helix	trans	-65.2	-40.8	175.2	-72.1	169.9	0	0	0	112.4	V106 V175 L176 L182 N183	V106-L179 HydrophobicContact CG2-CB 4.29Å; V175-L179 HydrophobicContact CG1-CD1 4.21Å; V175-L179 WeakPolarHBondContact O-CG 3.41Å; V175-L179 PolarHBondContact O-N 2.89Å; L176-L179 HydrophobicContact CD2-CD1 4.42Å; L176-L179 PolarHBondContact O-N 3.07Å; L179-L182 PolarHBondContact O-N 2.92Å; L179-N183 WeakPolarHBondContact O-CB 3.36Å; L179-N183 PolarHBondContact O-N 2.74Å
180	E	85.4	Confident	85.2	Confident	31 Å²	31	75.9 Å²	75.9	15%	0.145	42%	0.423	C	S	.	.	H	α-helix	trans	-61.2	-45.8	172.5	-178.2	177.3	-100.3	0	0	111.5	R102 G103 S105 V106 L176 L182 N183 L184	R102-E180 VanDerWaalsContact CA-OE2 3.23Å; R102-E180 WeakPolarHBondContact CA-OE2 3.44Å; G103-E180 PolarHBondContact N-OE1 3.42Å; G103-E180 PolarHBondContact N-OE2 2.94Å; S105-E180 WeakPolarHBondContact CB-OE1 3.29Å; S105-E180 PolarHBondContact N-OE1 3.39Å; V106-E180 HydrophobicContact CG2-CB 4.33Å; L176-E180 WeakPolarHBondContact O-CB 3.38Å; L176-E180 PolarHBondContact O-N 3.35Å; E180-L182 VanDerWaalsContact C-N 3.33Å; E180-L182 PolarHBondContact O-N 2.83Å; E180-N183 PolarHBondContact O-N 2.97Å; E180-L184 HydrophobicContact CG-CD1 4.4Å; E180-L184 WeakPolarHBondContact O-CG 3.17Å; E180-L184 PolarHBondContact O-N 2.99Å
181	T	87.4	Confident	85.5	Confident	74 Å²	74	76.9 Å²	76.9	45%	0.454	42%	0.415	S	S	.	.	H	α-helix	trans	-62.2	-39.2	176.1	-58.6	0	0	0	0	112	A177 S178 S185	A177-T181 WeakPolarHBondContact O-CB 3.32Å; A177-T181 PolarHBondContact O-N 2.78Å; A177-T181 PolarHBondContact O-OG1 3.03Å; S178-T181 PolarHBondContact O-N 3.06Å; T181-S185 WeakPolarHBondContact O-CB 3.33Å; T181-S185 PolarHBondContact O-N 2.82Å; T181-S185 VanDerWaalsContact O-N 3.09Å; T181-S185 PolarHBondContact O-OG 3.1Å
182	L	87.1	Confident	85.8	Confident	72 Å²	72	74.6 Å²	74.6	38%	0.377	40%	0.398	S	S	.	.	H	α-helix	trans	-65.3	-47.2	174.9	176.9	60.6	0	0	0	111.2	S178 L179 E180 L184 S185 I186	S178-L182 WeakPolarHBondContact O-CB 3.23Å; S178-L182 PolarHBondContact O-N 2.92Å; L179-L182 PolarHBondContact O-N 2.92Å; E180-L182 VanDerWaalsContact C-N 3.33Å; E180-L182 PolarHBondContact O-N 2.83Å; L182-L184 PolarHBondContact O-N 3.03Å; L182-S185 WeakPolarHBondContact O-CB 3.12Å; L182-S185 PolarHBondContact O-N 3.34Å; L182-S185 VanDerWaalsContact O-N 3.1Å; L182-I186 HydrophobicContact CD1-CD1 3.99Å; L182-I186 HydrophobicContact CD1-CG1 4.25Å; L182-I186 HydrophobicContact CG-CD1 3.86Å; L182-I186 WeakPolarHBondContact O-CG1 3.4Å; L182-I186 PolarHBondContact O-N 2.99Å
183	N	85.9	Confident	86.1	Confident	64 Å²	64	67.2 Å²	67.2	34%	0.342	37%	0.37	S	S	.	.	H	α-helix	trans	-59.5	-48.5	178.6	-169.4	16.3	0	0	0	111.6	L179 E180 S185 I186 L187	L179-N183 WeakPolarHBondContact O-CB 3.36Å; L179-N183 PolarHBondContact O-N 2.74Å; E180-N183 PolarHBondContact O-N 2.97Å; N183-S185 PolarHBondContact O-N 2.85Å; N183-I186 PolarHBondContact O-N 3.48Å; N183-I186 VanDerWaalsContact O-N 3.16Å; N183-L187 WeakPolarHBondContact O-CG 3.33Å; N183-L187 PolarHBondContact O-N 2.88Å
184	L	84.3	Confident	86.5	Confident	87 Å²	87	67.2 Å²	67.2	46%	0.455	37%	0.368	S	S	.	.	H	α-helix	trans	-59.2	-34.5	174.6	-70.3	172.1	0	0	0	112.7	E180 L182 R188	E180-L184 HydrophobicContact CG-CD1 4.4Å; E180-L184 WeakPolarHBondContact O-CG 3.17Å; E180-L184 PolarHBondContact O-N 2.99Å; L182-L184 PolarHBondContact O-N 3.03Å; L184-R188 WeakPolarHBondContact O-CD 3.45Å; L184-R188 VanDerWaalsContact O-CG 3.26Å; L184-R188 WeakPolarHBondContact O-CG 3.48Å; L184-R188 PolarHBondContact O-N 2.88Å; L184-R188 VanDerWaalsContact O-N 3.16Å
185	S	88.4	Confident	86.8	Confident	59 Å²	59	71 Å²	71	41%	0.413	37%	0.368	S	S	.	.	H	α-helix	trans	-71.8	-40.1	176.4	-59.2	0	0	0	0	112.2	T181 L182 N183 R188 A189	T181-S185 WeakPolarHBondContact O-CB 3.33Å; T181-S185 PolarHBondContact O-N 2.82Å; T181-S185 VanDerWaalsContact O-N 3.09Å; T181-S185 PolarHBondContact O-OG 3.1Å; L182-S185 WeakPolarHBondContact O-CB 3.12Å; L182-S185 PolarHBondContact O-N 3.34Å; L182-S185 VanDerWaalsContact O-N 3.1Å; N183-S185 PolarHBondContact O-N 2.85Å; S185-R188 PolarHBondContact O-N 3.29Å; S185-A189 WeakPolarHBondContact O-CB 3.49Å; S185-A189 PolarHBondContact O-N 2.74Å
186	I	87.1	Confident	87	Confident	59 Å²	59	68 Å²	68	30%	0.303	35%	0.35	S	S	.	.	H	α-helix	trans	-63.9	-43.7	174.3	-67	162.5	0	0	0	110.7	L182 N183 R188 A189 M190 I219	L182-I186 HydrophobicContact CD1-CD1 3.99Å; L182-I186 HydrophobicContact CD1-CG1 4.25Å; L182-I186 HydrophobicContact CG-CD1 3.86Å; L182-I186 WeakPolarHBondContact O-CG1 3.4Å; L182-I186 PolarHBondContact O-N 2.99Å; N183-I186 PolarHBondContact O-N 3.48Å; N183-I186 VanDerWaalsContact O-N 3.16Å; I186-R188 VanDerWaalsContact C-N 3.35Å; I186-R188 PolarHBondContact O-N 3.34Å; I186-A189 CarbonylContact O-C 3.54Å; I186-A189 WeakPolarHBondContact O-CA 3.45Å; I186-A189 WeakPolarHBondContact O-CB 3.49Å; I186-A189 PolarHBondContact O-N 3.09Å; I186-A189 VanDerWaalsContact O-N 3.1Å; I186-M190 HydrophobicContact CG2-CG 4.43Å; I186-M190 WeakPolarHBondContact O-CG 3.36Å; I186-M190 PolarHBondContact O-N 3.43Å; I186-I219 HydrophobicContact CD1-CD1 3.58Å; I186-I219 HydrophobicContact CG1-CD1 4.34Å
187	L	86.1	Confident	87	Confident	88 Å²	88	70 Å²	70	46%	0.461	36%	0.356	S	S	.	.	H	α-helix	trans	-60.6	-42.6	176.5	-70.4	170.1	0	0	0	111.8	N183 A189 M190 D191	N183-L187 WeakPolarHBondContact O-CG 3.33Å; N183-L187 PolarHBondContact O-N 2.88Å; L187-A189 VanDerWaalsContact C-N 3.32Å; L187-A189 PolarHBondContact O-N 3.1Å; L187-M190 WeakPolarHBondContact O-CB 3.33Å; L187-M190 PolarHBondContact O-N 3.49Å; L187-D191 PolarHBondContact O-N 3.36Å
188	R	86.1	Confident	87.3	Confident	177 Å²	177	75.2 Å²	75.2	67%	0.668	38%	0.377	S	S	*	.	H	α-helix	trans	-63.1	-36.2	173.2	-70.7	167	-178.7	177.8	1.7	112.4	L184 S185 I186 F192	L184-R188 WeakPolarHBondContact O-CD 3.45Å; L184-R188 VanDerWaalsContact O-CG 3.26Å; L184-R188 WeakPolarHBondContact O-CG 3.48Å; L184-R188 PolarHBondContact O-N 2.88Å; L184-R188 VanDerWaalsContact O-N 3.16Å; S185-R188 PolarHBondContact O-N 3.29Å; I186-R188 VanDerWaalsContact C-N 3.35Å; I186-R188 PolarHBondContact O-N 3.34Å; R188-F192 WeakPolarHBondContact O-CB 3.41Å; R188-F192 PolarHBondContact O-N 2.92Å
189	A	86.1	Confident	87.4	Confident	46 Å²	46	82.2 Å²	82.2	38%	0.38	39%	0.392	S	S	.	.	H	α-helix	trans	-71.6	-34.1	175.4	0	0	0	0	0	113	S185 I186 L187 F192 T193	S185-A189 WeakPolarHBondContact O-CB 3.49Å; S185-A189 PolarHBondContact O-N 2.74Å; I186-A189 CarbonylContact O-C 3.54Å; I186-A189 WeakPolarHBondContact O-CA 3.45Å; I186-A189 WeakPolarHBondContact O-CB 3.49Å; I186-A189 PolarHBondContact O-N 3.09Å; I186-A189 VanDerWaalsContact O-N 3.1Å; L187-A189 VanDerWaalsContact C-N 3.32Å; L187-A189 PolarHBondContact O-N 3.1Å; A189-F192 PolarHBondContact O-N 3.29Å; A189-T193 WeakPolarHBondContact O-CB 3.45Å; A189-T193 PolarHBondContact O-N 2.91Å; A189-T193 PolarHBondContact O-OG1 3.15Å
190	M	86.2	Confident	87.5	Confident	30 Å²	30	79.1 Å²	79.1	15%	0.148	38%	0.381	C	S	.	.	H	α-helix	trans	-62.4	-48.4	170.8	-72.9	-81.1	97.3	0	0	111.2	I66 M70 I186 L187 F192 T193 K194 L212	I66-M190 HydrophobicContact CD1-CE 4.34Å; I66-M190 HydrophobicContact CD1-SD 4.43Å; I66-M190 HydrophobicContact CG1-SD 4.33Å; M70-M190 HydrophobicContact CE-CB 3.76Å; I186-M190 HydrophobicContact CG2-CG 4.43Å; I186-M190 WeakPolarHBondContact O-CG 3.36Å; I186-M190 PolarHBondContact O-N 3.43Å; L187-M190 WeakPolarHBondContact O-CB 3.33Å; L187-M190 PolarHBondContact O-N 3.49Å; M190-F192 VanDerWaalsContact C-N 3.34Å; M190-F192 PolarHBondContact O-N 2.88Å; M190-T193 WeakPolarHBondContact O-CB 3.41Å; M190-T193 PolarHBondContact O-N 2.76Å; M190-T193 VanDerWaalsContact O-N 3.13Å; M190-K194 PolarHBondContact O-N 3.15Å; M190-L212 HydrophobicContact CE-CD1 3.34Å; M190-L212 HydrophobicContact CE-CD2 3.64Å; M190-L212 HydrophobicContact CE-CG 4.15Å
191	D	87.7	Confident	87.9	Confident	79 Å²	79	81.5 Å²	81.5	42%	0.422	40%	0.397	S	S	.	.	H	α-helix	trans	-59.8	-41.8	175.7	-105.1	11.3	0	0	0	112.8	L187 R195	L187-D191 PolarHBondContact O-N 3.36Å; D191-R195 WeakPolarHBondContact O-CG 3.39Å; D191-R195 VanDerWaalsContact O-CZ 3.29Å; D191-R195 PolarHBondContact O-N 3.4Å; D191-R195 PolarHBondContact O-NE 3.07Å; D191-R195 IonicContact OD2-NH1 2.8Å
192	F	88.8	Confident	87.9	Confident	112 Å²	112	84.1 Å²	84.1	49%	0.491	41%	0.409	S	S	.	.	H	α-helix	trans	-63.3	-45.1	172	175.1	-97.2	0	0	0	111.4	R188 A189 M190 K194 R195 V196	R188-F192 WeakPolarHBondContact O-CB 3.41Å; R188-F192 PolarHBondContact O-N 2.92Å; A189-F192 PolarHBondContact O-N 3.29Å; M190-F192 VanDerWaalsContact C-N 3.34Å; M190-F192 PolarHBondContact O-N 2.88Å; F192-K194 VanDerWaalsContact C-N 3.33Å; F192-K194 PolarHBondContact O-N 2.92Å; F192-R195 PolarHBondContact O-N 3.05Å; F192-R195 VanDerWaalsContact O-N 3.13Å; F192-V196 HydrophobicContact CD1-CG2 4.14Å; F192-V196 HydrophobicContact CD2-CG2 4.34Å; F192-V196 HydrophobicContact CE1-CG2 3.64Å; F192-V196 HydrophobicContact CE2-CG2 3.87Å; F192-V196 HydrophobicContact CG-CG2 4.46Å; F192-V196 HydrophobicContact CZ-CG2 3.5Å; F192-V196 VanDerWaalsContact CZ-CG2 3.5Å; F192-V196 WeakPolarHBondContact O-CG2 3.39Å; F192-V196 PolarHBondContact O-N 3.32Å
193	T	88.9	Confident	88.2	Confident	10 Å²	10	85.6 Å²	85.6	6%	0.061	42%	0.42	C	S	.	.	H	α-helix	trans	-56.4	-46.6	178.9	-64.1	0	0	0	0	111.5	A189 M190 V196 Y197 T208 L212	A189-T193 WeakPolarHBondContact O-CB 3.45Å; A189-T193 PolarHBondContact O-N 2.91Å; A189-T193 PolarHBondContact O-OG1 3.15Å; M190-T193 WeakPolarHBondContact O-CB 3.41Å; M190-T193 PolarHBondContact O-N 2.76Å; M190-T193 VanDerWaalsContact O-N 3.13Å; T193-V196 PolarHBondContact O-N 3.42Å; T193-Y197 HydrophobicContact CG2-CD2 4.08Å; T193-Y197 HydrophobicContact CG2-CE2 3.94Å; T193-Y197 WeakPolarHBondContact O-CD2 3.41Å; T193-Y197 PolarHBondContact O-N 3.38Å; T193-T208 HydrophobicContact CG2-CG2 3.72Å; T193-T208 WeakPolarHBondContact OG1-CG2 3.26Å; T193-L212 HydrophobicContact CG2-CD2 4.34Å
194	K	90.4	Very high	88.2	Confident	91 Å²	91	87 Å²	87	40%	0.396	43%	0.425	S	S	.	.	H	α-helix	trans	-56.7	-51.5	174.5	175.2	173.2	173.1	-178.4	0	111.8	M70 M190 F192 V196 Y197 E198	M70-K194 HydrophobicContact CE-CB 4.45Å; M70-K194 HydrophobicContact SD-CB 4.25Å; M70-K194 HydrophobicContact SD-CD 3.61Å; M70-K194 HydrophobicContact SD-CG 4.49Å; M190-K194 PolarHBondContact O-N 3.15Å; F192-K194 VanDerWaalsContact C-N 3.33Å; F192-K194 PolarHBondContact O-N 2.92Å; K194-V196 VanDerWaalsContact C-N 3.29Å; K194-V196 PolarHBondContact O-N 3.4Å; K194-Y197 PolarHBondContact O-N 2.91Å; K194-Y197 VanDerWaalsContact O-N 3.12Å; K194-E198 WeakPolarHBondContact CE-OE1 3.48Å; K194-E198 HydrophobicContact CG-CG 4.32Å; K194-E198 IonicContact NZ-OE1 2.68Å; K194-E198 WeakPolarHBondContact O-CG 3.24Å; K194-E198 PolarHBondContact O-N 3.15Å
195	R	90	Very high	88.4	Confident	126 Å²	126	84.3 Å²	84.3	48%	0.475	41%	0.41	S	S	.	.	H	α-helix	trans	-59.7	-37.1	-179.5	-71.1	-177.9	-71.2	-98.9	3.8	112.8	D191 F192 R199	D191-R195 WeakPolarHBondContact O-CG 3.39Å; D191-R195 VanDerWaalsContact O-CZ 3.29Å; D191-R195 PolarHBondContact O-N 3.4Å; D191-R195 PolarHBondContact O-NE 3.07Å; D191-R195 IonicContact OD2-NH1 2.8Å; F192-R195 PolarHBondContact O-N 3.05Å; F192-R195 VanDerWaalsContact O-N 3.13Å; R195-R199 WeakPolarHBondContact O-CB 3.41Å; R195-R199 PolarHBondContact O-N 3.05Å; R195-R199 VanDerWaalsContact O-N 3.1Å
196	V	89.4	Confident	88.5	Confident	14 Å²	14	88 Å²	88	9%	0.085	42%	0.419	C	S	.	.	H	α-helix	trans	-71.7	-35.1	176.3	175.9	0	0	0	0	112.4	F192 T193 K194 G200 E204 Q205	F192-V196 HydrophobicContact CD1-CG2 4.14Å; F192-V196 HydrophobicContact CD2-CG2 4.34Å; F192-V196 HydrophobicContact CE1-CG2 3.64Å; F192-V196 HydrophobicContact CE2-CG2 3.87Å; F192-V196 HydrophobicContact CG-CG2 4.46Å; F192-V196 HydrophobicContact CZ-CG2 3.5Å; F192-V196 VanDerWaalsContact CZ-CG2 3.5Å; F192-V196 WeakPolarHBondContact O-CG2 3.39Å; F192-V196 PolarHBondContact O-N 3.32Å; T193-V196 PolarHBondContact O-N 3.42Å; K194-V196 VanDerWaalsContact C-N 3.29Å; K194-V196 PolarHBondContact O-N 3.4Å; V196-G200 WeakPolarHBondContact O-CA 3.45Å; V196-G200 PolarHBondContact O-N 3.42Å; V196-E204 HydrophobicContact CG1-CB 3.72Å; V196-Q205 HydrophobicContact CG1-CG 4.08Å
197	Y	86.6	Confident	88.7	Confident	77 Å²	77	88.3 Å²	88.3	30%	0.302	42%	0.423	S	S	.	.	H	α-helix	trans	-70.5	-36.4	173.5	-89.8	-118.6	0	0	0	112.9	V63 T193 K194 Q205 R209	V63-Y197 HydrophobicContact CG2-CE1 4.24Å; T193-Y197 HydrophobicContact CG2-CD2 4.08Å; T193-Y197 HydrophobicContact CG2-CE2 3.94Å; T193-Y197 WeakPolarHBondContact O-CD2 3.41Å; T193-Y197 PolarHBondContact O-N 3.38Å; K194-Y197 PolarHBondContact O-N 2.91Å; K194-Y197 VanDerWaalsContact O-N 3.12Å; Y197-Q205 HydrophobicContact CD2-CG 4.41Å; Y197-R209 VanDerWaalsContact CE1-NH2 3.25Å; Y197-R209 HydrophobicContact CE2-CG 4.28Å; Y197-R209 WeakPolarHBondContact OH-CG 3.39Å; Y197-R209 PolarHBondContact OH-NE 3.04Å
198	E	90.1	Very high	88.9	Confident	124 Å²	124	84.5 Å²	84.5	58%	0.579	40%	0.404	S	S	*	.	H	α-helix	trans	-74.6	-29.1	179.6	-71	173.5	162.5	0	0	113.3	K194	K194-E198 WeakPolarHBondContact CE-OE1 3.48Å; K194-E198 HydrophobicContact CG-CG 4.32Å; K194-E198 IonicContact NZ-OE1 2.68Å; K194-E198 WeakPolarHBondContact O-CG 3.24Å; K194-E198 PolarHBondContact O-N 3.15Å
199	R	87.8	Confident	88.9	Confident	223 Å²	223	80.9 Å²	80.9	84%	0.842	39%	0.39	S	S	*	.	H	α-helix	trans	-140.6	-9.1	-165.3	-57.2	178.1	65.4	172.4	-0.5	115.9	R195	R195-R199 WeakPolarHBondContact O-CB 3.41Å; R195-R199 PolarHBondContact O-N 3.05Å; R195-R199 VanDerWaalsContact O-N 3.1Å
200	G	88.1	Confident	89.1	Confident	19 Å²	19	84.1 Å²	84.1	20%	0.196	40%	0.396	C	S	.	.	S	Bend	trans	-97.7	160.9	-175.3	0	0	0	0	0	114	V196 Q205	V196-G200 WeakPolarHBondContact O-CA 3.45Å; V196-G200 PolarHBondContact O-N 3.42Å; G200-Q205 PolarHBondContact O-NE2 3.27Å
201	T	92.6	Very high	89.3	Confident	80 Å²	80	87.2 Å²	87.2	49%	0.491	41%	0.412	S	S	.	.			trans	-68	162.5	178.8	64.4	0	0	0	0	112.8	V203 E204 Q205	T201-V203 PolarHBondContact O-N 3.43Å; T201-V203 VanDerWaalsContact O-N 3.13Å; T201-E204 VanDerWaalsContact CB-OE2 3.27Å; T201-E204 WeakPolarHBondContact CB-OE2 3.41Å; T201-E204 WeakPolarHBondContact CG2-OE2 3.43Å; T201-E204 PolarHBondContact N-OE2 3.03Å; T201-E204 PolarHBondContact O-N 3.08Å; T201-E204 VanDerWaalsContact O-N 3.16Å; T201-E204 WeakPolarHBondContact OG1-CG 3.36Å; T201-E204 PolarHBondContact OG1-N 3.27Å; T201-E204 PolarHBondContact OG1-OE2 3.28Å; T201-Q205 WeakPolarHBondContact O-CG 3.33Å; T201-Q205 PolarHBondContact O-N 2.95Å
202	N	88.6	Confident	89.4	Confident	130 Å²	130	85.5 Å²	85.5	70%	0.695	40%	0.403	S	S	*	.	H	α-helix	trans	-55	-31.5	174.9	-70.9	-54.6	0	0	0	113.4	F206	N202-F206 WeakPolarHBondContact O-CB 3.41Å; N202-F206 PolarHBondContact O-N 3.27Å
203	V	92.4	Very high	89.3	Confident	102 Å²	102	86.9 Å²	86.9	62%	0.618	41%	0.409	S	S	*	.	H	α-helix	trans	-73.6	-46.4	178.2	-178.2	0	0	0	0	110.8	T201 Q205 F206 V207	T201-V203 PolarHBondContact O-N 3.43Å; T201-V203 VanDerWaalsContact O-N 3.13Å; V203-Q205 VanDerWaalsContact C-N 3.31Å; V203-Q205 PolarHBondContact O-N 3.49Å; V203-F206 WeakPolarHBondContact O-CB 3.45Å; V203-F206 PolarHBondContact O-N 2.99Å; V203-F206 VanDerWaalsContact O-N 3.13Å; V203-V207 WeakPolarHBondContact O-CG2 3.43Å; V203-V207 PolarHBondContact O-N 2.93Å
204	E	86.6	Confident	89.4	Confident	95 Å²	95	89.5 Å²	89.5	44%	0.444	42%	0.42	S	S	.	.	H	α-helix	trans	-63	-39.3	176.2	-67.7	161.3	115.7	0	0	111.4	V196 T201 V207 T208	V196-E204 HydrophobicContact CG1-CB 3.72Å; T201-E204 VanDerWaalsContact CB-OE2 3.27Å; T201-E204 WeakPolarHBondContact CB-OE2 3.41Å; T201-E204 WeakPolarHBondContact CG2-OE2 3.43Å; T201-E204 PolarHBondContact N-OE2 3.03Å; T201-E204 PolarHBondContact O-N 3.08Å; T201-E204 VanDerWaalsContact O-N 3.16Å; T201-E204 WeakPolarHBondContact OG1-CG 3.36Å; T201-E204 PolarHBondContact OG1-N 3.27Å; T201-E204 PolarHBondContact OG1-OE2 3.28Å; E204-V207 PolarHBondContact O-N 3.24Å; E204-T208 VanDerWaalsContact O-CB 3.25Å; E204-T208 WeakPolarHBondContact O-CB 3.38Å; E204-T208 PolarHBondContact O-N 3.28Å; E204-T208 PolarHBondContact O-OG1 3.05Å
205	Q	88.1	Confident	89.3	Confident	30 Å²	30	88.2 Å²	88.2	14%	0.14	42%	0.423	C	S	.	.	H	α-helix	trans	-63.4	-38.9	172.5	-68	179.9	28.9	0	0	112.4	V196 Y197 G200 T201 V203 R209	V196-Q205 HydrophobicContact CG1-CG 4.08Å; Y197-Q205 HydrophobicContact CD2-CG 4.41Å; G200-Q205 PolarHBondContact O-NE2 3.27Å; T201-Q205 WeakPolarHBondContact O-CG 3.33Å; T201-Q205 PolarHBondContact O-N 2.95Å; V203-Q205 VanDerWaalsContact C-N 3.31Å; V203-Q205 PolarHBondContact O-N 3.49Å; Q205-R209 WeakPolarHBondContact O-CB 3.19Å; Q205-R209 WeakPolarHBondContact O-CD 3.48Å; Q205-R209 WeakPolarHBondContact O-CG 3.45Å; Q205-R209 PolarHBondContact O-N 2.68Å
206	F	90.7	Very high	89.1	Confident	135 Å²	135	84.8 Å²	84.8	59%	0.592	42%	0.421	S	S	*	.	H	α-helix	trans	-64.4	-48.8	174.1	169.9	-94.6	0	0	0	112	N202 V203 T208 R209 F210	N202-F206 WeakPolarHBondContact O-CB 3.41Å; N202-F206 PolarHBondContact O-N 3.27Å; V203-F206 WeakPolarHBondContact O-CB 3.45Å; V203-F206 PolarHBondContact O-N 2.99Å; V203-F206 VanDerWaalsContact O-N 3.13Å; F206-T208 VanDerWaalsContact C-N 3.28Å; F206-T208 PolarHBondContact O-N 3.13Å; F206-R209 WeakPolarHBondContact O-CB 3.45Å; F206-R209 PolarHBondContact O-N 3.19Å; F206-F210 PolarHBondContact O-N 3.45Å
207	V	91.8	Very high	89.1	Confident	67 Å²	67	87.2 Å²	87.2	41%	0.406	43%	0.434	S	S	.	.	H	α-helix	trans	-59.5	-41.8	176.9	172.2	0	0	0	0	110.6	V203 E204 F210 L211	V203-V207 WeakPolarHBondContact O-CG2 3.43Å; V203-V207 PolarHBondContact O-N 2.93Å; E204-V207 PolarHBondContact O-N 3.24Å; V207-F210 PolarHBondContact O-N 3.43Å; V207-L211 HydrophobicContact CG1-CD1 3.82Å; V207-L211 HydrophobicContact CG1-CG 4.28Å; V207-L211 WeakPolarHBondContact O-CB 3.41Å; V207-L211 WeakPolarHBondContact O-CG 3.29Å; V207-L211 PolarHBondContact O-N 3.09Å
208	T	89.4	Confident	89.3	Confident	7 Å²	7	88.6 Å²	88.6	4%	0.043	44%	0.443	C	S	.	.	H	α-helix	trans	-63.9	-43	176.5	-58.7	0	0	0	0	112	T193 E204 F206 F210 L211 L212	T193-T208 HydrophobicContact CG2-CG2 3.72Å; T193-T208 WeakPolarHBondContact OG1-CG2 3.26Å; E204-T208 VanDerWaalsContact O-CB 3.25Å; E204-T208 WeakPolarHBondContact O-CB 3.38Å; E204-T208 PolarHBondContact O-N 3.28Å; E204-T208 PolarHBondContact O-OG1 3.05Å; F206-T208 VanDerWaalsContact C-N 3.28Å; F206-T208 PolarHBondContact O-N 3.13Å; T208-F210 VanDerWaalsContact C-N 3.33Å; T208-F210 PolarHBondContact O-N 3.07Å; T208-L211 PolarHBondContact O-N 3.47Å; T208-L212 VanDerWaalsContact O-CB 3.28Å; T208-L212 WeakPolarHBondContact O-CB 3.49Å; T208-L212 PolarHBondContact O-N 2.93Å
209	R	86.1	Confident	89.3	Confident	101 Å²	101	85.8 Å²	85.8	38%	0.381	43%	0.431	S	S	.	.	H	α-helix	trans	-59.6	-42.9	173.4	-75.1	161.4	-171	137	14.3	111.8	Y197 Q205 F206 K213	Y197-R209 VanDerWaalsContact CE1-NH2 3.25Å; Y197-R209 HydrophobicContact CE2-CG 4.28Å; Y197-R209 WeakPolarHBondContact OH-CG 3.39Å; Y197-R209 PolarHBondContact OH-NE 3.04Å; Q205-R209 WeakPolarHBondContact O-CB 3.19Å; Q205-R209 WeakPolarHBondContact O-CD 3.48Å; Q205-R209 WeakPolarHBondContact O-CG 3.45Å; Q205-R209 PolarHBondContact O-N 2.68Å; F206-R209 WeakPolarHBondContact O-CB 3.45Å; F206-R209 PolarHBondContact O-N 3.19Å; R209-K213 WeakPolarHBondContact O-CB 3.37Å; R209-K213 PolarHBondContact O-N 3.23Å
210	F	90.6	Very high	89.4	Confident	115 Å²	115	80.5 Å²	80.5	50%	0.504	42%	0.416	S	S	.	.	H	α-helix	trans	-64.1	-53.2	177.6	176.2	-94.5	0	0	0	111.7	F206 V207 T208 L212 K213 E214	F206-F210 PolarHBondContact O-N 3.45Å; V207-F210 PolarHBondContact O-N 3.43Å; T208-F210 VanDerWaalsContact C-N 3.33Å; T208-F210 PolarHBondContact O-N 3.07Å; F210-L212 VanDerWaalsContact C-N 3.33Å; F210-L212 PolarHBondContact O-N 2.99Å; F210-K213 PolarHBondContact O-N 3.32Å; F210-E214 WeakPolarHBondContact O-CB 3.46Å; F210-E214 PolarHBondContact O-N 3.41Å
211	L	91.3	Very high	89.5	Confident	94 Å²	94	83.1 Å²	83.1	49%	0.492	43%	0.431	S	S	.	.	H	α-helix	trans	-61.8	-38.5	-179	-70	173.4	0	0	0	112.7	V207 T208 S215	V207-L211 HydrophobicContact CG1-CD1 3.82Å; V207-L211 HydrophobicContact CG1-CG 4.28Å; V207-L211 WeakPolarHBondContact O-CB 3.41Å; V207-L211 WeakPolarHBondContact O-CG 3.29Å; V207-L211 PolarHBondContact O-N 3.09Å; T208-L211 PolarHBondContact O-N 3.47Å; L211-S215 VanDerWaalsContact O-CB 3.31Å; L211-S215 WeakPolarHBondContact O-CB 3.45Å; L211-S215 PolarHBondContact O-N 3.47Å; L211-S215 PolarHBondContact O-OG 2.89Å
212	L	88.4	Confident	89.4	Confident	43 Å²	43	84.8 Å²	84.8	23%	0.225	44%	0.437	C	S	.	.	H	α-helix	trans	-67.1	-45.8	175.3	175.9	58.2	0	0	0	111.8	I66 M190 T193 T208 F210 E214 S215 A216	I66-L212 HydrophobicContact CD1-CD2 4.46Å; M190-L212 HydrophobicContact CE-CD1 3.34Å; M190-L212 HydrophobicContact CE-CD2 3.64Å; M190-L212 HydrophobicContact CE-CG 4.15Å; T193-L212 HydrophobicContact CG2-CD2 4.34Å; T208-L212 VanDerWaalsContact O-CB 3.28Å; T208-L212 WeakPolarHBondContact O-CB 3.49Å; T208-L212 PolarHBondContact O-N 2.93Å; F210-L212 VanDerWaalsContact C-N 3.33Å; F210-L212 PolarHBondContact O-N 2.99Å; L212-E214 VanDerWaalsContact C-N 3.31Å; L212-E214 PolarHBondContact O-N 3.43Å; L212-S215 PolarHBondContact O-N 2.96Å; L212-A216 PolarHBondContact O-N 3.28Å; L212-A216 VanDerWaalsContact O-N 3.07Å
213	K	88.1	Confident	89.3	Confident	142 Å²	142	82.3 Å²	82.3	62%	0.617	42%	0.423	S	S	*	.	H	α-helix	trans	-59.1	-45.6	175.7	-175.4	-171.3	177.3	-167.7	0	110.7	R209 F210 A216 N217	R209-K213 WeakPolarHBondContact O-CB 3.37Å; R209-K213 PolarHBondContact O-N 3.23Å; F210-K213 PolarHBondContact O-N 3.32Å; K213-A216 WeakPolarHBondContact O-CB 3.32Å; K213-A216 PolarHBondContact O-N 3.03Å; K213-N217 VanDerWaalsContact O-CG 3.22Å; K213-N217 PolarHBondContact O-N 2.99Å; K213-N217 PolarHBondContact O-ND2 3.44Å; K213-N217 PolarHBondContact O-OD1 3.11Å
214	E	90.9	Very high	89.1	Confident	65 Å²	65	80.6 Å²	80.6	30%	0.304	42%	0.416	S	S	.	.	H	α-helix	trans	-68.6	-40.5	-177.6	-168	51.9	-148	0	0	111.8	F210 L212 A216 N217 Q218	F210-E214 WeakPolarHBondContact O-CB 3.46Å; F210-E214 PolarHBondContact O-N 3.41Å; L212-E214 VanDerWaalsContact C-N 3.31Å; L212-E214 PolarHBondContact O-N 3.43Å; E214-A216 VanDerWaalsContact C-N 3.27Å; E214-A216 PolarHBondContact O-N 3.42Å; E214-N217 WeakPolarHBondContact O-CB 3.42Å; E214-N217 PolarHBondContact O-N 2.95Å; E214-N217 VanDerWaalsContact O-N 3.09Å; E214-N217 PolarHBondContact OE2-ND2 3.43Å; E214-Q218 WeakPolarHBondContact O-CG 3.47Å; E214-Q218 PolarHBondContact O-N 3.25Å; E214-Q218 PolarHBondContact OE1-NE2 3.49Å
215	S	87.8	Confident	89.2	Confident	64 Å²	64	80 Å²	80	45%	0.448	42%	0.422	S	S	.	.	H	α-helix	trans	-58.1	-40.2	173.2	-60	0	0	0	0	111.8	L211 L212 Q218 I219	L211-S215 VanDerWaalsContact O-CB 3.31Å; L211-S215 WeakPolarHBondContact O-CB 3.45Å; L211-S215 PolarHBondContact O-N 3.47Å; L211-S215 PolarHBondContact O-OG 2.89Å; L212-S215 PolarHBondContact O-N 2.96Å; S215-Q218 PolarHBondContact O-N 2.91Å; S215-I219 WeakPolarHBondContact O-CD1 3.31Å; S215-I219 VanDerWaalsContact O-CG1 3.25Å; S215-I219 WeakPolarHBondContact O-CG1 3.45Å; S215-I219 PolarHBondContact O-N 3.29Å; S215-I219 VanDerWaalsContact O-N 3.09Å
216	A	86.6	Confident	89.1	Confident	54 Å²	54	82.9 Å²	82.9	45%	0.446	44%	0.441	S	S	.	.	H	α-helix	trans	-66.1	-40.7	173.8	0	0	0	0	0	112.9	L212 K213 E214 Q218 I219 Q220	L212-A216 PolarHBondContact O-N 3.28Å; L212-A216 VanDerWaalsContact O-N 3.07Å; K213-A216 WeakPolarHBondContact O-CB 3.32Å; K213-A216 PolarHBondContact O-N 3.03Å; E214-A216 VanDerWaalsContact C-N 3.27Å; E214-A216 PolarHBondContact O-N 3.42Å; A216-Q218 VanDerWaalsContact C-N 3.34Å; A216-Q218 PolarHBondContact O-N 3.12Å; A216-I219 PolarHBondContact O-N 2.84Å; A216-Q220 WeakPolarHBondContact O-CB 3.27Å; A216-Q220 PolarHBondContact O-N 2.98Å
217	N	88.3	Confident	89	Confident	64 Å²	64	80.9 Å²	80.9	34%	0.342	43%	0.434	S	S	.	.	H	α-helix	trans	-59.8	-43.6	175.2	-62	-24.9	0	0	0	111.8	K213 E214 Q220 S221	K213-N217 VanDerWaalsContact O-CG 3.22Å; K213-N217 PolarHBondContact O-N 2.99Å; K213-N217 PolarHBondContact O-ND2 3.44Å; K213-N217 PolarHBondContact O-OD1 3.11Å; E214-N217 WeakPolarHBondContact O-CB 3.42Å; E214-N217 PolarHBondContact O-N 2.95Å; E214-N217 VanDerWaalsContact O-N 3.09Å; E214-N217 PolarHBondContact OE2-ND2 3.43Å; N217-Q220 PolarHBondContact O-N 2.94Å; N217-S221 PolarHBondContact O-N 3.1Å; N217-S221 PolarHBondContact O-OG 3.3Å
218	Q	90.4	Very high	88.8	Confident	106 Å²	106	81.5 Å²	81.5	50%	0.495	44%	0.441	S	S	.	.	H	α-helix	trans	-67.9	-42.3	-179.5	-63.8	-61.1	-33.2	0	0	111.2	E214 S215 A216 Q220 S221 L222	E214-Q218 WeakPolarHBondContact O-CG 3.47Å; E214-Q218 PolarHBondContact O-N 3.25Å; E214-Q218 PolarHBondContact OE1-NE2 3.49Å; S215-Q218 PolarHBondContact O-N 2.91Å; A216-Q218 VanDerWaalsContact C-N 3.34Å; A216-Q218 PolarHBondContact O-N 3.12Å; Q218-Q220 PolarHBondContact O-N 2.91Å; Q218-S221 WeakPolarHBondContact O-CB 3.36Å; Q218-S221 PolarHBondContact O-N 2.83Å; Q218-L222 WeakPolarHBondContact O-CG 3.25Å; Q218-L222 PolarHBondContact O-N 3.22Å
219	I	90.6	Very high	88.6	Confident	65 Å²	65	83.5 Å²	83.5	33%	0.333	46%	0.459	S	S	.	.	H	α-helix	trans	-62.1	-42.5	174.2	-66.7	161.9	0	0	0	111.2	I186 S215 A216 S221 L222 L223	I186-I219 HydrophobicContact CD1-CD1 3.58Å; I186-I219 HydrophobicContact CG1-CD1 4.34Å; S215-I219 WeakPolarHBondContact O-CD1 3.31Å; S215-I219 VanDerWaalsContact O-CG1 3.25Å; S215-I219 WeakPolarHBondContact O-CG1 3.45Å; S215-I219 PolarHBondContact O-N 3.29Å; S215-I219 VanDerWaalsContact O-N 3.09Å; A216-I219 PolarHBondContact O-N 2.84Å; I219-S221 VanDerWaalsContact C-N 3.3Å; I219-S221 PolarHBondContact O-N 3.09Å; I219-L222 PolarHBondContact O-N 3.17Å; I219-L223 WeakPolarHBondContact O-CB 3.28Å; I219-L223 PolarHBondContact O-N 3.13Å
220	Q	89.1	Confident	88.5	Confident	112 Å²	112	82 Å²	82	52%	0.523	46%	0.461	S	S	.	.	H	α-helix	trans	-65.1	-34.2	177.5	-174.8	61.3	74	0	0	112.6	A216 N217 Q218 S224	A216-Q220 WeakPolarHBondContact O-CB 3.27Å; A216-Q220 PolarHBondContact O-N 2.98Å; N217-Q220 PolarHBondContact O-N 2.94Å; Q218-Q220 PolarHBondContact O-N 2.91Å; Q220-S224 PolarHBondContact O-N 3.16Å
221	S	90.4	Very high	88.2	Confident	74 Å²	74	81.8 Å²	81.8	52%	0.517	47%	0.465	S	S	.	.	H	α-helix	trans	-67.1	-42.3	174.7	-55.2	0	0	0	0	111.8	N217 Q218 I219 S225	N217-S221 PolarHBondContact O-N 3.1Å; N217-S221 PolarHBondContact O-OG 3.3Å; Q218-S221 WeakPolarHBondContact O-CB 3.36Å; Q218-S221 PolarHBondContact O-N 2.83Å; I219-S221 VanDerWaalsContact C-N 3.3Å; I219-S221 PolarHBondContact O-N 3.09Å; S221-S225 PolarHBondContact O-N 3.11Å
222	L	90.1	Very high	87.9	Confident	115 Å²	115	79.7 Å²	79.7	60%	0.602	46%	0.461	S	S	*	.	H	α-helix	trans	-64.8	-42.7	173.7	-69.8	170.8	0	0	0	111.8	Q218 I219 S225 V226	Q218-L222 WeakPolarHBondContact O-CG 3.25Å; Q218-L222 PolarHBondContact O-N 3.22Å; I219-L222 PolarHBondContact O-N 3.17Å; L222-S225 WeakPolarHBondContact O-CB 3.49Å; L222-S225 PolarHBondContact O-N 3.13Å; L222-V226 WeakPolarHBondContact O-CG2 3.25Å; L222-V226 PolarHBondContact O-N 2.63Å; L222-V226 VanDerWaalsContact O-N 3.11Å
223	L	88.6	Confident	87.5	Confident	79 Å²	79	81.9 Å²	81.9	41%	0.414	47%	0.472	S	S	.	.	H	α-helix	trans	-58.9	-49.5	176.8	176.9	57.9	0	0	0	111.2	I219 S225 V226 E227	I219-L223 WeakPolarHBondContact O-CB 3.28Å; I219-L223 PolarHBondContact O-N 3.13Å; L223-S225 PolarHBondContact O-N 3.32Å; L223-V226 PolarHBondContact O-N 2.92Å; L223-E227 HydrophobicContact CD1-CG 3.96Å; L223-E227 HydrophobicContact CG-CG 4.22Å; L223-E227 WeakPolarHBondContact O-CG 3.44Å; L223-E227 PolarHBondContact O-N 2.89Å
224	S	87.4	Confident	87	Confident	66 Å²	66	79.7 Å²	79.7	46%	0.462	47%	0.467	S	S	.	.	H	α-helix	trans	-61	-31.8	177.6	180	0	0	0	0	113.1	Q220 V226 E227 S228	Q220-S224 PolarHBondContact O-N 3.16Å; S224-V226 VanDerWaalsContact C-N 3.34Å; S224-E227 WeakPolarHBondContact CA-OE2 3.4Å; S224-S228 WeakPolarHBondContact O-CB 3.34Å; S224-S228 PolarHBondContact O-N 3.45Å; S224-S228 VanDerWaalsContact O-N 3.12Å
225	S	88.1	Confident	86.4	Confident	82 Å²	82	82.7 Å²	82.7	57%	0.573	48%	0.481	S	S	*	.	H	α-helix	trans	-71.4	-26.7	173.8	-173.6	0	0	0	0	113.4	S221 L222 L223	S221-S225 PolarHBondContact O-N 3.11Å; L222-S225 WeakPolarHBondContact O-CB 3.49Å; L222-S225 PolarHBondContact O-N 3.13Å; L223-S225 PolarHBondContact O-N 3.32Å
226	V	87.3	Confident	85.5	Confident	90 Å²	90	86.7 Å²	86.7	55%	0.545	49%	0.493	S	S	.	.	H	α-helix	trans	-84.5	-43.2	175.9	174.1	0	0	0	0	110.5	L222 L223 S224 S228 A229 V230	L222-V226 WeakPolarHBondContact O-CG2 3.25Å; L222-V226 PolarHBondContact O-N 2.63Å; L222-V226 VanDerWaalsContact O-N 3.11Å; L223-V226 PolarHBondContact O-N 2.92Å; S224-V226 VanDerWaalsContact C-N 3.34Å; V226-S228 VanDerWaalsContact C-N 3.35Å; V226-S228 PolarHBondContact O-N 3.5Å; V226-A229 WeakPolarHBondContact O-CA 3.35Å; V226-A229 WeakPolarHBondContact O-CB 3.46Å; V226-A229 PolarHBondContact O-N 2.77Å; V226-V230 PolarHBondContact O-N 2.7Å
227	E	88.6	Confident	84.2	Confident	93 Å²	93	89.1 Å²	89.1	44%	0.435	49%	0.494	S	S	.	.	H	α-helix	trans	-53.5	-50.8	173.9	-70.7	169.2	150.9	0	0	110.6	L223 S224 A229 V230 D231	L223-E227 HydrophobicContact CD1-CG 3.96Å; L223-E227 HydrophobicContact CG-CG 4.22Å; L223-E227 WeakPolarHBondContact O-CG 3.44Å; L223-E227 PolarHBondContact O-N 2.89Å; S224-E227 WeakPolarHBondContact CA-OE2 3.4Å; E227-A229 PolarHBondContact O-N 3.43Å; E227-A229 VanDerWaalsContact O-N 3.13Å; E227-V230 PolarHBondContact O-N 2.73Å; E227-V230 VanDerWaalsContact O-N 3.09Å; E227-D231 PolarHBondContact O-N 2.93Å
228	S	86.6	Confident	82.6	Confident	80 Å²	80	89 Å²	89	56%	0.559	51%	0.508	S	S	*	.	H	α-helix	trans	-64.5	-17.2	176.7	-176.9	0	0	0	0	114.6	S224 V226 A232	S224-S228 WeakPolarHBondContact O-CB 3.34Å; S224-S228 PolarHBondContact O-N 3.45Å; S224-S228 VanDerWaalsContact O-N 3.12Å; V226-S228 VanDerWaalsContact C-N 3.35Å; V226-S228 PolarHBondContact O-N 3.5Å; S228-A232 WeakPolarHBondContact O-CB 3.49Å
229	A	84.7	Confident	80.7	Confident	50 Å²	50	90 Å²	90	41%	0.413	51%	0.513	S	S	.	.	H	α-helix	trans	-86.1	-35.1	173.9	0	0	0	0	0	111.6	V226 E227 I233	V226-A229 WeakPolarHBondContact O-CA 3.35Å; V226-A229 WeakPolarHBondContact O-CB 3.46Å; V226-A229 PolarHBondContact O-N 2.77Å; E227-A229 PolarHBondContact O-N 3.43Å; E227-A229 VanDerWaalsContact O-N 3.13Å; A229-I233 WeakPolarHBondContact O-CD1 3.45Å; A229-I233 VanDerWaalsContact O-CG1 3.29Å; A229-I233 WeakPolarHBondContact O-CG1 3.41Å; A229-I233 PolarHBondContact O-N 2.98Å
230	V	85.6	Confident	78.5	Confident	70 Å²	70	91.3 Å²	91.3	42%	0.424	53%	0.528	S	S	.	.	H	α-helix	trans	-66.4	-50.9	171.8	176.8	0	0	0	0	110.2	V226 E227 A232 I233 D234	V226-V230 PolarHBondContact O-N 2.7Å; E227-V230 PolarHBondContact O-N 2.73Å; E227-V230 VanDerWaalsContact O-N 3.09Å; V230-A232 PolarHBondContact O-N 3.09Å; V230-A232 VanDerWaalsContact O-N 3.1Å; V230-I233 WeakPolarHBondContact O-CA 3.05Å; V230-I233 WeakPolarHBondContact O-CB 3.44Å; V230-I233 PolarHBondContact O-N 2.7Å; V230-D234 PolarHBondContact O-N 3.24Å
231	D	84.2	Confident	76.5	Confident	109 Å²	109	89 Å²	89	58%	0.583	53%	0.534	S	S	*	.	H	α-helix	trans	-51.4	-39.5	176.6	-70.5	-24.7	0	0	0	112	E227 E235	E227-D231 PolarHBondContact O-N 2.93Å; D231-E235 PolarHBondContact O-N 2.83Å
232	A	83.1	Confident	74	Confident	51 Å²	51	93.6 Å²	93.6	42%	0.421	55%	0.547	S	S	.	.	H	α-helix	trans	-72.6	-32.6	178.5	0	0	0	0	0	113.4	S228 V230 Q236	S228-A232 WeakPolarHBondContact O-CB 3.49Å; V230-A232 PolarHBondContact O-N 3.09Å; V230-A232 VanDerWaalsContact O-N 3.1Å; A232-Q236 WeakPolarHBondContact O-CG 3.48Å; A232-Q236 PolarHBondContact O-N 2.96Å
233	I	80.6	Confident	71.5	Confident	89 Å²	89	97 Å²	97	46%	0.456	56%	0.56	S	S	.	*	H	α-helix	trans	-70.1	-40.5	173.7	-70.8	163.9	0	0	0	110.1	A229 V230 Q236 H237	A229-I233 WeakPolarHBondContact O-CD1 3.45Å; A229-I233 VanDerWaalsContact O-CG1 3.29Å; A229-I233 WeakPolarHBondContact O-CG1 3.41Å; A229-I233 PolarHBondContact O-N 2.98Å; V230-I233 WeakPolarHBondContact O-CA 3.05Å; V230-I233 WeakPolarHBondContact O-CB 3.44Å; V230-I233 PolarHBondContact O-N 2.7Å; I233-Q236 WeakPolarHBondContact O-CB 3.49Å; I233-Q236 PolarHBondContact O-N 3.49Å; I233-H237 PolarHBondContact O-N 2.79Å; I233-H237 VanDerWaalsContact O-N 3.11Å; I233-H237 PolarHBondContact O-ND1 3.01Å
234	D	77.8	Confident	69.1	Low	95 Å²	95	99.2 Å²	99.2	51%	0.508	58%	0.579	S	S	.	*	H	α-helix	trans	-67.5	-41.4	179.2	-65	-7.1	0	0	0	111.1	V230 Q236 H237 G238	V230-D234 PolarHBondContact O-N 3.24Å; D234-Q236 VanDerWaalsContact C-N 3.33Å; D234-Q236 PolarHBondContact O-N 3.34Å; D234-H237 PolarHBondContact O-N 3.37Å; D234-G238 PolarHBondContact O-N 3.27Å
235	E	79.4	Confident	66.7	Low	129 Å²	129	99.8 Å²	99.8	60%	0.603	59%	0.588	S	S	*	*	H	α-helix	trans	-63.3	-36.8	174.1	-167.4	-179.1	-176.9	0	0	112.2	D231 Q239	D231-E235 PolarHBondContact O-N 2.83Å; E235-Q239 WeakPolarHBondContact O-CG 3.33Å; E235-Q239 PolarHBondContact O-N 2.88Å; E235-Q239 PolarHBondContact OE1-NE2 3.38Å
236	Q	67.7	Low	64.5	Low	148 Å²	148	105.5 Å²	105.5	69%	0.692	60%	0.602	S	S	*	*	H	α-helix	trans	-62.1	-44.8	174.4	-66	-97.1	-77.7	0	0	111.6	A232 I233 D234 Q239	A232-Q236 WeakPolarHBondContact O-CG 3.48Å; A232-Q236 PolarHBondContact O-N 2.96Å; I233-Q236 WeakPolarHBondContact O-CB 3.49Å; I233-Q236 PolarHBondContact O-N 3.49Å; D234-Q236 VanDerWaalsContact C-N 3.33Å; D234-Q236 PolarHBondContact O-N 3.34Å; Q236-Q239 PolarHBondContact O-N 3.03Å
237	H	60	Low	61.9	Low	104 Å²	104	107.4 Å²	107.4	48%	0.481	61%	0.614	S	S	.	*	H	α-helix	trans	-68.1	-42.4	179.5	-73.9	88.5	0	0	0	111.8	I233 D234 Q239 S240	I233-H237 PolarHBondContact O-N 2.79Å; I233-H237 VanDerWaalsContact O-N 3.11Å; I233-H237 PolarHBondContact O-ND1 3.01Å; D234-H237 PolarHBondContact O-N 3.37Å; H237-Q239 VanDerWaalsContact C-N 3.26Å; H237-Q239 PolarHBondContact O-N 3.17Å; H237-S240 WeakPolarHBondContact O-CB 3.46Å; H237-S240 PolarHBondContact O-N 2.9Å; H237-S240 VanDerWaalsContact O-N 3.08Å; H237-S240 PolarHBondContact O-OG 2.8Å
238	G	54.7	Low	59.2	Low	61 Å²	61	108.1 Å²	108.1	63%	0.629	63%	0.629	S	S	*	*	H	α-helix	trans	-59	-31.5	177.3	0	0	0	0	0	114.5	D234	D234-G238 PolarHBondContact O-N 3.27Å
239	Q	50.2	Low	57	Low	128 Å²	128	109.6 Å²	109.6	60%	0.598	64%	0.637	S	S	*	*	H	α-helix	trans	-80.2	-15.9	177.7	-67.3	-175.6	28.6	0	0	114	E235 Q236 H237 G241	E235-Q239 WeakPolarHBondContact O-CG 3.33Å; E235-Q239 PolarHBondContact O-N 2.88Å; E235-Q239 PolarHBondContact OE1-NE2 3.38Å; Q236-Q239 PolarHBondContact O-N 3.03Å; H237-Q239 VanDerWaalsContact C-N 3.26Å; H237-Q239 PolarHBondContact O-N 3.17Å; Q239-G241 VanDerWaalsContact C-N 3.27Å; Q239-G241 PolarHBondContact O-N 3.2Å
240	S	45	Very low	54.4	Low	92 Å²	92	118.7 Å²	118.7	64%	0.643	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-24.9	-175.6	71.2	0	0	0	0	114.3	H237 H242	H237-S240 WeakPolarHBondContact O-CB 3.46Å; H237-S240 PolarHBondContact O-N 2.9Å; H237-S240 VanDerWaalsContact O-N 3.08Å; H237-S240 PolarHBondContact O-OG 2.8Å; S240-H242 VanDerWaalsContact C-N 3.32Å; S240-H242 PolarHBondContact O-N 2.89Å
241	G	46.2	Very low	51.9	Low	63 Å²	63	123.5 Å²	123.5	65%	0.649	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-2.1	-173.2	0	0	0	0	0	116.8	Q239	Q239-G241 VanDerWaalsContact C-N 3.27Å; Q239-G241 PolarHBondContact O-N 3.2Å
242	H	38.7	Very low	49.8	Very low	172 Å²	172	123.4 Å²	123.4	80%	0.796	69%	0.685	S	S	*	*			trans	-126.5	76.4	-172.9	-84.4	79.1	0	0	0	114.3	S240	S240-H242 VanDerWaalsContact C-N 3.32Å; S240-H242 PolarHBondContact O-N 2.89Å
243	Q	37.7	Very low	47.1	Very low	185 Å²	185	126.6 Å²	126.6	86%	0.864	70%	0.695	S	S	*	*			trans	-107.5	118	161.1	-77	-160.5	26.7	0	0	113.1
244	P	38.6	Very low	44.7	Very low	127 Å²	127	129 Å²	129	83%	0.825	70%	0.703	S	S	*	*			trans	-103.3	129.1	151.4	33.7	-26	0	0	0	110.5
245	A	36.2	Very low	42.3	Very low	78 Å²	78	133.6 Å²	133.6	65%	0.645	71%	0.713	S	S	*	*			trans	-104.6	150.4	-170.5	0	0	0	0	0	114.8
246	K	42.5	Very low	40	Very low	202 Å²	202	136.1 Å²	136.1	88%	0.878	72%	0.718	S	S	*	*			trans	72.3	158.4	172.7	-45.6	168.1	-179.7	169.5	0	113.4
247	V	31.4	Very low	38.1	Very low	130 Å²	130	136 Å²	136	79%	0.788	72%	0.717	S	S	*	*			cis	-138.3	155.8	12.2	-177.5	0	0	0	0	109.7
248	S	31.5	Very low	36.5	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	73%	0.728	S	S	*	*			trans	-121.4	140	164.9	173	0	0	0	0	111
249	P	40.6	Very low	35.3	Very low	110 Å²	110	140.6 Å²	140.6	71%	0.714	74%	0.736	S	S	*	*			trans	-149.1	126.1	134.4	33.5	-14.6	0	0	0	117.3
250	R	30	Very low	34.3	Very low	242 Å²	242	140.7 Å²	140.7	91%	0.913	75%	0.745	S	S	*	*			trans	49.8	122.4	133	-70.1	-179.1	169.5	156.1	-2.4	123.2
251	M	33.3	Very low	34.2	Very low	170 Å²	170	141.5 Å²	141.5	84%	0.837	75%	0.748	S	S	*	*			trans	-63.4	155.9	145.7	-75.5	-73	-72.8	0	0	112.1
252	P	41.3	Very low	33.4	Very low	107 Å²	107	145.8 Å²	145.8	70%	0.695	76%	0.756	S	S	*	*				-147.2	-157.4	71.2	43.7	-22.7	0	0	0	112.7
253	D	26.3	Very low	32.7	Very low	118 Å²	118	148.4 Å²	148.4	63%	0.631	76%	0.761	S	S	*	*			cis	-168.1	172.4	-1.1	-130.1	10.4	0	0	0	107.5
254	K	30.7	Very low	33.3	Very low	141 Å²	141	144.7 Å²	144.7	61%	0.613	75%	0.753	S	S	*	*			cis	-170.2	164.9	-15.1	-141.9	-180	-147.2	74.3	0	109.7
255	R	26.6	Very low	33.1	Very low	190 Å²	190	144.8 Å²	144.8	72%	0.717	75%	0.753	S	S	*	*			trans	70.5	151.3	160.2	-62.1	176.2	175.8	149.9	-0.1	117.1
256	Y	30.7	Very low	32.8	Very low	182 Å²	182	148.7 Å²	148.7	71%	0.714	76%	0.763	S	S	*	*			cis	-172.7	-178	-9.4	-98	-10.4	0	0	0	106.9
257	Q	28	Very low	32.1	Very low	145 Å²	145	145.9 Å²	145.9	68%	0.678	76%	0.758	S	S	*	*			cis	-163.9	153.3	3.3	-130.7	170	-106.7	0	0	110.6
258	N	27.2	Very low	31.9	Very low	133 Å²	133	150 Å²	150	71%	0.711	76%	0.76	S	S	*	*			trans	44.2	155.2	148	-61.2	7.9	0	0	0	122.5
259	T	28.2	Very low	31.7	Very low	129 Å²	129	151.6 Å²	151.6	79%	0.791	76%	0.764	S	S	*	*			cis	-155.4	171.2	21.7	-23.2	0	0	0	0	112.1
260	V	29.7	Very low	31	Very low	131 Å²	131	152 Å²	152	79%	0.794	77%	0.77	S	S	*	*			trans	-124.9	157.8	170.1	-139.7	0	0	0	0	109.3
261	P	43.2	Very low	31	Very low	109 Å²	109	144.7 Å²	144.7	71%	0.708	76%	0.761	S	S	*	*				-153.3	162.4	84.6	41.2	-22.9	0	0	0	117.5
262	D	28.3	Very low	30.8	Very low	152 Å²	152	148.6 Å²	148.6	81%	0.813	77%	0.767	S	S	*	*				154.7	153.4	125.9	-92	-6.9	0	0	0	115.9
263	Y	24.9	Very low	30.4	Very low	227 Å²	227	152.5 Å²	152.5	89%	0.89	78%	0.776	S	S	*	*			trans	-169.6	166.4	-178.9	-109.2	-51.4	0	0	0	108.2
264	P	49.3	Very low	30.5	Very low	107 Å²	107	151.5 Å²	151.5	70%	0.695	78%	0.784	S	S	*	*			cis	-119.8	-169.3	-26.7	42	-26.5	0	0	0	110.8
265	P	36.2	Very low	30.4	Very low	129 Å²	129	150.6 Å²	150.6	84%	0.838	79%	0.79	S	S	*	*				-147.5	161.3	86.1	37.7	-19.5	0	0	0	115.9
266	N	29	Very low	30.8	Very low	160 Å²	160	152.6 Å²	152.6	86%	0.856	80%	0.797	S	S	*	*			trans	-96.6	137.9	-178.4	-139.7	-6.5	0	0	0	111.4
267	N	27.2	Very low	30.6	Very low	144 Å²	144	149.6 Å²	149.6	77%	0.77	80%	0.798	S	S	*	*			trans	-173.4	160.3	133.2	-130.6	-40.6	0	0	0	116.7
268	R	28.6	Very low	31	Very low	217 Å²	217	149.9 Å²	149.9	82%	0.819	80%	0.803	S	S	*	*			trans	71.6	89.2	157.6	-69.5	178	176.2	170.7	-1.6	120.5
269	V	27.2	Very low	31	Very low	140 Å²	140	150.5 Å²	150.5	85%	0.848	81%	0.806	S	S	*	*				27.2	117.1	112	-175	0	0	0	0	117.8
270	S	26.1	Very low	31.3	Very low	119 Å²	119	151 Å²	151	83%	0.832	81%	0.809	S	S	*	*				-171.1	170.1	103.7	-155.2	0	0	0	0	112.8
271	A	29	Very low	31.5	Very low	89 Å²	89	149.2 Å²	149.2	74%	0.736	81%	0.808	S	S	*	*			trans	-86.9	164.4	-170.5	0	0	0	0	0	115.1
272	R	29.5	Very low	31.1	Very low	252 Å²	252	150.5 Å²	150.5	95%	0.951	82%	0.819	S	S	*	*			trans	-160.8	149.3	145.1	-111.2	166.1	-166.8	-167.3	1.7	112.2
273	E	33.2	Very low	31	Very low	189 Å²	189	146.9 Å²	146.9	88%	0.883	82%	0.818	S	S	*	*			trans	-98.6	150.3	-176	-59.2	159	108.7	0	0	112.2
274	A	28.4	Very low	31.3	Very low	97 Å²	97	140.8 Å²	140.8	80%	0.802	82%	0.815	S	S	*	*			trans	-153.5	95.7	158.8	0	0	0	0	0	107
275	V	28.3	Very low	30.7	Very low	122 Å²	122	142 Å²	142	74%	0.739	82%	0.82	S	S	*	*				57.3	98.8	80	-175.4	0	0	0	0	112.7
276	R	33.9	Very low	30.4	Very low	231 Å²	231	143.5 Å²	143.5	87%	0.872	82%	0.816	S	S	*	*			trans	37.5	131.3	146.8	-57.9	176.5	-179.6	166.8	-0.1	119.3
277	T	26.7	Very low	30.9	Very low	119 Å²	119	142.6 Å²	142.6	73%	0.73	82%	0.815	S	S	*	*				-163.5	134.9	112.4	-78	0	0	0	0	110.3
278	I	37.1	Very low	31.7	Very low	152 Å²	152	145.4 Å²	145.4	78%	0.779	82%	0.815	S	S	*	*			trans	-85.7	128.2	166.2	-61.6	166.8	0	0	0	107
279	N	27.5	Very low	32.8	Very low	146 Å²	146	144.3 Å²	144.3	78%	0.781	82%	0.816	S	S	*	*			trans	-139.9	115.7	170.4	-96.1	-26.6	0	0	0	110.5
280	T	35	Very low	34.1	Very low	140 Å²	140	143.7 Å²	143.7	86%	0.859	80%	0.804	S	S	*	*			trans	-110.2	97.1	178.5	-52.3	0	0	0	0	109.1
281	A	32.4	Very low	36.1	Very low	93 Å²	93	139.4 Å²	139.4	77%	0.769	78%	0.779	S	S	*	*			trans	-154.3	110.6	175.2	0	0	0	0	0	113.6
282	S	34.9	Very low	38.2	Very low	135 Å²	135	141.6 Å²	141.6	94%	0.944	78%	0.778	S	S	*	*			trans	38.5	99	146.6	-172.1	0	0	0	0	119.6
283	G	27.3	Very low	40.3	Very low	77 Å²	77	136.6 Å²	136.6	79%	0.794	77%	0.765	S	S	*	*			trans	-157.7	137.2	162.1	0	0	0	0	0	110.6
284	A	29.8	Very low	42.5	Very low	98 Å²	98	129.9 Å²	129.9	81%	0.81	74%	0.742	S	S	*	*			trans	-91.2	142	-170.6	0	0	0	0	0	113.5
285	V	37.1	Very low	44.9	Very low	133 Å²	133	129.9 Å²	129.9	81%	0.806	73%	0.725	S	S	*	*			trans	46.8	96.1	156.6	-171.7	0	0	0	0	117.2
286	E	31	Very low	47.4	Very low	161 Å²	161	129 Å²	129	75%	0.752	72%	0.716	S	S	*	*				-139.4	105.5	104.2	-90.9	-143.9	148.2	0	0	109.7	R288	E286-R288 HydrophobicContact CB-CG 4.24Å; E286-R288 PolarHBondContact O-N 3.33Å; E286-R288 WeakPolarHBondContact OE2-CG 3.36Å
287	V	39.8	Very low	49.6	Very low	140 Å²	140	122.6 Å²	122.6	85%	0.848	70%	0.699	S	S	*	*			trans	-76.6	84.1	158.6	-179.8	0	0	0	0	106.2	K289	V287-K289 PolarHBondContact O-N 2.98Å
288	R	43.6	Very low	52.5	Low	203 Å²	203	124 Å²	124	77%	0.766	69%	0.69	S	S	*	*			trans	-59.6	110.8	170.6	-69.4	-166.8	-56.4	146	6.9	107.4	E286 E290	E286-R288 HydrophobicContact CB-CG 4.24Å; E286-R288 PolarHBondContact O-N 3.33Å; E286-R288 WeakPolarHBondContact OE2-CG 3.36Å; R288-E290 VanDerWaalsContact C-N 3.32Å; R288-E290 PolarHBondContact O-N 3.01Å
289	K	50.2	Low	54.4	Low	194 Å²	194	121.3 Å²	121.3	84%	0.843	68%	0.677	S	S	*	*			trans	-63.4	89.6	-178.1	-172.4	175.8	-176.4	175.6	0	109.2	V287 G291	V287-K289 PolarHBondContact O-N 2.98Å; K289-G291 VanDerWaalsContact C-N 3.32Å; K289-G291 PolarHBondContact O-N 2.84Å
290	E	55.5	Low	56.8	Low	127 Å²	127	117 Å²	117	59%	0.593	66%	0.662	S	S	*	*			trans	-54.4	103.8	158.1	-74	-176	-166.9	0	0	105.7	R288 R298	R288-E290 VanDerWaalsContact C-N 3.32Å; R288-E290 PolarHBondContact O-N 3.01Å; E290-R298 IonicContact OE2-NH1 3.79Å
291	G	68.6	Low	58.8	Low	29 Å²	29	115.5 Å²	115.5	30%	0.299	65%	0.645	S	S	.	*			trans	-62.1	156.8	-174.3	0	0	0	0	0	110.6	K289 E293 A294 Q295	K289-G291 VanDerWaalsContact C-N 3.32Å; K289-G291 PolarHBondContact O-N 2.84Å; G291-E293 PolarHBondContact O-N 2.91Å; G291-E293 VanDerWaalsContact O-N 3.08Å; G291-A294 WeakPolarHBondContact O-CA 3.25Å; G291-A294 WeakPolarHBondContact O-CB 3.38Å; G291-A294 PolarHBondContact O-N 2.87Å; G291-Q295 PolarHBondContact O-N 3.46Å
292	L	71.9	Confident	60.7	Low	135 Å²	135	114.8 Å²	114.8	71%	0.707	63%	0.628	S	S	*	*	H	α-helix	trans	-51.4	-36.4	176	-71	168	0	0	0	111.3	Q295 I296	L292-Q295 CarbonylContact O-C 3.54Å; L292-Q295 PolarHBondContact O-N 3.5Å; L292-I296 VanDerWaalsContact O-CB 3.29Å; L292-I296 WeakPolarHBondContact O-CB 3.29Å; L292-I296 WeakPolarHBondContact O-CD1 3.14Å; L292-I296 WeakPolarHBondContact O-CG1 3.38Å; L292-I296 PolarHBondContact O-N 3.14Å
293	E	74.9	Confident	62.5	Low	147 Å²	147	112.5 Å²	112.5	69%	0.687	60%	0.604	S	S	*	*	H	α-helix	trans	-57.8	-45.1	171	-177.5	-178.6	-159.7	0	0	113.8	G291 Q295 I296 N297	G291-E293 PolarHBondContact O-N 2.91Å; G291-E293 VanDerWaalsContact O-N 3.08Å; E293-Q295 VanDerWaalsContact C-N 3.32Å; E293-Q295 PolarHBondContact O-N 3.24Å; E293-I296 PolarHBondContact O-N 2.83Å; E293-N297 VanDerWaalsContact O-CB 3.29Å; E293-N297 WeakPolarHBondContact O-CB 3.29Å; E293-N297 PolarHBondContact O-N 3.43Å; E293-N297 PolarHBondContact O-ND2 2.75Å; E293-N297 VanDerWaalsContact O-ND2 3.14Å
294	A	78.3	Confident	64.4	Low	48 Å²	48	109.7 Å²	109.7	40%	0.397	58%	0.576	S	S	.	*	H	α-helix	trans	-67	-36.2	176.3	0	0	0	0	0	111.5	G291 R298	G291-A294 WeakPolarHBondContact O-CA 3.25Å; G291-A294 WeakPolarHBondContact O-CB 3.38Å; G291-A294 PolarHBondContact O-N 2.87Å; A294-R298 VanDerWaalsContact O-CB 3.25Å; A294-R298 WeakPolarHBondContact O-CB 3.43Å; A294-R298 PolarHBondContact O-N 3.08Å
295	Q	79.9	Confident	65.9	Low	98 Å²	98	110.9 Å²	110.9	46%	0.458	56%	0.559	S	S	.	*	H	α-helix	trans	-69.8	-41	176.2	-140	174.3	1.9	0	0	111.6	G291 L292 E293 R298 L299	G291-Q295 PolarHBondContact O-N 3.46Å; L292-Q295 CarbonylContact O-C 3.54Å; L292-Q295 PolarHBondContact O-N 3.5Å; E293-Q295 VanDerWaalsContact C-N 3.32Å; E293-Q295 PolarHBondContact O-N 3.24Å; Q295-R298 PolarHBondContact O-N 3Å; Q295-L299 WeakPolarHBondContact O-CB 3.42Å; Q295-L299 VanDerWaalsContact O-CG 3.25Å; Q295-L299 WeakPolarHBondContact O-CG 3.49Å; Q295-L299 PolarHBondContact O-N 2.81Å
296	I	79.4	Confident	66.6	Low	104 Å²	104	110 Å²	110	53%	0.533	55%	0.549	S	S	.	.	H	α-helix	trans	-64	-46.7	173.2	-72.7	162	0	0	0	110.5	L292 E293 R298 L299 A300	L292-I296 VanDerWaalsContact O-CB 3.29Å; L292-I296 WeakPolarHBondContact O-CB 3.29Å; L292-I296 WeakPolarHBondContact O-CD1 3.14Å; L292-I296 WeakPolarHBondContact O-CG1 3.38Å; L292-I296 PolarHBondContact O-N 3.14Å; E293-I296 PolarHBondContact O-N 2.83Å; I296-R298 VanDerWaalsContact C-N 3.34Å; I296-R298 PolarHBondContact O-N 2.87Å; I296-L299 CarbonylContact O-C 3.57Å; I296-L299 PolarHBondContact O-N 3.23Å; I296-A300 WeakPolarHBondContact O-CB 3.17Å; I296-A300 PolarHBondContact O-N 2.98Å
297	N	81.4	Confident	67.8	Low	96 Å²	96	109.1 Å²	109.1	51%	0.513	55%	0.545	S	S	.	.	H	α-helix	trans	-63.6	-39.8	177.4	-74.1	-30.5	0	0	0	111.7	E293 A300 E301	E293-N297 VanDerWaalsContact O-CB 3.29Å; E293-N297 WeakPolarHBondContact O-CB 3.29Å; E293-N297 PolarHBondContact O-N 3.43Å; E293-N297 PolarHBondContact O-ND2 2.75Å; E293-N297 VanDerWaalsContact O-ND2 3.14Å; N297-A300 PolarHBondContact O-N 2.6Å; N297-E301 PolarHBondContact O-N 3.15Å
298	R	86.9	Confident	68.2	Low	147 Å²	147	108.2 Å²	108.2	56%	0.555	54%	0.535	S	S	*	.	H	α-helix	trans	-65	-38.9	172.5	178.6	178.7	171.4	-169.7	-3.8	112.4	E290 A294 Q295 I296 E301 L302	E290-R298 IonicContact OE2-NH1 3.79Å; A294-R298 VanDerWaalsContact O-CB 3.25Å; A294-R298 WeakPolarHBondContact O-CB 3.43Å; A294-R298 PolarHBondContact O-N 3.08Å; Q295-R298 PolarHBondContact O-N 3Å; I296-R298 VanDerWaalsContact C-N 3.34Å; I296-R298 PolarHBondContact O-N 2.87Å; R298-E301 PolarHBondContact O-N 2.91Å; R298-L302 HydrophobicContact CG-CD1 4.25Å; R298-L302 WeakPolarHBondContact O-CB 3.46Å; R298-L302 VanDerWaalsContact O-CG 3.27Å; R298-L302 WeakPolarHBondContact O-CG 3.45Å; R298-L302 PolarHBondContact O-N 2.88Å
299	L	77.9	Confident	68.6	Low	96 Å²	96	106.7 Å²	106.7	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-68.9	-38.9	174.8	-75.7	166.7	0	0	0	111.6	Q295 I296 L302 I303	Q295-L299 WeakPolarHBondContact O-CB 3.42Å; Q295-L299 VanDerWaalsContact O-CG 3.25Å; Q295-L299 WeakPolarHBondContact O-CG 3.49Å; Q295-L299 PolarHBondContact O-N 2.81Å; I296-L299 CarbonylContact O-C 3.57Å; I296-L299 PolarHBondContact O-N 3.23Å; L299-L302 PolarHBondContact O-N 2.73Å; L299-I303 WeakPolarHBondContact O-CB 3.45Å; L299-I303 WeakPolarHBondContact O-CD1 3.27Å; L299-I303 VanDerWaalsContact O-CG1 3.23Å; L299-I303 WeakPolarHBondContact O-CG1 3.25Å; L299-I303 PolarHBondContact O-N 3.3Å
300	A	77.7	Confident	68.5	Low	56 Å²	56	100.4 Å²	100.4	46%	0.463	51%	0.512	S	S	.	.	H	α-helix	trans	-65.1	-37.9	173.4	0	0	0	0	0	112	I296 N297 G304	I296-A300 WeakPolarHBondContact O-CB 3.17Å; I296-A300 PolarHBondContact O-N 2.98Å; N297-A300 PolarHBondContact O-N 2.6Å; A300-G304 PolarHBondContact O-N 2.82Å
301	E	75.9	Confident	68.1	Low	109 Å²	109	98.3 Å²	98.3	51%	0.509	51%	0.508	S	S	.	.	H	α-helix	trans	-64.8	-43.1	171	-163.6	-153.4	129.5	0	0	111.4	N297 R298 G304 R305	N297-E301 PolarHBondContact O-N 3.15Å; R298-E301 PolarHBondContact O-N 2.91Å; E301-G304 PolarHBondContact O-N 3.18Å; E301-R305 WeakPolarHBondContact O-CB 3.46Å; E301-R305 WeakPolarHBondContact O-CD 3.39Å; E301-R305 WeakPolarHBondContact O-CG 3.23Å; E301-R305 PolarHBondContact O-N 3.03Å; E301-R305 VanDerWaalsContact OE1-CD 3.29Å; E301-R305 WeakPolarHBondContact OE1-CD 3.37Å; E301-R305 IonicContact OE1-CZ 2.88Å; E301-R305 IonicContact OE1-NE 3.16Å; E301-R305 IonicContact OE1-NH1 3.95Å; E301-R305 PolarHBondContact OE1-NH1 2.92Å
302	L	71.8	Confident	67.1	Low	77 Å²	77	99.5 Å²	99.5	40%	0.403	51%	0.512	S	S	.	.	H	α-helix	trans	-64.5	-44.1	177.2	-75.3	166.6	0	0	0	112.2	R298 L299 R305 L306	R298-L302 HydrophobicContact CG-CD1 4.25Å; R298-L302 WeakPolarHBondContact O-CB 3.46Å; R298-L302 VanDerWaalsContact O-CG 3.27Å; R298-L302 WeakPolarHBondContact O-CG 3.45Å; R298-L302 PolarHBondContact O-N 2.88Å; L299-L302 PolarHBondContact O-N 2.73Å; L302-R305 PolarHBondContact O-N 3.42Å; L302-L306 VanDerWaalsContact O-CG 3.27Å; L302-L306 WeakPolarHBondContact O-CG 3.4Å; L302-L306 PolarHBondContact O-N 3.03Å
303	I	73.3	Confident	65.7	Low	87 Å²	87	100 Å²	100	45%	0.446	51%	0.508	S	S	.	.	H	α-helix	trans	-60.2	-51	173.1	-70.9	163.7	0	0	0	109.5	L299 R305 L306 E307	L299-I303 WeakPolarHBondContact O-CB 3.45Å; L299-I303 WeakPolarHBondContact O-CD1 3.27Å; L299-I303 VanDerWaalsContact O-CG1 3.23Å; L299-I303 WeakPolarHBondContact O-CG1 3.25Å; L299-I303 PolarHBondContact O-N 3.3Å; I303-R305 PolarHBondContact O-N 2.93Å; I303-R305 VanDerWaalsContact O-N 3.15Å; I303-L306 WeakPolarHBondContact O-CB 3.48Å; I303-L306 PolarHBondContact O-N 2.96Å; I303-E307 HydrophobicContact CG2-CG 4.24Å; I303-E307 WeakPolarHBondContact CG2-OE1 3.33Å; I303-E307 WeakPolarHBondContact O-CB 3.27Å; I303-E307 WeakPolarHBondContact O-CG 3.45Å; I303-E307 PolarHBondContact O-N 3.48Å
304	G	68.6	Low	64.4	Low	19 Å²	19	96.8 Å²	96.8	20%	0.196	50%	0.496	C	S	.	.	H	α-helix	trans	-58.8	-29	177.2	0	0	0	0	0	113.9	A300 E301 N308	A300-G304 PolarHBondContact O-N 2.82Å; E301-G304 PolarHBondContact O-N 3.18Å; G304-N308 WeakPolarHBondContact O-CB 3.47Å; G304-N308 PolarHBondContact O-N 2.94Å; G304-N308 PolarHBondContact O-ND2 3.46Å
305	R	59.5	Low	63.1	Low	123 Å²	123	96.3 Å²	96.3	46%	0.464	49%	0.487	S	S	.	.	H	α-helix	trans	-81	-32.6	174.3	-72.6	165.5	66.1	155	3.2	113.4	E301 L302 I303 N308 T310	E301-R305 WeakPolarHBondContact O-CB 3.46Å; E301-R305 WeakPolarHBondContact O-CD 3.39Å; E301-R305 WeakPolarHBondContact O-CG 3.23Å; E301-R305 PolarHBondContact O-N 3.03Å; E301-R305 VanDerWaalsContact OE1-CD 3.29Å; E301-R305 WeakPolarHBondContact OE1-CD 3.37Å; E301-R305 IonicContact OE1-CZ 2.88Å; E301-R305 IonicContact OE1-NE 3.16Å; E301-R305 IonicContact OE1-NH1 3.95Å; E301-R305 PolarHBondContact OE1-NH1 2.92Å; L302-R305 PolarHBondContact O-N 3.42Å; I303-R305 PolarHBondContact O-N 2.93Å; I303-R305 VanDerWaalsContact O-N 3.15Å; R305-N308 CarbonylContact O-C 3.59Å; R305-T310 VanDerWaalsContact O-CB 3.25Å; R305-T310 WeakPolarHBondContact O-CB 3.35Å; R305-T310 PolarHBondContact O-N 3.15Å; R305-T310 VanDerWaalsContact O-N 3.1Å; R305-T310 PolarHBondContact O-OG1 2.84Å
306	L	52.9	Low	61.7	Low	115 Å²	115	97.1 Å²	97.1	60%	0.602	49%	0.49	S	S	*	.	H	α-helix	trans	-67.8	-45.2	171.9	-72.5	163.3	0	0	0	110.6	L302 I303 V311	L302-L306 VanDerWaalsContact O-CG 3.27Å; L302-L306 WeakPolarHBondContact O-CG 3.4Å; L302-L306 PolarHBondContact O-N 3.03Å; I303-L306 WeakPolarHBondContact O-CB 3.48Å; I303-L306 PolarHBondContact O-N 2.96Å; L306-V311 HydrophobicContact CD2-CG2 3.69Å
307	E	57	Low	60.4	Low	142 Å²	142	96.4 Å²	96.4	66%	0.664	49%	0.485	S	S	*	.	H	α-helix	trans	-65.2	-48.4	175	-68.2	173.3	161.1	0	0	111.4	I303 K309	I303-E307 HydrophobicContact CG2-CG 4.24Å; I303-E307 WeakPolarHBondContact CG2-OE1 3.33Å; I303-E307 WeakPolarHBondContact O-CB 3.27Å; I303-E307 WeakPolarHBondContact O-CG 3.45Å; I303-E307 PolarHBondContact O-N 3.48Å; E307-K309 PolarHBondContact O-N 3.27Å
308	N	47.8	Very low	59.1	Low	120 Å²	120	99.1 Å²	99.1	64%	0.642	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	54.2	176.6	-66.9	-75.9	0	0	0	113	G304 R305 T310	G304-N308 WeakPolarHBondContact O-CB 3.47Å; G304-N308 PolarHBondContact O-N 2.94Å; G304-N308 PolarHBondContact O-ND2 3.46Å; R305-N308 CarbonylContact O-C 3.59Å; N308-T310 PolarHBondContact O-N 2.8Å; N308-T310 PolarHBondContact O-OG1 2.89Å
309	K	51.5	Low	57.3	Low	172 Å²	172	93.7 Å²	93.7	75%	0.748	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	8.1	160.3	-60.3	-177.8	177.7	-180	0	117.6	E307 V311 S312	E307-K309 PolarHBondContact O-N 3.27Å; K309-V311 PolarHBondContact O-N 2.85Å; K309-V311 VanDerWaalsContact O-N 3.15Å; K309-S312 WeakPolarHBondContact O-CB 3.33Å; K309-S312 PolarHBondContact O-N 2.71Å
310	T	46.9	Very low	56	Low	61 Å²	61	93.7 Å²	93.7	37%	0.374	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-21.7	-164.2	-53.7	0	0	0	0	112.2	R305 N308 S312 F313 D314	R305-T310 VanDerWaalsContact O-CB 3.25Å; R305-T310 WeakPolarHBondContact O-CB 3.35Å; R305-T310 PolarHBondContact O-N 3.15Å; R305-T310 VanDerWaalsContact O-N 3.1Å; R305-T310 PolarHBondContact O-OG1 2.84Å; N308-T310 PolarHBondContact O-N 2.8Å; N308-T310 PolarHBondContact O-OG1 2.89Å; T310-S312 PolarHBondContact O-N 3.26Å; T310-F313 WeakPolarHBondContact O-CB 3.2Å; T310-F313 PolarHBondContact O-N 2.85Å; T310-D314 PolarHBondContact O-N 2.83Å
311	V	47.4	Very low	54.6	Low	84 Å²	84	96.1 Å²	96.1	51%	0.509	48%	0.479	S	S	.	.	H	α-helix	trans	-55.1	-33.5	171.8	-174.7	0	0	0	0	112.7	L306 K309 F313 D314 L315	L306-V311 HydrophobicContact CD2-CG2 3.69Å; K309-V311 PolarHBondContact O-N 2.85Å; K309-V311 VanDerWaalsContact O-N 3.15Å; V311-F313 VanDerWaalsContact C-N 3.28Å; V311-F313 PolarHBondContact O-N 3.4Å; V311-D314 PolarHBondContact O-N 2.77Å; V311-L315 PolarHBondContact O-N 2.84Å; V311-L315 VanDerWaalsContact O-N 3.09Å
312	S	48.2	Very low	53.2	Low	53 Å²	53	93.9 Å²	93.9	37%	0.371	47%	0.473	S	S	.	.	H	α-helix	trans	-63	-35.7	177.7	-169.9	0	0	0	0	112	K309 T310 H316	K309-S312 WeakPolarHBondContact O-CB 3.33Å; K309-S312 PolarHBondContact O-N 2.71Å; T310-S312 PolarHBondContact O-N 3.26Å; S312-H316 VanDerWaalsContact O-CB 3.31Å; S312-H316 WeakPolarHBondContact O-CB 3.31Å; S312-H316 PolarHBondContact O-N 3.08Å
313	F	42	Very low	51.9	Low	146 Å²	146	97.8 Å²	97.8	64%	0.64	49%	0.494	S	S	*	.	H	α-helix	trans	-72.9	-43.8	-179.3	-161	-87.7	0	0	0	112	T310 V311 L315 H316 Q317	T310-F313 WeakPolarHBondContact O-CB 3.2Å; T310-F313 PolarHBondContact O-N 2.85Å; V311-F313 VanDerWaalsContact C-N 3.28Å; V311-F313 PolarHBondContact O-N 3.4Å; F313-L315 PolarHBondContact O-N 2.89Å; F313-H316 PolarHBondContact O-N 3.19Å; F313-Q317 VanDerWaalsContact O-CB 3.26Å; F313-Q317 WeakPolarHBondContact O-CB 3.32Å; F313-Q317 PolarHBondContact O-N 2.97Å
314	D	48.5	Very low	50.7	Low	80 Å²	80	97.8 Å²	97.8	43%	0.428	52%	0.515	S	S	.	.	H	α-helix	trans	-64.7	-38.1	176.5	-177.2	73.7	0	0	0	111.8	T310 V311 R318	T310-D314 PolarHBondContact O-N 2.83Å; V311-D314 PolarHBondContact O-N 2.77Å; D314-R318 VanDerWaalsContact CG-NE 3.3Å; D314-R318 WeakPolarHBondContact O-CB 3.47Å; D314-R318 WeakPolarHBondContact O-CG 3.37Å; D314-R318 PolarHBondContact O-N 3.04Å; D314-R318 IonicContact OD1-CZ 3.31Å; D314-R318 IonicContact OD1-NE 2.71Å; D314-R318 PolarHBondContact OD1-NE 2.83Å; D314-R318 IonicContact OD1-NH2 3.5Å; D314-R318 PolarHBondContact OD1-NH2 2.74Å; D314-R318 IonicContact OD2-CZ 2.74Å; D314-R318 IonicContact OD2-NE 3.89Å; D314-R318 PolarHBondContact OD2-NE 3.13Å; D314-R318 IonicContact OD2-NH2 3.39Å; D314-R318 PolarHBondContact OD2-NH2 3.31Å; D314-R318 VanDerWaalsContact OD2-NH2 3.16Å
315	L	49.6	Very low	49.8	Very low	38 Å²	38	101.6 Å²	101.6	20%	0.199	54%	0.535	C	S	.	.	H	α-helix	trans	-68.7	-41.7	175.2	-174.5	59	0	0	0	112.4	V311 F313 R318 L319 V419 A420 W425	V311-L315 PolarHBondContact O-N 2.84Å; V311-L315 VanDerWaalsContact O-N 3.09Å; F313-L315 PolarHBondContact O-N 2.89Å; L315-R318 PolarHBondContact O-N 3.42Å; L315-L319 HydrophobicContact CG-CD1 4.32Å; L315-L319 WeakPolarHBondContact O-CB 3.34Å; L315-L319 WeakPolarHBondContact O-CG 3.5Å; L315-L319 PolarHBondContact O-N 3.16Å; L315-V419 HydrophobicContact CD2-CG2 3.94Å; L315-A420 VanDerWaalsContact CD2-O 3.3Å; L315-A420 WeakPolarHBondContact CD2-O 3.43Å; L315-W425 HydrophobicContact CD1-CH2 4.37Å
316	H	50.7	Low	49.3	Very low	115 Å²	115	101.7 Å²	101.7	53%	0.532	55%	0.552	S	S	.	*	H	α-helix	trans	-66	-43.4	177.7	-164.5	79	0	0	0	111.9	S312 F313 L319 T320	S312-H316 VanDerWaalsContact O-CB 3.31Å; S312-H316 WeakPolarHBondContact O-CB 3.31Å; S312-H316 PolarHBondContact O-N 3.08Å; F313-H316 PolarHBondContact O-N 3.19Å; H316-L319 PolarHBondContact O-N 2.88Å; H316-T320 PolarHBondContact O-N 2.99Å; H316-T320 PolarHBondContact O-OG1 3.35Å
317	Q	53.8	Low	49.6	Very low	89 Å²	89	99 Å²	99	42%	0.416	54%	0.542	S	S	.	.	H	α-helix	trans	-58.1	-48	173.6	-177.5	91.9	55.7	0	0	111.5	F313 L319 T320 D321	F313-Q317 VanDerWaalsContact O-CB 3.26Å; F313-Q317 WeakPolarHBondContact O-CB 3.32Å; F313-Q317 PolarHBondContact O-N 2.97Å; Q317-L319 VanDerWaalsContact C-N 3.31Å; Q317-L319 PolarHBondContact O-N 3.19Å; Q317-T320 PolarHBondContact O-N 3.38Å; Q317-T320 VanDerWaalsContact O-N 3.16Å; Q317-T320 PolarHBondContact O-OG1 3.09Å; Q317-D321 PolarHBondContact NE2-OD2 3.48Å; Q317-D321 PolarHBondContact O-N 3.09Å; Q317-D321 VanDerWaalsContact O-N 3.09Å
318	R	52.6	Low	50.3	Low	153 Å²	153	95.6 Å²	95.6	58%	0.577	54%	0.538	S	S	*	.	H	α-helix	trans	-64.4	-31.4	177.4	-73.2	173.7	-163.8	-75.3	-14.4	113.7	D314 L315 T320	D314-R318 VanDerWaalsContact CG-NE 3.3Å; D314-R318 WeakPolarHBondContact O-CB 3.47Å; D314-R318 WeakPolarHBondContact O-CG 3.37Å; D314-R318 PolarHBondContact O-N 3.04Å; D314-R318 IonicContact OD1-CZ 3.31Å; D314-R318 IonicContact OD1-NE 2.71Å; D314-R318 PolarHBondContact OD1-NE 2.83Å; D314-R318 IonicContact OD1-NH2 3.5Å; D314-R318 PolarHBondContact OD1-NH2 2.74Å; D314-R318 IonicContact OD2-CZ 2.74Å; D314-R318 IonicContact OD2-NE 3.89Å; D314-R318 PolarHBondContact OD2-NE 3.13Å; D314-R318 IonicContact OD2-NH2 3.39Å; D314-R318 PolarHBondContact OD2-NH2 3.31Å; D314-R318 VanDerWaalsContact OD2-NH2 3.16Å; L315-R318 PolarHBondContact O-N 3.42Å; R318-T320 VanDerWaalsContact C-N 3.34Å
319	L	50.7	Low	51.9	Low	32 Å²	32	92.6 Å²	92.6	17%	0.168	53%	0.527	C	S	.	.	H	α-helix	trans	-69.6	-30.3	174.7	-80.5	167	0	0	0	112.3	L315 H316 Q317 A420 P422	L315-L319 HydrophobicContact CG-CD1 4.32Å; L315-L319 WeakPolarHBondContact O-CB 3.34Å; L315-L319 WeakPolarHBondContact O-CG 3.5Å; L315-L319 PolarHBondContact O-N 3.16Å; H316-L319 PolarHBondContact O-N 2.88Å; Q317-L319 VanDerWaalsContact C-N 3.31Å; Q317-L319 PolarHBondContact O-N 3.19Å; L319-A420 HydrophobicContact CD1-CB 3.82Å; L319-P422 HydrophobicContact CD2-CB 4.44Å; L319-P422 HydrophobicContact CD2-CG 3.94Å
320	T	50.7	Low	53.7	Low	96 Å²	96	84.9 Å²	84.9	59%	0.589	49%	0.494	S	S	*	.	H	α-helix	trans	-83.3	-27.5	176.4	44.8	0	0	0	0	114.3	H316 Q317 R318 T322	H316-T320 PolarHBondContact O-N 2.99Å; H316-T320 PolarHBondContact O-OG1 3.35Å; Q317-T320 PolarHBondContact O-N 3.38Å; Q317-T320 VanDerWaalsContact O-N 3.16Å; Q317-T320 PolarHBondContact O-OG1 3.09Å; R318-T320 VanDerWaalsContact C-N 3.34Å; T320-T322 PolarHBondContact O-N 3.38Å
321	D	46.8	Very low	55.7	Low	108 Å²	108	83 Å²	83	58%	0.578	48%	0.481	S	S	*	.			trans	-86	6.6	-172.4	-72.6	-26.5	0	0	0	114.9	Q317 D323	Q317-D321 PolarHBondContact NE2-OD2 3.48Å; Q317-D321 PolarHBondContact O-N 3.09Å; Q317-D321 VanDerWaalsContact O-N 3.09Å; D321-D323 PolarHBondContact O-N 2.78Å
322	T	46.6	Very low	57.8	Low	62 Å²	62	80.5 Å²	80.5	38%	0.38	47%	0.465	S	S	.	.	S	Bend	trans	-85.7	86	179.9	58.6	0	0	0	0	114.4	T320 G324 T325 S327	T320-T322 PolarHBondContact O-N 3.38Å; T322-G324 PolarHBondContact O-N 3.15Å; T322-T325 PolarHBondContact O-N 3.2Å; T322-S327 PolarHBondContact OG1-OG 2.83Å; T322-S327 VanDerWaalsContact OG1-OG 3.06Å
323	D	44.8	Very low	59.9	Low	158 Å²	158	78 Å²	78	85%	0.845	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	35.3	54.6	154.6	-75.8	-31.9	0	0	0	117.4	D321 T325	D321-D323 PolarHBondContact O-N 2.78Å; D323-T325 PolarHBondContact O-N 3.1Å; D323-T325 PolarHBondContact O-OG1 2.9Å
324	G	48.7	Very low	62.3	Low	87 Å²	87	74.4 Å²	74.4	90%	0.897	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	2.5	164.6	0	0	0	0	0	116.7	T322	T322-G324 PolarHBondContact O-N 3.15Å
325	T	48.2	Very low	64.6	Low	100 Å²	100	70.8 Å²	70.8	61%	0.613	41%	0.41	S	S	*	.	S	Bend	trans	-103.8	122.6	179.3	-54.5	0	0	0	0	107.6	T322 D323 S327	T322-T325 PolarHBondContact O-N 3.2Å; D323-T325 PolarHBondContact O-N 3.1Å; D323-T325 PolarHBondContact O-OG1 2.9Å; T325-S327 VanDerWaalsContact C-N 3.31Å; T325-S327 PolarHBondContact O-N 2.82Å
326	P	50.2	Low	66.6	Low	125 Å²	125	72 Å²	72	81%	0.812	41%	0.414	S	S	*	.			trans	-70.5	88.8	-178.1	28.1	-33.9	0	0	0	110.5	A328	P326-A328 PolarHBondContact O-N 2.95Å
327	S	58	Low	68.8	Low	58 Å²	58	66.5 Å²	66.5	41%	0.406	39%	0.389	S	S	.	.			trans	-57.6	98.7	168.8	-66.3	0	0	0	0	108.9	T322 T325 S329	T322-S327 PolarHBondContact OG1-OG 2.83Å; T322-S327 VanDerWaalsContact OG1-OG 3.06Å; T325-S327 VanDerWaalsContact C-N 3.31Å; T325-S327 PolarHBondContact O-N 2.82Å; S327-S329 PolarHBondContact O-N 3.4Å
328	A	73.2	Confident	70.8	Confident	70 Å²	70	64 Å²	64	58%	0.579	38%	0.38	S	S	*	.			trans	-53.5	124.8	-178.2	0	0	0	0	0	110.3	P326 A423	P326-A328 PolarHBondContact O-N 2.95Å; A328-A423 HydrophobicContact CB-CB 4.07Å; A328-A423 WeakPolarHBondContact O-CB 3.46Å; A328-A423 PolarHBondContact O-N 3.43Å
329	S	81.4	Confident	72.8	Confident	58 Å²	58	56.8 Å²	56.8	41%	0.406	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	136.1	-176.6	56	0	0	0	0	110	S327 V421	S327-S329 PolarHBondContact O-N 3.4Å; S329-V421 CarbonylContact C-O 3.59Å; S329-V421 VanDerWaalsContact CA-O 3.28Å; S329-V421 WeakPolarHBondContact CA-O 3.43Å
330	L	87.8	Confident	74.9	Confident	9 Å²	9	57 Å²	57	5%	0.047	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	145.7	172.3	-59.4	176.9	0	0	0	109	F365 F383 W384 D385 A420 V421 A423 C426	L330-F365 HydrophobicContact CD1-CB 3.89Å; L330-F365 HydrophobicContact CD1-CD1 3.88Å; L330-F365 HydrophobicContact CD1-CD2 3.95Å; L330-F365 HydrophobicContact CD1-CE1 4.46Å; L330-F365 HydrophobicContact CD1-CE2 4.49Å; L330-F365 HydrophobicContact CD1-CG 3.62Å; L330-F365 HydrophobicContact CD2-CB 4.21Å; L330-F365 HydrophobicContact CD2-CD2 4.45Å; L330-F365 HydrophobicContact CD2-CG 4.49Å; L330-F383 HydrophobicContact CD1-CB 4.43Å; L330-F383 HydrophobicContact CD1-CD1 4.46Å; L330-W384 CarbonylContact C-O 3.58Å; L330-W384 WeakPolarHBondContact CA-O 3.31Å; L330-D385 WeakPolarHBondContact CD2-OD1 3.29Å; L330-A420 WeakPolarHBondContact O-CA 3.3Å; L330-V421 HydrophobicContact CB-CG2 4.1Å; L330-V421 PolarHBondContact N-O 3.39Å; L330-V421 PolarHBondContact O-N 3.26Å; L330-A423 HydrophobicContact CD1-CB 4.27Å; L330-A423 HydrophobicContact CD2-CB 4.4Å; L330-A423 HydrophobicContact CG-CB 3.9Å; L330-C426 HydrophobicContact CD1-CB 3.96Å
331	L	89.8	Confident	76.9	Confident	23 Å²	23	59.9 Å²	59.9	12%	0.12	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	109.1	168.1	-179	61.3	0	0	0	109	I333 W384 E387 W390	L331-I333 HydrophobicContact CD1-CD1 4.23Å; L331-I333 HydrophobicContact CD2-CD1 3.89Å; L331-I333 HydrophobicContact CG-CD1 3.75Å; L331-I333 HydrophobicContact CG-CG1 4.35Å; L331-W384 HydrophobicContact CB-CB 4.4Å; L331-W384 PolarHBondContact N-O 2.89Å; L331-W384 PolarHBondContact O-N 2.72Å; L331-E387 HydrophobicContact CD2-CB 3.91Å; L331-E387 HydrophobicContact CD2-CG 3.89Å; L331-W390 HydrophobicContact CD2-CB 4.19Å; L331-W390 HydrophobicContact CD2-CD2 4.46Å; L331-W390 HydrophobicContact CD2-CE3 4.15Å
332	L	90.8	Very high	79.1	Confident	30 Å²	30	64.5 Å²	64.5	16%	0.157	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	119.5	171.6	173.8	55.3	0	0	0	109.5	Y381 E382 F383 S418 V419 V421	L332-Y381 HydrophobicContact CD1-CD1 4.24Å; L332-E382 WeakPolarHBondContact CA-O 3.44Å; L332-F383 HydrophobicContact CB-CD1 4.37Å; L332-F383 HydrophobicContact CB-CE1 4.35Å; L332-F383 HydrophobicContact CD1-CD1 4.05Å; L332-F383 HydrophobicContact CD1-CD2 4.04Å; L332-F383 HydrophobicContact CD1-CE1 3.76Å; L332-F383 HydrophobicContact CD1-CE2 3.74Å; L332-F383 HydrophobicContact CD1-CG 4.19Å; L332-F383 HydrophobicContact CD1-CZ 3.6Å; L332-F383 HydrophobicContact CD2-CE1 4.12Å; L332-F383 HydrophobicContact CD2-CZ 4.24Å; L332-F383 HydrophobicContact CG-CE1 4.3Å; L332-F383 HydrophobicContact CG-CZ 4.46Å; L332-S418 CarbonylContact O-C 3.6Å; L332-S418 VanDerWaalsContact O-CA 3.31Å; L332-S418 WeakPolarHBondContact O-CA 3.45Å; L332-V419 HydrophobicContact CB-CG1 4.02Å; L332-V419 HydrophobicContact CD2-CG1 4.18Å; L332-V419 HydrophobicContact CG-CG1 4.28Å; L332-V419 PolarHBondContact N-O 2.9Å; L332-V419 PolarHBondContact O-N 3.14Å; L332-V421 HydrophobicContact CB-CG1 4.25Å; L332-V421 HydrophobicContact CB-CG2 4.27Å; L332-V421 HydrophobicContact CD2-CG1 4.37Å
333	I	93.4	Very high	81.3	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	128.6	170.9	-51.8	-62.9	0	0	0	108.6	L331 Q335 Y381 E382 W390 V416	L331-I333 HydrophobicContact CD1-CD1 4.23Å; L331-I333 HydrophobicContact CD2-CD1 3.89Å; L331-I333 HydrophobicContact CG-CD1 3.75Å; L331-I333 HydrophobicContact CG-CG1 4.35Å; I333-Q335 HydrophobicContact CG2-CG 4.14Å; I333-Y381 WeakPolarHBondContact O-CA 3.41Å; I333-E382 HydrophobicContact CB-CB 4.28Å; I333-E382 PolarHBondContact N-O 2.84Å; I333-E382 PolarHBondContact O-N 2.97Å; I333-W390 HydrophobicContact CD1-CD2 3.79Å; I333-W390 HydrophobicContact CD1-CE3 4.12Å; I333-W390 HydrophobicContact CD1-CG 4.25Å; I333-W390 HydrophobicContact CD1-CH2 4.23Å; I333-W390 HydrophobicContact CD1-CZ2 3.91Å; I333-W390 HydrophobicContact CD1-CZ3 4.33Å; I333-W390 HydrophobicContact CG1-CD2 4.11Å; I333-W390 HydrophobicContact CG1-CG 4.12Å; I333-W390 HydrophobicContact CG1-CZ2 4.4Å; I333-W390 HydrophobicContact CG2-CZ2 4.31Å; I333-V416 HydrophobicContact CG2-CG1 3.96Å
334	R	93.1	Very high	83.7	Confident	72 Å²	72	58.7 Å²	58.7	27%	0.272	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	113.6	170.3	176	-170.8	-177.6	-80	-0.5	108.9	E336 V379 V380 Y381 S417	R334-E336 IonicContact CZ-OE2 3.76Å; R334-E336 IonicContact NH1-OE2 2.78Å; R334-E336 PolarHBondContact NH1-OE2 2.97Å; R334-E336 IonicContact NH2-OE2 3.64Å; R334-E336 PolarHBondContact NH2-OE2 3.27Å; R334-V379 HydrophobicContact CG-CG1 3.63Å; R334-V380 WeakPolarHBondContact CA-O 3.4Å; R334-Y381 HydrophobicContact CB-CD1 3.99Å; R334-Y381 HydrophobicContact CB-CE1 3.97Å; R334-Y381 HydrophobicContact CG-CD1 4.03Å; R334-Y381 HydrophobicContact CG-CE1 3.6Å; R334-S417 WeakPolarHBondContact CB-OG 3.25Å; R334-S417 PolarHBondContact N-O 2.89Å; R334-S417 PolarHBondContact O-N 3.39Å; R334-S417 PolarHBondContact O-OG 2.67Å; R334-S417 VanDerWaalsContact O-OG 3.11Å
335	Q	94.8	Very high	85.7	Confident	4 Å²	4	56.9 Å²	56.9	2%	0.019	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	128.7	172.2	-59.6	169.6	26.1	0	0	109	I333 M337 V379 V380 E382 E414 V416	I333-Q335 HydrophobicContact CG2-CG 4.14Å; Q335-M337 HydrophobicContact CB-CE 3.71Å; Q335-M337 HydrophobicContact CG-CE 4.43Å; Q335-V379 CarbonylContact O-C 3.52Å; Q335-V379 WeakPolarHBondContact O-CA 3.35Å; Q335-V380 HydrophobicContact CB-CB 4.36Å; Q335-V380 PolarHBondContact N-O 2.83Å; Q335-V380 PolarHBondContact O-N 2.88Å; Q335-E382 PolarHBondContact NE2-OE1 3.11Å; Q335-E414 PolarHBondContact OE1-OE2 3.14Å; Q335-V416 HydrophobicContact CG-CG1 4.35Å; Q335-V416 HydrophobicContact CG-CG2 4.28Å
336	E	93.1	Very high	88	Confident	62 Å²	62	56.2 Å²	56.2	29%	0.29	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.5	174.8	176.5	172.1	177.3	0	0	110.9	R334 F378 V379 E414 A415	R334-E336 IonicContact CZ-OE2 3.76Å; R334-E336 IonicContact NH1-OE2 2.78Å; R334-E336 PolarHBondContact NH1-OE2 2.97Å; R334-E336 IonicContact NH2-OE2 3.64Å; R334-E336 PolarHBondContact NH2-OE2 3.27Å; E336-F378 WeakPolarHBondContact CA-O 3.31Å; E336-V379 HydrophobicContact CB-CG2 4.49Å; E336-V379 HydrophobicContact CG-CG2 4.3Å; E336-E414 WeakPolarHBondContact O-CA 3.38Å; E336-A415 HydrophobicContact CB-CB 4.3Å; E336-A415 PolarHBondContact N-O 2.87Å; E336-A415 PolarHBondContact O-N 3.27Å
337	M	95.9	Very high	90.2	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	131.2	-166.2	-60	-174.6	-157.7	0	0	110.8	Q335 F347 S377 F378 V380 F402 K406 L410 E414	Q335-M337 HydrophobicContact CB-CE 3.71Å; Q335-M337 HydrophobicContact CG-CE 4.43Å; M337-F347 HydrophobicContact CB-CZ 4.48Å; M337-F347 HydrophobicContact SD-CE2 3.75Å; M337-F347 HydrophobicContact SD-CZ 3.72Å; M337-S377 CarbonylContact O-C 3.55Å; M337-S377 VanDerWaalsContact O-CA 3.32Å; M337-S377 WeakPolarHBondContact O-CA 3.47Å; M337-F378 PolarHBondContact N-O 3.32Å; M337-F378 PolarHBondContact O-N 2.92Å; M337-V380 HydrophobicContact CE-CG2 4.18Å; M337-F402 HydrophobicContact CE-CE1 4.13Å; M337-F402 HydrophobicContact CE-CZ 4.34Å; M337-F402 HydrophobicContact SD-CZ 4.32Å; M337-K406 HydrophobicContact CE-CD 3.92Å; M337-K406 VanDerWaalsContact CE-CE 3.46Å; M337-K406 HydrophobicContact SD-CD 4.04Å; M337-K406 HydrophobicContact SD-CG 4.03Å; M337-L410 HydrophobicContact CB-CD1 4.03Å; M337-L410 HydrophobicContact CB-CD2 3.79Å; M337-L410 HydrophobicContact CG-CD1 4.01Å; M337-L410 HydrophobicContact CG-CD2 4.5Å; M337-L410 HydrophobicContact SD-CD1 4.24Å; M337-E414 HydrophobicContact CG-CB 4.16Å
338	V	95.8	Very high	91.9	Very high	37 Å²	37	48.8 Å²	48.8	22%	0.224	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	115.4	175	-174.2	0	0	0	0	108.7	L410 C411 Q412	V338-L410 CarbonylContact O-C 3.54Å; V338-L410 WeakPolarHBondContact O-CA 3.18Å; V338-C411 HydrophobicContact CG1-CB 4.4Å; V338-C411 PolarHBondContact O-N 3.41Å; V338-Q412 HydrophobicContact CB-CG 4.29Å; V338-Q412 HydrophobicContact CG2-CG 4.37Å
339	V	96	Very high	92.9	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-97.8	137.2	-168.9	-172.6	0	0	0	0	111.2	Q341 L344 F347 L376 F378 L410	V339-Q341 PolarHBondContact O-N 3.4Å; V339-L344 HydrophobicContact CB-CD1 4.34Å; V339-L344 HydrophobicContact CG1-CD1 4.2Å; V339-F347 HydrophobicContact CB-CD1 4.45Å; V339-F347 HydrophobicContact CG1-CB 3.75Å; V339-F347 HydrophobicContact CG1-CD1 4.14Å; V339-F347 HydrophobicContact CG1-CG 3.89Å; V339-F347 HydrophobicContact CG2-CD1 3.48Å; V339-F347 VanDerWaalsContact CG2-CD1 3.48Å; V339-F347 HydrophobicContact CG2-CD2 4.12Å; V339-F347 HydrophobicContact CG2-CE1 3.56Å; V339-F347 HydrophobicContact CG2-CE2 4.19Å; V339-F347 HydrophobicContact CG2-CG 3.78Å; V339-F347 HydrophobicContact CG2-CZ 3.92Å; V339-L376 WeakPolarHBondContact CB-O 3.4Å; V339-L376 WeakPolarHBondContact CG2-O 3.26Å; V339-L376 PolarHBondContact N-O 2.95Å; V339-F378 HydrophobicContact CB-CE2 4.37Å; V339-F378 HydrophobicContact CG2-CD2 3.55Å; V339-F378 HydrophobicContact CG2-CE2 3.77Å; V339-L410 HydrophobicContact CB-CD2 4.35Å; V339-L410 HydrophobicContact CG2-CD2 3.7Å
340	S	93.7	Very high	93.6	Very high	36 Å²	36	50.2 Å²	50.2	25%	0.252	26%	0.255	S	S	.	.			trans	-65.3	127.3	173.9	178.3	0	0	0	0	111.1	K342 K343 L344 T409 C411	S340-K342 PolarHBondContact O-N 2.91Å; S340-K343 CarbonylContact O-C 3.6Å; S340-K343 WeakPolarHBondContact O-CA 3.18Å; S340-K343 PolarHBondContact O-N 2.97Å; S340-L344 PolarHBondContact O-N 3.11Å; S340-L344 VanDerWaalsContact O-N 3.09Å; S340-T409 WeakPolarHBondContact CB-O 3.46Å; S340-T409 PolarHBondContact N-O 3.34Å; S340-C411 VanDerWaalsContact CA-SG 3.53Å
341	Q	93	Very high	93.9	Very high	157 Å²	157	50.2 Å²	50.2	73%	0.734	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-33.2	-178.7	-170	-175.3	25.6	0	0	113.2	V339 K343 L376	V339-Q341 PolarHBondContact O-N 3.4Å; Q341-K343 VanDerWaalsContact C-N 3.28Å; Q341-K343 PolarHBondContact O-N 2.87Å; Q341-L376 HydrophobicContact CB-CD1 4.39Å; Q341-L376 HydrophobicContact CB-CD2 4Å; Q341-L376 HydrophobicContact CG-CD2 4.26Å
342	K	93	Very high	94	Very high	204 Å²	204	56 Å²	56	89%	0.887	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-17.8	177.9	-64.1	-178.7	-179.5	177.4	0	114.1	S340	S340-K342 PolarHBondContact O-N 2.91Å
343	K	92.9	Very high	94.2	Very high	65 Å²	65	60.8 Å²	60.8	28%	0.283	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	0.2	-173.6	-77.7	-66.9	-150.4	159.6	0	113.5	S340 Q341 G345 E346 F347 D408 T409	S340-K343 CarbonylContact O-C 3.6Å; S340-K343 WeakPolarHBondContact O-CA 3.18Å; S340-K343 PolarHBondContact O-N 2.97Å; Q341-K343 VanDerWaalsContact C-N 3.28Å; Q341-K343 PolarHBondContact O-N 2.87Å; K343-G345 VanDerWaalsContact C-N 3.3Å; K343-G345 PolarHBondContact O-N 3.15Å; K343-E346 WeakPolarHBondContact CD-OE2 3.37Å; K343-E346 IonicContact NZ-OE1 3.19Å; K343-E346 PolarHBondContact NZ-OE1 3.49Å; K343-E346 IonicContact NZ-OE2 3.61Å; K343-E346 PolarHBondContact NZ-OE2 2.87Å; K343-E346 PolarHBondContact O-N 3.29Å; K343-F347 PolarHBondContact O-N 3.26Å; K343-F347 VanDerWaalsContact O-N 3.11Å; K343-D408 WeakPolarHBondContact CE-O 3.38Å; K343-T409 HydrophobicContact CB-CG2 3.81Å; K343-T409 HydrophobicContact CD-CG2 4.09Å; K343-T409 HydrophobicContact CG-CG2 4.18Å
344	L	94	Very high	94.2	Very high	34 Å²	34	61 Å²	61	18%	0.178	30%	0.302	C	S	.	.	H	α-helix	trans	-53.6	-39.5	-174	-177.8	66	0	0	0	114.2	V339 S340 C348 L376 F378	V339-L344 HydrophobicContact CB-CD1 4.34Å; V339-L344 HydrophobicContact CG1-CD1 4.2Å; S340-L344 PolarHBondContact O-N 3.11Å; S340-L344 VanDerWaalsContact O-N 3.09Å; L344-C348 WeakPolarHBondContact O-CB 3.47Å; L344-C348 PolarHBondContact O-N 2.71Å; L344-C348 PolarHBondContact O-SG 2.9Å; L344-L376 HydrophobicContact CD1-CD2 4.39Å; L344-L376 HydrophobicContact CD2-CD2 4.21Å; L344-F378 HydrophobicContact CD1-CE2 3.64Å; L344-F378 HydrophobicContact CD1-CZ 3.81Å
345	G	92.1	Very high	94.2	Very high	48 Å²	48	59.2 Å²	59.2	50%	0.495	30%	0.297	S	S	.	.	H	α-helix	trans	-65.9	-50.1	179.8	0	0	0	0	0	112.9	K343 F347 C348 E349	K343-G345 VanDerWaalsContact C-N 3.3Å; K343-G345 PolarHBondContact O-N 3.15Å; G345-F347 PolarHBondContact O-N 3.39Å; G345-C348 WeakPolarHBondContact O-CB 3.39Å; G345-C348 PolarHBondContact O-N 2.92Å; G345-C348 VanDerWaalsContact O-N 3.09Å; G345-E349 PolarHBondContact O-N 3.02Å
346	E	95.3	Very high	94	Very high	86 Å²	86	66.5 Å²	66.5	40%	0.402	33%	0.329	S	S	.	.	H	α-helix	trans	-57.4	-46	177.4	-173.8	179.7	145.3	0	0	111.5	K343 E349 A350 T409	K343-E346 WeakPolarHBondContact CD-OE2 3.37Å; K343-E346 IonicContact NZ-OE1 3.19Å; K343-E346 PolarHBondContact NZ-OE1 3.49Å; K343-E346 IonicContact NZ-OE2 3.61Å; K343-E346 PolarHBondContact NZ-OE2 2.87Å; K343-E346 PolarHBondContact O-N 3.29Å; E346-E349 PolarHBondContact O-N 3.27Å; E346-A350 WeakPolarHBondContact O-CB 3.38Å; E346-A350 PolarHBondContact O-N 3.29Å; E346-T409 HydrophobicContact CG-CG2 4.41Å
347	F	96.6	Very high	93.9	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-44.6	172.4	177.5	-94.1	0	0	0	112.5	M337 V339 K343 G345 E349 A350 L351 F378 F402 K406 T409 L410	M337-F347 HydrophobicContact CB-CZ 4.48Å; M337-F347 HydrophobicContact SD-CE2 3.75Å; M337-F347 HydrophobicContact SD-CZ 3.72Å; V339-F347 HydrophobicContact CB-CD1 4.45Å; V339-F347 HydrophobicContact CG1-CB 3.75Å; V339-F347 HydrophobicContact CG1-CD1 4.14Å; V339-F347 HydrophobicContact CG1-CG 3.89Å; V339-F347 HydrophobicContact CG2-CD1 3.48Å; V339-F347 VanDerWaalsContact CG2-CD1 3.48Å; V339-F347 HydrophobicContact CG2-CD2 4.12Å; V339-F347 HydrophobicContact CG2-CE1 3.56Å; V339-F347 HydrophobicContact CG2-CE2 4.19Å; V339-F347 HydrophobicContact CG2-CG 3.78Å; V339-F347 HydrophobicContact CG2-CZ 3.92Å; K343-F347 PolarHBondContact O-N 3.26Å; K343-F347 VanDerWaalsContact O-N 3.11Å; G345-F347 PolarHBondContact O-N 3.39Å; F347-E349 VanDerWaalsContact C-N 3.3Å; F347-E349 PolarHBondContact O-N 2.85Å; F347-A350 PolarHBondContact O-N 2.89Å; F347-L351 HydrophobicContact CE1-CB 4.31Å; F347-L351 HydrophobicContact CE1-CD2 3.78Å; F347-L351 HydrophobicContact CZ-CD2 4.22Å; F347-L351 VanDerWaalsContact O-CB 3.23Å; F347-L351 WeakPolarHBondContact O-CB 3.5Å; F347-L351 PolarHBondContact O-N 3.43Å; F347-F378 HydrophobicContact CD1-CD2 4.33Å; F347-F378 HydrophobicContact CD1-CE2 4.22Å; F347-F378 HydrophobicContact CD1-CZ 4.41Å; F347-F378 HydrophobicContact CE1-CB 4.21Å; F347-F378 HydrophobicContact CE1-CD1 4.06Å; F347-F378 AromaticContact CE1-CD2 3.75Å; F347-F378 HydrophobicContact CE1-CD2 3.75Å; F347-F378 HydrophobicContact CE1-CE1 4.33Å; F347-F378 HydrophobicContact CE1-CE2 4.06Å; F347-F378 AromaticContact CE1-CG 3.75Å; F347-F378 HydrophobicContact CE1-CG 3.75Å; F347-F378 HydrophobicContact CE1-CZ 4.33Å; F347-F378 HydrophobicContact CZ-CB 4.46Å; F347-F378 HydrophobicContact CZ-CG 4.47Å; F347-F402 HydrophobicContact CD2-CE2 4.38Å; F347-F402 AromaticContact CE2-CE2 3.94Å; F347-F402 HydrophobicContact CE2-CE2 3.94Å; F347-F402 AromaticContact CE2-CZ 3.98Å; F347-F402 HydrophobicContact CE2-CZ 3.98Å; F347-F402 HydrophobicContact CZ-CZ 4.26Å; F347-K406 HydrophobicContact CE2-CG 4.39Å; F347-T409 HydrophobicContact CB-CG2 4.39Å; F347-T409 WeakPolarHBondContact CD2-OG1 3.36Å; F347-L410 HydrophobicContact CD2-CD2 4.27Å; F347-L410 HydrophobicContact CE2-CD2 4.01Å
348	C	94.3	Very high	93.7	Very high	28 Å²	28	66.3 Å²	66.3	19%	0.189	33%	0.33	C	S	.	.	H	α-helix	trans	-65	-30.7	-179.5	-74.4	0	0	0	0	113.3	L344 G345 K352	L344-C348 WeakPolarHBondContact O-CB 3.47Å; L344-C348 PolarHBondContact O-N 2.71Å; L344-C348 PolarHBondContact O-SG 2.9Å; G345-C348 WeakPolarHBondContact O-CB 3.39Å; G345-C348 PolarHBondContact O-N 2.92Å; G345-C348 VanDerWaalsContact O-N 3.09Å; C348-K352 VanDerWaalsContact O-CD 3.31Å; C348-K352 WeakPolarHBondContact O-CD 3.22Å; C348-K352 WeakPolarHBondContact O-CG 3.45Å; C348-K352 PolarHBondContact O-N 3.36Å
349	E	94.1	Very high	93.3	Very high	140 Å²	140	68.4 Å²	68.4	65%	0.654	35%	0.347	S	S	*	.	H	α-helix	trans	-75.6	-46.7	174.7	-69.9	-176.5	171.6	0	0	111.3	G345 E346 F347 L351 K352 Q353	G345-E349 PolarHBondContact O-N 3.02Å; E346-E349 PolarHBondContact O-N 3.27Å; F347-E349 VanDerWaalsContact C-N 3.3Å; F347-E349 PolarHBondContact O-N 2.85Å; E349-L351 VanDerWaalsContact C-N 3.35Å; E349-L351 PolarHBondContact O-N 3.25Å; E349-K352 PolarHBondContact O-N 3.06Å; E349-Q353 PolarHBondContact O-N 3.41Å
350	A	95.7	Very high	92.8	Very high	18 Å²	18	72.3 Å²	72.3	15%	0.149	38%	0.379	C	S	.	.	H	α-helix	trans	-60	-42.1	175.4	0	0	0	0	0	112.4	E346 F347 Q353 Y354 F402 V405	E346-A350 WeakPolarHBondContact O-CB 3.38Å; E346-A350 PolarHBondContact O-N 3.29Å; F347-A350 PolarHBondContact O-N 2.89Å; A350-Q353 PolarHBondContact O-N 3Å; A350-Y354 WeakPolarHBondContact O-CB 3.49Å; A350-Y354 PolarHBondContact O-N 3.09Å; A350-F402 HydrophobicContact CB-CD2 4.15Å; A350-F402 HydrophobicContact CB-CE2 4.46Å; A350-V405 HydrophobicContact CB-CB 4.03Å; A350-V405 HydrophobicContact CB-CG1 3.71Å; A350-V405 HydrophobicContact CB-CG2 3.9Å
351	L	94.5	Very high	92.4	Very high	9 Å²	9	73 Å²	73	5%	0.047	38%	0.378	C	S	.	.	H	α-helix	trans	-62.1	-44.9	175.7	175.3	60.9	0	0	0	111.5	F347 E349 Q353 Y354 L355 A369 F378 V380 F402	F347-L351 HydrophobicContact CE1-CB 4.31Å; F347-L351 HydrophobicContact CE1-CD2 3.78Å; F347-L351 HydrophobicContact CZ-CD2 4.22Å; F347-L351 VanDerWaalsContact O-CB 3.23Å; F347-L351 WeakPolarHBondContact O-CB 3.5Å; F347-L351 PolarHBondContact O-N 3.43Å; E349-L351 VanDerWaalsContact C-N 3.35Å; E349-L351 PolarHBondContact O-N 3.25Å; L351-Q353 VanDerWaalsContact C-N 3.3Å; L351-Q353 PolarHBondContact O-N 2.82Å; L351-Y354 PolarHBondContact O-N 3.38Å; L351-L355 HydrophobicContact CD1-CD1 4.04Å; L351-L355 HydrophobicContact CD1-CD2 4.39Å; L351-L355 HydrophobicContact CD1-CG 3.96Å; L351-L355 HydrophobicContact CG-CD1 4Å; L351-L355 HydrophobicContact CG-CG 4.38Å; L351-L355 WeakPolarHBondContact O-CB 3.37Å; L351-L355 WeakPolarHBondContact O-CG 3.42Å; L351-L355 PolarHBondContact O-N 3.45Å; L351-A369 HydrophobicContact CD1-CB 4.22Å; L351-A369 HydrophobicContact CD2-CB 4.07Å; L351-A369 HydrophobicContact CG-CB 4.47Å; L351-F378 HydrophobicContact CD2-CD1 3.91Å; L351-F378 HydrophobicContact CD2-CE1 4.31Å; L351-V380 HydrophobicContact CD1-CG2 3.87Å; L351-F402 HydrophobicContact CB-CE2 4.08Å; L351-F402 HydrophobicContact CB-CZ 4.21Å; L351-F402 HydrophobicContact CD1-CE1 4.33Å; L351-F402 HydrophobicContact CD1-CE2 4.44Å; L351-F402 HydrophobicContact CD1-CZ 3.75Å
352	K	92.8	Very high	92	Very high	145 Å²	145	76.7 Å²	76.7	63%	0.63	39%	0.385	S	S	*	.	H	α-helix	trans	-60.4	-40.4	175.3	-73.4	165.3	-171	170.9	0	111.9	C348 E349 K356	C348-K352 VanDerWaalsContact O-CD 3.31Å; C348-K352 WeakPolarHBondContact O-CD 3.22Å; C348-K352 WeakPolarHBondContact O-CG 3.45Å; C348-K352 PolarHBondContact O-N 3.36Å; E349-K352 PolarHBondContact O-N 3.06Å; K352-K356 WeakPolarHBondContact O-CB 3.23Å; K352-K356 PolarHBondContact O-N 2.68Å; K352-K356 VanDerWaalsContact O-N 3.15Å
353	Q	93.3	Very high	91.7	Very high	129 Å²	129	69.2 Å²	69.2	60%	0.603	36%	0.355	S	S	*	.	H	α-helix	trans	-68.9	-40.7	177.1	-170.2	175.3	9.3	0	0	111.7	E349 A350 L351 K356 N357	E349-Q353 PolarHBondContact O-N 3.41Å; A350-Q353 PolarHBondContact O-N 3Å; L351-Q353 VanDerWaalsContact C-N 3.3Å; L351-Q353 PolarHBondContact O-N 2.82Å; Q353-K356 PolarHBondContact O-N 3.25Å; Q353-N357 WeakPolarHBondContact O-CB 3.46Å; Q353-N357 PolarHBondContact O-N 3.21Å; Q353-N357 PolarHBondContact O-ND2 3.42Å
354	Y	94.9	Very high	91.4	Very high	4 Å²	4	66.7 Å²	66.7	2%	0.016	35%	0.345	C	S	.	.	H	α-helix	trans	-59.7	-54.4	174.4	178.9	-109.6	0	0	0	111.3	A350 L351 K356 N357 V358 E382 H393 N399 F402	A350-Y354 WeakPolarHBondContact O-CB 3.49Å; A350-Y354 PolarHBondContact O-N 3.09Å; L351-Y354 PolarHBondContact O-N 3.38Å; Y354-K356 VanDerWaalsContact C-N 3.31Å; Y354-K356 PolarHBondContact O-N 3.27Å; Y354-N357 CarbonylContact O-C 3.55Å; Y354-N357 WeakPolarHBondContact O-CA 3.47Å; Y354-N357 WeakPolarHBondContact O-CB 3.3Å; Y354-N357 PolarHBondContact O-N 3.06Å; Y354-V358 HydrophobicContact CD1-CG2 4.12Å; Y354-V358 HydrophobicContact CD2-CG2 4.02Å; Y354-V358 HydrophobicContact CE1-CG2 3.78Å; Y354-V358 HydrophobicContact CE2-CG2 3.63Å; Y354-V358 HydrophobicContact CG-CG2 4.24Å; Y354-V358 WeakPolarHBondContact O-CG2 3.36Å; Y354-V358 PolarHBondContact O-N 2.84Å; Y354-E382 PolarHBondContact OH-OE1 2.9Å; Y354-H393 AromaticContact CE2-NE2 3.48Å; Y354-H393 WeakPolarHBondContact CE2-NE2 3.29Å; Y354-H393 AromaticContact CZ-NE2 3.6Å; Y354-H393 PolarHBondContact OH-NE2 2.7Å; Y354-N399 HydrophobicContact CE2-CB 4.28Å; Y354-F402 AromaticContact CD1-CD1 3.41Å; Y354-F402 HydrophobicContact CD1-CD1 3.41Å; Y354-F402 VanDerWaalsContact CD1-CD1 3.41Å; Y354-F402 AromaticContact CD1-CE1 3.46Å; Y354-F402 HydrophobicContact CD1-CE1 3.46Å; Y354-F402 VanDerWaalsContact CD1-CE1 3.46Å; Y354-F402 HydrophobicContact CD1-CG 4.22Å; Y354-F402 HydrophobicContact CD1-CZ 4.33Å; Y354-F402 HydrophobicContact CD2-CB 3.62Å; Y354-F402 AromaticContact CD2-CD1 3.52Å; Y354-F402 HydrophobicContact CD2-CD1 3.52Å; Y354-F402 HydrophobicContact CD2-CE1 4.42Å; Y354-F402 AromaticContact CD2-CG 3.8Å; Y354-F402 HydrophobicContact CD2-CG 3.8Å; Y354-F402 AromaticContact CE1-CD1 3.72Å; Y354-F402 HydrophobicContact CE1-CD1 3.72Å; Y354-F402 AromaticContact CE1-CE1 3.8Å; Y354-F402 HydrophobicContact CE1-CE1 3.8Å; Y354-F402 HydrophobicContact CE2-CB 4.28Å; Y354-F402 AromaticContact CE2-CD1 3.85Å; Y354-F402 HydrophobicContact CE2-CD1 3.85Å; Y354-F402 HydrophobicContact CE2-CG 4.46Å; Y354-F402 HydrophobicContact CG-CB 3.98Å; Y354-F402 AromaticContact CG-CD1 3.29Å; Y354-F402 HydrophobicContact CG-CD1 3.29Å; Y354-F402 HydrophobicContact CG-CD2 4.43Å; Y354-F402 AromaticContact CG-CE1 3.8Å; Y354-F402 HydrophobicContact CG-CE1 3.8Å; Y354-F402 AromaticContact CG-CG 3.66Å; Y354-F402 HydrophobicContact CG-CG 3.66Å; Y354-F402 AromaticContact CZ-CD1 3.93Å
355	L	91.9	Very high	91	Very high	35 Å²	35	68.2 Å²	68.2	18%	0.183	35%	0.351	C	S	.	.	H	α-helix	trans	-53.5	-46.7	177.9	-68.7	169.7	0	0	0	111.8	L351 N357 V358 S359 V367 A369 V380	L351-L355 HydrophobicContact CD1-CD1 4.04Å; L351-L355 HydrophobicContact CD1-CD2 4.39Å; L351-L355 HydrophobicContact CD1-CG 3.96Å; L351-L355 HydrophobicContact CG-CD1 4Å; L351-L355 HydrophobicContact CG-CG 4.38Å; L351-L355 WeakPolarHBondContact O-CB 3.37Å; L351-L355 WeakPolarHBondContact O-CG 3.42Å; L351-L355 PolarHBondContact O-N 3.45Å; L355-N357 VanDerWaalsContact C-N 3.31Å; L355-N357 PolarHBondContact O-N 3.11Å; L355-V358 PolarHBondContact O-N 2.84Å; L355-S359 WeakPolarHBondContact O-CB 3.2Å; L355-S359 PolarHBondContact O-N 2.88Å; L355-S359 PolarHBondContact O-OG 3.19Å; L355-V367 HydrophobicContact CD2-CB 4.49Å; L355-V367 HydrophobicContact CD2-CG1 4.25Å; L355-V367 HydrophobicContact CD2-CG2 3.55Å; L355-A369 HydrophobicContact CD1-CB 3.83Å; L355-A369 HydrophobicContact CD2-CB 4.19Å; L355-V380 HydrophobicContact CD2-CG1 4.32Å
356	K	90.9	Very high	90.7	Very high	157 Å²	157	70.3 Å²	70.3	68%	0.683	35%	0.347	S	S	*	.	H	α-helix	trans	-61.9	-36.4	176.6	-176.3	179	178.4	-178.3	0	113	K352 Q353 Y354 S359	K352-K356 WeakPolarHBondContact O-CB 3.23Å; K352-K356 PolarHBondContact O-N 2.68Å; K352-K356 VanDerWaalsContact O-N 3.15Å; Q353-K356 PolarHBondContact O-N 3.25Å; Y354-K356 VanDerWaalsContact C-N 3.31Å; Y354-K356 PolarHBondContact O-N 3.27Å; K356-S359 PolarHBondContact O-OG 3.25Å
357	N	92.3	Very high	90.5	Very high	60 Å²	60	67 Å²	67	32%	0.321	33%	0.333	S	S	.	.	H	α-helix	trans	-76.8	-29.6	178	-70.4	-22.8	0	0	0	112.8	Q353 Y354 L355 Q361 P398	Q353-N357 WeakPolarHBondContact O-CB 3.46Å; Q353-N357 PolarHBondContact O-N 3.21Å; Q353-N357 PolarHBondContact O-ND2 3.42Å; Y354-N357 CarbonylContact O-C 3.55Å; Y354-N357 WeakPolarHBondContact O-CA 3.47Å; Y354-N357 WeakPolarHBondContact O-CB 3.3Å; Y354-N357 PolarHBondContact O-N 3.06Å; L355-N357 VanDerWaalsContact C-N 3.31Å; L355-N357 PolarHBondContact O-N 3.11Å; N357-Q361 WeakPolarHBondContact O-CG 3.39Å; N357-Q361 PolarHBondContact O-NE2 2.79Å; N357-Q361 VanDerWaalsContact O-NE2 3.11Å; N357-P398 HydrophobicContact CB-CB 3.87Å; N357-P398 HydrophobicContact CB-CG 4.21Å
358	V	89.9	Confident	90.2	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-76.4	-47.3	175.8	173.7	0	0	0	0	110.3	Y354 L355 A360 Q361 C364 V367 W384	Y354-V358 HydrophobicContact CD1-CG2 4.12Å; Y354-V358 HydrophobicContact CD2-CG2 4.02Å; Y354-V358 HydrophobicContact CE1-CG2 3.78Å; Y354-V358 HydrophobicContact CE2-CG2 3.63Å; Y354-V358 HydrophobicContact CG-CG2 4.24Å; Y354-V358 WeakPolarHBondContact O-CG2 3.36Å; Y354-V358 PolarHBondContact O-N 2.84Å; L355-V358 PolarHBondContact O-N 2.84Å; V358-A360 PolarHBondContact O-N 3.38Å; V358-Q361 WeakPolarHBondContact O-CB 3.17Å; V358-Q361 PolarHBondContact O-N 3.01Å; V358-C364 HydrophobicContact CG1-CB 4.25Å; V358-C364 VanDerWaalsContact CG1-SG 3.56Å; V358-V367 HydrophobicContact CB-CB 4.46Å; V358-V367 HydrophobicContact CB-CG1 4.02Å; V358-V367 HydrophobicContact CB-CG2 4.49Å; V358-V367 HydrophobicContact CG1-CB 3.75Å; V358-V367 HydrophobicContact CG1-CG1 3.76Å; V358-V367 HydrophobicContact CG1-CG2 3.96Å; V358-W384 HydrophobicContact CG1-CH2 4.15Å; V358-W384 HydrophobicContact CG1-CZ2 3.96Å
359	S	87.4	Confident	90.1	Very high	81 Å²	81	69.9 Å²	69.9	57%	0.566	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-6.1	179.2	69.7	0	0	0	0	114.7	L355 K356	L355-S359 WeakPolarHBondContact O-CB 3.2Å; L355-S359 PolarHBondContact O-N 2.88Å; L355-S359 PolarHBondContact O-OG 3.19Å; K356-S359 PolarHBondContact O-OG 3.25Å
360	A	86.1	Confident	89.8	Confident	82 Å²	82	66.5 Å²	66.5	68%	0.678	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-3	174.2	0	0	0	0	0	113.3	V358	V358-A360 PolarHBondContact O-N 3.38Å
361	Q	86.6	Confident	89.7	Confident	52 Å²	52	72.1 Å²	72.1	24%	0.243	36%	0.359	C	S	.	.			trans	-88.5	133.2	178.2	-55.1	-174.8	23.2	0	0	108.9	N357 V358 D363 C364 H393	N357-Q361 WeakPolarHBondContact O-CG 3.39Å; N357-Q361 PolarHBondContact O-NE2 2.79Å; N357-Q361 VanDerWaalsContact O-NE2 3.11Å; V358-Q361 WeakPolarHBondContact O-CB 3.17Å; V358-Q361 PolarHBondContact O-N 3.01Å; Q361-D363 VanDerWaalsContact C-N 3.31Å; Q361-D363 PolarHBondContact O-N 3.45Å; Q361-C364 HydrophobicContact CB-CB 4.39Å; Q361-C364 PolarHBondContact O-N 2.87Å; Q361-H393 PolarHBondContact NE2-CE1 2.81Å; Q361-H393 PolarHBondContact NE2-ND1 3.03Å; Q361-H393 PolarHBondContact OE1-ND1 3.16Å
362	R	83.8	Confident	89.4	Confident	233 Å²	233	74.3 Å²	74.3	88%	0.879	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-38.1	-175.9	-66.2	179.9	177.5	-179.8	-1.9	112.1	C364	R362-C364 PolarHBondContact O-N 2.93Å
363	D	85.8	Confident	89	Confident	47 Å²	47	74 Å²	74	25%	0.251	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-2.6	-176.4	-43.7	27.7	0	0	0	112.7	Q361 W384 D385 E389 R392	Q361-D363 VanDerWaalsContact C-N 3.31Å; Q361-D363 PolarHBondContact O-N 3.45Å; D363-W384 VanDerWaalsContact O-CE3 3.3Å; D363-D385 PolarHBondContact O-N 2.84Å; D363-D385 VanDerWaalsContact O-N 3.07Å; D363-E389 HydrophobicContact CB-CB 4.06Å; D363-E389 HydrophobicContact CB-CG 4.01Å; D363-R392 IonicContact OD2-CZ 2.71Å; D363-R392 IonicContact OD2-NH1 2.7Å; D363-R392 PolarHBondContact OD2-NH1 3.48Å; D363-R392 IonicContact OD2-NH2 2.68Å; D363-R392 PolarHBondContact OD2-NH2 3.22Å
364	C	87.4	Confident	88.7	Confident	12 Å²	12	72.3 Å²	72.3	8%	0.081	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	111.1	173.3	-174.9	0	0	0	0	109.7	V358 Q361 R362 H366 F383 W384	V358-C364 HydrophobicContact CG1-CB 4.25Å; V358-C364 VanDerWaalsContact CG1-SG 3.56Å; Q361-C364 HydrophobicContact CB-CB 4.39Å; Q361-C364 PolarHBondContact O-N 2.87Å; R362-C364 PolarHBondContact O-N 2.93Å; C364-H366 PolarHBondContact SG-O 3.5Å; C364-F383 CarbonylContact C-O 3.49Å; C364-F383 WeakPolarHBondContact CA-O 3.35Å; C364-F383 PolarHBondContact SG-O 3.38Å; C364-W384 HydrophobicContact CB-CD2 4.36Å; C364-W384 HydrophobicContact CB-CE3 3.91Å; C364-W384 HydrophobicContact CB-CH2 3.75Å; C364-W384 HydrophobicContact CB-CZ2 4.26Å; C364-W384 HydrophobicContact CB-CZ3 3.59Å
365	F	85.8	Confident	88.3	Confident	67 Å²	67	72.9 Å²	72.9	29%	0.294	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	-41.9	180	-175.6	-83.9	0	0	0	112.4	L330 F383 C426	L330-F365 HydrophobicContact CD1-CB 3.89Å; L330-F365 HydrophobicContact CD1-CD1 3.88Å; L330-F365 HydrophobicContact CD1-CD2 3.95Å; L330-F365 HydrophobicContact CD1-CE1 4.46Å; L330-F365 HydrophobicContact CD1-CE2 4.49Å; L330-F365 HydrophobicContact CD1-CG 3.62Å; L330-F365 HydrophobicContact CD2-CB 4.21Å; L330-F365 HydrophobicContact CD2-CD2 4.45Å; L330-F365 HydrophobicContact CD2-CG 4.49Å; F365-F383 HydrophobicContact CB-CB 4.1Å; F365-F383 PolarHBondContact N-O 3.02Å; F365-C426 HydrophobicContact CD1-CB 4.1Å; F365-C426 HydrophobicContact CE1-CB 3.5Å; F365-C426 WeakPolarHBondContact CE1-O 3.47Å; F365-C426 HydrophobicContact CZ-CB 3.92Å; F365-C426 WeakPolarHBondContact CZ-O 3.39Å
366	H	86.3	Confident	88.3	Confident	91 Å²	91	73.7 Å²	73.7	42%	0.421	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	150.2	179.5	-174.8	67.7	0	0	0	111.6	C364 F383	C364-H366 PolarHBondContact SG-O 3.5Å; H366-F383 HydrophobicContact CB-CB 4.34Å; H366-F383 HydrophobicContact CB-CD2 3.97Å; H366-F383 HydrophobicContact CB-CG 4.4Å; H366-F383 PolarHBondContact O-N 3.44Å
367	V	90.5	Very high	88.4	Confident	18 Å²	18	66.7 Å²	66.7	11%	0.109	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	139	169	67.6	0	0	0	0	110.9	L355 V358 V380 Y381 E382	L355-V367 HydrophobicContact CD2-CB 4.49Å; L355-V367 HydrophobicContact CD2-CG1 4.25Å; L355-V367 HydrophobicContact CD2-CG2 3.55Å; V358-V367 HydrophobicContact CB-CB 4.46Å; V358-V367 HydrophobicContact CB-CG1 4.02Å; V358-V367 HydrophobicContact CB-CG2 4.49Å; V358-V367 HydrophobicContact CG1-CB 3.75Å; V358-V367 HydrophobicContact CG1-CG1 3.76Å; V358-V367 HydrophobicContact CG1-CG2 3.96Å; V367-V380 HydrophobicContact CG2-CG1 4.25Å; V367-Y381 WeakPolarHBondContact CA-O 3.42Å; V367-E382 HydrophobicContact CG2-CB 4.48Å; V367-E382 HydrophobicContact CG2-CG 3.84Å
368	T	89.7	Confident	88.5	Confident	56 Å²	56	64.3 Å²	64.3	34%	0.344	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	157	176.2	-174.2	0	0	0	0	111.3	V380 Y381	T368-V380 WeakPolarHBondContact O-CA 3.49Å; T368-Y381 HydrophobicContact CG2-CD2 4.38Å; T368-Y381 PolarHBondContact N-O 2.83Å; T368-Y381 PolarHBondContact O-N 3.06Å
369	A	91.9	Very high	88.7	Confident	32 Å²	32	64.5 Å²	64.5	26%	0.264	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	132.4	174.7	0	0	0	0	0	111.2	L351 L355 V379 V380	L351-A369 HydrophobicContact CD1-CB 4.22Å; L351-A369 HydrophobicContact CD2-CB 4.07Å; L351-A369 HydrophobicContact CG-CB 4.47Å; L355-A369 HydrophobicContact CD1-CB 3.83Å; L355-A369 HydrophobicContact CD2-CB 4.19Å; A369-V379 WeakPolarHBondContact CA-O 3.48Å; A369-V380 HydrophobicContact CB-CG2 4.1Å
370	V	89.1	Confident	89	Confident	68 Å²	68	60.6 Å²	60.6	41%	0.412	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.5	178.1	-176.5	0	0	0	0	108.6	L372 F378 V379 Y381	V370-L372 HydrophobicContact CG1-CD2 4.48Å; V370-F378 CarbonylContact O-C 3.59Å; V370-F378 WeakPolarHBondContact O-CA 3.28Å; V370-V379 PolarHBondContact N-O 3.47Å; V370-V379 PolarHBondContact O-N 3.37Å; V370-Y381 HydrophobicContact CG2-CE2 4.31Å
371	R	92.6	Very high	89.2	Confident	136 Å²	136	60.1 Å²	60.1	51%	0.513	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130.5	169.7	-173.8	177.8	-179.5	-150.8	-2.6	108.4	G375 F378	R371-G375 VanDerWaalsContact CZ-O 3.23Å; R371-G375 PolarHBondContact NE-O 3.24Å; R371-G375 PolarHBondContact NH2-O 2.96Å; R371-F378 HydrophobicContact CB-CD1 3.93Å; R371-F378 HydrophobicContact CB-CE1 3.76Å; R371-F378 HydrophobicContact CB-CZ 4.35Å; R371-F378 HydrophobicContact CG-CD1 4.1Å; R371-F378 HydrophobicContact CG-CE1 3.64Å; R371-F378 HydrophobicContact CG-CE2 4.22Å; R371-F378 HydrophobicContact CG-CZ 3.71Å
372	L	88.6	Confident	89.5	Confident	55 Å²	55	57.6 Å²	57.6	29%	0.288	29%	0.291	S	S	.	.			trans	-79.8	164.9	-177	-60.1	-170.8	0	0	0	111.8	V370 D374 G375 S377 V379	V370-L372 HydrophobicContact CG1-CD2 4.48Å; L372-D374 PolarHBondContact O-N 3.22Å; L372-D374 VanDerWaalsContact O-N 3.15Å; L372-G375 PolarHBondContact O-N 2.88Å; L372-S377 PolarHBondContact N-O 2.84Å; L372-V379 HydrophobicContact CD1-CG2 4.21Å; L372-V379 HydrophobicContact CD2-CG2 4.17Å; L372-V379 HydrophobicContact CG-CG2 4.31Å
373	P	85.1	Confident	89.8	Confident	140 Å²	140	48.2 Å²	48.2	91%	0.909	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.3	-175.6	-25.8	36.4	0	0	0	115.5	G375	P373-G375 PolarHBondContact O-N 3.26Å
374	D	86.6	Confident	90.2	Very high	93 Å²	93	46 Å²	46	50%	0.497	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.8	172.5	65.8	9.9	0	0	0	113.4	L372 L376 S377	L372-D374 PolarHBondContact O-N 3.22Å; L372-D374 VanDerWaalsContact O-N 3.15Å; D374-L376 PolarHBondContact O-N 3.06Å; D374-L376 PolarHBondContact OD1-N 2.76Å; D374-S377 PolarHBondContact OD1-N 2.81Å; D374-S377 WeakPolarHBondContact OD2-CB 3.2Å; D374-S377 PolarHBondContact OD2-OG 2.93Å
375	G	87	Confident	90.2	Very high	15 Å²	15	49.4 Å²	49.4	16%	0.155	26%	0.262	C	S	.	.	S	Bend	trans	71	0.8	-177.6	0	0	0	0	0	115.4	R371 L372 P373	R371-G375 VanDerWaalsContact CZ-O 3.23Å; R371-G375 PolarHBondContact NE-O 3.24Å; R371-G375 PolarHBondContact NH2-O 2.96Å; L372-G375 PolarHBondContact O-N 2.88Å; P373-G375 PolarHBondContact O-N 3.26Å
376	L	92.2	Very high	90.1	Very high	53 Å²	53	47 Å²	47	28%	0.277	26%	0.255	S	S	.	.	S	Bend	trans	-120.6	-23.6	-176.6	-65.5	-179.8	0	0	0	113	V339 Q341 L344 D374 F378	V339-L376 WeakPolarHBondContact CB-O 3.4Å; V339-L376 WeakPolarHBondContact CG2-O 3.26Å; V339-L376 PolarHBondContact N-O 2.95Å; Q341-L376 HydrophobicContact CB-CD1 4.39Å; Q341-L376 HydrophobicContact CB-CD2 4Å; Q341-L376 HydrophobicContact CG-CD2 4.26Å; L344-L376 HydrophobicContact CD1-CD2 4.39Å; L344-L376 HydrophobicContact CD2-CD2 4.21Å; D374-L376 PolarHBondContact O-N 3.06Å; D374-L376 PolarHBondContact OD1-N 2.76Å; L376-F378 WeakPolarHBondContact O-CD2 3.48Å
377	S	92.6	Very high	90.2	Very high	10 Å²	10	47.6 Å²	47.6	7%	0.07	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	141	178.1	-55.5	0	0	0	0	111.5	M337 L372 D374	M337-S377 CarbonylContact O-C 3.55Å; M337-S377 VanDerWaalsContact O-CA 3.32Å; M337-S377 WeakPolarHBondContact O-CA 3.47Å; L372-S377 PolarHBondContact N-O 2.84Å; D374-S377 PolarHBondContact OD1-N 2.81Å; D374-S377 WeakPolarHBondContact OD2-CB 3.2Å; D374-S377 PolarHBondContact OD2-OG 2.93Å
378	F	94.4	Very high	90.1	Very high	10 Å²	10	51.8 Å²	51.8	4%	0.044	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	142.1	-177	-67.8	-103.9	0	0	0	110.1	E336 M337 V339 L344 F347 L351 V370 R371 L376	E336-F378 WeakPolarHBondContact CA-O 3.31Å; M337-F378 PolarHBondContact N-O 3.32Å; M337-F378 PolarHBondContact O-N 2.92Å; V339-F378 HydrophobicContact CB-CE2 4.37Å; V339-F378 HydrophobicContact CG2-CD2 3.55Å; V339-F378 HydrophobicContact CG2-CE2 3.77Å; L344-F378 HydrophobicContact CD1-CE2 3.64Å; L344-F378 HydrophobicContact CD1-CZ 3.81Å; F347-F378 HydrophobicContact CD1-CD2 4.33Å; F347-F378 HydrophobicContact CD1-CE2 4.22Å; F347-F378 HydrophobicContact CD1-CZ 4.41Å; F347-F378 HydrophobicContact CE1-CB 4.21Å; F347-F378 HydrophobicContact CE1-CD1 4.06Å; F347-F378 AromaticContact CE1-CD2 3.75Å; F347-F378 HydrophobicContact CE1-CD2 3.75Å; F347-F378 HydrophobicContact CE1-CE1 4.33Å; F347-F378 HydrophobicContact CE1-CE2 4.06Å; F347-F378 AromaticContact CE1-CG 3.75Å; F347-F378 HydrophobicContact CE1-CG 3.75Å; F347-F378 HydrophobicContact CE1-CZ 4.33Å; F347-F378 HydrophobicContact CZ-CB 4.46Å; F347-F378 HydrophobicContact CZ-CG 4.47Å; L351-F378 HydrophobicContact CD2-CD1 3.91Å; L351-F378 HydrophobicContact CD2-CE1 4.31Å; V370-F378 CarbonylContact O-C 3.59Å; V370-F378 WeakPolarHBondContact O-CA 3.28Å; R371-F378 HydrophobicContact CB-CD1 3.93Å; R371-F378 HydrophobicContact CB-CE1 3.76Å; R371-F378 HydrophobicContact CB-CZ 4.35Å; R371-F378 HydrophobicContact CG-CD1 4.1Å; R371-F378 HydrophobicContact CG-CE1 3.64Å; R371-F378 HydrophobicContact CG-CE2 4.22Å; R371-F378 HydrophobicContact CG-CZ 3.71Å; L376-F378 WeakPolarHBondContact O-CD2 3.48Å
379	V	93.2	Very high	90.1	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.018	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	118	174.3	-170.7	0	0	0	0	108.7	R334 Q335 E336 A369 V370 L372 Y381	R334-V379 HydrophobicContact CG-CG1 3.63Å; Q335-V379 CarbonylContact O-C 3.52Å; Q335-V379 WeakPolarHBondContact O-CA 3.35Å; E336-V379 HydrophobicContact CB-CG2 4.49Å; E336-V379 HydrophobicContact CG-CG2 4.3Å; A369-V379 WeakPolarHBondContact CA-O 3.48Å; V370-V379 PolarHBondContact N-O 3.47Å; V370-V379 PolarHBondContact O-N 3.37Å; L372-V379 HydrophobicContact CD1-CG2 4.21Å; L372-V379 HydrophobicContact CD2-CG2 4.17Å; L372-V379 HydrophobicContact CG-CG2 4.31Å; V379-Y381 HydrophobicContact CB-CE2 4.09Å; V379-Y381 HydrophobicContact CG1-CD2 4.16Å; V379-Y381 HydrophobicContact CG1-CE1 4.19Å; V379-Y381 HydrophobicContact CG1-CE2 3.51Å
380	V	93.2	Very high	90.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	131.5	174.8	-172.4	0	0	0	0	108.5	R334 Q335 M337 L351 L355 V367 T368 A369 E382	R334-V380 WeakPolarHBondContact CA-O 3.4Å; Q335-V380 HydrophobicContact CB-CB 4.36Å; Q335-V380 PolarHBondContact N-O 2.83Å; Q335-V380 PolarHBondContact O-N 2.88Å; M337-V380 HydrophobicContact CE-CG2 4.18Å; L351-V380 HydrophobicContact CD1-CG2 3.87Å; L355-V380 HydrophobicContact CD2-CG1 4.32Å; V367-V380 HydrophobicContact CG2-CG1 4.25Å; T368-V380 WeakPolarHBondContact O-CA 3.49Å; A369-V380 HydrophobicContact CB-CG2 4.1Å; V380-E382 HydrophobicContact CG1-CG 4.16Å
381	Y	91.8	Very high	90.2	Very high	71 Å²	71	52.3 Å²	52.3	28%	0.278	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122.5	174.2	-63.4	-86.1	0	0	0	109	L332 I333 R334 V367 T368 V370 V379	L332-Y381 HydrophobicContact CD1-CD1 4.24Å; I333-Y381 WeakPolarHBondContact O-CA 3.41Å; R334-Y381 HydrophobicContact CB-CD1 3.99Å; R334-Y381 HydrophobicContact CB-CE1 3.97Å; R334-Y381 HydrophobicContact CG-CD1 4.03Å; R334-Y381 HydrophobicContact CG-CE1 3.6Å; V367-Y381 WeakPolarHBondContact CA-O 3.42Å; T368-Y381 HydrophobicContact CG2-CD2 4.38Å; T368-Y381 PolarHBondContact N-O 2.83Å; T368-Y381 PolarHBondContact O-N 3.06Å; V370-Y381 HydrophobicContact CG2-CE2 4.31Å; V379-Y381 HydrophobicContact CB-CE2 4.09Å; V379-Y381 HydrophobicContact CG1-CD2 4.16Å; V379-Y381 HydrophobicContact CG1-CE1 4.19Å; V379-Y381 HydrophobicContact CG1-CE2 3.51Å
382	E	92.8	Very high	90.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	133.6	177.9	-52.2	168.2	-175	0	0	109.2	L332 I333 Q335 Y354 V367 V380 W384	L332-E382 WeakPolarHBondContact CA-O 3.44Å; I333-E382 HydrophobicContact CB-CB 4.28Å; I333-E382 PolarHBondContact N-O 2.84Å; I333-E382 PolarHBondContact O-N 2.97Å; Q335-E382 PolarHBondContact NE2-OE1 3.11Å; Y354-E382 PolarHBondContact OH-OE1 2.9Å; V367-E382 HydrophobicContact CG2-CB 4.48Å; V367-E382 HydrophobicContact CG2-CG 3.84Å; V380-E382 HydrophobicContact CG1-CG 4.16Å; E382-W384 VanDerWaalsContact CB-NE1 3.33Å; E382-W384 PolarHBondContact OE2-NE1 3.03Å
383	F	90.4	Very high	90.4	Very high	35 Å²	35	49.7 Å²	49.7	15%	0.154	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118	175.5	-64	-104.6	0	0	0	108	L330 L332 C364 F365 H366 V421	L330-F383 HydrophobicContact CD1-CB 4.43Å; L330-F383 HydrophobicContact CD1-CD1 4.46Å; L332-F383 HydrophobicContact CB-CD1 4.37Å; L332-F383 HydrophobicContact CB-CE1 4.35Å; L332-F383 HydrophobicContact CD1-CD1 4.05Å; L332-F383 HydrophobicContact CD1-CD2 4.04Å; L332-F383 HydrophobicContact CD1-CE1 3.76Å; L332-F383 HydrophobicContact CD1-CE2 3.74Å; L332-F383 HydrophobicContact CD1-CG 4.19Å; L332-F383 HydrophobicContact CD1-CZ 3.6Å; L332-F383 HydrophobicContact CD2-CE1 4.12Å; L332-F383 HydrophobicContact CD2-CZ 4.24Å; L332-F383 HydrophobicContact CG-CE1 4.3Å; L332-F383 HydrophobicContact CG-CZ 4.46Å; C364-F383 CarbonylContact C-O 3.49Å; C364-F383 WeakPolarHBondContact CA-O 3.35Å; C364-F383 PolarHBondContact SG-O 3.38Å; F365-F383 HydrophobicContact CB-CB 4.1Å; F365-F383 PolarHBondContact N-O 3.02Å; H366-F383 HydrophobicContact CB-CB 4.34Å; H366-F383 HydrophobicContact CB-CD2 3.97Å; H366-F383 HydrophobicContact CB-CG 4.4Å; H366-F383 PolarHBondContact O-N 3.44Å; F383-V421 HydrophobicContact CD1-CG2 4.48Å; F383-V421 HydrophobicContact CE1-CG2 4.5Å
384	W	92.5	Very high	90.7	Very high	1 Å²	1	45.4 Å²	45.4	0%	0.004	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	148.1	-178.2	-66.2	95.2	0	0	0	110.7	L330 L331 V358 D363 C364 E382 G386 E389 W390 H393	L330-W384 CarbonylContact C-O 3.58Å; L330-W384 WeakPolarHBondContact CA-O 3.31Å; L331-W384 HydrophobicContact CB-CB 4.4Å; L331-W384 PolarHBondContact N-O 2.89Å; L331-W384 PolarHBondContact O-N 2.72Å; V358-W384 HydrophobicContact CG1-CH2 4.15Å; V358-W384 HydrophobicContact CG1-CZ2 3.96Å; D363-W384 VanDerWaalsContact O-CE3 3.3Å; C364-W384 HydrophobicContact CB-CD2 4.36Å; C364-W384 HydrophobicContact CB-CE3 3.91Å; C364-W384 HydrophobicContact CB-CH2 3.75Å; C364-W384 HydrophobicContact CB-CZ2 4.26Å; C364-W384 HydrophobicContact CB-CZ3 3.59Å; E382-W384 VanDerWaalsContact CB-NE1 3.33Å; E382-W384 PolarHBondContact OE2-NE1 3.03Å; W384-G386 PolarHBondContact O-N 2.97Å; W384-E389 HydrophobicContact CE3-CB 4.38Å; W384-W390 HydrophobicContact CB-CB 4.27Å; W384-W390 AromaticContact CD1-CD1 3.72Å; W384-W390 HydrophobicContact CD2-CB 4.27Å; W384-W390 HydrophobicContact CG-CB 3.91Å; W384-W390 HydrophobicContact CG-CG 4.47Å; W384-W390 AromaticContact NE1-CD1 3.46Å; W384-H393 HydrophobicContact CE3-CB 4.46Å; W384-H393 HydrophobicContact CH2-CB 3.46Å; W384-H393 VanDerWaalsContact CH2-CB 3.46Å; W384-H393 AromaticContact CH2-CD2 3.97Å; W384-H393 AromaticContact CH2-CG 3.23Å; W384-H393 AromaticContact CH2-ND1 3.29Å; W384-H393 VanDerWaalsContact CH2-ND1 3.29Å; W384-H393 WeakPolarHBondContact CH2-ND1 3.35Å; W384-H393 HydrophobicContact CZ2-CB 3.76Å; W384-H393 AromaticContact CZ2-CD2 3.65Å; W384-H393 AromaticContact CZ2-CG 3.38Å; W384-H393 AromaticContact CZ2-ND1 3.77Å; W384-H393 HydrophobicContact CZ3-CB 3.81Å
385	D	87.6	Confident	90.9	Very high	84 Å²	84	47.2 Å²	47.2	45%	0.449	22%	0.224	S	C	.	.	S	Bend	trans	-68	-14.8	177.5	-67.9	-19.6	0	0	0	113	L330 D363 E389	L330-D385 WeakPolarHBondContact CD2-OD1 3.29Å; D363-D385 PolarHBondContact O-N 2.84Å; D363-D385 VanDerWaalsContact O-N 3.07Å; D385-E389 HydrophobicContact CB-CG 4.33Å
386	G	85	Confident	91.2	Very high	15 Å²	15	47.7 Å²	47.7	16%	0.155	23%	0.225	C	C	.	.			trans	-175.3	175.5	177.2	0	0	0	0	0	114.3	W384 E389 W390	W384-G386 PolarHBondContact O-N 2.97Å; G386-E389 VanDerWaalsContact CA-OE2 3.24Å; G386-E389 WeakPolarHBondContact CA-OE2 3.35Å; G386-W390 PolarHBondContact O-N 3.19Å
387	E	86.5	Confident	91.2	Very high	105 Å²	105	48.9 Å²	48.9	49%	0.491	24%	0.242	S	C	.	.	H	α-helix	trans	-74.6	-31.7	-179.5	-158	-169.1	134.5	0	0	112.6	L331 W390 K391	L331-E387 HydrophobicContact CD2-CB 3.91Å; L331-E387 HydrophobicContact CD2-CG 3.89Å; E387-W390 HydrophobicContact CG-CE3 4.32Å; E387-K391 VanDerWaalsContact CD-NZ 3.35Å; E387-K391 WeakPolarHBondContact O-CB 3.42Å; E387-K391 WeakPolarHBondContact O-CD 3.3Å; E387-K391 VanDerWaalsContact O-CG 3.23Å; E387-K391 WeakPolarHBondContact O-CG 3.36Å; E387-K391 PolarHBondContact O-N 3.34Å; E387-K391 WeakPolarHBondContact OE1-CE 3.34Å; E387-K391 IonicContact OE1-NZ 2.74Å; E387-K391 PolarHBondContact OE1-NZ 3.2Å
388	E	88.6	Confident	91.1	Very high	105 Å²	105	50.4 Å²	50.4	49%	0.491	25%	0.251	S	S	.	.	H	α-helix	trans	-73.6	-31.7	177.3	-60.1	-51.1	123.5	0	0	111.5	K391 R392	E388-K391 PolarHBondContact O-N 2.8Å; E388-K391 WeakPolarHBondContact OE1-CD 3.46Å; E388-K391 IonicContact OE1-NZ 2.65Å; E388-K391 PolarHBondContact OE1-NZ 2.82Å; E388-R392 WeakPolarHBondContact O-CB 3.38Å; E388-R392 VanDerWaalsContact O-CG 3.25Å; E388-R392 WeakPolarHBondContact O-CG 3.26Å; E388-R392 PolarHBondContact O-N 3.49Å
389	E	91.3	Very high	91	Very high	48 Å²	48	50.1 Å²	50.1	22%	0.224	25%	0.251	C	S	.	.	H	α-helix	trans	-64	-48.3	174.5	-65.9	43.3	-107.9	0	0	109.1	D363 W384 D385 G386 R392 H393	D363-E389 HydrophobicContact CB-CB 4.06Å; D363-E389 HydrophobicContact CB-CG 4.01Å; W384-E389 HydrophobicContact CE3-CB 4.38Å; D385-E389 HydrophobicContact CB-CG 4.33Å; G386-E389 VanDerWaalsContact CA-OE2 3.24Å; G386-E389 WeakPolarHBondContact CA-OE2 3.35Å; E389-R392 WeakPolarHBondContact O-CB 3.21Å; E389-R392 PolarHBondContact O-N 2.86Å; E389-R392 IonicContact OE1-CZ 2.67Å; E389-R392 IonicContact OE1-NE 2.73Å; E389-R392 IonicContact OE1-NH2 2.82Å; E389-R392 PolarHBondContact OE1-NH2 3.07Å; E389-H393 PolarHBondContact O-N 2.71Å
390	W	92.1	Very high	91	Very high	41 Å²	41	54.2 Å²	54.2	16%	0.155	27%	0.268	C	S	.	.	H	α-helix	trans	-63.7	-43.3	173.3	177.9	59.8	0	0	0	112.6	L331 I333 W384 G386 E387 R392 H393 L394 V416	L331-W390 HydrophobicContact CD2-CB 4.19Å; L331-W390 HydrophobicContact CD2-CD2 4.46Å; L331-W390 HydrophobicContact CD2-CE3 4.15Å; I333-W390 HydrophobicContact CD1-CD2 3.79Å; I333-W390 HydrophobicContact CD1-CE3 4.12Å; I333-W390 HydrophobicContact CD1-CG 4.25Å; I333-W390 HydrophobicContact CD1-CH2 4.23Å; I333-W390 HydrophobicContact CD1-CZ2 3.91Å; I333-W390 HydrophobicContact CD1-CZ3 4.33Å; I333-W390 HydrophobicContact CG1-CD2 4.11Å; I333-W390 HydrophobicContact CG1-CG 4.12Å; I333-W390 HydrophobicContact CG1-CZ2 4.4Å; I333-W390 HydrophobicContact CG2-CZ2 4.31Å; W384-W390 HydrophobicContact CB-CB 4.27Å; W384-W390 AromaticContact CD1-CD1 3.72Å; W384-W390 HydrophobicContact CD2-CB 4.27Å; W384-W390 HydrophobicContact CG-CB 3.91Å; W384-W390 HydrophobicContact CG-CG 4.47Å; W384-W390 AromaticContact NE1-CD1 3.46Å; G386-W390 PolarHBondContact O-N 3.19Å; E387-W390 HydrophobicContact CG-CE3 4.32Å; W390-R392 VanDerWaalsContact C-N 3.33Å; W390-R392 PolarHBondContact O-N 2.62Å; W390-H393 CarbonylContact O-C 3.57Å; W390-H393 WeakPolarHBondContact O-CA 3.35Å; W390-H393 WeakPolarHBondContact O-CB 3.4Å; W390-H393 PolarHBondContact O-N 3.16Å; W390-H393 VanDerWaalsContact O-N 3.08Å; W390-L394 HydrophobicContact CD2-CD1 4.15Å; W390-L394 HydrophobicContact CD2-CG 4.48Å; W390-L394 HydrophobicContact CE3-CD1 4.4Å; W390-L394 HydrophobicContact CH2-CD1 4.13Å; W390-L394 HydrophobicContact CZ2-CD1 3.84Å; W390-L394 HydrophobicContact CZ2-CD2 4.39Å; W390-L394 HydrophobicContact CZ2-CG 4.44Å; W390-L394 HydrophobicContact CZ3-CD1 4.39Å; W390-L394 WeakPolarHBondContact O-CG 3.46Å; W390-L394 PolarHBondContact O-N 2.84Å; W390-V416 HydrophobicContact CZ2-CG1 4.49Å
391	K	91.3	Very high	91.1	Very high	79 Å²	79	57 Å²	57	34%	0.343	29%	0.291	S	S	.	.	H	α-helix	trans	-60.2	-40.8	173.9	-74.8	162.7	-173.9	162.3	0	112.3	E387 E388 L394 Q395	E387-K391 VanDerWaalsContact CD-NZ 3.35Å; E387-K391 WeakPolarHBondContact O-CB 3.42Å; E387-K391 WeakPolarHBondContact O-CD 3.3Å; E387-K391 VanDerWaalsContact O-CG 3.23Å; E387-K391 WeakPolarHBondContact O-CG 3.36Å; E387-K391 PolarHBondContact O-N 3.34Å; E387-K391 WeakPolarHBondContact OE1-CE 3.34Å; E387-K391 IonicContact OE1-NZ 2.74Å; E387-K391 PolarHBondContact OE1-NZ 3.2Å; E388-K391 PolarHBondContact O-N 2.8Å; E388-K391 WeakPolarHBondContact OE1-CD 3.46Å; E388-K391 IonicContact OE1-NZ 2.65Å; E388-K391 PolarHBondContact OE1-NZ 2.82Å; K391-L394 PolarHBondContact O-N 3.48Å; K391-Q395 PolarHBondContact O-N 3.01Å
392	R	92.5	Very high	91.2	Very high	133 Å²	133	53.9 Å²	53.9	50%	0.502	28%	0.279	S	S	.	.	H	α-helix	trans	-62.4	-42.3	171.9	-74.5	-175.7	-66.4	116.1	-14.2	110.8	D363 E388 E389 W390 Q395 S396	D363-R392 IonicContact OD2-CZ 2.71Å; D363-R392 IonicContact OD2-NH1 2.7Å; D363-R392 PolarHBondContact OD2-NH1 3.48Å; D363-R392 IonicContact OD2-NH2 2.68Å; D363-R392 PolarHBondContact OD2-NH2 3.22Å; E388-R392 WeakPolarHBondContact O-CB 3.38Å; E388-R392 VanDerWaalsContact O-CG 3.25Å; E388-R392 WeakPolarHBondContact O-CG 3.26Å; E388-R392 PolarHBondContact O-N 3.49Å; E389-R392 WeakPolarHBondContact O-CB 3.21Å; E389-R392 PolarHBondContact O-N 2.86Å; E389-R392 IonicContact OE1-CZ 2.67Å; E389-R392 IonicContact OE1-NE 2.73Å; E389-R392 IonicContact OE1-NH2 2.82Å; E389-R392 PolarHBondContact OE1-NH2 3.07Å; W390-R392 VanDerWaalsContact C-N 3.33Å; W390-R392 PolarHBondContact O-N 2.62Å; R392-Q395 PolarHBondContact O-N 2.94Å; R392-S396 PolarHBondContact O-N 2.99Å
393	H	92.4	Very high	91.3	Very high	3 Å²	3	56.4 Å²	56.4	1%	0.014	29%	0.291	C	S	.	.	H	α-helix	trans	-61	-44.2	174.8	-178.2	73.8	0	0	0	112.9	Y354 Q361 W384 E389 W390 Q395 S396 N399	Y354-H393 AromaticContact CE2-NE2 3.48Å; Y354-H393 WeakPolarHBondContact CE2-NE2 3.29Å; Y354-H393 AromaticContact CZ-NE2 3.6Å; Y354-H393 PolarHBondContact OH-NE2 2.7Å; Q361-H393 PolarHBondContact NE2-CE1 2.81Å; Q361-H393 PolarHBondContact NE2-ND1 3.03Å; Q361-H393 PolarHBondContact OE1-ND1 3.16Å; W384-H393 HydrophobicContact CE3-CB 4.46Å; W384-H393 HydrophobicContact CH2-CB 3.46Å; W384-H393 VanDerWaalsContact CH2-CB 3.46Å; W384-H393 AromaticContact CH2-CD2 3.97Å; W384-H393 AromaticContact CH2-CG 3.23Å; W384-H393 AromaticContact CH2-ND1 3.29Å; W384-H393 VanDerWaalsContact CH2-ND1 3.29Å; W384-H393 WeakPolarHBondContact CH2-ND1 3.35Å; W384-H393 HydrophobicContact CZ2-CB 3.76Å; W384-H393 AromaticContact CZ2-CD2 3.65Å; W384-H393 AromaticContact CZ2-CG 3.38Å; W384-H393 AromaticContact CZ2-ND1 3.77Å; W384-H393 HydrophobicContact CZ3-CB 3.81Å; E389-H393 PolarHBondContact O-N 2.71Å; W390-H393 CarbonylContact O-C 3.57Å; W390-H393 WeakPolarHBondContact O-CA 3.35Å; W390-H393 WeakPolarHBondContact O-CB 3.4Å; W390-H393 PolarHBondContact O-N 3.16Å; W390-H393 VanDerWaalsContact O-N 3.08Å; H393-Q395 PolarHBondContact O-N 3.09Å; H393-Q395 VanDerWaalsContact O-N 3.14Å; H393-S396 WeakPolarHBondContact O-CB 3.24Å; H393-S396 PolarHBondContact O-N 3.32Å; H393-S396 PolarHBondContact O-OG 3.48Å; H393-N399 WeakPolarHBondContact O-CB 3.41Å
394	L	90.7	Very high	91.5	Very high	50 Å²	50	60.9 Å²	60.9	26%	0.262	31%	0.312	S	S	.	.	H	α-helix	trans	-57.5	-30.8	178.4	-71.4	176.3	0	0	0	112.4	W390 K391 N399	W390-L394 HydrophobicContact CD2-CD1 4.15Å; W390-L394 HydrophobicContact CD2-CG 4.48Å; W390-L394 HydrophobicContact CE3-CD1 4.4Å; W390-L394 HydrophobicContact CH2-CD1 4.13Å; W390-L394 HydrophobicContact CZ2-CD1 3.84Å; W390-L394 HydrophobicContact CZ2-CD2 4.39Å; W390-L394 HydrophobicContact CZ2-CG 4.44Å; W390-L394 HydrophobicContact CZ3-CD1 4.39Å; W390-L394 WeakPolarHBondContact O-CG 3.46Å; W390-L394 PolarHBondContact O-N 2.84Å; K391-L394 PolarHBondContact O-N 3.48Å; L394-N399 WeakPolarHBondContact CA-ND2 3.48Å; L394-N399 PolarHBondContact O-ND2 3.45Å
395	Q	91.6	Very high	91.7	Very high	131 Å²	131	62.3 Å²	62.3	61%	0.612	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-7.3	176.4	-64.4	-59.8	-23.9	0	0	114.6	K391 R392 H393 K400	K391-Q395 PolarHBondContact O-N 3.01Å; R392-Q395 PolarHBondContact O-N 2.94Å; H393-Q395 PolarHBondContact O-N 3.09Å; H393-Q395 VanDerWaalsContact O-N 3.14Å; Q395-K400 WeakPolarHBondContact O-CE 3.36Å; Q395-K400 PolarHBondContact O-NZ 3.37Å; Q395-K400 VanDerWaalsContact OE1-CE 3.31Å
396	S	92.5	Very high	91.9	Very high	25 Å²	25	58.6 Å²	58.6	18%	0.175	30%	0.3	C	S	.	.	S	Bend	trans	-68.6	152.5	-177.9	77.5	0	0	0	0	113.3	R392 H393 N399 K400	R392-S396 PolarHBondContact O-N 2.99Å; H393-S396 WeakPolarHBondContact O-CB 3.24Å; H393-S396 PolarHBondContact O-N 3.32Å; H393-S396 PolarHBondContact O-OG 3.48Å; S396-N399 PolarHBondContact O-N 3.26Å; S396-N399 PolarHBondContact OG-N 3.2Å; S396-K400 WeakPolarHBondContact O-CG 3.35Å; S396-K400 PolarHBondContact O-N 3.34Å
397	A	92.4	Very high	92.4	Very high	78 Å²	78	63.4 Å²	63.4	65%	0.645	33%	0.327	S	S	*	.	H	α-helix	trans	-62.1	-39.9	176.3	0	0	0	0	0	113.5	N399 K400 A401	A397-N399 PolarHBondContact O-N 2.86Å; A397-K400 PolarHBondContact O-N 2.97Å; A397-A401 WeakPolarHBondContact O-CB 3.43Å; A397-A401 PolarHBondContact O-N 3.3Å
398	P	89.9	Confident	92.8	Very high	41 Å²	41	63.1 Å²	63.1	27%	0.266	33%	0.329	S	S	.	.	H	α-helix	trans	-59.3	-42.9	173	-27.5	37.2	0	0	0	114	N357 F402	N357-P398 HydrophobicContact CB-CB 3.87Å; N357-P398 HydrophobicContact CB-CG 4.21Å; P398-F402 PolarHBondContact O-N 3.07Å; P398-F402 VanDerWaalsContact O-N 3.11Å
399	N	92.1	Very high	93.1	Very high	5 Å²	5	58.2 Å²	58.2	3%	0.027	31%	0.306	C	S	.	.	H	α-helix	trans	-65.5	-46	175.6	-179.5	58.9	0	0	0	111.5	Y354 H393 L394 S396 A397 A401 F402 Q403	Y354-N399 HydrophobicContact CE2-CB 4.28Å; H393-N399 WeakPolarHBondContact O-CB 3.41Å; L394-N399 WeakPolarHBondContact CA-ND2 3.48Å; L394-N399 PolarHBondContact O-ND2 3.45Å; S396-N399 PolarHBondContact O-N 3.26Å; S396-N399 PolarHBondContact OG-N 3.2Å; A397-N399 PolarHBondContact O-N 2.86Å; N399-A401 VanDerWaalsContact C-N 3.32Å; N399-A401 PolarHBondContact O-N 3.35Å; N399-F402 CarbonylContact O-C 3.6Å; N399-F402 PolarHBondContact O-N 3.49Å; N399-F402 VanDerWaalsContact O-N 3.12Å; N399-Q403 WeakPolarHBondContact O-CB 3.22Å; N399-Q403 WeakPolarHBondContact O-CG 3.44Å; N399-Q403 PolarHBondContact O-N 2.95Å
400	K	94.6	Very high	93.3	Very high	89 Å²	89	57.3 Å²	57.3	39%	0.387	30%	0.302	S	S	.	.	H	α-helix	trans	-60.2	-41.6	179.7	-75.7	168.8	175.3	161.5	0	112.2	Q395 S396 A397 Q403 H404	Q395-K400 WeakPolarHBondContact O-CE 3.36Å; Q395-K400 PolarHBondContact O-NZ 3.37Å; Q395-K400 VanDerWaalsContact OE1-CE 3.31Å; S396-K400 WeakPolarHBondContact O-CG 3.35Å; S396-K400 PolarHBondContact O-N 3.34Å; A397-K400 PolarHBondContact O-N 2.97Å; K400-Q403 PolarHBondContact O-N 3.37Å; K400-H404 PolarHBondContact O-CD2 3.01Å; K400-H404 PolarHBondContact O-N 3.32Å; K400-H404 VanDerWaalsContact O-N 3.09Å
401	A	93.5	Very high	93.4	Very high	59 Å²	59	59.3 Å²	59.3	49%	0.488	32%	0.322	S	S	.	.	H	α-helix	trans	-60.9	-44.3	173.2	0	0	0	0	0	112.3	A397 N399 H404 V405	A397-A401 WeakPolarHBondContact O-CB 3.43Å; A397-A401 PolarHBondContact O-N 3.3Å; N399-A401 VanDerWaalsContact C-N 3.32Å; N399-A401 PolarHBondContact O-N 3.35Å; A401-H404 PolarHBondContact O-N 2.84Å; A401-V405 PolarHBondContact O-N 3.36Å
402	F	95.3	Very high	93.4	Very high	5 Å²	5	61 Å²	61	2%	0.022	33%	0.331	C	S	.	.	H	α-helix	trans	-68.7	-35.4	177.4	-174.1	-135.4	0	0	0	112.7	M337 F347 A350 L351 Y354 P398 N399 H404 V405 K406	M337-F402 HydrophobicContact CE-CE1 4.13Å; M337-F402 HydrophobicContact CE-CZ 4.34Å; M337-F402 HydrophobicContact SD-CZ 4.32Å; F347-F402 HydrophobicContact CD2-CE2 4.38Å; F347-F402 AromaticContact CE2-CE2 3.94Å; F347-F402 HydrophobicContact CE2-CE2 3.94Å; F347-F402 AromaticContact CE2-CZ 3.98Å; F347-F402 HydrophobicContact CE2-CZ 3.98Å; F347-F402 HydrophobicContact CZ-CZ 4.26Å; A350-F402 HydrophobicContact CB-CD2 4.15Å; A350-F402 HydrophobicContact CB-CE2 4.46Å; L351-F402 HydrophobicContact CB-CE2 4.08Å; L351-F402 HydrophobicContact CB-CZ 4.21Å; L351-F402 HydrophobicContact CD1-CE1 4.33Å; L351-F402 HydrophobicContact CD1-CE2 4.44Å; L351-F402 HydrophobicContact CD1-CZ 3.75Å; Y354-F402 AromaticContact CD1-CD1 3.41Å; Y354-F402 HydrophobicContact CD1-CD1 3.41Å; Y354-F402 VanDerWaalsContact CD1-CD1 3.41Å; Y354-F402 AromaticContact CD1-CE1 3.46Å; Y354-F402 HydrophobicContact CD1-CE1 3.46Å; Y354-F402 VanDerWaalsContact CD1-CE1 3.46Å; Y354-F402 HydrophobicContact CD1-CG 4.22Å; Y354-F402 HydrophobicContact CD1-CZ 4.33Å; Y354-F402 HydrophobicContact CD2-CB 3.62Å; Y354-F402 AromaticContact CD2-CD1 3.52Å; Y354-F402 HydrophobicContact CD2-CD1 3.52Å; Y354-F402 HydrophobicContact CD2-CE1 4.42Å; Y354-F402 AromaticContact CD2-CG 3.8Å; Y354-F402 HydrophobicContact CD2-CG 3.8Å; Y354-F402 AromaticContact CE1-CD1 3.72Å; Y354-F402 HydrophobicContact CE1-CD1 3.72Å; Y354-F402 AromaticContact CE1-CE1 3.8Å; Y354-F402 HydrophobicContact CE1-CE1 3.8Å; Y354-F402 HydrophobicContact CE2-CB 4.28Å; Y354-F402 AromaticContact CE2-CD1 3.85Å; Y354-F402 HydrophobicContact CE2-CD1 3.85Å; Y354-F402 HydrophobicContact CE2-CG 4.46Å; Y354-F402 HydrophobicContact CG-CB 3.98Å; Y354-F402 AromaticContact CG-CD1 3.29Å; Y354-F402 HydrophobicContact CG-CD1 3.29Å; Y354-F402 HydrophobicContact CG-CD2 4.43Å; Y354-F402 AromaticContact CG-CE1 3.8Å; Y354-F402 HydrophobicContact CG-CE1 3.8Å; Y354-F402 AromaticContact CG-CG 3.66Å; Y354-F402 HydrophobicContact CG-CG 3.66Å; Y354-F402 AromaticContact CZ-CD1 3.93Å; P398-F402 PolarHBondContact O-N 3.07Å; P398-F402 VanDerWaalsContact O-N 3.11Å; N399-F402 CarbonylContact O-C 3.6Å; N399-F402 PolarHBondContact O-N 3.49Å; N399-F402 VanDerWaalsContact O-N 3.12Å; F402-H404 PolarHBondContact O-N 2.83Å; F402-V405 PolarHBondContact O-N 3.46Å; F402-K406 HydrophobicContact CD1-CD 3.69Å; F402-K406 HydrophobicContact CD2-CD 4.38Å; F402-K406 HydrophobicContact CD2-CG 4.45Å; F402-K406 HydrophobicContact CE1-CD 3.63Å; F402-K406 HydrophobicContact CE1-CG 4.4Å; F402-K406 HydrophobicContact CE2-CD 4.3Å; F402-K406 HydrophobicContact CE2-CG 4.23Å; F402-K406 HydrophobicContact CG-CD 4.08Å; F402-K406 HydrophobicContact CZ-CD 3.92Å; F402-K406 HydrophobicContact CZ-CG 4.19Å; F402-K406 WeakPolarHBondContact O-CG 3.48Å; F402-K406 PolarHBondContact O-N 3.11Å
403	Q	94.2	Very high	93.3	Very high	53 Å²	53	60.2 Å²	60.2	25%	0.248	34%	0.343	C	S	.	.	H	α-helix	trans	-64.6	-35.9	175.1	-75.1	-68.7	1.3	0	0	112.8	N399 K400 K406 V407 E414	N399-Q403 WeakPolarHBondContact O-CB 3.22Å; N399-Q403 WeakPolarHBondContact O-CG 3.44Å; N399-Q403 PolarHBondContact O-N 2.95Å; K400-Q403 PolarHBondContact O-N 3.37Å; Q403-K406 PolarHBondContact O-N 2.79Å; Q403-V407 WeakPolarHBondContact O-CG2 3.25Å; Q403-V407 PolarHBondContact O-N 3.12Å; Q403-E414 PolarHBondContact NE2-OE1 3.35Å; Q403-E414 PolarHBondContact OE1-OE1 2.88Å
404	H	95.1	Very high	93.4	Very high	129 Å²	129	62.4 Å²	62.4	60%	0.597	35%	0.353	S	S	*	.	H	α-helix	trans	-60.2	-48.6	169.2	-76.3	-67.6	0	0	0	111.6	K400 A401 F402 K406 V407 D408	K400-H404 PolarHBondContact O-CD2 3.01Å; K400-H404 PolarHBondContact O-N 3.32Å; K400-H404 VanDerWaalsContact O-N 3.09Å; A401-H404 PolarHBondContact O-N 2.84Å; F402-H404 PolarHBondContact O-N 2.83Å; H404-K406 VanDerWaalsContact C-N 3.28Å; H404-K406 PolarHBondContact O-N 3.38Å; H404-V407 PolarHBondContact O-N 3.32Å; H404-V407 VanDerWaalsContact O-N 3.13Å; H404-D408 PolarHBondContact O-N 3.13Å
405	V	95.4	Very high	93.4	Very high	30 Å²	30	62.5 Å²	62.5	18%	0.182	36%	0.361	C	S	.	.	H	α-helix	trans	-62.1	-35.8	176.9	-177.4	0	0	0	0	111.5	A350 A401 F402 V407 D408 T409	A350-V405 HydrophobicContact CB-CB 4.03Å; A350-V405 HydrophobicContact CB-CG1 3.71Å; A350-V405 HydrophobicContact CB-CG2 3.9Å; A401-V405 PolarHBondContact O-N 3.36Å; F402-V405 PolarHBondContact O-N 3.46Å; V405-V407 PolarHBondContact O-N 3.42Å; V405-D408 PolarHBondContact O-N 2.74Å; V405-T409 HydrophobicContact CG1-CG2 3.67Å; V405-T409 VanDerWaalsContact O-CB 3.3Å; V405-T409 WeakPolarHBondContact O-CB 2.94Å; V405-T409 VanDerWaalsContact O-CG2 3.26Å; V405-T409 WeakPolarHBondContact O-CG2 3.23Å; V405-T409 PolarHBondContact O-N 2.73Å; V405-T409 PolarHBondContact O-OG1 2.84Å
406	K	93.4	Very high	93.4	Very high	6 Å²	6	59.5 Å²	59.5	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-61.4	-42.2	174.6	-73.2	160	63.2	169.3	0	111.7	M337 F347 F402 Q403 H404 D408 L410 E414	M337-K406 HydrophobicContact CE-CD 3.92Å; M337-K406 VanDerWaalsContact CE-CE 3.46Å; M337-K406 HydrophobicContact SD-CD 4.04Å; M337-K406 HydrophobicContact SD-CG 4.03Å; F347-K406 HydrophobicContact CE2-CG 4.39Å; F402-K406 HydrophobicContact CD1-CD 3.69Å; F402-K406 HydrophobicContact CD2-CD 4.38Å; F402-K406 HydrophobicContact CD2-CG 4.45Å; F402-K406 HydrophobicContact CE1-CD 3.63Å; F402-K406 HydrophobicContact CE1-CG 4.4Å; F402-K406 HydrophobicContact CE2-CD 4.3Å; F402-K406 HydrophobicContact CE2-CG 4.23Å; F402-K406 HydrophobicContact CG-CD 4.08Å; F402-K406 HydrophobicContact CZ-CD 3.92Å; F402-K406 HydrophobicContact CZ-CG 4.19Å; F402-K406 WeakPolarHBondContact O-CG 3.48Å; F402-K406 PolarHBondContact O-N 3.11Å; Q403-K406 PolarHBondContact O-N 2.79Å; H404-K406 VanDerWaalsContact C-N 3.28Å; H404-K406 PolarHBondContact O-N 3.38Å; K406-D408 PolarHBondContact O-N 2.68Å; K406-L410 HydrophobicContact CB-CD1 3.99Å; K406-L410 HydrophobicContact CB-CG 4.37Å; K406-L410 HydrophobicContact CG-CD1 4.26Å; K406-L410 WeakPolarHBondContact O-CB 3.5Å; K406-L410 WeakPolarHBondContact O-CG 3.46Å; K406-L410 PolarHBondContact O-N 3.1Å; K406-L410 VanDerWaalsContact O-N 3.16Å; K406-E414 WeakPolarHBondContact CE-OE1 3.38Å; K406-E414 VanDerWaalsContact CE-OE2 3.3Å; K406-E414 WeakPolarHBondContact CE-OE2 3.14Å; K406-E414 IonicContact NZ-OE1 3.17Å; K406-E414 PolarHBondContact NZ-OE1 3.09Å; K406-E414 IonicContact NZ-OE2 2.71Å; K406-E414 PolarHBondContact NZ-OE2 3.07Å
407	V	95.1	Very high	93.3	Very high	116 Å²	116	60.8 Å²	60.8	70%	0.703	36%	0.361	S	S	*	.	H	α-helix	trans	-62.6	-40.4	173.6	173	0	0	0	0	112.1	Q403 H404 V405	Q403-V407 WeakPolarHBondContact O-CG2 3.25Å; Q403-V407 PolarHBondContact O-N 3.12Å; H404-V407 PolarHBondContact O-N 3.32Å; H404-V407 VanDerWaalsContact O-N 3.13Å; V405-V407 PolarHBondContact O-N 3.42Å
408	D	93.9	Very high	93.1	Very high	100 Å²	100	60.3 Å²	60.3	54%	0.535	35%	0.353	S	S	.	.	H	α-helix	trans	-84.3	-9.2	-174.9	-68.1	-32.4	0	0	0	115	K343 H404 V405 K406	K343-D408 WeakPolarHBondContact CE-O 3.38Å; H404-D408 PolarHBondContact O-N 3.13Å; V405-D408 PolarHBondContact O-N 2.74Å; K406-D408 PolarHBondContact O-N 2.68Å
409	T	95.3	Very high	92.9	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.012	35%	0.353	C	S	.	.	H	α-helix	trans	-128.8	-19.4	-171	65.8	0	0	0	0	116.1	S340 K343 E346 F347 V405	S340-T409 WeakPolarHBondContact CB-O 3.46Å; S340-T409 PolarHBondContact N-O 3.34Å; K343-T409 HydrophobicContact CB-CG2 3.81Å; K343-T409 HydrophobicContact CD-CG2 4.09Å; K343-T409 HydrophobicContact CG-CG2 4.18Å; E346-T409 HydrophobicContact CG-CG2 4.41Å; F347-T409 HydrophobicContact CB-CG2 4.39Å; F347-T409 WeakPolarHBondContact CD2-OG1 3.36Å; V405-T409 HydrophobicContact CG1-CG2 3.67Å; V405-T409 VanDerWaalsContact O-CB 3.3Å; V405-T409 WeakPolarHBondContact O-CB 2.94Å; V405-T409 VanDerWaalsContact O-CG2 3.26Å; V405-T409 WeakPolarHBondContact O-CG2 3.23Å; V405-T409 PolarHBondContact O-N 2.73Å; V405-T409 PolarHBondContact O-OG1 2.84Å
410	L	95.4	Very high	92.5	Very high	28 Å²	28	61.3 Å²	61.3	15%	0.147	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-84	149.4	-179.9	-59	-175.5	0	0	0	112.7	M337 V338 V339 F347 K406 Q412 E414	M337-L410 HydrophobicContact CB-CD1 4.03Å; M337-L410 HydrophobicContact CB-CD2 3.79Å; M337-L410 HydrophobicContact CG-CD1 4.01Å; M337-L410 HydrophobicContact CG-CD2 4.5Å; M337-L410 HydrophobicContact SD-CD1 4.24Å; V338-L410 CarbonylContact O-C 3.54Å; V338-L410 WeakPolarHBondContact O-CA 3.18Å; V339-L410 HydrophobicContact CB-CD2 4.35Å; V339-L410 HydrophobicContact CG2-CD2 3.7Å; F347-L410 HydrophobicContact CD2-CD2 4.27Å; F347-L410 HydrophobicContact CE2-CD2 4.01Å; K406-L410 HydrophobicContact CB-CD1 3.99Å; K406-L410 HydrophobicContact CB-CG 4.37Å; K406-L410 HydrophobicContact CG-CD1 4.26Å; K406-L410 WeakPolarHBondContact O-CB 3.5Å; K406-L410 WeakPolarHBondContact O-CG 3.46Å; K406-L410 PolarHBondContact O-N 3.1Å; K406-L410 VanDerWaalsContact O-N 3.16Å; L410-Q412 WeakPolarHBondContact CB-O 3.4Å; L410-E414 HydrophobicContact CD1-CB 4.5Å
411	C	93.9	Very high	92	Very high	84 Å²	84	57.6 Å²	57.6	57%	0.568	35%	0.346	S	S	*	.	S	Bend	trans	-79	-21	174.4	-71.3	0	0	0	0	113.2	V338 S340	V338-C411 HydrophobicContact CG1-CB 4.4Å; V338-C411 PolarHBondContact O-N 3.41Å; S340-C411 VanDerWaalsContact CA-SG 3.53Å
412	Q	91.6	Very high	91.5	Very high	113 Å²	113	56 Å²	56	53%	0.528	33%	0.33	S	S	.	.	S	Bend	trans	-153.3	161.5	-177.7	63.5	-175.4	49.9	0	0	109.5	V338 L410	V338-Q412 HydrophobicContact CB-CG 4.29Å; V338-Q412 HydrophobicContact CG2-CG 4.37Å; L410-Q412 WeakPolarHBondContact CB-O 3.4Å
413	P	91.6	Very high	90.8	Very high	118 Å²	118	56.6 Å²	56.6	77%	0.766	34%	0.336	S	S	*	.			trans	-55	148.5	172.2	-24.7	35.1	0	0	0	112.3
414	E	93.1	Very high	89.9	Confident	48 Å²	48	57.3 Å²	57.3	22%	0.224	35%	0.351	C	S	.	.			trans	-65.2	141.3	176.3	59	171.7	147.9	0	0	112.3	Q335 E336 M337 Q403 K406 L410 V416	Q335-E414 PolarHBondContact OE1-OE2 3.14Å; E336-E414 WeakPolarHBondContact O-CA 3.38Å; M337-E414 HydrophobicContact CG-CB 4.16Å; Q403-E414 PolarHBondContact NE2-OE1 3.35Å; Q403-E414 PolarHBondContact OE1-OE1 2.88Å; K406-E414 WeakPolarHBondContact CE-OE1 3.38Å; K406-E414 VanDerWaalsContact CE-OE2 3.3Å; K406-E414 WeakPolarHBondContact CE-OE2 3.14Å; K406-E414 IonicContact NZ-OE1 3.17Å; K406-E414 PolarHBondContact NZ-OE1 3.09Å; K406-E414 IonicContact NZ-OE2 2.71Å; K406-E414 PolarHBondContact NZ-OE2 3.07Å; L410-E414 HydrophobicContact CD1-CB 4.5Å; E414-V416 HydrophobicContact CB-CG2 4.48Å; E414-V416 HydrophobicContact CG-CG2 3.75Å
415	A	91.6	Very high	89.1	Confident	52 Å²	52	59.4 Å²	59.4	43%	0.43	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	103	170.7	0	0	0	0	0	109.1	E336	E336-A415 HydrophobicContact CB-CB 4.3Å; E336-A415 PolarHBondContact N-O 2.87Å; E336-A415 PolarHBondContact O-N 3.27Å
416	V	92	Very high	87.9	Confident	69 Å²	69	59.8 Å²	59.8	42%	0.418	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	135.4	178.5	-169	0	0	0	0	110.4	I333 Q335 W390 E414	I333-V416 HydrophobicContact CG2-CG1 3.96Å; Q335-V416 HydrophobicContact CG-CG1 4.35Å; Q335-V416 HydrophobicContact CG-CG2 4.28Å; W390-V416 HydrophobicContact CZ2-CG1 4.49Å; E414-V416 HydrophobicContact CB-CG2 4.48Å; E414-V416 HydrophobicContact CG-CG2 3.75Å
417	S	88.9	Confident	86.4	Confident	52 Å²	52	62.4 Å²	62.4	36%	0.364	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	146.1	175.8	49.4	0	0	0	0	109.9	R334	R334-S417 WeakPolarHBondContact CB-OG 3.25Å; R334-S417 PolarHBondContact N-O 2.89Å; R334-S417 PolarHBondContact O-N 3.39Å; R334-S417 PolarHBondContact O-OG 2.67Å; R334-S417 VanDerWaalsContact O-OG 3.11Å
418	S	88.6	Confident	84.3	Confident	68 Å²	68	62.3 Å²	62.3	48%	0.476	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	147.1	-177	57.1	0	0	0	0	111.6	L332	L332-S418 CarbonylContact O-C 3.6Å; L332-S418 VanDerWaalsContact O-CA 3.31Å; L332-S418 WeakPolarHBondContact O-CA 3.45Å
419	V	86.8	Confident	81.7	Confident	43 Å²	43	64.9 Å²	64.9	26%	0.261	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	141.8	177.5	63.4	0	0	0	0	110.3	L315 L332 V421	L315-V419 HydrophobicContact CD2-CG2 3.94Å; L332-V419 HydrophobicContact CB-CG1 4.02Å; L332-V419 HydrophobicContact CD2-CG1 4.18Å; L332-V419 HydrophobicContact CG-CG1 4.28Å; L332-V419 PolarHBondContact N-O 2.9Å; L332-V419 PolarHBondContact O-N 3.14Å; V419-V421 HydrophobicContact CG1-CG1 4.15Å
420	A	84.1	Confident	79.3	Confident	23 Å²	23	74.1 Å²	74.1	19%	0.19	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	132.4	171.6	0	0	0	0	0	109.9	L315 L319 L330	L315-A420 VanDerWaalsContact CD2-O 3.3Å; L315-A420 WeakPolarHBondContact CD2-O 3.43Å; L319-A420 HydrophobicContact CD1-CB 3.82Å; L330-A420 WeakPolarHBondContact O-CA 3.3Å
421	V	83.2	Confident	76.3	Confident	12 Å²	12	84.4 Å²	84.4	7%	0.073	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	147.3	179.6	-61.1	0	0	0	0	111	S329 L330 L332 F383 V419 A423 W425	S329-V421 CarbonylContact C-O 3.59Å; S329-V421 VanDerWaalsContact CA-O 3.28Å; S329-V421 WeakPolarHBondContact CA-O 3.43Å; L330-V421 HydrophobicContact CB-CG2 4.1Å; L330-V421 PolarHBondContact N-O 3.39Å; L330-V421 PolarHBondContact O-N 3.26Å; L332-V421 HydrophobicContact CB-CG1 4.25Å; L332-V421 HydrophobicContact CB-CG2 4.27Å; L332-V421 HydrophobicContact CD2-CG1 4.37Å; F383-V421 HydrophobicContact CD1-CG2 4.48Å; F383-V421 HydrophobicContact CE1-CG2 4.5Å; V419-V421 HydrophobicContact CG1-CG1 4.15Å; V421-A423 PolarHBondContact O-N 3.4Å; V421-W425 HydrophobicContact CB-CE3 4.4Å
422	P	83.3	Confident	75.4	Confident	24 Å²	24	84.5 Å²	84.5	16%	0.156	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	127.8	172.6	-17.7	28.3	0	0	0	111.2	L319 A424 W425	L319-P422 HydrophobicContact CD2-CB 4.44Å; L319-P422 HydrophobicContact CD2-CG 3.94Å; P422-A424 PolarHBondContact O-N 2.89Å; P422-A424 VanDerWaalsContact O-N 3.13Å; P422-W425 HydrophobicContact CB-CD2 4.41Å; P422-W425 HydrophobicContact CB-CG 4.29Å; P422-W425 HydrophobicContact CG-CD2 3.98Å; P422-W425 HydrophobicContact CG-CE3 4.48Å; P422-W425 HydrophobicContact CG-CG 4.36Å; P422-W425 HydrophobicContact CG-CH2 4.45Å; P422-W425 HydrophobicContact CG-CZ2 3.94Å; P422-W425 WeakPolarHBondContact O-CB 3.32Å; P422-W425 PolarHBondContact O-N 3.08Å
423	A	79.4	Confident	74.6	Confident	19 Å²	19	82.9 Å²	82.9	16%	0.157	47%	0.472	C	S	.	.	G	3₁₀ helix	trans	-58.8	-27.8	176.3	0	0	0	0	0	112.3	A328 L330 V421 W425 C426 S427	A328-A423 HydrophobicContact CB-CB 4.07Å; A328-A423 WeakPolarHBondContact O-CB 3.46Å; A328-A423 PolarHBondContact O-N 3.43Å; L330-A423 HydrophobicContact CD1-CB 4.27Å; L330-A423 HydrophobicContact CD2-CB 4.4Å; L330-A423 HydrophobicContact CG-CB 3.9Å; V421-A423 PolarHBondContact O-N 3.4Å; A423-W425 PolarHBondContact O-N 2.85Å; A423-C426 PolarHBondContact O-N 3.41Å; A423-S427 PolarHBondContact O-N 2.8Å
424	A	76.4	Confident	73.6	Confident	67 Å²	67	81 Å²	81	55%	0.554	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-57.9	-23.8	173.9	0	0	0	0	0	114.2	P422 C426 S427	P422-A424 PolarHBondContact O-N 2.89Å; P422-A424 VanDerWaalsContact O-N 3.13Å; A424-C426 VanDerWaalsContact C-N 3.31Å; A424-S427 PolarHBondContact O-OG 2.69Å
425	W	77.4	Confident	72.5	Confident	173 Å²	173	82.9 Å²	82.9	66%	0.655	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-76.3	-20.5	174	-65.1	-2	0	0	0	112.5	L315 V421 P422 A423	L315-W425 HydrophobicContact CD1-CH2 4.37Å; V421-W425 HydrophobicContact CB-CE3 4.4Å; P422-W425 HydrophobicContact CB-CD2 4.41Å; P422-W425 HydrophobicContact CB-CG 4.29Å; P422-W425 HydrophobicContact CG-CD2 3.98Å; P422-W425 HydrophobicContact CG-CE3 4.48Å; P422-W425 HydrophobicContact CG-CG 4.36Å; P422-W425 HydrophobicContact CG-CH2 4.45Å; P422-W425 HydrophobicContact CG-CZ2 3.94Å; P422-W425 WeakPolarHBondContact O-CB 3.32Å; P422-W425 PolarHBondContact O-N 3.08Å; A423-W425 PolarHBondContact O-N 2.85Å
426	C	71.5	Confident	71.3	Confident	39 Å²	39	84.9 Å²	84.9	26%	0.264	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-11.8	-174.4	-57.8	0	0	0	0	113.3	L330 F365 A423 A424	L330-C426 HydrophobicContact CD1-CB 3.96Å; F365-C426 HydrophobicContact CD1-CB 4.1Å; F365-C426 HydrophobicContact CE1-CB 3.5Å; F365-C426 WeakPolarHBondContact CE1-O 3.47Å; F365-C426 HydrophobicContact CZ-CB 3.92Å; F365-C426 WeakPolarHBondContact CZ-O 3.39Å; A423-C426 PolarHBondContact O-N 3.41Å; A424-C426 VanDerWaalsContact C-N 3.31Å
427	S	61.5	Low	69.9	Low	60 Å²	60	85.9 Å²	85.9	42%	0.42	48%	0.475	S	S	.	.			trans	-95.1	-0.2	-173.4	56	0	0	0	0	115.8	A423 A424 N429	A423-S427 PolarHBondContact O-N 2.8Å; A424-S427 PolarHBondContact O-OG 2.69Å; S427-N429 PolarHBondContact O-N 2.65Å
428	V	50	Low	68.6	Low	114 Å²	114	88.4 Å²	88.4	69%	0.691	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.7	-167.4	-178.2	0	0	0	0	115.2
429	N	39.8	Very low	67	Low	155 Å²	155	89.9 Å²	89.9	83%	0.829	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129	55	-178.5	-71.2	-31.7	0	0	0	112.2	S427	S427-N429 PolarHBondContact O-N 2.65Å
430	R	44.4	Very low	65.4	Low	196 Å²	196	93.8 Å²	93.8	74%	0.74	50%	0.503	S	S	*	.			trans	-132.4	9.3	179.5	-89	-161.3	66.7	173.7	-1.8	116.9
431	D	33.7	Very low	63.7	Low	244 Å²	244	100.3 Å²	100.3	100%	1.305	53%	0.531	S	S	*	.			trans	-99.2	0	166.2	-65.4	-38.2	0	0	0	110.7

Retrieved 431 of 431 residues in 2598.1 ms (Link to these results)

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