A0A077Z7X5_TRITR Loading...

SEFIR domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z7X5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 653 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	51.7	Low	62.2	Low	219 Å²	219	132.8 Å²	132.8	100%	1.079	68%	0.684	S	S	*	*				0	-29	0	-97.7	-178.5	174.1	0	0	115	F3 A4	M1-F3 VanDerWaalsContact C-N 3.34Å; M1-F3 PolarHBondContact O-N 3.03Å; M1-A4 PolarHBondContact O-N 2.58Å
2	L	51.3	Low	63.4	Low	160 Å²	160	126.3 Å²	126.3	84%	0.838	67%	0.665	S	S	*	*	H	α-helix	trans	-63.9	-31.3	178.7	-96.6	126.1	0	0	0	114.8	A4	L2-A4 PolarHBondContact O-N 3.36Å
3	F	51.6	Low	64.6	Low	189 Å²	189	119.9 Å²	119.9	83%	0.829	64%	0.641	S	S	*	*	H	α-helix	trans	-67	-33.6	177.9	-81.9	-83.9	0	0	0	113.9	M1 R6 A7	M1-F3 VanDerWaalsContact C-N 3.34Å; M1-F3 PolarHBondContact O-N 3.03Å; F3-R6 PolarHBondContact O-N 3.37Å; F3-A7 PolarHBondContact O-N 2.95Å
4	A	56.4	Low	65.9	Low	69 Å²	69	123.4 Å²	123.4	57%	0.57	64%	0.64	S	S	*	*	H	α-helix	trans	-72.6	-35.6	-178.1	0	0	0	0	0	113.1	M1 L2 R6 F8	M1-A4 PolarHBondContact O-N 2.58Å; L2-A4 PolarHBondContact O-N 3.36Å; A4-R6 VanDerWaalsContact C-N 3.34Å; A4-F8 PolarHBondContact O-N 3.09Å; A4-F8 VanDerWaalsContact O-N 3.13Å
5	K	57.5	Low	66.8	Low	178 Å²	178	120.9 Å²	120.9	77%	0.774	63%	0.632	S	S	*	*	H	α-helix	trans	-67.3	-34.8	176	-78.9	-172.5	175.3	-176.7	0	112.3	A9	K5-A9 PolarHBondContact O-N 3.26Å
6	R	63.1	Low	67.8	Low	185 Å²	185	120.4 Å²	120.4	70%	0.698	63%	0.63	S	S	*	*	H	α-helix	trans	-70.2	-43.3	178.2	-146.3	176.5	-164.1	170.8	3.8	111.4	F3 A4 F8 A9 E10	F3-R6 PolarHBondContact O-N 3.37Å; A4-R6 VanDerWaalsContact C-N 3.34Å; R6-F8 VanDerWaalsContact C-N 3.35Å; R6-F8 PolarHBondContact O-N 3.35Å; R6-A9 PolarHBondContact O-N 3.46Å; R6-E10 WeakPolarHBondContact O-CG 3.42Å; R6-E10 PolarHBondContact O-N 2.99Å
7	A	64.8	Low	68.6	Low	56 Å²	56	124 Å²	124	46%	0.463	63%	0.633	S	S	.	*	H	α-helix	trans	-61.9	-38.9	175.7	0	0	0	0	0	112.9	F3 A11	F3-A7 PolarHBondContact O-N 2.95Å; A7-A11 WeakPolarHBondContact O-CB 3.27Å; A7-A11 PolarHBondContact O-N 3.44Å
8	F	66.6	Low	69.1	Low	165 Å²	165	122.4 Å²	122.4	72%	0.724	63%	0.626	S	S	*	*	H	α-helix	trans	-71.1	-37.8	178.9	-146.2	-88.4	0	0	0	112.7	A4 R6 A11 A12	A4-F8 PolarHBondContact O-N 3.09Å; A4-F8 VanDerWaalsContact O-N 3.13Å; R6-F8 VanDerWaalsContact C-N 3.35Å; R6-F8 PolarHBondContact O-N 3.35Å; F8-A11 PolarHBondContact O-N 2.82Å; F8-A12 WeakPolarHBondContact O-CB 3.44Å; F8-A12 PolarHBondContact O-N 3.3Å
9	A	72.1	Confident	69.4	Low	66 Å²	66	121.5 Å²	121.5	55%	0.545	62%	0.622	S	S	.	*	H	α-helix	trans	-66.8	-40.4	174.8	0	0	0	0	0	111.8	K5 R6 A13	K5-A9 PolarHBondContact O-N 3.26Å; R6-A9 PolarHBondContact O-N 3.46Å; A9-A13 VanDerWaalsContact O-CB 3.27Å; A9-A13 WeakPolarHBondContact O-CB 3.16Å; A9-A13 PolarHBondContact O-N 3.21Å
10	E	73.5	Confident	69.5	Low	122 Å²	122	120.6 Å²	120.6	57%	0.57	62%	0.616	S	S	*	*	H	α-helix	trans	-66	-42	175	-77	176	-173.7	0	0	112	R6 A13 W14	R6-E10 WeakPolarHBondContact O-CG 3.42Å; R6-E10 PolarHBondContact O-N 2.99Å; E10-A13 PolarHBondContact O-N 3.11Å; E10-W14 WeakPolarHBondContact O-CB 3.46Å; E10-W14 PolarHBondContact O-N 2.85Å
11	A	76	Confident	69.2	Low	52 Å²	52	117.3 Å²	117.3	43%	0.43	61%	0.607	S	S	.	*	H	α-helix	trans	-65	-44.9	176.3	0	0	0	0	0	112.2	A7 F8 A13 W14 V15	A7-A11 WeakPolarHBondContact O-CB 3.27Å; A7-A11 PolarHBondContact O-N 3.44Å; F8-A11 PolarHBondContact O-N 2.82Å; A11-A13 PolarHBondContact O-N 3.42Å; A11-W14 WeakPolarHBondContact O-CB 3.28Å; A11-W14 PolarHBondContact O-N 3.26Å; A11-V15 WeakPolarHBondContact O-CG2 3.48Å; A11-V15 PolarHBondContact O-N 2.85Å
12	A	76.7	Confident	69.6	Low	55 Å²	55	113.3 Å²	113.3	46%	0.455	58%	0.581	S	S	.	*	H	α-helix	trans	-63.7	-40.4	176.6	0	0	0	0	0	111.9	F8 W14 V15 L16	F8-A12 WeakPolarHBondContact O-CB 3.44Å; F8-A12 PolarHBondContact O-N 3.3Å; A12-W14 VanDerWaalsContact C-N 3.33Å; A12-V15 PolarHBondContact O-N 2.87Å; A12-L16 WeakPolarHBondContact O-CB 3.3Å; A12-L16 PolarHBondContact O-N 3.35Å
13	A	79.2	Confident	70	Confident	43 Å²	43	112.2 Å²	112.2	36%	0.355	57%	0.566	S	S	.	*	H	α-helix	trans	-64.9	-37.4	173.8	0	0	0	0	0	111.9	A9 E10 A11 L16 R17	A9-A13 VanDerWaalsContact O-CB 3.27Å; A9-A13 WeakPolarHBondContact O-CB 3.16Å; A9-A13 PolarHBondContact O-N 3.21Å; E10-A13 PolarHBondContact O-N 3.11Å; A11-A13 PolarHBondContact O-N 3.42Å; A13-L16 PolarHBondContact O-N 3.2Å; A13-R17 WeakPolarHBondContact O-CB 3.38Å; A13-R17 VanDerWaalsContact O-CG 3.3Å; A13-R17 WeakPolarHBondContact O-CG 3.38Å; A13-R17 PolarHBondContact O-N 3.16Å
14	W	81.9	Confident	70.1	Confident	168 Å²	168	107 Å²	107	64%	0.636	54%	0.543	S	S	*	.	H	α-helix	trans	-65.3	-44.7	174.7	-114.1	94.7	0	0	0	112.5	E10 A11 A12 L16 R17 L18	E10-W14 WeakPolarHBondContact O-CB 3.46Å; E10-W14 PolarHBondContact O-N 2.85Å; A11-W14 WeakPolarHBondContact O-CB 3.28Å; A11-W14 PolarHBondContact O-N 3.26Å; A12-W14 VanDerWaalsContact C-N 3.33Å; W14-L16 VanDerWaalsContact C-N 3.35Å; W14-R17 PolarHBondContact O-N 3.38Å; W14-L18 HydrophobicContact CE3-CD1 3.72Å; W14-L18 HydrophobicContact CE3-CG 4Å; W14-L18 HydrophobicContact CZ3-CD1 4.03Å; W14-L18 HydrophobicContact CZ3-CG 4.15Å; W14-L18 WeakPolarHBondContact O-CB 3.41Å; W14-L18 PolarHBondContact O-N 3.32Å
15	V	80.4	Confident	69.7	Low	86 Å²	86	109.8 Å²	109.8	52%	0.521	54%	0.544	S	S	.	.	H	α-helix	trans	-63.6	-42.2	175.5	173.2	0	0	0	0	110.6	A11 A12 L18 L19	A11-V15 WeakPolarHBondContact O-CG2 3.48Å; A11-V15 PolarHBondContact O-N 2.85Å; A12-V15 PolarHBondContact O-N 2.87Å; V15-L18 PolarHBondContact O-N 3.44Å; V15-L19 HydrophobicContact CG1-CD1 4.01Å; V15-L19 HydrophobicContact CG1-CG 4.41Å; V15-L19 WeakPolarHBondContact O-CB 3.45Å; V15-L19 WeakPolarHBondContact O-CG 3.48Å; V15-L19 PolarHBondContact O-N 3.38Å
16	L	82.5	Confident	69	Low	114 Å²	114	103.8 Å²	103.8	60%	0.597	52%	0.519	S	S	*	.	H	α-helix	trans	-64	-41.7	176.1	-165.9	79	0	0	0	111.5	A12 A13 W14 L19 M20	A12-L16 WeakPolarHBondContact O-CB 3.3Å; A12-L16 PolarHBondContact O-N 3.35Å; A13-L16 PolarHBondContact O-N 3.2Å; W14-L16 VanDerWaalsContact C-N 3.35Å; L16-L19 PolarHBondContact O-N 2.92Å; L16-M20 WeakPolarHBondContact O-CB 3.32Å; L16-M20 WeakPolarHBondContact O-CG 3.48Å; L16-M20 PolarHBondContact O-N 2.82Å
17	R	81	Confident	68.2	Low	181 Å²	181	96.7 Å²	96.7	68%	0.683	50%	0.495	S	S	*	.	H	α-helix	trans	-64.9	-38.2	174.2	-76.8	179	-171.7	-177.6	3.4	112.2	A13 W14 M20 A21	A13-R17 WeakPolarHBondContact O-CB 3.38Å; A13-R17 VanDerWaalsContact O-CG 3.3Å; A13-R17 WeakPolarHBondContact O-CG 3.38Å; A13-R17 PolarHBondContact O-N 3.16Å; W14-R17 PolarHBondContact O-N 3.38Å; R17-M20 PolarHBondContact O-N 3Å; R17-A21 WeakPolarHBondContact O-CB 3.27Å; R17-A21 PolarHBondContact O-N 3.05Å
18	L	77.2	Confident	67.3	Low	96 Å²	96	97.7 Å²	97.7	50%	0.503	50%	0.495	S	S	.	.	H	α-helix	trans	-66.7	-41.9	174.2	-88.4	164.6	0	0	0	111.6	W14 V15 A21 Y22	W14-L18 HydrophobicContact CE3-CD1 3.72Å; W14-L18 HydrophobicContact CE3-CG 4Å; W14-L18 HydrophobicContact CZ3-CD1 4.03Å; W14-L18 HydrophobicContact CZ3-CG 4.15Å; W14-L18 WeakPolarHBondContact O-CB 3.41Å; W14-L18 PolarHBondContact O-N 3.32Å; V15-L18 PolarHBondContact O-N 3.44Å; L18-A21 PolarHBondContact O-N 3.16Å; L18-Y22 WeakPolarHBondContact O-CB 3.43Å; L18-Y22 PolarHBondContact O-N 2.96Å
19	L	75.3	Confident	65.9	Low	105 Å²	105	97.9 Å²	97.9	55%	0.55	49%	0.492	S	S	.	.	H	α-helix	trans	-65.8	-42	175.1	-75.8	170.6	0	0	0	111.1	V15 L16 W23	V15-L19 HydrophobicContact CG1-CD1 4.01Å; V15-L19 HydrophobicContact CG1-CG 4.41Å; V15-L19 WeakPolarHBondContact O-CB 3.45Å; V15-L19 WeakPolarHBondContact O-CG 3.48Å; V15-L19 PolarHBondContact O-N 3.38Å; L16-L19 PolarHBondContact O-N 2.92Å; L19-W23 WeakPolarHBondContact O-CA 3.43Å; L19-W23 WeakPolarHBondContact O-CB 3.33Å; L19-W23 PolarHBondContact O-N 2.97Å
20	M	71.9	Confident	64.2	Low	102 Å²	102	95.3 Å²	95.3	50%	0.502	47%	0.473	S	S	.	.	H	α-helix	trans	-64.3	-45.6	173.8	-73	-75.1	-76.3	0	0	111	L16 R17 W23 F24	L16-M20 WeakPolarHBondContact O-CB 3.32Å; L16-M20 WeakPolarHBondContact O-CG 3.48Å; L16-M20 PolarHBondContact O-N 2.82Å; R17-M20 PolarHBondContact O-N 3Å; M20-W23 CarbonylContact O-C 3.56Å; M20-W23 PolarHBondContact O-N 3.32Å; M20-F24 HydrophobicContact CE-CE2 4.2Å; M20-F24 WeakPolarHBondContact O-CB 3.45Å; M20-F24 VanDerWaalsContact O-CD2 3.26Å; M20-F24 WeakPolarHBondContact O-CD2 3.3Å; M20-F24 PolarHBondContact O-N 3.41Å
21	A	63.3	Low	62.8	Low	52 Å²	52	91.1 Å²	91.1	43%	0.43	45%	0.454	S	S	.	.	H	α-helix	trans	-65.5	-41.6	178	0	0	0	0	0	111.7	R17 L18 F24 Q25	R17-A21 WeakPolarHBondContact O-CB 3.27Å; R17-A21 PolarHBondContact O-N 3.05Å; L18-A21 PolarHBondContact O-N 3.16Å; A21-F24 PolarHBondContact O-N 3.39Å; A21-Q25 WeakPolarHBondContact O-CB 3.12Å; A21-Q25 PolarHBondContact O-N 3.17Å
22	Y	60.4	Low	61.2	Low	136 Å²	136	92.2 Å²	92.2	53%	0.533	46%	0.455	S	S	.	.	H	α-helix	trans	-64.2	-43.1	173.2	-178.4	-105.3	0	0	0	110.7	L18 Q25 E26	L18-Y22 WeakPolarHBondContact O-CB 3.43Å; L18-Y22 PolarHBondContact O-N 2.96Å; Y22-Q25 PolarHBondContact O-N 2.88Å; Y22-E26 HydrophobicContact CD1-CG 4.33Å; Y22-E26 HydrophobicContact CD2-CG 4.23Å; Y22-E26 HydrophobicContact CE1-CG 3.9Å; Y22-E26 HydrophobicContact CE2-CG 3.75Å; Y22-E26 HydrophobicContact CG-CG 4.49Å; Y22-E26 VanDerWaalsContact O-CB 3.25Å; Y22-E26 WeakPolarHBondContact O-CB 3.27Å; Y22-E26 WeakPolarHBondContact O-CG 3.39Å; Y22-E26 PolarHBondContact O-N 3Å; Y22-E26 PolarHBondContact OH-OE1 3.42Å
23	W	59.6	Low	59.8	Low	137 Å²	137	98.7 Å²	98.7	52%	0.519	47%	0.473	S	S	.	.	H	α-helix	trans	-63.4	-40.8	175	-170.7	91.6	0	0	0	111.5	L19 M20 N27	L19-W23 WeakPolarHBondContact O-CA 3.43Å; L19-W23 WeakPolarHBondContact O-CB 3.33Å; L19-W23 PolarHBondContact O-N 2.97Å; M20-W23 CarbonylContact O-C 3.56Å; M20-W23 PolarHBondContact O-N 3.32Å; W23-N27 VanDerWaalsContact CD2-ND2 3.28Å; W23-N27 VanDerWaalsContact CG-ND2 3.26Å; W23-N27 PolarHBondContact NE1-ND2 3.12Å; W23-N27 VanDerWaalsContact NE1-ND2 3.11Å; W23-N27 WeakPolarHBondContact O-CA 3.29Å; W23-N27 WeakPolarHBondContact O-CB 3.4Å; W23-N27 PolarHBondContact O-N 2.81Å; W23-N27 PolarHBondContact O-ND2 2.89Å
24	F	51.9	Low	58.3	Low	79 Å²	79	100.1 Å²	100.1	35%	0.346	47%	0.472	S	S	.	.	H	α-helix	trans	-67.1	-42.4	171.8	-93.3	-78.9	0	0	0	111.5	M20 A21 E26 V28 Y29	M20-F24 HydrophobicContact CE-CE2 4.2Å; M20-F24 WeakPolarHBondContact O-CB 3.45Å; M20-F24 VanDerWaalsContact O-CD2 3.26Å; M20-F24 WeakPolarHBondContact O-CD2 3.3Å; M20-F24 PolarHBondContact O-N 3.41Å; A21-F24 PolarHBondContact O-N 3.39Å; F24-E26 VanDerWaalsContact C-N 3.34Å; F24-E26 PolarHBondContact O-N 3.33Å; F24-V28 HydrophobicContact CD1-CB 4.46Å; F24-V28 HydrophobicContact CD1-CG2 3.66Å; F24-V28 HydrophobicContact CE1-CG2 4.23Å; F24-V28 VanDerWaalsContact O-CA 3.32Å; F24-V28 WeakPolarHBondContact O-CA 3.44Å; F24-V28 WeakPolarHBondContact O-CB 3.2Å; F24-V28 PolarHBondContact O-N 3.32Å; F24-Y29 PolarHBondContact O-N 2.91Å
25	Q	48.5	Very low	56.9	Low	127 Å²	127	93.4 Å²	93.4	59%	0.593	45%	0.45	S	S	*	.	I	π-helix	trans	-66.2	-36.4	179.6	-165.1	173.7	-4.9	0	0	111.8	A21 Y22 Y29 G30	A21-Q25 WeakPolarHBondContact O-CB 3.12Å; A21-Q25 PolarHBondContact O-N 3.17Å; Y22-Q25 PolarHBondContact O-N 2.88Å; Q25-Y29 CarbonylContact O-C 3.38Å; Q25-Y29 WeakPolarHBondContact O-CA 3.25Å; Q25-Y29 VanDerWaalsContact O-CB 3.22Å; Q25-Y29 WeakPolarHBondContact O-CB 3.45Å; Q25-Y29 PolarHBondContact O-N 2.82Å; Q25-G30 PolarHBondContact O-N 3.26Å
26	E	44	Very low	56.1	Low	52 Å²	52	97.2 Å²	97.2	24%	0.243	46%	0.455	C	S	.	.	I	π-helix	trans	-81.3	-51.2	176.6	-78.4	-85.3	156.9	0	0	111.6	Y22 F24 G30 Y94	Y22-E26 HydrophobicContact CD1-CG 4.33Å; Y22-E26 HydrophobicContact CD2-CG 4.23Å; Y22-E26 HydrophobicContact CE1-CG 3.9Å; Y22-E26 HydrophobicContact CE2-CG 3.75Å; Y22-E26 HydrophobicContact CG-CG 4.49Å; Y22-E26 VanDerWaalsContact O-CB 3.25Å; Y22-E26 WeakPolarHBondContact O-CB 3.27Å; Y22-E26 WeakPolarHBondContact O-CG 3.39Å; Y22-E26 PolarHBondContact O-N 3Å; Y22-E26 PolarHBondContact OH-OE1 3.42Å; F24-E26 VanDerWaalsContact C-N 3.34Å; F24-E26 PolarHBondContact O-N 3.33Å; E26-G30 WeakPolarHBondContact O-CA 3.2Å; E26-G30 PolarHBondContact O-N 2.86Å; E26-G30 VanDerWaalsContact O-N 3.11Å; E26-Y94 HydrophobicContact CB-CE1 3.97Å; E26-Y94 PolarHBondContact O-OH 2.88Å; E26-Y94 PolarHBondContact OE2-OH 2.9Å
27	N	44.7	Very low	55.4	Low	36 Å²	36	95.6 Å²	95.6	19%	0.193	44%	0.444	C	S	.	.	I	π-helix	trans	-77.1	-29.6	-176.2	-69.6	-82.3	0	0	0	114	W23 I31 Y94	W23-N27 VanDerWaalsContact CD2-ND2 3.28Å; W23-N27 VanDerWaalsContact CG-ND2 3.26Å; W23-N27 PolarHBondContact NE1-ND2 3.12Å; W23-N27 VanDerWaalsContact NE1-ND2 3.11Å; W23-N27 WeakPolarHBondContact O-CA 3.29Å; W23-N27 WeakPolarHBondContact O-CB 3.4Å; W23-N27 PolarHBondContact O-N 2.81Å; W23-N27 PolarHBondContact O-ND2 2.89Å; N27-I31 WeakPolarHBondContact O-CD1 3.41Å; N27-I31 WeakPolarHBondContact O-CG1 3.38Å; N27-Y94 WeakPolarHBondContact OD1-CD1 3.17Å
28	V	45.9	Very low	54.6	Low	77 Å²	77	90.6 Å²	90.6	47%	0.467	44%	0.437	S	S	.	.	I	π-helix	trans	-102.4	-44.3	-178.7	-174.9	0	0	0	0	111	F24	F24-V28 HydrophobicContact CD1-CB 4.46Å; F24-V28 HydrophobicContact CD1-CG2 3.66Å; F24-V28 HydrophobicContact CE1-CG2 4.23Å; F24-V28 VanDerWaalsContact O-CA 3.32Å; F24-V28 WeakPolarHBondContact O-CA 3.44Å; F24-V28 WeakPolarHBondContact O-CB 3.2Å; F24-V28 PolarHBondContact O-N 3.32Å
29	Y	38.9	Very low	54	Low	169 Å²	169	86.8 Å²	86.8	66%	0.663	42%	0.418	S	S	*	.	I	π-helix	trans	-91.4	-29	-178.5	-62.5	-92.6	0	0	0	113.9	F24 Q25 I31 V32	F24-Y29 PolarHBondContact O-N 2.91Å; Q25-Y29 CarbonylContact O-C 3.38Å; Q25-Y29 WeakPolarHBondContact O-CA 3.25Å; Q25-Y29 VanDerWaalsContact O-CB 3.22Å; Q25-Y29 WeakPolarHBondContact O-CB 3.45Å; Q25-Y29 PolarHBondContact O-N 2.82Å; Y29-I31 PolarHBondContact O-N 3.04Å; Y29-V32 PolarHBondContact O-N 2.99Å
30	G	36.1	Very low	53.6	Low	13 Å²	13	84.6 Å²	84.6	13%	0.134	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-67.1	-19.3	176.8	0	0	0	0	0	114.1	Q25 E26 V32 K33	Q25-G30 PolarHBondContact O-N 3.26Å; E26-G30 WeakPolarHBondContact O-CA 3.2Å; E26-G30 PolarHBondContact O-N 2.86Å; E26-G30 VanDerWaalsContact O-N 3.11Å; G30-V32 PolarHBondContact O-N 3.39Å; G30-K33 WeakPolarHBondContact O-CB 3.16Å; G30-K33 PolarHBondContact O-N 2.91Å; G30-K33 VanDerWaalsContact O-N 3.1Å
31	I	42.9	Very low	53.2	Low	34 Å²	34	85 Å²	85	17%	0.174	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-58.5	-32.4	174.4	-65.7	177	0	0	0	111.5	N27 Y29 K33 H34 H158	N27-I31 WeakPolarHBondContact O-CD1 3.41Å; N27-I31 WeakPolarHBondContact O-CG1 3.38Å; Y29-I31 PolarHBondContact O-N 3.04Å; I31-K33 PolarHBondContact O-N 3.36Å; I31-K33 VanDerWaalsContact O-N 3.16Å; I31-H34 PolarHBondContact O-N 3.01Å; I31-H158 HydrophobicContact CD1-CB 4.17Å
32	V	44	Very low	53.3	Low	75 Å²	75	87.1 Å²	87.1	46%	0.455	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-62.5	-25.7	179.9	-173.5	0	0	0	0	111.8	Y29 G30 H34 C35	Y29-V32 PolarHBondContact O-N 2.99Å; G30-V32 PolarHBondContact O-N 3.39Å; V32-H34 PolarHBondContact O-N 3.06Å; V32-C35 VanDerWaalsContact O-CB 3.32Å; V32-C35 WeakPolarHBondContact O-CB 3.34Å; V32-C35 PolarHBondContact O-N 3.07Å
33	K	45.8	Very low	53.9	Low	191 Å²	191	84.2 Å²	84.2	83%	0.83	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-70.4	-16.9	175.2	-72	-176.4	178.8	174.4	0	113.9	G30 I31 C35	G30-K33 WeakPolarHBondContact O-CB 3.16Å; G30-K33 PolarHBondContact O-N 2.91Å; G30-K33 VanDerWaalsContact O-N 3.1Å; I31-K33 PolarHBondContact O-N 3.36Å; I31-K33 VanDerWaalsContact O-N 3.16Å; K33-C35 VanDerWaalsContact C-N 3.32Å
34	H	48.5	Very low	54.8	Low	72 Å²	72	77.8 Å²	77.8	33%	0.333	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-89.3	-3.3	178.4	-69.8	62	0	0	0	112.7	I31 V32 R36 M99	I31-H34 PolarHBondContact O-N 3.01Å; V32-H34 PolarHBondContact O-N 3.06Å; H34-R36 PolarHBondContact O-N 3.43Å; H34-R36 VanDerWaalsContact O-N 3.08Å; H34-M99 HydrophobicContact CB-CE 3.94Å
35	C	53.3	Low	56.3	Low	27 Å²	27	77.9 Å²	77.9	18%	0.182	40%	0.402	C	S	.	.			trans	-64.4	105.9	174.5	-91.5	0	0	0	0	112.1	V32 K33 F46 E155 C156	V32-C35 VanDerWaalsContact O-CB 3.32Å; V32-C35 WeakPolarHBondContact O-CB 3.34Å; V32-C35 PolarHBondContact O-N 3.07Å; K33-C35 VanDerWaalsContact C-N 3.32Å; C35-F46 HydrophobicContact CB-CE1 4.47Å; C35-E155 VanDerWaalsContact CA-O 3.32Å; C35-E155 WeakPolarHBondContact CA-O 3.47Å; C35-C156 WeakPolarHBondContact CA-SG 3.34Å; C35-C156 HydrophobicContact CB-CB 4.35Å; C35-C156 WeakPolarHBondContact CB-SG 3.17Å; C35-C156 VanDerWaalsContact SG-CA 3.57Å; C35-C156 WeakPolarHBondContact SG-CB 3.42Å; C35-C156 CovalentContact SG-SG 2.03Å; C35-C156 PolarHBondContact SG-SG 3.32Å
36	R	62.9	Low	58	Low	167 Å²	167	73.4 Å²	73.4	63%	0.63	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	139.2	168.6	-58.5	-171.8	177.9	-178.3	-4	109.9	H34 E155	H34-R36 PolarHBondContact O-N 3.43Å; H34-R36 VanDerWaalsContact O-N 3.08Å; R36-E155 HydrophobicContact CB-CB 4.24Å; R36-E155 HydrophobicContact CB-CG 4.18Å; R36-E155 WeakPolarHBondContact CB-OE2 3.49Å; R36-E155 VanDerWaalsContact CD-OE2 3.3Å; R36-E155 WeakPolarHBondContact CD-OE2 3.48Å; R36-E155 WeakPolarHBondContact CG-OE2 3.15Å; R36-E155 PolarHBondContact O-N 2.84Å
37	H	67.4	Low	59.9	Low	80 Å²	80	71.9 Å²	71.9	37%	0.37	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	146.5	166.9	59.3	-68.1	0	0	0	108.4	C39 F46 S153	H37-C39 VanDerWaalsContact C-N 3.26Å; H37-C39 PolarHBondContact CD2-O 3.43Å; H37-C39 PolarHBondContact NE2-O 2.84Å; H37-C39 PolarHBondContact O-N 3.41Å; H37-F46 HydrophobicContact CB-CB 4.48Å; H37-F46 HydrophobicContact CB-CD1 4.08Å; H37-F46 HydrophobicContact CB-CE1 4.49Å; H37-F46 HydrophobicContact CB-CG 4.14Å; H37-F46 AromaticContact CG-CD1 3.78Å; H37-F46 AromaticContact CG-CG 3.97Å; H37-F46 AromaticContact ND1-CD1 3.63Å; H37-S153 WeakPolarHBondContact CA-O 3.26Å
38	S	64.3	Low	61.7	Low	75 Å²	75	71.6 Å²	71.6	52%	0.524	38%	0.375	S	S	.	.	S	Bend	trans	-82.4	-1.1	-176	51.8	0	0	0	0	114.1	L151 S153	S38-L151 PolarHBondContact OG-O 3.28Å; S38-S153 PolarHBondContact OG-N 3.02Å
39	C	65.2	Low	63.5	Low	17 Å²	17	71.8 Å²	71.8	12%	0.115	37%	0.374	C	S	.	.			trans	-108.1	140.4	-166.4	176.8	0	0	0	0	111.5	H37 C44	H37-C39 VanDerWaalsContact C-N 3.26Å; H37-C39 PolarHBondContact CD2-O 3.43Å; H37-C39 PolarHBondContact NE2-O 2.84Å; H37-C39 PolarHBondContact O-N 3.41Å; C39-C44 HydrophobicContact CB-CB 4.31Å; C39-C44 WeakPolarHBondContact CB-SG 3.36Å; C39-C44 WeakPolarHBondContact SG-CB 3.35Å; C39-C44 PolarHBondContact SG-N 2.67Å; C39-C44 CovalentContact SG-SG 2Å; C39-C44 PolarHBondContact SG-SG 3.48Å
40	T	66.6	Low	65.6	Low	59 Å²	59	65 Å²	65	36%	0.362	35%	0.35	S	S	.	.			trans	-80.1	150.2	176.9	63.5	0	0	0	0	111	S42 E43 C44	T40-S42 PolarHBondContact O-N 3.2Å; T40-S42 PolarHBondContact OG1-OG 2.62Å; T40-E43 PolarHBondContact N-OE2 3.38Å; T40-E43 PolarHBondContact O-N 3.47Å; T40-E43 WeakPolarHBondContact OG1-CG 3.47Å; T40-E43 PolarHBondContact OG1-OE2 3.08Å; T40-C44 PolarHBondContact O-N 3.36Å; T40-C44 VanDerWaalsContact O-N 3.08Å
41	P	63.7	Low	67.9	Low	111 Å²	111	66.4 Å²	66.4	72%	0.721	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.4	179.9	-23.5	32.6	0	0	0	114.5
42	S	65.2	Low	69.9	Low	95 Å²	95	67.1 Å²	67.1	66%	0.664	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-32.3	173.5	37.8	0	0	0	0	113	T40	T40-S42 PolarHBondContact O-N 3.2Å; T40-S42 PolarHBondContact OG1-OG 2.62Å
43	E	73.4	Confident	72	Confident	76 Å²	76	63.5 Å²	63.5	36%	0.355	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-37.1	-173.4	-66.6	167.4	153.5	0	0	111.9	T40 N144 M147	T40-E43 PolarHBondContact N-OE2 3.38Å; T40-E43 PolarHBondContact O-N 3.47Å; T40-E43 WeakPolarHBondContact OG1-CG 3.47Å; T40-E43 PolarHBondContact OG1-OE2 3.08Å; E43-N144 PolarHBondContact O-N 2.92Å; E43-M147 HydrophobicContact CB-CE 4.11Å; E43-M147 HydrophobicContact CG-CE 3.7Å
44	C	78.3	Confident	74	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.014	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	161.3	177.4	76.6	0	0	0	0	113	C39 T40 I141 K142 W143	C39-C44 HydrophobicContact CB-CB 4.31Å; C39-C44 WeakPolarHBondContact CB-SG 3.36Å; C39-C44 WeakPolarHBondContact SG-CB 3.35Å; C39-C44 PolarHBondContact SG-N 2.67Å; C39-C44 CovalentContact SG-SG 2Å; C39-C44 PolarHBondContact SG-SG 3.48Å; T40-C44 PolarHBondContact O-N 3.36Å; T40-C44 VanDerWaalsContact O-N 3.08Å; C44-I141 HydrophobicContact CB-CG2 4.24Å; C44-K142 CarbonylContact C-O 3.45Å; C44-K142 WeakPolarHBondContact CA-O 3.44Å; C44-K142 WeakPolarHBondContact CB-O 3.49Å; C44-W143 HydrophobicContact CB-CB 4.43Å; C44-W143 HydrophobicContact CB-CG 3.99Å
45	I	82.9	Confident	75.8	Confident	80 Å²	80	57.1 Å²	57.1	41%	0.41	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	121.9	173.3	-60	167.5	0	0	0	107.5	V47 I141 K142	I45-V47 HydrophobicContact CG2-CG2 4.17Å; I45-I141 WeakPolarHBondContact O-CA 3.5Å; I45-K142 HydrophobicContact CB-CB 4.46Å; I45-K142 PolarHBondContact N-O 2.97Å; I45-K142 PolarHBondContact O-N 3.18Å
46	F	83.7	Confident	77.4	Confident	34 Å²	34	60.5 Å²	60.5	15%	0.149	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	124.7	173.8	177	-117.2	0	0	0	110.8	C35 H37 R139 L140 I141 V154 C156	C35-F46 HydrophobicContact CB-CE1 4.47Å; H37-F46 HydrophobicContact CB-CB 4.48Å; H37-F46 HydrophobicContact CB-CD1 4.08Å; H37-F46 HydrophobicContact CB-CE1 4.49Å; H37-F46 HydrophobicContact CB-CG 4.14Å; H37-F46 AromaticContact CG-CD1 3.78Å; H37-F46 AromaticContact CG-CG 3.97Å; H37-F46 AromaticContact ND1-CD1 3.63Å; F46-R139 HydrophobicContact CE2-CB 4.25Å; F46-L140 WeakPolarHBondContact CD2-O 3.38Å; F46-I141 HydrophobicContact CD2-CG1 3.65Å; F46-I141 HydrophobicContact CE2-CG1 4.21Å; F46-V154 HydrophobicContact CE2-CG1 3.85Å; F46-V154 HydrophobicContact CE2-CG2 3.93Å; F46-V154 HydrophobicContact CZ-CG1 3.87Å; F46-C156 HydrophobicContact CZ-CB 4.48Å; F46-C156 VanDerWaalsContact CZ-SG 3.56Å
47	V	85.1	Confident	78.5	Confident	19 Å²	19	52.5 Å²	52.5	12%	0.115	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	107.5	178.3	-169.4	0	0	0	0	109.3	I45 C53 E56 L140	I45-V47 HydrophobicContact CG2-CG2 4.17Å; V47-C53 HydrophobicContact CB-CB 4.38Å; V47-C53 HydrophobicContact CG1-CB 3.95Å; V47-E56 HydrophobicContact CG2-CG 4.5Å; V47-L140 HydrophobicContact CB-CB 4.21Å; V47-L140 PolarHBondContact N-O 3.41Å; V47-L140 PolarHBondContact O-N 3.25Å; V47-L140 VanDerWaalsContact O-N 3.16Å
48	S	81.4	Confident	79.3	Confident	31 Å²	31	55.1 Å²	55.1	22%	0.217	31%	0.309	C	S	.	.			trans	-91.2	-28.6	-179	62.9	0	0	0	0	113.9	T50 R139	S48-T50 PolarHBondContact O-N 3.5Å; S48-R139 VanDerWaalsContact O-CD 3.31Å; S48-R139 WeakPolarHBondContact O-CD 3.36Å; S48-R139 PolarHBondContact O-NE 2.77Å; S48-R139 PolarHBondContact O-NH1 3.4Å
49	N	83.9	Confident	80.2	Confident	81 Å²	81	56.6 Å²	56.6	43%	0.433	32%	0.317	S	S	.	.	S	Bend	trans	-74.5	124.3	179.2	-179	1.6	0	0	0	110	S51 S52 C53	N49-S51 VanDerWaalsContact C-N 3.28Å; N49-S51 PolarHBondContact ND2-OG 3.08Å; N49-S51 PolarHBondContact O-N 2.81Å; N49-S51 PolarHBondContact OD1-N 3Å; N49-S51 VanDerWaalsContact OD1-N 3.11Å; N49-S51 PolarHBondContact OD1-OG 3.24Å; N49-S52 PolarHBondContact O-N 3.06Å; N49-C53 VanDerWaalsContact O-CB 3.24Å; N49-C53 WeakPolarHBondContact O-CB 3.16Å; N49-C53 PolarHBondContact O-N 3.06Å
50	T	83.3	Confident	81.1	Confident	26 Å²	26	57.7 Å²	57.7	16%	0.16	32%	0.321	C	S	.	.	H	α-helix	trans	-52	-44.2	177.3	-56.9	0	0	0	0	112.3	S48 C53 E54 R135 R139	S48-T50 PolarHBondContact O-N 3.5Å; T50-C53 PolarHBondContact O-N 3.24Å; T50-E54 WeakPolarHBondContact O-CG 3.48Å; T50-E54 PolarHBondContact O-N 2.75Å; T50-R135 HydrophobicContact CG2-CG 4.48Å; T50-R139 PolarHBondContact OG1-NH1 3.25Å
51	S	84.8	Confident	81.9	Confident	42 Å²	42	55.7 Å²	55.7	29%	0.294	31%	0.308	S	S	.	.	H	α-helix	trans	-67.5	-40.5	-177.7	62.1	0	0	0	0	113.2	N49 I55 R135	N49-S51 VanDerWaalsContact C-N 3.28Å; N49-S51 PolarHBondContact ND2-OG 3.08Å; N49-S51 PolarHBondContact O-N 2.81Å; N49-S51 PolarHBondContact OD1-N 3Å; N49-S51 VanDerWaalsContact OD1-N 3.11Å; N49-S51 PolarHBondContact OD1-OG 3.24Å; S51-I55 WeakPolarHBondContact O-CD1 3.3Å; S51-I55 WeakPolarHBondContact O-CG1 3.43Å; S51-I55 PolarHBondContact O-N 2.91Å; S51-R135 VanDerWaalsContact CA-NH2 3.3Å
52	S	85.2	Confident	82.5	Confident	49 Å²	49	57.6 Å²	57.6	34%	0.343	31%	0.312	S	S	.	.	H	α-helix	trans	-70.2	-38.9	176.3	-56.3	0	0	0	0	111	N49 I55 E56	N49-S52 PolarHBondContact O-N 3.06Å; S52-I55 PolarHBondContact O-N 3.26Å; S52-E56 WeakPolarHBondContact O-CG 3.43Å; S52-E56 PolarHBondContact O-N 2.92Å
53	C	88.1	Confident	82.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.1	-43.3	177.8	162.3	0	0	0	0	111.5	V47 N49 T50 I55 E56 A57 C138 R139	V47-C53 HydrophobicContact CB-CB 4.38Å; V47-C53 HydrophobicContact CG1-CB 3.95Å; N49-C53 VanDerWaalsContact O-CB 3.24Å; N49-C53 WeakPolarHBondContact O-CB 3.16Å; N49-C53 PolarHBondContact O-N 3.06Å; T50-C53 PolarHBondContact O-N 3.24Å; C53-I55 VanDerWaalsContact C-N 3.35Å; C53-I55 PolarHBondContact O-N 3.02Å; C53-E56 PolarHBondContact O-N 3.08Å; C53-A57 WeakPolarHBondContact O-CB 3.32Å; C53-A57 PolarHBondContact O-N 2.93Å; C53-C138 VanDerWaalsContact C-SG 3.55Å; C53-C138 HydrophobicContact CB-CB 4.34Å; C53-C138 WeakPolarHBondContact CB-SG 3.37Å; C53-C138 WeakPolarHBondContact SG-CB 3.4Å; C53-C138 CovalentContact SG-SG 2.04Å; C53-C138 PolarHBondContact SG-SG 3.37Å; C53-R139 PolarHBondContact SG-N 2.89Å
54	E	86.5	Confident	82.8	Confident	16 Å²	16	53.5 Å²	53.5	8%	0.075	28%	0.284	C	S	.	.	H	α-helix	trans	-61.3	-42.2	176.2	-72.9	173.6	-168.5	0	0	112.4	T50 R58 F65 R135 C138	T50-E54 WeakPolarHBondContact O-CG 3.48Å; T50-E54 PolarHBondContact O-N 2.75Å; E54-R58 VanDerWaalsContact O-CG 3.25Å; E54-R58 WeakPolarHBondContact O-CG 3.22Å; E54-R58 PolarHBondContact O-N 3.07Å; E54-R58 VanDerWaalsContact O-N 3.09Å; E54-F65 HydrophobicContact CB-CD2 4.02Å; E54-F65 HydrophobicContact CB-CE2 4.11Å; E54-F65 HydrophobicContact CB-CG 4.38Å; E54-F65 HydrophobicContact CG-CB 4.16Å; E54-F65 HydrophobicContact CG-CD1 3.85Å; E54-F65 HydrophobicContact CG-CD2 3.83Å; E54-F65 HydrophobicContact CG-CE1 4.18Å; E54-F65 HydrophobicContact CG-CE2 4.17Å; E54-F65 HydrophobicContact CG-CG 3.67Å; E54-F65 HydrophobicContact CG-CZ 4.34Å; E54-R135 VanDerWaalsContact CD-NH2 3.26Å; E54-R135 WeakPolarHBondContact OE1-CG 3.29Å; E54-R135 IonicContact OE1-CZ 3.33Å; E54-R135 IonicContact OE1-NE 3.54Å; E54-R135 PolarHBondContact OE1-NE 3.26Å; E54-R135 IonicContact OE1-NH2 3.53Å; E54-R135 PolarHBondContact OE1-NH2 3.23Å; E54-R135 IonicContact OE2-CZ 2.66Å; E54-R135 IonicContact OE2-NE 3.66Å; E54-R135 IonicContact OE2-NH2 2.74Å; E54-R135 PolarHBondContact OE2-NH2 3.49Å; E54-C138 PolarHBondContact N-SG 2.94Å
55	I	86.4	Confident	82.4	Confident	112 Å²	112	53.9 Å²	53.9	57%	0.574	29%	0.286	S	S	*	.	H	α-helix	trans	-64.4	-47.3	179.9	-67	166.2	0	0	0	110.5	S51 S52 C53 P59	S51-I55 WeakPolarHBondContact O-CD1 3.3Å; S51-I55 WeakPolarHBondContact O-CG1 3.43Å; S51-I55 PolarHBondContact O-N 2.91Å; S52-I55 PolarHBondContact O-N 3.26Å; C53-I55 VanDerWaalsContact C-N 3.35Å; C53-I55 PolarHBondContact O-N 3.02Å; I55-P59 VanDerWaalsContact O-CD 3.22Å; I55-P59 WeakPolarHBondContact O-CD 3.46Å
56	E	86.8	Confident	81.7	Confident	98 Å²	98	58.9 Å²	58.9	46%	0.458	31%	0.305	S	S	.	.	H	α-helix	trans	-71.1	-31.1	-179.6	-70.1	-68.1	160.3	0	0	113.1	V47 S52 C53 P59 L140	V47-E56 HydrophobicContact CG2-CG 4.5Å; S52-E56 WeakPolarHBondContact O-CG 3.43Å; S52-E56 PolarHBondContact O-N 2.92Å; C53-E56 PolarHBondContact O-N 3.08Å; E56-P59 WeakPolarHBondContact O-CD 3.49Å; E56-P59 WeakPolarHBondContact O-CG 3.42Å; E56-L140 HydrophobicContact CB-CD2 3.65Å
57	A	86.7	Confident	80.9	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-81.9	-29	-178.5	0	0	0	0	0	113.5	C53 L60 F61 F65 L115	C53-A57 WeakPolarHBondContact O-CB 3.32Å; C53-A57 PolarHBondContact O-N 2.93Å; A57-L60 PolarHBondContact O-N 2.51Å; A57-L60 VanDerWaalsContact O-N 3.09Å; A57-F61 HydrophobicContact CB-CD2 4.14Å; A57-F61 PolarHBondContact O-N 3.37Å; A57-F65 HydrophobicContact CB-CE2 4.27Å; A57-F65 HydrophobicContact CB-CZ 3.72Å; A57-L115 HydrophobicContact CB-CD1 3.87Å; A57-L115 HydrophobicContact CB-CD2 4.22Å
58	R	84.7	Confident	80	Confident	135 Å²	135	68 Å²	68	51%	0.509	35%	0.346	S	S	.	.	H	α-helix	trans	-49.6	-52.8	177.6	-86.7	174.8	-163.3	-175.8	6.6	114.3	E54 L60 D62 F65	E54-R58 VanDerWaalsContact O-CG 3.25Å; E54-R58 WeakPolarHBondContact O-CG 3.22Å; E54-R58 PolarHBondContact O-N 3.07Å; E54-R58 VanDerWaalsContact O-N 3.09Å; R58-L60 PolarHBondContact O-N 3.04Å; R58-D62 WeakPolarHBondContact O-CA 3.47Å; R58-D62 PolarHBondContact O-N 3.43Å; R58-F65 HydrophobicContact CG-CE2 4.21Å
59	P	82.9	Confident	79.3	Confident	106 Å²	106	68.2 Å²	68.2	69%	0.688	35%	0.345	S	S	*	.	H	α-helix	trans	-69.2	-18.4	-179.2	27.8	-36.2	0	0	0	113.7	I55 E56	I55-P59 VanDerWaalsContact O-CD 3.22Å; I55-P59 WeakPolarHBondContact O-CD 3.46Å; E56-P59 WeakPolarHBondContact O-CD 3.49Å; E56-P59 WeakPolarHBondContact O-CG 3.42Å
60	L	84	Confident	78.5	Confident	39 Å²	39	67.9 Å²	67.9	20%	0.204	35%	0.347	C	S	.	.	H	α-helix	trans	-89.1	-43.4	-177.7	-64.5	174	0	0	0	111.9	A57 R58 A113 L140 H172	A57-L60 PolarHBondContact O-N 2.51Å; A57-L60 VanDerWaalsContact O-N 3.09Å; R58-L60 PolarHBondContact O-N 3.04Å; L60-A113 HydrophobicContact CD1-CB 4.01Å; L60-L140 HydrophobicContact CD1-CD2 4.43Å; L60-H172 PolarHBondContact O-CD2 3.42Å; L60-H172 PolarHBondContact O-NE2 2.93Å
61	F	82.5	Confident	77.7	Confident	18 Å²	18	75 Å²	75	8%	0.079	37%	0.372	C	S	.	.	H	α-helix	trans	-114.4	-7.2	-169.8	-61.8	-86.9	0	0	0	114.8	A57 F63 A113 L115 L140 T170 H172	A57-F61 HydrophobicContact CB-CD2 4.14Å; A57-F61 PolarHBondContact O-N 3.37Å; F61-F63 VanDerWaalsContact C-N 3.3Å; F61-F63 HydrophobicContact CB-CD1 4.42Å; F61-F63 HydrophobicContact CB-CD2 3.31Å; F61-F63 HydrophobicContact CB-CE1 4.41Å; F61-F63 HydrophobicContact CB-CE2 3.32Å; F61-F63 HydrophobicContact CB-CG 3.9Å; F61-F63 HydrophobicContact CB-CZ 3.91Å; F61-F63 AromaticContact CD1-CE2 3.88Å; F61-F63 HydrophobicContact CD1-CE2 3.88Å; F61-F63 HydrophobicContact CD1-CZ 4.33Å; F61-F63 HydrophobicContact CG-CD2 4.03Å; F61-F63 AromaticContact CG-CE2 3.72Å; F61-F63 HydrophobicContact CG-CE2 3.72Å; F61-F63 HydrophobicContact CG-CZ 4.46Å; F61-F63 PolarHBondContact O-N 2.95Å; F61-A113 HydrophobicContact CZ-CB 4.44Å; F61-L115 HydrophobicContact CD2-CB 4.2Å; F61-L115 HydrophobicContact CD2-CD2 4.08Å; F61-L115 HydrophobicContact CE1-CB 4.31Å; F61-L115 HydrophobicContact CE2-CB 3.61Å; F61-L115 HydrophobicContact CE2-CD2 4.34Å; F61-L115 HydrophobicContact CG-CD2 4.39Å; F61-L115 HydrophobicContact CZ-CB 3.65Å; F61-L140 HydrophobicContact CE2-CD1 3.94Å; F61-T170 HydrophobicContact CD1-CG2 3.64Å; F61-T170 HydrophobicContact CE1-CG2 3.6Å; F61-H172 HydrophobicContact CE1-CB 3.72Å; F61-H172 HydrophobicContact CE2-CB 4.32Å; F61-H172 HydrophobicContact CZ-CB 3.61Å
62	D	77	Confident	77.2	Confident	150 Å²	150	74.7 Å²	74.7	80%	0.802	37%	0.367	S	S	*	.			trans	52.1	44.5	-176.1	-161.6	25.7	0	0	0	113.6	R58	R58-D62 WeakPolarHBondContact O-CA 3.47Å; R58-D62 PolarHBondContact O-N 3.43Å
63	F	74.4	Confident	76.8	Confident	11 Å²	11	75 Å²	75	5%	0.048	37%	0.373	C	S	.	.			trans	-96.5	131.6	-179.1	-69.4	-35.5	0	0	0	113.8	F61 F65 L69 P70 I72 L115 T170	F61-F63 VanDerWaalsContact C-N 3.3Å; F61-F63 HydrophobicContact CB-CD1 4.42Å; F61-F63 HydrophobicContact CB-CD2 3.31Å; F61-F63 HydrophobicContact CB-CE1 4.41Å; F61-F63 HydrophobicContact CB-CE2 3.32Å; F61-F63 HydrophobicContact CB-CG 3.9Å; F61-F63 HydrophobicContact CB-CZ 3.91Å; F61-F63 AromaticContact CD1-CE2 3.88Å; F61-F63 HydrophobicContact CD1-CE2 3.88Å; F61-F63 HydrophobicContact CD1-CZ 4.33Å; F61-F63 HydrophobicContact CG-CD2 4.03Å; F61-F63 AromaticContact CG-CE2 3.72Å; F61-F63 HydrophobicContact CG-CE2 3.72Å; F61-F63 HydrophobicContact CG-CZ 4.46Å; F61-F63 PolarHBondContact O-N 2.95Å; F63-F65 HydrophobicContact CB-CD2 4.43Å; F63-F65 HydrophobicContact CB-CE2 4.1Å; F63-F65 HydrophobicContact CB-CZ 4.3Å; F63-F65 WeakPolarHBondContact O-CD2 3.48Å; F63-F65 PolarHBondContact O-N 2.85Å; F63-L69 HydrophobicContact CB-CD2 4.44Å; F63-L69 HydrophobicContact CD1-CD2 3.67Å; F63-L69 HydrophobicContact CD2-CD2 3.81Å; F63-L69 HydrophobicContact CE1-CD2 3.73Å; F63-L69 HydrophobicContact CE2-CD2 3.86Å; F63-L69 HydrophobicContact CG-CD2 3.72Å; F63-L69 HydrophobicContact CZ-CD2 3.83Å; F63-P70 HydrophobicContact CD1-CG 3.92Å; F63-P70 HydrophobicContact CE1-CG 3.67Å; F63-I72 HydrophobicContact CE1-CD1 3.53Å; F63-I72 HydrophobicContact CZ-CD1 3.4Å; F63-L115 HydrophobicContact CD2-CD2 3.58Å; F63-L115 HydrophobicContact CE2-CD2 3.7Å; F63-T170 HydrophobicContact CE2-CG2 4.01Å; F63-T170 HydrophobicContact CZ-CG2 3.87Å
64	D	70.8	Confident	76.6	Confident	74 Å²	74	77.3 Å²	77.3	40%	0.396	39%	0.388	S	S	.	.			trans	-85.4	100.5	158.3	-171.2	-4.7	0	0	0	110.3	K66 Q67	D64-K66 PolarHBondContact O-N 2.82Å; D64-K66 WeakPolarHBondContact OD1-CB 3.5Å; D64-K66 PolarHBondContact OD1-N 2.74Å; D64-Q67 HydrophobicContact CB-CB 4.26Å; D64-Q67 HydrophobicContact CB-CG 4.36Å; D64-Q67 PolarHBondContact O-N 2.97Å; D64-Q67 WeakPolarHBondContact OD2-CG 3.34Å; D64-Q67 PolarHBondContact OD2-NE2 2.99Å
65	F	70.3	Confident	76.4	Confident	10 Å²	10	77 Å²	77	4%	0.044	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-11	178.4	-69	-89.5	0	0	0	114.4	E54 A57 R58 F63 L115 T117 C138	E54-F65 HydrophobicContact CB-CD2 4.02Å; E54-F65 HydrophobicContact CB-CE2 4.11Å; E54-F65 HydrophobicContact CB-CG 4.38Å; E54-F65 HydrophobicContact CG-CB 4.16Å; E54-F65 HydrophobicContact CG-CD1 3.85Å; E54-F65 HydrophobicContact CG-CD2 3.83Å; E54-F65 HydrophobicContact CG-CE1 4.18Å; E54-F65 HydrophobicContact CG-CE2 4.17Å; E54-F65 HydrophobicContact CG-CG 3.67Å; E54-F65 HydrophobicContact CG-CZ 4.34Å; A57-F65 HydrophobicContact CB-CE2 4.27Å; A57-F65 HydrophobicContact CB-CZ 3.72Å; R58-F65 HydrophobicContact CG-CE2 4.21Å; F63-F65 HydrophobicContact CB-CD2 4.43Å; F63-F65 HydrophobicContact CB-CE2 4.1Å; F63-F65 HydrophobicContact CB-CZ 4.3Å; F63-F65 WeakPolarHBondContact O-CD2 3.48Å; F63-F65 PolarHBondContact O-N 2.85Å; F65-L115 HydrophobicContact CE1-CD2 4.14Å; F65-L115 HydrophobicContact CZ-CD2 4.06Å; F65-T117 HydrophobicContact CE1-CG2 4.26Å; F65-C138 HydrophobicContact CE1-CB 4.15Å
66	K	66.8	Low	76.2	Confident	186 Å²	186	74.3 Å²	74.3	81%	0.809	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-19.5	174.4	-64	179.8	178.7	-179.7	0	113.2	D64	D64-K66 PolarHBondContact O-N 2.82Å; D64-K66 WeakPolarHBondContact OD1-CB 3.5Å; D64-K66 PolarHBondContact OD1-N 2.74Å
67	Q	68.2	Low	75.7	Confident	126 Å²	126	73.2 Å²	73.2	59%	0.589	38%	0.384	S	S	*	.	S	Bend	trans	-101.9	173.5	-176.7	-69	-176.3	36.4	0	0	112.5	D64 L69 R136	D64-Q67 HydrophobicContact CB-CB 4.26Å; D64-Q67 HydrophobicContact CB-CG 4.36Å; D64-Q67 PolarHBondContact O-N 2.97Å; D64-Q67 WeakPolarHBondContact OD2-CG 3.34Å; D64-Q67 PolarHBondContact OD2-NE2 2.99Å; Q67-L69 PolarHBondContact O-N 3.31Å; Q67-R136 VanDerWaalsContact O-CZ 3.25Å; Q67-R136 PolarHBondContact O-NH1 2.99Å; Q67-R136 PolarHBondContact O-NH2 2.95Å
68	E	65.3	Low	75.1	Confident	118 Å²	118	77.3 Å²	77.3	55%	0.551	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-56.2	133.7	165.2	-68.5	-154	161.6	0	0	109	R292	E68-R292 IonicContact OE1-NH2 3.11Å; E68-R292 IonicContact OE2-CZ 3.06Å; E68-R292 IonicContact OE2-NH1 2.71Å; E68-R292 PolarHBondContact OE2-NH1 2.63Å; E68-R292 IonicContact OE2-NH2 2.67Å; E68-R292 PolarHBondContact OE2-NH2 3.2Å
69	L	67.2	Low	74.7	Confident	35 Å²	35	74.2 Å²	74.2	18%	0.183	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-59.1	137.5	173.3	-85.7	153.2	0	0	0	107	F63 Q67 R136 N168	F63-L69 HydrophobicContact CB-CD2 4.44Å; F63-L69 HydrophobicContact CD1-CD2 3.67Å; F63-L69 HydrophobicContact CD2-CD2 3.81Å; F63-L69 HydrophobicContact CE1-CD2 3.73Å; F63-L69 HydrophobicContact CE2-CD2 3.86Å; F63-L69 HydrophobicContact CG-CD2 3.72Å; F63-L69 HydrophobicContact CZ-CD2 3.83Å; Q67-L69 PolarHBondContact O-N 3.31Å; L69-R136 VanDerWaalsContact CG-NH1 3.28Å; L69-N168 HydrophobicContact CD1-CB 4.33Å
70	P	66.6	Low	74.6	Confident	74 Å²	74	69.4 Å²	69.4	48%	0.481	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-56.3	147.2	174.3	25.6	-33.6	0	0	0	109.2	F63 I72	F63-P70 HydrophobicContact CD1-CG 3.92Å; F63-P70 HydrophobicContact CE1-CG 3.67Å; P70-I72 HydrophobicContact CG-CD1 4.46Å; P70-I72 HydrophobicContact CG-CG1 4.45Å; P70-I72 PolarHBondContact O-N 3.33Å
71	Y	67.4	Low	74.6	Confident	176 Å²	176	74.4 Å²	74.4	69%	0.69	39%	0.389	S	S	*	.			trans	-66	112.7	173.6	179	-97.2	0	0	0	108.6
72	I	72.7	Confident	74.7	Confident	36 Å²	36	74.1 Å²	74.1	19%	0.185	39%	0.39	C	S	.	.			trans	-109.3	139.3	175.2	-65.5	173.1	0	0	0	107.6	F63 P70 T170 N175 C176 T177	F63-I72 HydrophobicContact CE1-CD1 3.53Å; F63-I72 HydrophobicContact CZ-CD1 3.4Å; P70-I72 HydrophobicContact CG-CD1 4.46Å; P70-I72 HydrophobicContact CG-CG1 4.45Å; P70-I72 PolarHBondContact O-N 3.33Å; I72-T170 HydrophobicContact CD1-CG2 4.25Å; I72-N175 WeakPolarHBondContact CG2-O 3.26Å; I72-C176 VanDerWaalsContact CG2-CA 3.41Å; I72-T177 WeakPolarHBondContact CB-OG1 3.34Å
73	A	78.1	Confident	75.1	Confident	56 Å²	56	72.3 Å²	72.3	46%	0.463	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-59	145.8	178.5	0	0	0	0	0	111.7	C176 T177	A73-C176 WeakPolarHBondContact O-CA 3.44Å; A73-T177 PolarHBondContact O-N 2.99Å
74	P	82.9	Confident	75.9	Confident	48 Å²	48	72.4 Å²	72.4	31%	0.312	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-61.8	141.2	174.3	26.6	-33.1	0	0	0	110.8	T177	P74-T177 WeakPolarHBondContact CA-O 3.46Å
75	C	82.9	Confident	76.6	Confident	10 Å²	10	73.1 Å²	73.1	7%	0.068	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-69.8	140.8	175.8	-59	0	0	0	0	111	I80 C176 L178	C75-I80 HydrophobicContact CB-CG2 3.16Å; C75-I80 VanDerWaalsContact SG-CG2 3.51Å; C75-C176 VanDerWaalsContact CA-SG 3.56Å; C75-C176 HydrophobicContact CB-CB 3.77Å; C75-C176 WeakPolarHBondContact CB-SG 3.46Å; C75-C176 WeakPolarHBondContact SG-CB 3.37Å; C75-C176 PolarHBondContact SG-O 3.3Å; C75-C176 CovalentContact SG-SG 2.03Å; C75-C176 PolarHBondContact SG-SG 2.85Å; C75-L178 HydrophobicContact CB-CD2 3.94Å; C75-L178 HydrophobicContact CB-CG 4.1Å
76	P	81	Confident	77.5	Confident	54 Å²	54	73.6 Å²	73.6	35%	0.351	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-65.2	138.5	171.7	28.1	-33.5	0	0	0	110.4	S78 Q79 I80	P76-S78 PolarHBondContact O-N 2.87Å; P76-Q79 HydrophobicContact CG-CB 4.05Å; P76-Q79 HydrophobicContact CG-CG 3.7Å; P76-Q79 PolarHBondContact O-N 3.24Å; P76-I80 PolarHBondContact O-N 3.4Å
77	A	76.5	Confident	78.3	Confident	75 Å²	75	69.7 Å²	69.7	62%	0.62	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-11.3	-177	0	0	0	0	0	114.7	R81	A77-R81 PolarHBondContact O-NE 2.87Å
78	S	74.5	Confident	79.1	Confident	86 Å²	86	64.3 Å²	64.3	60%	0.601	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-28.3	172.2	51.9	0	0	0	0	113.4	P76	P76-S78 PolarHBondContact O-N 2.87Å
79	Q	76	Confident	79.8	Confident	70 Å²	70	59.9 Å²	59.9	33%	0.327	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-33.6	-174.1	-69.2	175.7	2.4	0	0	112.9	P76 D107 L108	P76-Q79 HydrophobicContact CG-CB 4.05Å; P76-Q79 HydrophobicContact CG-CG 3.7Å; P76-Q79 PolarHBondContact O-N 3.24Å; Q79-D107 PolarHBondContact O-N 3.4Å; Q79-L108 HydrophobicContact CB-CD2 4.42Å; Q79-L108 HydrophobicContact CG-CD2 4.37Å
80	I	81.3	Confident	80.2	Confident	5 Å²	5	65.2 Å²	65.2	3%	0.026	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	142.7	178.2	177.8	166.7	0	0	0	111.6	C75 P76 L105 V106 V169 V171 L178	C75-I80 HydrophobicContact CB-CG2 3.16Å; C75-I80 VanDerWaalsContact SG-CG2 3.51Å; P76-I80 PolarHBondContact O-N 3.4Å; I80-L105 CarbonylContact C-O 3.48Å; I80-L105 VanDerWaalsContact CA-O 3.31Å; I80-L105 WeakPolarHBondContact CA-O 3.49Å; I80-V106 HydrophobicContact CD1-CG2 4.13Å; I80-V106 HydrophobicContact CG1-CG2 4.36Å; I80-V169 HydrophobicContact CD1-CG1 3.94Å; I80-V171 HydrophobicContact CB-CG2 4.35Å; I80-V171 HydrophobicContact CD1-CG2 3.27Å; I80-V171 HydrophobicContact CG1-CG2 4.37Å; I80-V171 HydrophobicContact CG2-CG2 4.22Å; I80-L178 HydrophobicContact CD1-CD1 4.38Å; I80-L178 HydrophobicContact CG1-CD1 4.07Å; I80-L178 HydrophobicContact CG2-CD1 3.88Å; I80-L178 HydrophobicContact CG2-CG 4.33Å
81	R	83.4	Confident	80.3	Confident	145 Å²	145	65.2 Å²	65.2	55%	0.547	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128	167	-61.1	-178.1	-176.8	177.3	1.4	109.4	A77 F83 T104 L105	A77-R81 PolarHBondContact O-NE 2.87Å; R81-F83 HydrophobicContact CB-CE2 3.9Å; R81-F83 HydrophobicContact CB-CZ 4.09Å; R81-T104 CarbonylContact O-C 3.36Å; R81-T104 WeakPolarHBondContact O-CA 3.3Å; R81-L105 HydrophobicContact CB-CB 4.4Å; R81-L105 PolarHBondContact N-O 3.49Å; R81-L105 PolarHBondContact O-N 3.45Å
82	A	85.7	Confident	80.1	Confident	12 Å²	12	66.1 Å²	66.1	10%	0.099	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.2	171.7	0	0	0	0	0	110	L84 S103 T104 V169 L178 Y180	A82-L84 HydrophobicContact CB-CD1 4.08Å; A82-S103 CarbonylContact C-O 3.59Å; A82-S103 WeakPolarHBondContact CA-O 3.39Å; A82-T104 HydrophobicContact CB-CG2 4.15Å; A82-V169 HydrophobicContact CB-CG2 4.31Å; A82-L178 HydrophobicContact CB-CD1 4.13Å; A82-Y180 HydrophobicContact CB-CE2 3.67Å
83	F	85.8	Confident	79.6	Confident	111 Å²	111	71.5 Å²	71.5	49%	0.487	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	119.6	176.1	-57.6	-83.7	0	0	0	108.2	R81 S103	R81-F83 HydrophobicContact CB-CE2 3.9Å; R81-F83 HydrophobicContact CB-CZ 4.09Å; F83-S103 PolarHBondContact N-O 2.85Å; F83-S103 PolarHBondContact O-N 2.86Å
84	L	89.8	Confident	79.1	Confident	13 Å²	13	70.6 Å²	70.6	7%	0.068	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.4	179.7	-74.8	78	0	0	0	108.9	A82 L100 N101 V102 V167 Y180 V182 L204	A82-L84 HydrophobicContact CB-CD1 4.08Å; L84-L100 HydrophobicContact CB-CD1 4.25Å; L84-L100 HydrophobicContact CD2-CD1 4.41Å; L84-N101 WeakPolarHBondContact CA-O 3.5Å; L84-V102 HydrophobicContact CD1-CG1 4.41Å; L84-V102 HydrophobicContact CD2-CG2 4.5Å; L84-V102 HydrophobicContact CG-CG1 4.4Å; L84-V102 HydrophobicContact CG-CG2 4.26Å; L84-V167 HydrophobicContact CD2-CB 3.94Å; L84-V167 HydrophobicContact CD2-CG1 3.95Å; L84-V167 HydrophobicContact CD2-CG2 4Å; L84-Y180 HydrophobicContact CD1-CD1 4.31Å; L84-Y180 HydrophobicContact CD1-CD2 3.7Å; L84-Y180 HydrophobicContact CD1-CE1 4.47Å; L84-Y180 HydrophobicContact CD1-CE2 3.9Å; L84-Y180 HydrophobicContact CD1-CG 3.92Å; L84-Y180 HydrophobicContact CD2-CD2 4.33Å; L84-Y180 HydrophobicContact CD2-CG 4.13Å; L84-V182 HydrophobicContact CD2-CG1 3.92Å; L84-L204 HydrophobicContact CB-CD1 3.95Å; L84-L204 HydrophobicContact CB-CD2 4.12Å; L84-L204 HydrophobicContact CD2-CD1 4.07Å; L84-L204 HydrophobicContact CG-CD1 4.48Å
85	F	86.9	Confident	78.7	Confident	89 Å²	89	76.9 Å²	76.9	39%	0.39	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	146.2	175.9	64	-84.6	0	0	0	111.8	N101	F85-N101 HydrophobicContact CD1-CB 3.91Å; F85-N101 HydrophobicContact CD2-CB 3.97Å; F85-N101 HydrophobicContact CE1-CB 3.54Å; F85-N101 HydrophobicContact CE2-CB 3.62Å; F85-N101 WeakPolarHBondContact CE2-ND2 3.27Å; F85-N101 HydrophobicContact CG-CB 4.12Å; F85-N101 HydrophobicContact CZ-CB 3.4Å; F85-N101 VanDerWaalsContact CZ-CB 3.4Å; F85-N101 WeakPolarHBondContact CZ-ND2 3.48Å; F85-N101 PolarHBondContact N-O 3.35Å; F85-N101 PolarHBondContact O-N 3.38Å
86	A	87.9	Confident	78.5	Confident	21 Å²	21	78.1 Å²	78.1	17%	0.174	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	136.8	174	0	0	0	0	0	110.7	V98 M99 L190 F202	A86-V98 HydrophobicContact CB-CG1 3.65Å; A86-M99 WeakPolarHBondContact CA-O 3.46Å; A86-L190 HydrophobicContact CB-CD2 4.19Å; A86-F202 HydrophobicContact CB-CB 3.98Å; A86-F202 HydrophobicContact CB-CD1 3.96Å; A86-F202 HydrophobicContact CB-CD2 3.53Å; A86-F202 HydrophobicContact CB-CE1 4.3Å; A86-F202 HydrophobicContact CB-CE2 3.9Å; A86-F202 HydrophobicContact CB-CG 3.54Å; A86-F202 HydrophobicContact CB-CZ 4.27Å
87	R	85	Confident	78.7	Confident	104 Å²	104	76.7 Å²	76.7	39%	0.392	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	137	173.3	-179.9	179.3	177.6	-169.2	-2.1	109.4	M99 E155	R87-M99 PolarHBondContact N-O 3.13Å; R87-M99 PolarHBondContact O-N 2.87Å; R87-E155 IonicContact NH1-OE1 3.8Å; R87-E155 PolarHBondContact NH1-OE1 2.75Å; R87-E155 IonicContact NH1-OE2 3.71Å; R87-E155 PolarHBondContact NH1-OE2 3.45Å
88	I	83.2	Confident	79.2	Confident	12 Å²	12	73.2 Å²	73.2	6%	0.062	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	126.4	171.8	-57.5	-168.2	0	0	0	109.3	Q90 P96 A187 L190 Q191	I88-Q90 PolarHBondContact O-N 3.46Å; I88-P96 HydrophobicContact CG2-CB 4.35Å; I88-A187 HydrophobicContact CD1-CB 4.28Å; I88-A187 VanDerWaalsContact CD1-O 3.29Å; I88-A187 WeakPolarHBondContact CD1-O 3.45Å; I88-A187 HydrophobicContact CG2-CB 4.2Å; I88-L190 HydrophobicContact CD1-CB 4.16Å; I88-L190 HydrophobicContact CD1-CD2 4.43Å; I88-L190 HydrophobicContact CG1-CD2 4.26Å; I88-Q191 HydrophobicContact CD1-CB 3.48Å; I88-Q191 VanDerWaalsContact CD1-CB 3.48Å; I88-Q191 HydrophobicContact CD1-CG 3.47Å; I88-Q191 VanDerWaalsContact CD1-CG 3.47Å; I88-Q191 HydrophobicContact CG1-CG 4.05Å
89	V	80.4	Confident	79.7	Confident	26 Å²	26	69.4 Å²	69.4	16%	0.158	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	109.4	165.2	-178.5	0	0	0	0	107.1	P96 F97 M99	V89-P96 WeakPolarHBondContact O-CA 3.43Å; V89-F97 HydrophobicContact CB-CD1 4.32Å; V89-F97 HydrophobicContact CB-CD2 4.13Å; V89-F97 HydrophobicContact CB-CE1 3.91Å; V89-F97 HydrophobicContact CB-CE2 3.75Å; V89-F97 HydrophobicContact CB-CG 4.43Å; V89-F97 HydrophobicContact CB-CZ 3.63Å; V89-F97 HydrophobicContact CG1-CE1 3.92Å; V89-F97 HydrophobicContact CG1-CE2 4.39Å; V89-F97 HydrophobicContact CG1-CZ 3.77Å; V89-F97 HydrophobicContact CG2-CD2 4.13Å; V89-F97 HydrophobicContact CG2-CE1 4.47Å; V89-F97 HydrophobicContact CG2-CE2 3.5Å; V89-F97 VanDerWaalsContact CG2-CE2 3.5Å; V89-F97 HydrophobicContact CG2-CZ 3.7Å; V89-F97 PolarHBondContact N-O 3.48Å; V89-M99 HydrophobicContact CG2-CB 4.04Å; V89-M99 HydrophobicContact CG2-CE 3.74Å; V89-M99 HydrophobicContact CG2-SD 4.41Å
90	Q	76.5	Confident	80.4	Confident	147 Å²	147	66 Å²	66	69%	0.687	31%	0.306	S	S	*	.			trans	-63.7	148.7	177.1	-74.6	-177.5	-8.1	0	0	111.1	I88 K92	I88-Q90 PolarHBondContact O-N 3.46Å; Q90-K92 PolarHBondContact O-N 3.2Å
91	P	68.9	Low	80.7	Confident	74 Å²	74	65.8 Å²	65.8	48%	0.481	31%	0.305	S	S	.	.			trans	-65.3	120.1	-177.2	26.9	-33.6	0	0	0	110.6	Y94	P91-Y94 VanDerWaalsContact CA-O 3.25Å; P91-Y94 WeakPolarHBondContact CA-O 3.41Å; P91-Y94 WeakPolarHBondContact CB-O 3.35Å
92	K	63	Low	80.9	Confident	195 Å²	195	59 Å²	59	85%	0.848	28%	0.279	S	S	*	.	S	Bend	trans	-109	-50.8	162.1	-73.6	-174	177.3	-175.3	0	110.9	Q90	Q90-K92 PolarHBondContact O-N 3.2Å
93	Q	62.5	Low	80.9	Confident	149 Å²	149	59.2 Å²	59.2	70%	0.696	28%	0.28	S	S	*	.	S	Bend	trans	-132.4	-4.9	176.5	-71.3	172.8	-25.8	0	0	112.6
94	Y	67	Low	80.8	Confident	37 Å²	37	54 Å²	54	15%	0.145	26%	0.257	C	S	.	.	S	Bend	trans	-127.5	160.1	-173.8	-48.6	-60.8	0	0	0	109.9	E26 N27 P91	E26-Y94 HydrophobicContact CB-CE1 3.97Å; E26-Y94 PolarHBondContact O-OH 2.88Å; E26-Y94 PolarHBondContact OE2-OH 2.9Å; N27-Y94 WeakPolarHBondContact OD1-CD1 3.17Å; P91-Y94 VanDerWaalsContact CA-O 3.25Å; P91-Y94 WeakPolarHBondContact CA-O 3.41Å; P91-Y94 WeakPolarHBondContact CB-O 3.35Å
95	F	73.9	Confident	80.5	Confident	179 Å²	179	56 Å²	56	79%	0.785	27%	0.268	S	S	*	.			trans	-62.3	148.2	168.8	-72.9	-74.3	0	0	0	110.7	F97	F95-F97 WeakPolarHBondContact O-CD1 3.24Å; F95-F97 PolarHBondContact O-N 3.31Å
96	P	80.3	Confident	80.2	Confident	37 Å²	37	51.9 Å²	51.9	24%	0.24	25%	0.25	C	C	.	.			trans	-58.2	132.2	177.6	24.2	-32.9	0	0	0	110	I88 V89 A187	I88-P96 HydrophobicContact CG2-CB 4.35Å; V89-P96 WeakPolarHBondContact O-CA 3.43Å; P96-A187 HydrophobicContact CB-CB 3.94Å; P96-A187 WeakPolarHBondContact O-CB 3.42Å
97	F	83.6	Confident	79.7	Confident	23 Å²	23	55.4 Å²	55.4	10%	0.101	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	162.1	178.9	64.8	-99.7	0	0	0	111.2	V89 F95 M99 H158	V89-F97 HydrophobicContact CB-CD1 4.32Å; V89-F97 HydrophobicContact CB-CD2 4.13Å; V89-F97 HydrophobicContact CB-CE1 3.91Å; V89-F97 HydrophobicContact CB-CE2 3.75Å; V89-F97 HydrophobicContact CB-CG 4.43Å; V89-F97 HydrophobicContact CB-CZ 3.63Å; V89-F97 HydrophobicContact CG1-CE1 3.92Å; V89-F97 HydrophobicContact CG1-CE2 4.39Å; V89-F97 HydrophobicContact CG1-CZ 3.77Å; V89-F97 HydrophobicContact CG2-CD2 4.13Å; V89-F97 HydrophobicContact CG2-CE1 4.47Å; V89-F97 HydrophobicContact CG2-CE2 3.5Å; V89-F97 VanDerWaalsContact CG2-CE2 3.5Å; V89-F97 HydrophobicContact CG2-CZ 3.7Å; V89-F97 PolarHBondContact N-O 3.48Å; F95-F97 WeakPolarHBondContact O-CD1 3.24Å; F95-F97 PolarHBondContact O-N 3.31Å; F97-M99 HydrophobicContact CE2-CB 4.42Å; F97-M99 HydrophobicContact CE2-CE 3.95Å; F97-M99 HydrophobicContact CZ-CE 4.38Å; F97-H158 WeakPolarHBondContact CB-NE2 3.37Å; F97-H158 AromaticContact CD2-CD2 3.35Å; F97-H158 WeakPolarHBondContact CD2-CD2 3.41Å; F97-H158 AromaticContact CG-CD2 3.65Å; F97-H158 AromaticContact CG-NE2 3.87Å
98	V	86.6	Confident	78.8	Confident	3 Å²	3	52 Å²	52	2%	0.018	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	127.5	178.4	-176.6	0	0	0	0	109.4	A86 M159 S184 A187 L190	A86-V98 HydrophobicContact CB-CG1 3.65Å; V98-M159 HydrophobicContact CB-CB 4.21Å; V98-M159 HydrophobicContact CG1-CB 4.28Å; V98-M159 HydrophobicContact CG1-CG 4.44Å; V98-M159 WeakPolarHBondContact O-CB 3.19Å; V98-M159 PolarHBondContact O-N 2.82Å; V98-S184 WeakPolarHBondContact CG1-OG 3.36Å; V98-S184 WeakPolarHBondContact CG2-OG 3.31Å; V98-A187 HydrophobicContact CG2-CB 3.98Å; V98-L190 HydrophobicContact CG1-CD2 4.38Å; V98-L190 HydrophobicContact CG2-CD2 4.09Å
99	M	86.9	Confident	78.1	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.025	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.1	172.1	-173	177.2	-72.9	0	0	108.9	H34 A86 R87 V89 F97 E155 F157	H34-M99 HydrophobicContact CB-CE 3.94Å; A86-M99 WeakPolarHBondContact CA-O 3.46Å; R87-M99 PolarHBondContact N-O 3.13Å; R87-M99 PolarHBondContact O-N 2.87Å; V89-M99 HydrophobicContact CG2-CB 4.04Å; V89-M99 HydrophobicContact CG2-CE 3.74Å; V89-M99 HydrophobicContact CG2-SD 4.41Å; F97-M99 HydrophobicContact CE2-CB 4.42Å; F97-M99 HydrophobicContact CE2-CE 3.95Å; F97-M99 HydrophobicContact CZ-CE 4.38Å; M99-E155 HydrophobicContact SD-CB 4.21Å; M99-F157 CarbonylContact C-O 3.53Å; M99-F157 WeakPolarHBondContact CA-O 3.47Å
100	L	89.9	Confident	77.7	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	121.6	171.1	178.5	71.2	0	0	0	109.3	L84 V102 F118 F157 M159 V167 V182 F202	L84-L100 HydrophobicContact CB-CD1 4.25Å; L84-L100 HydrophobicContact CD2-CD1 4.41Å; L100-V102 HydrophobicContact CD2-CG2 4.17Å; L100-V102 HydrophobicContact CG-CG2 4.14Å; L100-F118 HydrophobicContact CD2-CD1 4.37Å; L100-F118 HydrophobicContact CD2-CE1 3.88Å; L100-F157 HydrophobicContact CB-CB 4.3Å; L100-F157 HydrophobicContact CB-CD1 4.47Å; L100-F157 PolarHBondContact N-O 3.31Å; L100-M159 HydrophobicContact CB-CG 3.61Å; L100-M159 HydrophobicContact CB-SD 3.81Å; L100-M159 HydrophobicContact CD2-SD 3.95Å; L100-M159 HydrophobicContact CG-SD 4.39Å; L100-V167 HydrophobicContact CD2-CG2 3.79Å; L100-V182 HydrophobicContact CD2-CG2 4.1Å; L100-F202 HydrophobicContact CD1-CE2 4.31Å; L100-F202 HydrophobicContact CD1-CZ 3.96Å
101	N	87.1	Confident	77.1	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129	171	-72.9	-1	0	0	0	108.9	L84 F85 V154 E155	L84-N101 WeakPolarHBondContact CA-O 3.5Å; F85-N101 HydrophobicContact CD1-CB 3.91Å; F85-N101 HydrophobicContact CD2-CB 3.97Å; F85-N101 HydrophobicContact CE1-CB 3.54Å; F85-N101 HydrophobicContact CE2-CB 3.62Å; F85-N101 WeakPolarHBondContact CE2-ND2 3.27Å; F85-N101 HydrophobicContact CG-CB 4.12Å; F85-N101 HydrophobicContact CZ-CB 3.4Å; F85-N101 VanDerWaalsContact CZ-CB 3.4Å; F85-N101 WeakPolarHBondContact CZ-ND2 3.48Å; F85-N101 PolarHBondContact N-O 3.35Å; F85-N101 PolarHBondContact O-N 3.38Å; N101-V154 WeakPolarHBondContact CA-O 3.24Å; N101-E155 PolarHBondContact ND2-OE1 2.84Å; N101-E155 WeakPolarHBondContact OD1-CA 3.19Å; N101-E155 WeakPolarHBondContact OD1-CB 3.2Å; N101-E155 WeakPolarHBondContact OD1-CG 3.48Å
102	V	88.7	Confident	77.6	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.012	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	107.2	176.3	-174.8	0	0	0	0	107.4	L84 L100 T104 V116 F118 V154 V167 V169	L84-V102 HydrophobicContact CD1-CG1 4.41Å; L84-V102 HydrophobicContact CD2-CG2 4.5Å; L84-V102 HydrophobicContact CG-CG1 4.4Å; L84-V102 HydrophobicContact CG-CG2 4.26Å; L100-V102 HydrophobicContact CD2-CG2 4.17Å; L100-V102 HydrophobicContact CG-CG2 4.14Å; V102-T104 HydrophobicContact CG1-CG2 4.36Å; V102-V116 HydrophobicContact CG1-CG1 4.27Å; V102-V116 HydrophobicContact CG1-CG2 4.28Å; V102-V116 HydrophobicContact CG2-CG1 4.33Å; V102-F118 HydrophobicContact CG2-CE1 4.23Å; V102-F118 HydrophobicContact CG2-CZ 4.32Å; V102-V154 PolarHBondContact N-O 2.87Å; V102-V154 PolarHBondContact O-N 3.44Å; V102-V167 HydrophobicContact CG2-CG1 4.31Å; V102-V169 HydrophobicContact CG1-CG2 4.16Å
103	S	85.7	Confident	78.7	Confident	16 Å²	16	45.7 Å²	45.7	11%	0.112	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	132.4	174	-52.4	0	0	0	0	109.7	A82 F83 S152 S153	A82-S103 CarbonylContact C-O 3.59Å; A82-S103 WeakPolarHBondContact CA-O 3.39Å; F83-S103 PolarHBondContact N-O 2.85Å; F83-S103 PolarHBondContact O-N 2.86Å; S103-S152 CarbonylContact C-O 3.42Å; S103-S152 VanDerWaalsContact CA-O 3.24Å; S103-S152 WeakPolarHBondContact CA-O 3.33Å; S103-S153 PolarHBondContact OG-OG 2.8Å
104	T	83.9	Confident	80	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.8	178.5	53.8	0	0	0	0	109.5	R81 A82 V102 V114 L151 S152 V169	R81-T104 CarbonylContact O-C 3.36Å; R81-T104 WeakPolarHBondContact O-CA 3.3Å; A82-T104 HydrophobicContact CB-CG2 4.15Å; V102-T104 HydrophobicContact CG1-CG2 4.36Å; T104-V114 HydrophobicContact CG2-CG1 4.24Å; T104-L151 WeakPolarHBondContact O-CA 3.46Å; T104-S152 PolarHBondContact N-O 3.25Å; T104-S152 PolarHBondContact O-N 2.94Å; T104-S152 PolarHBondContact OG1-OG 3.25Å; T104-V169 HydrophobicContact CG2-CG1 3.71Å
105	L	82.3	Confident	81	Confident	57 Å²	57	36.8 Å²	36.8	30%	0.298	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	115.5	168.1	-179.5	72.1	0	0	0	107.2	I80 R81 M150 L151	I80-L105 CarbonylContact C-O 3.48Å; I80-L105 VanDerWaalsContact CA-O 3.31Å; I80-L105 WeakPolarHBondContact CA-O 3.49Å; R81-L105 HydrophobicContact CB-CB 4.4Å; R81-L105 PolarHBondContact N-O 3.49Å; R81-L105 PolarHBondContact O-N 3.45Å; L105-M150 WeakPolarHBondContact CA-O 3.44Å; L105-L151 HydrophobicContact CB-CD1 4.33Å; L105-L151 HydrophobicContact CD1-CB 4.25Å; L105-L151 HydrophobicContact CD1-CD1 4.39Å
106	V	80	Confident	81.8	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.006	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	126.1	178.6	-174.4	0	0	0	0	108.6	I80 L108 V114 W143 S149 M150 V171	I80-V106 HydrophobicContact CD1-CG2 4.13Å; I80-V106 HydrophobicContact CG1-CG2 4.36Å; V106-L108 HydrophobicContact CG1-CB 4.03Å; V106-L108 HydrophobicContact CG1-CD1 3.56Å; V106-L108 HydrophobicContact CG1-CG 3.75Å; V106-V114 HydrophobicContact CG2-CG2 3.79Å; V106-W143 HydrophobicContact CG2-CH2 3.98Å; V106-W143 HydrophobicContact CG2-CZ3 4.3Å; V106-S149 WeakPolarHBondContact O-CA 3.4Å; V106-M150 PolarHBondContact N-O 3.01Å; V106-M150 PolarHBondContact O-N 3.06Å; V106-V171 HydrophobicContact CG1-CG1 4.43Å
107	D	77.5	Confident	82.2	Confident	95 Å²	95	26.7 Å²	26.7	51%	0.508	14%	0.137	S	C	.	.			trans	-112	80	177.1	-169.6	-0.3	0	0	0	108.5	Q79 A148	Q79-D107 PolarHBondContact O-N 3.4Å; D107-A148 VanDerWaalsContact OD1-O 3.11Å
108	L	67.8	Low	82.5	Confident	34 Å²	34	25.7 Å²	25.7	18%	0.178	13%	0.132	C	C	.	.			trans	-137.9	137.4	-178.1	-69.4	173.5	0	0	0	110	Q79 V106 E110 T112 V171 A174	Q79-L108 HydrophobicContact CB-CD2 4.42Å; Q79-L108 HydrophobicContact CG-CD2 4.37Å; V106-L108 HydrophobicContact CG1-CB 4.03Å; V106-L108 HydrophobicContact CG1-CD1 3.56Å; V106-L108 HydrophobicContact CG1-CG 3.75Å; L108-E110 PolarHBondContact O-N 3.46Å; L108-T112 HydrophobicContact CB-CG2 3.91Å; L108-T112 HydrophobicContact CD1-CG2 3.46Å; L108-T112 VanDerWaalsContact CD1-CG2 3.46Å; L108-T112 HydrophobicContact CG-CG2 4.32Å; L108-V171 HydrophobicContact CD1-CG1 3.75Å; L108-A174 HydrophobicContact CD1-CB 4.41Å
109	Q	67.8	Low	82.6	Confident	170 Å²	170	28.5 Å²	28.5	79%	0.794	15%	0.145	S	C	*	.	S	Bend	trans	-77.5	-6.1	-176.8	-63.1	-175	1.7	0	0	114	K146	Q109-K146 WeakPolarHBondContact O-CD 3.42Å; Q109-K146 WeakPolarHBondContact O-CG 3.33Å
110	E	71.3	Confident	82.7	Confident	98 Å²	98	29.1 Å²	29.1	46%	0.458	15%	0.149	S	C	.	.	S	Bend	trans	-114.7	152	-174.5	-67.7	-168.8	165.2	0	0	111.8	L108 T112	L108-E110 PolarHBondContact O-N 3.46Å; E110-T112 VanDerWaalsContact O-CG2 3.24Å; E110-T112 WeakPolarHBondContact O-CG2 3.31Å; E110-T112 PolarHBondContact O-N 3.29Å
111	P	64.9	Low	82.5	Confident	48 Å²	48	32.6 Å²	32.6	31%	0.312	17%	0.167	S	C	.	.			trans	-61.1	114.1	173.7	27.4	-33.4	0	0	0	108.9	F173	P111-F173 WeakPolarHBondContact O-CD2 3.31Å; P111-F173 VanDerWaalsContact O-CE2 3.29Å; P111-F173 WeakPolarHBondContact O-CE2 3.4Å
112	T	79.1	Confident	82.6	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.018	18%	0.18	C	C	.	.			trans	-111.1	169.5	-175.8	54.4	0	0	0	0	110.5	L108 E110 W143 H172	L108-T112 HydrophobicContact CB-CG2 3.91Å; L108-T112 HydrophobicContact CD1-CG2 3.46Å; L108-T112 VanDerWaalsContact CD1-CG2 3.46Å; L108-T112 HydrophobicContact CG-CG2 4.32Å; E110-T112 VanDerWaalsContact O-CG2 3.24Å; E110-T112 WeakPolarHBondContact O-CG2 3.31Å; E110-T112 PolarHBondContact O-N 3.29Å; T112-W143 VanDerWaalsContact O-CE3 3.31Å; T112-W143 PolarHBondContact O-N 3.31Å; T112-H172 WeakPolarHBondContact CG2-O 3.41Å
113	A	86.6	Confident	82.4	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.008	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.5	169.6	0	0	0	0	0	108.5	L60 F61 L140 I141 K142 H172	L60-A113 HydrophobicContact CD1-CB 4.01Å; F61-A113 HydrophobicContact CZ-CB 4.44Å; A113-L140 HydrophobicContact CB-CD1 4.19Å; A113-I141 CarbonylContact C-O 3.58Å; A113-I141 WeakPolarHBondContact CA-O 3.37Å; A113-K142 HydrophobicContact CB-CB 4.21Å; A113-K142 HydrophobicContact CB-CG 4.37Å; A113-H172 HydrophobicContact CB-CB 3.81Å; A113-H172 WeakPolarHBondContact O-CB 3.29Å; A113-H172 PolarHBondContact O-N 2.81Å
114	V	88.2	Confident	82.1	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.2	175.9	165.9	0	0	0	0	108.8	T104 V106 V116 L140 I141 W143 V169 T170 V171	T104-V114 HydrophobicContact CG2-CG1 4.24Å; V106-V114 HydrophobicContact CG2-CG2 3.79Å; V114-V116 HydrophobicContact CG1-CG2 4.13Å; V114-L140 WeakPolarHBondContact O-CA 3.39Å; V114-I141 PolarHBondContact N-O 3.07Å; V114-I141 PolarHBondContact O-N 3.13Å; V114-W143 HydrophobicContact CB-CH2 4.04Å; V114-W143 HydrophobicContact CB-CZ3 3.95Å; V114-W143 HydrophobicContact CG2-CH2 3.74Å; V114-W143 HydrophobicContact CG2-CZ3 3.57Å; V114-V169 HydrophobicContact CG1-CG1 3.78Å; V114-T170 CarbonylContact C-O 3.57Å; V114-T170 WeakPolarHBondContact CA-O 3.46Å; V114-V171 HydrophobicContact CG2-CG1 4.32Å; V114-V171 HydrophobicContact CG2-CG2 4.24Å
115	L	89.3	Confident	81.5	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	119.6	174.7	179.9	69.9	0	0	0	109.4	A57 F61 F63 F65 T117 C138 L140 V169 T170	A57-L115 HydrophobicContact CB-CD1 3.87Å; A57-L115 HydrophobicContact CB-CD2 4.22Å; F61-L115 HydrophobicContact CD2-CB 4.2Å; F61-L115 HydrophobicContact CD2-CD2 4.08Å; F61-L115 HydrophobicContact CE1-CB 4.31Å; F61-L115 HydrophobicContact CE2-CB 3.61Å; F61-L115 HydrophobicContact CE2-CD2 4.34Å; F61-L115 HydrophobicContact CG-CD2 4.39Å; F61-L115 HydrophobicContact CZ-CB 3.65Å; F63-L115 HydrophobicContact CD2-CD2 3.58Å; F63-L115 HydrophobicContact CE2-CD2 3.7Å; F65-L115 HydrophobicContact CE1-CD2 4.14Å; F65-L115 HydrophobicContact CZ-CD2 4.06Å; L115-T117 HydrophobicContact CD1-CG2 4.4Å; L115-T117 HydrophobicContact CD2-CG2 3.96Å; L115-T117 HydrophobicContact CG-CG2 3.9Å; L115-C138 HydrophobicContact CD1-CB 3.96Å; L115-L140 HydrophobicContact CB-CD1 4.23Å; L115-L140 HydrophobicContact CD1-CB 4.39Å; L115-L140 HydrophobicContact CD1-CD1 4.26Å; L115-V169 WeakPolarHBondContact O-CA 3.48Å; L115-T170 PolarHBondContact N-O 2.85Å; L115-T170 PolarHBondContact O-N 3.45Å
116	V	90.6	Very high	80.8	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.012	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	122	172.1	-172.3	0	0	0	0	108.4	V102 V114 F118 C138 R139 V167 N168 V169	V102-V116 HydrophobicContact CG1-CG1 4.27Å; V102-V116 HydrophobicContact CG1-CG2 4.28Å; V102-V116 HydrophobicContact CG2-CG1 4.33Å; V114-V116 HydrophobicContact CG1-CG2 4.13Å; V116-F118 HydrophobicContact CB-CE2 4.45Å; V116-F118 HydrophobicContact CB-CZ 4.4Å; V116-F118 HydrophobicContact CG1-CE1 3.99Å; V116-F118 HydrophobicContact CG1-CE2 3.84Å; V116-F118 HydrophobicContact CG1-CZ 3.44Å; V116-F118 VanDerWaalsContact CG1-CZ 3.44Å; V116-C138 CarbonylContact O-C 3.43Å; V116-C138 WeakPolarHBondContact O-CA 3.47Å; V116-R139 HydrophobicContact CB-CB 4.44Å; V116-R139 PolarHBondContact N-O 3.38Å; V116-R139 PolarHBondContact O-N 3.32Å; V116-V167 HydrophobicContact CG1-CG1 3.85Å; V116-N168 CarbonylContact C-O 3.59Å; V116-N168 WeakPolarHBondContact CA-O 3.21Å; V116-V169 HydrophobicContact CG1-CG2 4.44Å; V116-V169 HydrophobicContact CG2-CG2 4.39Å
117	T	89.2	Confident	80.3	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	146.3	175.9	64.1	0	0	0	0	110.9	F65 L115 P137 C138 V167 N168	F65-T117 HydrophobicContact CE1-CG2 4.26Å; L115-T117 HydrophobicContact CD1-CG2 4.4Å; L115-T117 HydrophobicContact CD2-CG2 3.96Å; L115-T117 HydrophobicContact CG-CG2 3.9Å; T117-P137 WeakPolarHBondContact CA-O 3.47Å; T117-C138 HydrophobicContact CG2-CB 3.95Å; T117-V167 WeakPolarHBondContact O-CA 3.05Å; T117-N168 PolarHBondContact N-O 2.92Å; T117-N168 PolarHBondContact O-N 3.17Å; T117-N168 WeakPolarHBondContact OG1-CB 3.31Å
118	F	89.8	Confident	80	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.009	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.4	-178.2	-54.1	-87.2	0	0	0	109.6	L100 V102 V116 F130 P137 R139 F157 I165 E166 V167	L100-F118 HydrophobicContact CD2-CD1 4.37Å; L100-F118 HydrophobicContact CD2-CE1 3.88Å; V102-F118 HydrophobicContact CG2-CE1 4.23Å; V102-F118 HydrophobicContact CG2-CZ 4.32Å; V116-F118 HydrophobicContact CB-CE2 4.45Å; V116-F118 HydrophobicContact CB-CZ 4.4Å; V116-F118 HydrophobicContact CG1-CE1 3.99Å; V116-F118 HydrophobicContact CG1-CE2 3.84Å; V116-F118 HydrophobicContact CG1-CZ 3.44Å; V116-F118 VanDerWaalsContact CG1-CZ 3.44Å; F118-F130 HydrophobicContact CB-CZ 4.3Å; F118-P137 HydrophobicContact CD2-CB 4.28Å; F118-P137 WeakPolarHBondContact CD2-O 3.47Å; F118-P137 PolarHBondContact N-O 2.78Å; F118-P137 WeakPolarHBondContact O-CD 3.45Å; F118-R139 HydrophobicContact CE2-CG 3.92Å; F118-F157 HydrophobicContact CB-CD2 4.02Å; F118-F157 HydrophobicContact CB-CE2 3.68Å; F118-F157 HydrophobicContact CB-CZ 4.1Å; F118-F157 HydrophobicContact CD1-CB 4.2Å; F118-F157 HydrophobicContact CD1-CD1 4.09Å; F118-F157 AromaticContact CD1-CD2 3.77Å; F118-F157 HydrophobicContact CD1-CD2 3.77Å; F118-F157 HydrophobicContact CD1-CE2 4.2Å; F118-F157 AromaticContact CD1-CG 3.71Å; F118-F157 HydrophobicContact CD1-CG 3.71Å; F118-F157 AromaticContact CD2-CD2 3.64Å; F118-F157 HydrophobicContact CD2-CD2 3.64Å; F118-F157 HydrophobicContact CD2-CE2 4.12Å; F118-F157 HydrophobicContact CD2-CG 4.3Å; F118-F157 HydrophobicContact CE1-CB 3.78Å; F118-F157 HydrophobicContact CE1-CD1 4.41Å; F118-F157 HydrophobicContact CE1-CD2 4.15Å; F118-F157 AromaticContact CE1-CG 3.83Å; F118-F157 HydrophobicContact CE1-CG 3.83Å; F118-F157 HydrophobicContact CE2-CB 4.31Å; F118-F157 HydrophobicContact CE2-CD2 4.03Å; F118-F157 HydrophobicContact CE2-CG 4.4Å; F118-F157 AromaticContact CG-CD2 3.5Å; F118-F157 HydrophobicContact CG-CD2 3.5Å; F118-F157 AromaticContact CG-CE2 3.73Å; F118-F157 HydrophobicContact CG-CE2 3.73Å; F118-F157 AromaticContact CG-CG 3.97Å; F118-F157 HydrophobicContact CG-CG 3.97Å; F118-F157 HydrophobicContact CG-CZ 4.37Å; F118-F157 HydrophobicContact CZ-CB 3.83Å; F118-F157 HydrophobicContact CZ-CD2 4.26Å; F118-F157 HydrophobicContact CZ-CG 4.17Å; F118-I165 HydrophobicContact CB-CG2 4.41Å; F118-E166 WeakPolarHBondContact CA-O 3.18Å; F118-V167 HydrophobicContact CD1-CG1 4.23Å; F118-V167 HydrophobicContact CD1-CG2 3.99Å; F118-V167 HydrophobicContact CE1-CG1 3.92Å; F118-V167 HydrophobicContact CE1-CG2 4.21Å
119	K	87.9	Confident	80.5	Confident	63 Å²	63	54.7 Å²	54.7	27%	0.274	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	123.7	175.8	177.2	-173.2	176.1	-171.3	0	109.1	I121 R136 I165 E166	K119-I121 PolarHBondContact O-N 3.38Å; K119-R136 HydrophobicContact CB-CG 4.45Å; K119-I165 CarbonylContact O-C 3.49Å; K119-I165 WeakPolarHBondContact O-CA 3.36Å; K119-E166 HydrophobicContact CB-CB 4.29Å; K119-E166 PolarHBondContact N-O 3.27Å; K119-E166 PolarHBondContact O-N 2.96Å
120	C	88.5	Confident	81.1	Confident	18 Å²	18	47.9 Å²	47.9	12%	0.122	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	127.1	167.5	-175.5	0	0	0	0	109.4	F130 C131	C120-F130 HydrophobicContact CB-CD1 3.73Å; C120-F130 HydrophobicContact CB-CE1 3.57Å; C120-F130 HydrophobicContact CB-CZ 4.38Å; C120-C131 HydrophobicContact CB-CB 3.71Å; C120-C131 WeakPolarHBondContact CB-SG 3.31Å; C120-C131 WeakPolarHBondContact SG-CB 3.35Å; C120-C131 CovalentContact SG-SG 2.03Å; C120-C131 PolarHBondContact SG-SG 2.98Å
121	I	87.3	Confident	81.5	Confident	72 Å²	72	45 Å²	45	37%	0.369	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-48.6	171.6	-62.4	-178.7	0	0	0	109.4	K119 L164 E166 L181	K119-I121 PolarHBondContact O-N 3.38Å; I121-L164 HydrophobicContact CB-CB 4.48Å; I121-L164 HydrophobicContact CB-CD2 4.07Å; I121-L164 HydrophobicContact CB-CG 4.2Å; I121-L164 HydrophobicContact CD1-CD2 4.03Å; I121-L164 HydrophobicContact CD1-CG 4.21Å; I121-L164 HydrophobicContact CG2-CD2 4.09Å; I121-L164 PolarHBondContact N-O 3.36Å; I121-E166 HydrophobicContact CD1-CB 4.08Å; I121-E166 HydrophobicContact CG1-CB 4.14Å; I121-L181 HydrophobicContact CD1-CD2 3.53Å
122	T	87.3	Confident	82.2	Confident	45 Å²	45	48.9 Å²	48.9	28%	0.276	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	151.2	-177.8	-171.2	0	0	0	0	111	Y124 S163 L164	T122-Y124 HydrophobicContact CG2-CD2 4.49Å; T122-Y124 HydrophobicContact CG2-CE1 3.98Å; T122-Y124 HydrophobicContact CG2-CE2 3.77Å; T122-Y124 VanDerWaalsContact CG2-CZ 3.46Å; T122-Y124 WeakPolarHBondContact CG2-OH 3.36Å; T122-S163 WeakPolarHBondContact O-CA 3.33Å; T122-L164 HydrophobicContact CG2-CB 3.9Å; T122-L164 HydrophobicContact CG2-CD2 4.27Å; T122-L164 PolarHBondContact O-N 2.95Å
123	S	84.8	Confident	82	Confident	32 Å²	32	53.6 Å²	53.6	22%	0.224	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	131.8	168.4	61.1	0	0	0	0	110.4	M126	S123-M126 WeakPolarHBondContact CB-O 3.41Å; S123-M126 PolarHBondContact OG-O 3.07Å
124	Y	80.8	Confident	81.1	Confident	74 Å²	74	59.3 Å²	59.3	29%	0.29	33%	0.327	S	S	.	.	S	Bend	trans	-97.2	121.7	179.5	-60.5	-72.3	0	0	0	110.5	T122 M126 N162 L164 N286 S288	T122-Y124 HydrophobicContact CG2-CD2 4.49Å; T122-Y124 HydrophobicContact CG2-CE1 3.98Å; T122-Y124 HydrophobicContact CG2-CE2 3.77Å; T122-Y124 VanDerWaalsContact CG2-CZ 3.46Å; T122-Y124 WeakPolarHBondContact CG2-OH 3.36Å; Y124-M126 VanDerWaalsContact C-N 3.31Å; Y124-M126 PolarHBondContact O-N 3.43Å; Y124-N162 WeakPolarHBondContact CD2-O 3.39Å; Y124-N162 PolarHBondContact N-O 3.32Å; Y124-N162 WeakPolarHBondContact O-CB 3.29Å; Y124-L164 HydrophobicContact CE2-CB 4.3Å; Y124-N286 WeakPolarHBondContact CE2-O 3.07Å; Y124-S288 PolarHBondContact OH-N 2.84Å; Y124-S288 PolarHBondContact OH-OG 3.45Å
125	G	69.8	Low	80.4	Confident	84 Å²	84	64.9 Å²	64.9	87%	0.866	35%	0.348	S	S	*	.	S	Bend	trans	84.8	-18	169.5	0	0	0	0	0	116.5
126	M	67.8	Low	79.9	Confident	125 Å²	125	66.1 Å²	66.1	62%	0.616	35%	0.353	S	S	*	.	S	Bend	trans	-137.9	140	177.3	-66.6	-90.8	-78.4	0	0	110.1	S123 Y124	S123-M126 WeakPolarHBondContact CB-O 3.41Å; S123-M126 PolarHBondContact OG-O 3.07Å; Y124-M126 VanDerWaalsContact C-N 3.31Å; Y124-M126 PolarHBondContact O-N 3.43Å
127	L	69	Low	79.7	Confident	153 Å²	153	66.8 Å²	66.8	80%	0.801	36%	0.357	S	S	*	.			trans	-65	137.3	164.3	-67.7	171.5	0	0	0	108.3
128	N	73.1	Confident	79.6	Confident	33 Å²	33	66.7 Å²	66.7	18%	0.176	36%	0.356	C	S	.	.			trans	-135	119.5	-177.4	176.9	7.3	0	0	0	108.6	F130 C131 E132 P160	N128-F130 PolarHBondContact O-N 3.04Å; N128-F130 VanDerWaalsContact O-N 3.11Å; N128-F130 WeakPolarHBondContact OD1-CB 3.41Å; N128-F130 PolarHBondContact OD1-N 3.32Å; N128-C131 HydrophobicContact CB-CB 4.36Å; N128-C131 PolarHBondContact ND2-SG 3.03Å; N128-C131 WeakPolarHBondContact O-CA 3.28Å; N128-C131 WeakPolarHBondContact O-CB 3.5Å; N128-C131 PolarHBondContact O-N 3.43Å; N128-E132 PolarHBondContact O-N 3.04Å; N128-P160 WeakPolarHBondContact ND2-CB 3.3Å; N128-P160 WeakPolarHBondContact ND2-CG 3.44Å
129	E	77.2	Confident	79.5	Confident	125 Å²	125	68 Å²	68	58%	0.584	36%	0.361	S	S	*	.	H	α-helix	trans	-53.5	-34.7	179.5	-65	-178.1	177	0	0	111.8	C131 E132 Q133	E129-C131 VanDerWaalsContact C-N 3.27Å; E129-C131 PolarHBondContact O-N 3.21Å; E129-E132 PolarHBondContact O-N 3Å; E129-Q133 VanDerWaalsContact O-CG 3.24Å; E129-Q133 WeakPolarHBondContact O-CG 3.49Å; E129-Q133 PolarHBondContact O-N 3.06Å
130	F	79.9	Confident	79.5	Confident	27 Å²	27	65.1 Å²	65.1	12%	0.118	35%	0.349	C	S	.	.	H	α-helix	trans	-61.6	-34.9	176.2	176.5	-115.2	0	0	0	112.9	F118 C120 N128 P137 F157 P160 I165	F118-F130 HydrophobicContact CB-CZ 4.3Å; C120-F130 HydrophobicContact CB-CD1 3.73Å; C120-F130 HydrophobicContact CB-CE1 3.57Å; C120-F130 HydrophobicContact CB-CZ 4.38Å; N128-F130 PolarHBondContact O-N 3.04Å; N128-F130 VanDerWaalsContact O-N 3.11Å; N128-F130 WeakPolarHBondContact OD1-CB 3.41Å; N128-F130 PolarHBondContact OD1-N 3.32Å; F130-P137 HydrophobicContact CD2-CG 4.25Å; F130-P137 VanDerWaalsContact CE2-CD 3.45Å; F130-P137 HydrophobicContact CE2-CG 3.44Å; F130-P137 VanDerWaalsContact CE2-CG 3.44Å; F130-P137 HydrophobicContact CZ-CG 4.23Å; F130-F157 HydrophobicContact CD1-CZ 4.21Å; F130-F157 HydrophobicContact CE1-CE1 4.44Å; F130-F157 HydrophobicContact CE1-CE2 4.48Å; F130-F157 AromaticContact CE1-CZ 3.61Å; F130-F157 HydrophobicContact CE1-CZ 3.61Å; F130-F157 HydrophobicContact CE2-CE2 4.22Å; F130-F157 HydrophobicContact CE2-CZ 4.08Å; F130-F157 AromaticContact CZ-CE2 3.99Å; F130-F157 HydrophobicContact CZ-CE2 3.99Å; F130-F157 AromaticContact CZ-CZ 3.56Å; F130-F157 HydrophobicContact CZ-CZ 3.56Å; F130-P160 HydrophobicContact CB-CG 4.23Å; F130-P160 HydrophobicContact CD1-CG 3.88Å; F130-P160 HydrophobicContact CG-CG 4.33Å; F130-I165 HydrophobicContact CE1-CD1 4.18Å; F130-I165 HydrophobicContact CE1-CG1 4.25Å
131	C	81.2	Confident	79.4	Confident	38 Å²	38	64.4 Å²	64.4	26%	0.257	34%	0.344	S	S	.	.	H	α-helix	trans	-81.6	-20.1	179.8	-58.5	0	0	0	0	113.2	C120 N128 E129	C120-C131 HydrophobicContact CB-CB 3.71Å; C120-C131 WeakPolarHBondContact CB-SG 3.31Å; C120-C131 WeakPolarHBondContact SG-CB 3.35Å; C120-C131 CovalentContact SG-SG 2.03Å; C120-C131 PolarHBondContact SG-SG 2.98Å; N128-C131 HydrophobicContact CB-CB 4.36Å; N128-C131 PolarHBondContact ND2-SG 3.03Å; N128-C131 WeakPolarHBondContact O-CA 3.28Å; N128-C131 WeakPolarHBondContact O-CB 3.5Å; N128-C131 PolarHBondContact O-N 3.43Å; E129-C131 VanDerWaalsContact C-N 3.27Å; E129-C131 PolarHBondContact O-N 3.21Å
132	E	79.5	Confident	79.4	Confident	128 Å²	128	64.7 Å²	64.7	60%	0.598	34%	0.342	S	S	*	.	H	α-helix	trans	-87.6	-18.8	174.2	-64.9	179.6	-178.6	0	0	112.3	N128 E129 P134	N128-E132 PolarHBondContact O-N 3.04Å; E129-E132 PolarHBondContact O-N 3Å; E132-P134 WeakPolarHBondContact O-CD 3.33Å
133	Q	73.5	Confident	79.2	Confident	102 Å²	102	63 Å²	63	48%	0.477	33%	0.331	S	S	.	.			trans	-70.5	124.3	178	-80.1	171.8	26.6	0	0	111	E129 R135	E129-Q133 VanDerWaalsContact O-CG 3.24Å; E129-Q133 WeakPolarHBondContact O-CG 3.49Å; E129-Q133 PolarHBondContact O-N 3.06Å; Q133-R135 PolarHBondContact O-N 3.33Å
134	P	68.5	Low	78.8	Confident	122 Å²	122	65.4 Å²	65.4	79%	0.792	34%	0.341	S	S	*	.	S	Bend	trans	-70.5	-18.8	175.6	28.4	-34.5	0	0	0	112.3	E132	E132-P134 WeakPolarHBondContact O-CD 3.33Å
135	R	73.2	Confident	78.1	Confident	116 Å²	116	63.8 Å²	63.8	44%	0.438	34%	0.343	S	S	.	.	S	Bend	trans	-83.9	129	-174.9	-168.7	-179	-169.9	167.1	11.4	110.8	T50 S51 E54 Q133 P137	T50-R135 HydrophobicContact CG2-CG 4.48Å; S51-R135 VanDerWaalsContact CA-NH2 3.3Å; E54-R135 VanDerWaalsContact CD-NH2 3.26Å; E54-R135 WeakPolarHBondContact OE1-CG 3.29Å; E54-R135 IonicContact OE1-CZ 3.33Å; E54-R135 IonicContact OE1-NE 3.54Å; E54-R135 PolarHBondContact OE1-NE 3.26Å; E54-R135 IonicContact OE1-NH2 3.53Å; E54-R135 PolarHBondContact OE1-NH2 3.23Å; E54-R135 IonicContact OE2-CZ 2.66Å; E54-R135 IonicContact OE2-NE 3.66Å; E54-R135 IonicContact OE2-NH2 2.74Å; E54-R135 PolarHBondContact OE2-NH2 3.49Å; Q133-R135 PolarHBondContact O-N 3.33Å; R135-P137 WeakPolarHBondContact O-CD 3.23Å
136	R	79.5	Confident	77.9	Confident	27 Å²	27	66.8 Å²	66.8	10%	0.102	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-85.8	119.1	174.7	-62.5	-176	-171.2	149.9	18.2	110.7	Q67 L69 K119 C138	Q67-R136 VanDerWaalsContact O-CZ 3.25Å; Q67-R136 PolarHBondContact O-NH1 2.99Å; Q67-R136 PolarHBondContact O-NH2 2.95Å; L69-R136 VanDerWaalsContact CG-NH1 3.28Å; K119-R136 HydrophobicContact CB-CG 4.45Å; R136-C138 PolarHBondContact O-N 2.78Å
137	P	85.6	Confident	77.5	Confident	15 Å²	15	64.2 Å²	64.2	10%	0.097	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-58.3	138.5	167.2	-24.1	35.9	0	0	0	109.9	T117 F118 F130 R135 F157	T117-P137 WeakPolarHBondContact CA-O 3.47Å; F118-P137 HydrophobicContact CD2-CB 4.28Å; F118-P137 WeakPolarHBondContact CD2-O 3.47Å; F118-P137 PolarHBondContact N-O 2.78Å; F118-P137 WeakPolarHBondContact O-CD 3.45Å; F130-P137 HydrophobicContact CD2-CG 4.25Å; F130-P137 VanDerWaalsContact CE2-CD 3.45Å; F130-P137 HydrophobicContact CE2-CG 3.44Å; F130-P137 VanDerWaalsContact CE2-CG 3.44Å; F130-P137 HydrophobicContact CZ-CG 4.23Å; R135-P137 WeakPolarHBondContact O-CD 3.23Å; P137-F157 HydrophobicContact CB-CE2 4.32Å; P137-F157 HydrophobicContact CG-CE2 4.24Å
138	C	87.7	Confident	76.8	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	154.2	174.8	76	0	0	0	0	111.4	C53 E54 F65 L115 V116 T117 R136	C53-C138 VanDerWaalsContact C-SG 3.55Å; C53-C138 HydrophobicContact CB-CB 4.34Å; C53-C138 WeakPolarHBondContact CB-SG 3.37Å; C53-C138 WeakPolarHBondContact SG-CB 3.4Å; C53-C138 CovalentContact SG-SG 2.04Å; C53-C138 PolarHBondContact SG-SG 3.37Å; E54-C138 PolarHBondContact N-SG 2.94Å; F65-C138 HydrophobicContact CE1-CB 4.15Å; L115-C138 HydrophobicContact CD1-CB 3.96Å; V116-C138 CarbonylContact O-C 3.43Å; V116-C138 WeakPolarHBondContact O-CA 3.47Å; T117-C138 HydrophobicContact CG2-CB 3.95Å; R136-C138 PolarHBondContact O-N 2.78Å
139	R	87.5	Confident	76.1	Confident	29 Å²	29	62.8 Å²	62.8	11%	0.109	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	130.7	173.3	-57.1	-67	179.2	-96.2	1.6	107.3	F46 S48 T50 C53 V116 F118 V154 C156	F46-R139 HydrophobicContact CE2-CB 4.25Å; S48-R139 VanDerWaalsContact O-CD 3.31Å; S48-R139 WeakPolarHBondContact O-CD 3.36Å; S48-R139 PolarHBondContact O-NE 2.77Å; S48-R139 PolarHBondContact O-NH1 3.4Å; T50-R139 PolarHBondContact OG1-NH1 3.25Å; C53-R139 PolarHBondContact SG-N 2.89Å; V116-R139 HydrophobicContact CB-CB 4.44Å; V116-R139 PolarHBondContact N-O 3.38Å; V116-R139 PolarHBondContact O-N 3.32Å; F118-R139 HydrophobicContact CE2-CG 3.92Å; R139-V154 HydrophobicContact CB-CG1 4.2Å; R139-V154 HydrophobicContact CG-CG1 4.21Å; R139-C156 HydrophobicContact CG-CB 4.44Å; R139-C156 PolarHBondContact NH2-O 3.04Å
140	L	87.8	Confident	75.4	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	133.5	-179.2	-179.8	70.3	0	0	0	109.3	F46 V47 E56 L60 F61 A113 V114 L115	F46-L140 WeakPolarHBondContact CD2-O 3.38Å; V47-L140 HydrophobicContact CB-CB 4.21Å; V47-L140 PolarHBondContact N-O 3.41Å; V47-L140 PolarHBondContact O-N 3.25Å; V47-L140 VanDerWaalsContact O-N 3.16Å; E56-L140 HydrophobicContact CB-CD2 3.65Å; L60-L140 HydrophobicContact CD1-CD2 4.43Å; F61-L140 HydrophobicContact CE2-CD1 3.94Å; A113-L140 HydrophobicContact CB-CD1 4.19Å; V114-L140 WeakPolarHBondContact O-CA 3.39Å; L115-L140 HydrophobicContact CB-CD1 4.23Å; L115-L140 HydrophobicContact CD1-CB 4.39Å; L115-L140 HydrophobicContact CD1-CD1 4.26Å
141	I	87.2	Confident	74.5	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.021	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.7	165.5	-61.8	158.8	0	0	0	107	C44 I45 F46 A113 V114 W143 S152 V154	C44-I141 HydrophobicContact CB-CG2 4.24Å; I45-I141 WeakPolarHBondContact O-CA 3.5Å; F46-I141 HydrophobicContact CD2-CG1 3.65Å; F46-I141 HydrophobicContact CE2-CG1 4.21Å; A113-I141 CarbonylContact C-O 3.58Å; A113-I141 WeakPolarHBondContact CA-O 3.37Å; V114-I141 PolarHBondContact N-O 3.07Å; V114-I141 PolarHBondContact O-N 3.13Å; I141-W143 HydrophobicContact CB-CH2 4.41Å; I141-W143 HydrophobicContact CG2-CD2 4.05Å; I141-W143 HydrophobicContact CG2-CE3 4.3Å; I141-W143 HydrophobicContact CG2-CH2 3.93Å; I141-W143 HydrophobicContact CG2-CZ2 3.69Å; I141-W143 HydrophobicContact CG2-CZ3 4.23Å; I141-S152 WeakPolarHBondContact CD1-OG 3.07Å; I141-V154 HydrophobicContact CD1-CG2 3.18Å; I141-V154 HydrophobicContact CG1-CG2 3.96Å
142	K	86.1	Confident	73.7	Confident	77 Å²	77	59.5 Å²	59.5	34%	0.335	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	119.2	176.3	176.2	-179.5	178.6	178.6	0	109	C44 I45 A113	C44-K142 CarbonylContact C-O 3.45Å; C44-K142 WeakPolarHBondContact CA-O 3.44Å; C44-K142 WeakPolarHBondContact CB-O 3.49Å; I45-K142 HydrophobicContact CB-CB 4.46Å; I45-K142 PolarHBondContact N-O 2.97Å; I45-K142 PolarHBondContact O-N 3.18Å; A113-K142 HydrophobicContact CB-CB 4.21Å; A113-K142 HydrophobicContact CB-CG 4.37Å
143	W	83.8	Confident	72.8	Confident	10 Å²	10	54.6 Å²	54.6	4%	0.038	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	136.7	177.5	-67.3	-88.9	0	0	0	111.2	C44 V106 T112 V114 I141 M150 S152	C44-W143 HydrophobicContact CB-CB 4.43Å; C44-W143 HydrophobicContact CB-CG 3.99Å; V106-W143 HydrophobicContact CG2-CH2 3.98Å; V106-W143 HydrophobicContact CG2-CZ3 4.3Å; T112-W143 VanDerWaalsContact O-CE3 3.31Å; T112-W143 PolarHBondContact O-N 3.31Å; V114-W143 HydrophobicContact CB-CH2 4.04Å; V114-W143 HydrophobicContact CB-CZ3 3.95Å; V114-W143 HydrophobicContact CG2-CH2 3.74Å; V114-W143 HydrophobicContact CG2-CZ3 3.57Å; I141-W143 HydrophobicContact CB-CH2 4.41Å; I141-W143 HydrophobicContact CG2-CD2 4.05Å; I141-W143 HydrophobicContact CG2-CE3 4.3Å; I141-W143 HydrophobicContact CG2-CH2 3.93Å; I141-W143 HydrophobicContact CG2-CZ2 3.69Å; I141-W143 HydrophobicContact CG2-CZ3 4.23Å; W143-M150 HydrophobicContact CB-CE 4.04Å; W143-M150 HydrophobicContact CB-SD 3.6Å; W143-M150 VanDerWaalsContact CD1-SD 3.57Å; W143-M150 HydrophobicContact CD2-CB 4.27Å; W143-M150 HydrophobicContact CD2-CG 4.37Å; W143-M150 HydrophobicContact CD2-SD 3.37Å; W143-M150 HydrophobicContact CE3-SD 3.85Å; W143-M150 HydrophobicContact CG-CE 4.25Å; W143-M150 HydrophobicContact CG-CG 4.3Å; W143-M150 HydrophobicContact CG-SD 3.23Å; W143-M150 HydrophobicContact CZ2-CB 3.86Å; W143-S152 VanDerWaalsContact CZ2-OG 3.31Å; W143-S152 WeakPolarHBondContact CZ2-OG 3.2Å
144	N	75.4	Confident	72.5	Confident	82 Å²	82	49.9 Å²	49.9	44%	0.439	27%	0.273	S	S	.	.			trans	-91.2	-20.5	-178.6	-67.7	-25.5	0	0	0	112.5	E43	E43-N144 PolarHBondContact O-N 2.92Å
145	A	67.3	Low	72.4	Confident	40 Å²	40	45.3 Å²	45.3	33%	0.331	24%	0.241	S	C	.	.	S	Bend	trans	-119.4	149.5	-174.9	0	0	0	0	0	111.8	M147 M150	A145-M147 PolarHBondContact O-N 2.93Å; A145-M150 WeakPolarHBondContact O-CE 3.45Å
146	K	63.9	Low	72.1	Confident	148 Å²	148	40 Å²	40	64%	0.643	22%	0.221	S	C	*	.			trans	-71.7	117.8	166.7	-68.8	-175.5	177.4	-166.5	0	108.6	Q109	Q109-K146 WeakPolarHBondContact O-CD 3.42Å; Q109-K146 WeakPolarHBondContact O-CG 3.33Å
147	M	59.7	Low	72.2	Confident	70 Å²	70	39.3 Å²	39.3	35%	0.345	22%	0.219	S	C	.	.			trans	-129.2	146.6	172.3	-63.4	-174.6	174.8	0	0	108.7	E43 A145 S149 M150	E43-M147 HydrophobicContact CB-CE 4.11Å; E43-M147 HydrophobicContact CG-CE 3.7Å; A145-M147 PolarHBondContact O-N 2.93Å; M147-S149 VanDerWaalsContact C-N 3.31Å; M147-S149 PolarHBondContact O-N 2.97Å; M147-M150 HydrophobicContact CB-CE 3.72Å; M147-M150 HydrophobicContact CB-CG 3.95Å; M147-M150 HydrophobicContact CG-CE 4.28Å; M147-M150 VanDerWaalsContact N-CE 3.3Å
148	A	54.8	Low	72.1	Confident	81 Å²	81	42 Å²	42	67%	0.669	23%	0.231	S	C	*	.	S	Bend	trans	-65.3	-32.5	-178.3	0	0	0	0	0	113.1	D107	D107-A148 VanDerWaalsContact OD1-O 3.11Å
149	S	58	Low	72.1	Confident	75 Å²	75	42.2 Å²	42.2	52%	0.524	23%	0.231	S	C	.	.			trans	-148.8	130.4	176.3	63.1	0	0	0	0	109.7	V106 M147	V106-S149 WeakPolarHBondContact O-CA 3.4Å; M147-S149 VanDerWaalsContact C-N 3.31Å; M147-S149 PolarHBondContact O-N 2.97Å
150	M	62.3	Low	72	Confident	6 Å²	6	41.2 Å²	41.2	3%	0.03	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	109.6	-176.9	-61.8	173.4	-172.4	0	0	109.4	L105 V106 W143 A145 M147	L105-M150 WeakPolarHBondContact CA-O 3.44Å; V106-M150 PolarHBondContact N-O 3.01Å; V106-M150 PolarHBondContact O-N 3.06Å; W143-M150 HydrophobicContact CB-CE 4.04Å; W143-M150 HydrophobicContact CB-SD 3.6Å; W143-M150 VanDerWaalsContact CD1-SD 3.57Å; W143-M150 HydrophobicContact CD2-CB 4.27Å; W143-M150 HydrophobicContact CD2-CG 4.37Å; W143-M150 HydrophobicContact CD2-SD 3.37Å; W143-M150 HydrophobicContact CE3-SD 3.85Å; W143-M150 HydrophobicContact CG-CE 4.25Å; W143-M150 HydrophobicContact CG-CG 4.3Å; W143-M150 HydrophobicContact CG-SD 3.23Å; W143-M150 HydrophobicContact CZ2-CB 3.86Å; A145-M150 WeakPolarHBondContact O-CE 3.45Å; M147-M150 HydrophobicContact CB-CE 3.72Å; M147-M150 HydrophobicContact CB-CG 3.95Å; M147-M150 HydrophobicContact CG-CE 4.28Å; M147-M150 VanDerWaalsContact N-CE 3.3Å
151	L	63	Low	71.8	Confident	112 Å²	112	43.5 Å²	43.5	59%	0.586	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	115.5	170.6	-178	71	0	0	0	109.3	S38 T104 L105	S38-L151 PolarHBondContact OG-O 3.28Å; T104-L151 WeakPolarHBondContact O-CA 3.46Å; L105-L151 HydrophobicContact CB-CD1 4.33Å; L105-L151 HydrophobicContact CD1-CB 4.25Å; L105-L151 HydrophobicContact CD1-CD1 4.39Å
152	S	62.7	Low	71.8	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.021	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.9	171.7	52	0	0	0	0	110.4	S103 T104 I141 W143	S103-S152 CarbonylContact C-O 3.42Å; S103-S152 VanDerWaalsContact CA-O 3.24Å; S103-S152 WeakPolarHBondContact CA-O 3.33Å; T104-S152 PolarHBondContact N-O 3.25Å; T104-S152 PolarHBondContact O-N 2.94Å; T104-S152 PolarHBondContact OG1-OG 3.25Å; I141-S152 WeakPolarHBondContact CD1-OG 3.07Å; W143-S152 VanDerWaalsContact CZ2-OG 3.31Å; W143-S152 WeakPolarHBondContact CZ2-OG 3.2Å
153	S	61.8	Low	71.9	Confident	26 Å²	26	40.9 Å²	40.9	18%	0.182	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125	167	-171.8	0	0	0	0	109.9	H37 S38 S103	H37-S153 WeakPolarHBondContact CA-O 3.26Å; S38-S153 PolarHBondContact OG-N 3.02Å; S103-S153 PolarHBondContact OG-OG 2.8Å
154	V	67.1	Low	72.2	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.012	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	104	171.8	179.6	0	0	0	0	108.3	F46 N101 V102 R139 I141 C156	F46-V154 HydrophobicContact CE2-CG1 3.85Å; F46-V154 HydrophobicContact CE2-CG2 3.93Å; F46-V154 HydrophobicContact CZ-CG1 3.87Å; N101-V154 WeakPolarHBondContact CA-O 3.24Å; V102-V154 PolarHBondContact N-O 2.87Å; V102-V154 PolarHBondContact O-N 3.44Å; R139-V154 HydrophobicContact CB-CG1 4.2Å; R139-V154 HydrophobicContact CG-CG1 4.21Å; I141-V154 HydrophobicContact CD1-CG2 3.18Å; I141-V154 HydrophobicContact CG1-CG2 3.96Å; V154-C156 HydrophobicContact CG1-CB 3.71Å; V154-C156 PolarHBondContact O-N 3.17Å
155	E	65.6	Low	73	Confident	26 Å²	26	36.5 Å²	36.5	12%	0.121	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	74.9	174.1	-59.2	-158	128.8	0	0	110.5	C35 R36 R87 M99 N101	C35-E155 VanDerWaalsContact CA-O 3.32Å; C35-E155 WeakPolarHBondContact CA-O 3.47Å; R36-E155 HydrophobicContact CB-CB 4.24Å; R36-E155 HydrophobicContact CB-CG 4.18Å; R36-E155 WeakPolarHBondContact CB-OE2 3.49Å; R36-E155 VanDerWaalsContact CD-OE2 3.3Å; R36-E155 WeakPolarHBondContact CD-OE2 3.48Å; R36-E155 WeakPolarHBondContact CG-OE2 3.15Å; R36-E155 PolarHBondContact O-N 2.84Å; R87-E155 IonicContact NH1-OE1 3.8Å; R87-E155 PolarHBondContact NH1-OE1 2.75Å; R87-E155 IonicContact NH1-OE2 3.71Å; R87-E155 PolarHBondContact NH1-OE2 3.45Å; M99-E155 HydrophobicContact SD-CB 4.21Å; N101-E155 PolarHBondContact ND2-OE1 2.84Å; N101-E155 WeakPolarHBondContact OD1-CA 3.19Å; N101-E155 WeakPolarHBondContact OD1-CB 3.2Å; N101-E155 WeakPolarHBondContact OD1-CG 3.48Å
156	C	66.5	Low	74.1	Confident	5 Å²	5	35.8 Å²	35.8	3%	0.034	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	13.2	-163.9	-77	0	0	0	0	119.2	C35 F46 R139 V154	C35-C156 WeakPolarHBondContact CA-SG 3.34Å; C35-C156 HydrophobicContact CB-CB 4.35Å; C35-C156 WeakPolarHBondContact CB-SG 3.17Å; C35-C156 VanDerWaalsContact SG-CA 3.57Å; C35-C156 WeakPolarHBondContact SG-CB 3.42Å; C35-C156 CovalentContact SG-SG 2.03Å; C35-C156 PolarHBondContact SG-SG 3.32Å; F46-C156 HydrophobicContact CZ-CB 4.48Å; F46-C156 VanDerWaalsContact CZ-SG 3.56Å; R139-C156 HydrophobicContact CG-CB 4.44Å; R139-C156 PolarHBondContact NH2-O 3.04Å; V154-C156 HydrophobicContact CG1-CB 3.71Å; V154-C156 PolarHBondContact O-N 3.17Å
157	F	82.6	Confident	75.5	Confident	12 Å²	12	28.8 Å²	28.8	5%	0.053	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	113.9	178.9	-168.2	-92	0	0	0	112.5	M99 L100 F118 F130 P137 M159 I165	M99-F157 CarbonylContact C-O 3.53Å; M99-F157 WeakPolarHBondContact CA-O 3.47Å; L100-F157 HydrophobicContact CB-CB 4.3Å; L100-F157 HydrophobicContact CB-CD1 4.47Å; L100-F157 PolarHBondContact N-O 3.31Å; F118-F157 HydrophobicContact CB-CD2 4.02Å; F118-F157 HydrophobicContact CB-CE2 3.68Å; F118-F157 HydrophobicContact CB-CZ 4.1Å; F118-F157 HydrophobicContact CD1-CB 4.2Å; F118-F157 HydrophobicContact CD1-CD1 4.09Å; F118-F157 AromaticContact CD1-CD2 3.77Å; F118-F157 HydrophobicContact CD1-CD2 3.77Å; F118-F157 HydrophobicContact CD1-CE2 4.2Å; F118-F157 AromaticContact CD1-CG 3.71Å; F118-F157 HydrophobicContact CD1-CG 3.71Å; F118-F157 AromaticContact CD2-CD2 3.64Å; F118-F157 HydrophobicContact CD2-CD2 3.64Å; F118-F157 HydrophobicContact CD2-CE2 4.12Å; F118-F157 HydrophobicContact CD2-CG 4.3Å; F118-F157 HydrophobicContact CE1-CB 3.78Å; F118-F157 HydrophobicContact CE1-CD1 4.41Å; F118-F157 HydrophobicContact CE1-CD2 4.15Å; F118-F157 AromaticContact CE1-CG 3.83Å; F118-F157 HydrophobicContact CE1-CG 3.83Å; F118-F157 HydrophobicContact CE2-CB 4.31Å; F118-F157 HydrophobicContact CE2-CD2 4.03Å; F118-F157 HydrophobicContact CE2-CG 4.4Å; F118-F157 AromaticContact CG-CD2 3.5Å; F118-F157 HydrophobicContact CG-CD2 3.5Å; F118-F157 AromaticContact CG-CE2 3.73Å; F118-F157 HydrophobicContact CG-CE2 3.73Å; F118-F157 AromaticContact CG-CG 3.97Å; F118-F157 HydrophobicContact CG-CG 3.97Å; F118-F157 HydrophobicContact CG-CZ 4.37Å; F118-F157 HydrophobicContact CZ-CB 3.83Å; F118-F157 HydrophobicContact CZ-CD2 4.26Å; F118-F157 HydrophobicContact CZ-CG 4.17Å; F130-F157 HydrophobicContact CD1-CZ 4.21Å; F130-F157 HydrophobicContact CE1-CE1 4.44Å; F130-F157 HydrophobicContact CE1-CE2 4.48Å; F130-F157 AromaticContact CE1-CZ 3.61Å; F130-F157 HydrophobicContact CE1-CZ 3.61Å; F130-F157 HydrophobicContact CE2-CE2 4.22Å; F130-F157 HydrophobicContact CE2-CZ 4.08Å; F130-F157 AromaticContact CZ-CE2 3.99Å; F130-F157 HydrophobicContact CZ-CE2 3.99Å; F130-F157 AromaticContact CZ-CZ 3.56Å; F130-F157 HydrophobicContact CZ-CZ 3.56Å; P137-F157 HydrophobicContact CB-CE2 4.32Å; P137-F157 HydrophobicContact CG-CE2 4.24Å; F157-M159 HydrophobicContact CD1-CG 4.35Å; F157-M159 HydrophobicContact CD1-SD 3.78Å; F157-M159 HydrophobicContact CE1-SD 3.93Å; F157-M159 PolarHBondContact O-N 3.38Å; F157-I165 HydrophobicContact CD1-CD1 4.49Å; F157-I165 HydrophobicContact CE1-CD1 3.52Å; F157-I165 HydrophobicContact CZ-CD1 4.17Å
158	H	84.4	Confident	76.9	Confident	73 Å²	73	25.9 Å²	25.9	34%	0.338	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	112.5	171	172	-125.6	0	0	0	108.8	I31 F97 P160	I31-H158 HydrophobicContact CD1-CB 4.17Å; F97-H158 WeakPolarHBondContact CB-NE2 3.37Å; F97-H158 AromaticContact CD2-CD2 3.35Å; F97-H158 WeakPolarHBondContact CD2-CD2 3.41Å; F97-H158 AromaticContact CG-CD2 3.65Å; F97-H158 AromaticContact CG-NE2 3.87Å; H158-P160 VanDerWaalsContact O-CD 3.26Å; H158-P160 WeakPolarHBondContact O-CD 3.49Å
159	M	85.8	Confident	78.6	Confident	3 Å²	3	22 Å²	22	2%	0.015	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	116.8	178.1	-73	-68.1	-65.7	0	0	109.4	V98 L100 F157 I165 V182	V98-M159 HydrophobicContact CB-CB 4.21Å; V98-M159 HydrophobicContact CG1-CB 4.28Å; V98-M159 HydrophobicContact CG1-CG 4.44Å; V98-M159 WeakPolarHBondContact O-CB 3.19Å; V98-M159 PolarHBondContact O-N 2.82Å; L100-M159 HydrophobicContact CB-CG 3.61Å; L100-M159 HydrophobicContact CB-SD 3.81Å; L100-M159 HydrophobicContact CD2-SD 3.95Å; L100-M159 HydrophobicContact CG-SD 4.39Å; F157-M159 HydrophobicContact CD1-CG 4.35Å; F157-M159 HydrophobicContact CD1-SD 3.78Å; F157-M159 HydrophobicContact CE1-SD 3.93Å; F157-M159 PolarHBondContact O-N 3.38Å; M159-I165 HydrophobicContact CE-CB 4.36Å; M159-I165 HydrophobicContact CE-CD1 3.5Å; M159-I165 HydrophobicContact CE-CG1 4.23Å; M159-I165 HydrophobicContact SD-CD1 3.44Å; M159-I165 WeakPolarHBondContact SD-CD1 3.42Å; M159-V182 HydrophobicContact CE-CB 4.32Å; M159-V182 HydrophobicContact CE-CG2 3.77Å; M159-V182 HydrophobicContact SD-CG2 4.2Å
160	P	86	Confident	80.1	Confident	9 Å²	9	18.5 Å²	18.5	6%	0.058	10%	0.099	C	C	.	.	P	Polyproline II helix	trans	-65.5	136.8	168.5	-13.9	29.3	0	0	0	110.1	N128 F130 H158 S163 I165	N128-P160 WeakPolarHBondContact ND2-CB 3.3Å; N128-P160 WeakPolarHBondContact ND2-CG 3.44Å; F130-P160 HydrophobicContact CB-CG 4.23Å; F130-P160 HydrophobicContact CD1-CG 3.88Å; F130-P160 HydrophobicContact CG-CG 4.33Å; H158-P160 VanDerWaalsContact O-CD 3.26Å; H158-P160 WeakPolarHBondContact O-CD 3.49Å; P160-S163 WeakPolarHBondContact CB-OG 3.29Å; P160-S163 PolarHBondContact O-N 2.93Å; P160-S163 PolarHBondContact O-OG 3.34Å; P160-I165 HydrophobicContact CG-CD1 4.48Å
161	P	84.1	Confident	81.3	Confident	50 Å²	50	18.3 Å²	18.3	33%	0.325	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	142.5	-177.6	28	-34.4	0	0	0	110.6	S163 Y186	P161-S163 PolarHBondContact O-N 2.97Å; P161-S163 VanDerWaalsContact O-N 3.1Å; P161-Y186 HydrophobicContact CB-CD1 3.43Å; P161-Y186 VanDerWaalsContact CB-CD1 3.43Å; P161-Y186 HydrophobicContact CB-CD2 4.33Å; P161-Y186 HydrophobicContact CB-CE1 3.54Å; P161-Y186 HydrophobicContact CB-CE2 4.43Å; P161-Y186 HydrophobicContact CB-CG 3.85Å; P161-Y186 HydrophobicContact CG-CD1 3.73Å; P161-Y186 HydrophobicContact CG-CE1 3.43Å; P161-Y186 VanDerWaalsContact CG-CE1 3.43Å
162	N	86.4	Confident	82.2	Confident	25 Å²	25	14.3 Å²	14.3	13%	0.134	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	26.9	178.8	-54.8	-43.5	0	0	0	114.3	Y124 S184 Y186	Y124-N162 WeakPolarHBondContact CD2-O 3.39Å; Y124-N162 PolarHBondContact N-O 3.32Å; Y124-N162 WeakPolarHBondContact O-CB 3.29Å; N162-S184 PolarHBondContact N-O 2.99Å; N162-Y186 WeakPolarHBondContact ND2-CE2 3.42Å
163	S	88.8	Confident	82.8	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	139	171.3	67.9	0	0	0	0	111.1	T122 P160 P161 I165	T122-S163 WeakPolarHBondContact O-CA 3.33Å; P160-S163 WeakPolarHBondContact CB-OG 3.29Å; P160-S163 PolarHBondContact O-N 2.93Å; P160-S163 PolarHBondContact O-OG 3.34Å; P161-S163 PolarHBondContact O-N 2.97Å; P161-S163 VanDerWaalsContact O-N 3.1Å; S163-I165 WeakPolarHBondContact OG-CD1 3.19Å
164	L	90.8	Very high	83.7	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.8	170.7	179.4	65.7	0	0	0	108.6	I121 T122 Y124 L181 Q183 F287 S288	I121-L164 HydrophobicContact CB-CB 4.48Å; I121-L164 HydrophobicContact CB-CD2 4.07Å; I121-L164 HydrophobicContact CB-CG 4.2Å; I121-L164 HydrophobicContact CD1-CD2 4.03Å; I121-L164 HydrophobicContact CD1-CG 4.21Å; I121-L164 HydrophobicContact CG2-CD2 4.09Å; I121-L164 PolarHBondContact N-O 3.36Å; T122-L164 HydrophobicContact CG2-CB 3.9Å; T122-L164 HydrophobicContact CG2-CD2 4.27Å; T122-L164 PolarHBondContact O-N 2.95Å; Y124-L164 HydrophobicContact CE2-CB 4.3Å; L164-L181 HydrophobicContact CD1-CB 4.22Å; L164-Q183 HydrophobicContact CD1-CB 4.42Å; L164-F287 HydrophobicContact CD1-CD1 3.62Å; L164-F287 HydrophobicContact CD1-CE1 4.16Å; L164-S288 VanDerWaalsContact CD2-O 3.24Å; L164-S288 WeakPolarHBondContact CD2-O 3.5Å; L164-S288 VanDerWaalsContact CD2-OG 3.27Å; L164-S288 WeakPolarHBondContact CD2-OG 3.28Å
165	I	91	Very high	84.4	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.5	-175.4	-60.4	170.6	0	0	0	109.4	F118 K119 F130 F157 M159 P160 S163 V167 L181 V182	F118-I165 HydrophobicContact CB-CG2 4.41Å; K119-I165 CarbonylContact O-C 3.49Å; K119-I165 WeakPolarHBondContact O-CA 3.36Å; F130-I165 HydrophobicContact CE1-CD1 4.18Å; F130-I165 HydrophobicContact CE1-CG1 4.25Å; F157-I165 HydrophobicContact CD1-CD1 4.49Å; F157-I165 HydrophobicContact CE1-CD1 3.52Å; F157-I165 HydrophobicContact CZ-CD1 4.17Å; M159-I165 HydrophobicContact CE-CB 4.36Å; M159-I165 HydrophobicContact CE-CD1 3.5Å; M159-I165 HydrophobicContact CE-CG1 4.23Å; M159-I165 HydrophobicContact SD-CD1 3.44Å; M159-I165 WeakPolarHBondContact SD-CD1 3.42Å; P160-I165 HydrophobicContact CG-CD1 4.48Å; S163-I165 WeakPolarHBondContact OG-CD1 3.19Å; I165-V167 HydrophobicContact CG2-CG2 4.23Å; I165-L181 WeakPolarHBondContact O-CA 3.34Å; I165-V182 HydrophobicContact CB-CG2 4.01Å; I165-V182 HydrophobicContact CG2-CG2 4.47Å; I165-V182 PolarHBondContact N-O 3.28Å; I165-V182 WeakPolarHBondContact O-CG2 3.33Å; I165-V182 PolarHBondContact O-N 2.91Å
166	E	91.1	Very high	85.4	Confident	26 Å²	26	24.5 Å²	24.5	12%	0.121	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	126.2	167.8	-172.9	-176	167.4	0	0	109.2	F118 K119 I121 N168 R179 Y180 L181	F118-E166 WeakPolarHBondContact CA-O 3.18Å; K119-E166 HydrophobicContact CB-CB 4.29Å; K119-E166 PolarHBondContact N-O 3.27Å; K119-E166 PolarHBondContact O-N 2.96Å; I121-E166 HydrophobicContact CD1-CB 4.08Å; I121-E166 HydrophobicContact CG1-CB 4.14Å; E166-N168 PolarHBondContact OE1-ND2 2.93Å; E166-N168 PolarHBondContact OE1-OD1 3.48Å; E166-R179 HydrophobicContact CG-CG 4.06Å; E166-R179 WeakPolarHBondContact OE1-CD 3.17Å; E166-Y180 CarbonylContact C-O 3.59Å; E166-Y180 WeakPolarHBondContact CA-O 3.2Å; E166-L181 HydrophobicContact CB-CD2 3.91Å; E166-L181 HydrophobicContact CG-CD2 4.02Å
167	V	92	Very high	86.4	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	114.5	177.8	-173.9	0	0	0	0	107.8	L84 L100 V102 V116 T117 F118 I165 V169 Y180 V182	L84-V167 HydrophobicContact CD2-CB 3.94Å; L84-V167 HydrophobicContact CD2-CG1 3.95Å; L84-V167 HydrophobicContact CD2-CG2 4Å; L100-V167 HydrophobicContact CD2-CG2 3.79Å; V102-V167 HydrophobicContact CG2-CG1 4.31Å; V116-V167 HydrophobicContact CG1-CG1 3.85Å; T117-V167 WeakPolarHBondContact O-CA 3.05Å; F118-V167 HydrophobicContact CD1-CG1 4.23Å; F118-V167 HydrophobicContact CD1-CG2 3.99Å; F118-V167 HydrophobicContact CE1-CG1 3.92Å; F118-V167 HydrophobicContact CE1-CG2 4.21Å; I165-V167 HydrophobicContact CG2-CG2 4.23Å; V167-V169 HydrophobicContact CG1-CG2 4.48Å; V167-Y180 PolarHBondContact N-O 3.3Å; V167-Y180 PolarHBondContact O-N 3.09Å; V167-V182 HydrophobicContact CG2-CG2 3.72Å
168	N	90	Very high	86.7	Confident	10 Å²	10	25.1 Å²	25.1	5%	0.053	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	122.6	178.6	-67.6	-32.7	0	0	0	109.5	L69 V116 T117 E166 T177 L178 R179	L69-N168 HydrophobicContact CD1-CB 4.33Å; V116-N168 CarbonylContact C-O 3.59Å; V116-N168 WeakPolarHBondContact CA-O 3.21Å; T117-N168 PolarHBondContact N-O 2.92Å; T117-N168 PolarHBondContact O-N 3.17Å; T117-N168 WeakPolarHBondContact OG1-CB 3.31Å; E166-N168 PolarHBondContact OE1-ND2 2.93Å; E166-N168 PolarHBondContact OE1-OD1 3.48Å; N168-T177 HydrophobicContact CB-CG2 3.98Å; N168-L178 CarbonylContact C-O 3.52Å; N168-L178 WeakPolarHBondContact CA-O 3.37Å; N168-R179 WeakPolarHBondContact OD1-CA 3.49Å; N168-R179 WeakPolarHBondContact OD1-CB 3.39Å; N168-R179 VanDerWaalsContact OD1-CG 3.27Å; N168-R179 WeakPolarHBondContact OD1-CG 3.36Å
169	V	90.6	Very high	87	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	106.4	178.1	-177.5	0	0	0	0	107.8	I80 A82 V102 T104 V114 L115 V116 V167 T177 L178	I80-V169 HydrophobicContact CD1-CG1 3.94Å; A82-V169 HydrophobicContact CB-CG2 4.31Å; V102-V169 HydrophobicContact CG1-CG2 4.16Å; T104-V169 HydrophobicContact CG2-CG1 3.71Å; V114-V169 HydrophobicContact CG1-CG1 3.78Å; L115-V169 WeakPolarHBondContact O-CA 3.48Å; V116-V169 HydrophobicContact CG1-CG2 4.44Å; V116-V169 HydrophobicContact CG2-CG2 4.39Å; V167-V169 HydrophobicContact CG1-CG2 4.48Å; V169-T177 CarbonylContact O-C 3.55Å; V169-T177 WeakPolarHBondContact O-CA 3.39Å; V169-L178 HydrophobicContact CB-CB 4.36Å; V169-L178 PolarHBondContact N-O 3.34Å; V169-L178 PolarHBondContact O-N 3.35Å
170	T	89	Confident	87.3	Confident	1 Å²	1	25 Å²	25	1%	0.006	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	138.4	-178.4	-51.3	0	0	0	0	110.3	F61 F63 I72 V114 L115 C176 T177	F61-T170 HydrophobicContact CD1-CG2 3.64Å; F61-T170 HydrophobicContact CE1-CG2 3.6Å; F63-T170 HydrophobicContact CE2-CG2 4.01Å; F63-T170 HydrophobicContact CZ-CG2 3.87Å; I72-T170 HydrophobicContact CD1-CG2 4.25Å; V114-T170 CarbonylContact C-O 3.57Å; V114-T170 WeakPolarHBondContact CA-O 3.46Å; L115-T170 PolarHBondContact N-O 2.85Å; L115-T170 PolarHBondContact O-N 3.45Å; T170-C176 WeakPolarHBondContact CA-O 3.37Å; T170-T177 WeakPolarHBondContact CG2-OG1 3.4Å; T170-T177 WeakPolarHBondContact OG1-CG2 3.43Å; T170-T177 PolarHBondContact OG1-OG1 3.24Å
171	V	87.5	Confident	87.7	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.006	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.4	-179.1	-167.2	0	0	0	0	110.9	I80 V106 L108 V114 A174 N175 C176	I80-V171 HydrophobicContact CB-CG2 4.35Å; I80-V171 HydrophobicContact CD1-CG2 3.27Å; I80-V171 HydrophobicContact CG1-CG2 4.37Å; I80-V171 HydrophobicContact CG2-CG2 4.22Å; V106-V171 HydrophobicContact CG1-CG1 4.43Å; L108-V171 HydrophobicContact CD1-CG1 3.75Å; V114-V171 HydrophobicContact CG2-CG1 4.32Å; V114-V171 HydrophobicContact CG2-CG2 4.24Å; V171-A174 HydrophobicContact CB-CB 4.32Å; V171-A174 HydrophobicContact CG1-CB 4.36Å; V171-N175 PolarHBondContact O-N 3.24Å; V171-C176 PolarHBondContact N-O 2.9Å
172	H	81.9	Confident	88.1	Confident	28 Å²	28	22.5 Å²	22.5	13%	0.13	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	146.7	176	179.6	-99.8	0	0	0	111.3	L60 F61 T112 A113 A174	L60-H172 PolarHBondContact O-CD2 3.42Å; L60-H172 PolarHBondContact O-NE2 2.93Å; F61-H172 HydrophobicContact CE1-CB 3.72Å; F61-H172 HydrophobicContact CE2-CB 4.32Å; F61-H172 HydrophobicContact CZ-CB 3.61Å; T112-H172 WeakPolarHBondContact CG2-O 3.41Å; A113-H172 HydrophobicContact CB-CB 3.81Å; A113-H172 WeakPolarHBondContact O-CB 3.29Å; A113-H172 PolarHBondContact O-N 2.81Å; H172-A174 PolarHBondContact O-N 3.49Å
173	F	75.7	Confident	88.4	Confident	121 Å²	121	21.5 Å²	21.5	53%	0.531	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	-43.3	-159.6	-69.3	-65.4	0	0	0	115.7	P111 N175	P111-F173 WeakPolarHBondContact O-CD2 3.31Å; P111-F173 VanDerWaalsContact O-CE2 3.29Å; P111-F173 WeakPolarHBondContact O-CE2 3.4Å; F173-N175 VanDerWaalsContact C-N 3.27Å; F173-N175 PolarHBondContact O-N 3.32Å
174	A	80.3	Confident	88.4	Confident	34 Å²	34	21.6 Å²	21.6	28%	0.281	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-17.7	179.3	0	0	0	0	0	113.8	L108 V171 H172 C176	L108-A174 HydrophobicContact CD1-CB 4.41Å; V171-A174 HydrophobicContact CB-CB 4.32Å; V171-A174 HydrophobicContact CG1-CB 4.36Å; H172-A174 PolarHBondContact O-N 3.49Å; A174-C176 PolarHBondContact O-N 2.87Å
175	N	81.9	Confident	88.3	Confident	109 Å²	109	21.6 Å²	21.6	58%	0.583	11%	0.109	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.8	50	-176.7	-77.5	-6	0	0	0	112.1	I72 V171 F173	I72-N175 WeakPolarHBondContact CG2-O 3.26Å; V171-N175 PolarHBondContact O-N 3.24Å; F173-N175 VanDerWaalsContact C-N 3.27Å; F173-N175 PolarHBondContact O-N 3.32Å
176	C	86.1	Confident	88.1	Confident	7 Å²	7	25.8 Å²	25.8	5%	0.047	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	152	-178.8	73.5	0	0	0	0	110.3	I72 A73 C75 T170 V171 A174	I72-C176 VanDerWaalsContact CG2-CA 3.41Å; A73-C176 WeakPolarHBondContact O-CA 3.44Å; C75-C176 VanDerWaalsContact CA-SG 3.56Å; C75-C176 HydrophobicContact CB-CB 3.77Å; C75-C176 WeakPolarHBondContact CB-SG 3.46Å; C75-C176 WeakPolarHBondContact SG-CB 3.37Å; C75-C176 PolarHBondContact SG-O 3.3Å; C75-C176 CovalentContact SG-SG 2.03Å; C75-C176 PolarHBondContact SG-SG 2.85Å; T170-C176 WeakPolarHBondContact CA-O 3.37Å; V171-C176 PolarHBondContact N-O 2.9Å; A174-C176 PolarHBondContact O-N 2.87Å
177	T	87.6	Confident	87.8	Confident	21 Å²	21	24.8 Å²	24.8	13%	0.129	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	128.9	-177.2	-59.2	0	0	0	0	111.7	I72 A73 P74 N168 V169 T170	I72-T177 WeakPolarHBondContact CB-OG1 3.34Å; A73-T177 PolarHBondContact O-N 2.99Å; P74-T177 WeakPolarHBondContact CA-O 3.46Å; N168-T177 HydrophobicContact CB-CG2 3.98Å; V169-T177 CarbonylContact O-C 3.55Å; V169-T177 WeakPolarHBondContact O-CA 3.39Å; T170-T177 WeakPolarHBondContact CG2-OG1 3.4Å; T170-T177 WeakPolarHBondContact OG1-CG2 3.43Å; T170-T177 PolarHBondContact OG1-OG1 3.24Å
178	L	90.3	Very high	87.5	Confident	9 Å²	9	27.8 Å²	27.8	5%	0.047	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	128.5	166.9	-61.3	174.6	0	0	0	109.9	C75 I80 A82 N168 V169 Y180 N208	C75-L178 HydrophobicContact CB-CD2 3.94Å; C75-L178 HydrophobicContact CB-CG 4.1Å; I80-L178 HydrophobicContact CD1-CD1 4.38Å; I80-L178 HydrophobicContact CG1-CD1 4.07Å; I80-L178 HydrophobicContact CG2-CD1 3.88Å; I80-L178 HydrophobicContact CG2-CG 4.33Å; A82-L178 HydrophobicContact CB-CD1 4.13Å; N168-L178 CarbonylContact C-O 3.52Å; N168-L178 WeakPolarHBondContact CA-O 3.37Å; V169-L178 HydrophobicContact CB-CB 4.36Å; V169-L178 PolarHBondContact N-O 3.34Å; V169-L178 PolarHBondContact O-N 3.35Å; L178-Y180 HydrophobicContact CB-CD2 4.49Å; L178-Y180 HydrophobicContact CB-CE2 3.68Å; L178-Y180 HydrophobicContact CD1-CE2 4.4Å; L178-N208 HydrophobicContact CD2-CB 4.11Å
179	R	90.1	Very high	87.3	Confident	62 Å²	62	28.3 Å²	28.3	23%	0.234	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.4	178.8	178.4	173.9	75.5	150	9.2	110.2	E166 N168 P207 N208	E166-R179 HydrophobicContact CG-CG 4.06Å; E166-R179 WeakPolarHBondContact OE1-CD 3.17Å; N168-R179 WeakPolarHBondContact OD1-CA 3.49Å; N168-R179 WeakPolarHBondContact OD1-CB 3.39Å; N168-R179 VanDerWaalsContact OD1-CG 3.27Å; N168-R179 WeakPolarHBondContact OD1-CG 3.36Å; R179-P207 VanDerWaalsContact O-CD 3.29Å; R179-P207 WeakPolarHBondContact O-CD 2.85Å; R179-N208 PolarHBondContact N-ND2 2.96Å; R179-N208 PolarHBondContact N-OD1 2.97Å; R179-N208 PolarHBondContact O-ND2 3.04Å; R179-N208 PolarHBondContact O-OD1 3.28Å
180	Y	92.7	Very high	87	Confident	12 Å²	12	28.7 Å²	28.7	5%	0.047	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	145.9	174.7	-63.4	-83.9	0	0	0	110.3	A82 L84 E166 V167 L178 L204 D206	A82-Y180 HydrophobicContact CB-CE2 3.67Å; L84-Y180 HydrophobicContact CD1-CD1 4.31Å; L84-Y180 HydrophobicContact CD1-CD2 3.7Å; L84-Y180 HydrophobicContact CD1-CE1 4.47Å; L84-Y180 HydrophobicContact CD1-CE2 3.9Å; L84-Y180 HydrophobicContact CD1-CG 3.92Å; L84-Y180 HydrophobicContact CD2-CD2 4.33Å; L84-Y180 HydrophobicContact CD2-CG 4.13Å; E166-Y180 CarbonylContact C-O 3.59Å; E166-Y180 WeakPolarHBondContact CA-O 3.2Å; V167-Y180 PolarHBondContact N-O 3.3Å; V167-Y180 PolarHBondContact O-N 3.09Å; L178-Y180 HydrophobicContact CB-CD2 4.49Å; L178-Y180 HydrophobicContact CB-CE2 3.68Å; L178-Y180 HydrophobicContact CD1-CE2 4.4Å; Y180-L204 HydrophobicContact CD1-CD1 3.81Å; Y180-L204 HydrophobicContact CG-CD1 4.17Å; Y180-D206 HydrophobicContact CD1-CB 3.98Å; Y180-D206 HydrophobicContact CE1-CB 3.82Å; Y180-D206 VanDerWaalsContact CE1-CG 3.47Å; Y180-D206 WeakPolarHBondContact CE1-OD2 2.8Å
181	L	93.2	Very high	86.4	Confident	6 Å²	6	33.7 Å²	33.7	3%	0.031	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	126.9	169.4	-57.2	175.9	0	0	0	108.8	I121 L164 I165 E166 V205 L289	I121-L181 HydrophobicContact CD1-CD2 3.53Å; L164-L181 HydrophobicContact CD1-CB 4.22Å; I165-L181 WeakPolarHBondContact O-CA 3.34Å; E166-L181 HydrophobicContact CB-CD2 3.91Å; E166-L181 HydrophobicContact CG-CD2 4.02Å; L181-V205 HydrophobicContact CB-CB 4.21Å; L181-V205 PolarHBondContact N-O 3.5Å; L181-V205 PolarHBondContact O-N 3.31Å; L181-L289 HydrophobicContact CD1-CD1 3.48Å; L181-L289 VanDerWaalsContact CD1-CD1 3.48Å
182	V	93.3	Very high	85.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	143.4	-178.8	-67.5	0	0	0	0	110.6	L84 L100 M159 I165 V167 F202 V203 L204	L84-V182 HydrophobicContact CD2-CG1 3.92Å; L100-V182 HydrophobicContact CD2-CG2 4.1Å; M159-V182 HydrophobicContact CE-CB 4.32Å; M159-V182 HydrophobicContact CE-CG2 3.77Å; M159-V182 HydrophobicContact SD-CG2 4.2Å; I165-V182 HydrophobicContact CB-CG2 4.01Å; I165-V182 HydrophobicContact CG2-CG2 4.47Å; I165-V182 PolarHBondContact N-O 3.28Å; I165-V182 WeakPolarHBondContact O-CG2 3.33Å; I165-V182 PolarHBondContact O-N 2.91Å; V167-V182 HydrophobicContact CG2-CG2 3.72Å; V182-F202 HydrophobicContact CB-CE2 3.98Å; V182-F202 HydrophobicContact CB-CZ 4.03Å; V182-F202 HydrophobicContact CG1-CE2 4.28Å; V182-F202 HydrophobicContact CG1-CZ 3.8Å; V182-V203 WeakPolarHBondContact CA-O 3.18Å; V182-L204 HydrophobicContact CG1-CB 4.35Å; V182-L204 HydrophobicContact CG1-CD1 3.36Å; V182-L204 HydrophobicContact CG1-CG 4.47Å
183	Q	92.1	Very high	85.1	Confident	5 Å²	5	37.3 Å²	37.3	2%	0.023	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	137.6	170.9	-176.7	174.4	-9	0	0	108.5	L164 F202 V203 N286 F287	L164-Q183 HydrophobicContact CD1-CB 4.42Å; Q183-F202 WeakPolarHBondContact O-CD2 3.5Å; Q183-V203 PolarHBondContact N-O 3.17Å; Q183-V203 VanDerWaalsContact N-O 3.07Å; Q183-V203 PolarHBondContact O-N 2.81Å; Q183-N286 PolarHBondContact OE1-O 2.8Å; Q183-F287 HydrophobicContact CB-CD1 4.18Å; Q183-F287 HydrophobicContact CB-CE1 3.21Å; Q183-F287 HydrophobicContact CB-CZ 3.4Å; Q183-F287 VanDerWaalsContact CB-CZ 3.4Å; Q183-F287 HydrophobicContact CG-CE1 4.21Å; Q183-F287 HydrophobicContact CG-CZ 4.03Å; Q183-F287 VanDerWaalsContact OE1-CE1 3.26Å
184	S	88.8	Confident	84.9	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.007	20%	0.201	C	C	.	.			trans	-122.6	139	175.4	-175.5	0	0	0	0	109.8	V98 N162	V98-S184 WeakPolarHBondContact CG1-OG 3.36Å; V98-S184 WeakPolarHBondContact CG2-OG 3.31Å; N162-S184 PolarHBondContact N-O 2.99Å
185	P	88.7	Confident	85	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	20%	0.199	C	C	.	.			trans	-73.2	-174.9	164.4	34.7	-36.1	0	0	0	110.6	Q189 L190 L200 P201	P185-Q189 HydrophobicContact CB-CB 4.11Å; P185-Q189 HydrophobicContact CG-CB 4.41Å; P185-L190 HydrophobicContact CG-CB 4.33Å; P185-L190 HydrophobicContact CG-CD1 4.4Å; P185-L200 HydrophobicContact CB-CB 3.73Å; P185-L200 HydrophobicContact CB-CD1 4.15Å; P185-L200 HydrophobicContact CG-CB 3.78Å; P185-L200 WeakPolarHBondContact CG-O 3.49Å; P185-P201 WeakPolarHBondContact CD-O 3.36Å
186	Y	87.2	Confident	85	Confident	87 Å²	87	36 Å²	36	34%	0.341	19%	0.186	S	C	.	.			trans	-59	147.9	169.6	-68.1	-82.7	0	0	0	111.2	P161 N162 S188 Q189 L190	P161-Y186 HydrophobicContact CB-CD1 3.43Å; P161-Y186 VanDerWaalsContact CB-CD1 3.43Å; P161-Y186 HydrophobicContact CB-CD2 4.33Å; P161-Y186 HydrophobicContact CB-CE1 3.54Å; P161-Y186 HydrophobicContact CB-CE2 4.43Å; P161-Y186 HydrophobicContact CB-CG 3.85Å; P161-Y186 HydrophobicContact CG-CD1 3.73Å; P161-Y186 HydrophobicContact CG-CE1 3.43Å; P161-Y186 VanDerWaalsContact CG-CE1 3.43Å; N162-Y186 WeakPolarHBondContact ND2-CE2 3.42Å; Y186-S188 PolarHBondContact O-N 2.66Å; Y186-Q189 WeakPolarHBondContact O-CB 3.42Å; Y186-Q189 PolarHBondContact O-N 3.23Å; Y186-L190 PolarHBondContact O-N 3.13Å
187	A	86	Confident	85	Confident	6 Å²	6	37.5 Å²	37.5	5%	0.05	20%	0.199	C	C	.	.	H	α-helix	trans	-55	-39.8	178.9	0	0	0	0	0	112.5	I88 P96 V98 Q189 L190 Q191	I88-A187 HydrophobicContact CD1-CB 4.28Å; I88-A187 VanDerWaalsContact CD1-O 3.29Å; I88-A187 WeakPolarHBondContact CD1-O 3.45Å; I88-A187 HydrophobicContact CG2-CB 4.2Å; P96-A187 HydrophobicContact CB-CB 3.94Å; P96-A187 WeakPolarHBondContact O-CB 3.42Å; V98-A187 HydrophobicContact CG2-CB 3.98Å; A187-Q189 PolarHBondContact O-N 3.21Å; A187-L190 PolarHBondContact O-N 2.82Å; A187-L190 VanDerWaalsContact O-N 3.11Å; A187-Q191 PolarHBondContact O-N 3.07Å
188	S	84.6	Confident	84.9	Confident	62 Å²	62	40.2 Å²	40.2	43%	0.434	21%	0.213	S	C	.	.	H	α-helix	trans	-61	-30.4	176.7	54.8	0	0	0	0	113.5	Y186 E192 S193	Y186-S188 PolarHBondContact O-N 2.66Å; S188-E192 CarbonylContact O-C 3.59Å; S188-S193 PolarHBondContact O-N 2.96Å
189	Q	86.3	Confident	84.9	Confident	21 Å²	21	39.8 Å²	39.8	10%	0.098	21%	0.21	C	C	.	.	H	α-helix	trans	-83	-19.1	178.3	-63.4	-176.8	-61.3	0	0	113.1	P185 Y186 A187 D198 L200	P185-Q189 HydrophobicContact CB-CB 4.11Å; P185-Q189 HydrophobicContact CG-CB 4.41Å; Y186-Q189 WeakPolarHBondContact O-CB 3.42Å; Y186-Q189 PolarHBondContact O-N 3.23Å; A187-Q189 PolarHBondContact O-N 3.21Å; Q189-D198 PolarHBondContact NE2-O 3.35Å; Q189-L200 PolarHBondContact O-N 3.14Å
190	L	83.5	Confident	84.9	Confident	9 Å²	9	37.1 Å²	37.1	5%	0.047	20%	0.201	C	C	.	.	H	α-helix	trans	-87.6	-51.5	-171.9	-174.9	64.4	0	0	0	113.1	A86 I88 V98 P185 Y186 A187 W199 F202	A86-L190 HydrophobicContact CB-CD2 4.19Å; I88-L190 HydrophobicContact CD1-CB 4.16Å; I88-L190 HydrophobicContact CD1-CD2 4.43Å; I88-L190 HydrophobicContact CG1-CD2 4.26Å; V98-L190 HydrophobicContact CG1-CD2 4.38Å; V98-L190 HydrophobicContact CG2-CD2 4.09Å; P185-L190 HydrophobicContact CG-CB 4.33Å; P185-L190 HydrophobicContact CG-CD1 4.4Å; Y186-L190 PolarHBondContact O-N 3.13Å; A187-L190 PolarHBondContact O-N 2.82Å; A187-L190 VanDerWaalsContact O-N 3.11Å; L190-W199 PolarHBondContact O-NE1 3.07Å; L190-F202 HydrophobicContact CD1-CB 3.87Å; L190-F202 VanDerWaalsContact CD1-N 3.33Å; L190-F202 HydrophobicContact CD2-CB 4.43Å
191	Q	77.8	Confident	84.7	Confident	105 Å²	105	36.6 Å²	36.6	49%	0.491	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.2	-23.9	178.6	-60.1	178.7	-26.6	0	0	114.4	I88 A187	I88-Q191 HydrophobicContact CD1-CB 3.48Å; I88-Q191 VanDerWaalsContact CD1-CB 3.48Å; I88-Q191 HydrophobicContact CD1-CG 3.47Å; I88-Q191 VanDerWaalsContact CD1-CG 3.47Å; I88-Q191 HydrophobicContact CG1-CG 4.05Å; A187-Q191 PolarHBondContact O-N 3.07Å
192	E	69.4	Low	84.6	Confident	96 Å²	96	36.9 Å²	36.9	45%	0.449	20%	0.2	S	C	.	.	S	Bend	trans	-90.6	-1.6	-177.9	-59	178	171.8	0	0	112.8	S188 T194	S188-E192 CarbonylContact O-C 3.59Å; E192-T194 PolarHBondContact O-N 3.26Å
193	S	70.9	Confident	84.5	Confident	9 Å²	9	36.9 Å²	36.9	6%	0.063	20%	0.2	C	C	.	.			trans	-66	121.3	-178.1	-168.7	0	0	0	0	110.5	S188 S195 W199	S188-S193 PolarHBondContact O-N 2.96Å; S193-S195 PolarHBondContact OG-N 3.4Å; S193-S195 PolarHBondContact OG-O 3.12Å; S193-W199 PolarHBondContact OG-N 3.5Å
194	T	72.5	Confident	84.5	Confident	132 Å²	132	37.3 Å²	37.3	81%	0.81	20%	0.202	S	C	*	.			trans	-90.9	-11.3	172.1	53.5	0	0	0	0	112.4	E192	E192-T194 PolarHBondContact O-N 3.26Å
195	S	83.2	Confident	84.7	Confident	34 Å²	34	37.4 Å²	37.4	24%	0.238	20%	0.203	C	C	.	.			trans	-109.9	126.5	-176.2	169.5	0	0	0	0	110.3	S193 A197 D198 W199	S193-S195 PolarHBondContact OG-N 3.4Å; S193-S195 PolarHBondContact OG-O 3.12Å; S195-A197 PolarHBondContact O-N 3.41Å; S195-A197 PolarHBondContact OG-N 3.04Å; S195-D198 VanDerWaalsContact CB-OD2 3.23Å; S195-D198 WeakPolarHBondContact CB-OD2 3.37Å; S195-D198 PolarHBondContact O-N 3.3Å; S195-D198 PolarHBondContact OG-OD2 2.93Å; S195-W199 PolarHBondContact O-N 3.37Å
196	F	81.8	Confident	84.8	Confident	70 Å²	70	39.1 Å²	39.1	31%	0.307	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-24	173.4	63	-99.8	0	0	0	112.4	L226 H274	F196-L226 HydrophobicContact CB-CD2 3.85Å; F196-H274 AromaticContact CD1-CE1 3.57Å; F196-H274 AromaticContact CD1-ND1 3.91Å; F196-H274 HydrophobicContact CD2-CB 4.03Å; F196-H274 AromaticContact CD2-CE1 3.7Å; F196-H274 AromaticContact CD2-CG 3.58Å; F196-H274 AromaticContact CD2-ND1 3.14Å; F196-H274 WeakPolarHBondContact CD2-ND1 3.25Å; F196-H274 AromaticContact CE1-CE1 3.68Å; F196-H274 AromaticContact CE2-CE1 3.81Å; F196-H274 AromaticContact CE2-ND1 3.27Å; F196-H274 VanDerWaalsContact CE2-ND1 3.27Å; F196-H274 WeakPolarHBondContact CE2-ND1 3.29Å; F196-H274 AromaticContact CG-CE1 3.59Å; F196-H274 AromaticContact CG-CG 3.85Å; F196-H274 AromaticContact CG-ND1 3.5Å; F196-H274 AromaticContact CG-NE2 3.99Å; F196-H274 AromaticContact CZ-CE1 3.8Å; F196-H274 AromaticContact CZ-ND1 3.71Å
197	A	84.9	Confident	84.8	Confident	39 Å²	39	35.7 Å²	35.7	32%	0.322	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-27.6	-178.3	0	0	0	0	0	112.8	S195	S195-A197 PolarHBondContact O-N 3.41Å; S195-A197 PolarHBondContact OG-N 3.04Å
198	D	86.3	Confident	84.7	Confident	79 Å²	79	36.8 Å²	36.8	42%	0.422	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-17.6	-175.4	-63.7	-54.7	0	0	0	113.7	Q189 S195	Q189-D198 PolarHBondContact NE2-O 3.35Å; S195-D198 VanDerWaalsContact CB-OD2 3.23Å; S195-D198 WeakPolarHBondContact CB-OD2 3.37Å; S195-D198 PolarHBondContact O-N 3.3Å; S195-D198 PolarHBondContact OG-OD2 2.93Å
199	W	89.6	Confident	84.4	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.202	C	C	.	.			trans	-66	138.8	179.4	-177.4	82.8	0	0	0	111.6	L190 S193 S195 P201 S218 P220 P221 I224 L226 F251 V272	L190-W199 PolarHBondContact O-NE1 3.07Å; S193-W199 PolarHBondContact OG-N 3.5Å; S195-W199 PolarHBondContact O-N 3.37Å; W199-P201 HydrophobicContact CH2-CB 3.58Å; W199-P201 HydrophobicContact CH2-CG 4.26Å; W199-P201 HydrophobicContact CZ2-CB 4.04Å; W199-P201 HydrophobicContact CZ3-CB 4.1Å; W199-P201 HydrophobicContact CZ3-CG 4.29Å; W199-S218 WeakPolarHBondContact CH2-O 3.38Å; W199-P220 HydrophobicContact CD2-CB 4.25Å; W199-P220 HydrophobicContact CH2-CB 4.07Å; W199-P220 HydrophobicContact CZ2-CB 3.81Å; W199-P220 HydrophobicContact CZ3-CB 4.45Å; W199-P221 VanDerWaalsContact NE1-CD 3.3Å; W199-I224 HydrophobicContact CB-CD1 3.48Å; W199-I224 VanDerWaalsContact CB-CD1 3.48Å; W199-I224 HydrophobicContact CD2-CD1 3.94Å; W199-I224 HydrophobicContact CG-CD1 3.36Å; W199-L226 HydrophobicContact CD2-CD1 3.97Å; W199-L226 HydrophobicContact CE3-CD1 3.26Å; W199-L226 HydrophobicContact CH2-CD1 4.23Å; W199-L226 HydrophobicContact CZ3-CD1 3.41Å; W199-L226 VanDerWaalsContact CZ3-CD1 3.41Å; W199-F251 HydrophobicContact CH2-CE1 4.41Å; W199-F251 AromaticContact CH2-CZ 3.75Å; W199-F251 HydrophobicContact CH2-CZ 3.75Å; W199-F251 HydrophobicContact CZ3-CE2 4.45Å; W199-F251 AromaticContact CZ3-CZ 4Å; W199-F251 HydrophobicContact CZ3-CZ 4Å; W199-V272 HydrophobicContact CE3-CG1 4.15Å; W199-V272 HydrophobicContact CE3-CG2 3.92Å; W199-V272 HydrophobicContact CZ3-CG1 4.37Å; W199-V272 HydrophobicContact CZ3-CG2 3.94Å
200	L	89.9	Confident	83.7	Confident	5 Å²	5	41.1 Å²	41.1	3%	0.026	23%	0.23	C	C	.	.			trans	-137.1	140.1	177.1	-81.7	-176.9	0	0	0	109.1	P185 Q189 V272 R283 Q285	P185-L200 HydrophobicContact CB-CB 3.73Å; P185-L200 HydrophobicContact CB-CD1 4.15Å; P185-L200 HydrophobicContact CG-CB 3.78Å; P185-L200 WeakPolarHBondContact CG-O 3.49Å; Q189-L200 PolarHBondContact O-N 3.14Å; L200-V272 HydrophobicContact CD2-CG2 4.49Å; L200-R283 HydrophobicContact CD1-CG 4.33Å; L200-R283 HydrophobicContact CD2-CB 3.98Å; L200-R283 HydrophobicContact CD2-CG 4.01Å; L200-R283 HydrophobicContact CG-CG 4.38Å; L200-Q285 HydrophobicContact CD1-CG 4.07Å; L200-Q285 HydrophobicContact CD2-CG 4.01Å
201	P	89.4	Confident	83.3	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.006	25%	0.249	C	C	.	.			trans	-80	153.8	179.1	29.6	-33.7	0	0	0	112.6	P185 W199 V203 V217 S218 Q285	P185-P201 WeakPolarHBondContact CD-O 3.36Å; W199-P201 HydrophobicContact CH2-CB 3.58Å; W199-P201 HydrophobicContact CH2-CG 4.26Å; W199-P201 HydrophobicContact CZ2-CB 4.04Å; W199-P201 HydrophobicContact CZ3-CB 4.1Å; W199-P201 HydrophobicContact CZ3-CG 4.29Å; P201-V203 HydrophobicContact CB-CG2 4.48Å; P201-V203 HydrophobicContact CG-CG2 4.09Å; P201-V217 HydrophobicContact CB-CG1 3.16Å; P201-V217 HydrophobicContact CG-CG1 3.41Å; P201-V217 VanDerWaalsContact CG-CG1 3.41Å; P201-S218 WeakPolarHBondContact CA-OG 3.24Å; P201-Q285 PolarHBondContact O-NE2 3.24Å
202	F	90.4	Very high	83.6	Confident	12 Å²	12	41.7 Å²	41.7	5%	0.053	24%	0.237	C	C	.	.			trans	-70.6	134.1	153	169.3	-99.7	0	0	0	108.7	A86 L100 V182 Q183 L190 L204 V217 S218	A86-F202 HydrophobicContact CB-CB 3.98Å; A86-F202 HydrophobicContact CB-CD1 3.96Å; A86-F202 HydrophobicContact CB-CD2 3.53Å; A86-F202 HydrophobicContact CB-CE1 4.3Å; A86-F202 HydrophobicContact CB-CE2 3.9Å; A86-F202 HydrophobicContact CB-CG 3.54Å; A86-F202 HydrophobicContact CB-CZ 4.27Å; L100-F202 HydrophobicContact CD1-CE2 4.31Å; L100-F202 HydrophobicContact CD1-CZ 3.96Å; V182-F202 HydrophobicContact CB-CE2 3.98Å; V182-F202 HydrophobicContact CB-CZ 4.03Å; V182-F202 HydrophobicContact CG1-CE2 4.28Å; V182-F202 HydrophobicContact CG1-CZ 3.8Å; Q183-F202 WeakPolarHBondContact O-CD2 3.5Å; L190-F202 HydrophobicContact CD1-CB 3.87Å; L190-F202 VanDerWaalsContact CD1-N 3.33Å; L190-F202 HydrophobicContact CD2-CB 4.43Å; F202-L204 HydrophobicContact CE1-CB 4.1Å; F202-V217 CarbonylContact O-C 3.58Å; F202-S218 PolarHBondContact N-OG 3.05Å; F202-S218 PolarHBondContact O-N 2.61Å; F202-S218 PolarHBondContact O-OG 3.47Å
203	V	91.8	Very high	84.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.2	-177	-179	0	0	0	0	108.9	V182 Q183 P201 V205 V215 N216 I270 F287	V182-V203 WeakPolarHBondContact CA-O 3.18Å; Q183-V203 PolarHBondContact N-O 3.17Å; Q183-V203 VanDerWaalsContact N-O 3.07Å; Q183-V203 PolarHBondContact O-N 2.81Å; P201-V203 HydrophobicContact CB-CG2 4.48Å; P201-V203 HydrophobicContact CG-CG2 4.09Å; V203-V205 HydrophobicContact CG1-CG2 4.19Å; V203-V215 HydrophobicContact CG1-CG1 4.08Å; V203-N216 WeakPolarHBondContact CA-O 3.3Å; V203-I270 HydrophobicContact CB-CD1 4.14Å; V203-I270 HydrophobicContact CG1-CD1 3.36Å; V203-I270 HydrophobicContact CG2-CD1 3.65Å; V203-F287 HydrophobicContact CB-CE1 3.69Å; V203-F287 HydrophobicContact CB-CE2 3.97Å; V203-F287 HydrophobicContact CB-CZ 3.21Å; V203-F287 HydrophobicContact CG1-CD1 4.48Å; V203-F287 HydrophobicContact CG1-CE1 3.69Å; V203-F287 HydrophobicContact CG1-CE2 3.92Å; V203-F287 HydrophobicContact CG1-CZ 3.46Å; V203-F287 VanDerWaalsContact CG1-CZ 3.46Å; V203-F287 HydrophobicContact CG2-CE1 4.49Å; V203-F287 HydrophobicContact CG2-CE2 3.91Å; V203-F287 HydrophobicContact CG2-CZ 3.54Å
204	L	92.3	Very high	85.4	Confident	15 Å²	15	37.9 Å²	37.9	8%	0.079	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	123.5	175	169.2	70.5	0	0	0	108	L84 Y180 V182 F202 N216	L84-L204 HydrophobicContact CB-CD1 3.95Å; L84-L204 HydrophobicContact CB-CD2 4.12Å; L84-L204 HydrophobicContact CD2-CD1 4.07Å; L84-L204 HydrophobicContact CG-CD1 4.48Å; Y180-L204 HydrophobicContact CD1-CD1 3.81Å; Y180-L204 HydrophobicContact CG-CD1 4.17Å; V182-L204 HydrophobicContact CG1-CB 4.35Å; V182-L204 HydrophobicContact CG1-CD1 3.36Å; V182-L204 HydrophobicContact CG1-CG 4.47Å; F202-L204 HydrophobicContact CE1-CB 4.1Å; L204-N216 HydrophobicContact CB-CB 4.15Å; L204-N216 HydrophobicContact CD2-CB 4.4Å; L204-N216 PolarHBondContact N-O 3.41Å; L204-N216 PolarHBondContact O-N 2.96Å
205	V	92.2	Very high	86.3	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.012	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	122.6	174.1	-175.9	0	0	0	0	108.2	L181 V203 P207 I213 V214 V215 L268 F287	L181-V205 HydrophobicContact CB-CB 4.21Å; L181-V205 PolarHBondContact N-O 3.5Å; L181-V205 PolarHBondContact O-N 3.31Å; V203-V205 HydrophobicContact CG1-CG2 4.19Å; V205-P207 VanDerWaalsContact O-CD 3.28Å; V205-P207 WeakPolarHBondContact O-CD 3.35Å; V205-I213 HydrophobicContact CG1-CG2 3.39Å; V205-V214 WeakPolarHBondContact CA-O 3.44Å; V205-V215 HydrophobicContact CG1-CG2 4.44Å; V205-V215 HydrophobicContact CG2-CG2 4.37Å; V205-L268 HydrophobicContact CG2-CD2 3.82Å; V205-F287 HydrophobicContact CG2-CD1 4.32Å
206	D	90.6	Very high	86.7	Confident	38 Å²	38	33 Å²	33	20%	0.203	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	101.5	174.8	-176.8	-5.9	0	0	0	109.6	Y180 N208 I213 V214	Y180-D206 HydrophobicContact CD1-CB 3.98Å; Y180-D206 HydrophobicContact CE1-CB 3.82Å; Y180-D206 VanDerWaalsContact CE1-CG 3.47Å; Y180-D206 WeakPolarHBondContact CE1-OD2 2.8Å; D206-N208 VanDerWaalsContact OD1-CB 3.24Å; D206-N208 WeakPolarHBondContact OD1-CB 3.4Å; D206-N208 PolarHBondContact OD1-N 3.1Å; D206-N208 PolarHBondContact OD1-ND2 2.83Å; D206-I213 WeakPolarHBondContact O-CA 3.45Å; D206-V214 HydrophobicContact CB-CB 4.22Å; D206-V214 PolarHBondContact N-O 3.45Å; D206-V214 PolarHBondContact O-N 3.03Å
207	P	87.5	Confident	87.1	Confident	15 Å²	15	31.2 Å²	31.2	10%	0.097	18%	0.181	C	C	.	.			trans	-91.1	12.5	174.5	37.9	-39.2	0	0	0	114.1	R179 V205 L291	R179-P207 VanDerWaalsContact O-CD 3.29Å; R179-P207 WeakPolarHBondContact O-CD 2.85Å; V205-P207 VanDerWaalsContact O-CD 3.28Å; V205-P207 WeakPolarHBondContact O-CD 3.35Å; P207-L291 HydrophobicContact CB-CD2 4.31Å
208	N	83.9	Confident	87.2	Confident	28 Å²	28	30.8 Å²	30.8	15%	0.15	18%	0.175	C	C	.	.			trans	-80.7	-14.7	-171	-60.2	-60.6	0	0	0	114.5	L178 R179 D206	L178-N208 HydrophobicContact CD2-CB 4.11Å; R179-N208 PolarHBondContact N-ND2 2.96Å; R179-N208 PolarHBondContact N-OD1 2.97Å; R179-N208 PolarHBondContact O-ND2 3.04Å; R179-N208 PolarHBondContact O-OD1 3.28Å; D206-N208 VanDerWaalsContact OD1-CB 3.24Å; D206-N208 WeakPolarHBondContact OD1-CB 3.4Å; D206-N208 PolarHBondContact OD1-N 3.1Å; D206-N208 PolarHBondContact OD1-ND2 2.83Å
209	A	77.9	Confident	87.2	Confident	44 Å²	44	34.1 Å²	34.1	36%	0.364	18%	0.182	S	C	.	.	S	Bend	trans	-74.9	143.3	173.3	0	0	0	0	0	110.6	D211 D212 R293	A209-D211 VanDerWaalsContact C-N 3.34Å; A209-D211 PolarHBondContact O-N 3.49Å; A209-D212 HydrophobicContact CB-CB 4.08Å; A209-R293 PolarHBondContact O-NH2 2.99Å
210	D	71.2	Confident	87	Confident	131 Å²	131	35.4 Å²	35.4	70%	0.701	19%	0.19	S	C	*	.	S	Bend	trans	-56.7	-45.2	-171.2	-67.3	-39.8	0	0	0	112.5	R293 Y295	D210-R293 PolarHBondContact O-NH2 3.05Å; D210-Y295 PolarHBondContact O-OH 3.12Å
211	D	75.3	Confident	86.8	Confident	80 Å²	80	36.2 Å²	36.2	43%	0.428	20%	0.196	S	C	.	.	S	Bend	trans	-113.3	-14.8	-177.2	-67.9	-29	0	0	0	114.4	A209 S259 N260 R293 Y295	A209-D211 VanDerWaalsContact C-N 3.34Å; A209-D211 PolarHBondContact O-N 3.49Å; D211-S259 CarbonylContact O-C 3.55Å; D211-S259 WeakPolarHBondContact O-CA 3.29Å; D211-N260 PolarHBondContact O-N 3.43Å; D211-R293 VanDerWaalsContact C-NH1 3.34Å; D211-R293 VanDerWaalsContact C-NH2 3.33Å; D211-R293 PolarHBondContact O-NH1 2.84Å; D211-R293 PolarHBondContact O-NH2 3.23Å; D211-Y295 PolarHBondContact OD1-OH 2.92Å
212	D	85.2	Confident	86.5	Confident	46 Å²	46	42.3 Å²	42.3	25%	0.246	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	146.4	-170.5	-72.5	-7.4	0	0	0	112.2	A209 I258 S259 R293	A209-D212 HydrophobicContact CB-CB 4.08Å; D212-I258 CarbonylContact C-O 3.57Å; D212-I258 WeakPolarHBondContact CA-O 3.28Å; D212-S259 VanDerWaalsContact OD1-CA 3.23Å; D212-S259 WeakPolarHBondContact OD1-CA 3.47Å; D212-S259 WeakPolarHBondContact OD1-CB 3.3Å; D212-R293 PolarHBondContact O-NH2 3.03Å
213	I	88.4	Confident	86.1	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.4	164.9	-55.6	-172	0	0	0	107.6	V205 D206 V215 R257 I258 L261 L289 L291	V205-I213 HydrophobicContact CG1-CG2 3.39Å; D206-I213 WeakPolarHBondContact O-CA 3.45Å; I213-V215 HydrophobicContact CG2-CG2 4.4Å; I213-R257 CarbonylContact O-C 3.59Å; I213-R257 WeakPolarHBondContact O-CA 3.42Å; I213-I258 HydrophobicContact CB-CB 4.45Å; I213-I258 PolarHBondContact N-O 3.49Å; I213-I258 PolarHBondContact O-N 3.11Å; I213-L261 HydrophobicContact CD1-CB 4.47Å; I213-L261 HydrophobicContact CD1-CD1 3.53Å; I213-L261 HydrophobicContact CG1-CD1 4.21Å; I213-L289 HydrophobicContact CD1-CD2 3.68Å; I213-L291 HydrophobicContact CD1-CD1 3.51Å; I213-L291 HydrophobicContact CD1-CD2 3.56Å; I213-L291 HydrophobicContact CD1-CG 4.1Å
214	V	89.8	Confident	85.7	Confident	24 Å²	24	47.5 Å²	47.5	15%	0.145	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	116.6	179.3	-170.9	0	0	0	0	108.7	V205 D206 R257	V205-V214 WeakPolarHBondContact CA-O 3.44Å; D206-V214 HydrophobicContact CB-CB 4.22Å; D206-V214 PolarHBondContact N-O 3.45Å; D206-V214 PolarHBondContact O-N 3.03Å; V214-R257 HydrophobicContact CG2-CG 4.25Å
215	V	91.6	Very high	85.4	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.006	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	112.4	175.9	-177.7	0	0	0	0	108.7	V203 V205 I213 V217 V256 I258 L268 I270	V203-V215 HydrophobicContact CG1-CG1 4.08Å; V205-V215 HydrophobicContact CG1-CG2 4.44Å; V205-V215 HydrophobicContact CG2-CG2 4.37Å; I213-V215 HydrophobicContact CG2-CG2 4.4Å; V215-V217 HydrophobicContact CG1-CG2 4.15Å; V215-V256 HydrophobicContact CB-CB 4.26Å; V215-V256 PolarHBondContact N-O 3.47Å; V215-V256 PolarHBondContact O-N 3.22Å; V215-I258 HydrophobicContact CG2-CD1 3.79Å; V215-L268 HydrophobicContact CB-CD2 4.47Å; V215-L268 HydrophobicContact CG1-CD2 3.9Å; V215-L268 HydrophobicContact CG2-CD1 4.27Å; V215-L268 HydrophobicContact CG2-CD2 3.69Å; V215-I270 HydrophobicContact CG1-CD1 3.98Å
216	N	90.3	Very high	85.1	Confident	62 Å²	62	55.1 Å²	55.1	33%	0.332	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	135	175.8	-70	-24	0	0	0	109.8	V203 L204 S255	V203-N216 WeakPolarHBondContact CA-O 3.3Å; L204-N216 HydrophobicContact CB-CB 4.15Å; L204-N216 HydrophobicContact CD2-CB 4.4Å; L204-N216 PolarHBondContact N-O 3.41Å; L204-N216 PolarHBondContact O-N 2.96Å; N216-S255 WeakPolarHBondContact OD1-CB 3.44Å
217	V	90	Very high	84.9	Confident	33 Å²	33	57 Å²	57	20%	0.2	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	131.4	-175.3	-176.3	0	0	0	0	108.2	P201 F202 V215 V229 I270	P201-V217 HydrophobicContact CB-CG1 3.16Å; P201-V217 HydrophobicContact CG-CG1 3.41Å; P201-V217 VanDerWaalsContact CG-CG1 3.41Å; F202-V217 CarbonylContact O-C 3.58Å; V215-V217 HydrophobicContact CG1-CG2 4.15Å; V217-V229 HydrophobicContact CG1-CG1 4.13Å; V217-V229 HydrophobicContact CG1-CG2 4.48Å; V217-V229 HydrophobicContact CG2-CG2 4.33Å; V217-I270 HydrophobicContact CG2-CD1 4.45Å
218	S	87.5	Confident	85	Confident	29 Å²	29	56.3 Å²	56.3	20%	0.203	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-65.7	149.1	-179.7	67	0	0	0	0	111.8	W199 P201 F202 F251	W199-S218 WeakPolarHBondContact CH2-O 3.38Å; P201-S218 WeakPolarHBondContact CA-OG 3.24Å; F202-S218 PolarHBondContact N-OG 3.05Å; F202-S218 PolarHBondContact O-N 2.61Å; F202-S218 PolarHBondContact O-OG 3.47Å; S218-F251 WeakPolarHBondContact O-CE1 3.33Å
219	R	85.7	Confident	85.4	Confident	149 Å²	149	55.2 Å²	55.2	56%	0.562	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-69.9	147.7	175.3	-61.7	-178.9	-174.7	171.1	2.6	111.8	P252 D253	R219-P252 PolarHBondContact NE-O 2.92Å; R219-P252 PolarHBondContact NH2-O 3.04Å; R219-D253 IonicContact CZ-OD1 3.47Å; R219-D253 IonicContact NH2-OD1 2.75Å; R219-D253 PolarHBondContact NH2-OD1 3.41Å
220	P	87	Confident	86	Confident	28 Å²	28	53.5 Å²	53.5	18%	0.182	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-68.2	157.5	169.9	28.9	-34.4	0	0	0	112.1	W199 I224 L226 F251	W199-P220 HydrophobicContact CD2-CB 4.25Å; W199-P220 HydrophobicContact CH2-CB 4.07Å; W199-P220 HydrophobicContact CZ2-CB 3.81Å; W199-P220 HydrophobicContact CZ3-CB 4.45Å; P220-I224 HydrophobicContact CB-CD1 3.84Å; P220-I224 HydrophobicContact CB-CG1 3.72Å; P220-L226 HydrophobicContact CB-CD1 3.68Å; P220-L226 HydrophobicContact CB-CG 4.37Å; P220-L226 HydrophobicContact CG-CB 4.49Å; P220-L226 HydrophobicContact CG-CD1 3.96Å; P220-L226 HydrophobicContact CG-CG 4.43Å; P220-F251 HydrophobicContact CG-CD2 4.21Å; P220-F251 HydrophobicContact CG-CE2 4.21Å
221	P	84.7	Confident	87.1	Confident	22 Å²	22	47.3 Å²	47.3	14%	0.143	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-62	151.6	170.1	27.2	-33.4	0	0	0	110.5	W199 T223 I224	W199-P221 VanDerWaalsContact NE1-CD 3.3Å; P221-T223 PolarHBondContact O-N 2.92Å; P221-I224 HydrophobicContact CG-CD1 3.96Å; P221-I224 HydrophobicContact CG-CG1 3.95Å; P221-I224 PolarHBondContact O-N 3.48Å; P221-I224 VanDerWaalsContact O-N 3.13Å
222	S	82.7	Confident	87.9	Confident	129 Å²	129	43.8 Å²	43.8	90%	0.902	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-13.6	-179.7	51.6	0	0	0	0	114.3	I224	S222-I224 VanDerWaalsContact C-N 3.33Å
223	T	82	Confident	88.2	Confident	104 Å²	104	41.7 Å²	41.7	64%	0.638	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-20	177.5	49.9	0	0	0	0	113.6	P221	P221-T223 PolarHBondContact O-N 2.92Å
224	I	84.3	Confident	88.3	Confident	16 Å²	16	44.2 Å²	44.2	8%	0.082	23%	0.227	C	C	.	.	S	Bend	trans	-121	136.4	-180	70	-177.8	0	0	0	110.1	W199 P220 P221 S222 L226	W199-I224 HydrophobicContact CB-CD1 3.48Å; W199-I224 VanDerWaalsContact CB-CD1 3.48Å; W199-I224 HydrophobicContact CD2-CD1 3.94Å; W199-I224 HydrophobicContact CG-CD1 3.36Å; P220-I224 HydrophobicContact CB-CD1 3.84Å; P220-I224 HydrophobicContact CB-CG1 3.72Å; P221-I224 HydrophobicContact CG-CD1 3.96Å; P221-I224 HydrophobicContact CG-CG1 3.95Å; P221-I224 PolarHBondContact O-N 3.48Å; P221-I224 VanDerWaalsContact O-N 3.13Å; S222-I224 VanDerWaalsContact C-N 3.33Å; I224-L226 HydrophobicContact CD1-CD1 4.1Å; I224-L226 HydrophobicContact CD1-CG 4.4Å; I224-L226 HydrophobicContact CG1-CG 4.42Å
225	W	85	Confident	88.2	Confident	166 Å²	166	43.8 Å²	43.8	63%	0.629	23%	0.225	S	C	*	.			trans	-96.9	133.2	170.3	178.2	82.1	0	0	0	109.5	Q227 H274 P275	W225-Q227 HydrophobicContact CH2-CG 3.54Å; W225-Q227 HydrophobicContact CZ2-CG 4.12Å; W225-Q227 HydrophobicContact CZ3-CG 4.06Å; W225-H274 AromaticContact CE3-CD2 3.97Å; W225-H274 AromaticContact CE3-NE2 3.87Å; W225-H274 PolarHBondContact O-CD2 3.2Å; W225-H274 PolarHBondContact O-NE2 3.21Å; W225-P275 HydrophobicContact CZ3-CG 3.88Å
226	L	86.4	Confident	87.8	Confident	11 Å²	11	49.8 Å²	49.8	6%	0.058	25%	0.248	C	C	.	.			trans	-133	147	177.2	-63.7	175.6	0	0	0	109.1	F196 W199 P220 I224 F251 V272 H274	F196-L226 HydrophobicContact CB-CD2 3.85Å; W199-L226 HydrophobicContact CD2-CD1 3.97Å; W199-L226 HydrophobicContact CE3-CD1 3.26Å; W199-L226 HydrophobicContact CH2-CD1 4.23Å; W199-L226 HydrophobicContact CZ3-CD1 3.41Å; W199-L226 VanDerWaalsContact CZ3-CD1 3.41Å; P220-L226 HydrophobicContact CB-CD1 3.68Å; P220-L226 HydrophobicContact CB-CG 4.37Å; P220-L226 HydrophobicContact CG-CB 4.49Å; P220-L226 HydrophobicContact CG-CD1 3.96Å; P220-L226 HydrophobicContact CG-CG 4.43Å; I224-L226 HydrophobicContact CD1-CD1 4.1Å; I224-L226 HydrophobicContact CD1-CG 4.4Å; I224-L226 HydrophobicContact CG1-CG 4.42Å; L226-F251 HydrophobicContact CB-CD2 4.22Å; L226-F251 HydrophobicContact CB-CE2 4.03Å; L226-F251 HydrophobicContact CD1-CE2 4.17Å; L226-V272 HydrophobicContact CD1-CG1 3.81Å; L226-V272 HydrophobicContact CD2-CG1 3.78Å; L226-V272 HydrophobicContact CG-CG1 4.36Å; L226-H274 HydrophobicContact CD2-CB 4.13Å
227	Q	87.7	Confident	87.2	Confident	78 Å²	78	53.7 Å²	53.7	36%	0.364	26%	0.264	S	S	.	.			trans	-71.5	-42.8	176.9	-72.7	178.2	-24.9	0	0	110.9	W225 L273	W225-Q227 HydrophobicContact CH2-CG 3.54Å; W225-Q227 HydrophobicContact CZ2-CG 4.12Å; W225-Q227 HydrophobicContact CZ3-CG 4.06Å; Q227-L273 HydrophobicContact CB-CB 4.17Å; Q227-L273 PolarHBondContact N-O 3.33Å
228	G	89.5	Confident	86.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.8	-158.1	-175	0	0	0	0	0	112	A249 L273	G228-A249 CarbonylContact C-O 3.51Å; G228-A249 WeakPolarHBondContact CA-O 3.48Å; G228-L273 WeakPolarHBondContact O-CB 3.43Å; G228-L273 PolarHBondContact O-N 2.88Å
229	V	91	Very high	85.9	Confident	5 Å²	5	60.2 Å²	60.2	3%	0.03	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	145	174.7	-66.1	0	0	0	0	111.1	V217 V231 T248 A249 F251 I270 H271	V217-V229 HydrophobicContact CG1-CG1 4.13Å; V217-V229 HydrophobicContact CG1-CG2 4.48Å; V217-V229 HydrophobicContact CG2-CG2 4.33Å; V229-V231 HydrophobicContact CG2-CG2 4.4Å; V229-T248 CarbonylContact O-C 3.5Å; V229-T248 WeakPolarHBondContact O-CA 3.38Å; V229-A249 HydrophobicContact CG2-CB 4.16Å; V229-A249 PolarHBondContact N-O 3.41Å; V229-A249 PolarHBondContact O-N 2.99Å; V229-F251 HydrophobicContact CG1-CE2 4.12Å; V229-F251 HydrophobicContact CG1-CZ 3.68Å; V229-I270 HydrophobicContact CB-CG2 4.22Å; V229-I270 HydrophobicContact CG1-CG2 4.42Å; V229-H271 CarbonylContact C-O 3.58Å; V229-H271 VanDerWaalsContact CA-O 3.26Å; V229-H271 WeakPolarHBondContact CA-O 3.48Å
230	L	91.8	Very high	85.5	Confident	9 Å²	9	58.1 Å²	58.1	5%	0.047	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	117.2	171.3	166.5	67.6	0	0	0	108.3	E232 S246 T248 I270 H271 L273	L230-E232 HydrophobicContact CD1-CG 4.3Å; L230-E232 HydrophobicContact CD2-CG 4.36Å; L230-E232 HydrophobicContact CG-CG 4.08Å; L230-S246 WeakPolarHBondContact CD1-OG 3.26Å; L230-T248 HydrophobicContact CB-CG2 4.29Å; L230-T248 HydrophobicContact CD1-CG2 3.79Å; L230-I270 WeakPolarHBondContact O-CA 3.19Å; L230-H271 HydrophobicContact CB-CB 4.12Å; L230-H271 PolarHBondContact N-O 3.34Å; L230-H271 PolarHBondContact O-N 3.12Å; L230-L273 HydrophobicContact CB-CD1 4.08Å; L230-L273 HydrophobicContact CB-CD2 3.84Å; L230-L273 HydrophobicContact CB-CG 4.12Å
231	V	92.4	Very high	85.2	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	116.7	178.2	-177.8	0	0	0	0	108.4	V229 S246 K247 V256 I258 L268 I270	V229-V231 HydrophobicContact CG2-CG2 4.4Å; V231-S246 WeakPolarHBondContact O-CA 3.38Å; V231-K247 PolarHBondContact N-O 3.4Å; V231-K247 PolarHBondContact O-N 3.15Å; V231-V256 HydrophobicContact CB-CG1 4.15Å; V231-V256 HydrophobicContact CB-CG2 4.37Å; V231-V256 HydrophobicContact CG1-CG1 4.21Å; V231-V256 HydrophobicContact CG2-CB 4.21Å; V231-V256 HydrophobicContact CG2-CG1 4.39Å; V231-V256 HydrophobicContact CG2-CG2 3.78Å; V231-I258 HydrophobicContact CG1-CD1 4.33Å; V231-L268 HydrophobicContact CG1-CD1 3.45Å; V231-L268 VanDerWaalsContact CG1-CD1 3.45Å; V231-L268 HydrophobicContact CG1-CG 4.22Å; V231-I270 HydrophobicContact CG2-CG1 4.38Å
232	E	92.7	Very high	85.3	Confident	7 Å²	7	61.1 Å²	61.1	3%	0.033	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.3	176.7	-66.8	177.2	171.2	0	0	109.8	L230 W234 L243 Y245 L268 R269 H271 R281	L230-E232 HydrophobicContact CD1-CG 4.3Å; L230-E232 HydrophobicContact CD2-CG 4.36Å; L230-E232 HydrophobicContact CG-CG 4.08Å; E232-W234 PolarHBondContact OE2-NE1 3.16Å; E232-W234 VanDerWaalsContact OE2-NE1 3.13Å; E232-L243 HydrophobicContact CB-CD1 3.81Å; E232-L243 HydrophobicContact CG-CD1 4.1Å; E232-Y245 CarbonylContact C-O 3.52Å; E232-Y245 VanDerWaalsContact CA-O 3.3Å; E232-Y245 WeakPolarHBondContact CA-O 3.42Å; E232-L268 CarbonylContact O-C 3.58Å; E232-L268 WeakPolarHBondContact O-CA 3.24Å; E232-R269 HydrophobicContact CB-CB 4.36Å; E232-R269 PolarHBondContact N-O 3.44Å; E232-R269 PolarHBondContact O-N 2.96Å; E232-H271 IonicContact OE2-NE2 2.74Å; E232-R281 IonicContact OE1-CZ 3.18Å; E232-R281 IonicContact OE1-NH1 3.95Å; E232-R281 PolarHBondContact OE1-NH1 2.75Å; E232-R281 IonicContact OE1-NH2 3.6Å
233	V	91.8	Very high	85.5	Confident	1 Å²	1	59 Å²	59	1%	0.006	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	123.6	171.8	-174	0	0	0	0	108.6	L244 Y245 I258 L261 Y266 L268	V233-L244 PolarHBondContact O-N 3.17Å; V233-Y245 HydrophobicContact CG2-CD1 4.04Å; V233-Y245 HydrophobicContact CG2-CG 4.37Å; V233-Y245 PolarHBondContact N-O 3.31Å; V233-Y245 PolarHBondContact O-N 2.87Å; V233-I258 HydrophobicContact CG2-CD1 3.66Å; V233-I258 HydrophobicContact CG2-CG2 4.24Å; V233-L261 HydrophobicContact CG1-CD1 4.44Å; V233-L261 HydrophobicContact CG1-CD2 4.27Å; V233-Y266 HydrophobicContact CG1-CD1 3.8Å; V233-Y266 HydrophobicContact CG1-CG 4.21Å; V233-L268 HydrophobicContact CG2-CD1 3.78Å
234	W	91	Very high	85.6	Confident	55 Å²	55	57.9 Å²	57.9	21%	0.208	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.9	176.9	-62.2	75.9	0	0	0	108.6	E232 F241 G242 L243 Y266 I267	E232-W234 PolarHBondContact OE2-NE1 3.16Å; E232-W234 VanDerWaalsContact OE2-NE1 3.13Å; W234-F241 HydrophobicContact CE3-CB 3.99Å; W234-G242 CarbonylContact C-O 3.55Å; W234-G242 WeakPolarHBondContact CA-O 3.25Å; W234-L243 HydrophobicContact CD2-CB 4.29Å; W234-L243 HydrophobicContact CD2-CD1 4.15Å; W234-L243 HydrophobicContact CE3-CB 4.07Å; W234-L243 HydrophobicContact CG-CD1 4.48Å; W234-L243 HydrophobicContact CH2-CB 4.13Å; W234-L243 HydrophobicContact CZ2-CB 4.33Å; W234-L243 HydrophobicContact CZ2-CD1 3.99Å; W234-L243 HydrophobicContact CZ3-CB 4Å; W234-Y266 CarbonylContact O-C 3.58Å; W234-Y266 VanDerWaalsContact O-CA 3.23Å; W234-Y266 WeakPolarHBondContact O-CA 3.27Å; W234-I267 HydrophobicContact CB-CB 4.32Å; W234-I267 PolarHBondContact N-O 3Å; W234-I267 PolarHBondContact O-N 3.21Å
235	S	88.3	Confident	85.8	Confident	15 Å²	15	60 Å²	60	11%	0.105	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	142.5	165.8	51.5	0	0	0	0	109.9	F241 G242	S235-F241 WeakPolarHBondContact O-CA 3.43Å; S235-G242 PolarHBondContact N-O 2.91Å; S235-G242 PolarHBondContact O-N 2.81Å; S235-G242 PolarHBondContact OG-O 3.49Å
236	R	81.8	Confident	86	Confident	127 Å²	127	55 Å²	55	48%	0.479	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	113.1	171.3	-176	-178.3	-176.8	-179.8	1.3	108.7	G238 F241 D265	R236-G238 WeakPolarHBondContact CG-O 3.45Å; R236-G238 PolarHBondContact NE-O 3.35Å; R236-G238 VanDerWaalsContact NE-O 3.17Å; R236-F241 HydrophobicContact CB-CD1 4.28Å; R236-F241 HydrophobicContact CB-CE1 4.01Å; R236-F241 HydrophobicContact CG-CD1 4.37Å; R236-F241 HydrophobicContact CG-CE1 3.77Å; R236-F241 HydrophobicContact CG-CZ 4.37Å; R236-D265 HydrophobicContact CB-CB 4.34Å; R236-D265 WeakPolarHBondContact CB-O 3.14Å; R236-D265 PolarHBondContact N-O 3.35Å
237	E	77.6	Confident	86.3	Confident	144 Å²	144	59 Å²	59	67%	0.673	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	95.9	170.4	-163.6	173.1	-166.5	0	0	107.7	D239 V240	E237-D239 PolarHBondContact O-N 2.82Å; E237-V240 PolarHBondContact N-O 3.46Å; E237-V240 VanDerWaalsContact N-O 3.08Å; E237-V240 PolarHBondContact O-N 3.35Å; E237-V240 VanDerWaalsContact O-N 3.13Å
238	G	74.3	Confident	86.2	Confident	54 Å²	54	59 Å²	59	56%	0.557	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	-115.9	-168.7	0	0	0	0	0	112.3	R236	R236-G238 WeakPolarHBondContact CG-O 3.45Å; R236-G238 PolarHBondContact NE-O 3.35Å; R236-G238 VanDerWaalsContact NE-O 3.17Å
239	D	75.8	Confident	86.1	Confident	144 Å²	144	59.3 Å²	59.3	77%	0.77	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-3.9	178.4	-68.6	-28.6	0	0	0	113.5	E237	E237-D239 PolarHBondContact O-N 2.82Å
240	V	77.8	Confident	85.7	Confident	105 Å²	105	64.6 Å²	64.6	64%	0.636	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	130.1	-179	-175	0	0	0	0	109.9	E237	E237-V240 PolarHBondContact N-O 3.46Å; E237-V240 VanDerWaalsContact N-O 3.08Å; E237-V240 PolarHBondContact O-N 3.35Å; E237-V240 VanDerWaalsContact O-N 3.13Å
241	F	81.5	Confident	84.9	Confident	96 Å²	96	66.5 Å²	66.5	42%	0.421	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.9	175	-62.7	-76.8	0	0	0	110.4	W234 S235 R236 I267	W234-F241 HydrophobicContact CE3-CB 3.99Å; S235-F241 WeakPolarHBondContact O-CA 3.43Å; R236-F241 HydrophobicContact CB-CD1 4.28Å; R236-F241 HydrophobicContact CB-CE1 4.01Å; R236-F241 HydrophobicContact CG-CD1 4.37Å; R236-F241 HydrophobicContact CG-CE1 3.77Å; R236-F241 HydrophobicContact CG-CZ 4.37Å; F241-I267 HydrophobicContact CD1-CD1 3.97Å; F241-I267 HydrophobicContact CE1-CD1 3.3Å; F241-I267 HydrophobicContact CE1-CG1 4.21Å; F241-I267 HydrophobicContact CZ-CD1 4.02Å
242	G	85	Confident	83.1	Confident	17 Å²	17	70.2 Å²	70.2	18%	0.175	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.1	174.6	0	0	0	0	0	111.3	W234 S235 L244	W234-G242 CarbonylContact C-O 3.55Å; W234-G242 WeakPolarHBondContact CA-O 3.25Å; S235-G242 PolarHBondContact N-O 2.91Å; S235-G242 PolarHBondContact O-N 2.81Å; S235-G242 PolarHBondContact OG-O 3.49Å; G242-L244 PolarHBondContact O-N 2.95Å
243	L	87.6	Confident	81.4	Confident	85 Å²	85	75.6 Å²	75.6	45%	0.445	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	116.7	172	-179.4	70.2	0	0	0	109.2	E232 W234 Y245	E232-L243 HydrophobicContact CB-CD1 3.81Å; E232-L243 HydrophobicContact CG-CD1 4.1Å; W234-L243 HydrophobicContact CD2-CB 4.29Å; W234-L243 HydrophobicContact CD2-CD1 4.15Å; W234-L243 HydrophobicContact CE3-CB 4.07Å; W234-L243 HydrophobicContact CG-CD1 4.48Å; W234-L243 HydrophobicContact CH2-CB 4.13Å; W234-L243 HydrophobicContact CZ2-CB 4.33Å; W234-L243 HydrophobicContact CZ2-CD1 3.99Å; W234-L243 HydrophobicContact CZ3-CB 4Å; L243-Y245 WeakPolarHBondContact CD1-O 3.28Å
244	L	84.7	Confident	80.2	Confident	81 Å²	81	80.9 Å²	80.9	42%	0.424	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-35	178.9	-70.5	-178.4	0	0	0	113	V233 G242 Y266	V233-L244 PolarHBondContact O-N 3.17Å; G242-L244 PolarHBondContact O-N 2.95Å; L244-Y266 HydrophobicContact CD1-CD1 4.11Å; L244-Y266 HydrophobicContact CD1-CE1 3.57Å
245	Y	87.5	Confident	79.8	Confident	59 Å²	59	80 Å²	80	23%	0.231	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	143.5	-174.3	179.3	-88.5	0	0	0	110.4	E232 V233 L243 K247 V256 R257 I258	E232-Y245 CarbonylContact C-O 3.52Å; E232-Y245 VanDerWaalsContact CA-O 3.3Å; E232-Y245 WeakPolarHBondContact CA-O 3.42Å; V233-Y245 HydrophobicContact CG2-CD1 4.04Å; V233-Y245 HydrophobicContact CG2-CG 4.37Å; V233-Y245 PolarHBondContact N-O 3.31Å; V233-Y245 PolarHBondContact O-N 2.87Å; L243-Y245 WeakPolarHBondContact CD1-O 3.28Å; Y245-K247 HydrophobicContact CD1-CB 4.49Å; Y245-K247 HydrophobicContact CE1-CB 3.49Å; Y245-K247 VanDerWaalsContact CE1-CB 3.49Å; Y245-K247 WeakPolarHBondContact OH-CB 3.22Å; Y245-K247 WeakPolarHBondContact OH-CD 3.43Å; Y245-V256 HydrophobicContact CE1-CG1 4.03Å; Y245-R257 PolarHBondContact OH-O 2.86Å; Y245-I258 HydrophobicContact CD1-CG1 4.16Å; Y245-I258 HydrophobicContact CD1-CG2 4.24Å; Y245-I258 HydrophobicContact CD2-CG2 4.16Å; Y245-I258 HydrophobicContact CE1-CD1 4.46Å; Y245-I258 HydrophobicContact CE1-CG1 3.8Å; Y245-I258 HydrophobicContact CE1-CG2 4.46Å; Y245-I258 HydrophobicContact CE2-CG2 4.35Å; Y245-I258 HydrophobicContact CG-CG2 4.07Å
246	S	90.9	Very high	79.7	Confident	63 Å²	63	79.4 Å²	79.4	44%	0.441	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	121.5	176.5	-170.2	0	0	0	0	109.3	L230 V231	L230-S246 WeakPolarHBondContact CD1-OG 3.26Å; V231-S246 WeakPolarHBondContact O-CA 3.38Å
247	K	90.9	Very high	80	Confident	93 Å²	93	80.8 Å²	80.8	40%	0.404	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	136.2	176.8	-174.4	173.1	177.7	-175.7	0	111.2	V231 Y245 V256	V231-K247 PolarHBondContact N-O 3.4Å; V231-K247 PolarHBondContact O-N 3.15Å; Y245-K247 HydrophobicContact CD1-CB 4.49Å; Y245-K247 HydrophobicContact CE1-CB 3.49Å; Y245-K247 VanDerWaalsContact CE1-CB 3.49Å; Y245-K247 WeakPolarHBondContact OH-CB 3.22Å; Y245-K247 WeakPolarHBondContact OH-CD 3.43Å; K247-V256 HydrophobicContact CB-CG1 4.44Å; K247-V256 HydrophobicContact CD-CG1 4.36Å
248	T	87.1	Confident	80.5	Confident	80 Å²	80	74 Å²	74	49%	0.491	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	130	170	53.6	0	0	0	0	110	V229 L230 L273	V229-T248 CarbonylContact O-C 3.5Å; V229-T248 WeakPolarHBondContact O-CA 3.38Å; L230-T248 HydrophobicContact CB-CG2 4.29Å; L230-T248 HydrophobicContact CD1-CG2 3.79Å; T248-L273 HydrophobicContact CG2-CD1 3.95Å
249	A	86.2	Confident	81.1	Confident	5 Å²	5	74.5 Å²	74.5	4%	0.041	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.3	169.9	0	0	0	0	0	109.5	G228 V229 D254 V256	G228-A249 CarbonylContact C-O 3.51Å; G228-A249 WeakPolarHBondContact CA-O 3.48Å; V229-A249 HydrophobicContact CG2-CB 4.16Å; V229-A249 PolarHBondContact N-O 3.41Å; V229-A249 PolarHBondContact O-N 2.99Å; A249-D254 HydrophobicContact CB-CB 4.15Å; A249-V256 HydrophobicContact CB-CG2 3.54Å
250	M	83.6	Confident	81.2	Confident	117 Å²	117	72.4 Å²	72.4	58%	0.576	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	144	173.8	-57.1	-58.8	-158	0	0	108.9
251	F	75	Confident	81.3	Confident	48 Å²	48	68 Å²	68	21%	0.211	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	138.3	168.9	-68.4	-67.5	0	0	0	108.9	W199 S218 P220 L226 V229	W199-F251 HydrophobicContact CH2-CE1 4.41Å; W199-F251 AromaticContact CH2-CZ 3.75Å; W199-F251 HydrophobicContact CH2-CZ 3.75Å; W199-F251 HydrophobicContact CZ3-CE2 4.45Å; W199-F251 AromaticContact CZ3-CZ 4Å; W199-F251 HydrophobicContact CZ3-CZ 4Å; S218-F251 WeakPolarHBondContact O-CE1 3.33Å; P220-F251 HydrophobicContact CG-CD2 4.21Å; P220-F251 HydrophobicContact CG-CE2 4.21Å; L226-F251 HydrophobicContact CB-CD2 4.22Å; L226-F251 HydrophobicContact CB-CE2 4.03Å; L226-F251 HydrophobicContact CD1-CE2 4.17Å; V229-F251 HydrophobicContact CG1-CE2 4.12Å; V229-F251 HydrophobicContact CG1-CZ 3.68Å
252	P	53.3	Low	81.2	Confident	79 Å²	79	63.6 Å²	63.6	51%	0.513	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	cis	-126.2	-4.5	36.6	26.7	-6.2	0	0	0	118.9	R219	R219-P252 PolarHBondContact NE-O 2.92Å; R219-P252 PolarHBondContact NH2-O 3.04Å
253	D	57.2	Low	81	Confident	119 Å²	119	64.8 Å²	64.8	64%	0.636	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.2	-5.7	-169.4	-70	-39.7	0	0	0	116.8	R219 S255	R219-D253 IonicContact CZ-OD1 3.47Å; R219-D253 IonicContact NH2-OD1 2.75Å; R219-D253 PolarHBondContact NH2-OD1 3.41Å; D253-S255 PolarHBondContact O-N 3.43Å
254	D	67.3	Low	80.9	Confident	113 Å²	113	62.1 Å²	62.1	60%	0.604	34%	0.341	S	S	*	.			trans	-77.5	99.9	-176	-76.3	-16.7	0	0	0	111.7	A249 V256	A249-D254 HydrophobicContact CB-CB 4.15Å; D254-V256 PolarHBondContact O-N 3.17Å
255	S	81.6	Confident	81	Confident	37 Å²	37	61.7 Å²	61.7	26%	0.259	34%	0.339	S	S	.	.			trans	-60.1	130.3	155.6	67.5	0	0	0	0	109	N216 D253 R257	N216-S255 WeakPolarHBondContact OD1-CB 3.44Å; D253-S255 PolarHBondContact O-N 3.43Å; S255-R257 PolarHBondContact O-N 2.99Å
256	V	86.9	Confident	81.1	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.012	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	104.8	175.7	178	0	0	0	0	108.5	V215 V231 Y245 K247 A249 D254 I258	V215-V256 HydrophobicContact CB-CB 4.26Å; V215-V256 PolarHBondContact N-O 3.47Å; V215-V256 PolarHBondContact O-N 3.22Å; V231-V256 HydrophobicContact CB-CG1 4.15Å; V231-V256 HydrophobicContact CB-CG2 4.37Å; V231-V256 HydrophobicContact CG1-CG1 4.21Å; V231-V256 HydrophobicContact CG2-CB 4.21Å; V231-V256 HydrophobicContact CG2-CG1 4.39Å; V231-V256 HydrophobicContact CG2-CG2 3.78Å; Y245-V256 HydrophobicContact CE1-CG1 4.03Å; K247-V256 HydrophobicContact CB-CG1 4.44Å; K247-V256 HydrophobicContact CD-CG1 4.36Å; A249-V256 HydrophobicContact CB-CG2 3.54Å; D254-V256 PolarHBondContact O-N 3.17Å; V256-I258 HydrophobicContact CG1-CG1 3.99Å
257	R	88.1	Confident	81.1	Confident	155 Å²	155	58.3 Å²	58.3	59%	0.585	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	125.7	170.4	-60.1	-167.9	-176.7	-179.8	0.7	110.4	I213 V214 Y245 S255	I213-R257 CarbonylContact O-C 3.59Å; I213-R257 WeakPolarHBondContact O-CA 3.42Å; V214-R257 HydrophobicContact CG2-CG 4.25Å; Y245-R257 PolarHBondContact OH-O 2.86Å; S255-R257 PolarHBondContact O-N 2.99Å
258	I	87.9	Confident	81.2	Confident	2 Å²	2	54 Å²	54	1%	0.01	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	106.9	178.7	-50.2	163.3	0	0	0	106.6	D212 I213 V215 V231 V233 Y245 V256 L261 L268	D212-I258 CarbonylContact C-O 3.57Å; D212-I258 WeakPolarHBondContact CA-O 3.28Å; I213-I258 HydrophobicContact CB-CB 4.45Å; I213-I258 PolarHBondContact N-O 3.49Å; I213-I258 PolarHBondContact O-N 3.11Å; V215-I258 HydrophobicContact CG2-CD1 3.79Å; V231-I258 HydrophobicContact CG1-CD1 4.33Å; V233-I258 HydrophobicContact CG2-CD1 3.66Å; V233-I258 HydrophobicContact CG2-CG2 4.24Å; Y245-I258 HydrophobicContact CD1-CG1 4.16Å; Y245-I258 HydrophobicContact CD1-CG2 4.24Å; Y245-I258 HydrophobicContact CD2-CG2 4.16Å; Y245-I258 HydrophobicContact CE1-CD1 4.46Å; Y245-I258 HydrophobicContact CE1-CG1 3.8Å; Y245-I258 HydrophobicContact CE1-CG2 4.46Å; Y245-I258 HydrophobicContact CE2-CG2 4.35Å; Y245-I258 HydrophobicContact CG-CG2 4.07Å; V256-I258 HydrophobicContact CG1-CG1 3.99Å; I258-L261 HydrophobicContact CB-CD1 4.2Å; I258-L261 HydrophobicContact CG2-CD1 3.51Å; I258-L261 HydrophobicContact CG2-CD2 4.2Å; I258-L261 HydrophobicContact CG2-CG 3.76Å; I258-L268 HydrophobicContact CD1-CD1 3.98Å
259	S	86.3	Confident	81.5	Confident	65 Å²	65	53.3 Å²	53.3	46%	0.455	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	159.6	-177.6	55.4	0	0	0	0	111.9	D211 D212 L261	D211-S259 CarbonylContact O-C 3.55Å; D211-S259 WeakPolarHBondContact O-CA 3.29Å; D212-S259 VanDerWaalsContact OD1-CA 3.23Å; D212-S259 WeakPolarHBondContact OD1-CA 3.47Å; D212-S259 WeakPolarHBondContact OD1-CB 3.3Å; S259-L261 VanDerWaalsContact C-N 3.26Å; S259-L261 PolarHBondContact O-N 2.95Å
260	N	78.2	Confident	81.8	Confident	100 Å²	100	53.2 Å²	53.2	54%	0.535	29%	0.287	S	S	.	.	S	Bend	trans	59.6	27.8	170	-56.6	-46	0	0	0	115.4	D211	D211-N260 PolarHBondContact O-N 3.43Å
261	L	80.8	Confident	82.2	Confident	12 Å²	12	48.3 Å²	48.3	6%	0.063	26%	0.263	C	S	.	.			trans	-74.6	141.2	165.5	-67.7	175.8	0	0	0	109	I213 V233 I258 S259 Y266 L291 R293	I213-L261 HydrophobicContact CD1-CB 4.47Å; I213-L261 HydrophobicContact CD1-CD1 3.53Å; I213-L261 HydrophobicContact CG1-CD1 4.21Å; V233-L261 HydrophobicContact CG1-CD1 4.44Å; V233-L261 HydrophobicContact CG1-CD2 4.27Å; I258-L261 HydrophobicContact CB-CD1 4.2Å; I258-L261 HydrophobicContact CG2-CD1 3.51Å; I258-L261 HydrophobicContact CG2-CD2 4.2Å; I258-L261 HydrophobicContact CG2-CG 3.76Å; S259-L261 VanDerWaalsContact C-N 3.26Å; S259-L261 PolarHBondContact O-N 2.95Å; L261-Y266 HydrophobicContact CD2-CE1 4.24Å; L261-L291 HydrophobicContact CB-CD1 3.72Å; L261-L291 HydrophobicContact CD1-CD1 4.22Å; L261-R293 VanDerWaalsContact O-CD 3.31Å; L261-R293 WeakPolarHBondContact O-CD 3.43Å; L261-R293 PolarHBondContact O-NH1 2.46Å
262	A	78.1	Confident	83	Confident	4 Å²	4	46 Å²	46	3%	0.033	25%	0.253	C	S	.	.			trans	-109	-176.6	177.6	0	0	0	0	0	113	G264 Y266 Y295 P296 A297	A262-G264 PolarHBondContact O-N 2.82Å; A262-Y266 PolarHBondContact N-OH 3.15Å; A262-Y266 WeakPolarHBondContact O-CE2 3.25Å; A262-Y266 PolarHBondContact O-OH 3.36Å; A262-Y295 HydrophobicContact CB-CD2 4.38Å; A262-Y295 HydrophobicContact CB-CE2 4.49Å; A262-P296 VanDerWaalsContact CB-C 3.47Å; A262-A297 HydrophobicContact CB-CB 3.7Å
263	A	82.1	Confident	84.8	Confident	41 Å²	41	43.2 Å²	43.2	34%	0.339	23%	0.234	S	C	.	.	S	Bend	trans	-55.6	134.9	175	0	0	0	0	0	111.3	L291 R293	A263-L291 VanDerWaalsContact CA-O 3.24Å; A263-L291 WeakPolarHBondContact CA-O 3.27Å; A263-R293 HydrophobicContact CB-CB 4.34Å; A263-R293 WeakPolarHBondContact CB-O 3.21Å
264	G	84.6	Confident	86.4	Confident	29 Å²	29	38.7 Å²	38.7	30%	0.299	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	155	176.9	-178.5	0	0	0	0	0	113	A262 Y266 L291	A262-G264 PolarHBondContact O-N 2.82Å; G264-Y266 WeakPolarHBondContact O-CD2 3.47Å; G264-Y266 WeakPolarHBondContact O-CE2 3.34Å; G264-L291 PolarHBondContact N-O 3.31Å; G264-L291 PolarHBondContact O-N 2.89Å
265	D	87.3	Confident	87.3	Confident	73 Å²	73	37 Å²	37	39%	0.39	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	126	175.3	-63.4	-34.2	0	0	0	109.7	R236 Q290	R236-D265 HydrophobicContact CB-CB 4.34Å; R236-D265 WeakPolarHBondContact CB-O 3.14Å; R236-D265 PolarHBondContact N-O 3.35Å; D265-Q290 VanDerWaalsContact OD1-CG 3.3Å; D265-Q290 WeakPolarHBondContact OD1-CG 3.19Å; D265-Q290 PolarHBondContact OD1-NE2 3.16Å
266	Y	90.1	Very high	87.6	Confident	16 Å²	16	37.7 Å²	37.7	6%	0.063	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	153.9	-179.1	-57.3	-89	0	0	0	110.6	V233 W234 L244 L261 A262 G264 L289 L291	V233-Y266 HydrophobicContact CG1-CD1 3.8Å; V233-Y266 HydrophobicContact CG1-CG 4.21Å; W234-Y266 CarbonylContact O-C 3.58Å; W234-Y266 VanDerWaalsContact O-CA 3.23Å; W234-Y266 WeakPolarHBondContact O-CA 3.27Å; L244-Y266 HydrophobicContact CD1-CD1 4.11Å; L244-Y266 HydrophobicContact CD1-CE1 3.57Å; L261-Y266 HydrophobicContact CD2-CE1 4.24Å; A262-Y266 PolarHBondContact N-OH 3.15Å; A262-Y266 WeakPolarHBondContact O-CE2 3.25Å; A262-Y266 PolarHBondContact O-OH 3.36Å; G264-Y266 WeakPolarHBondContact O-CD2 3.47Å; G264-Y266 WeakPolarHBondContact O-CE2 3.34Å; Y266-L289 PolarHBondContact N-O 3.45Å; Y266-L289 PolarHBondContact O-N 2.98Å; Y266-L291 HydrophobicContact CD2-CD1 3.78Å; Y266-L291 HydrophobicContact CD2-CG 4.13Å; Y266-L291 HydrophobicContact CE2-CB 4.25Å; Y266-L291 HydrophobicContact CE2-CD1 3.6Å; Y266-L291 HydrophobicContact CE2-CG 4.17Å
267	I	91	Very high	87.7	Confident	34 Å²	34	38.1 Å²	38.1	17%	0.174	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	114.3	166	-58.9	-175.6	0	0	0	107.9	W234 F241 N286 F287	W234-I267 HydrophobicContact CB-CB 4.32Å; W234-I267 PolarHBondContact N-O 3Å; W234-I267 PolarHBondContact O-N 3.21Å; F241-I267 HydrophobicContact CD1-CD1 3.97Å; F241-I267 HydrophobicContact CE1-CD1 3.3Å; F241-I267 HydrophobicContact CE1-CG1 4.21Å; F241-I267 HydrophobicContact CZ-CD1 4.02Å; I267-N286 HydrophobicContact CG2-CB 4.08Å; I267-F287 CarbonylContact C-O 3.57Å; I267-F287 VanDerWaalsContact CA-O 3.3Å; I267-F287 WeakPolarHBondContact CA-O 3.23Å
268	L	92.3	Very high	87.7	Confident	4 Å²	4	36 Å²	36	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	121.2	168	-170.4	72.2	0	0	0	108.1	V205 V215 V231 E232 V233 I258 I270 N286 F287	V205-L268 HydrophobicContact CG2-CD2 3.82Å; V215-L268 HydrophobicContact CB-CD2 4.47Å; V215-L268 HydrophobicContact CG1-CD2 3.9Å; V215-L268 HydrophobicContact CG2-CD1 4.27Å; V215-L268 HydrophobicContact CG2-CD2 3.69Å; V231-L268 HydrophobicContact CG1-CD1 3.45Å; V231-L268 VanDerWaalsContact CG1-CD1 3.45Å; V231-L268 HydrophobicContact CG1-CG 4.22Å; E232-L268 CarbonylContact O-C 3.58Å; E232-L268 WeakPolarHBondContact O-CA 3.24Å; V233-L268 HydrophobicContact CG2-CD1 3.78Å; I258-L268 HydrophobicContact CD1-CD1 3.98Å; L268-I270 HydrophobicContact CD2-CD1 3.97Å; L268-I270 HydrophobicContact CD2-CG1 4.32Å; L268-I270 HydrophobicContact CG-CD1 4.41Å; L268-I270 HydrophobicContact CG-CG1 4.22Å; L268-N286 CarbonylContact O-C 3.58Å; L268-N286 WeakPolarHBondContact O-CA 3.42Å; L268-F287 HydrophobicContact CB-CB 4.02Å; L268-F287 HydrophobicContact CD2-CD2 4.44Å; L268-F287 HydrophobicContact CD2-CG 4.5Å; L268-F287 PolarHBondContact N-O 3.09Å; L268-F287 PolarHBondContact O-N 3.07Å
269	R	92.5	Very high	87.6	Confident	65 Å²	65	45.6 Å²	45.6	25%	0.245	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.5	175.5	-175.2	176.2	-66.2	161.6	-0.1	109.7	E232 H271 Y284 Q285 N286	E232-R269 HydrophobicContact CB-CB 4.36Å; E232-R269 PolarHBondContact N-O 3.44Å; E232-R269 PolarHBondContact O-N 2.96Å; R269-H271 WeakPolarHBondContact CD-NE2 3.41Å; R269-Y284 HydrophobicContact CG-CD2 3.94Å; R269-Y284 HydrophobicContact CG-CG 4.33Å; R269-Q285 WeakPolarHBondContact CA-O 3.46Å; R269-N286 WeakPolarHBondContact CG-OD1 2.98Å; R269-N286 PolarHBondContact NE-OD1 2.79Å; R269-N286 VanDerWaalsContact NE-OD1 3.08Å
270	I	92.6	Very high	87.7	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	110.3	-177.7	-58.9	172.1	0	0	0	108.1	V203 V215 V217 V229 L230 V231 L268 Y284 Q285 F287	V203-I270 HydrophobicContact CB-CD1 4.14Å; V203-I270 HydrophobicContact CG1-CD1 3.36Å; V203-I270 HydrophobicContact CG2-CD1 3.65Å; V215-I270 HydrophobicContact CG1-CD1 3.98Å; V217-I270 HydrophobicContact CG2-CD1 4.45Å; V229-I270 HydrophobicContact CB-CG2 4.22Å; V229-I270 HydrophobicContact CG1-CG2 4.42Å; L230-I270 WeakPolarHBondContact O-CA 3.19Å; V231-I270 HydrophobicContact CG2-CG1 4.38Å; L268-I270 HydrophobicContact CD2-CD1 3.97Å; L268-I270 HydrophobicContact CD2-CG1 4.32Å; L268-I270 HydrophobicContact CG-CD1 4.41Å; L268-I270 HydrophobicContact CG-CG1 4.22Å; I270-Y284 CarbonylContact O-C 3.58Å; I270-Y284 WeakPolarHBondContact O-CA 3.49Å; I270-Y284 VanDerWaalsContact O-CB 3.29Å; I270-Y284 WeakPolarHBondContact O-CB 3.37Å; I270-Q285 PolarHBondContact N-O 2.91Å; I270-Q285 PolarHBondContact O-N 3.19Å; I270-F287 HydrophobicContact CD1-CD2 4.2Å; I270-F287 HydrophobicContact CD1-CE2 3.83Å
271	H	92.1	Very high	88.2	Confident	14 Å²	14	43.9 Å²	43.9	7%	0.065	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	135.8	175.6	-69.5	-85.5	0	0	0	110.6	V229 L230 E232 R269 Y284	V229-H271 CarbonylContact C-O 3.58Å; V229-H271 VanDerWaalsContact CA-O 3.26Å; V229-H271 WeakPolarHBondContact CA-O 3.48Å; L230-H271 HydrophobicContact CB-CB 4.12Å; L230-H271 PolarHBondContact N-O 3.34Å; L230-H271 PolarHBondContact O-N 3.12Å; E232-H271 IonicContact OE2-NE2 2.74Å; R269-H271 WeakPolarHBondContact CD-NE2 3.41Å; H271-Y284 AromaticContact CE1-CD1 3.83Å; H271-Y284 AromaticContact CE1-CG 3.84Å; H271-Y284 WeakPolarHBondContact ND1-CB 3.41Å; H271-Y284 AromaticContact ND1-CG 4Å
272	V	91.6	Very high	88.5	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	132.1	168.3	176.1	0	0	0	0	109.5	W199 L200 L226 C282 R283	W199-V272 HydrophobicContact CE3-CG1 4.15Å; W199-V272 HydrophobicContact CE3-CG2 3.92Å; W199-V272 HydrophobicContact CZ3-CG1 4.37Å; W199-V272 HydrophobicContact CZ3-CG2 3.94Å; L200-V272 HydrophobicContact CD2-CG2 4.49Å; L226-V272 HydrophobicContact CD1-CG1 3.81Å; L226-V272 HydrophobicContact CD2-CG1 3.78Å; L226-V272 HydrophobicContact CG-CG1 4.36Å; V272-C282 HydrophobicContact CB-CB 4.09Å; V272-C282 HydrophobicContact CG1-CB 4.32Å; V272-C282 PolarHBondContact O-N 3.27Å; V272-R283 PolarHBondContact N-O 2.83Å
273	L	91.4	Very high	89	Confident	21 Å²	21	49.6 Å²	49.6	11%	0.11	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	123.4	-178.3	-58.8	176.8	0	0	0	111.4	Q227 G228 L230 T248 G280 R281	Q227-L273 HydrophobicContact CB-CB 4.17Å; Q227-L273 PolarHBondContact N-O 3.33Å; G228-L273 WeakPolarHBondContact O-CB 3.43Å; G228-L273 PolarHBondContact O-N 2.88Å; L230-L273 HydrophobicContact CB-CD1 4.08Å; L230-L273 HydrophobicContact CB-CD2 3.84Å; L230-L273 HydrophobicContact CB-CG 4.12Å; T248-L273 HydrophobicContact CG2-CD1 3.95Å; L273-G280 WeakPolarHBondContact CA-O 3.31Å; L273-R281 HydrophobicContact CD2-CG 4.31Å
274	H	91.2	Very high	89.4	Confident	23 Å²	23	53.1 Å²	53.1	11%	0.106	28%	0.278	C	S	.	.			trans	-153	138	174	-171.5	-98.1	0	0	0	109.9	F196 W225 L226 G276 C277 G280 C282	F196-H274 AromaticContact CD1-CE1 3.57Å; F196-H274 AromaticContact CD1-ND1 3.91Å; F196-H274 HydrophobicContact CD2-CB 4.03Å; F196-H274 AromaticContact CD2-CE1 3.7Å; F196-H274 AromaticContact CD2-CG 3.58Å; F196-H274 AromaticContact CD2-ND1 3.14Å; F196-H274 WeakPolarHBondContact CD2-ND1 3.25Å; F196-H274 AromaticContact CE1-CE1 3.68Å; F196-H274 AromaticContact CE2-CE1 3.81Å; F196-H274 AromaticContact CE2-ND1 3.27Å; F196-H274 VanDerWaalsContact CE2-ND1 3.27Å; F196-H274 WeakPolarHBondContact CE2-ND1 3.29Å; F196-H274 AromaticContact CG-CE1 3.59Å; F196-H274 AromaticContact CG-CG 3.85Å; F196-H274 AromaticContact CG-ND1 3.5Å; F196-H274 AromaticContact CG-NE2 3.99Å; F196-H274 AromaticContact CZ-CE1 3.8Å; F196-H274 AromaticContact CZ-ND1 3.71Å; W225-H274 AromaticContact CE3-CD2 3.97Å; W225-H274 AromaticContact CE3-NE2 3.87Å; W225-H274 PolarHBondContact O-CD2 3.2Å; W225-H274 PolarHBondContact O-NE2 3.21Å; L226-H274 HydrophobicContact CD2-CB 4.13Å; H274-G276 WeakPolarHBondContact ND1-CA 3.4Å; H274-G276 PolarHBondContact ND1-N 3.2Å; H274-G276 PolarHBondContact O-N 2.87Å; H274-C277 PolarHBondContact O-N 3.18Å; H274-G280 PolarHBondContact N-O 3.48Å; H274-G280 CarbonylContact O-C 3.55Å; H274-G280 WeakPolarHBondContact O-CA 3.27Å; H274-C282 WeakPolarHBondContact CB-SG 3.36Å
275	P	87.3	Confident	89.6	Confident	78 Å²	78	52.1 Å²	52.1	51%	0.506	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-24.1	-177.7	25.6	-34.5	0	0	0	113.2	W225 C277	W225-P275 HydrophobicContact CZ3-CG 3.88Å; P275-C277 PolarHBondContact O-N 3.23Å
276	G	87.2	Confident	89.7	Confident	51 Å²	51	50.8 Å²	50.8	53%	0.526	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-4.1	175.5	0	0	0	0	0	115	H274	H274-G276 WeakPolarHBondContact ND1-CA 3.4Å; H274-G276 PolarHBondContact ND1-N 3.2Å; H274-G276 PolarHBondContact O-N 2.87Å
277	C	89.9	Confident	89.6	Confident	12 Å²	12	50.2 Å²	50.2	8%	0.081	26%	0.256	C	S	.	.	S	Bend	trans	-98.2	155.2	-179.6	-69.6	0	0	0	0	112.5	H274 P275 K279 G280 R281 C282	H274-C277 PolarHBondContact O-N 3.18Å; P275-C277 PolarHBondContact O-N 3.23Å; C277-K279 PolarHBondContact O-N 2.94Å; C277-G280 WeakPolarHBondContact O-CA 3.47Å; C277-G280 PolarHBondContact O-N 3.27Å; C277-R281 VanDerWaalsContact CB-C 3.48Å; C277-R281 WeakPolarHBondContact CB-O 3.32Å; C277-C282 HydrophobicContact CB-CB 3.93Å; C277-C282 WeakPolarHBondContact CB-SG 3.28Å; C277-C282 VanDerWaalsContact SG-CA 3.52Å; C277-C282 WeakPolarHBondContact SG-CB 3.4Å; C277-C282 CovalentContact SG-SG 2.03Å; C277-C282 PolarHBondContact SG-SG 3.06Å
278	P	86.9	Confident	89.4	Confident	109 Å²	109	50.6 Å²	50.6	71%	0.708	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-56.9	125.4	177.6	-21.9	32.4	0	0	0	111.4	G280 R281	P278-G280 PolarHBondContact O-N 3.17Å; P278-G280 VanDerWaalsContact O-N 3.16Å; P278-R281 PolarHBondContact O-N 3.45Å; P278-R281 VanDerWaalsContact O-N 3.08Å
279	K	86.4	Confident	89.1	Confident	205 Å²	205	50.9 Å²	50.9	89%	0.891	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	56.6	23.4	-174.1	-54.3	-179.8	177.5	179.3	0	114.1	C277 R281	C277-K279 PolarHBondContact O-N 2.94Å; K279-R281 PolarHBondContact O-N 3.5Å
280	G	87.2	Confident	88.7	Confident	22 Å²	22	52.4 Å²	52.4	23%	0.227	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	72.3	6.3	-175.8	0	0	0	0	0	114.7	L273 H274 C277 P278	L273-G280 WeakPolarHBondContact CA-O 3.31Å; H274-G280 PolarHBondContact N-O 3.48Å; H274-G280 CarbonylContact O-C 3.55Å; H274-G280 WeakPolarHBondContact O-CA 3.27Å; C277-G280 WeakPolarHBondContact O-CA 3.47Å; C277-G280 PolarHBondContact O-N 3.27Å; P278-G280 PolarHBondContact O-N 3.17Å; P278-G280 VanDerWaalsContact O-N 3.16Å
281	R	88.5	Confident	88.2	Confident	106 Å²	106	52.6 Å²	52.6	40%	0.4	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	118.3	-176.7	-58.6	-178.6	-171.9	-155.4	-1.9	110.1	E232 L273 C277 P278 K279	E232-R281 IonicContact OE1-CZ 3.18Å; E232-R281 IonicContact OE1-NH1 3.95Å; E232-R281 PolarHBondContact OE1-NH1 2.75Å; E232-R281 IonicContact OE1-NH2 3.6Å; L273-R281 HydrophobicContact CD2-CG 4.31Å; C277-R281 VanDerWaalsContact CB-C 3.48Å; C277-R281 WeakPolarHBondContact CB-O 3.32Å; P278-R281 PolarHBondContact O-N 3.45Å; P278-R281 VanDerWaalsContact O-N 3.08Å; K279-R281 PolarHBondContact O-N 3.5Å
282	C	88.4	Confident	87.4	Confident	14 Å²	14	58.5 Å²	58.5	10%	0.095	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-155.8	173.9	-48.9	0	0	0	0	110.8	V272 H274 C277	V272-C282 HydrophobicContact CB-CB 4.09Å; V272-C282 HydrophobicContact CG1-CB 4.32Å; V272-C282 PolarHBondContact O-N 3.27Å; H274-C282 WeakPolarHBondContact CB-SG 3.36Å; C277-C282 HydrophobicContact CB-CB 3.93Å; C277-C282 WeakPolarHBondContact CB-SG 3.28Å; C277-C282 VanDerWaalsContact SG-CA 3.52Å; C277-C282 WeakPolarHBondContact SG-CB 3.4Å; C277-C282 CovalentContact SG-SG 2.03Å; C277-C282 PolarHBondContact SG-SG 3.06Å
283	R	88.1	Confident	86.3	Confident	122 Å²	122	59.9 Å²	59.9	46%	0.46	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	151.1	175.5	-158.2	170.3	-176.4	158.2	-0.2	111.3	L200 V272	L200-R283 HydrophobicContact CD1-CG 4.33Å; L200-R283 HydrophobicContact CD2-CB 3.98Å; L200-R283 HydrophobicContact CD2-CG 4.01Å; L200-R283 HydrophobicContact CG-CG 4.38Å; V272-R283 PolarHBondContact N-O 2.83Å
284	Y	89.9	Confident	84.8	Confident	115 Å²	115	65 Å²	65	45%	0.451	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	159.9	-178.9	65.4	-90.5	0	0	0	111.9	R269 I270 H271	R269-Y284 HydrophobicContact CG-CD2 3.94Å; R269-Y284 HydrophobicContact CG-CG 4.33Å; I270-Y284 CarbonylContact O-C 3.58Å; I270-Y284 WeakPolarHBondContact O-CA 3.49Å; I270-Y284 VanDerWaalsContact O-CB 3.29Å; I270-Y284 WeakPolarHBondContact O-CB 3.37Å; H271-Y284 AromaticContact CE1-CD1 3.83Å; H271-Y284 AromaticContact CE1-CG 3.84Å; H271-Y284 WeakPolarHBondContact ND1-CB 3.41Å; H271-Y284 AromaticContact ND1-CG 4Å
285	Q	89	Confident	83.1	Confident	8 Å²	8	67.3 Å²	67.3	4%	0.037	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	147.4	168.2	-70.7	179	54.2	0	0	109.9	L200 P201 R269 I270 F287	L200-Q285 HydrophobicContact CD1-CG 4.07Å; L200-Q285 HydrophobicContact CD2-CG 4.01Å; P201-Q285 PolarHBondContact O-NE2 3.24Å; R269-Q285 WeakPolarHBondContact CA-O 3.46Å; I270-Q285 PolarHBondContact N-O 2.91Å; I270-Q285 PolarHBondContact O-N 3.19Å; Q285-F287 HydrophobicContact CB-CE2 3.87Å
286	N	89.4	Confident	81.2	Confident	46 Å²	46	68.9 Å²	68.9	25%	0.246	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	137.6	173	-69.8	-26.3	0	0	0	109.1	Y124 Q183 I267 L268 R269	Y124-N286 WeakPolarHBondContact CE2-O 3.07Å; Q183-N286 PolarHBondContact OE1-O 2.8Å; I267-N286 HydrophobicContact CG2-CB 4.08Å; L268-N286 CarbonylContact O-C 3.58Å; L268-N286 WeakPolarHBondContact O-CA 3.42Å; R269-N286 WeakPolarHBondContact CG-OD1 2.98Å; R269-N286 PolarHBondContact NE-OD1 2.79Å; R269-N286 VanDerWaalsContact NE-OD1 3.08Å
287	F	87.8	Confident	79.3	Confident	3 Å²	3	68.7 Å²	68.7	1%	0.013	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	123.3	171.8	-59.9	-116.8	0	0	0	108.2	L164 Q183 V203 V205 I267 L268 I270 Q285 L289	L164-F287 HydrophobicContact CD1-CD1 3.62Å; L164-F287 HydrophobicContact CD1-CE1 4.16Å; Q183-F287 HydrophobicContact CB-CD1 4.18Å; Q183-F287 HydrophobicContact CB-CE1 3.21Å; Q183-F287 HydrophobicContact CB-CZ 3.4Å; Q183-F287 VanDerWaalsContact CB-CZ 3.4Å; Q183-F287 HydrophobicContact CG-CE1 4.21Å; Q183-F287 HydrophobicContact CG-CZ 4.03Å; Q183-F287 VanDerWaalsContact OE1-CE1 3.26Å; V203-F287 HydrophobicContact CB-CE1 3.69Å; V203-F287 HydrophobicContact CB-CE2 3.97Å; V203-F287 HydrophobicContact CB-CZ 3.21Å; V203-F287 HydrophobicContact CG1-CD1 4.48Å; V203-F287 HydrophobicContact CG1-CE1 3.69Å; V203-F287 HydrophobicContact CG1-CE2 3.92Å; V203-F287 HydrophobicContact CG1-CZ 3.46Å; V203-F287 VanDerWaalsContact CG1-CZ 3.46Å; V203-F287 HydrophobicContact CG2-CE1 4.49Å; V203-F287 HydrophobicContact CG2-CE2 3.91Å; V203-F287 HydrophobicContact CG2-CZ 3.54Å; V205-F287 HydrophobicContact CG2-CD1 4.32Å; I267-F287 CarbonylContact C-O 3.57Å; I267-F287 VanDerWaalsContact CA-O 3.3Å; I267-F287 WeakPolarHBondContact CA-O 3.23Å; L268-F287 HydrophobicContact CB-CB 4.02Å; L268-F287 HydrophobicContact CD2-CD2 4.44Å; L268-F287 HydrophobicContact CD2-CG 4.5Å; L268-F287 PolarHBondContact N-O 3.09Å; L268-F287 PolarHBondContact O-N 3.07Å; I270-F287 HydrophobicContact CD1-CD2 4.2Å; I270-F287 HydrophobicContact CD1-CE2 3.83Å; Q285-F287 HydrophobicContact CB-CE2 3.87Å; F287-L289 PolarHBondContact O-N 3.3Å
288	S	87.1	Confident	77.2	Confident	43 Å²	43	74.7 Å²	74.7	30%	0.301	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	118.9	162.9	52.1	0	0	0	0	109.2	Y124 L164	Y124-S288 PolarHBondContact OH-N 2.84Å; Y124-S288 PolarHBondContact OH-OG 3.45Å; L164-S288 VanDerWaalsContact CD2-O 3.24Å; L164-S288 WeakPolarHBondContact CD2-O 3.5Å; L164-S288 VanDerWaalsContact CD2-OG 3.27Å; L164-S288 WeakPolarHBondContact CD2-OG 3.28Å
289	L	86.3	Confident	75.1	Confident	9 Å²	9	73.5 Å²	73.5	5%	0.047	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	115.4	179.8	173.6	69.2	0	0	0	108.8	L181 I213 Y266 F287 L291	L181-L289 HydrophobicContact CD1-CD1 3.48Å; L181-L289 VanDerWaalsContact CD1-CD1 3.48Å; I213-L289 HydrophobicContact CD1-CD2 3.68Å; Y266-L289 PolarHBondContact N-O 3.45Å; Y266-L289 PolarHBondContact O-N 2.98Å; F287-L289 PolarHBondContact O-N 3.3Å; L289-L291 HydrophobicContact CD1-CD2 3.96Å; L289-L291 HydrophobicContact CD1-CG 4.47Å; L289-L291 HydrophobicContact CD2-CD1 4.23Å; L289-L291 HydrophobicContact CD2-CD2 4.15Å; L289-L291 HydrophobicContact CD2-CG 4.12Å; L289-L291 HydrophobicContact CG-CD2 4.06Å; L289-L291 HydrophobicContact CG-CG 4.04Å
290	Q	84.6	Confident	73.1	Confident	97 Å²	97	70.6 Å²	70.6	45%	0.453	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	115	170.9	-177.8	167.5	68.2	0	0	110.1	D265	D265-Q290 VanDerWaalsContact OD1-CG 3.3Å; D265-Q290 WeakPolarHBondContact OD1-CG 3.19Å; D265-Q290 PolarHBondContact OD1-NE2 3.16Å
291	L	81.7	Confident	70.8	Confident	7 Å²	7	74 Å²	74	4%	0.037	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	118.4	176.6	-64.5	175.3	0	0	0	110	P207 I213 L261 A263 G264 Y266 L289	P207-L291 HydrophobicContact CB-CD2 4.31Å; I213-L291 HydrophobicContact CD1-CD1 3.51Å; I213-L291 HydrophobicContact CD1-CD2 3.56Å; I213-L291 HydrophobicContact CD1-CG 4.1Å; L261-L291 HydrophobicContact CB-CD1 3.72Å; L261-L291 HydrophobicContact CD1-CD1 4.22Å; A263-L291 VanDerWaalsContact CA-O 3.24Å; A263-L291 WeakPolarHBondContact CA-O 3.27Å; G264-L291 PolarHBondContact N-O 3.31Å; G264-L291 PolarHBondContact O-N 2.89Å; Y266-L291 HydrophobicContact CD2-CD1 3.78Å; Y266-L291 HydrophobicContact CD2-CG 4.13Å; Y266-L291 HydrophobicContact CE2-CB 4.25Å; Y266-L291 HydrophobicContact CE2-CD1 3.6Å; Y266-L291 HydrophobicContact CE2-CG 4.17Å; L289-L291 HydrophobicContact CD1-CD2 3.96Å; L289-L291 HydrophobicContact CD1-CG 4.47Å; L289-L291 HydrophobicContact CD2-CD1 4.23Å; L289-L291 HydrophobicContact CD2-CD2 4.15Å; L289-L291 HydrophobicContact CD2-CG 4.12Å; L289-L291 HydrophobicContact CG-CD2 4.06Å; L289-L291 HydrophobicContact CG-CG 4.04Å
292	R	76.1	Confident	68.7	Low	137 Å²	137	73.8 Å²	73.8	52%	0.517	40%	0.396	S	S	.	.			trans	-100.5	81.8	170.2	-63.2	-177.6	-176.9	177.3	-1.8	107.5	E68	E68-R292 IonicContact OE1-NH2 3.11Å; E68-R292 IonicContact OE2-CZ 3.06Å; E68-R292 IonicContact OE2-NH1 2.71Å; E68-R292 PolarHBondContact OE2-NH1 2.63Å; E68-R292 IonicContact OE2-NH2 2.67Å; E68-R292 PolarHBondContact OE2-NH2 3.2Å
293	R	68.3	Low	66.7	Low	30 Å²	30	78 Å²	78	11%	0.113	42%	0.417	C	S	.	.			trans	-104.1	146	175.4	-66.7	-169.3	168.4	-177.6	-10	109.9	A209 D210 D211 D212 L261 A263 Y295	A209-R293 PolarHBondContact O-NH2 2.99Å; D210-R293 PolarHBondContact O-NH2 3.05Å; D211-R293 VanDerWaalsContact C-NH1 3.34Å; D211-R293 VanDerWaalsContact C-NH2 3.33Å; D211-R293 PolarHBondContact O-NH1 2.84Å; D211-R293 PolarHBondContact O-NH2 3.23Å; D212-R293 PolarHBondContact O-NH2 3.03Å; L261-R293 VanDerWaalsContact O-CD 3.31Å; L261-R293 WeakPolarHBondContact O-CD 3.43Å; L261-R293 PolarHBondContact O-NH1 2.46Å; A263-R293 HydrophobicContact CB-CB 4.34Å; A263-R293 WeakPolarHBondContact CB-O 3.21Å; R293-Y295 HydrophobicContact CB-CE1 4.32Å; R293-Y295 HydrophobicContact CB-CE2 4.29Å; R293-Y295 VanDerWaalsContact CD-OH 3.28Å; R293-Y295 WeakPolarHBondContact CD-OH 3.44Å; R293-Y295 PolarHBondContact NH1-OH 3.13Å; R293-Y295 PolarHBondContact O-N 3.03Å
294	P	59.3	Low	65	Low	127 Å²	127	74.9 Å²	74.9	83%	0.825	41%	0.414	S	S	*	.	S	Bend	trans	-74.4	-15.2	-177.8	28.6	-33.8	0	0	0	113.4
295	Y	54.7	Low	63.7	Low	73 Å²	73	73.9 Å²	73.9	29%	0.286	42%	0.423	S	S	.	.	S	Bend	trans	-101.6	140.9	179.8	50.7	-99.5	0	0	0	112	D210 D211 A262 R293	D210-Y295 PolarHBondContact O-OH 3.12Å; D211-Y295 PolarHBondContact OD1-OH 2.92Å; A262-Y295 HydrophobicContact CB-CD2 4.38Å; A262-Y295 HydrophobicContact CB-CE2 4.49Å; R293-Y295 HydrophobicContact CB-CE1 4.32Å; R293-Y295 HydrophobicContact CB-CE2 4.29Å; R293-Y295 VanDerWaalsContact CD-OH 3.28Å; R293-Y295 WeakPolarHBondContact CD-OH 3.44Å; R293-Y295 PolarHBondContact NH1-OH 3.13Å; R293-Y295 PolarHBondContact O-N 3.03Å
296	P	49.1	Very low	62.3	Low	110 Å²	110	77.4 Å²	77.4	71%	0.714	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-66.7	159	178.5	28.3	-34.1	0	0	0	111.5	A262 L298	A262-P296 VanDerWaalsContact CB-C 3.47Å; P296-L298 PolarHBondContact O-N 3.06Å; P296-L298 VanDerWaalsContact O-N 3.14Å
297	A	46.9	Very low	61.3	Low	47 Å²	47	79.6 Å²	79.6	39%	0.388	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-46.6	121.4	166.1	0	0	0	0	0	110.6	A262 S299	A262-A297 HydrophobicContact CB-CB 3.7Å; A297-S299 PolarHBondContact O-N 3.13Å
298	L	46.2	Very low	60.6	Low	139 Å²	139	84.1 Å²	84.1	73%	0.728	48%	0.482	S	S	*	.			trans	-63	72.5	144.2	-72	167.2	0	0	0	105.8	P296 V300	P296-L298 PolarHBondContact O-N 3.06Å; P296-L298 VanDerWaalsContact O-N 3.14Å; L298-V300 VanDerWaalsContact C-N 3.29Å; L298-V300 PolarHBondContact O-N 3.12Å
299	S	42.1	Very low	60.3	Low	83 Å²	83	87.1 Å²	87.1	58%	0.58	49%	0.494	S	S	*	.			trans	-66.3	98.5	170.8	47.4	0	0	0	0	105.8	A297 Q301	A297-S299 PolarHBondContact O-N 3.13Å; S299-Q301 PolarHBondContact O-N 3.06Å
300	V	43.4	Very low	60.2	Low	144 Å²	144	90.7 Å²	90.7	87%	0.873	52%	0.516	S	S	*	.			trans	-72.5	0.4	161.3	-166.8	0	0	0	0	109.7	L298 S302	L298-V300 VanDerWaalsContact C-N 3.29Å; L298-V300 PolarHBondContact O-N 3.12Å; V300-S302 PolarHBondContact O-N 2.97Å
301	Q	40.5	Very low	60.2	Low	95 Å²	95	89.2 Å²	89.2	44%	0.444	51%	0.513	S	S	.	.	S	Bend	trans	-66.8	107.3	174.5	-95.4	172.2	-26.2	0	0	111	S299	S299-Q301 PolarHBondContact O-N 3.06Å
302	S	44.7	Very low	60.5	Low	101 Å²	101	93.7 Å²	93.7	71%	0.706	54%	0.537	S	S	*	.			trans	46.2	90.7	140.8	170.6	0	0	0	0	112.9	V300 S304	V300-S302 PolarHBondContact O-N 2.97Å; S302-S304 VanDerWaalsContact C-N 3.32Å; S302-S304 PolarHBondContact O-N 3.03Å
303	L	44.8	Very low	61	Low	103 Å²	103	90.1 Å²	90.1	54%	0.539	53%	0.53	S	S	.	.			trans	-37.8	100.2	168.7	-78.7	109.9	0	0	0	109.3	S305 I307 L308 V311	L303-S305 PolarHBondContact O-N 3.42Å; L303-I307 HydrophobicContact CD2-CG2 4.22Å; L303-L308 HydrophobicContact CB-CB 4.34Å; L303-L308 HydrophobicContact CB-CD1 4.39Å; L303-L308 HydrophobicContact CD2-CB 4.36Å; L303-L308 HydrophobicContact CD2-CD1 4.04Å; L303-V311 HydrophobicContact CD2-CG2 4.29Å
304	S	52.1	Low	62.1	Low	55 Å²	55	92.2 Å²	92.2	39%	0.385	55%	0.546	S	S	.	.			trans	-61.9	142.1	174.9	57.4	0	0	0	0	106.3	S302 P306 I307 L308	S302-S304 VanDerWaalsContact C-N 3.32Å; S302-S304 PolarHBondContact O-N 3.03Å; S304-P306 WeakPolarHBondContact O-CD 3.39Å; S304-I307 PolarHBondContact O-N 2.71Å; S304-I307 WeakPolarHBondContact OG-CD1 3.16Å; S304-L308 PolarHBondContact O-N 2.67Å; S304-L308 VanDerWaalsContact O-N 3.17Å
305	S	62.8	Low	63.6	Low	94 Å²	94	91.2 Å²	91.2	66%	0.657	53%	0.533	S	S	*	.	H	α-helix	trans	-35	-43.6	-179	-177.3	0	0	0	0	115.2	L303 L309	L303-S305 PolarHBondContact O-N 3.42Å; S305-L309 PolarHBondContact O-N 3.3Å
306	P	59.6	Low	65.4	Low	83 Å²	83	92.2 Å²	92.2	54%	0.539	54%	0.543	S	S	.	.	H	α-helix	trans	-69	-37.6	177	26.8	-36	0	0	0	114.6	S304 L309 V310	S304-P306 WeakPolarHBondContact O-CD 3.39Å; P306-L309 WeakPolarHBondContact O-CB 3.31Å; P306-L309 PolarHBondContact O-N 3.06Å; P306-V310 WeakPolarHBondContact O-CG2 3.3Å; P306-V310 PolarHBondContact O-N 3.26Å
307	I	69.5	Low	67.5	Low	92 Å²	92	92.4 Å²	92.4	47%	0.472	54%	0.537	S	S	.	.	H	α-helix	trans	-69.5	-39.2	179.6	-59.5	175.2	0	0	0	110	L303 S304 L309 V310 V311	L303-I307 HydrophobicContact CD2-CG2 4.22Å; S304-I307 PolarHBondContact O-N 2.71Å; S304-I307 WeakPolarHBondContact OG-CD1 3.16Å; I307-L309 PolarHBondContact O-N 3.42Å; I307-V310 PolarHBondContact O-N 3.11Å; I307-V311 HydrophobicContact CG2-CG2 4.27Å; I307-V311 WeakPolarHBondContact O-CB 3.44Å; I307-V311 VanDerWaalsContact O-CG2 3.31Å; I307-V311 WeakPolarHBondContact O-CG2 3.39Å; I307-V311 PolarHBondContact O-N 2.8Å
308	L	73.1	Confident	69.7	Low	97 Å²	97	95 Å²	95	51%	0.508	54%	0.544	S	S	.	.	H	α-helix	trans	-57.2	-42	171.5	-171.4	80.7	0	0	0	110.7	L303 S304 V311 L312	L303-L308 HydrophobicContact CB-CB 4.34Å; L303-L308 HydrophobicContact CB-CD1 4.39Å; L303-L308 HydrophobicContact CD2-CB 4.36Å; L303-L308 HydrophobicContact CD2-CD1 4.04Å; S304-L308 PolarHBondContact O-N 2.67Å; S304-L308 VanDerWaalsContact O-N 3.17Å; L308-V311 PolarHBondContact O-N 3.4Å; L308-L312 VanDerWaalsContact O-CB 3.25Å; L308-L312 WeakPolarHBondContact O-CB 3.5Å; L308-L312 PolarHBondContact O-N 3.24Å
309	L	80.6	Confident	71.9	Confident	106 Å²	106	90.9 Å²	90.9	56%	0.555	53%	0.53	S	S	*	.	H	α-helix	trans	-64.4	-42.6	177.9	-130.5	153.2	0	0	0	111.8	S305 P306 I307 L312 T313	S305-L309 PolarHBondContact O-N 3.3Å; P306-L309 WeakPolarHBondContact O-CB 3.31Å; P306-L309 PolarHBondContact O-N 3.06Å; I307-L309 PolarHBondContact O-N 3.42Å; L309-L312 PolarHBondContact O-N 3.09Å; L309-T313 HydrophobicContact CD2-CG2 4.33Å; L309-T313 VanDerWaalsContact O-CG2 3.28Å; L309-T313 WeakPolarHBondContact O-CG2 3.22Å; L309-T313 PolarHBondContact O-N 2.97Å; L309-T313 PolarHBondContact O-OG1 2.97Å
310	V	83.9	Confident	74.2	Confident	85 Å²	85	90.1 Å²	90.1	52%	0.515	52%	0.522	S	S	.	.	H	α-helix	trans	-66.5	-43.2	175.7	174.8	0	0	0	0	111.7	P306 I307 L312 T313 V314	P306-V310 WeakPolarHBondContact O-CG2 3.3Å; P306-V310 PolarHBondContact O-N 3.26Å; I307-V310 PolarHBondContact O-N 3.11Å; V310-L312 VanDerWaalsContact C-N 3.31Å; V310-L312 PolarHBondContact O-N 3.41Å; V310-T313 WeakPolarHBondContact CA-OG1 3.35Å; V310-T313 PolarHBondContact O-N 3.35Å; V310-T313 PolarHBondContact O-OG1 3.29Å; V310-V314 HydrophobicContact CG1-CG2 4.46Å; V310-V314 WeakPolarHBondContact O-CB 3.24Å; V310-V314 VanDerWaalsContact O-CG2 3.27Å; V310-V314 WeakPolarHBondContact O-CG2 3.4Å; V310-V314 PolarHBondContact O-N 2.88Å
311	V	84.8	Confident	76.6	Confident	66 Å²	66	89.7 Å²	89.7	40%	0.4	51%	0.508	S	S	.	.	H	α-helix	trans	-64.3	-40.4	176.4	172.9	0	0	0	0	110.4	L303 I307 L308 V314 L315	L303-V311 HydrophobicContact CD2-CG2 4.29Å; I307-V311 HydrophobicContact CG2-CG2 4.27Å; I307-V311 WeakPolarHBondContact O-CB 3.44Å; I307-V311 VanDerWaalsContact O-CG2 3.31Å; I307-V311 WeakPolarHBondContact O-CG2 3.39Å; I307-V311 PolarHBondContact O-N 2.8Å; L308-V311 PolarHBondContact O-N 3.4Å; V311-V314 PolarHBondContact O-N 3.28Å; V311-L315 HydrophobicContact CG1-CD1 3.92Å; V311-L315 HydrophobicContact CG1-CG 4.44Å; V311-L315 WeakPolarHBondContact O-CB 3.36Å; V311-L315 VanDerWaalsContact O-CG 3.29Å; V311-L315 WeakPolarHBondContact O-CG 3.35Å; V311-L315 PolarHBondContact O-N 3.02Å
312	L	88	Confident	79	Confident	100 Å²	100	89.5 Å²	89.5	52%	0.524	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-43.1	176.5	-160.1	94.8	0	0	0	111.6	L308 L309 V310 L315 I316	L308-L312 VanDerWaalsContact O-CB 3.25Å; L308-L312 WeakPolarHBondContact O-CB 3.5Å; L308-L312 PolarHBondContact O-N 3.24Å; L309-L312 PolarHBondContact O-N 3.09Å; V310-L312 VanDerWaalsContact C-N 3.31Å; V310-L312 PolarHBondContact O-N 3.41Å; L312-L315 PolarHBondContact O-N 3.5Å; L312-I316 HydrophobicContact CD2-CD1 4.05Å; L312-I316 HydrophobicContact CG-CD1 4.14Å; L312-I316 WeakPolarHBondContact O-CB 3.23Å; L312-I316 WeakPolarHBondContact O-CD1 3.05Å; L312-I316 WeakPolarHBondContact O-CG1 3.5Å; L312-I316 PolarHBondContact O-N 3.46Å
313	T	87.2	Confident	81.2	Confident	62 Å²	62	90.2 Å²	90.2	38%	0.38	51%	0.506	S	S	.	.	H	α-helix	trans	-66.2	-40.9	177.6	55.1	0	0	0	0	111.8	L309 V310 I316 L317	L309-T313 HydrophobicContact CD2-CG2 4.33Å; L309-T313 VanDerWaalsContact O-CG2 3.28Å; L309-T313 WeakPolarHBondContact O-CG2 3.22Å; L309-T313 PolarHBondContact O-N 2.97Å; L309-T313 PolarHBondContact O-OG1 2.97Å; V310-T313 WeakPolarHBondContact CA-OG1 3.35Å; V310-T313 PolarHBondContact O-N 3.35Å; V310-T313 PolarHBondContact O-OG1 3.29Å; T313-I316 PolarHBondContact O-N 2.77Å; T313-L317 WeakPolarHBondContact O-CB 3.45Å; T313-L317 WeakPolarHBondContact O-CG 3.43Å; T313-L317 PolarHBondContact O-N 2.73Å
314	V	90.9	Very high	83.4	Confident	75 Å²	75	89.3 Å²	89.3	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-62.7	-44.6	174	172.3	0	0	0	0	110.8	V310 V311 I316 L317 L318	V310-V314 HydrophobicContact CG1-CG2 4.46Å; V310-V314 WeakPolarHBondContact O-CB 3.24Å; V310-V314 VanDerWaalsContact O-CG2 3.27Å; V310-V314 WeakPolarHBondContact O-CG2 3.4Å; V310-V314 PolarHBondContact O-N 2.88Å; V311-V314 PolarHBondContact O-N 3.28Å; V314-I316 VanDerWaalsContact C-N 3.34Å; V314-I316 PolarHBondContact O-N 3.46Å; V314-L317 PolarHBondContact O-N 3.29Å; V314-L318 WeakPolarHBondContact O-CB 2.94Å; V314-L318 PolarHBondContact O-N 2.79Å
315	L	91.5	Very high	85.1	Confident	105 Å²	105	90.1 Å²	90.1	55%	0.55	50%	0.503	S	S	.	.	H	α-helix	trans	-62.4	-39.3	176.5	-77.8	169	0	0	0	112.3	V311 L312 L318 A319	V311-L315 HydrophobicContact CG1-CD1 3.92Å; V311-L315 HydrophobicContact CG1-CG 4.44Å; V311-L315 WeakPolarHBondContact O-CB 3.36Å; V311-L315 VanDerWaalsContact O-CG 3.29Å; V311-L315 WeakPolarHBondContact O-CG 3.35Å; V311-L315 PolarHBondContact O-N 3.02Å; L312-L315 PolarHBondContact O-N 3.5Å; L315-L318 PolarHBondContact O-N 3.27Å; L315-A319 VanDerWaalsContact O-CB 3.3Å; L315-A319 WeakPolarHBondContact O-CB 3.49Å; L315-A319 PolarHBondContact O-N 2.84Å
316	I	92.1	Very high	86.4	Confident	95 Å²	95	90.1 Å²	90.1	49%	0.487	50%	0.495	S	S	.	.	H	α-helix	trans	-65.2	-42.8	174.6	-69.2	163.6	0	0	0	110.7	L312 T313 V314 L318 A319 T320	L312-I316 HydrophobicContact CD2-CD1 4.05Å; L312-I316 HydrophobicContact CG-CD1 4.14Å; L312-I316 WeakPolarHBondContact O-CB 3.23Å; L312-I316 WeakPolarHBondContact O-CD1 3.05Å; L312-I316 WeakPolarHBondContact O-CG1 3.5Å; L312-I316 PolarHBondContact O-N 3.46Å; T313-I316 PolarHBondContact O-N 2.77Å; V314-I316 VanDerWaalsContact C-N 3.34Å; V314-I316 PolarHBondContact O-N 3.46Å; I316-L318 VanDerWaalsContact C-N 3.35Å; I316-L318 PolarHBondContact O-N 3.02Å; I316-A319 PolarHBondContact O-N 3.02Å; I316-T320 HydrophobicContact CG2-CG2 4.44Å; I316-T320 WeakPolarHBondContact O-CB 3.38Å; I316-T320 VanDerWaalsContact O-CG2 3.29Å; I316-T320 WeakPolarHBondContact O-CG2 3.41Å; I316-T320 PolarHBondContact O-N 3.08Å; I316-T320 PolarHBondContact O-OG1 3.38Å
317	L	92.9	Very high	87.8	Confident	114 Å²	114	93.2 Å²	93.2	60%	0.597	50%	0.497	S	S	*	.	H	α-helix	trans	-62.7	-41.2	174.9	-77.3	168.1	0	0	0	111.9	T313 V314 T320 F321	T313-L317 WeakPolarHBondContact O-CB 3.45Å; T313-L317 WeakPolarHBondContact O-CG 3.43Å; T313-L317 PolarHBondContact O-N 2.73Å; V314-L317 PolarHBondContact O-N 3.29Å; L317-T320 WeakPolarHBondContact CA-OG1 3.42Å; L317-T320 PolarHBondContact O-N 3.48Å; L317-T320 PolarHBondContact O-OG1 3.26Å; L317-F321 VanDerWaalsContact O-CB 3.25Å; L317-F321 WeakPolarHBondContact O-CB 3.5Å; L317-F321 PolarHBondContact O-N 3.12Å
318	L	93.3	Very high	88.6	Confident	100 Å²	100	93.7 Å²	93.7	52%	0.524	50%	0.499	S	S	.	.	H	α-helix	trans	-67.3	-41.7	177.8	-131.6	147.2	0	0	0	111.1	V314 L315 I316 F321 L322	V314-L318 WeakPolarHBondContact O-CB 2.94Å; V314-L318 PolarHBondContact O-N 2.79Å; L315-L318 PolarHBondContact O-N 3.27Å; I316-L318 VanDerWaalsContact C-N 3.35Å; I316-L318 PolarHBondContact O-N 3.02Å; L318-F321 PolarHBondContact O-N 2.94Å; L318-L322 VanDerWaalsContact O-CB 3.27Å; L318-L322 WeakPolarHBondContact O-CB 3.45Å; L318-L322 PolarHBondContact O-N 2.78Å
319	A	91.5	Very high	89.2	Confident	53 Å²	53	92.5 Å²	92.5	44%	0.438	49%	0.493	S	S	.	.	H	α-helix	trans	-65.1	-42.2	175.9	0	0	0	0	0	112.4	L315 I316 L322 L323	L315-A319 VanDerWaalsContact O-CB 3.3Å; L315-A319 WeakPolarHBondContact O-CB 3.49Å; L315-A319 PolarHBondContact O-N 2.84Å; I316-A319 PolarHBondContact O-N 3.02Å; A319-L322 PolarHBondContact O-N 3.35Å; A319-L323 WeakPolarHBondContact O-CB 3.48Å; A319-L323 PolarHBondContact O-N 3.28Å
320	T	91.6	Very high	89.2	Confident	67 Å²	67	94.7 Å²	94.7	41%	0.411	50%	0.498	S	S	.	.	H	α-helix	trans	-66.7	-42.3	175.8	52	0	0	0	0	111.4	I316 L317 L322 L323 V324	I316-T320 HydrophobicContact CG2-CG2 4.44Å; I316-T320 WeakPolarHBondContact O-CB 3.38Å; I316-T320 VanDerWaalsContact O-CG2 3.29Å; I316-T320 WeakPolarHBondContact O-CG2 3.41Å; I316-T320 PolarHBondContact O-N 3.08Å; I316-T320 PolarHBondContact O-OG1 3.38Å; L317-T320 WeakPolarHBondContact CA-OG1 3.42Å; L317-T320 PolarHBondContact O-N 3.48Å; L317-T320 PolarHBondContact O-OG1 3.26Å; T320-L322 VanDerWaalsContact C-N 3.35Å; T320-L322 PolarHBondContact O-N 2.85Å; T320-L323 WeakPolarHBondContact O-CB 3.29Å; T320-L323 PolarHBondContact O-N 3.14Å; T320-V324 WeakPolarHBondContact O-CG2 3.28Å; T320-V324 PolarHBondContact O-N 2.8Å
321	F	92.3	Very high	89	Confident	135 Å²	135	98.3 Å²	98.3	59%	0.592	50%	0.502	S	S	*	.	H	α-helix	trans	-59.9	-44.1	173.6	-176.5	-109.5	0	0	0	112	L317 L318 L323 V324 I325	L317-F321 VanDerWaalsContact O-CB 3.25Å; L317-F321 WeakPolarHBondContact O-CB 3.5Å; L317-F321 PolarHBondContact O-N 3.12Å; L318-F321 PolarHBondContact O-N 2.94Å; F321-L323 PolarHBondContact O-N 3.4Å; F321-V324 PolarHBondContact O-N 3.28Å; F321-I325 HydrophobicContact CD1-CD1 3.68Å; F321-I325 HydrophobicContact CE1-CD1 3.29Å; F321-I325 HydrophobicContact CE1-CG1 4.27Å; F321-I325 HydrophobicContact CE2-CD1 4.49Å; F321-I325 HydrophobicContact CG-CD1 4.45Å; F321-I325 HydrophobicContact CZ-CD1 3.75Å; F321-I325 HydrophobicContact CZ-CG1 4.36Å; F321-I325 WeakPolarHBondContact O-CG1 3.37Å; F321-I325 PolarHBondContact O-N 3.5Å
322	L	91.6	Very high	88.3	Confident	91 Å²	91	100 Å²	100	48%	0.476	51%	0.506	S	S	.	.	H	α-helix	trans	-66.3	-38.4	177.8	-152.9	150.3	0	0	0	111.3	L318 A319 T320 I325 L326	L318-L322 VanDerWaalsContact O-CB 3.27Å; L318-L322 WeakPolarHBondContact O-CB 3.45Å; L318-L322 PolarHBondContact O-N 2.78Å; A319-L322 PolarHBondContact O-N 3.35Å; T320-L322 VanDerWaalsContact C-N 3.35Å; T320-L322 PolarHBondContact O-N 2.85Å; L322-I325 PolarHBondContact O-N 3.49Å; L322-L326 HydrophobicContact CD2-CD1 3.68Å; L322-L326 HydrophobicContact CD2-CG 4.07Å; L322-L326 WeakPolarHBondContact O-CB 3.48Å; L322-L326 VanDerWaalsContact O-CG 3.28Å; L322-L326 WeakPolarHBondContact O-CG 3.26Å; L322-L326 PolarHBondContact O-N 2.8Å
323	L	91.4	Very high	87.3	Confident	117 Å²	117	104 Å²	104	61%	0.613	51%	0.514	S	S	*	.	H	α-helix	trans	-62.2	-41.1	170.8	-98.9	162.1	0	0	0	112.6	A319 T320 F321 L326 Y327	A319-L323 WeakPolarHBondContact O-CB 3.48Å; A319-L323 PolarHBondContact O-N 3.28Å; T320-L323 WeakPolarHBondContact O-CB 3.29Å; T320-L323 PolarHBondContact O-N 3.14Å; F321-L323 PolarHBondContact O-N 3.4Å; L323-L326 PolarHBondContact O-N 2.85Å; L323-Y327 VanDerWaalsContact O-CB 3.28Å; L323-Y327 WeakPolarHBondContact O-CB 3.44Å; L323-Y327 PolarHBondContact O-N 3.38Å
324	V	90.5	Very high	85.9	Confident	84 Å²	84	108.8 Å²	108.8	51%	0.509	53%	0.529	S	S	.	.	H	α-helix	trans	-64.4	-44.4	174.9	170.5	0	0	0	0	110.4	T320 F321 L326 Y327 M328	T320-V324 WeakPolarHBondContact O-CG2 3.28Å; T320-V324 PolarHBondContact O-N 2.8Å; F321-V324 PolarHBondContact O-N 3.28Å; V324-L326 PolarHBondContact O-N 3.13Å; V324-Y327 PolarHBondContact O-N 2.85Å; V324-M328 HydrophobicContact CG1-CG 4.29Å; V324-M328 WeakPolarHBondContact O-CB 3.24Å; V324-M328 WeakPolarHBondContact O-CG 3.01Å; V324-M328 PolarHBondContact O-N 3.2Å
325	I	88.2	Confident	84	Confident	71 Å²	71	108.8 Å²	108.8	36%	0.364	53%	0.533	S	S	.	.	H	α-helix	trans	-59.2	-49.1	174.1	-71.1	170.3	0	0	0	110.2	F321 L322 Y327 M328 L329	F321-I325 HydrophobicContact CD1-CD1 3.68Å; F321-I325 HydrophobicContact CE1-CD1 3.29Å; F321-I325 HydrophobicContact CE1-CG1 4.27Å; F321-I325 HydrophobicContact CE2-CD1 4.49Å; F321-I325 HydrophobicContact CG-CD1 4.45Å; F321-I325 HydrophobicContact CZ-CD1 3.75Å; F321-I325 HydrophobicContact CZ-CG1 4.36Å; F321-I325 WeakPolarHBondContact O-CG1 3.37Å; F321-I325 PolarHBondContact O-N 3.5Å; L322-I325 PolarHBondContact O-N 3.49Å; I325-Y327 VanDerWaalsContact C-N 3.31Å; I325-Y327 PolarHBondContact O-N 3.5Å; I325-M328 CarbonylContact O-C 3.44Å; I325-M328 PolarHBondContact O-N 2.76Å; I325-L329 HydrophobicContact CG2-CD1 3.74Å; I325-L329 HydrophobicContact CG2-CG 4.13Å; I325-L329 WeakPolarHBondContact O-CB 3.39Å; I325-L329 VanDerWaalsContact O-CG 3.26Å; I325-L329 WeakPolarHBondContact O-CG 3.34Å; I325-L329 PolarHBondContact O-N 3.2Å
326	L	90.2	Very high	81.9	Confident	95 Å²	95	112.9 Å²	112.9	50%	0.497	54%	0.541	S	S	.	.	H	α-helix	trans	-62.1	-39.3	178.7	-73.2	173.7	0	0	0	111.9	L322 L323 V324 L329 K330	L322-L326 HydrophobicContact CD2-CD1 3.68Å; L322-L326 HydrophobicContact CD2-CG 4.07Å; L322-L326 WeakPolarHBondContact O-CB 3.48Å; L322-L326 VanDerWaalsContact O-CG 3.28Å; L322-L326 WeakPolarHBondContact O-CG 3.26Å; L322-L326 PolarHBondContact O-N 2.8Å; L323-L326 PolarHBondContact O-N 2.85Å; V324-L326 PolarHBondContact O-N 3.13Å; L326-L329 PolarHBondContact O-N 2.64Å; L326-K330 VanDerWaalsContact O-CB 3.24Å; L326-K330 WeakPolarHBondContact O-CB 3.49Å; L326-K330 PolarHBondContact O-N 2.87Å
327	Y	89.2	Confident	79.6	Confident	147 Å²	147	119 Å²	119	58%	0.576	56%	0.558	S	S	*	*	H	α-helix	trans	-63.2	-45.9	173.7	176.3	-100.5	0	0	0	111.4	L323 V324 I325 K330 R331	L323-Y327 VanDerWaalsContact O-CB 3.28Å; L323-Y327 WeakPolarHBondContact O-CB 3.44Å; L323-Y327 PolarHBondContact O-N 3.38Å; V324-Y327 PolarHBondContact O-N 2.85Å; I325-Y327 VanDerWaalsContact C-N 3.31Å; I325-Y327 PolarHBondContact O-N 3.5Å; Y327-K330 PolarHBondContact O-N 3.5Å; Y327-R331 VanDerWaalsContact O-CB 3.3Å; Y327-R331 WeakPolarHBondContact O-CB 3.44Å; Y327-R331 PolarHBondContact O-N 3.36Å
328	M	85.5	Confident	76.9	Confident	102 Å²	102	121.1 Å²	121.1	50%	0.502	56%	0.564	S	S	.	*	H	α-helix	trans	-63.5	-44	176.5	-70.8	-65.4	-91.2	0	0	111.1	V324 I325 K330 R331 Q332	V324-M328 HydrophobicContact CG1-CG 4.29Å; V324-M328 WeakPolarHBondContact O-CB 3.24Å; V324-M328 WeakPolarHBondContact O-CG 3.01Å; V324-M328 PolarHBondContact O-N 3.2Å; I325-M328 CarbonylContact O-C 3.44Å; I325-M328 PolarHBondContact O-N 2.76Å; M328-K330 PolarHBondContact O-N 3.27Å; M328-R331 PolarHBondContact O-N 2.87Å; M328-Q332 WeakPolarHBondContact O-CB 3.48Å; M328-Q332 PolarHBondContact O-N 3.08Å
329	L	85.6	Confident	74.5	Confident	73 Å²	73	120.2 Å²	120.2	38%	0.382	57%	0.572	S	S	.	*	H	α-helix	trans	-62.6	-40.5	174.1	-71.8	173.1	0	0	0	111.6	I325 L326 Q332 R333	I325-L329 HydrophobicContact CG2-CD1 3.74Å; I325-L329 HydrophobicContact CG2-CG 4.13Å; I325-L329 WeakPolarHBondContact O-CB 3.39Å; I325-L329 VanDerWaalsContact O-CG 3.26Å; I325-L329 WeakPolarHBondContact O-CG 3.34Å; I325-L329 PolarHBondContact O-N 3.2Å; L326-L329 PolarHBondContact O-N 2.64Å; L329-Q332 PolarHBondContact O-N 2.79Å; L329-R333 VanDerWaalsContact O-CB 3.27Å; L329-R333 WeakPolarHBondContact O-CB 2.97Å; L329-R333 VanDerWaalsContact O-CG 3.24Å; L329-R333 WeakPolarHBondContact O-CG 3.31Å; L329-R333 PolarHBondContact O-N 2.91Å
330	K	81.5	Confident	71.9	Confident	151 Å²	151	122.8 Å²	122.8	66%	0.657	58%	0.582	S	S	*	*	H	α-helix	trans	-68.2	-39.7	176.7	-165.8	177.4	-176.7	179.2	0	111.3	L326 Y327 M328 R333 K334	L326-K330 VanDerWaalsContact O-CB 3.24Å; L326-K330 WeakPolarHBondContact O-CB 3.49Å; L326-K330 PolarHBondContact O-N 2.87Å; Y327-K330 PolarHBondContact O-N 3.5Å; M328-K330 PolarHBondContact O-N 3.27Å; K330-R333 PolarHBondContact O-N 2.9Å; K330-K334 PolarHBondContact O-N 3.47Å
331	R	80	Confident	69.6	Low	161 Å²	161	125.8 Å²	125.8	61%	0.608	60%	0.6	S	S	*	*	H	α-helix	trans	-64.7	-44.9	173.3	-174.6	179.1	179.2	-175.5	0.6	111	Y327 M328 K334 S335	Y327-R331 VanDerWaalsContact O-CB 3.3Å; Y327-R331 WeakPolarHBondContact O-CB 3.44Å; Y327-R331 PolarHBondContact O-N 3.36Å; M328-R331 PolarHBondContact O-N 2.87Å; R331-K334 CarbonylContact O-C 3.51Å; R331-K334 WeakPolarHBondContact O-CB 3.3Å; R331-K334 PolarHBondContact O-N 3.42Å; R331-S335 PolarHBondContact O-N 2.89Å
332	Q	69.8	Low	67.2	Low	102 Å²	102	122.8 Å²	122.8	48%	0.477	59%	0.593	S	S	.	*	H	α-helix	trans	-68.5	-35.4	178.3	-154	-176.1	25.7	0	0	111.2	M328 L329 S335 R336	M328-Q332 WeakPolarHBondContact O-CB 3.48Å; M328-Q332 PolarHBondContact O-N 3.08Å; L329-Q332 PolarHBondContact O-N 2.79Å; Q332-S335 CarbonylContact O-C 3.54Å; Q332-S335 WeakPolarHBondContact O-CB 3.37Å; Q332-S335 PolarHBondContact O-N 3.45Å; Q332-R336 WeakPolarHBondContact O-CB 3.3Å; Q332-R336 WeakPolarHBondContact O-CG 3.42Å; Q332-R336 PolarHBondContact O-N 2.88Å
333	R	66	Low	64.7	Low	185 Å²	185	129.8 Å²	129.8	70%	0.698	61%	0.613	S	S	*	*	H	α-helix	trans	-65.7	-39.8	169.4	-78.3	179.2	-176	-178.8	2.8	112.1	L329 K330 S335 R336 R337	L329-R333 VanDerWaalsContact O-CB 3.27Å; L329-R333 WeakPolarHBondContact O-CB 2.97Å; L329-R333 VanDerWaalsContact O-CG 3.24Å; L329-R333 WeakPolarHBondContact O-CG 3.31Å; L329-R333 PolarHBondContact O-N 2.91Å; K330-R333 PolarHBondContact O-N 2.9Å; R333-S335 VanDerWaalsContact C-N 3.31Å; R333-R336 PolarHBondContact O-N 3.46Å; R333-R337 PolarHBondContact O-N 2.88Å; R333-R337 VanDerWaalsContact O-N 3.17Å
334	K	58.4	Low	62.7	Low	161 Å²	161	127 Å²	127	70%	0.7	60%	0.6	S	S	*	*	H	α-helix	trans	-62.5	-39.4	171	-94.3	-171.9	173.3	-173.6	0	111.3	K330 R331	K330-K334 PolarHBondContact O-N 3.47Å; R331-K334 CarbonylContact O-C 3.51Å; R331-K334 WeakPolarHBondContact O-CB 3.3Å; R331-K334 PolarHBondContact O-N 3.42Å
335	S	51.9	Low	60.6	Low	75 Å²	75	127.8 Å²	127.8	52%	0.524	60%	0.602	S	S	.	*	H	α-helix	trans	-68.9	-42.7	176.4	-157.9	0	0	0	0	112.5	R331 Q332 R333 R337 Q338	R331-S335 PolarHBondContact O-N 2.89Å; Q332-S335 CarbonylContact O-C 3.54Å; Q332-S335 WeakPolarHBondContact O-CB 3.37Å; Q332-S335 PolarHBondContact O-N 3.45Å; R333-S335 VanDerWaalsContact C-N 3.31Å; S335-R337 VanDerWaalsContact C-N 3.25Å; S335-R337 PolarHBondContact O-N 2.89Å; S335-Q338 WeakPolarHBondContact O-CB 3.07Å; S335-Q338 PolarHBondContact O-N 3.08Å
336	R	47.3	Very low	58.9	Low	192 Å²	192	131.2 Å²	131.2	73%	0.725	62%	0.619	S	S	*	*	H	α-helix	trans	-69.1	-17.9	178.3	-78.7	-171.8	-179.6	-168.4	1.5	113.8	Q332 R333 Q338 A339	Q332-R336 WeakPolarHBondContact O-CB 3.3Å; Q332-R336 WeakPolarHBondContact O-CG 3.42Å; Q332-R336 PolarHBondContact O-N 2.88Å; R333-R336 PolarHBondContact O-N 3.46Å; R336-Q338 PolarHBondContact O-N 3.35Å; R336-A339 PolarHBondContact O-N 2.98Å
337	R	43.5	Very low	57.2	Low	223 Å²	223	134.4 Å²	134.4	84%	0.842	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-16.1	170	-80.2	-174.6	179.8	-170.7	-0.6	112.7	R333 S335 A339	R333-R337 PolarHBondContact O-N 2.88Å; R333-R337 VanDerWaalsContact O-N 3.17Å; S335-R337 VanDerWaalsContact C-N 3.25Å; S335-R337 PolarHBondContact O-N 2.89Å; R337-A339 PolarHBondContact O-N 2.79Å; R337-A339 VanDerWaalsContact O-N 3.14Å
338	Q	35.7	Very low	56.1	Low	158 Å²	158	134 Å²	134	74%	0.738	64%	0.64	S	S	*	*			trans	-85.2	66.2	164.4	-67.8	177	-24.9	0	0	108.6	S335 R336 T340	S335-Q338 WeakPolarHBondContact O-CB 3.07Å; S335-Q338 PolarHBondContact O-N 3.08Å; R336-Q338 PolarHBondContact O-N 3.35Å; Q338-T340 PolarHBondContact O-N 2.95Å; Q338-T340 VanDerWaalsContact O-N 3.07Å
339	A	42.2	Very low	55.8	Low	82 Å²	82	132 Å²	132	68%	0.678	63%	0.631	S	S	*	*			trans	-66.8	102.9	161.5	0	0	0	0	0	106.5	R336 R337 V341	R336-A339 PolarHBondContact O-N 2.98Å; R337-A339 PolarHBondContact O-N 2.79Å; R337-A339 VanDerWaalsContact O-N 3.14Å; A339-V341 PolarHBondContact O-N 2.88Å
340	T	37.3	Very low	55.9	Low	107 Å²	107	129.7 Å²	129.7	66%	0.656	62%	0.619	S	S	*	*			trans	-65.6	103.2	171.5	34.3	0	0	0	0	108.1	Q338 V342	Q338-T340 PolarHBondContact O-N 2.95Å; Q338-T340 VanDerWaalsContact O-N 3.07Å; T340-V342 PolarHBondContact O-N 2.91Å
341	V	42.5	Very low	56.3	Low	129 Å²	129	125.2 Å²	125.2	78%	0.782	60%	0.6	S	S	*	*			trans	-62.2	105.4	166.9	-178.9	0	0	0	0	106.7	A339 R343	A339-V341 PolarHBondContact O-N 2.88Å; V341-R343 PolarHBondContact O-N 3.33Å
342	V	43.7	Very low	56.8	Low	73 Å²	73	117.6 Å²	117.6	44%	0.442	57%	0.571	S	S	.	*			trans	-65.8	107.2	172.7	178.9	0	0	0	0	106.7	T340 V344	T340-V342 PolarHBondContact O-N 2.91Å; V342-V344 VanDerWaalsContact C-N 3.34Å; V342-V344 HydrophobicContact CG1-CG2 4.14Å; V342-V344 PolarHBondContact O-N 3.44Å
343	R	38.6	Very low	57.9	Low	237 Å²	237	112.8 Å²	112.8	89%	0.894	55%	0.549	S	S	*	.			trans	-74.3	93	168.9	-70.8	-173.2	-178.2	176.4	0.6	107.3	V341 N345	V341-R343 PolarHBondContact O-N 3.33Å; R343-N345 PolarHBondContact O-N 2.87Å
344	V	49.1	Very low	59.1	Low	59 Å²	59	104.1 Å²	104.1	36%	0.358	52%	0.516	S	S	.	.			trans	-65.3	125.5	168.6	-176.9	0	0	0	0	107.3	V342 I346 A379	V342-V344 VanDerWaalsContact C-N 3.34Å; V342-V344 HydrophobicContact CG1-CG2 4.14Å; V342-V344 PolarHBondContact O-N 3.44Å; V344-I346 PolarHBondContact O-N 3.39Å; V344-I346 VanDerWaalsContact O-N 3.12Å; V344-A379 HydrophobicContact CG1-CB 4.32Å
345	N	47.4	Very low	60.4	Low	101 Å²	101	96.9 Å²	96.9	54%	0.54	49%	0.485	S	S	.	.			trans	-70.9	106.6	173.3	-173.1	3.8	0	0	0	108.1	R343 Q347 N348	R343-N345 PolarHBondContact O-N 2.87Å; N345-Q347 PolarHBondContact O-N 2.83Å; N345-Q347 PolarHBondContact OD1-N 3.22Å; N345-N348 PolarHBondContact O-N 3.39Å
346	I	51.7	Low	62	Low	142 Å²	142	93.7 Å²	93.7	73%	0.728	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-18.9	-175.5	-59.8	163.7	0	0	0	112.1	V344 N348	V344-I346 PolarHBondContact O-N 3.39Å; V344-I346 VanDerWaalsContact O-N 3.12Å; I346-N348 PolarHBondContact O-N 3.5Å
347	Q	54.6	Low	63.4	Low	163 Å²	163	84.5 Å²	84.5	76%	0.762	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-25.8	-174.7	-66.5	-176	-12.4	0	0	114.7	N345	N345-Q347 PolarHBondContact O-N 2.83Å; N345-Q347 PolarHBondContact OD1-N 3.22Å
348	N	66	Low	64.7	Low	138 Å²	138	75 Å²	75	74%	0.738	39%	0.392	S	S	*	.	S	Bend	trans	-130.2	77.8	179.3	-73.2	-13.4	0	0	0	109.7	N345 I346	N345-N348 PolarHBondContact O-N 3.39Å; I346-N348 PolarHBondContact O-N 3.5Å
349	L	79.4	Confident	66.4	Low	61 Å²	61	68.7 Å²	68.7	32%	0.319	36%	0.364	S	S	.	.			trans	-66.1	139.1	171.9	-57.7	173.9	0	0	0	109.4	K351 A379 E381	L349-K351 PolarHBondContact O-N 2.89Å; L349-A379 HydrophobicContact CD2-CB 4.07Å; L349-A379 WeakPolarHBondContact CD2-O 3.42Å; L349-E381 HydrophobicContact CB-CB 4.24Å
350	V	87	Confident	67.9	Low	23 Å²	23	65.7 Å²	65.7	14%	0.139	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	122.7	176	175.8	0	0	0	0	108.8	V352 C380 E381 N408 F409 L500	V350-V352 HydrophobicContact CG1-CG2 4.16Å; V350-C380 CarbonylContact O-C 3.57Å; V350-C380 WeakPolarHBondContact O-CA 3.27Å; V350-C380 WeakPolarHBondContact O-CB 3.44Å; V350-E381 PolarHBondContact O-N 3.38Å; V350-N408 HydrophobicContact CG1-CB 4.48Å; V350-F409 HydrophobicContact CG1-CD2 3.24Å; V350-F409 HydrophobicContact CG1-CE2 3.37Å; V350-F409 HydrophobicContact CG1-CG 4.48Å; V350-L500 HydrophobicContact CG1-CD2 4.41Å
351	K	89.8	Confident	70	Confident	58 Å²	58	65.9 Å²	65.9	25%	0.252	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	114.1	-179.7	-56.2	-172.5	179.7	-157.4	0	110.6	L349 E381 M383 K406 N408 F409	L349-K351 PolarHBondContact O-N 2.89Å; K351-E381 CarbonylContact C-O 3.54Å; K351-E381 WeakPolarHBondContact CA-O 3.29Å; K351-E381 WeakPolarHBondContact CE-OE2 3.45Å; K351-E381 HydrophobicContact CG-CB 4.18Å; K351-E381 IonicContact NZ-OE1 3.63Å; K351-E381 IonicContact NZ-OE2 2.89Å; K351-M383 HydrophobicContact CB-CE 4.04Å; K351-K406 HydrophobicContact CD-CB 4.5Å; K351-K406 WeakPolarHBondContact CD-O 3.11Å; K351-N408 VanDerWaalsContact CB-OD1 3.3Å; K351-N408 WeakPolarHBondContact CB-OD1 3.49Å; K351-N408 PolarHBondContact N-OD1 3.4Å; K351-N408 WeakPolarHBondContact O-CB 3.33Å; K351-N408 PolarHBondContact O-N 3.37Å; K351-F409 PolarHBondContact O-N 3.07Å
352	V	91.3	Very high	71.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	118.2	-179	-175.5	0	0	0	0	109	V350 L374 C380 E381 V382 M383 F409 L411 L500	V350-V352 HydrophobicContact CG1-CG2 4.16Å; V352-L374 HydrophobicContact CG1-CD1 4.3Å; V352-C380 HydrophobicContact CG2-CB 4.1Å; V352-E381 PolarHBondContact N-O 2.69Å; V352-V382 WeakPolarHBondContact O-CA 3.34Å; V352-M383 PolarHBondContact O-N 3.4Å; V352-F409 WeakPolarHBondContact CA-O 3.33Å; V352-F409 HydrophobicContact CG2-CB 4.35Å; V352-L411 HydrophobicContact CG1-CB 3.8Å; V352-L411 HydrophobicContact CG1-CD2 4.3Å; V352-L500 HydrophobicContact CG2-CD1 4.34Å; V352-L500 HydrophobicContact CG2-CD2 3.85Å
353	F	92.1	Very high	73.9	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.009	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	114.2	167.9	-175.6	-156.8	0	0	0	109.4	L355 M383 W399 L400 C403 M404 A407 F409 Y410 L411	F353-L355 HydrophobicContact CD1-CD1 4.2Å; F353-L355 HydrophobicContact CD1-CG 4.25Å; F353-L355 HydrophobicContact CE1-CD1 3.89Å; F353-L355 HydrophobicContact CE1-CD2 3.87Å; F353-L355 HydrophobicContact CE1-CG 3.89Å; F353-L355 HydrophobicContact CE2-CD2 3.98Å; F353-L355 HydrophobicContact CE2-CG 4.21Å; F353-L355 HydrophobicContact CZ-CD1 4.34Å; F353-L355 HydrophobicContact CZ-CD2 3.46Å; F353-L355 VanDerWaalsContact CZ-CD2 3.46Å; F353-L355 HydrophobicContact CZ-CG 3.87Å; F353-M383 HydrophobicContact CB-CE 4.03Å; F353-M383 HydrophobicContact CD2-CB 4.15Å; F353-W399 AromaticContact CE2-CH2 3.84Å; F353-W399 HydrophobicContact CE2-CH2 3.84Å; F353-W399 HydrophobicContact CE2-CZ3 4.1Å; F353-W399 HydrophobicContact CZ-CZ3 4.44Å; F353-L400 HydrophobicContact CE1-CD1 3.81Å; F353-L400 HydrophobicContact CZ-CD1 3.53Å; F353-C403 HydrophobicContact CD1-CB 4.09Å; F353-C403 HydrophobicContact CD2-CB 3.96Å; F353-C403 HydrophobicContact CE1-CB 4.04Å; F353-C403 HydrophobicContact CE2-CB 3.91Å; F353-C403 HydrophobicContact CG-CB 4.07Å; F353-C403 HydrophobicContact CZ-CB 3.95Å; F353-M404 HydrophobicContact CD1-SD 4.18Å; F353-M404 HydrophobicContact CE1-CG 4.34Å; F353-M404 HydrophobicContact CE1-SD 3.91Å; F353-A407 HydrophobicContact CB-CB 3.67Å; F353-F409 PolarHBondContact N-O 3.04Å; F353-Y410 HydrophobicContact CB-CD1 4.38Å; F353-Y410 AromaticContact CD1-CD1 3.95Å; F353-Y410 HydrophobicContact CD1-CD1 3.95Å; F353-Y410 HydrophobicContact CD1-CE1 4.25Å; F353-L411 PolarHBondContact O-N 2.83Å
354	L	90.6	Very high	76.1	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	110.9	-177.6	178.4	56	0	0	0	110.2	V367 L370 A371 V382 M383 L384 L411 L413	L354-V367 HydrophobicContact CD2-CG1 3.77Å; L354-V367 HydrophobicContact CG-CG1 4.18Å; L354-L370 HydrophobicContact CD1-CD2 4.46Å; L354-A371 HydrophobicContact CD2-CB 4.03Å; L354-V382 HydrophobicContact CB-CG1 4.15Å; L354-V382 HydrophobicContact CD2-CG1 4.45Å; L354-M383 PolarHBondContact N-O 2.85Å; L354-L384 HydrophobicContact CB-CD1 4.42Å; L354-L384 HydrophobicContact CD2-CD1 4.15Å; L354-L384 HydrophobicContact CG-CD1 4.22Å; L354-L411 WeakPolarHBondContact CA-O 3.38Å; L354-L411 HydrophobicContact CD1-CB 4.2Å; L354-L411 HydrophobicContact CD1-CD2 3.81Å; L354-L411 HydrophobicContact CD1-CG 3.72Å; L354-L413 HydrophobicContact CD1-CB 4.39Å
355	L	87.6	Confident	77.9	Confident	10 Å²	10	47.6 Å²	47.6	5%	0.052	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	137.5	175.5	-72.4	166.8	0	0	0	109.4	F353 L411 L412 L413 A442 V446	F353-L355 HydrophobicContact CD1-CD1 4.2Å; F353-L355 HydrophobicContact CD1-CG 4.25Å; F353-L355 HydrophobicContact CE1-CD1 3.89Å; F353-L355 HydrophobicContact CE1-CD2 3.87Å; F353-L355 HydrophobicContact CE1-CG 3.89Å; F353-L355 HydrophobicContact CE2-CD2 3.98Å; F353-L355 HydrophobicContact CE2-CG 4.21Å; F353-L355 HydrophobicContact CZ-CD1 4.34Å; F353-L355 HydrophobicContact CZ-CD2 3.46Å; F353-L355 VanDerWaalsContact CZ-CD2 3.46Å; F353-L355 HydrophobicContact CZ-CG 3.87Å; L355-L411 PolarHBondContact N-O 2.82Å; L355-L412 HydrophobicContact CB-CD1 4.45Å; L355-L412 HydrophobicContact CB-CG 4.14Å; L355-L412 HydrophobicContact CD1-CD1 4.12Å; L355-L412 HydrophobicContact CD1-CG 4.41Å; L355-L412 CarbonylContact O-C 3.57Å; L355-L412 VanDerWaalsContact O-CA 3.31Å; L355-L412 WeakPolarHBondContact O-CA 3.39Å; L355-L413 PolarHBondContact O-N 2.91Å; L355-A442 HydrophobicContact CD1-CB 4.36Å; L355-A442 HydrophobicContact CD2-CB 3.95Å; L355-V446 HydrophobicContact CD1-CG2 3.96Å
356	Y	85.4	Confident	79.9	Confident	7 Å²	7	42.8 Å²	42.8	3%	0.027	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	151.7	-179.7	65.7	-78.3	0	0	0	110.9	H358 Y363 V367 L384 D385 E386 L413 W439	Y356-H358 HydrophobicContact CE2-CB 4.48Å; Y356-Y363 HydrophobicContact CD2-CD1 4.2Å; Y356-Y363 AromaticContact CD2-CE1 3.98Å; Y356-Y363 HydrophobicContact CD2-CE1 3.98Å; Y356-Y363 HydrophobicContact CG-CE1 4.5Å; Y356-V367 HydrophobicContact CD1-CB 4.38Å; Y356-V367 HydrophobicContact CD1-CG1 3.5Å; Y356-V367 VanDerWaalsContact CD1-CG1 3.5Å; Y356-V367 HydrophobicContact CD1-CG2 4.12Å; Y356-V367 HydrophobicContact CD2-CB 4.39Å; Y356-V367 HydrophobicContact CD2-CG1 4.34Å; Y356-V367 HydrophobicContact CD2-CG2 3.57Å; Y356-V367 HydrophobicContact CE1-CG1 3.78Å; Y356-V367 HydrophobicContact CE2-CG2 4.2Å; Y356-V367 HydrophobicContact CG-CB 4.25Å; Y356-V367 HydrophobicContact CG-CG1 3.81Å; Y356-V367 HydrophobicContact CG-CG2 3.52Å; Y356-L384 HydrophobicContact CD1-CD1 4.18Å; Y356-L384 HydrophobicContact CE1-CD1 3.73Å; Y356-D385 WeakPolarHBondContact CE1-OD1 3.46Å; Y356-D385 PolarHBondContact OH-OD1 2.92Å; Y356-D385 VanDerWaalsContact OH-OD1 3.07Å; Y356-D385 PolarHBondContact OH-OD2 2.82Å; Y356-E386 WeakPolarHBondContact OH-CG 3.39Å; Y356-E386 PolarHBondContact OH-OE1 3.32Å; Y356-L413 WeakPolarHBondContact CA-O 3.06Å; Y356-W439 VanDerWaalsContact C-NE1 3.3Å; Y356-W439 PolarHBondContact O-NE1 3.03Å
357	S	75.8	Confident	81.8	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.181	C	C	.	.			trans	-76.6	126.7	172.8	64.4	0	0	0	0	110.2	D359 Y363 S415 V418	S357-D359 VanDerWaalsContact CB-OD1 3.26Å; S357-D359 WeakPolarHBondContact CB-OD1 3.06Å; S357-D359 PolarHBondContact O-N 3.47Å; S357-D359 PolarHBondContact OG-OD1 2.88Å; S357-Y363 WeakPolarHBondContact O-CD1 3.38Å; S357-Y363 WeakPolarHBondContact O-CE1 3.45Å; S357-S415 PolarHBondContact OG-N 3.36Å; S357-V418 WeakPolarHBondContact OG-CG2 3.24Å
358	H	71.8	Confident	83.5	Confident	23 Å²	23	30 Å²	30	11%	0.106	16%	0.155	C	C	.	.			trans	-78	96.5	175.7	-177.7	-70.3	0	0	0	110.3	Y356 C364 R433	Y356-H358 HydrophobicContact CE2-CB 4.48Å; H358-C364 PolarHBondContact CD2-SG 3.23Å; H358-R433 PolarHBondContact NE2-NE 3.21Å
359	D	70	Confident	84.7	Confident	26 Å²	26	23.9 Å²	23.9	14%	0.139	12%	0.124	C	C	.	.			trans	-100.8	-36.3	-177.4	-65.2	8.4	0	0	0	113.1	S357 S415 G417	S357-D359 VanDerWaalsContact CB-OD1 3.26Å; S357-D359 WeakPolarHBondContact CB-OD1 3.06Å; S357-D359 PolarHBondContact O-N 3.47Å; S357-D359 PolarHBondContact OG-OD1 2.88Å; D359-S415 WeakPolarHBondContact OD2-CA 3.46Å; D359-S415 WeakPolarHBondContact OD2-CB 3.44Å; D359-S415 PolarHBondContact OD2-OG 3.25Å; D359-G417 WeakPolarHBondContact OD2-CA 3.49Å; D359-G417 PolarHBondContact OD2-N 2.91Å
360	S	75.3	Confident	85.3	Confident	19 Å²	19	21 Å²	21	13%	0.133	11%	0.109	C	C	.	.			trans	-162.8	160.7	179.6	59.1	0	0	0	0	110.6	Q362 Y363 C364	S360-Q362 VanDerWaalsContact C-N 3.25Å; S360-Q362 PolarHBondContact O-N 3.36Å; S360-Y363 WeakPolarHBondContact O-CB 3.27Å; S360-Y363 PolarHBondContact O-N 2.94Å; S360-Y363 VanDerWaalsContact O-N 3.13Å; S360-Y363 WeakPolarHBondContact OG-CB 3.14Å; S360-Y363 PolarHBondContact OG-N 3.42Å; S360-C364 PolarHBondContact O-N 3.47Å; S360-C364 VanDerWaalsContact O-N 3.13Å; S360-C364 PolarHBondContact O-SG 3.23Å
361	E	79.9	Confident	85.6	Confident	110 Å²	110	20 Å²	20	51%	0.514	10%	0.102	S	C	.	.	H	α-helix	trans	-57.2	-39.4	174.4	-172.2	-172.9	-160.3	0	0	112	Y363 C364 D365	E361-Y363 VanDerWaalsContact C-N 3.29Å; E361-Y363 PolarHBondContact O-N 3.46Å; E361-C364 WeakPolarHBondContact O-CA 3.27Å; E361-C364 VanDerWaalsContact O-CB 3.27Å; E361-C364 WeakPolarHBondContact O-CB 3.38Å; E361-C364 PolarHBondContact O-N 3.44Å; E361-C364 VanDerWaalsContact O-N 3.07Å; E361-D365 PolarHBondContact O-N 3.2Å
362	Q	83.1	Confident	85.7	Confident	24 Å²	24	20 Å²	20	11%	0.112	11%	0.105	C	C	.	.	H	α-helix	trans	-72.1	-26.3	-179.2	-57.6	83	38.1	0	0	112.5	S360 D365 V366 Y526	S360-Q362 VanDerWaalsContact C-N 3.25Å; S360-Q362 PolarHBondContact O-N 3.36Å; Q362-D365 WeakPolarHBondContact O-CB 3.47Å; Q362-D365 PolarHBondContact O-N 3.36Å; Q362-V366 WeakPolarHBondContact O-CG2 3.07Å; Q362-V366 PolarHBondContact O-N 2.86Å; Q362-Y526 HydrophobicContact CB-CD2 4.39Å
363	Y	84.9	Confident	85.6	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-70	-36.8	169.9	-174.5	-107.7	0	0	0	111.3	Y356 S357 S360 E361 D365 V366 V367 L413 S415 L467 Y526	Y356-Y363 HydrophobicContact CD2-CD1 4.2Å; Y356-Y363 AromaticContact CD2-CE1 3.98Å; Y356-Y363 HydrophobicContact CD2-CE1 3.98Å; Y356-Y363 HydrophobicContact CG-CE1 4.5Å; S357-Y363 WeakPolarHBondContact O-CD1 3.38Å; S357-Y363 WeakPolarHBondContact O-CE1 3.45Å; S360-Y363 WeakPolarHBondContact O-CB 3.27Å; S360-Y363 PolarHBondContact O-N 2.94Å; S360-Y363 VanDerWaalsContact O-N 3.13Å; S360-Y363 WeakPolarHBondContact OG-CB 3.14Å; S360-Y363 PolarHBondContact OG-N 3.42Å; E361-Y363 VanDerWaalsContact C-N 3.29Å; E361-Y363 PolarHBondContact O-N 3.46Å; Y363-D365 VanDerWaalsContact C-N 3.28Å; Y363-D365 PolarHBondContact O-N 3.18Å; Y363-V366 WeakPolarHBondContact O-CB 3.49Å; Y363-V366 PolarHBondContact O-N 3.23Å; Y363-V366 VanDerWaalsContact O-N 3.09Å; Y363-V367 HydrophobicContact CD1-CG2 4.18Å; Y363-V367 HydrophobicContact CE1-CG2 3.9Å; Y363-V367 WeakPolarHBondContact O-CG2 3.39Å; Y363-V367 PolarHBondContact O-N 3.47Å; Y363-L413 HydrophobicContact CE2-CD2 4.35Å; Y363-L413 VanDerWaalsContact OH-C 3.3Å; Y363-L413 WeakPolarHBondContact OH-CD2 3.23Å; Y363-L413 VanDerWaalsContact OH-CG 3.23Å; Y363-L413 WeakPolarHBondContact OH-CG 3.1Å; Y363-L413 PolarHBondContact OH-O 2.8Å; Y363-S415 PolarHBondContact OH-N 2.86Å; Y363-L467 HydrophobicContact CD2-CD1 4.38Å; Y363-L467 HydrophobicContact CE2-CD1 3.99Å; Y363-Y526 HydrophobicContact CD2-CD2 4.34Å; Y363-Y526 HydrophobicContact CD2-CE1 4.44Å; Y363-Y526 HydrophobicContact CD2-CE2 4.01Å; Y363-Y526 HydrophobicContact CG-CE2 4.3Å
364	C	84.9	Confident	85.5	Confident	2 Å²	2	19.9 Å²	19.9	1%	0.014	11%	0.105	C	C	.	.	H	α-helix	trans	-61.2	-38.8	172.9	-57	0	0	0	0	111.2	H358 S360 E361 V366 V367 V368	H358-C364 PolarHBondContact CD2-SG 3.23Å; S360-C364 PolarHBondContact O-N 3.47Å; S360-C364 VanDerWaalsContact O-N 3.13Å; S360-C364 PolarHBondContact O-SG 3.23Å; E361-C364 WeakPolarHBondContact O-CA 3.27Å; E361-C364 VanDerWaalsContact O-CB 3.27Å; E361-C364 WeakPolarHBondContact O-CB 3.38Å; E361-C364 PolarHBondContact O-N 3.44Å; E361-C364 VanDerWaalsContact O-N 3.07Å; C364-V366 VanDerWaalsContact C-N 3.27Å; C364-V366 PolarHBondContact O-N 2.84Å; C364-V367 WeakPolarHBondContact O-CB 3.46Å; C364-V367 PolarHBondContact O-N 2.96Å; C364-V367 VanDerWaalsContact O-N 3.13Å; C364-V368 WeakPolarHBondContact O-CG2 3.4Å; C364-V368 PolarHBondContact O-N 3.17Å
365	D	87.4	Confident	85.4	Confident	88 Å²	88	25 Å²	25	47%	0.471	13%	0.127	S	C	.	.	H	α-helix	trans	-59.6	-37.9	173.6	-68.8	-30.2	0	0	0	112.4	E361 Q362 Y363 A369	E361-D365 PolarHBondContact O-N 3.2Å; Q362-D365 WeakPolarHBondContact O-CB 3.47Å; Q362-D365 PolarHBondContact O-N 3.36Å; Y363-D365 VanDerWaalsContact C-N 3.28Å; Y363-D365 PolarHBondContact O-N 3.18Å; D365-A369 VanDerWaalsContact O-CB 3.26Å; D365-A369 WeakPolarHBondContact O-CB 3.39Å; D365-A369 PolarHBondContact O-N 2.71Å
366	V	89.9	Confident	85.3	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-63.7	-44.9	174.1	174.6	0	0	0	0	110.9	Q362 Y363 C364 A369 L370 L467 L519 A522 I523 Y526	Q362-V366 WeakPolarHBondContact O-CG2 3.07Å; Q362-V366 PolarHBondContact O-N 2.86Å; Y363-V366 WeakPolarHBondContact O-CB 3.49Å; Y363-V366 PolarHBondContact O-N 3.23Å; Y363-V366 VanDerWaalsContact O-N 3.09Å; C364-V366 VanDerWaalsContact C-N 3.27Å; C364-V366 PolarHBondContact O-N 2.84Å; V366-A369 PolarHBondContact O-N 3.04Å; V366-L370 WeakPolarHBondContact O-CB 3.39Å; V366-L370 PolarHBondContact O-N 3.17Å; V366-L467 HydrophobicContact CG1-CD2 4.11Å; V366-L519 HydrophobicContact CG1-CD1 4.16Å; V366-A522 HydrophobicContact CG2-CB 3.94Å; V366-I523 HydrophobicContact CG1-CD1 4.48Å; V366-I523 HydrophobicContact CG1-CG1 3.69Å; V366-I523 HydrophobicContact CG2-CG1 4.17Å; V366-Y526 HydrophobicContact CG2-CG 4.46Å
367	V	90.3	Very high	85.2	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.1	-46.5	178.5	174.3	0	0	0	0	110.8	L354 Y356 Y363 C364 A369 L370 A371 L384 L413	L354-V367 HydrophobicContact CD2-CG1 3.77Å; L354-V367 HydrophobicContact CG-CG1 4.18Å; Y356-V367 HydrophobicContact CD1-CB 4.38Å; Y356-V367 HydrophobicContact CD1-CG1 3.5Å; Y356-V367 VanDerWaalsContact CD1-CG1 3.5Å; Y356-V367 HydrophobicContact CD1-CG2 4.12Å; Y356-V367 HydrophobicContact CD2-CB 4.39Å; Y356-V367 HydrophobicContact CD2-CG1 4.34Å; Y356-V367 HydrophobicContact CD2-CG2 3.57Å; Y356-V367 HydrophobicContact CE1-CG1 3.78Å; Y356-V367 HydrophobicContact CE2-CG2 4.2Å; Y356-V367 HydrophobicContact CG-CB 4.25Å; Y356-V367 HydrophobicContact CG-CG1 3.81Å; Y356-V367 HydrophobicContact CG-CG2 3.52Å; Y363-V367 HydrophobicContact CD1-CG2 4.18Å; Y363-V367 HydrophobicContact CE1-CG2 3.9Å; Y363-V367 WeakPolarHBondContact O-CG2 3.39Å; Y363-V367 PolarHBondContact O-N 3.47Å; C364-V367 WeakPolarHBondContact O-CB 3.46Å; C364-V367 PolarHBondContact O-N 2.96Å; C364-V367 VanDerWaalsContact O-N 3.13Å; V367-A369 VanDerWaalsContact C-N 3.34Å; V367-A369 PolarHBondContact O-N 3.15Å; V367-L370 WeakPolarHBondContact O-CB 3.42Å; V367-L370 PolarHBondContact O-N 3.29Å; V367-A371 WeakPolarHBondContact O-CB 3.35Å; V367-A371 PolarHBondContact O-N 2.9Å; V367-L384 HydrophobicContact CG1-CD1 3.68Å; V367-L384 HydrophobicContact CG1-CD2 4.48Å; V367-L413 HydrophobicContact CG2-CD2 3.81Å
368	V	90.5	Very high	85.5	Confident	36 Å²	36	32.9 Å²	32.9	22%	0.218	17%	0.169	C	C	.	.	H	α-helix	trans	-64.4	-39.9	177.4	172.9	0	0	0	0	110.9	C364 L370 A371 N372 L384 E386	C364-V368 WeakPolarHBondContact O-CG2 3.4Å; C364-V368 PolarHBondContact O-N 3.17Å; V368-L370 VanDerWaalsContact C-N 3.35Å; V368-A371 PolarHBondContact O-N 2.81Å; V368-N372 PolarHBondContact O-N 2.76Å; V368-N372 PolarHBondContact O-ND2 2.99Å; V368-L384 HydrophobicContact CG2-CD2 4.14Å; V368-E386 HydrophobicContact CG2-CB 4.14Å; V368-E386 HydrophobicContact CG2-CG 4.12Å
369	A	90.9	Very high	86.1	Confident	10 Å²	10	33.3 Å²	33.3	8%	0.083	18%	0.177	C	C	.	.	H	α-helix	trans	-63.7	-40.5	175	0	0	0	0	0	111.8	D365 V366 V367 N372 V373 L519 A522	D365-A369 VanDerWaalsContact O-CB 3.26Å; D365-A369 WeakPolarHBondContact O-CB 3.39Å; D365-A369 PolarHBondContact O-N 2.71Å; V366-A369 PolarHBondContact O-N 3.04Å; V367-A369 VanDerWaalsContact C-N 3.34Å; V367-A369 PolarHBondContact O-N 3.15Å; A369-N372 PolarHBondContact O-N 3.14Å; A369-V373 WeakPolarHBondContact O-CG2 3.39Å; A369-V373 PolarHBondContact O-N 3.43Å; A369-V373 VanDerWaalsContact O-N 3.07Å; A369-L519 HydrophobicContact CB-CB 4.23Å; A369-L519 HydrophobicContact CB-CD1 4.12Å; A369-A522 HydrophobicContact CB-CB 4.09Å
370	L	93.3	Very high	86.9	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-63.6	-46.6	174.9	177.6	61.4	0	0	0	111.2	L354 V366 V367 V368 N372 V373 L374 L411 L413 L489 L493 L519	L354-L370 HydrophobicContact CD1-CD2 4.46Å; V366-L370 WeakPolarHBondContact O-CB 3.39Å; V366-L370 PolarHBondContact O-N 3.17Å; V367-L370 WeakPolarHBondContact O-CB 3.42Å; V367-L370 PolarHBondContact O-N 3.29Å; V368-L370 VanDerWaalsContact C-N 3.35Å; L370-N372 PolarHBondContact O-N 3.2Å; L370-V373 WeakPolarHBondContact O-CB 3.42Å; L370-V373 PolarHBondContact O-N 2.89Å; L370-L374 HydrophobicContact CD1-CG 4.47Å; L370-L374 HydrophobicContact CG-CD1 4.49Å; L370-L374 WeakPolarHBondContact O-CG 3.43Å; L370-L374 PolarHBondContact O-N 2.88Å; L370-L411 HydrophobicContact CD2-CD2 4.35Å; L370-L413 HydrophobicContact CD2-CD1 4.28Å; L370-L413 HydrophobicContact CD2-CD2 4.08Å; L370-L489 HydrophobicContact CD1-CD1 3.76Å; L370-L489 HydrophobicContact CD2-CD1 3.54Å; L370-L489 HydrophobicContact CG-CD1 4.29Å; L370-L493 HydrophobicContact CD1-CD1 4.4Å; L370-L519 HydrophobicContact CB-CD1 3.99Å; L370-L519 HydrophobicContact CD1-CD2 3.99Å
371	A	92	Very high	87.6	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57.6	-39	176.3	0	0	0	0	0	112	L354 V367 V368 L374 K375 V382 L384 W387	L354-A371 HydrophobicContact CD2-CB 4.03Å; V367-A371 WeakPolarHBondContact O-CB 3.35Å; V367-A371 PolarHBondContact O-N 2.9Å; V368-A371 PolarHBondContact O-N 2.81Å; A371-L374 PolarHBondContact O-N 2.98Å; A371-K375 VanDerWaalsContact O-CB 3.29Å; A371-K375 WeakPolarHBondContact O-CB 3.42Å; A371-K375 PolarHBondContact O-N 3.29Å; A371-V382 HydrophobicContact CB-CG1 3.94Å; A371-L384 HydrophobicContact CB-CD2 3.83Å; A371-W387 HydrophobicContact CB-CH2 3.8Å; A371-W387 HydrophobicContact CB-CZ2 3.64Å
372	N	91.8	Very high	88.1	Confident	58 Å²	58	30.5 Å²	30.5	31%	0.31	16%	0.162	S	C	.	.	H	α-helix	trans	-65.4	-38.6	174.1	-76.6	-46.5	0	0	0	112.8	V368 A369 L370 K375 L376	V368-N372 PolarHBondContact O-N 2.76Å; V368-N372 PolarHBondContact O-ND2 2.99Å; A369-N372 PolarHBondContact O-N 3.14Å; L370-N372 PolarHBondContact O-N 3.2Å; N372-K375 PolarHBondContact O-N 3.15Å; N372-L376 HydrophobicContact CB-CD1 4.38Å; N372-L376 WeakPolarHBondContact O-CB 3.47Å; N372-L376 VanDerWaalsContact O-CG 3.27Å; N372-L376 WeakPolarHBondContact O-CG 3.39Å; N372-L376 PolarHBondContact O-N 3.14Å
373	V	89.5	Confident	88.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.5	-47.7	174.3	170.9	0	0	0	0	110.9	A369 L370 K375 D377 L378 L493 A515 L519	A369-V373 WeakPolarHBondContact O-CG2 3.39Å; A369-V373 PolarHBondContact O-N 3.43Å; A369-V373 VanDerWaalsContact O-N 3.07Å; L370-V373 WeakPolarHBondContact O-CB 3.42Å; L370-V373 PolarHBondContact O-N 2.89Å; V373-K375 VanDerWaalsContact C-N 3.28Å; V373-K375 PolarHBondContact O-N 2.84Å; V373-D377 HydrophobicContact CG1-CB 4.42Å; V373-D377 WeakPolarHBondContact O-CA 3.24Å; V373-D377 WeakPolarHBondContact O-CB 3.39Å; V373-D377 PolarHBondContact O-N 3.37Å; V373-L378 PolarHBondContact O-N 2.81Å; V373-L493 HydrophobicContact CG1-CD1 4.33Å; V373-L493 HydrophobicContact CG1-CD2 3.77Å; V373-A515 HydrophobicContact CG2-CB 3.81Å; V373-A515 WeakPolarHBondContact CG2-O 3.33Å; V373-L519 HydrophobicContact CG2-CB 4Å; V373-L519 HydrophobicContact CG2-CD2 4.17Å
374	L	90.4	Very high	88.6	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-58.5	-42.5	176.9	-64.8	-180	0	0	0	111.2	V352 L370 A371 L378 A379 C380 V382 L411 L496 L500	V352-L374 HydrophobicContact CG1-CD1 4.3Å; L370-L374 HydrophobicContact CD1-CG 4.47Å; L370-L374 HydrophobicContact CG-CD1 4.49Å; L370-L374 WeakPolarHBondContact O-CG 3.43Å; L370-L374 PolarHBondContact O-N 2.88Å; A371-L374 PolarHBondContact O-N 2.98Å; L374-L378 HydrophobicContact CD2-CD1 3.63Å; L374-L378 CarbonylContact O-C 3.59Å; L374-L378 WeakPolarHBondContact O-CB 3.42Å; L374-L378 PolarHBondContact O-N 3.37Å; L374-A379 PolarHBondContact O-N 2.83Å; L374-C380 HydrophobicContact CB-CB 4.31Å; L374-C380 WeakPolarHBondContact O-CB 3.45Å; L374-C380 PolarHBondContact O-N 3.32Å; L374-V382 HydrophobicContact CB-CG2 3.54Å; L374-V382 HydrophobicContact CD1-CG2 4.16Å; L374-L411 HydrophobicContact CD1-CD2 3.88Å; L374-L496 HydrophobicContact CD2-CD2 4.3Å; L374-L500 HydrophobicContact CD2-CD1 3.98Å
375	K	88.8	Confident	88.4	Confident	111 Å²	111	31.9 Å²	31.9	48%	0.483	17%	0.169	S	C	.	.	H	α-helix	trans	-72	-49.2	-179.7	-176	175.6	-179.3	174.2	0	113.5	A371 N372 V373 C380 V382 W387	A371-K375 VanDerWaalsContact O-CB 3.29Å; A371-K375 WeakPolarHBondContact O-CB 3.42Å; A371-K375 PolarHBondContact O-N 3.29Å; N372-K375 PolarHBondContact O-N 3.15Å; V373-K375 VanDerWaalsContact C-N 3.28Å; V373-K375 PolarHBondContact O-N 2.84Å; K375-C380 WeakPolarHBondContact CA-O 3.4Å; K375-V382 HydrophobicContact CB-CG2 4.41Å; K375-W387 HydrophobicContact CB-CH2 4.38Å; K375-W387 HydrophobicContact CD-CH2 3.79Å; K375-W387 HydrophobicContact CD-CZ3 4.07Å
376	L	85.2	Confident	88.1	Confident	119 Å²	119	28.8 Å²	28.8	62%	0.623	15%	0.152	S	C	*	.	H	α-helix	trans	-87	-42	-169.8	-62.9	173.2	0	0	0	112.7	N372 A515	N372-L376 HydrophobicContact CB-CD1 4.38Å; N372-L376 WeakPolarHBondContact O-CB 3.47Å; N372-L376 VanDerWaalsContact O-CG 3.27Å; N372-L376 WeakPolarHBondContact O-CG 3.39Å; N372-L376 PolarHBondContact O-N 3.14Å; L376-A515 HydrophobicContact CD1-CB 4.24Å
377	D	83	Confident	87.7	Confident	56 Å²	56	31.5 Å²	31.5	30%	0.299	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-34.4	-174	-60.5	-35	0	0	0	112.5	V373 L510 S513	V373-D377 HydrophobicContact CG1-CB 4.42Å; V373-D377 WeakPolarHBondContact O-CA 3.24Å; V373-D377 WeakPolarHBondContact O-CB 3.39Å; V373-D377 PolarHBondContact O-N 3.37Å; D377-L510 HydrophobicContact CB-CD2 3.93Å; D377-S513 PolarHBondContact OD1-OG 3.3Å; D377-S513 VanDerWaalsContact OD2-CB 3.29Å; D377-S513 WeakPolarHBondContact OD2-CB 3.1Å; D377-S513 PolarHBondContact OD2-OG 2.86Å
378	L	83.3	Confident	87	Confident	7 Å²	7	31.9 Å²	31.9	4%	0.037	17%	0.166	C	C	.	.	S	Bend	trans	-101.6	-1	-177.4	-52.9	-172.9	0	0	0	113.6	V373 L374 C380 A497 L500 H501 L508	V373-L378 PolarHBondContact O-N 2.81Å; L374-L378 HydrophobicContact CD2-CD1 3.63Å; L374-L378 CarbonylContact O-C 3.59Å; L374-L378 WeakPolarHBondContact O-CB 3.42Å; L374-L378 PolarHBondContact O-N 3.37Å; L378-C380 VanDerWaalsContact C-N 3.28Å; L378-C380 PolarHBondContact O-N 2.79Å; L378-A497 HydrophobicContact CD1-CB 3.73Å; L378-A497 HydrophobicContact CD2-CB 3.53Å; L378-A497 HydrophobicContact CG-CB 4.29Å; L378-L500 HydrophobicContact CD1-CD1 4.37Å; L378-H501 PolarHBondContact O-CE1 3.2Å; L378-H501 VanDerWaalsContact O-CE1 3.26Å; L378-H501 PolarHBondContact O-NE2 3.47Å; L378-L508 HydrophobicContact CD2-CD2 3.69Å
379	A	83.7	Confident	86.1	Confident	32 Å²	32	32.8 Å²	32.8	26%	0.264	17%	0.169	S	C	.	.			trans	51	46.6	-178.6	0	0	0	0	0	112.8	V344 L349 L374	V344-A379 HydrophobicContact CG1-CB 4.32Å; L349-A379 HydrophobicContact CD2-CB 4.07Å; L349-A379 WeakPolarHBondContact CD2-O 3.42Å; L374-A379 PolarHBondContact O-N 2.83Å
380	C	87.7	Confident	85	Confident	3 Å²	3	42 Å²	42	2%	0.02	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	148.3	172.6	-58.6	0	0	0	0	110.9	V350 V352 L374 K375 L378 V382	V350-C380 CarbonylContact O-C 3.57Å; V350-C380 WeakPolarHBondContact O-CA 3.27Å; V350-C380 WeakPolarHBondContact O-CB 3.44Å; V352-C380 HydrophobicContact CG2-CB 4.1Å; L374-C380 HydrophobicContact CB-CB 4.31Å; L374-C380 WeakPolarHBondContact O-CB 3.45Å; L374-C380 PolarHBondContact O-N 3.32Å; K375-C380 WeakPolarHBondContact CA-O 3.4Å; L378-C380 VanDerWaalsContact C-N 3.28Å; L378-C380 PolarHBondContact O-N 2.79Å; C380-V382 HydrophobicContact CB-CG2 4.37Å
381	E	89.3	Confident	83.7	Confident	80 Å²	80	47 Å²	47	37%	0.374	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	112.3	164.7	-176.1	-178.3	160.4	0	0	107.5	L349 V350 K351 V352	L349-E381 HydrophobicContact CB-CB 4.24Å; V350-E381 PolarHBondContact O-N 3.38Å; K351-E381 CarbonylContact C-O 3.54Å; K351-E381 WeakPolarHBondContact CA-O 3.29Å; K351-E381 WeakPolarHBondContact CE-OE2 3.45Å; K351-E381 HydrophobicContact CG-CB 4.18Å; K351-E381 IonicContact NZ-OE1 3.63Å; K351-E381 IonicContact NZ-OE2 2.89Å; V352-E381 PolarHBondContact N-O 2.69Å
382	V	90.5	Very high	82	Confident	12 Å²	12	52 Å²	52	7%	0.073	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	123.9	-176.3	-173.9	0	0	0	0	109.5	V352 L354 A371 L374 K375 C380 L384 W387	V352-V382 WeakPolarHBondContact O-CA 3.34Å; L354-V382 HydrophobicContact CB-CG1 4.15Å; L354-V382 HydrophobicContact CD2-CG1 4.45Å; A371-V382 HydrophobicContact CB-CG1 3.94Å; L374-V382 HydrophobicContact CB-CG2 3.54Å; L374-V382 HydrophobicContact CD1-CG2 4.16Å; K375-V382 HydrophobicContact CB-CG2 4.41Å; C380-V382 HydrophobicContact CB-CG2 4.37Å; V382-L384 HydrophobicContact CG1-CB 4.38Å; V382-W387 HydrophobicContact CB-CH2 4.14Å; V382-W387 HydrophobicContact CB-CZ3 3.85Å; V382-W387 HydrophobicContact CG1-CZ3 4.41Å; V382-W387 WeakPolarHBondContact O-CZ3 3.48Å
383	M	90	Very high	81	Confident	21 Å²	21	57 Å²	57	10%	0.103	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	110.9	169.9	-65.9	167.7	-70.3	0	0	107.8	K351 V352 F353 L354 C403 K406 A407	K351-M383 HydrophobicContact CB-CE 4.04Å; V352-M383 PolarHBondContact O-N 3.4Å; F353-M383 HydrophobicContact CB-CE 4.03Å; F353-M383 HydrophobicContact CD2-CB 4.15Å; L354-M383 PolarHBondContact N-O 2.85Å; M383-C403 HydrophobicContact SD-CB 4.16Å; M383-K406 HydrophobicContact SD-CB 4.25Å; M383-A407 HydrophobicContact CE-CB 3.62Å
384	L	89	Confident	80.1	Confident	3 Å²	3	59.3 Å²	59.3	2%	0.016	31%	0.31	C	S	.	.			trans	-132.5	132.7	-177.8	177.9	65.9	0	0	0	109	L354 Y356 V367 V368 A371 V382 E386 W387 A388	L354-L384 HydrophobicContact CB-CD1 4.42Å; L354-L384 HydrophobicContact CD2-CD1 4.15Å; L354-L384 HydrophobicContact CG-CD1 4.22Å; Y356-L384 HydrophobicContact CD1-CD1 4.18Å; Y356-L384 HydrophobicContact CE1-CD1 3.73Å; V367-L384 HydrophobicContact CG1-CD1 3.68Å; V367-L384 HydrophobicContact CG1-CD2 4.48Å; V368-L384 HydrophobicContact CG2-CD2 4.14Å; A371-L384 HydrophobicContact CB-CD2 3.83Å; V382-L384 HydrophobicContact CG1-CB 4.38Å; L384-E386 VanDerWaalsContact C-N 3.34Å; L384-E386 HydrophobicContact CD2-CB 3.87Å; L384-E386 HydrophobicContact CD2-CG 4.41Å; L384-E386 HydrophobicContact CG-CB 3.93Å; L384-E386 HydrophobicContact CG-CG 4.42Å; L384-E386 PolarHBondContact O-N 3.36Å; L384-W387 HydrophobicContact CB-CD2 4.21Å; L384-W387 HydrophobicContact CB-CE3 4.32Å; L384-W387 HydrophobicContact CB-CG 4.4Å; L384-W387 HydrophobicContact CD2-CD2 4.29Å; L384-W387 HydrophobicContact CD2-CG 4.37Å; L384-W387 PolarHBondContact O-N 3.46Å; L384-W387 VanDerWaalsContact O-N 3.16Å; L384-A388 PolarHBondContact O-N 3.23Å
385	D	80.9	Confident	79.5	Confident	31 Å²	31	63 Å²	63	17%	0.166	33%	0.33	C	S	.	.	H	α-helix	trans	-59.5	-40.6	179.4	57.3	-2.6	0	0	0	112.8	Y356 W387 A388 L389 W399 W435	Y356-D385 WeakPolarHBondContact CE1-OD1 3.46Å; Y356-D385 PolarHBondContact OH-OD1 2.92Å; Y356-D385 VanDerWaalsContact OH-OD1 3.07Å; Y356-D385 PolarHBondContact OH-OD2 2.82Å; D385-W387 PolarHBondContact O-N 2.81Å; D385-A388 PolarHBondContact O-N 2.87Å; D385-L389 WeakPolarHBondContact O-CB 3.4Å; D385-L389 VanDerWaalsContact O-CG 3.32Å; D385-L389 WeakPolarHBondContact O-CG 3.46Å; D385-L389 PolarHBondContact O-N 2.84Å; D385-W399 HydrophobicContact CB-CH2 3.88Å; D385-W399 HydrophobicContact CB-CZ3 4.11Å; D385-W435 HydrophobicContact CB-CE3 3.53Å; D385-W435 HydrophobicContact CB-CZ3 3.59Å
386	E	79.8	Confident	78.7	Confident	23 Å²	23	59.6 Å²	59.6	11%	0.107	32%	0.319	C	S	.	.	H	α-helix	trans	-55.8	-25.9	176.4	-71.1	-65.5	127	0	0	113.8	Y356 V368 L384 R433	Y356-E386 WeakPolarHBondContact OH-CG 3.39Å; Y356-E386 PolarHBondContact OH-OE1 3.32Å; V368-E386 HydrophobicContact CG2-CB 4.14Å; V368-E386 HydrophobicContact CG2-CG 4.12Å; L384-E386 VanDerWaalsContact C-N 3.34Å; L384-E386 HydrophobicContact CD2-CB 3.87Å; L384-E386 HydrophobicContact CD2-CG 4.41Å; L384-E386 HydrophobicContact CG-CB 3.93Å; L384-E386 HydrophobicContact CG-CG 4.42Å; L384-E386 PolarHBondContact O-N 3.36Å; E386-R433 IonicContact OE1-CZ 3.85Å; E386-R433 IonicContact OE1-NE 3.4Å; E386-R433 IonicContact OE1-NH1 2.67Å; E386-R433 PolarHBondContact OE1-NH1 2.92Å; E386-R433 IonicContact OE1-NH2 3.28Å; E386-R433 IonicContact OE2-CZ 3.7Å; E386-R433 IonicContact OE2-NH1 3.91Å; E386-R433 PolarHBondContact OE2-NH1 3Å; E386-R433 IonicContact OE2-NH2 3.85Å
387	W	82.6	Confident	78.3	Confident	58 Å²	58	56.8 Å²	56.8	22%	0.22	31%	0.313	C	S	.	.	H	α-helix	trans	-86.8	-40.2	175.8	-64	-9	0	0	0	111.3	A371 K375 V382 L384 D385 R390	A371-W387 HydrophobicContact CB-CH2 3.8Å; A371-W387 HydrophobicContact CB-CZ2 3.64Å; K375-W387 HydrophobicContact CB-CH2 4.38Å; K375-W387 HydrophobicContact CD-CH2 3.79Å; K375-W387 HydrophobicContact CD-CZ3 4.07Å; V382-W387 HydrophobicContact CB-CH2 4.14Å; V382-W387 HydrophobicContact CB-CZ3 3.85Å; V382-W387 HydrophobicContact CG1-CZ3 4.41Å; V382-W387 WeakPolarHBondContact O-CZ3 3.48Å; L384-W387 HydrophobicContact CB-CD2 4.21Å; L384-W387 HydrophobicContact CB-CE3 4.32Å; L384-W387 HydrophobicContact CB-CG 4.4Å; L384-W387 HydrophobicContact CD2-CD2 4.29Å; L384-W387 HydrophobicContact CD2-CG 4.37Å; L384-W387 PolarHBondContact O-N 3.46Å; L384-W387 VanDerWaalsContact O-N 3.16Å; D385-W387 PolarHBondContact O-N 2.81Å; W387-R390 WeakPolarHBondContact O-CB 3.44Å; W387-R390 PolarHBondContact O-N 2.93Å
388	A	75.1	Confident	78.2	Confident	9 Å²	9	59.1 Å²	59.1	7%	0.074	33%	0.326	C	S	.	.	H	α-helix	trans	-72.1	-30.3	179.8	0	0	0	0	0	113.2	L384 D385 R390 D391 W399 W435	L384-A388 PolarHBondContact O-N 3.23Å; D385-A388 PolarHBondContact O-N 2.87Å; A388-R390 PolarHBondContact O-N 3.4Å; A388-R390 VanDerWaalsContact O-N 3.09Å; A388-D391 PolarHBondContact O-N 3.47Å; A388-W399 HydrophobicContact CB-CD2 4.28Å; A388-W399 HydrophobicContact CB-CG 4.49Å; A388-W399 HydrophobicContact CB-CZ2 3.97Å; A388-W435 HydrophobicContact CB-CH2 3.64Å; A388-W435 HydrophobicContact CB-CZ3 4.05Å
389	L	70.4	Confident	78.3	Confident	55 Å²	55	60.5 Å²	60.5	29%	0.288	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.6	173.7	-75.9	170.9	0	0	0	113.4	D385 D391 P434 W435	D385-L389 WeakPolarHBondContact O-CB 3.4Å; D385-L389 VanDerWaalsContact O-CG 3.32Å; D385-L389 WeakPolarHBondContact O-CG 3.46Å; D385-L389 PolarHBondContact O-N 2.84Å; L389-D391 VanDerWaalsContact C-N 3.32Å; L389-P434 HydrophobicContact CD2-CB 3.79Å; L389-P434 HydrophobicContact CD2-CG 4.01Å; L389-W435 HydrophobicContact CD2-CD2 3.94Å; L389-W435 HydrophobicContact CD2-CE3 4.48Å; L389-W435 HydrophobicContact CD2-CG 4.44Å; L389-W435 HydrophobicContact CD2-CH2 4.33Å; L389-W435 HydrophobicContact CD2-CZ2 3.75Å; L389-W435 HydrophobicContact CG-CD2 4.48Å; L389-W435 HydrophobicContact CG-CH2 4.38Å; L389-W435 HydrophobicContact CG-CZ2 4.27Å; L389-W435 HydrophobicContact CG-CZ3 4.5Å
390	R	68.9	Low	78.2	Confident	203 Å²	203	60.2 Å²	60.2	77%	0.766	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-18.4	175.3	-60.6	-178.4	179.8	-164	-3.6	112.6	W387 A388	W387-R390 WeakPolarHBondContact O-CB 3.44Å; W387-R390 PolarHBondContact O-N 2.93Å; A388-R390 PolarHBondContact O-N 3.4Å; A388-R390 VanDerWaalsContact O-N 3.09Å
391	D	66.4	Low	78	Confident	107 Å²	107	62.5 Å²	62.5	57%	0.572	34%	0.343	S	S	*	.	S	Bend	trans	-94.9	103.4	179.8	-65	-30.7	0	0	0	109.2	A388 L389 D393 T394	A388-D391 PolarHBondContact O-N 3.47Å; L389-D391 VanDerWaalsContact C-N 3.32Å; D391-D393 PolarHBondContact O-N 3.42Å; D391-T394 PolarHBondContact O-N 2.89Å; D391-T394 PolarHBondContact O-OG1 2.99Å
392	A	56.7	Low	77.8	Confident	103 Å²	103	63 Å²	63	85%	0.851	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-16.4	-169.8	0	0	0	0	0	115.5
393	D	69.8	Low	77.7	Confident	164 Å²	164	62.5 Å²	62.5	88%	0.877	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	4.3	-172.7	-63.3	-34.8	0	0	0	113.9	D391	D391-D393 PolarHBondContact O-N 3.42Å
394	T	70.6	Confident	77.4	Confident	49 Å²	49	62.7 Å²	62.7	30%	0.301	34%	0.344	S	S	.	.			trans	-93.8	117.4	-171.4	-48.5	0	0	0	0	112.1	D391 P396 W399	D391-T394 PolarHBondContact O-N 2.89Å; D391-T394 PolarHBondContact O-OG1 2.99Å; T394-P396 WeakPolarHBondContact O-CD 3.49Å; T394-W399 HydrophobicContact CG2-CB 3.59Å; T394-W399 HydrophobicContact CG2-CG 3.94Å
395	N	78	Confident	77.2	Confident	76 Å²	76	69 Å²	69	41%	0.406	38%	0.377	S	S	.	.			trans	-72.6	123.8	169.3	178.6	-0.1	0	0	0	110.3	A397 D398 W399	N395-A397 VanDerWaalsContact C-N 3.31Å; N395-A397 PolarHBondContact O-N 2.93Å; N395-A397 PolarHBondContact OD1-N 2.97Å; N395-D398 HydrophobicContact CB-CB 4.16Å; N395-D398 VanDerWaalsContact CB-OD2 3.28Å; N395-D398 WeakPolarHBondContact CB-OD2 3.49Å; N395-D398 PolarHBondContact ND2-OD2 2.66Å; N395-D398 PolarHBondContact O-N 3.5Å; N395-W399 WeakPolarHBondContact O-CB 3.34Å; N395-W399 PolarHBondContact O-N 3.05Å
396	P	72.1	Confident	77.5	Confident	41 Å²	41	72.2 Å²	72.2	27%	0.266	39%	0.39	S	S	.	.	H	α-helix	trans	-52.8	-41.2	178.9	0.9	-13.9	0	0	0	115.5	T394 L400 W435	T394-P396 WeakPolarHBondContact O-CD 3.49Å; P396-L400 VanDerWaalsContact O-CB 3.27Å; P396-L400 WeakPolarHBondContact O-CB 3.35Å; P396-L400 PolarHBondContact O-N 3.08Å; P396-W435 VanDerWaalsContact CB-CD1 3.4Å; P396-W435 HydrophobicContact CB-CD2 3.85Å; P396-W435 HydrophobicContact CB-CG 3.73Å; P396-W435 HydrophobicContact CB-CZ2 4.25Å; P396-W435 HydrophobicContact CG-CG 4.36Å
397	A	77	Confident	78	Confident	60 Å²	60	71.7 Å²	71.7	50%	0.496	39%	0.39	S	S	.	.	H	α-helix	trans	-68.5	-44.4	-176.3	0	0	0	0	0	111	N395 L400 A401	N395-A397 VanDerWaalsContact C-N 3.31Å; N395-A397 PolarHBondContact O-N 2.93Å; N395-A397 PolarHBondContact OD1-N 2.97Å; A397-L400 PolarHBondContact O-N 3.13Å; A397-A401 WeakPolarHBondContact O-CB 3.49Å; A397-A401 PolarHBondContact O-N 2.8Å
398	D	81.1	Confident	78.3	Confident	105 Å²	105	73 Å²	73	56%	0.561	40%	0.401	S	S	*	.	H	α-helix	trans	-66.1	-42.5	178.6	-60.9	-31	0	0	0	110.8	N395 A401 E402	N395-D398 HydrophobicContact CB-CB 4.16Å; N395-D398 VanDerWaalsContact CB-OD2 3.28Å; N395-D398 WeakPolarHBondContact CB-OD2 3.49Å; N395-D398 PolarHBondContact ND2-OD2 2.66Å; N395-D398 PolarHBondContact O-N 3.5Å; D398-A401 PolarHBondContact O-N 2.93Å; D398-E402 VanDerWaalsContact O-CB 3.3Å; D398-E402 WeakPolarHBondContact O-CB 3.15Å; D398-E402 PolarHBondContact O-N 2.89Å
399	W	83.8	Confident	79	Confident	35 Å²	35	73.3 Å²	73.3	13%	0.133	40%	0.401	C	S	.	.	H	α-helix	trans	-63.8	-41.9	175.9	179	83.8	0	0	0	112.6	F353 D385 A388 T394 N395 E402 C403 W435	F353-W399 AromaticContact CE2-CH2 3.84Å; F353-W399 HydrophobicContact CE2-CH2 3.84Å; F353-W399 HydrophobicContact CE2-CZ3 4.1Å; F353-W399 HydrophobicContact CZ-CZ3 4.44Å; D385-W399 HydrophobicContact CB-CH2 3.88Å; D385-W399 HydrophobicContact CB-CZ3 4.11Å; A388-W399 HydrophobicContact CB-CD2 4.28Å; A388-W399 HydrophobicContact CB-CG 4.49Å; A388-W399 HydrophobicContact CB-CZ2 3.97Å; T394-W399 HydrophobicContact CG2-CB 3.59Å; T394-W399 HydrophobicContact CG2-CG 3.94Å; N395-W399 WeakPolarHBondContact O-CB 3.34Å; N395-W399 PolarHBondContact O-N 3.05Å; W399-E402 WeakPolarHBondContact O-CB 3.05Å; W399-E402 PolarHBondContact O-N 3.13Å; W399-C403 VanDerWaalsContact CZ2-SG 3.52Å; W399-C403 WeakPolarHBondContact O-CB 3.5Å; W399-C403 PolarHBondContact O-N 2.8Å; W399-C403 PolarHBondContact O-SG 3.16Å; W399-W435 HydrophobicContact CD2-CH2 4.09Å; W399-W435 AromaticContact CD2-CZ3 3.81Å; W399-W435 HydrophobicContact CD2-CZ3 3.81Å; W399-W435 HydrophobicContact CE3-CE3 4.01Å; W399-W435 HydrophobicContact CE3-CH2 4.09Å; W399-W435 AromaticContact CE3-CZ3 3.4Å; W399-W435 HydrophobicContact CE3-CZ3 3.4Å; W399-W435 HydrophobicContact CG-CH2 4.39Å; W399-W435 HydrophobicContact CH2-CZ3 4.07Å; W399-W435 HydrophobicContact CZ2-CZ3 4.41Å; W399-W435 AromaticContact CZ3-CE3 3.98Å; W399-W435 HydrophobicContact CZ3-CE3 3.98Å; W399-W435 AromaticContact CZ3-CZ3 3.55Å; W399-W435 HydrophobicContact CZ3-CZ3 3.55Å
400	L	83.5	Confident	80	Confident	27 Å²	27	71.1 Å²	71.1	14%	0.141	39%	0.388	C	S	.	.	H	α-helix	trans	-63.7	-45.8	176.7	178.1	63.3	0	0	0	110.8	F353 P396 A397 E402 C403 M404 A438 A442	F353-L400 HydrophobicContact CE1-CD1 3.81Å; F353-L400 HydrophobicContact CZ-CD1 3.53Å; P396-L400 VanDerWaalsContact O-CB 3.27Å; P396-L400 WeakPolarHBondContact O-CB 3.35Å; P396-L400 PolarHBondContact O-N 3.08Å; A397-L400 PolarHBondContact O-N 3.13Å; L400-E402 VanDerWaalsContact C-N 3.3Å; L400-E402 PolarHBondContact O-N 2.88Å; L400-C403 PolarHBondContact O-N 2.92Å; L400-M404 HydrophobicContact CD1-CG 4.3Å; L400-M404 HydrophobicContact CG-CG 4.49Å; L400-M404 WeakPolarHBondContact O-CB 3.24Å; L400-M404 VanDerWaalsContact O-CG 3.25Å; L400-M404 WeakPolarHBondContact O-CG 3.37Å; L400-M404 PolarHBondContact O-N 2.9Å; L400-A438 HydrophobicContact CD2-CB 4.18Å; L400-A442 HydrophobicContact CD1-CB 3.6Å; L400-A442 HydrophobicContact CD2-CB 3.96Å; L400-A442 HydrophobicContact CG-CB 4.39Å
401	A	82.6	Confident	81.1	Confident	50 Å²	50	61.4 Å²	61.4	41%	0.413	35%	0.352	S	S	.	.	H	α-helix	trans	-60.2	-41.6	175.7	0	0	0	0	0	111.4	A397 D398 M404 N405	A397-A401 WeakPolarHBondContact O-CB 3.49Å; A397-A401 PolarHBondContact O-N 2.8Å; D398-A401 PolarHBondContact O-N 2.93Å; A401-M404 PolarHBondContact O-N 3.39Å; A401-N405 WeakPolarHBondContact O-CB 3.33Å; A401-N405 VanDerWaalsContact O-CG 3.29Å; A401-N405 PolarHBondContact O-N 3.04Å; A401-N405 VanDerWaalsContact O-N 3.11Å; A401-N405 PolarHBondContact O-ND2 3.24Å
402	E	85.3	Confident	82.2	Confident	91 Å²	91	56.5 Å²	56.5	43%	0.425	33%	0.325	S	S	.	.	H	α-helix	trans	-61.6	-46	174.9	-175	-177.6	166.1	0	0	111.9	D398 W399 L400 N405 K406	D398-E402 VanDerWaalsContact O-CB 3.3Å; D398-E402 WeakPolarHBondContact O-CB 3.15Å; D398-E402 PolarHBondContact O-N 2.89Å; W399-E402 WeakPolarHBondContact O-CB 3.05Å; W399-E402 PolarHBondContact O-N 3.13Å; L400-E402 VanDerWaalsContact C-N 3.3Å; L400-E402 PolarHBondContact O-N 2.88Å; E402-N405 PolarHBondContact O-N 2.78Å; E402-K406 HydrophobicContact CG-CD 3.78Å; E402-K406 HydrophobicContact CG-CG 4.31Å; E402-K406 WeakPolarHBondContact O-CB 3.31Å; E402-K406 WeakPolarHBondContact O-CG 3.17Å; E402-K406 PolarHBondContact O-N 2.85Å; E402-K406 VanDerWaalsContact OE1-CE 3.27Å; E402-K406 WeakPolarHBondContact OE1-CE 3.29Å; E402-K406 IonicContact OE1-NZ 2.58Å; E402-K406 PolarHBondContact OE1-NZ 3.19Å
403	C	87.4	Confident	83.6	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.014	29%	0.285	C	S	.	.	H	α-helix	trans	-62.2	-44.4	177.4	-69.6	0	0	0	0	111.6	F353 M383 W399 L400 N405 K406 A407	F353-C403 HydrophobicContact CD1-CB 4.09Å; F353-C403 HydrophobicContact CD2-CB 3.96Å; F353-C403 HydrophobicContact CE1-CB 4.04Å; F353-C403 HydrophobicContact CE2-CB 3.91Å; F353-C403 HydrophobicContact CG-CB 4.07Å; F353-C403 HydrophobicContact CZ-CB 3.95Å; M383-C403 HydrophobicContact SD-CB 4.16Å; W399-C403 VanDerWaalsContact CZ2-SG 3.52Å; W399-C403 WeakPolarHBondContact O-CB 3.5Å; W399-C403 PolarHBondContact O-N 2.8Å; W399-C403 PolarHBondContact O-SG 3.16Å; L400-C403 PolarHBondContact O-N 2.92Å; C403-N405 PolarHBondContact O-N 3.18Å; C403-K406 PolarHBondContact O-N 2.83Å; C403-A407 WeakPolarHBondContact O-CB 3.2Å; C403-A407 PolarHBondContact O-N 3.04Å
404	M	84.9	Confident	84.3	Confident	25 Å²	25	44.2 Å²	44.2	12%	0.123	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-26	177.3	-71.8	-66	-68.8	0	0	113.3	F353 L400 A401 Y410 V446 K449	F353-M404 HydrophobicContact CD1-SD 4.18Å; F353-M404 HydrophobicContact CE1-CG 4.34Å; F353-M404 HydrophobicContact CE1-SD 3.91Å; L400-M404 HydrophobicContact CD1-CG 4.3Å; L400-M404 HydrophobicContact CG-CG 4.49Å; L400-M404 WeakPolarHBondContact O-CB 3.24Å; L400-M404 VanDerWaalsContact O-CG 3.25Å; L400-M404 WeakPolarHBondContact O-CG 3.37Å; L400-M404 PolarHBondContact O-N 2.9Å; A401-M404 PolarHBondContact O-N 3.39Å; M404-Y410 HydrophobicContact CE-CE1 4.27Å; M404-Y410 PolarHBondContact O-OH 3.08Å; M404-Y410 HydrophobicContact SD-CD1 4.23Å; M404-Y410 HydrophobicContact SD-CE1 3.72Å; M404-V446 HydrophobicContact CE-CG2 3.75Å; M404-V446 HydrophobicContact SD-CG2 3.64Å; M404-K449 PolarHBondContact O-NZ 3.3Å
405	N	85.3	Confident	84.6	Confident	135 Å²	135	41.9 Å²	41.9	72%	0.722	23%	0.231	S	C	*	.	H	α-helix	trans	-90.2	-35.5	177.5	-71.9	-26	0	0	0	113	A401 E402 C403	A401-N405 WeakPolarHBondContact O-CB 3.33Å; A401-N405 VanDerWaalsContact O-CG 3.29Å; A401-N405 PolarHBondContact O-N 3.04Å; A401-N405 VanDerWaalsContact O-N 3.11Å; A401-N405 PolarHBondContact O-ND2 3.24Å; E402-N405 PolarHBondContact O-N 2.78Å; C403-N405 PolarHBondContact O-N 3.18Å
406	K	86.9	Confident	84.1	Confident	98 Å²	98	40.9 Å²	40.9	43%	0.426	22%	0.224	S	C	.	.	H	α-helix	trans	-87	-22.7	-175.8	-71.3	-173.8	179.9	-180	0	114.1	K351 M383 E402 C403	K351-K406 HydrophobicContact CD-CB 4.5Å; K351-K406 WeakPolarHBondContact CD-O 3.11Å; M383-K406 HydrophobicContact SD-CB 4.25Å; E402-K406 HydrophobicContact CG-CD 3.78Å; E402-K406 HydrophobicContact CG-CG 4.31Å; E402-K406 WeakPolarHBondContact O-CB 3.31Å; E402-K406 WeakPolarHBondContact O-CG 3.17Å; E402-K406 PolarHBondContact O-N 2.85Å; E402-K406 VanDerWaalsContact OE1-CE 3.27Å; E402-K406 WeakPolarHBondContact OE1-CE 3.29Å; E402-K406 IonicContact OE1-NZ 2.58Å; E402-K406 PolarHBondContact OE1-NZ 3.19Å; C403-K406 PolarHBondContact O-N 2.83Å
407	A	89.1	Confident	83.6	Confident	13 Å²	13	39.5 Å²	39.5	11%	0.107	22%	0.218	C	C	.	.			trans	-68.8	131.7	-173.9	0	0	0	0	0	113.5	F353 M383 C403 Y410	F353-A407 HydrophobicContact CB-CB 3.67Å; M383-A407 HydrophobicContact CE-CB 3.62Å; C403-A407 WeakPolarHBondContact O-CB 3.2Å; C403-A407 PolarHBondContact O-N 3.04Å; A407-Y410 HydrophobicContact CB-CD1 4.41Å; A407-Y410 HydrophobicContact CB-CE1 3.95Å
408	N	88.4	Confident	83	Confident	85 Å²	85	36.8 Å²	36.8	46%	0.455	19%	0.194	S	C	.	.	S	Bend	trans	-81.2	-37.9	165.9	-59.5	109.8	0	0	0	110.9	V350 K351 P461	V350-N408 HydrophobicContact CG1-CB 4.48Å; K351-N408 VanDerWaalsContact CB-OD1 3.3Å; K351-N408 WeakPolarHBondContact CB-OD1 3.49Å; K351-N408 PolarHBondContact N-OD1 3.4Å; K351-N408 WeakPolarHBondContact O-CB 3.33Å; K351-N408 PolarHBondContact O-N 3.37Å; N408-P461 WeakPolarHBondContact O-CB 3.1Å
409	F	91.5	Very high	81.9	Confident	16 Å²	16	33.4 Å²	33.4	7%	0.07	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	144.2	179.6	-65.5	-86.9	0	0	0	111.8	V350 K351 V352 F353 H459 P461 I463 L500	V350-F409 HydrophobicContact CG1-CD2 3.24Å; V350-F409 HydrophobicContact CG1-CE2 3.37Å; V350-F409 HydrophobicContact CG1-CG 4.48Å; K351-F409 PolarHBondContact O-N 3.07Å; V352-F409 WeakPolarHBondContact CA-O 3.33Å; V352-F409 HydrophobicContact CG2-CB 4.35Å; F353-F409 PolarHBondContact N-O 3.04Å; F409-H459 AromaticContact CE1-CE1 3.24Å; F409-H459 WeakPolarHBondContact CE1-CE1 3.14Å; F409-H459 AromaticContact CE1-ND1 3.93Å; F409-H459 AromaticContact CE1-NE2 3.88Å; F409-H459 AromaticContact CZ-CE1 3.17Å; F409-H459 WeakPolarHBondContact CZ-CE1 3.37Å; F409-H459 AromaticContact CZ-NE2 3.35Å; F409-H459 VanDerWaalsContact CZ-NE2 3.35Å; F409-H459 WeakPolarHBondContact CZ-NE2 3.49Å; F409-P461 CarbonylContact C-O 3.49Å; F409-P461 VanDerWaalsContact CA-O 3.3Å; F409-P461 WeakPolarHBondContact CA-O 3.44Å; F409-P461 HydrophobicContact CD1-CB 4.37Å; F409-I463 HydrophobicContact CB-CD1 4.14Å; F409-I463 HydrophobicContact CD1-CD1 3.85Å; F409-I463 HydrophobicContact CD1-CG1 4.44Å; F409-I463 HydrophobicContact CG-CD1 4.27Å; F409-L500 HydrophobicContact CB-CD2 3.9Å; F409-L500 HydrophobicContact CD1-CD2 3.95Å; F409-L500 HydrophobicContact CD2-CD2 3.7Å; F409-L500 HydrophobicContact CE2-CD2 4.26Å; F409-L500 HydrophobicContact CG-CD2 3.54Å
410	Y	90.8	Very high	80.5	Confident	8 Å²	8	35.6 Å²	35.6	3%	0.031	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	109.9	174.3	-55.1	-93	0	0	0	107.7	F353 M404 A407 V446 K449 P461 Y462 I463	F353-Y410 HydrophobicContact CB-CD1 4.38Å; F353-Y410 AromaticContact CD1-CD1 3.95Å; F353-Y410 HydrophobicContact CD1-CD1 3.95Å; F353-Y410 HydrophobicContact CD1-CE1 4.25Å; M404-Y410 HydrophobicContact CE-CE1 4.27Å; M404-Y410 PolarHBondContact O-OH 3.08Å; M404-Y410 HydrophobicContact SD-CD1 4.23Å; M404-Y410 HydrophobicContact SD-CE1 3.72Å; A407-Y410 HydrophobicContact CB-CD1 4.41Å; A407-Y410 HydrophobicContact CB-CE1 3.95Å; Y410-V446 HydrophobicContact CD1-CG1 4.28Å; Y410-V446 HydrophobicContact CD1-CG2 3.67Å; Y410-V446 HydrophobicContact CE1-CG2 4.23Å; Y410-V446 HydrophobicContact CG-CG1 4.03Å; Y410-V446 HydrophobicContact CG-CG2 4.26Å; Y410-K449 PolarHBondContact OH-NZ 2.85Å; Y410-P461 PolarHBondContact N-O 2.89Å; Y410-Y462 AromaticContact CD2-CD1 3.81Å; Y410-Y462 HydrophobicContact CD2-CD1 3.81Å; Y410-Y462 AromaticContact CD2-CE1 3.77Å; Y410-Y462 HydrophobicContact CD2-CE1 3.77Å; Y410-Y462 HydrophobicContact CE2-CE1 4.08Å; Y410-Y462 HydrophobicContact CG-CD1 4.33Å; Y410-I463 PolarHBondContact O-N 2.96Å
411	L	92	Very high	79.2	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	108.8	-179.7	175	57.9	0	0	0	109.2	V352 F353 L354 L355 L370 L374 I463 L496	V352-L411 HydrophobicContact CG1-CB 3.8Å; V352-L411 HydrophobicContact CG1-CD2 4.3Å; F353-L411 PolarHBondContact O-N 2.83Å; L354-L411 WeakPolarHBondContact CA-O 3.38Å; L354-L411 HydrophobicContact CD1-CB 4.2Å; L354-L411 HydrophobicContact CD1-CD2 3.81Å; L354-L411 HydrophobicContact CD1-CG 3.72Å; L355-L411 PolarHBondContact N-O 2.82Å; L370-L411 HydrophobicContact CD2-CD2 4.35Å; L374-L411 HydrophobicContact CD1-CD2 3.88Å; L411-I463 HydrophobicContact CD1-CB 3.9Å; L411-I463 HydrophobicContact CD1-CG2 3.41Å; L411-I463 VanDerWaalsContact CD1-CG2 3.41Å; L411-L496 HydrophobicContact CD2-CD2 4.39Å
412	L	88.9	Confident	77.8	Confident	3 Å²	3	36.7 Å²	36.7	2%	0.016	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	118.2	174.8	-76.5	69.5	0	0	0	109.3	L355 F414 V443 V446 I463 S465 W484	L355-L412 HydrophobicContact CB-CD1 4.45Å; L355-L412 HydrophobicContact CB-CG 4.14Å; L355-L412 HydrophobicContact CD1-CD1 4.12Å; L355-L412 HydrophobicContact CD1-CG 4.41Å; L355-L412 CarbonylContact O-C 3.57Å; L355-L412 VanDerWaalsContact O-CA 3.31Å; L355-L412 WeakPolarHBondContact O-CA 3.39Å; L412-F414 HydrophobicContact CB-CD2 4.23Å; L412-F414 HydrophobicContact CB-CE2 3.43Å; L412-F414 VanDerWaalsContact CB-CE2 3.43Å; L412-F414 HydrophobicContact CB-CZ 3.92Å; L412-F414 HydrophobicContact CD2-CE2 4Å; L412-F414 HydrophobicContact CD2-CZ 3.69Å; L412-F414 HydrophobicContact CG-CE2 4.35Å; L412-F414 HydrophobicContact CG-CZ 4.4Å; L412-V443 HydrophobicContact CD2-CG1 4.13Å; L412-V443 HydrophobicContact CD2-CG2 4.27Å; L412-V446 HydrophobicContact CD1-CG1 4.1Å; L412-I463 PolarHBondContact N-O 2.81Å; L412-S465 PolarHBondContact O-N 2.84Å; L412-W484 HydrophobicContact CD1-CH2 4.19Å; L412-W484 HydrophobicContact CD1-CZ3 4Å; L412-W484 HydrophobicContact CD2-CH2 4.15Å; L412-W484 HydrophobicContact CD2-CZ3 4.37Å
413	L	87.7	Confident	76.4	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	111.5	176.8	-169.2	71.7	0	0	0	110.6	L354 L355 Y356 Y363 V367 L370 S465 L489	L354-L413 HydrophobicContact CD1-CB 4.39Å; L355-L413 PolarHBondContact O-N 2.91Å; Y356-L413 WeakPolarHBondContact CA-O 3.06Å; Y363-L413 HydrophobicContact CE2-CD2 4.35Å; Y363-L413 VanDerWaalsContact OH-C 3.3Å; Y363-L413 WeakPolarHBondContact OH-CD2 3.23Å; Y363-L413 VanDerWaalsContact OH-CG 3.23Å; Y363-L413 WeakPolarHBondContact OH-CG 3.1Å; Y363-L413 PolarHBondContact OH-O 2.8Å; V367-L413 HydrophobicContact CG2-CD2 3.81Å; L370-L413 HydrophobicContact CD2-CD1 4.28Å; L370-L413 HydrophobicContact CD2-CD2 4.08Å; L413-S465 WeakPolarHBondContact CA-O 3.26Å; L413-L489 HydrophobicContact CD1-CD1 3.88Å
414	F	82.5	Confident	74.6	Confident	7 Å²	7	39.6 Å²	39.6	3%	0.031	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	124.9	-174.9	-71.6	-86.1	0	0	0	113.4	L412 V418 S465 L475 L479	L412-F414 HydrophobicContact CB-CD2 4.23Å; L412-F414 HydrophobicContact CB-CE2 3.43Å; L412-F414 VanDerWaalsContact CB-CE2 3.43Å; L412-F414 HydrophobicContact CB-CZ 3.92Å; L412-F414 HydrophobicContact CD2-CE2 4Å; L412-F414 HydrophobicContact CD2-CZ 3.69Å; L412-F414 HydrophobicContact CG-CE2 4.35Å; L412-F414 HydrophobicContact CG-CZ 4.4Å; F414-V418 HydrophobicContact CB-CG2 4.25Å; F414-V418 HydrophobicContact CD1-CB 4.4Å; F414-V418 HydrophobicContact CD1-CG1 4.04Å; F414-V418 HydrophobicContact CD1-CG2 3.65Å; F414-V418 HydrophobicContact CE1-CG1 4.36Å; F414-V418 HydrophobicContact CG-CG2 4.43Å; F414-S465 PolarHBondContact N-O 3.43Å; F414-L475 HydrophobicContact CB-CD2 3.85Å; F414-L475 HydrophobicContact CD1-CD2 4.36Å; F414-L475 HydrophobicContact CD2-CD2 3.48Å; F414-L475 VanDerWaalsContact CD2-CD2 3.48Å; F414-L475 HydrophobicContact CE2-CD2 4.14Å; F414-L475 HydrophobicContact CG-CD2 3.61Å; F414-L479 HydrophobicContact CD2-CD1 4.31Å; F414-L479 HydrophobicContact CE1-CD1 3.85Å; F414-L479 HydrophobicContact CE2-CD1 3.31Å; F414-L479 HydrophobicContact CZ-CD1 3.05Å
415	S	77.4	Confident	72.8	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.007	25%	0.245	C	C	.	.			trans	-57.9	160.8	158.8	162	0	0	0	0	114.9	S357 D359 Y363 G417 V418 V474 Y526	S357-S415 PolarHBondContact OG-N 3.36Å; D359-S415 WeakPolarHBondContact OD2-CA 3.46Å; D359-S415 WeakPolarHBondContact OD2-CB 3.44Å; D359-S415 PolarHBondContact OD2-OG 3.25Å; Y363-S415 PolarHBondContact OH-N 2.86Å; S415-G417 VanDerWaalsContact C-N 3.3Å; S415-V418 VanDerWaalsContact O-CG2 3.31Å; S415-V418 WeakPolarHBondContact O-CG2 3.49Å; S415-V474 WeakPolarHBondContact O-CG1 3.41Å; S415-Y526 PolarHBondContact OG-OH 3.09Å
416	E	67.1	Low	71.1	Confident	54 Å²	54	40.3 Å²	40.3	25%	0.252	24%	0.237	S	C	.	.	S	Bend	trans	-72.9	-24	148.4	-92.4	177	-121.6	0	0	112.3	V418 T470 P471 V474 R530	E416-V418 PolarHBondContact O-N 3.13Å; E416-T470 HydrophobicContact CG-CG2 3.82Å; E416-P471 HydrophobicContact CG-CG 4.46Å; E416-P471 WeakPolarHBondContact OE1-CD 3.5Å; E416-V474 HydrophobicContact CG-CG2 3.98Å; E416-R530 VanDerWaalsContact CB-NH2 3.31Å; E416-R530 IonicContact OE1-NH1 3Å; E416-R530 PolarHBondContact OE1-NH1 3.01Å; E416-R530 IonicContact OE2-CZ 3.52Å; E416-R530 IonicContact OE2-NH1 2.62Å; E416-R530 PolarHBondContact OE2-NH1 2.86Å; E416-R530 IonicContact OE2-NH2 3.77Å; E416-R530 PolarHBondContact OE2-NH2 3.43Å
417	G	62.8	Low	69.4	Low	13 Å²	13	36.5 Å²	36.5	13%	0.134	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-5.4	-179.9	0	0	0	0	0	114.5	D359 S415 G419 L420 L421	D359-G417 WeakPolarHBondContact OD2-CA 3.49Å; D359-G417 PolarHBondContact OD2-N 2.91Å; S415-G417 VanDerWaalsContact C-N 3.3Å; G417-G419 PolarHBondContact O-N 2.78Å; G417-L420 WeakPolarHBondContact O-CA 3.48Å; G417-L420 VanDerWaalsContact O-CB 3.29Å; G417-L420 WeakPolarHBondContact O-CB 3.39Å; G417-L420 PolarHBondContact O-N 2.03Å; G417-L421 PolarHBondContact O-N 3.49Å
418	V	63.3	Low	67.5	Low	2 Å²	2	41.9 Å²	41.9	1%	0.012	25%	0.254	C	S	.	.	H	α-helix	trans	-54.2	-36	171.9	177.6	0	0	0	0	111	S357 F414 S415 E416 L420 L421 C422 V474	S357-V418 WeakPolarHBondContact OG-CG2 3.24Å; F414-V418 HydrophobicContact CB-CG2 4.25Å; F414-V418 HydrophobicContact CD1-CB 4.4Å; F414-V418 HydrophobicContact CD1-CG1 4.04Å; F414-V418 HydrophobicContact CD1-CG2 3.65Å; F414-V418 HydrophobicContact CE1-CG1 4.36Å; F414-V418 HydrophobicContact CG-CG2 4.43Å; S415-V418 VanDerWaalsContact O-CG2 3.31Å; S415-V418 WeakPolarHBondContact O-CG2 3.49Å; E416-V418 PolarHBondContact O-N 3.13Å; V418-L420 VanDerWaalsContact C-N 3.26Å; V418-L420 PolarHBondContact O-N 3.43Å; V418-L421 PolarHBondContact O-N 3.21Å; V418-C422 WeakPolarHBondContact O-CB 3.43Å; V418-C422 PolarHBondContact O-N 2.89Å; V418-C422 PolarHBondContact O-SG 2.92Å; V418-C422 VanDerWaalsContact O-SG 3.35Å; V418-V474 HydrophobicContact CB-CG1 4.09Å
419	G	58.2	Low	65.6	Low	34 Å²	34	42.4 Å²	42.4	35%	0.351	26%	0.256	S	S	.	.	H	α-helix	trans	-59.5	-35.2	174.7	0	0	0	0	0	113.1	G417 N423	G417-G419 PolarHBondContact O-N 2.78Å; G419-N423 VanDerWaalsContact O-CB 3.31Å; G419-N423 WeakPolarHBondContact O-CB 3.43Å; G419-N423 PolarHBondContact O-N 3.33Å; G419-N423 PolarHBondContact O-ND2 2.73Å
420	L	55.4	Low	63.5	Low	82 Å²	82	47.8 Å²	47.8	43%	0.429	29%	0.286	S	S	.	.	H	α-helix	trans	-70.9	-43.2	176	-61.4	168.3	0	0	0	110.9	G417 V418 N423 G424 M425	G417-L420 WeakPolarHBondContact O-CA 3.48Å; G417-L420 VanDerWaalsContact O-CB 3.29Å; G417-L420 WeakPolarHBondContact O-CB 3.39Å; G417-L420 PolarHBondContact O-N 2.03Å; V418-L420 VanDerWaalsContact C-N 3.26Å; V418-L420 PolarHBondContact O-N 3.43Å; L420-N423 CarbonylContact O-C 3.5Å; L420-N423 PolarHBondContact O-N 3.21Å; L420-G424 PolarHBondContact O-N 3.17Å; L420-M425 HydrophobicContact CB-CB 4.23Å; L420-M425 HydrophobicContact CD2-SD 3.64Å; L420-M425 WeakPolarHBondContact O-CB 3.45Å; L420-M425 PolarHBondContact O-N 2.95Å
421	L	55.9	Low	61.5	Low	25 Å²	25	51.9 Å²	51.9	13%	0.131	31%	0.311	C	S	.	.	H	α-helix	trans	-67.3	-42.3	-179	-143.2	116.7	0	0	0	111.9	G417 V418 N423 G424 W439	G417-L421 PolarHBondContact O-N 3.49Å; V418-L421 PolarHBondContact O-N 3.21Å; L421-N423 VanDerWaalsContact C-N 3.26Å; L421-N423 PolarHBondContact O-N 3.3Å; L421-G424 PolarHBondContact O-N 2.92Å; L421-G424 VanDerWaalsContact O-N 3.12Å; L421-W439 HydrophobicContact CD2-CE3 3.68Å; L421-W439 HydrophobicContact CD2-CH2 4.24Å; L421-W439 HydrophobicContact CD2-CZ3 3.41Å; L421-W439 VanDerWaalsContact CD2-CZ3 3.41Å
422	C	53.6	Low	59.4	Low	74 Å²	74	57.4 Å²	57.4	50%	0.5	34%	0.34	S	S	.	.	H	α-helix	trans	-64.8	-29.6	173.9	-70.4	0	0	0	0	112.6	V418 G424	V418-C422 WeakPolarHBondContact O-CB 3.43Å; V418-C422 PolarHBondContact O-N 2.89Å; V418-C422 PolarHBondContact O-SG 2.92Å; V418-C422 VanDerWaalsContact O-SG 3.35Å; C422-G424 PolarHBondContact O-N 2.91Å
423	N	54.3	Low	57.9	Low	110 Å²	110	60.3 Å²	60.3	59%	0.588	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	3.8	175.7	-69.4	-15.6	0	0	0	113.3	G419 L420 L421 M425	G419-N423 VanDerWaalsContact O-CB 3.31Å; G419-N423 WeakPolarHBondContact O-CB 3.43Å; G419-N423 PolarHBondContact O-N 3.33Å; G419-N423 PolarHBondContact O-ND2 2.73Å; L420-N423 CarbonylContact O-C 3.5Å; L420-N423 PolarHBondContact O-N 3.21Å; L421-N423 VanDerWaalsContact C-N 3.26Å; L421-N423 PolarHBondContact O-N 3.3Å; N423-M425 VanDerWaalsContact C-N 3.28Å; N423-M425 PolarHBondContact O-N 3.08Å
424	G	50.3	Low	56.2	Low	44 Å²	44	64.1 Å²	64.1	45%	0.454	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	16.4	-179	0	0	0	0	0	114.6	L420 L421 C422	L420-G424 PolarHBondContact O-N 3.17Å; L421-G424 PolarHBondContact O-N 2.92Å; L421-G424 VanDerWaalsContact O-N 3.12Å; C422-G424 PolarHBondContact O-N 2.91Å
425	M	47.3	Very low	55.3	Low	87 Å²	87	65.9 Å²	65.9	43%	0.429	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-80.8	131.3	171	-64.6	-174.2	-169.8	0	0	109.4	L420 N423	L420-M425 HydrophobicContact CB-CB 4.23Å; L420-M425 HydrophobicContact CD2-SD 3.64Å; L420-M425 WeakPolarHBondContact O-CB 3.45Å; L420-M425 PolarHBondContact O-N 2.95Å; N423-M425 VanDerWaalsContact C-N 3.28Å; N423-M425 PolarHBondContact O-N 3.08Å
426	T	50.1	Low	54.5	Low	89 Å²	89	67.3 Å²	67.3	55%	0.546	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-68.9	144.4	171.7	48.4	0	0	0	0	109.9
427	P	49.9	Very low	54.3	Low	18 Å²	18	71.3 Å²	71.3	12%	0.117	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-56.3	149.3	176.5	22.8	-32	0	0	0	111	D429 N430	P427-D429 PolarHBondContact O-N 3.44Å; P427-N430 PolarHBondContact O-N 2.9Å
428	V	50.3	Low	54.5	Low	126 Å²	126	71.9 Å²	71.9	76%	0.764	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-30.4	-170.7	178.5	0	0	0	0	113.2	N430	V428-N430 VanDerWaalsContact C-N 3.35Å; V428-N430 PolarHBondContact O-N 2.82Å
429	D	48.7	Very low	55	Low	95 Å²	95	73.5 Å²	73.5	51%	0.508	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-1.7	-174.8	-64.8	-29.6	0	0	0	114.2	P427 V431	P427-D429 PolarHBondContact O-N 3.44Å; D429-V431 HydrophobicContact CB-CG2 4.47Å; D429-V431 WeakPolarHBondContact O-CG2 3.48Å; D429-V431 PolarHBondContact O-N 3.36Å
430	N	47.8	Very low	55.7	Low	130 Å²	130	74.7 Å²	74.7	70%	0.695	42%	0.42	S	S	*	.			trans	51.7	7	-176.1	-76.3	-24	0	0	0	115.4	P427 V428 L432	P427-N430 PolarHBondContact O-N 2.9Å; V428-N430 VanDerWaalsContact C-N 3.35Å; V428-N430 PolarHBondContact O-N 2.82Å; N430-L432 PolarHBondContact O-N 3.4Å
431	V	47.7	Very low	56.6	Low	93 Å²	93	72.8 Å²	72.8	56%	0.564	42%	0.417	S	S	*	.			trans	-85.1	94	172	-175.4	0	0	0	0	107	D429 R433	D429-V431 HydrophobicContact CB-CG2 4.47Å; D429-V431 WeakPolarHBondContact O-CG2 3.48Å; D429-V431 PolarHBondContact O-N 3.36Å; V431-R433 VanDerWaalsContact C-N 3.33Å; V431-R433 PolarHBondContact O-N 2.81Å
432	L	49	Very low	57.7	Low	116 Å²	116	71.7 Å²	71.7	61%	0.607	41%	0.411	S	S	*	.			trans	-64.3	99.5	160.4	-80.3	150.7	0	0	0	106.8	N430	N430-L432 PolarHBondContact O-N 3.4Å
433	R	57.1	Low	58.9	Low	65 Å²	65	69.2 Å²	69.2	25%	0.245	39%	0.393	C	S	.	.			trans	-61.3	147.1	166.9	-84.5	-158.2	-163.3	-137.5	5.5	108.8	H358 E386 V431 W435 T436	H358-R433 PolarHBondContact NE2-NE 3.21Å; E386-R433 IonicContact OE1-CZ 3.85Å; E386-R433 IonicContact OE1-NE 3.4Å; E386-R433 IonicContact OE1-NH1 2.67Å; E386-R433 PolarHBondContact OE1-NH1 2.92Å; E386-R433 IonicContact OE1-NH2 3.28Å; E386-R433 IonicContact OE2-CZ 3.7Å; E386-R433 IonicContact OE2-NH1 3.91Å; E386-R433 PolarHBondContact OE2-NH1 3Å; E386-R433 IonicContact OE2-NH2 3.85Å; V431-R433 VanDerWaalsContact C-N 3.33Å; V431-R433 PolarHBondContact O-N 2.81Å; R433-W435 PolarHBondContact O-N 2.8Å; R433-T436 PolarHBondContact O-N 3.07Å; R433-T436 PolarHBondContact O-OG1 2.97Å
434	P	51.3	Low	60.1	Low	81 Å²	81	70.9 Å²	70.9	53%	0.526	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	139.2	173.3	-16.6	28.3	0	0	0	109.3	L389	L389-P434 HydrophobicContact CD2-CB 3.79Å; L389-P434 HydrophobicContact CD2-CG 4.01Å
435	W	62.8	Low	61.5	Low	44 Å²	44	71.4 Å²	71.4	17%	0.167	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	5.9	173.3	-39.1	-9.1	0	0	0	116.4	D385 A388 L389 P396 W399 R433 D437 A438 W439	D385-W435 HydrophobicContact CB-CE3 3.53Å; D385-W435 HydrophobicContact CB-CZ3 3.59Å; A388-W435 HydrophobicContact CB-CH2 3.64Å; A388-W435 HydrophobicContact CB-CZ3 4.05Å; L389-W435 HydrophobicContact CD2-CD2 3.94Å; L389-W435 HydrophobicContact CD2-CE3 4.48Å; L389-W435 HydrophobicContact CD2-CG 4.44Å; L389-W435 HydrophobicContact CD2-CH2 4.33Å; L389-W435 HydrophobicContact CD2-CZ2 3.75Å; L389-W435 HydrophobicContact CG-CD2 4.48Å; L389-W435 HydrophobicContact CG-CH2 4.38Å; L389-W435 HydrophobicContact CG-CZ2 4.27Å; L389-W435 HydrophobicContact CG-CZ3 4.5Å; P396-W435 VanDerWaalsContact CB-CD1 3.4Å; P396-W435 HydrophobicContact CB-CD2 3.85Å; P396-W435 HydrophobicContact CB-CG 3.73Å; P396-W435 HydrophobicContact CB-CZ2 4.25Å; P396-W435 HydrophobicContact CG-CG 4.36Å; W399-W435 HydrophobicContact CD2-CH2 4.09Å; W399-W435 AromaticContact CD2-CZ3 3.81Å; W399-W435 HydrophobicContact CD2-CZ3 3.81Å; W399-W435 HydrophobicContact CE3-CE3 4.01Å; W399-W435 HydrophobicContact CE3-CH2 4.09Å; W399-W435 AromaticContact CE3-CZ3 3.4Å; W399-W435 HydrophobicContact CE3-CZ3 3.4Å; W399-W435 HydrophobicContact CG-CH2 4.39Å; W399-W435 HydrophobicContact CH2-CZ3 4.07Å; W399-W435 HydrophobicContact CZ2-CZ3 4.41Å; W399-W435 AromaticContact CZ3-CE3 3.98Å; W399-W435 HydrophobicContact CZ3-CE3 3.98Å; W399-W435 AromaticContact CZ3-CZ3 3.55Å; W399-W435 HydrophobicContact CZ3-CZ3 3.55Å; R433-W435 PolarHBondContact O-N 2.8Å; W435-D437 PolarHBondContact O-N 2.03Å; W435-A438 HydrophobicContact CB-CB 4.26Å; W435-A438 WeakPolarHBondContact O-CA 3.48Å; W435-A438 WeakPolarHBondContact O-CB 3.47Å; W435-A438 PolarHBondContact O-N 2.8Å; W435-W439 PolarHBondContact O-N 3.49Å; W435-W439 VanDerWaalsContact O-N 3.08Å
436	T	61.7	Low	63.3	Low	31 Å²	31	67.3 Å²	67.3	19%	0.19	37%	0.368	C	S	.	.	H	α-helix	trans	-54.6	-37.9	172.3	18.7	0	0	0	0	112.9	R433 A438 W439	R433-T436 PolarHBondContact O-N 3.07Å; R433-T436 PolarHBondContact O-OG1 2.97Å; T436-A438 VanDerWaalsContact C-N 3.33Å; T436-A438 PolarHBondContact O-N 2.83Å; T436-W439 WeakPolarHBondContact O-CB 3.07Å; T436-W439 PolarHBondContact O-N 2.8Å
437	D	62.2	Low	64.8	Low	138 Å²	138	64 Å²	64	74%	0.738	35%	0.349	S	S	*	.	H	α-helix	trans	-65.5	-37.1	175.3	-61.7	-29.8	0	0	0	112.2	W435 W439	W435-D437 PolarHBondContact O-N 2.03Å; D437-W439 VanDerWaalsContact C-N 3.32Å; D437-W439 PolarHBondContact O-N 2.85Å
438	A	66.8	Low	66.3	Low	26 Å²	26	69.8 Å²	69.8	22%	0.215	37%	0.374	C	S	.	.	H	α-helix	trans	-70.3	-29.9	179.6	0	0	0	0	0	111.8	L400 W435 T436 Q440 A441 A442	L400-A438 HydrophobicContact CD2-CB 4.18Å; W435-A438 HydrophobicContact CB-CB 4.26Å; W435-A438 WeakPolarHBondContact O-CA 3.48Å; W435-A438 WeakPolarHBondContact O-CB 3.47Å; W435-A438 PolarHBondContact O-N 2.8Å; T436-A438 VanDerWaalsContact C-N 3.33Å; T436-A438 PolarHBondContact O-N 2.83Å; A438-Q440 PolarHBondContact O-N 2.81Å; A438-A441 PolarHBondContact O-N 3.46Å; A438-A442 WeakPolarHBondContact O-CB 3.22Å; A438-A442 PolarHBondContact O-N 2.83Å
439	W	73.7	Confident	67.7	Low	35 Å²	35	67.7 Å²	67.7	13%	0.133	36%	0.355	C	S	.	.	H	α-helix	trans	-58.6	-45.5	177.2	-179.8	86.8	0	0	0	112.4	Y356 L421 W435 T436 D437 A441 A442 V443	Y356-W439 VanDerWaalsContact C-NE1 3.3Å; Y356-W439 PolarHBondContact O-NE1 3.03Å; L421-W439 HydrophobicContact CD2-CE3 3.68Å; L421-W439 HydrophobicContact CD2-CH2 4.24Å; L421-W439 HydrophobicContact CD2-CZ3 3.41Å; L421-W439 VanDerWaalsContact CD2-CZ3 3.41Å; W435-W439 PolarHBondContact O-N 3.49Å; W435-W439 VanDerWaalsContact O-N 3.08Å; T436-W439 WeakPolarHBondContact O-CB 3.07Å; T436-W439 PolarHBondContact O-N 2.8Å; D437-W439 VanDerWaalsContact C-N 3.32Å; D437-W439 PolarHBondContact O-N 2.85Å; W439-A441 VanDerWaalsContact C-N 3.34Å; W439-A441 PolarHBondContact O-N 2.81Å; W439-A442 WeakPolarHBondContact O-CB 3.48Å; W439-A442 PolarHBondContact O-N 2.83Å; W439-V443 HydrophobicContact CD2-CG2 3.89Å; W439-V443 VanDerWaalsContact CE2-CG2 3.5Å; W439-V443 HydrophobicContact CE3-CG2 4.35Å; W439-V443 HydrophobicContact CG-CG2 4.4Å; W439-V443 HydrophobicContact CH2-CG2 4.17Å; W439-V443 HydrophobicContact CZ2-CG2 3.69Å; W439-V443 HydrophobicContact CZ3-CG2 4.46Å; W439-V443 WeakPolarHBondContact O-CG2 3.29Å; W439-V443 PolarHBondContact O-N 3.02Å
440	Q	73.4	Confident	69.2	Low	59 Å²	59	63.2 Å²	63.2	28%	0.276	33%	0.331	S	S	.	.	H	α-helix	trans	-63.3	-42.4	179.4	-67.3	-170.1	11.8	0	0	111.6	A438 R444	A438-Q440 PolarHBondContact O-N 2.81Å; Q440-R444 WeakPolarHBondContact O-CB 3.39Å; Q440-R444 WeakPolarHBondContact O-CG 3.42Å; Q440-R444 PolarHBondContact O-N 3.05Å
441	A	73.9	Confident	70.5	Confident	43 Å²	43	61.4 Å²	61.4	36%	0.355	32%	0.324	S	S	.	.	H	α-helix	trans	-63.3	-42.3	175.9	0	0	0	0	0	111.5	A438 W439 R444 S445	A438-A441 PolarHBondContact O-N 3.46Å; W439-A441 VanDerWaalsContact C-N 3.34Å; W439-A441 PolarHBondContact O-N 2.81Å; A441-R444 PolarHBondContact O-N 3.24Å; A441-S445 WeakPolarHBondContact O-CB 3.44Å; A441-S445 PolarHBondContact O-N 2.84Å; A441-S445 PolarHBondContact O-OG 2.96Å
442	A	79.2	Confident	71.7	Confident	2 Å²	2	61.8 Å²	61.8	2%	0.017	33%	0.327	C	S	.	.	H	α-helix	trans	-61.3	-50.8	176.7	0	0	0	0	0	111.7	L355 L400 A438 W439 R444 S445 V446	L355-A442 HydrophobicContact CD1-CB 4.36Å; L355-A442 HydrophobicContact CD2-CB 3.95Å; L400-A442 HydrophobicContact CD1-CB 3.6Å; L400-A442 HydrophobicContact CD2-CB 3.96Å; L400-A442 HydrophobicContact CG-CB 4.39Å; A438-A442 WeakPolarHBondContact O-CB 3.22Å; A438-A442 PolarHBondContact O-N 2.83Å; W439-A442 WeakPolarHBondContact O-CB 3.48Å; W439-A442 PolarHBondContact O-N 2.83Å; A442-R444 PolarHBondContact O-N 3.37Å; A442-S445 PolarHBondContact O-N 3.13Å; A442-V446 WeakPolarHBondContact O-CG2 3.45Å; A442-V446 PolarHBondContact O-N 2.8Å
443	V	80.6	Confident	72.8	Confident	21 Å²	21	58 Å²	58	13%	0.127	31%	0.311	C	S	.	.	H	α-helix	trans	-61.8	-44.2	179.7	171.9	0	0	0	0	111.1	L412 W439 S445 V446 C447	L412-V443 HydrophobicContact CD2-CG1 4.13Å; L412-V443 HydrophobicContact CD2-CG2 4.27Å; W439-V443 HydrophobicContact CD2-CG2 3.89Å; W439-V443 VanDerWaalsContact CE2-CG2 3.5Å; W439-V443 HydrophobicContact CE3-CG2 4.35Å; W439-V443 HydrophobicContact CG-CG2 4.4Å; W439-V443 HydrophobicContact CH2-CG2 4.17Å; W439-V443 HydrophobicContact CZ2-CG2 3.69Å; W439-V443 HydrophobicContact CZ3-CG2 4.46Å; W439-V443 WeakPolarHBondContact O-CG2 3.29Å; W439-V443 PolarHBondContact O-N 3.02Å; V443-S445 VanDerWaalsContact C-N 3.33Å; V443-S445 PolarHBondContact O-N 2.75Å; V443-V446 PolarHBondContact O-N 2.93Å; V443-C447 WeakPolarHBondContact O-CB 3.3Å; V443-C447 PolarHBondContact O-N 2.81Å; V443-C447 PolarHBondContact O-SG 3.4Å
444	R	78.4	Confident	72.8	Confident	145 Å²	145	64.4 Å²	64.4	55%	0.547	34%	0.34	S	S	.	.	H	α-helix	trans	-59.4	-45.1	174.7	-75.3	-172.6	-163.4	115.5	8.3	111.6	Q440 A441 A442 C447 Q448	Q440-R444 WeakPolarHBondContact O-CB 3.39Å; Q440-R444 WeakPolarHBondContact O-CG 3.42Å; Q440-R444 PolarHBondContact O-N 3.05Å; A441-R444 PolarHBondContact O-N 3.24Å; A442-R444 PolarHBondContact O-N 3.37Å; R444-C447 PolarHBondContact O-N 3.41Å; R444-Q448 WeakPolarHBondContact O-CB 3.32Å; R444-Q448 PolarHBondContact O-N 3.47Å
445	S	80.5	Confident	73.1	Confident	56 Å²	56	62.8 Å²	62.8	39%	0.392	33%	0.33	S	S	.	.	H	α-helix	trans	-63.1	-43.5	179.5	-58.4	0	0	0	0	112	A441 A442 V443 Q448 K449	A441-S445 WeakPolarHBondContact O-CB 3.44Å; A441-S445 PolarHBondContact O-N 2.84Å; A441-S445 PolarHBondContact O-OG 2.96Å; A442-S445 PolarHBondContact O-N 3.13Å; V443-S445 VanDerWaalsContact C-N 3.33Å; V443-S445 PolarHBondContact O-N 2.75Å; S445-Q448 PolarHBondContact O-N 3.3Å; S445-K449 VanDerWaalsContact O-CB 3.32Å; S445-K449 WeakPolarHBondContact O-CB 3.32Å; S445-K449 PolarHBondContact O-N 3.25Å
446	V	83.8	Confident	72.5	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-64.9	-44	175.9	177.3	0	0	0	0	110.9	L355 M404 Y410 L412 A442 V443 Q448 K449 A450 Y462 W484	L355-V446 HydrophobicContact CD1-CG2 3.96Å; M404-V446 HydrophobicContact CE-CG2 3.75Å; M404-V446 HydrophobicContact SD-CG2 3.64Å; Y410-V446 HydrophobicContact CD1-CG1 4.28Å; Y410-V446 HydrophobicContact CD1-CG2 3.67Å; Y410-V446 HydrophobicContact CE1-CG2 4.23Å; Y410-V446 HydrophobicContact CG-CG1 4.03Å; Y410-V446 HydrophobicContact CG-CG2 4.26Å; L412-V446 HydrophobicContact CD1-CG1 4.1Å; A442-V446 WeakPolarHBondContact O-CG2 3.45Å; A442-V446 PolarHBondContact O-N 2.8Å; V443-V446 PolarHBondContact O-N 2.93Å; V446-Q448 PolarHBondContact O-N 3.28Å; V446-K449 PolarHBondContact O-N 3.38Å; V446-A450 VanDerWaalsContact O-CB 3.31Å; V446-A450 WeakPolarHBondContact O-CB 2.81Å; V446-A450 PolarHBondContact O-N 3.06Å; V446-Y462 HydrophobicContact CG1-CD1 3.84Å; V446-Y462 HydrophobicContact CG1-CE1 4.26Å; V446-W484 HydrophobicContact CG1-CH2 3.91Å
447	C	82.1	Confident	72.1	Confident	21 Å²	21	68.1 Å²	68.1	14%	0.142	38%	0.377	C	S	.	.	H	α-helix	trans	-60.9	-44.6	176.7	-73.4	0	0	0	0	112.1	V443 R444 A450 V451	V443-C447 WeakPolarHBondContact O-CB 3.3Å; V443-C447 PolarHBondContact O-N 2.81Å; V443-C447 PolarHBondContact O-SG 3.4Å; R444-C447 PolarHBondContact O-N 3.41Å; C447-A450 PolarHBondContact O-N 3.4Å; C447-V451 WeakPolarHBondContact O-CG2 3.47Å; C447-V451 PolarHBondContact O-N 3.29Å
448	Q	81.2	Confident	72.2	Confident	139 Å²	139	69.6 Å²	69.6	65%	0.65	39%	0.385	S	S	*	.	H	α-helix	trans	-61.6	-47.1	176	-173	174.6	-3	0	0	110.8	R444 S445 V446 A450 V451 T452	R444-Q448 WeakPolarHBondContact O-CB 3.32Å; R444-Q448 PolarHBondContact O-N 3.47Å; S445-Q448 PolarHBondContact O-N 3.3Å; V446-Q448 PolarHBondContact O-N 3.28Å; Q448-A450 VanDerWaalsContact C-N 3.3Å; Q448-A450 PolarHBondContact O-N 2.93Å; Q448-V451 PolarHBondContact O-N 3.25Å; Q448-T452 WeakPolarHBondContact O-CG2 2.94Å; Q448-T452 PolarHBondContact O-N 3.45Å; Q448-T452 PolarHBondContact O-OG1 3.32Å
449	K	80.3	Confident	72.5	Confident	81 Å²	81	71.7 Å²	71.7	35%	0.352	39%	0.39	S	S	.	.	H	α-helix	trans	-61.4	-36.6	176.7	-158.6	-179.5	-179.6	171.1	0	112.5	M404 Y410 S445 V446 T452 S453 Y462	M404-K449 PolarHBondContact O-NZ 3.3Å; Y410-K449 PolarHBondContact OH-NZ 2.85Å; S445-K449 VanDerWaalsContact O-CB 3.32Å; S445-K449 WeakPolarHBondContact O-CB 3.32Å; S445-K449 PolarHBondContact O-N 3.25Å; V446-K449 PolarHBondContact O-N 3.38Å; K449-T452 PolarHBondContact O-OG1 2.98Å; K449-S453 WeakPolarHBondContact O-CB 3.16Å; K449-S453 PolarHBondContact O-N 3.26Å; K449-S453 PolarHBondContact O-OG 3.34Å; K449-Y462 HydrophobicContact CB-CE1 4.44Å; K449-Y462 WeakPolarHBondContact CG-OH 3.33Å; K449-Y462 PolarHBondContact O-OH 2.85Å
450	A	78.8	Confident	72.9	Confident	1 Å²	1	70.6 Å²	70.6	1%	0.008	39%	0.387	C	S	.	.	H	α-helix	trans	-68.2	-42.2	178.2	0	0	0	0	0	112.5	V446 C447 Q448 S453 Y462 W484	V446-A450 VanDerWaalsContact O-CB 3.31Å; V446-A450 WeakPolarHBondContact O-CB 2.81Å; V446-A450 PolarHBondContact O-N 3.06Å; C447-A450 PolarHBondContact O-N 3.4Å; Q448-A450 VanDerWaalsContact C-N 3.3Å; Q448-A450 PolarHBondContact O-N 2.93Å; A450-S453 PolarHBondContact O-OG 2.77Å; A450-Y462 HydrophobicContact CB-CD1 3.76Å; A450-Y462 HydrophobicContact CB-CD2 3.72Å; A450-Y462 HydrophobicContact CB-CE1 3.95Å; A450-Y462 HydrophobicContact CB-CE2 3.93Å; A450-Y462 HydrophobicContact CB-CG 3.63Å; A450-W484 HydrophobicContact CB-CZ2 3.72Å
451	V	75.8	Confident	73.5	Confident	92 Å²	92	69.5 Å²	69.5	56%	0.558	39%	0.385	S	S	*	.	H	α-helix	trans	-71.3	-40.3	178.3	174.1	0	0	0	0	111.4	C447 Q448 L481	C447-V451 WeakPolarHBondContact O-CG2 3.47Å; C447-V451 PolarHBondContact O-N 3.29Å; Q448-V451 PolarHBondContact O-N 3.25Å; V451-L481 HydrophobicContact CG2-CD1 4.13Å
452	T	74.1	Confident	74.2	Confident	101 Å²	101	67.9 Å²	67.9	62%	0.62	37%	0.37	S	S	*	.	H	α-helix	trans	-76.7	-25.6	179	57.6	0	0	0	0	112.9	Q448 K449 K454	Q448-T452 WeakPolarHBondContact O-CG2 2.94Å; Q448-T452 PolarHBondContact O-N 3.45Å; Q448-T452 PolarHBondContact O-OG1 3.32Å; K449-T452 PolarHBondContact O-OG1 2.98Å; T452-K454 PolarHBondContact O-N 3.06Å
453	S	71.2	Confident	74.8	Confident	38 Å²	38	67.8 Å²	67.8	27%	0.266	37%	0.369	S	S	.	.	S	Bend	trans	-70.2	116.6	176.8	80.5	0	0	0	0	110.7	K449 A450 S455 Y462	K449-S453 WeakPolarHBondContact O-CB 3.16Å; K449-S453 PolarHBondContact O-N 3.26Å; K449-S453 PolarHBondContact O-OG 3.34Å; A450-S453 PolarHBondContact O-OG 2.77Å; S453-S455 PolarHBondContact O-N 2.86Å; S453-Y462 VanDerWaalsContact OG-CE2 3.24Å; S453-Y462 WeakPolarHBondContact OG-CE2 3.49Å
454	K	58.2	Low	75.1	Confident	198 Å²	198	66.9 Å²	66.9	86%	0.861	36%	0.364	S	S	*	.			trans	-70.4	72.3	164.4	-69	179.4	-179.6	173.8	0	108.9	T452 T456	T452-K454 PolarHBondContact O-N 3.06Å; K454-T456 PolarHBondContact O-N 2.87Å
455	S	57.5	Low	75.5	Confident	47 Å²	47	60 Å²	60	33%	0.329	34%	0.337	S	S	.	.			trans	-62.4	101.2	171.6	171.3	0	0	0	0	108.6	S453 G457	S453-S455 PolarHBondContact O-N 2.86Å; S455-G457 VanDerWaalsContact C-N 3.35Å; S455-G457 PolarHBondContact OG-O 2.81Å
456	T	49	Very low	75.8	Confident	145 Å²	145	57.6 Å²	57.6	89%	0.89	32%	0.321	S	S	*	.			trans	-91.2	8.3	-175.3	38	0	0	0	0	113.5	K454	K454-T456 PolarHBondContact O-N 2.87Å
457	G	53.7	Low	75.9	Confident	43 Å²	43	57.6 Å²	57.6	44%	0.443	32%	0.321	S	S	.	.	S	Bend	trans	-137.5	164.1	180	0	0	0	0	0	113.6	S455 H459	S455-G457 VanDerWaalsContact C-N 3.35Å; S455-G457 PolarHBondContact OG-O 2.81Å; G457-H459 PolarHBondContact O-N 2.89Å
458	D	64.7	Low	75.7	Confident	169 Å²	169	58.3 Å²	58.3	90%	0.904	33%	0.326	S	S	*	.	S	Bend	trans	-60.7	-12.1	177.2	-69	-20.6	0	0	0	113.3
459	H	72.5	Confident	75.2	Confident	70 Å²	70	55.7 Å²	55.7	32%	0.324	32%	0.32	S	S	.	.			trans	-105.4	82.4	-175.1	-166.7	20.3	0	0	0	112.2	F409 G457 H499 S502	F409-H459 AromaticContact CE1-CE1 3.24Å; F409-H459 WeakPolarHBondContact CE1-CE1 3.14Å; F409-H459 AromaticContact CE1-ND1 3.93Å; F409-H459 AromaticContact CE1-NE2 3.88Å; F409-H459 AromaticContact CZ-CE1 3.17Å; F409-H459 WeakPolarHBondContact CZ-CE1 3.37Å; F409-H459 AromaticContact CZ-NE2 3.35Å; F409-H459 VanDerWaalsContact CZ-NE2 3.35Å; F409-H459 WeakPolarHBondContact CZ-NE2 3.49Å; G457-H459 PolarHBondContact O-N 2.89Å; H459-H499 PolarHBondContact CE1-O 2.82Å; H459-H499 AromaticContact ND1-CE1 3.37Å; H459-H499 PolarHBondContact ND1-CE1 2.78Å; H459-H499 AromaticContact ND1-ND1 3.67Å; H459-H499 AromaticContact ND1-NE2 3.55Å; H459-H499 PolarHBondContact NE2-O 3.09Å; H459-S502 PolarHBondContact CD2-OG 2.81Å; H459-S502 PolarHBondContact NE2-OG 3.47Å
460	T	82.2	Confident	74.7	Confident	12 Å²	12	52.1 Å²	52.1	7%	0.074	30%	0.304	C	S	.	.			trans	-80.6	138.8	179.2	74.5	0	0	0	0	111.3	Y462 C483 F485 H499	T460-Y462 PolarHBondContact O-N 3.48Å; T460-Y462 PolarHBondContact OG1-O 3.35Å; T460-C483 WeakPolarHBondContact CB-O 3.47Å; T460-C483 WeakPolarHBondContact CG2-O 2.97Å; T460-C483 PolarHBondContact OG1-O 3.48Å; T460-F485 PolarHBondContact OG1-N 2.88Å; T460-H499 PolarHBondContact O-NE2 2.92Å
461	P	86.2	Confident	74.1	Confident	35 Å²	35	54.9 Å²	54.9	23%	0.227	32%	0.322	C	S	.	.	S	Bend	trans	-76.9	-10	176.6	30.7	-33.8	0	0	0	112.9	N408 F409 Y410	N408-P461 WeakPolarHBondContact O-CB 3.1Å; F409-P461 CarbonylContact C-O 3.49Å; F409-P461 VanDerWaalsContact CA-O 3.3Å; F409-P461 WeakPolarHBondContact CA-O 3.44Å; F409-P461 HydrophobicContact CD1-CB 4.37Å; Y410-P461 PolarHBondContact N-O 2.89Å
462	Y	88.9	Confident	73.6	Confident	9 Å²	9	54.7 Å²	54.7	4%	0.035	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	116.3	-174.9	-48.6	-75.3	0	0	0	110.6	Y410 V446 K449 A450 S453 T460 F485	Y410-Y462 AromaticContact CD2-CD1 3.81Å; Y410-Y462 HydrophobicContact CD2-CD1 3.81Å; Y410-Y462 AromaticContact CD2-CE1 3.77Å; Y410-Y462 HydrophobicContact CD2-CE1 3.77Å; Y410-Y462 HydrophobicContact CE2-CE1 4.08Å; Y410-Y462 HydrophobicContact CG-CD1 4.33Å; V446-Y462 HydrophobicContact CG1-CD1 3.84Å; V446-Y462 HydrophobicContact CG1-CE1 4.26Å; K449-Y462 HydrophobicContact CB-CE1 4.44Å; K449-Y462 WeakPolarHBondContact CG-OH 3.33Å; K449-Y462 PolarHBondContact O-OH 2.85Å; A450-Y462 HydrophobicContact CB-CD1 3.76Å; A450-Y462 HydrophobicContact CB-CD2 3.72Å; A450-Y462 HydrophobicContact CB-CE1 3.95Å; A450-Y462 HydrophobicContact CB-CE2 3.93Å; A450-Y462 HydrophobicContact CB-CG 3.63Å; S453-Y462 VanDerWaalsContact OG-CE2 3.24Å; S453-Y462 WeakPolarHBondContact OG-CE2 3.49Å; T460-Y462 PolarHBondContact O-N 3.48Å; T460-Y462 PolarHBondContact OG1-O 3.35Å; Y462-F485 PolarHBondContact O-N 3.28Å
463	I	90.2	Very high	73.1	Confident	0 Å²	0	55 Å²	55	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.8	-174.1	-54.6	167.6	0	0	0	109.4	F409 Y410 L411 L412 F485 L496 L500	F409-I463 HydrophobicContact CB-CD1 4.14Å; F409-I463 HydrophobicContact CD1-CD1 3.85Å; F409-I463 HydrophobicContact CD1-CG1 4.44Å; F409-I463 HydrophobicContact CG-CD1 4.27Å; Y410-I463 PolarHBondContact O-N 2.96Å; L411-I463 HydrophobicContact CD1-CB 3.9Å; L411-I463 HydrophobicContact CD1-CG2 3.41Å; L411-I463 VanDerWaalsContact CD1-CG2 3.41Å; L412-I463 PolarHBondContact N-O 2.81Å; I463-F485 CarbonylContact C-O 3.59Å; I463-F485 WeakPolarHBondContact CA-O 3.31Å; I463-F485 HydrophobicContact CG1-CB 4.25Å; I463-F485 HydrophobicContact CG1-CD1 4.24Å; I463-F485 HydrophobicContact CG2-CD1 3.84Å; I463-L496 HydrophobicContact CD1-CD1 3.82Å; I463-L496 HydrophobicContact CG2-CD1 3.88Å; I463-L500 HydrophobicContact CD1-CD2 3.7Å; I463-L500 HydrophobicContact CD1-CG 4.47Å
464	C	87	Confident	72.7	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.014	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.5	172.9	179.4	0	0	0	0	109.2	L475 W484 F485 R486 C487	C464-L475 WeakPolarHBondContact SG-CD2 3.38Å; C464-W484 HydrophobicContact CB-CE3 3.95Å; C464-F485 PolarHBondContact N-O 2.88Å; C464-R486 HydrophobicContact CB-CG 4.48Å; C464-R486 WeakPolarHBondContact O-CA 3.24Å; C464-C487 PolarHBondContact O-N 2.85Å; C464-C487 VanDerWaalsContact O-N 3.07Å
465	S	88.1	Confident	73.2	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	139.8	-177.8	-173.6	0	0	0	0	111.7	L412 L413 F414 C487 L489	L412-S465 PolarHBondContact O-N 2.84Å; L413-S465 WeakPolarHBondContact CA-O 3.26Å; F414-S465 PolarHBondContact N-O 3.43Å; S465-C487 VanDerWaalsContact CA-O 3.29Å; S465-C487 WeakPolarHBondContact CA-O 2.89Å; S465-C487 PolarHBondContact OG-O 3.08Å; S465-L489 WeakPolarHBondContact OG-CD1 3.49Å; S465-L489 VanDerWaalsContact OG-CG 3.3Å; S465-L489 WeakPolarHBondContact OG-CG 3.42Å
466	T	86.5	Confident	73.6	Confident	6 Å²	6	46.3 Å²	46.3	4%	0.037	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	160.7	171.1	72.2	0	0	0	0	110.2	T470 L475 C487 R488 L489	T466-T470 WeakPolarHBondContact CB-OG1 3.39Å; T466-L475 HydrophobicContact CG2-CD1 3.91Å; T466-L475 HydrophobicContact CG2-CD2 3.73Å; T466-L475 HydrophobicContact CG2-CG 3.95Å; T466-C487 PolarHBondContact N-O 3.06Å; T466-C487 VanDerWaalsContact N-O 3.15Å; T466-R488 WeakPolarHBondContact O-CA 3.17Å; T466-L489 PolarHBondContact O-N 2.85Å
467	L	85.4	Confident	74.5	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	153.1	168.9	-60.4	178.5	0	0	0	109.6	Y363 V366 T469 T470 L489 I523 Y526 F527	Y363-L467 HydrophobicContact CD2-CD1 4.38Å; Y363-L467 HydrophobicContact CE2-CD1 3.99Å; V366-L467 HydrophobicContact CG1-CD2 4.11Å; L467-T469 PolarHBondContact O-N 2.85Å; L467-T469 VanDerWaalsContact O-N 3.12Å; L467-T470 HydrophobicContact CB-CG2 4.09Å; L467-T470 PolarHBondContact N-OG1 2.9Å; L467-T470 PolarHBondContact O-N 2.9Å; L467-T470 PolarHBondContact O-OG1 2.96Å; L467-L489 CarbonylContact C-O 3.54Å; L467-L489 WeakPolarHBondContact CA-O 3.4Å; L467-L489 HydrophobicContact CD2-CB 4.4Å; L467-I523 HydrophobicContact CD2-CD1 4.04Å; L467-I523 HydrophobicContact CD2-CG1 4.14Å; L467-Y526 HydrophobicContact CD1-CD1 3.99Å; L467-Y526 HydrophobicContact CD1-CE1 3.92Å; L467-F527 HydrophobicContact CB-CE2 4.35Å; L467-F527 HydrophobicContact CB-CZ 3.8Å; L467-F527 HydrophobicContact CD1-CE2 4.36Å; L467-F527 HydrophobicContact CD1-CZ 3.86Å; L467-F527 HydrophobicContact CG-CZ 4.5Å
468	S	78.1	Confident	75.1	Confident	36 Å²	36	45.8 Å²	45.8	25%	0.252	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-30.7	-171.4	54.4	0	0	0	0	114.6	L489 E491	S468-L489 PolarHBondContact N-O 2.03Å; S468-E491 WeakPolarHBondContact CB-OE1 3.44Å
469	T	71.1	Confident	75.3	Confident	84 Å²	84	37.8 Å²	37.8	52%	0.515	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-4.3	179.1	72.8	0	0	0	0	113.9	L467 F527	L467-T469 PolarHBondContact O-N 2.85Å; L467-T469 VanDerWaalsContact O-N 3.12Å; T469-F527 HydrophobicContact CG2-CE2 4.19Å; T469-F527 HydrophobicContact CG2-CZ 4.34Å; T469-F527 WeakPolarHBondContact OG1-CE1 3.18Å; T469-F527 WeakPolarHBondContact OG1-CE2 3.32Å; T469-F527 WeakPolarHBondContact OG1-CZ 3.49Å
470	T	68.8	Low	75.1	Confident	5 Å²	5	37.8 Å²	37.8	3%	0.031	24%	0.236	C	C	.	.	S	Bend	trans	-81.5	129.5	179.3	57.1	0	0	0	0	110	E416 T466 L467	E416-T470 HydrophobicContact CG-CG2 3.82Å; T466-T470 WeakPolarHBondContact CB-OG1 3.39Å; L467-T470 HydrophobicContact CB-CG2 4.09Å; L467-T470 PolarHBondContact N-OG1 2.9Å; L467-T470 PolarHBondContact O-N 2.9Å; L467-T470 PolarHBondContact O-OG1 2.96Å
471	P	67.6	Low	74.5	Confident	60 Å²	60	40.6 Å²	40.6	39%	0.39	25%	0.25	S	S	.	.			trans	-68.2	137.3	-177.4	24.7	-29.3	0	0	0	110.6	E416 S473 V474	E416-P471 HydrophobicContact CG-CG 4.46Å; E416-P471 WeakPolarHBondContact OE1-CD 3.5Å; P471-S473 PolarHBondContact O-N 2.75Å; P471-V474 HydrophobicContact CG-CG2 4.02Å; P471-V474 WeakPolarHBondContact O-CG2 3.48Å; P471-V474 PolarHBondContact O-N 3.19Å; P471-V474 VanDerWaalsContact O-N 3.13Å
472	L	65	Low	73.7	Confident	88 Å²	88	44.6 Å²	44.6	46%	0.461	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-61.2	-18.9	179.8	-71.8	173.1	0	0	0	113.3	V474 L475	L472-V474 PolarHBondContact O-N 2.81Å; L472-V474 VanDerWaalsContact O-N 3.14Å; L472-L475 HydrophobicContact CD2-CD1 4.03Å; L472-L475 WeakPolarHBondContact O-CB 3.46Å; L472-L475 PolarHBondContact O-N 2.76Å; L472-L475 VanDerWaalsContact O-N 3.13Å
473	S	63.2	Low	73	Confident	108 Å²	108	45.3 Å²	45.3	76%	0.755	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-62.5	-13.8	175.7	57.7	0	0	0	0	113.9	P471 L475	P471-S473 PolarHBondContact O-N 2.75Å; S473-L475 VanDerWaalsContact C-N 3.32Å
474	V	63.9	Low	72.6	Confident	35 Å²	35	45.7 Å²	45.7	21%	0.212	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-76.6	-22.5	176.3	-176.2	0	0	0	0	112	S415 E416 V418 P471 L472 P476	S415-V474 WeakPolarHBondContact O-CG1 3.41Å; E416-V474 HydrophobicContact CG-CG2 3.98Å; V418-V474 HydrophobicContact CB-CG1 4.09Å; P471-V474 HydrophobicContact CG-CG2 4.02Å; P471-V474 WeakPolarHBondContact O-CG2 3.48Å; P471-V474 PolarHBondContact O-N 3.19Å; P471-V474 VanDerWaalsContact O-N 3.13Å; L472-V474 PolarHBondContact O-N 2.81Å; L472-V474 VanDerWaalsContact O-N 3.14Å; V474-P476 WeakPolarHBondContact O-CD 3.35Å
475	L	66.9	Low	72.6	Confident	18 Å²	18	47.8 Å²	47.8	9%	0.094	29%	0.292	C	S	.	.	S	Bend	trans	-70	126.7	-179.4	-65.9	177.4	0	0	0	110.4	F414 C464 T466 L472 S473	F414-L475 HydrophobicContact CB-CD2 3.85Å; F414-L475 HydrophobicContact CD1-CD2 4.36Å; F414-L475 HydrophobicContact CD2-CD2 3.48Å; F414-L475 VanDerWaalsContact CD2-CD2 3.48Å; F414-L475 HydrophobicContact CE2-CD2 4.14Å; F414-L475 HydrophobicContact CG-CD2 3.61Å; C464-L475 WeakPolarHBondContact SG-CD2 3.38Å; T466-L475 HydrophobicContact CG2-CD1 3.91Å; T466-L475 HydrophobicContact CG2-CD2 3.73Å; T466-L475 HydrophobicContact CG2-CG 3.95Å; L472-L475 HydrophobicContact CD2-CD1 4.03Å; L472-L475 WeakPolarHBondContact O-CB 3.46Å; L472-L475 PolarHBondContact O-N 2.76Å; L472-L475 VanDerWaalsContact O-N 3.13Å; S473-L475 VanDerWaalsContact C-N 3.32Å
476	P	66.8	Low	72.5	Confident	46 Å²	46	54.4 Å²	54.4	30%	0.299	32%	0.317	S	S	.	.			trans	-51.4	141.3	168.2	-27.2	33	0	0	0	111.8	V474 C478 L479	V474-P476 WeakPolarHBondContact O-CD 3.35Å; P476-C478 PolarHBondContact O-N 2.77Å; P476-C478 VanDerWaalsContact O-N 3.12Å; P476-L479 HydrophobicContact CB-CD1 4.41Å; P476-L479 HydrophobicContact CB-CG 4.36Å; P476-L479 HydrophobicContact CG-CD1 4.16Å; P476-L479 WeakPolarHBondContact O-CB 3.34Å; P476-L479 PolarHBondContact O-N 3.03Å
477	V	67.8	Low	72.5	Confident	120 Å²	120	54.4 Å²	54.4	73%	0.727	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-55.4	-35.2	-176.2	178.3	0	0	0	0	112.2	L479 T480	V477-L479 PolarHBondContact O-N 3.18Å; V477-L479 VanDerWaalsContact O-N 3.16Å; V477-T480 WeakPolarHBondContact O-CB 3.25Å; V477-T480 PolarHBondContact O-N 3.41Å; V477-T480 PolarHBondContact O-OG1 3.03Å
478	C	66.7	Low	72.5	Confident	57 Å²	57	58.7 Å²	58.7	39%	0.385	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-60.7	-23.3	176.7	58.8	0	0	0	0	114	P476 T480 L481 W484	P476-C478 PolarHBondContact O-N 2.77Å; P476-C478 VanDerWaalsContact O-N 3.12Å; C478-T480 VanDerWaalsContact C-N 3.34Å; C478-L481 WeakPolarHBondContact O-CB 3.38Å; C478-L481 WeakPolarHBondContact O-CD1 3.04Å; C478-L481 VanDerWaalsContact O-CG 3.29Å; C478-L481 WeakPolarHBondContact O-CG 2.97Å; C478-W484 PolarHBondContact O-NE1 3.35Å
479	L	68.7	Low	73	Confident	1 Å²	1	57 Å²	57	1%	0.005	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-89.3	-4.1	177.4	-54.6	-178.8	0	0	0	113	F414 P476 V477 L481 W484	F414-L479 HydrophobicContact CD2-CD1 4.31Å; F414-L479 HydrophobicContact CE1-CD1 3.85Å; F414-L479 HydrophobicContact CE2-CD1 3.31Å; F414-L479 HydrophobicContact CZ-CD1 3.05Å; P476-L479 HydrophobicContact CB-CD1 4.41Å; P476-L479 HydrophobicContact CB-CG 4.36Å; P476-L479 HydrophobicContact CG-CD1 4.16Å; P476-L479 WeakPolarHBondContact O-CB 3.34Å; P476-L479 PolarHBondContact O-N 3.03Å; V477-L479 PolarHBondContact O-N 3.18Å; V477-L479 VanDerWaalsContact O-N 3.16Å; L479-L481 VanDerWaalsContact C-N 3.28Å; L479-W484 HydrophobicContact CD2-CD2 4Å; L479-W484 VanDerWaalsContact CD2-CE2 3.46Å; L479-W484 HydrophobicContact CD2-CE3 4.3Å; L479-W484 HydrophobicContact CD2-CH2 3.62Å; L479-W484 HydrophobicContact CD2-CZ2 3.27Å; L479-W484 HydrophobicContact CD2-CZ3 4.12Å
480	T	67.2	Low	73.5	Confident	71 Å²	71	54.1 Å²	54.1	44%	0.436	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-85	-6.6	172.1	70.9	0	0	0	0	112.4	V477 C478	V477-T480 WeakPolarHBondContact O-CB 3.25Å; V477-T480 PolarHBondContact O-N 3.41Å; V477-T480 PolarHBondContact O-OG1 3.03Å; C478-T480 VanDerWaalsContact C-N 3.34Å
481	L	71.2	Confident	74.2	Confident	71 Å²	71	60.3 Å²	60.3	37%	0.372	33%	0.333	S	S	.	.	S	Bend	trans	-63.2	147.8	177.5	-66.7	175.8	0	0	0	111.6	V451 C478 L479 C483 W484	V451-L481 HydrophobicContact CG2-CD1 4.13Å; C478-L481 WeakPolarHBondContact O-CB 3.38Å; C478-L481 WeakPolarHBondContact O-CD1 3.04Å; C478-L481 VanDerWaalsContact O-CG 3.29Å; C478-L481 WeakPolarHBondContact O-CG 2.97Å; L479-L481 VanDerWaalsContact C-N 3.28Å; L481-C483 PolarHBondContact O-N 2.9Å; L481-C483 VanDerWaalsContact O-N 3.09Å; L481-W484 PolarHBondContact O-N 2.74Å; L481-W484 VanDerWaalsContact O-N 3.17Å
482	P	68.7	Low	75.1	Confident	118 Å²	118	61.2 Å²	61.2	77%	0.766	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-12.5	-175.9	25.8	-34.3	0	0	0	114.4	W484	P482-W484 PolarHBondContact O-N 3.48Å
483	C	74.2	Confident	76.1	Confident	24 Å²	24	57.1 Å²	57.1	16%	0.162	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-8.1	173.9	54.3	0	0	0	0	113.7	T460 L481	T460-C483 WeakPolarHBondContact CB-O 3.47Å; T460-C483 WeakPolarHBondContact CG2-O 2.97Å; T460-C483 PolarHBondContact OG1-O 3.48Å; L481-C483 PolarHBondContact O-N 2.9Å; L481-C483 VanDerWaalsContact O-N 3.09Å
484	W	82.8	Confident	77	Confident	9 Å²	9	54.5 Å²	54.5	3%	0.034	29%	0.292	C	S	.	.	S	Bend	trans	-102.9	126.4	-179.3	-67.9	87.8	0	0	0	112.2	L412 V446 A450 C464 C478 L479 L481 P482	L412-W484 HydrophobicContact CD1-CH2 4.19Å; L412-W484 HydrophobicContact CD1-CZ3 4Å; L412-W484 HydrophobicContact CD2-CH2 4.15Å; L412-W484 HydrophobicContact CD2-CZ3 4.37Å; V446-W484 HydrophobicContact CG1-CH2 3.91Å; A450-W484 HydrophobicContact CB-CZ2 3.72Å; C464-W484 HydrophobicContact CB-CE3 3.95Å; C478-W484 PolarHBondContact O-NE1 3.35Å; L479-W484 HydrophobicContact CD2-CD2 4Å; L479-W484 VanDerWaalsContact CD2-CE2 3.46Å; L479-W484 HydrophobicContact CD2-CE3 4.3Å; L479-W484 HydrophobicContact CD2-CH2 3.62Å; L479-W484 HydrophobicContact CD2-CZ2 3.27Å; L479-W484 HydrophobicContact CD2-CZ3 4.12Å; L481-W484 PolarHBondContact O-N 2.74Å; L481-W484 VanDerWaalsContact O-N 3.17Å; P482-W484 PolarHBondContact O-N 3.48Å
485	F	86	Confident	78	Confident	45 Å²	45	53.9 Å²	53.9	20%	0.197	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	125.6	163.9	-179.5	-102.9	0	0	0	108.6	T460 Y462 I463 C464 C487 A495 L496 H499	T460-F485 PolarHBondContact OG1-N 2.88Å; Y462-F485 PolarHBondContact O-N 3.28Å; I463-F485 CarbonylContact C-O 3.59Å; I463-F485 WeakPolarHBondContact CA-O 3.31Å; I463-F485 HydrophobicContact CG1-CB 4.25Å; I463-F485 HydrophobicContact CG1-CD1 4.24Å; I463-F485 HydrophobicContact CG2-CD1 3.84Å; C464-F485 PolarHBondContact N-O 2.88Å; F485-C487 HydrophobicContact CE1-CB 3.93Å; F485-A495 HydrophobicContact CZ-CB 4.32Å; F485-L496 HydrophobicContact CE1-CD1 4.24Å; F485-H499 HydrophobicContact CD1-CB 4.19Å; F485-H499 AromaticContact CD1-CD2 3.77Å; F485-H499 AromaticContact CD1-CG 3.87Å; F485-H499 HydrophobicContact CD2-CB 4.4Å; F485-H499 AromaticContact CD2-CE1 3.73Å; F485-H499 AromaticContact CD2-CG 3.83Å; F485-H499 AromaticContact CD2-ND1 3.54Å; F485-H499 HydrophobicContact CE1-CB 3.89Å; F485-H499 HydrophobicContact CE2-CB 4.1Å; F485-H499 AromaticContact CE2-ND1 3.9Å; F485-H499 HydrophobicContact CG-CB 4.45Å; F485-H499 AromaticContact CG-CD2 3.71Å; F485-H499 AromaticContact CG-CE1 3.75Å; F485-H499 AromaticContact CG-CG 3.77Å; F485-H499 AromaticContact CG-ND1 3.83Å; F485-H499 AromaticContact CG-NE2 3.71Å; F485-H499 HydrophobicContact CZ-CB 3.84Å
486	R	85.4	Confident	79	Confident	140 Å²	140	53 Å²	53	53%	0.528	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	131.8	-176	-73.5	173.6	-82.5	159.1	-7.2	109.8	C464	C464-R486 HydrophobicContact CB-CG 4.48Å; C464-R486 WeakPolarHBondContact O-CA 3.24Å
487	C	86.4	Confident	79.8	Confident	5 Å²	5	51 Å²	51	3%	0.034	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	150.5	174.2	62.9	0	0	0	0	113.6	C464 S465 T466 F485 E492	C464-C487 PolarHBondContact O-N 2.85Å; C464-C487 VanDerWaalsContact O-N 3.07Å; S465-C487 VanDerWaalsContact CA-O 3.29Å; S465-C487 WeakPolarHBondContact CA-O 2.89Å; S465-C487 PolarHBondContact OG-O 3.08Å; T466-C487 PolarHBondContact N-O 3.06Å; T466-C487 VanDerWaalsContact N-O 3.15Å; F485-C487 HydrophobicContact CE1-CB 3.93Å; C487-E492 WeakPolarHBondContact CA-OE2 3.39Å; C487-E492 HydrophobicContact CB-CB 4.22Å
488	R	86.6	Confident	80.5	Confident	91 Å²	91	45.8 Å²	45.8	34%	0.343	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.1	171.5	-72.3	-175.9	175.7	159.4	-1.9	111.8	T466 E491 E492	T466-R488 WeakPolarHBondContact O-CA 3.17Å; R488-E491 PolarHBondContact O-N 2.76Å; R488-E492 HydrophobicContact CB-CG 4.46Å; R488-E492 PolarHBondContact N-OE2 3.06Å; R488-E492 WeakPolarHBondContact O-CB 2.85Å; R488-E492 PolarHBondContact O-N 3.26Å
489	L	87.2	Confident	81.4	Confident	2 Å²	2	44 Å²	44	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	140.8	177.5	-65	175	0	0	0	111.2	L370 L413 S465 T466 L467 S468 L493 L496	L370-L489 HydrophobicContact CD1-CD1 3.76Å; L370-L489 HydrophobicContact CD2-CD1 3.54Å; L370-L489 HydrophobicContact CG-CD1 4.29Å; L413-L489 HydrophobicContact CD1-CD1 3.88Å; S465-L489 WeakPolarHBondContact OG-CD1 3.49Å; S465-L489 VanDerWaalsContact OG-CG 3.3Å; S465-L489 WeakPolarHBondContact OG-CG 3.42Å; T466-L489 PolarHBondContact O-N 2.85Å; L467-L489 CarbonylContact C-O 3.54Å; L467-L489 WeakPolarHBondContact CA-O 3.4Å; L467-L489 HydrophobicContact CD2-CB 4.4Å; S468-L489 PolarHBondContact N-O 2.03Å; L489-L493 HydrophobicContact CD2-CB 3.99Å; L489-L493 HydrophobicContact CD2-CD1 3.87Å; L489-L496 HydrophobicContact CD2-CD2 4.32Å
490	P	82.9	Confident	82.3	Confident	23 Å²	23	44.1 Å²	44.1	15%	0.149	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	cis	-90.8	-1.1	5.6	34.9	-33.4	0	0	0	115	L493 F516 Q520 I523	P490-L493 WeakPolarHBondContact O-CB 3.22Å; P490-L493 PolarHBondContact O-N 3.46Å; P490-F516 HydrophobicContact CB-CE2 3.91Å; P490-F516 HydrophobicContact CB-CZ 4.24Å; P490-Q520 HydrophobicContact CB-CG 4.41Å; P490-Q520 HydrophobicContact CG-CG 4.36Å; P490-I523 HydrophobicContact CB-CD1 4.18Å; P490-I523 HydrophobicContact CG-CD1 4.16Å
491	E	83.6	Confident	83	Confident	134 Å²	134	43 Å²	43	63%	0.626	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-42.8	-168.4	-65.8	172.2	-169.3	0	0	113.9	S468 R488	S468-E491 WeakPolarHBondContact CB-OE1 3.44Å; R488-E491 PolarHBondContact O-N 2.76Å
492	E	86	Confident	83.4	Confident	79 Å²	79	43.7 Å²	43.7	37%	0.369	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	19.8	-175.6	-60.5	179	163.4	0	0	112.4	C487 R488 S494 A495 L496	C487-E492 WeakPolarHBondContact CA-OE2 3.39Å; C487-E492 HydrophobicContact CB-CB 4.22Å; R488-E492 HydrophobicContact CB-CG 4.46Å; R488-E492 PolarHBondContact N-OE2 3.06Å; R488-E492 WeakPolarHBondContact O-CB 2.85Å; R488-E492 PolarHBondContact O-N 3.26Å; E492-S494 PolarHBondContact O-N 3.07Å; E492-A495 HydrophobicContact CB-CB 4.32Å; E492-A495 WeakPolarHBondContact O-CA 3.32Å; E492-A495 WeakPolarHBondContact O-CB 3.32Å; E492-A495 PolarHBondContact O-N 2.8Å; E492-L496 PolarHBondContact O-N 3.4Å
493	L	85.2	Confident	83.7	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-59	-32.3	177.4	-179	65.2	0	0	0	112.2	L370 V373 L489 P490 A495 L496 A497 L510 F516	L370-L493 HydrophobicContact CD1-CD1 4.4Å; V373-L493 HydrophobicContact CG1-CD1 4.33Å; V373-L493 HydrophobicContact CG1-CD2 3.77Å; L489-L493 HydrophobicContact CD2-CB 3.99Å; L489-L493 HydrophobicContact CD2-CD1 3.87Å; P490-L493 WeakPolarHBondContact O-CB 3.22Å; P490-L493 PolarHBondContact O-N 3.46Å; L493-A495 VanDerWaalsContact C-N 3.34Å; L493-L496 HydrophobicContact CD1-CD2 4.16Å; L493-L496 PolarHBondContact O-N 3.1Å; L493-A497 WeakPolarHBondContact O-CB 3.47Å; L493-A497 PolarHBondContact O-N 2.71Å; L493-L510 HydrophobicContact CB-CD1 4.45Å; L493-L510 HydrophobicContact CD2-CD1 3.44Å; L493-L510 VanDerWaalsContact CD2-CD1 3.44Å; L493-L510 HydrophobicContact CG-CD1 3.72Å; L493-F516 HydrophobicContact CB-CE2 4.48Å; L493-F516 HydrophobicContact CD2-CD2 3.3Å; L493-F516 HydrophobicContact CD2-CE2 3.42Å; L493-F516 VanDerWaalsContact CD2-CE2 3.42Å; L493-F516 HydrophobicContact CD2-CG 4.44Å
494	S	82.7	Confident	83.3	Confident	53 Å²	53	48.5 Å²	48.5	37%	0.371	24%	0.241	S	C	.	.	H	α-helix	trans	-65.7	-36.6	174	60.9	0	0	0	0	112.3	E492 A497 C498	E492-S494 PolarHBondContact O-N 3.07Å; S494-A497 PolarHBondContact O-N 3.44Å; S494-C498 WeakPolarHBondContact O-CB 3.46Å; S494-C498 PolarHBondContact O-N 3.3Å; S494-C498 PolarHBondContact O-SG 2.98Å
495	A	84.9	Confident	82.3	Confident	21 Å²	21	56 Å²	56	17%	0.174	28%	0.276	C	S	.	.	H	α-helix	trans	-70	-40.8	175.3	0	0	0	0	0	111	F485 E492 L493 A497 C498 H499	F485-A495 HydrophobicContact CZ-CB 4.32Å; E492-A495 HydrophobicContact CB-CB 4.32Å; E492-A495 WeakPolarHBondContact O-CA 3.32Å; E492-A495 WeakPolarHBondContact O-CB 3.32Å; E492-A495 PolarHBondContact O-N 2.8Å; L493-A495 VanDerWaalsContact C-N 3.34Å; A495-A497 VanDerWaalsContact C-N 3.35Å; A495-A497 PolarHBondContact O-N 3.33Å; A495-C498 PolarHBondContact O-N 3.27Å; A495-H499 WeakPolarHBondContact O-CB 3.43Å; A495-H499 PolarHBondContact O-N 3.22Å
496	L	87.4	Confident	81.1	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58.6	-46	172.2	178.9	62.5	0	0	0	111.5	L374 L411 I463 F485 L489 E492 L493 C498 H499 L500	L374-L496 HydrophobicContact CD2-CD2 4.3Å; L411-L496 HydrophobicContact CD2-CD2 4.39Å; I463-L496 HydrophobicContact CD1-CD1 3.82Å; I463-L496 HydrophobicContact CG2-CD1 3.88Å; F485-L496 HydrophobicContact CE1-CD1 4.24Å; L489-L496 HydrophobicContact CD2-CD2 4.32Å; E492-L496 PolarHBondContact O-N 3.4Å; L493-L496 HydrophobicContact CD1-CD2 4.16Å; L493-L496 PolarHBondContact O-N 3.1Å; L496-C498 PolarHBondContact O-N 2.94Å; L496-H499 WeakPolarHBondContact O-CB 3.24Å; L496-H499 PolarHBondContact O-N 2.96Å; L496-L500 HydrophobicContact CD1-CD1 4.28Å; L496-L500 HydrophobicContact CD1-CG 4.24Å; L496-L500 HydrophobicContact CG-CD1 4.09Å; L496-L500 HydrophobicContact CG-CG 4.46Å; L496-L500 VanDerWaalsContact O-CG 3.31Å; L496-L500 WeakPolarHBondContact O-CG 3.25Å; L496-L500 PolarHBondContact O-N 2.96Å
497	A	84	Confident	79.8	Confident	4 Å²	4	54.8 Å²	54.8	3%	0.033	30%	0.304	C	S	.	.	H	α-helix	trans	-62.8	-41.9	177.2	0	0	0	0	0	112.5	L378 L493 S494 A495 H499 H501 L508	L378-A497 HydrophobicContact CD1-CB 3.73Å; L378-A497 HydrophobicContact CD2-CB 3.53Å; L378-A497 HydrophobicContact CG-CB 4.29Å; L493-A497 WeakPolarHBondContact O-CB 3.47Å; L493-A497 PolarHBondContact O-N 2.71Å; S494-A497 PolarHBondContact O-N 3.44Å; A495-A497 VanDerWaalsContact C-N 3.35Å; A495-A497 PolarHBondContact O-N 3.33Å; A497-H499 VanDerWaalsContact C-N 3.31Å; A497-H501 PolarHBondContact O-CD2 3.44Å; A497-H501 PolarHBondContact O-N 3.11Å; A497-L508 HydrophobicContact CB-CD2 3.58Å
498	C	82.9	Confident	78.8	Confident	10 Å²	10	57.9 Å²	57.9	7%	0.068	32%	0.32	C	S	.	.	H	α-helix	trans	-64.1	-39.4	175.5	-67.7	0	0	0	0	111.2	S494 A495 L496 S502 L503	S494-C498 WeakPolarHBondContact O-CB 3.46Å; S494-C498 PolarHBondContact O-N 3.3Å; S494-C498 PolarHBondContact O-SG 2.98Å; A495-C498 PolarHBondContact O-N 3.27Å; L496-C498 PolarHBondContact O-N 2.94Å; C498-S502 CarbonylContact O-C 3.58Å; C498-S502 WeakPolarHBondContact O-CA 3.12Å; C498-S502 PolarHBondContact O-N 2.84Å; C498-L503 HydrophobicContact CB-CB 4.4Å; C498-L503 WeakPolarHBondContact CB-O 3.34Å; C498-L503 PolarHBondContact O-N 2.82Å
499	H	86.1	Confident	77.9	Confident	20 Å²	20	59.3 Å²	59.3	9%	0.093	33%	0.334	C	S	.	.	H	α-helix	trans	-62.1	-57.5	175.4	-168.4	71.6	0	0	0	110.5	H459 T460 F485 A495 L496 A497 H501 S502	H459-H499 PolarHBondContact CE1-O 2.82Å; H459-H499 AromaticContact ND1-CE1 3.37Å; H459-H499 PolarHBondContact ND1-CE1 2.78Å; H459-H499 AromaticContact ND1-ND1 3.67Å; H459-H499 AromaticContact ND1-NE2 3.55Å; H459-H499 PolarHBondContact NE2-O 3.09Å; T460-H499 PolarHBondContact O-NE2 2.92Å; F485-H499 HydrophobicContact CD1-CB 4.19Å; F485-H499 AromaticContact CD1-CD2 3.77Å; F485-H499 AromaticContact CD1-CG 3.87Å; F485-H499 HydrophobicContact CD2-CB 4.4Å; F485-H499 AromaticContact CD2-CE1 3.73Å; F485-H499 AromaticContact CD2-CG 3.83Å; F485-H499 AromaticContact CD2-ND1 3.54Å; F485-H499 HydrophobicContact CE1-CB 3.89Å; F485-H499 HydrophobicContact CE2-CB 4.1Å; F485-H499 AromaticContact CE2-ND1 3.9Å; F485-H499 HydrophobicContact CG-CB 4.45Å; F485-H499 AromaticContact CG-CD2 3.71Å; F485-H499 AromaticContact CG-CE1 3.75Å; F485-H499 AromaticContact CG-CG 3.77Å; F485-H499 AromaticContact CG-ND1 3.83Å; F485-H499 AromaticContact CG-NE2 3.71Å; F485-H499 HydrophobicContact CZ-CB 3.84Å; A495-H499 WeakPolarHBondContact O-CB 3.43Å; A495-H499 PolarHBondContact O-N 3.22Å; L496-H499 WeakPolarHBondContact O-CB 3.24Å; L496-H499 PolarHBondContact O-N 2.96Å; A497-H499 VanDerWaalsContact C-N 3.31Å; H499-H501 PolarHBondContact O-N 3.02Å; H499-S502 PolarHBondContact O-N 2.79Å
500	L	86.8	Confident	77.1	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-54	-33.7	-177.5	-70.4	173.2	0	0	0	114.1	V350 V352 L374 L378 F409 I463 L496	V350-L500 HydrophobicContact CG1-CD2 4.41Å; V352-L500 HydrophobicContact CG2-CD1 4.34Å; V352-L500 HydrophobicContact CG2-CD2 3.85Å; L374-L500 HydrophobicContact CD2-CD1 3.98Å; L378-L500 HydrophobicContact CD1-CD1 4.37Å; F409-L500 HydrophobicContact CB-CD2 3.9Å; F409-L500 HydrophobicContact CD1-CD2 3.95Å; F409-L500 HydrophobicContact CD2-CD2 3.7Å; F409-L500 HydrophobicContact CE2-CD2 4.26Å; F409-L500 HydrophobicContact CG-CD2 3.54Å; I463-L500 HydrophobicContact CD1-CD2 3.7Å; I463-L500 HydrophobicContact CD1-CG 4.47Å; L496-L500 HydrophobicContact CD1-CD1 4.28Å; L496-L500 HydrophobicContact CD1-CG 4.24Å; L496-L500 HydrophobicContact CG-CD1 4.09Å; L496-L500 HydrophobicContact CG-CG 4.46Å; L496-L500 VanDerWaalsContact O-CG 3.31Å; L496-L500 WeakPolarHBondContact O-CG 3.25Å; L496-L500 PolarHBondContact O-N 2.96Å
501	H	83	Confident	76.5	Confident	46 Å²	46	62.5 Å²	62.5	21%	0.213	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	6.5	-178.3	-70.2	-75.4	0	0	0	114.5	L378 A497 H499 L503	L378-H501 PolarHBondContact O-CE1 3.2Å; L378-H501 VanDerWaalsContact O-CE1 3.26Å; L378-H501 PolarHBondContact O-NE2 3.47Å; A497-H501 PolarHBondContact O-CD2 3.44Å; A497-H501 PolarHBondContact O-N 3.11Å; H499-H501 PolarHBondContact O-N 3.02Å; H501-L503 VanDerWaalsContact C-N 3.29Å; H501-L503 HydrophobicContact CB-CD1 3.78Å; H501-L503 HydrophobicContact CB-CG 3.73Å; H501-L503 PolarHBondContact O-N 3.28Å
502	S	77.9	Confident	75.9	Confident	87 Å²	87	66.6 Å²	66.6	61%	0.608	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	40.8	-174.5	-64.5	0	0	0	0	114	H459 C498 H499	H459-S502 PolarHBondContact CD2-OG 2.81Å; H459-S502 PolarHBondContact NE2-OG 3.47Å; C498-S502 CarbonylContact O-C 3.58Å; C498-S502 WeakPolarHBondContact O-CA 3.12Å; C498-S502 PolarHBondContact O-N 2.84Å; H499-S502 PolarHBondContact O-N 2.79Å
503	L	75.1	Confident	75.6	Confident	69 Å²	69	63.6 Å²	63.6	36%	0.361	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-97.8	154.8	-179	-58.5	173.6	0	0	0	112.2	C498 H501	C498-L503 HydrophobicContact CB-CB 4.4Å; C498-L503 WeakPolarHBondContact CB-O 3.34Å; C498-L503 PolarHBondContact O-N 2.82Å; H501-L503 VanDerWaalsContact C-N 3.29Å; H501-L503 HydrophobicContact CB-CD1 3.78Å; H501-L503 HydrophobicContact CB-CG 3.73Å; H501-L503 PolarHBondContact O-N 3.28Å
504	Q	67.6	Low	75.5	Confident	173 Å²	173	69.6 Å²	69.6	81%	0.808	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-71.5	137.5	172.8	-68.6	-177.2	-7.6	0	0	111.5
505	Q	60.6	Low	75.5	Confident	167 Å²	167	67.5 Å²	67.5	78%	0.78	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	138.3	-179.5	-73.3	-180	-6.3	0	0	112.3
506	G	60.3	Low	75.6	Confident	79 Å²	79	67.6 Å²	67.6	81%	0.814	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.1	6.2	170.2	0	0	0	0	0	116.8
507	V	58.6	Low	75.6	Confident	81 Å²	81	73 Å²	73	49%	0.491	39%	0.387	S	S	.	.			trans	-98.9	-20.9	-172.1	-174.7	0	0	0	0	114.1
508	L	65.4	Low	75.9	Confident	69 Å²	69	78.2 Å²	78.2	36%	0.361	41%	0.408	S	S	.	.			trans	-100.2	119.4	-169.4	-153.2	81	0	0	0	113.2	L378 A497 L510	L378-L508 HydrophobicContact CD2-CD2 3.69Å; A497-L508 HydrophobicContact CB-CD2 3.58Å; L508-L510 HydrophobicContact CD2-CD1 3.68Å; L508-L510 HydrophobicContact CD2-CD2 3.95Å; L508-L510 HydrophobicContact CD2-CG 3.67Å; L508-L510 HydrophobicContact CG-CD2 4.46Å; L508-L510 HydrophobicContact CG-CG 4.15Å
509	D	68.2	Low	76.2	Confident	122 Å²	122	77.8 Å²	77.8	65%	0.652	41%	0.406	S	S	*	.			trans	-107.5	101.8	170.7	-176.4	4.4	0	0	0	110.2	S511	D509-S511 WeakPolarHBondContact OD1-CB 3.21Å; D509-S511 PolarHBondContact OD1-N 3.16Å; D509-S511 PolarHBondContact OD1-OG 3.41Å; D509-S511 PolarHBondContact OD2-OG 3.48Å
510	L	69.7	Low	76.4	Confident	23 Å²	23	81.1 Å²	81.1	12%	0.12	42%	0.421	C	S	.	.			trans	-91.6	2.5	178.9	-70.6	167.3	0	0	0	113.3	D377 L493 L508 R512 S513 F516	D377-L510 HydrophobicContact CB-CD2 3.93Å; L493-L510 HydrophobicContact CB-CD1 4.45Å; L493-L510 HydrophobicContact CD2-CD1 3.44Å; L493-L510 VanDerWaalsContact CD2-CD1 3.44Å; L493-L510 HydrophobicContact CG-CD1 3.72Å; L508-L510 HydrophobicContact CD2-CD1 3.68Å; L508-L510 HydrophobicContact CD2-CD2 3.95Å; L508-L510 HydrophobicContact CD2-CG 3.67Å; L508-L510 HydrophobicContact CG-CD2 4.46Å; L508-L510 HydrophobicContact CG-CG 4.15Å; L510-R512 PolarHBondContact O-N 2.86Å; L510-S513 PolarHBondContact O-N 3.46Å; L510-F516 HydrophobicContact CB-CD1 4.29Å; L510-F516 HydrophobicContact CB-CG 4.24Å; L510-F516 WeakPolarHBondContact O-CD1 2.92Å
511	S	70.8	Confident	76.5	Confident	69 Å²	69	86.6 Å²	86.6	48%	0.483	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.7	-174	62.2	0	0	0	0	114.3	D509	D509-S511 WeakPolarHBondContact OD1-CB 3.21Å; D509-S511 PolarHBondContact OD1-N 3.16Å; D509-S511 PolarHBondContact OD1-OG 3.41Å; D509-S511 PolarHBondContact OD2-OG 3.48Å
512	R	71.7	Confident	76.7	Confident	219 Å²	219	85.1 Å²	85.1	83%	0.826	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-11.6	-179	-64.3	-174.7	179	-173	-1.7	114.7	L510	L510-R512 PolarHBondContact O-N 2.86Å
513	S	78.5	Confident	77.2	Confident	16 Å²	16	81.5 Å²	81.5	11%	0.112	42%	0.416	C	S	.	.			trans	-66.1	135	-176.8	161.7	0	0	0	0	111.7	D377 L510 A515 F516 K517	D377-S513 PolarHBondContact OD1-OG 3.3Å; D377-S513 VanDerWaalsContact OD2-CB 3.29Å; D377-S513 WeakPolarHBondContact OD2-CB 3.1Å; D377-S513 PolarHBondContact OD2-OG 2.86Å; L510-S513 PolarHBondContact O-N 3.46Å; S513-A515 PolarHBondContact OG-N 3.38Å; S513-A515 VanDerWaalsContact OG-N 3.08Å; S513-F516 PolarHBondContact OG-N 3Å; S513-K517 VanDerWaalsContact O-CG 3.3Å; S513-K517 WeakPolarHBondContact O-CG 3.49Å; S513-K517 PolarHBondContact O-N 3.05Å
514	E	83.6	Confident	77.8	Confident	129 Å²	129	80.7 Å²	80.7	60%	0.603	42%	0.416	S	S	*	.	H	α-helix	trans	-70.9	-38.9	171.3	-167.3	-170.9	147.6	0	0	111.7	F516 K517 K518	E514-F516 VanDerWaalsContact C-N 3.35Å; E514-K517 PolarHBondContact O-N 2.87Å; E514-K518 WeakPolarHBondContact O-CG 3.22Å; E514-K518 PolarHBondContact O-N 2.84Å; E514-K518 VanDerWaalsContact OE1-CE 3.22Å; E514-K518 WeakPolarHBondContact OE1-CE 3.15Å; E514-K518 IonicContact OE1-NZ 3.38Å; E514-K518 PolarHBondContact OE1-NZ 3.47Å
515	A	83.3	Confident	78.7	Confident	9 Å²	9	75.5 Å²	75.5	7%	0.074	39%	0.393	C	S	.	.	H	α-helix	trans	-65.6	-40.7	178	0	0	0	0	0	110.9	V373 L376 S513 K517 K518 L519	V373-A515 HydrophobicContact CG2-CB 3.81Å; V373-A515 WeakPolarHBondContact CG2-O 3.33Å; L376-A515 HydrophobicContact CD1-CB 4.24Å; S513-A515 PolarHBondContact OG-N 3.38Å; S513-A515 VanDerWaalsContact OG-N 3.08Å; A515-K517 VanDerWaalsContact C-N 3.34Å; A515-K517 PolarHBondContact O-N 3.45Å; A515-K518 WeakPolarHBondContact O-CB 3.48Å; A515-K518 PolarHBondContact O-N 2.77Å; A515-L519 PolarHBondContact O-N 3.29Å
516	F	86.4	Confident	79.9	Confident	24 Å²	24	67.9 Å²	67.9	11%	0.105	36%	0.358	C	S	.	.	H	α-helix	trans	-63.1	-40.2	175.6	-177.8	-116.3	0	0	0	112.1	P490 L493 L510 S513 E514 K518 L519 Q520	P490-F516 HydrophobicContact CB-CE2 3.91Å; P490-F516 HydrophobicContact CB-CZ 4.24Å; L493-F516 HydrophobicContact CB-CE2 4.48Å; L493-F516 HydrophobicContact CD2-CD2 3.3Å; L493-F516 HydrophobicContact CD2-CE2 3.42Å; L493-F516 VanDerWaalsContact CD2-CE2 3.42Å; L493-F516 HydrophobicContact CD2-CG 4.44Å; L510-F516 HydrophobicContact CB-CD1 4.29Å; L510-F516 HydrophobicContact CB-CG 4.24Å; L510-F516 WeakPolarHBondContact O-CD1 2.92Å; S513-F516 PolarHBondContact OG-N 3Å; E514-F516 VanDerWaalsContact C-N 3.35Å; F516-K518 VanDerWaalsContact C-N 3.34Å; F516-K518 PolarHBondContact O-N 2Å; F516-L519 WeakPolarHBondContact O-CB 3.32Å; F516-L519 PolarHBondContact O-N 3.08Å; F516-Q520 HydrophobicContact CE1-CG 4.19Å; F516-Q520 HydrophobicContact CE2-CG 4.37Å; F516-Q520 HydrophobicContact CZ-CG 4.1Å; F516-Q520 WeakPolarHBondContact O-CG 3.02Å; F516-Q520 PolarHBondContact O-N 3.07Å
517	K	87.9	Confident	80.9	Confident	114 Å²	114	65.8 Å²	65.8	50%	0.496	33%	0.326	S	S	.	.	H	α-helix	trans	-62.3	-40.9	173.4	-73.3	171.3	-176.9	176.6	0	112	S513 E514 A515 L519 Q520 Q521	S513-K517 VanDerWaalsContact O-CG 3.3Å; S513-K517 WeakPolarHBondContact O-CG 3.49Å; S513-K517 PolarHBondContact O-N 3.05Å; E514-K517 PolarHBondContact O-N 2.87Å; A515-K517 VanDerWaalsContact C-N 3.34Å; A515-K517 PolarHBondContact O-N 3.45Å; K517-L519 VanDerWaalsContact C-N 3.35Å; K517-Q520 PolarHBondContact O-N 2.97Å; K517-Q521 WeakPolarHBondContact O-CB 3.14Å; K517-Q521 PolarHBondContact O-N 3.17Å
518	K	88.9	Confident	82.1	Confident	112 Å²	112	68.3 Å²	68.3	49%	0.487	33%	0.332	S	S	.	.	H	α-helix	trans	-63.2	-39.9	175	-73.6	176.3	-176	165.4	0	111.8	E514 A515 F516 Q521 A522	E514-K518 WeakPolarHBondContact O-CG 3.22Å; E514-K518 PolarHBondContact O-N 2.84Å; E514-K518 VanDerWaalsContact OE1-CE 3.22Å; E514-K518 WeakPolarHBondContact OE1-CE 3.15Å; E514-K518 IonicContact OE1-NZ 3.38Å; E514-K518 PolarHBondContact OE1-NZ 3.47Å; A515-K518 WeakPolarHBondContact O-CB 3.48Å; A515-K518 PolarHBondContact O-N 2.77Å; F516-K518 VanDerWaalsContact C-N 3.34Å; F516-K518 PolarHBondContact O-N 2Å; K518-Q521 PolarHBondContact O-N 2.81Å; K518-A522 WeakPolarHBondContact O-CB 3.18Å; K518-A522 PolarHBondContact O-N 3.29Å
519	L	90	Very high	82.6	Confident	2 Å²	2	71.4 Å²	71.4	1%	0.01	34%	0.339	C	S	.	.	H	α-helix	trans	-61.2	-49.6	173.3	175.6	62.8	0	0	0	111.6	V366 A369 L370 V373 A515 F516 K517 Q521 A522 I523	V366-L519 HydrophobicContact CG1-CD1 4.16Å; A369-L519 HydrophobicContact CB-CB 4.23Å; A369-L519 HydrophobicContact CB-CD1 4.12Å; L370-L519 HydrophobicContact CB-CD1 3.99Å; L370-L519 HydrophobicContact CD1-CD2 3.99Å; V373-L519 HydrophobicContact CG2-CB 4Å; V373-L519 HydrophobicContact CG2-CD2 4.17Å; A515-L519 PolarHBondContact O-N 3.29Å; F516-L519 WeakPolarHBondContact O-CB 3.32Å; F516-L519 PolarHBondContact O-N 3.08Å; K517-L519 VanDerWaalsContact C-N 3.35Å; L519-Q521 VanDerWaalsContact C-N 3.26Å; L519-Q521 PolarHBondContact O-N 3.48Å; L519-A522 PolarHBondContact O-N 2.95Å; L519-I523 HydrophobicContact CD1-CD1 3.85Å; L519-I523 HydrophobicContact CD1-CG1 4.14Å; L519-I523 HydrophobicContact CG-CD1 3.91Å; L519-I523 VanDerWaalsContact O-CG1 3.28Å; L519-I523 WeakPolarHBondContact O-CG1 3.38Å; L519-I523 PolarHBondContact O-N 2.9Å
520	Q	89.5	Confident	82.8	Confident	89 Å²	89	69.8 Å²	69.8	42%	0.416	32%	0.324	S	S	.	.	H	α-helix	trans	-58.2	-41.1	176.7	-71.6	-175.8	-34.1	0	0	111.9	P490 F516 K517 S524	P490-Q520 HydrophobicContact CB-CG 4.41Å; P490-Q520 HydrophobicContact CG-CG 4.36Å; F516-Q520 HydrophobicContact CE1-CG 4.19Å; F516-Q520 HydrophobicContact CE2-CG 4.37Å; F516-Q520 HydrophobicContact CZ-CG 4.1Å; F516-Q520 WeakPolarHBondContact O-CG 3.02Å; F516-Q520 PolarHBondContact O-N 3.07Å; K517-Q520 PolarHBondContact O-N 2.97Å; Q520-S524 PolarHBondContact O-N 2.84Å
521	Q	89.4	Confident	82.9	Confident	120 Å²	120	74.8 Å²	74.8	56%	0.561	35%	0.35	S	S	*	.	H	α-helix	trans	-65.1	-46.8	176.6	-172.2	177.4	1.4	0	0	111.9	K517 K518 L519 I523 S524 I525	K517-Q521 WeakPolarHBondContact O-CB 3.14Å; K517-Q521 PolarHBondContact O-N 3.17Å; K518-Q521 PolarHBondContact O-N 2.81Å; L519-Q521 VanDerWaalsContact C-N 3.26Å; L519-Q521 PolarHBondContact O-N 3.48Å; Q521-I523 VanDerWaalsContact C-N 3.34Å; Q521-I523 PolarHBondContact O-N 3.33Å; Q521-S524 PolarHBondContact O-N 3.27Å; Q521-S524 VanDerWaalsContact O-N 3.17Å; Q521-S524 PolarHBondContact O-OG 2.85Å; Q521-I525 HydrophobicContact CG-CD1 4.03Å; Q521-I525 WeakPolarHBondContact O-CG1 3.25Å; Q521-I525 PolarHBondContact O-N 3.34Å
522	A	88.1	Confident	82.6	Confident	14 Å²	14	73.9 Å²	73.9	12%	0.116	35%	0.347	C	S	.	.	H	α-helix	trans	-59.4	-44.2	177.7	0	0	0	0	0	111.7	V366 A369 K518 L519 S524 I525 Y526	V366-A522 HydrophobicContact CG2-CB 3.94Å; A369-A522 HydrophobicContact CB-CB 4.09Å; K518-A522 WeakPolarHBondContact O-CB 3.18Å; K518-A522 PolarHBondContact O-N 3.29Å; L519-A522 PolarHBondContact O-N 2.95Å; A522-S524 VanDerWaalsContact C-N 3.31Å; A522-S524 PolarHBondContact O-N 2.86Å; A522-I525 PolarHBondContact O-N 3.45Å; A522-Y526 WeakPolarHBondContact O-CB 3.04Å; A522-Y526 PolarHBondContact O-N 2.75Å
523	I	88	Confident	82.1	Confident	11 Å²	11	68.7 Å²	68.7	6%	0.056	33%	0.334	C	S	.	.	H	α-helix	trans	-59.8	-43.8	176.3	-68.1	171.3	0	0	0	110.5	V366 L467 P490 L519 Q521 I525 Y526 F527	V366-I523 HydrophobicContact CG1-CD1 4.48Å; V366-I523 HydrophobicContact CG1-CG1 3.69Å; V366-I523 HydrophobicContact CG2-CG1 4.17Å; L467-I523 HydrophobicContact CD2-CD1 4.04Å; L467-I523 HydrophobicContact CD2-CG1 4.14Å; P490-I523 HydrophobicContact CB-CD1 4.18Å; P490-I523 HydrophobicContact CG-CD1 4.16Å; L519-I523 HydrophobicContact CD1-CD1 3.85Å; L519-I523 HydrophobicContact CD1-CG1 4.14Å; L519-I523 HydrophobicContact CG-CD1 3.91Å; L519-I523 VanDerWaalsContact O-CG1 3.28Å; L519-I523 WeakPolarHBondContact O-CG1 3.38Å; L519-I523 PolarHBondContact O-N 2.9Å; Q521-I523 VanDerWaalsContact C-N 3.34Å; Q521-I523 PolarHBondContact O-N 3.33Å; I523-I525 PolarHBondContact O-N 2.04Å; I523-Y526 PolarHBondContact O-N 2.98Å; I523-F527 HydrophobicContact CG2-CD2 3.68Å; I523-F527 HydrophobicContact CG2-CE2 3.38Å; I523-F527 WeakPolarHBondContact O-CD2 3.26Å; I523-F527 PolarHBondContact O-N 3.45Å; I523-F527 VanDerWaalsContact O-N 3.11Å
524	S	87.8	Confident	81.1	Confident	52 Å²	52	72.2 Å²	72.2	36%	0.364	36%	0.359	S	S	.	.	H	α-helix	trans	-63.7	-39.5	178.2	74.3	0	0	0	0	112.9	Q520 Q521 A522 Q528	Q520-S524 PolarHBondContact O-N 2.84Å; Q521-S524 PolarHBondContact O-N 3.27Å; Q521-S524 VanDerWaalsContact O-N 3.17Å; Q521-S524 PolarHBondContact O-OG 2.85Å; A522-S524 VanDerWaalsContact C-N 3.31Å; A522-S524 PolarHBondContact O-N 2.86Å; S524-Q528 WeakPolarHBondContact O-CB 3.38Å; S524-Q528 WeakPolarHBondContact O-CG 3.15Å; S524-Q528 PolarHBondContact O-N 3.48Å
525	I	86.3	Confident	79.5	Confident	64 Å²	64	70.3 Å²	70.3	33%	0.328	36%	0.36	S	S	.	.	H	α-helix	trans	-67.3	-44.2	178.5	-68.4	167	0	0	0	110.6	Q521 A522 I523 F527 Q528 R529	Q521-I525 HydrophobicContact CG-CD1 4.03Å; Q521-I525 WeakPolarHBondContact O-CG1 3.25Å; Q521-I525 PolarHBondContact O-N 3.34Å; A522-I525 PolarHBondContact O-N 3.45Å; I523-I525 PolarHBondContact O-N 2.04Å; I525-F527 PolarHBondContact O-N 3.31Å; I525-Q528 PolarHBondContact O-N 3.39Å; I525-R529 PolarHBondContact O-N 3.25Å
526	Y	85.1	Confident	77.6	Confident	8 Å²	8	76.5 Å²	76.5	3%	0.031	39%	0.392	C	S	.	.	H	α-helix	trans	-56.4	-49.9	176.3	166.6	-102.2	0	0	0	111.3	Q362 Y363 V366 S415 L467 A522 I523 R530	Q362-Y526 HydrophobicContact CB-CD2 4.39Å; Y363-Y526 HydrophobicContact CD2-CD2 4.34Å; Y363-Y526 HydrophobicContact CD2-CE1 4.44Å; Y363-Y526 HydrophobicContact CD2-CE2 4.01Å; Y363-Y526 HydrophobicContact CG-CE2 4.3Å; V366-Y526 HydrophobicContact CG2-CG 4.46Å; S415-Y526 PolarHBondContact OG-OH 3.09Å; L467-Y526 HydrophobicContact CD1-CD1 3.99Å; L467-Y526 HydrophobicContact CD1-CE1 3.92Å; A522-Y526 WeakPolarHBondContact O-CB 3.04Å; A522-Y526 PolarHBondContact O-N 2.75Å; I523-Y526 PolarHBondContact O-N 2.98Å; Y526-R530 WeakPolarHBondContact O-CB 3.44Å; Y526-R530 PolarHBondContact O-N 3.21Å; Y526-R530 VanDerWaalsContact O-N 3.15Å
527	F	82.8	Confident	75.4	Confident	35 Å²	35	78.9 Å²	78.9	15%	0.154	41%	0.411	C	S	.	.	H	α-helix	trans	-66.5	-39.5	178.2	-72	-53.3	0	0	0	113.4	L467 T469 I523 I525 R530 L531	L467-F527 HydrophobicContact CB-CE2 4.35Å; L467-F527 HydrophobicContact CB-CZ 3.8Å; L467-F527 HydrophobicContact CD1-CE2 4.36Å; L467-F527 HydrophobicContact CD1-CZ 3.86Å; L467-F527 HydrophobicContact CG-CZ 4.5Å; T469-F527 HydrophobicContact CG2-CE2 4.19Å; T469-F527 HydrophobicContact CG2-CZ 4.34Å; T469-F527 WeakPolarHBondContact OG1-CE1 3.18Å; T469-F527 WeakPolarHBondContact OG1-CE2 3.32Å; T469-F527 WeakPolarHBondContact OG1-CZ 3.49Å; I523-F527 HydrophobicContact CG2-CD2 3.68Å; I523-F527 HydrophobicContact CG2-CE2 3.38Å; I523-F527 WeakPolarHBondContact O-CD2 3.26Å; I523-F527 PolarHBondContact O-N 3.45Å; I523-F527 VanDerWaalsContact O-N 3.11Å; I525-F527 PolarHBondContact O-N 3.31Å; F527-R530 PolarHBondContact O-N 3.43Å; F527-L531 WeakPolarHBondContact O-CG 3.14Å; F527-L531 PolarHBondContact O-N 3.03Å
528	Q	83	Confident	72.8	Confident	134 Å²	134	80.8 Å²	80.8	63%	0.626	43%	0.427	S	S	*	.	H	α-helix	trans	-61.3	-46.7	177.1	-80.9	-178.2	-13	0	0	112.6	S524 I525 R530 L531 A532	S524-Q528 WeakPolarHBondContact O-CB 3.38Å; S524-Q528 WeakPolarHBondContact O-CG 3.15Å; S524-Q528 PolarHBondContact O-N 3.48Å; I525-Q528 PolarHBondContact O-N 3.39Å; Q528-R530 VanDerWaalsContact C-N 3.31Å; Q528-R530 PolarHBondContact O-N 2.82Å; Q528-L531 PolarHBondContact O-N 3.32Å; Q528-A532 PolarHBondContact O-N 2.95Å; Q528-A532 VanDerWaalsContact O-N 3.12Å
529	R	76.7	Confident	70.1	Confident	133 Å²	133	78.9 Å²	78.9	50%	0.502	44%	0.439	S	S	.	.	H	α-helix	trans	-64.6	-37.7	178.1	-76.4	-156.1	-171.1	-172.6	-3.9	112	I525 A532 I533	I525-R529 PolarHBondContact O-N 3.25Å; R529-A532 WeakPolarHBondContact O-CB 3.38Å; R529-A532 PolarHBondContact O-N 2.9Å; R529-A532 VanDerWaalsContact O-N 3.17Å; R529-I533 WeakPolarHBondContact O-CG1 3.42Å; R529-I533 PolarHBondContact O-N 3.11Å
530	R	72.1	Confident	67.2	Low	88 Å²	88	89.3 Å²	89.3	33%	0.332	48%	0.48	S	S	.	.	H	α-helix	trans	-66.6	-41.2	179.4	-164.8	173.9	-179.4	-136.2	-4	112.6	E416 Y526 F527 Q528 A532 I533 S534	E416-R530 VanDerWaalsContact CB-NH2 3.31Å; E416-R530 IonicContact OE1-NH1 3Å; E416-R530 PolarHBondContact OE1-NH1 3.01Å; E416-R530 IonicContact OE2-CZ 3.52Å; E416-R530 IonicContact OE2-NH1 2.62Å; E416-R530 PolarHBondContact OE2-NH1 2.86Å; E416-R530 IonicContact OE2-NH2 3.77Å; E416-R530 PolarHBondContact OE2-NH2 3.43Å; Y526-R530 WeakPolarHBondContact O-CB 3.44Å; Y526-R530 PolarHBondContact O-N 3.21Å; Y526-R530 VanDerWaalsContact O-N 3.15Å; F527-R530 PolarHBondContact O-N 3.43Å; Q528-R530 VanDerWaalsContact C-N 3.31Å; Q528-R530 PolarHBondContact O-N 2.82Å; R530-A532 VanDerWaalsContact C-N 3.27Å; R530-A532 PolarHBondContact O-N 3.41Å; R530-I533 PolarHBondContact O-N 3.25Å; R530-S534 PolarHBondContact O-N 3.01Å
531	L	70.5	Confident	64.1	Low	128 Å²	128	93.7 Å²	93.7	67%	0.67	50%	0.501	S	S	*	.	H	α-helix	trans	-58.5	-40.8	170.9	-74.9	166	0	0	0	111.3	F527 Q528 S534 S535	F527-L531 WeakPolarHBondContact O-CG 3.14Å; F527-L531 PolarHBondContact O-N 3.03Å; Q528-L531 PolarHBondContact O-N 3.32Å; L531-S534 PolarHBondContact O-N 3.08Å; L531-S535 PolarHBondContact O-N 2.03Å; L531-S535 PolarHBondContact O-OG 3.31Å
532	A	65.7	Low	61.4	Low	50 Å²	50	92.6 Å²	92.6	41%	0.413	51%	0.505	S	S	.	.	H	α-helix	trans	-65.5	-38.8	177.1	0	0	0	0	0	113.2	Q528 R529 R530 S535 N536	Q528-A532 PolarHBondContact O-N 2.95Å; Q528-A532 VanDerWaalsContact O-N 3.12Å; R529-A532 WeakPolarHBondContact O-CB 3.38Å; R529-A532 PolarHBondContact O-N 2.9Å; R529-A532 VanDerWaalsContact O-N 3.17Å; R530-A532 VanDerWaalsContact C-N 3.27Å; R530-A532 PolarHBondContact O-N 3.41Å; A532-S535 WeakPolarHBondContact CA-OG 3.12Å; A532-S535 PolarHBondContact O-N 3.23Å; A532-S535 PolarHBondContact O-OG 2.74Å; A532-N536 PolarHBondContact O-N 3.35Å
533	I	61.6	Low	58.6	Low	110 Å²	110	97.8 Å²	97.8	56%	0.564	54%	0.538	S	S	*	.	H	α-helix	trans	-66.4	-45.4	175.6	-65.7	164.3	0	0	0	110.4	R529 R530 S535 N536 S537	R529-I533 WeakPolarHBondContact O-CG1 3.42Å; R529-I533 PolarHBondContact O-N 3.11Å; R530-I533 PolarHBondContact O-N 3.25Å; I533-S535 PolarHBondContact O-N 3.07Å; I533-N536 PolarHBondContact O-N 3.03Å; I533-N536 VanDerWaalsContact O-N 3.11Å; I533-S537 PolarHBondContact O-N 3.18Å; I533-S537 VanDerWaalsContact O-N 3.09Å
534	S	56.9	Low	55.9	Low	90 Å²	90	104 Å²	104	63%	0.629	58%	0.576	S	S	*	*	H	α-helix	trans	-62.7	-28.2	177.4	-176	0	0	0	0	113.1	R530 L531	R530-S534 PolarHBondContact O-N 3.01Å; L531-S534 PolarHBondContact O-N 3.08Å
535	S	50.8	Low	53.2	Low	90 Å²	90	104.8 Å²	104.8	63%	0.629	59%	0.592	S	S	*	*	H	α-helix	trans	-79.8	-22.2	175.5	58.2	0	0	0	0	114.1	L531 A532 I533	L531-S535 PolarHBondContact O-N 2.03Å; L531-S535 PolarHBondContact O-OG 3.31Å; A532-S535 WeakPolarHBondContact CA-OG 3.12Å; A532-S535 PolarHBondContact O-N 3.23Å; A532-S535 PolarHBondContact O-OG 2.74Å; I533-S535 PolarHBondContact O-N 3.07Å
536	N	43.4	Very low	50.4	Low	138 Å²	138	112.4 Å²	112.4	74%	0.738	62%	0.617	S	S	*	*	H	α-helix	trans	-99.7	-12.4	-177.9	-87.7	-1.6	0	0	0	114.1	A532 I533 N538	A532-N536 PolarHBondContact O-N 3.35Å; I533-N536 PolarHBondContact O-N 3.03Å; I533-N536 VanDerWaalsContact O-N 3.11Å; N536-N538 PolarHBondContact O-N 3.11Å
537	S	39.4	Very low	47.8	Very low	74 Å²	74	121.3 Å²	121.3	52%	0.517	66%	0.656	S	S	.	*			trans	-77.6	84.9	178.3	60.5	0	0	0	0	111.4	I533 G539	I533-S537 PolarHBondContact O-N 3.18Å; I533-S537 VanDerWaalsContact O-N 3.09Å; S537-G539 PolarHBondContact O-N 3.26Å
538	N	33.3	Very low	45.5	Very low	154 Å²	154	125.9 Å²	125.9	82%	0.824	68%	0.682	S	S	*	*			trans	-64.7	108.5	154.3	-80.2	-20.6	0	0	0	108.6	N536 Y540	N536-N538 PolarHBondContact O-N 3.11Å; N538-Y540 PolarHBondContact O-N 3.37Å
539	G	31.2	Very low	42.9	Very low	72 Å²	72	122 Å²	122	74%	0.742	67%	0.673	S	S	*	*			trans	57.1	52.4	146.8	0	0	0	0	0	119.2	S537 E541	S537-G539 PolarHBondContact O-N 3.26Å; G539-E541 PolarHBondContact O-N 3.29Å
540	Y	29	Very low	40.8	Very low	221 Å²	221	122.3 Å²	122.3	87%	0.867	67%	0.674	S	S	*	*			trans	-84.4	95.5	153.8	-79.7	-78.3	0	0	0	108.9	N538 C542	N538-Y540 PolarHBondContact O-N 3.37Å; Y540-C542 PolarHBondContact O-N 3.22Å
541	E	26.1	Very low	38.9	Very low	182 Å²	182	127.1 Å²	127.1	85%	0.85	70%	0.697	S	S	*	*			trans	-54.1	121	163.3	-72.6	177.4	153.6	0	0	108.8	G539 P543	G539-E541 PolarHBondContact O-N 3.29Å; E541-P543 WeakPolarHBondContact O-CD 3.3Å
542	C	31.5	Very low	37	Very low	96 Å²	96	129 Å²	129	65%	0.649	70%	0.703	S	S	*	*			trans	-53.8	123.3	168	-77.3	0	0	0	0	108.8	Y540 T544	Y540-C542 PolarHBondContact O-N 3.22Å; C542-T544 PolarHBondContact O-N 2.97Å
543	P	30.6	Very low	35.4	Very low	124 Å²	124	131.5 Å²	131.5	81%	0.805	71%	0.713	S	S	*	*			trans	-65.6	102.1	175.8	-15.4	28.2	0	0	0	109.4	E541 G545	E541-P543 WeakPolarHBondContact O-CD 3.3Å; P543-G545 PolarHBondContact O-N 3.21Å
544	T	31.4	Very low	33.8	Very low	141 Å²	141	129.4 Å²	129.4	87%	0.865	72%	0.719	S	S	*	*	S	Bend	trans	-67.9	93.1	167.4	47.6	0	0	0	0	108.2	C542	C542-T544 PolarHBondContact O-N 2.97Å
545	G	31	Very low	32.6	Very low	68 Å²	68	133.3 Å²	133.3	70%	0.701	73%	0.727	S	S	*	*			trans	172.8	11.3	176.7	0	0	0	0	0	119.8	P543	P543-G545 PolarHBondContact O-N 3.21Å
546	R	25.7	Very low	31.6	Very low	224 Å²	224	134.6 Å²	134.6	85%	0.845	73%	0.732	S	S	*	*			trans	-138	52.2	179.5	-130.9	-177.9	-162.2	-174.7	4.6	113.6	D548	R546-D548 VanDerWaalsContact C-N 3.26Å; R546-D548 PolarHBondContact O-N 3.33Å
547	F	32.1	Very low	30.9	Very low	195 Å²	195	132.7 Å²	132.7	86%	0.855	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-2.4	171.9	-89.5	-80.7	0	0	0	114.4
548	D	33.3	Very low	30.4	Very low	131 Å²	131	132.9 Å²	132.9	70%	0.701	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113	13.1	-173.1	-68.6	-41.7	0	0	0	116.1	R546 W550	R546-D548 VanDerWaalsContact C-N 3.26Å; R546-D548 PolarHBondContact O-N 3.33Å; D548-W550 VanDerWaalsContact C-N 3.35Å; D548-W550 PolarHBondContact O-N 3.16Å
549	A	29	Very low	30.3	Very low	52 Å²	52	131.2 Å²	131.2	43%	0.43	72%	0.721	S	S	.	*	G	3₁₀ helix	trans	-75.2	-20.8	176.9	0	0	0	0	0	113.8	K551 Q552	A549-K551 VanDerWaalsContact C-N 3.3Å; A549-K551 PolarHBondContact O-N 3.1Å; A549-Q552 PolarHBondContact O-N 3.24Å
550	W	32.1	Very low	30.1	Very low	140 Å²	140	135 Å²	135	53%	0.53	72%	0.724	S	S	.	*	G	3₁₀ helix	trans	-75.1	-13.4	-176.5	-83.5	65.3	0	0	0	114.5	D548 Q552	D548-W550 VanDerWaalsContact C-N 3.35Å; D548-W550 PolarHBondContact O-N 3.16Å; W550-Q552 VanDerWaalsContact C-N 3.25Å; W550-Q552 PolarHBondContact O-N 3.46Å
551	K	31.7	Very low	30	Very low	189 Å²	189	132.6 Å²	132.6	82%	0.822	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-74.8	-9.2	174.5	-81.8	-173.4	178.3	176.8	0	114.1	A549	A549-K551 VanDerWaalsContact C-N 3.3Å; A549-K551 PolarHBondContact O-N 3.1Å
552	Q	31.7	Very low	30.2	Very low	169 Å²	169	131.9 Å²	131.9	79%	0.79	72%	0.717	S	S	*	*	S	Bend	trans	-110.4	-14.2	-172.7	-72.5	-172.6	-6.5	0	0	116.2	A549 W550	A549-Q552 PolarHBondContact O-N 3.24Å; W550-Q552 VanDerWaalsContact C-N 3.25Å; W550-Q552 PolarHBondContact O-N 3.46Å
553	T	31.4	Very low	30	Very low	101 Å²	101	134.9 Å²	134.9	62%	0.62	73%	0.727	S	S	*	*	S	Bend	trans	-95.9	3.9	179.5	43.6	0	0	0	0	114.6	Q555	T553-Q555 PolarHBondContact O-N 3.28Å; T553-Q555 VanDerWaalsContact O-N 3.08Å
554	G	29.1	Very low	29.9	Very low	67 Å²	67	135.3 Å²	135.3	69%	0.691	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	8.8	173.5	0	0	0	0	0	116
555	Q	30.1	Very low	29.7	Very low	172 Å²	172	133 Å²	133	80%	0.804	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	0.2	-177.7	-89.8	-171.6	-19.2	0	0	115.9	T553	T553-Q555 PolarHBondContact O-N 3.28Å; T553-Q555 VanDerWaalsContact O-N 3.08Å
556	T	31.5	Very low	29.4	Very low	117 Å²	117	136.9 Å²	136.9	72%	0.718	72%	0.721	S	S	*	*	S	Bend	trans	-115.5	4.2	-178.5	38.6	0	0	0	0	115.9
557	V	28.5	Very low	29.5	Very low	97 Å²	97	134.3 Å²	134.3	59%	0.588	72%	0.718	S	S	*	*	S	Bend	trans	-120.9	22.3	174.7	-160.7	0	0	0	0	112.1	T559 L560	V557-T559 PolarHBondContact O-N 2.8Å; V557-L560 HydrophobicContact CG1-CB 4.38Å; V557-L560 HydrophobicContact CG1-CD1 4.31Å
558	S	28.4	Very low	29.4	Very low	79 Å²	79	133.7 Å²	133.7	55%	0.552	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-13.9	168.8	-34	0	0	0	0	112.5
559	T	31.2	Very low	29.2	Very low	118 Å²	118	132.9 Å²	132.9	72%	0.724	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-9	-175.3	47.2	0	0	0	0	114.6	V557	V557-T559 PolarHBondContact O-N 2.8Å
560	L	26.7	Very low	29.4	Very low	151 Å²	151	137 Å²	137	79%	0.791	73%	0.733	S	S	*	*	S	Bend	trans	-97.8	1.4	174.1	-80.7	165.2	0	0	0	113.2	V557	V557-L560 HydrophobicContact CG1-CB 4.38Å; V557-L560 HydrophobicContact CG1-CD1 4.31Å
561	Q	27	Very low	29.7	Very low	172 Å²	172	136.8 Å²	136.8	80%	0.804	74%	0.742	S	S	*	*	S	Bend	trans	-95	1.1	179.6	-160.9	162.9	-9.6	0	0	113.4
562	E	30.7	Very low	30.2	Very low	167 Å²	167	136.2 Å²	136.2	78%	0.78	74%	0.742	S	S	*	*	S	Bend	trans	-93.8	1	-170.8	-133	171.4	-167.6	0	0	115.8
563	D	26.2	Very low	30.5	Very low	158 Å²	158	135.2 Å²	135.2	85%	0.845	74%	0.742	S	S	*	*			trans	-134.8	56.8	179.4	-88.4	-35.2	0	0	0	112.8
564	V	29.7	Very low	31.2	Very low	133 Å²	133	138.5 Å²	138.5	81%	0.806	76%	0.756	S	S	*	*	S	Bend	trans	-135.5	84.1	154.6	-172.9	0	0	0	0	108.4	D566	V564-D566 PolarHBondContact O-N 2.82Å
565	S	26.3	Very low	32	Very low	93 Å²	93	139 Å²	139	65%	0.65	74%	0.743	S	S	*	*			trans	-9.9	113.4	157.7	171.9	0	0	0	0	114.6	H567	S565-H567 PolarHBondContact O-N 3.11Å
566	D	24.5	Very low	33.1	Very low	150 Å²	150	136.7 Å²	136.7	80%	0.802	74%	0.741	S	S	*	*			trans	-49.6	107.4	162.2	-58.2	-46.4	0	0	0	109.8	V564	V564-D566 PolarHBondContact O-N 2.82Å
567	H	28.8	Very low	34.2	Very low	169 Å²	169	136.4 Å²	136.4	78%	0.782	73%	0.731	S	S	*	*			trans	-102.1	92.9	153.5	-92.5	7.1	0	0	0	106.5	S565 V569	S565-H567 PolarHBondContact O-N 3.11Å; H567-V569 PolarHBondContact O-N 2.84Å
568	E	28.7	Very low	35.5	Very low	182 Å²	182	136.2 Å²	136.2	85%	0.85	73%	0.726	S	S	*	*			trans	-8.7	89	153.3	-69.2	170.2	153.1	0	0	112.3
569	V	31	Very low	36.7	Very low	115 Å²	115	135 Å²	135	70%	0.697	72%	0.72	S	S	*	*			trans	-93.7	93.6	145.2	-180	0	0	0	0	104	H567 D571	H567-V569 PolarHBondContact O-N 2.84Å; V569-D571 HydrophobicContact CG1-CB 4.24Å; V569-D571 WeakPolarHBondContact CG1-OD2 3.4Å; V569-D571 PolarHBondContact O-N 3.3Å
570	D	31.3	Very low	37.9	Very low	139 Å²	139	136.2 Å²	136.2	74%	0.743	72%	0.716	S	S	*	*			trans	-70.6	72	172.8	-152	10.6	0	0	0	107.8
571	D	39.7	Very low	39.1	Very low	134 Å²	134	134.2 Å²	134.2	72%	0.717	70%	0.702	S	S	*	*			trans	-111.4	80.5	167.2	-76.4	-28.9	0	0	0	106.7	V569 D573	V569-D571 HydrophobicContact CG1-CB 4.24Å; V569-D571 WeakPolarHBondContact CG1-OD2 3.4Å; V569-D571 PolarHBondContact O-N 3.3Å; D571-D573 PolarHBondContact O-N 2.8Å
572	E	40.9	Very low	40.4	Very low	177 Å²	177	134.3 Å²	134.3	83%	0.827	70%	0.696	S	S	*	*			trans	-61.2	19.2	176	-97.2	-163.2	160.9	0	0	115.2	D574	E572-D574 PolarHBondContact O-N 3.14Å
573	D	39	Very low	41	Very low	149 Å²	149	134.6 Å²	134.6	80%	0.797	69%	0.691	S	S	*	*			trans	-98.1	70.3	173.5	-77.6	-29.1	0	0	0	110.5	D571 D575	D571-D573 PolarHBondContact O-N 2.8Å; D573-D575 VanDerWaalsContact C-N 3.29Å; D573-D575 PolarHBondContact O-N 3.31Å
574	D	45.7	Very low	42.1	Very low	170 Å²	170	129.1 Å²	129.1	91%	0.909	67%	0.667	S	S	*	*			trans	-64.6	81	165.7	-97.8	-28.2	0	0	0	110.6	E572	E572-D574 PolarHBondContact O-N 3.14Å
575	D	46.7	Very low	42.7	Very low	77 Å²	77	130.8 Å²	130.8	41%	0.412	67%	0.666	S	S	.	*			trans	-151.3	109.5	145	-155.7	-22.2	0	0	0	111.1	D573 Q577 I578 A579	D573-D575 VanDerWaalsContact C-N 3.29Å; D573-D575 PolarHBondContact O-N 3.31Å; D575-Q577 PolarHBondContact O-N 2.6Å; D575-Q577 WeakPolarHBondContact OD1-CB 3.36Å; D575-Q577 PolarHBondContact OD1-N 2.74Å; D575-I578 HydrophobicContact CB-CB 4.26Å; D575-I578 HydrophobicContact CB-CD1 3.83Å; D575-I578 HydrophobicContact CB-CG1 3.88Å; D575-I578 PolarHBondContact O-N 3.11Å; D575-A579 PolarHBondContact O-N 2.72Å
576	T	52.7	Low	43.4	Very low	124 Å²	124	131.6 Å²	131.6	76%	0.761	67%	0.667	S	S	*	*	H	α-helix	trans	-52.8	-26.5	171.8	51.5	0	0	0	0	112.6	F580	T576-F580 WeakPolarHBondContact O-CB 3.41Å; T576-F580 PolarHBondContact O-N 3.37Å
577	Q	54.3	Low	43.7	Very low	111 Å²	111	127.7 Å²	127.7	52%	0.519	65%	0.651	S	S	.	*	H	α-helix	trans	-69	-43	176.1	-161.8	82.3	15.3	0	0	111.9	D575 F580 E581	D575-Q577 PolarHBondContact O-N 2.6Å; D575-Q577 WeakPolarHBondContact OD1-CB 3.36Å; D575-Q577 PolarHBondContact OD1-N 2.74Å; Q577-F580 PolarHBondContact O-N 3.3Å; Q577-E581 WeakPolarHBondContact O-CG 3.32Å; Q577-E581 PolarHBondContact O-N 3.25Å
578	I	55.2	Low	43.7	Very low	92 Å²	92	128.8 Å²	128.8	47%	0.472	65%	0.654	S	S	.	*	H	α-helix	trans	-68.7	-40.1	179	-64.1	172.8	0	0	0	110.5	D575 F580 E581 R582	D575-I578 HydrophobicContact CB-CB 4.26Å; D575-I578 HydrophobicContact CB-CD1 3.83Å; D575-I578 HydrophobicContact CB-CG1 3.88Å; D575-I578 PolarHBondContact O-N 3.11Å; I578-F580 VanDerWaalsContact C-N 3.33Å; I578-F580 PolarHBondContact O-N 2.79Å; I578-E581 PolarHBondContact O-N 3.27Å; I578-R582 WeakPolarHBondContact O-CB 3.39Å; I578-R582 PolarHBondContact O-N 3.49Å
579	A	54.5	Low	43.8	Very low	53 Å²	53	124.9 Å²	124.9	44%	0.438	64%	0.642	S	S	.	*	H	α-helix	trans	-60.8	-43.6	173.2	0	0	0	0	0	111.2	D575 Y583	D575-A579 PolarHBondContact O-N 2.72Å; A579-Y583 WeakPolarHBondContact O-CD2 3.37Å; A579-Y583 PolarHBondContact O-N 2.76Å; A579-Y583 VanDerWaalsContact O-N 3.12Å
580	F	55.8	Low	43.6	Very low	144 Å²	144	129.1 Å²	129.1	63%	0.632	65%	0.647	S	S	*	*	H	α-helix	trans	-63.6	-44.1	175.4	-177.7	-95	0	0	0	112.2	T576 Q577 I578 Y583 A584	T576-F580 WeakPolarHBondContact O-CB 3.41Å; T576-F580 PolarHBondContact O-N 3.37Å; Q577-F580 PolarHBondContact O-N 3.3Å; I578-F580 VanDerWaalsContact C-N 3.33Å; I578-F580 PolarHBondContact O-N 2.79Å; F580-Y583 CarbonylContact O-C 3.59Å; F580-Y583 PolarHBondContact O-N 3.37Å; F580-A584 HydrophobicContact CE1-CB 4.39Å; F580-A584 VanDerWaalsContact O-CB 3.25Å; F580-A584 WeakPolarHBondContact O-CB 3.27Å; F580-A584 PolarHBondContact O-N 2.74Å
581	E	53.2	Low	43.4	Very low	109 Å²	109	130.7 Å²	130.7	51%	0.509	65%	0.65	S	S	.	*	H	α-helix	trans	-63	-42.6	178.1	-77.2	178.4	179.5	0	0	112.1	Q577 I578 Y583 A584 E585	Q577-E581 WeakPolarHBondContact O-CG 3.32Å; Q577-E581 PolarHBondContact O-N 3.25Å; I578-E581 PolarHBondContact O-N 3.27Å; E581-Y583 VanDerWaalsContact C-N 3.31Å; E581-Y583 PolarHBondContact O-N 2.81Å; E581-A584 CarbonylContact O-C 3.56Å; E581-A584 PolarHBondContact O-N 2.81Å; E581-A584 VanDerWaalsContact O-N 3.13Å; E581-E585 WeakPolarHBondContact O-CG 3.46Å; E581-E585 PolarHBondContact O-N 2.88Å
582	R	53.6	Low	42.8	Very low	175 Å²	175	132.1 Å²	132.1	66%	0.66	66%	0.657	S	S	*	*	H	α-helix	trans	-63.6	-35.5	176.1	-164.6	-176.9	-88.1	164.5	-4.8	112.2	I578 T586	I578-R582 WeakPolarHBondContact O-CB 3.39Å; I578-R582 PolarHBondContact O-N 3.49Å; R582-T586 PolarHBondContact O-OG1 3.48Å
583	Y	43.1	Very low	42.2	Very low	173 Å²	173	130.5 Å²	130.5	68%	0.678	65%	0.652	S	S	*	*	H	α-helix	trans	-75	-32.4	172.7	-92.6	-79.7	0	0	0	113	A579 F580 E581 T586 C587	A579-Y583 WeakPolarHBondContact O-CD2 3.37Å; A579-Y583 PolarHBondContact O-N 2.76Å; A579-Y583 VanDerWaalsContact O-N 3.12Å; F580-Y583 CarbonylContact O-C 3.59Å; F580-Y583 PolarHBondContact O-N 3.37Å; E581-Y583 VanDerWaalsContact C-N 3.31Å; E581-Y583 PolarHBondContact O-N 2.81Å; Y583-T586 WeakPolarHBondContact CA-OG1 3.5Å; Y583-T586 PolarHBondContact O-N 2.75Å; Y583-T586 PolarHBondContact O-OG1 3.31Å; Y583-C587 PolarHBondContact O-N 3.42Å; Y583-C587 VanDerWaalsContact O-N 3.08Å
584	A	49.4	Very low	41.8	Very low	42 Å²	42	128.1 Å²	128.1	35%	0.347	65%	0.645	S	S	.	*	H	α-helix	trans	-74.1	-28.2	176.4	0	0	0	0	0	112.6	F580 E581	F580-A584 HydrophobicContact CE1-CB 4.39Å; F580-A584 VanDerWaalsContact O-CB 3.25Å; F580-A584 WeakPolarHBondContact O-CB 3.27Å; F580-A584 PolarHBondContact O-N 2.74Å; E581-A584 CarbonylContact O-C 3.56Å; E581-A584 PolarHBondContact O-N 2.81Å; E581-A584 VanDerWaalsContact O-N 3.13Å
585	E	41.9	Very low	41.1	Very low	168 Å²	168	125.7 Å²	125.7	79%	0.785	64%	0.638	S	S	*	*	H	α-helix	trans	-71.2	-32.1	172.5	-76.5	-172.8	163	0	0	112.6	E581	E581-E585 WeakPolarHBondContact O-CG 3.46Å; E581-E585 PolarHBondContact O-N 2.88Å
586	T	41.6	Very low	40.5	Very low	110 Å²	110	129.5 Å²	129.5	68%	0.675	66%	0.659	S	S	*	*	H	α-helix	trans	-83.4	-30.8	180	37.2	0	0	0	0	112.7	R582 Y583	R582-T586 PolarHBondContact O-OG1 3.48Å; Y583-T586 WeakPolarHBondContact CA-OG1 3.5Å; Y583-T586 PolarHBondContact O-N 2.75Å; Y583-T586 PolarHBondContact O-OG1 3.31Å
587	C	31	Very low	39.5	Very low	69 Å²	69	129 Å²	129	47%	0.466	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.1	113.3	168.5	-66.3	0	0	0	0	108.6	Y583 V589	Y583-C587 PolarHBondContact O-N 3.42Å; Y583-C587 VanDerWaalsContact O-N 3.08Å; C587-V589 HydrophobicContact CB-CG2 3.7Å; C587-V589 PolarHBondContact O-N 3.28Å
588	K	28.8	Very low	38.4	Very low	191 Å²	191	128 Å²	128	83%	0.83	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	72.3	159.3	-76	-177	178	179.5	0	108.6	Y590	K588-Y590 PolarHBondContact O-N 2.89Å; K588-Y590 VanDerWaalsContact O-N 3.08Å
589	V	31.1	Very low	37.4	Very low	101 Å²	101	130.6 Å²	130.6	61%	0.612	69%	0.691	S	S	*	*			trans	-68.5	106.5	167.4	-177.4	0	0	0	0	103.5	C587 Q591	C587-V589 HydrophobicContact CB-CG2 3.7Å; C587-V589 PolarHBondContact O-N 3.28Å; V589-Q591 PolarHBondContact O-N 2.83Å
590	Y	26.3	Very low	36.3	Very low	204 Å²	204	134.9 Å²	134.9	80%	0.8	71%	0.706	S	S	*	*			trans	-57	96.2	162.7	-68.4	-90.6	0	0	0	106	K588 L592	K588-Y590 PolarHBondContact O-N 2.89Å; K588-Y590 VanDerWaalsContact O-N 3.08Å; Y590-L592 VanDerWaalsContact C-N 3.32Å; Y590-L592 PolarHBondContact O-N 3.44Å
591	Q	27.2	Very low	35.2	Very low	172 Å²	172	133.1 Å²	133.1	80%	0.804	71%	0.712	S	S	*	*			trans	-58.3	105.9	163.9	-98.3	179.8	-11	0	0	105.3	V589 I593	V589-Q591 PolarHBondContact O-N 2.83Å; Q591-I593 PolarHBondContact O-N 3.2Å
592	L	26.1	Very low	34.1	Very low	163 Å²	163	136.6 Å²	136.6	85%	0.853	73%	0.728	S	S	*	*			trans	-59.1	99.4	161.7	-75.7	155.5	0	0	0	104.8	Y590 P594	Y590-L592 VanDerWaalsContact C-N 3.32Å; Y590-L592 PolarHBondContact O-N 3.44Å; L592-P594 WeakPolarHBondContact O-CD 3.33Å
593	I	28.6	Very low	33	Very low	143 Å²	143	134.1 Å²	134.1	73%	0.733	74%	0.735	S	S	*	*			trans	-51.3	112	175.4	-60.8	167.2	0	0	0	105.8	Q591	Q591-I593 PolarHBondContact O-N 3.2Å
594	P	31.8	Very low	32.2	Very low	99 Å²	99	135.2 Å²	135.2	64%	0.643	75%	0.746	S	S	*	*			trans	-60.9	137.3	173.5	-15.2	29.1	0	0	0	107	L592 D596	L592-P594 WeakPolarHBondContact O-CD 3.33Å; P594-D596 PolarHBondContact O-N 2.96Å; P594-D596 VanDerWaalsContact O-N 3.08Å
595	P	31	Very low	31.3	Very low	119 Å²	119	141 Å²	141	77%	0.773	77%	0.766	S	S	*	*			trans	-59.3	121.4	178.2	24	-31.1	0	0	0	108.4	S597	P595-S597 VanDerWaalsContact C-N 3.34Å; P595-S597 PolarHBondContact O-N 3.49Å
596	D	34.2	Very low	30.7	Very low	157 Å²	157	142.5 Å²	142.5	84%	0.84	77%	0.77	S	S	*	*			trans	-55.3	97	177.6	-73.4	-39	0	0	0	109.6	P594 A598	P594-D596 PolarHBondContact O-N 2.96Å; P594-D596 VanDerWaalsContact O-N 3.08Å; D596-A598 PolarHBondContact O-N 3.42Å
597	S	30.7	Very low	30	Very low	113 Å²	113	147.2 Å²	147.2	79%	0.79	78%	0.777	S	S	*	*			trans	-79.6	107	162.8	52.2	0	0	0	0	107.3	P595	P595-S597 VanDerWaalsContact C-N 3.34Å; P595-S597 PolarHBondContact O-N 3.49Å
598	A	30.5	Very low	29.8	Very low	90 Å²	90	149.1 Å²	149.1	74%	0.744	79%	0.791	S	S	*	*			trans	82.5	90.7	166.3	0	0	0	0	0	117.5	D596	D596-A598 PolarHBondContact O-N 3.42Å
599	V	35.2	Very low	29.7	Very low	147 Å²	147	148 Å²	148	89%	0.891	79%	0.793	S	S	*	*				-136.6	126.1	127.4	-176.9	0	0	0	0	109.5
600	D	32.2	Very low	29.7	Very low	144 Å²	144	150.6 Å²	150.6	77%	0.77	80%	0.802	S	S	*	*			trans	-53.6	144.6	176.2	-77.4	-57.8	0	0	0	115.1
601	S	31.6	Very low	30	Very low	106 Å²	106	146.2 Å²	146.2	74%	0.741	80%	0.799	S	S	*	*			trans	42	88.2	143.4	67	0	0	0	0	118.6
602	Q	30.3	Very low	30.2	Very low	183 Å²	183	143.9 Å²	143.9	86%	0.855	80%	0.799	S	S	*	*			trans	-141.6	138.5	135.3	-94.5	-165.6	-21.9	0	0	110.7	Q604	Q602-Q604 PolarHBondContact O-N 2.91Å
603	P	29.8	Very low	30.3	Very low	123 Å²	123	144 Å²	144	80%	0.799	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-71.7	116.5	-171.6	28.3	-31.9	0	0	0	110.1	Q605	P603-Q605 PolarHBondContact O-N 2.88Å
604	Q	28	Very low	30.6	Very low	195 Å²	195	141.4 Å²	141.4	91%	0.911	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-62.7	119.4	172	-84.3	-176	-27.6	0	0	110	Q602 K606	Q602-Q604 PolarHBondContact O-N 2.91Å; Q604-K606 PolarHBondContact O-N 3.36Å
605	Q	30	Very low	30.6	Very low	165 Å²	165	144.5 Å²	144.5	77%	0.771	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-48.4	123.6	174.1	-70.9	162.8	-32.3	0	0	110.7	P603 Y607	P603-Q605 PolarHBondContact O-N 2.88Å; Q605-Y607 PolarHBondContact O-N 3.18Å; Q605-Y607 VanDerWaalsContact O-N 3.15Å
606	K	29.1	Very low	30.8	Very low	198 Å²	198	144.3 Å²	144.3	86%	0.861	81%	0.813	S	S	*	*			trans	-57.8	115.1	161.6	-92.7	179.6	173.2	178.5	0	108	Q604 S608	Q604-K606 PolarHBondContact O-N 3.36Å; K606-S608 PolarHBondContact O-N 2.94Å; K606-S608 VanDerWaalsContact O-N 3.14Å
607	Y	25.9	Very low	30.5	Very low	210 Å²	210	140.4 Å²	140.4	82%	0.824	81%	0.81	S	S	*	*			trans	-66.6	104.9	159.3	-70	-87.9	0	0	0	107.9	Q605 L609	Q605-Y607 PolarHBondContact O-N 3.18Å; Q605-Y607 VanDerWaalsContact O-N 3.15Å; Y607-L609 PolarHBondContact O-N 3.49Å
608	S	27.5	Very low	30.7	Very low	109 Å²	109	142.4 Å²	142.4	76%	0.762	81%	0.812	S	S	*	*			trans	-70.3	117	168.7	-68.9	0	0	0	0	109.1	K606	K606-S608 PolarHBondContact O-N 2.94Å; K606-S608 VanDerWaalsContact O-N 3.14Å
609	L	27.1	Very low	30.6	Very low	168 Å²	168	147.3 Å²	147.3	88%	0.88	82%	0.819	S	S	*	*			trans	-104.7	28.4	172.7	-80.8	171.1	0	0	0	112.3	Y607	Y607-L609 PolarHBondContact O-N 3.49Å
610	L	30	Very low	30.4	Very low	154 Å²	154	146.7 Å²	146.7	81%	0.806	82%	0.815	S	S	*	*	S	Bend	trans	-125.9	130.9	170.3	-81	145.2	0	0	0	109.3
611	P	32.7	Very low	30.1	Very low	112 Å²	112	148.5 Å²	148.5	73%	0.727	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-66.8	155.9	-179.2	28.5	-32.7	0	0	0	111.1
612	P	31.6	Very low	29.7	Very low	124 Å²	124	150.2 Å²	150.2	81%	0.805	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-71	150.1	-161	29.9	-35.7	0	0	0	113.2
613	D	27.8	Very low	29.3	Very low	165 Å²	165	151.2 Å²	151.2	88%	0.882	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-53.7	135.5	168.1	-61.1	-52.9	0	0	0	112
614	A	35.8	Very low	29	Very low	88 Å²	88	152.9 Å²	152.9	73%	0.727	82%	0.819	S	S	*	*			trans	-154.6	98.2	149.8	0	0	0	0	0	108.7
615	D	32.4	Very low	28.9	Very low	165 Å²	165	151.3 Å²	151.3	88%	0.882	82%	0.815	S	S	*	*			trans	51.7	87.2	146.8	-56	-27.1	0	0	0	119
616	S	35.1	Very low	28.8	Very low	114 Å²	114	148 Å²	148	80%	0.797	81%	0.81	S	S	*	*			trans	-156.9	105.2	134.3	60.7	0	0	0	0	109.1	D618	S616-D618 PolarHBondContact O-N 3.13Å
617	G	28.4	Very low	28.7	Very low	75 Å²	75	144.3 Å²	144.3	77%	0.773	81%	0.806	S	S	*	*			trans	-65.3	127	171.8	0	0	0	0	0	110.3
618	D	34.4	Very low	28.9	Very low	156 Å²	156	139.3 Å²	139.3	83%	0.834	81%	0.808	S	S	*	*			trans	-136.9	116.5	147.3	-83.7	-38.1	0	0	0	106.7	S616 V620	S616-D618 PolarHBondContact O-N 3.13Å; D618-V620 PolarHBondContact O-N 3.43Å
619	E	27	Very low	28.9	Very low	192 Å²	192	138.3 Å²	138.3	90%	0.897	81%	0.807	S	S	*	*			trans	-60.9	121.5	175.7	-61.4	176.1	148.5	0	0	109.6
620	V	32.6	Very low	28.7	Very low	134 Å²	134	136.3 Å²	136.3	81%	0.812	81%	0.805	S	S	*	*			trans	-128.3	110.4	155.9	-175.8	0	0	0	0	107.5	D618	D618-V620 PolarHBondContact O-N 3.43Å
621	E	25.9	Very low	28.6	Very low	182 Å²	182	134.7 Å²	134.7	85%	0.85	81%	0.807	S	S	*	*			trans	-52.7	131.8	-175.9	-76.7	177.3	130.8	0	0	113.3	F623	E621-F623 PolarHBondContact O-N 2.94Å
622	N	22.5	Very low	28.4	Very low	142 Å²	142	135.2 Å²	135.2	76%	0.759	81%	0.808	S	S	*	*			trans	-61.5	122.9	169.1	-69.9	-45.2	0	0	0	111.5	H624	N622-H624 PolarHBondContact O-N 3.49Å
623	F	22.9	Very low	28.3	Very low	205 Å²	205	136 Å²	136	90%	0.899	81%	0.805	S	S	*	*			trans	-86.3	101.7	151.7	-95.7	-89.1	0	0	0	109.2	E621 I625	E621-F623 PolarHBondContact O-N 2.94Å; F623-I625 PolarHBondContact O-N 3Å
624	H	21.5	Very low	28.2	Very low	158 Å²	158	137.1 Å²	137.1	73%	0.731	81%	0.805	S	S	*	*			trans	-66.3	121.5	167.3	-99	-83.1	0	0	0	110.5	N622	N622-H624 PolarHBondContact O-N 3.49Å
625	I	27.7	Very low	27.7	Very low	162 Å²	162	141.4 Å²	141.4	83%	0.831	81%	0.813	S	S	*	*			trans	-115.2	107.2	151.6	-62.8	175.7	0	0	0	106.3	F623	F623-I625 PolarHBondContact O-N 3Å
626	S	27.9	Very low	27.6	Very low	95 Å²	95	140.2 Å²	140.2	66%	0.664	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-65.8	141.9	177.3	-60.3	0	0	0	0	111.1
627	P	26.6	Very low	27.2	Very low	121 Å²	121	140.6 Å²	140.6	79%	0.786	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-80.6	140.1	-169.8	31.1	-34	0	0	0	112.7
628	A	28.7	Very low	27	Very low	104 Å²	104	148.1 Å²	148.1	86%	0.86	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-70.5	133.9	157.4	0	0	0	0	0	109.1
629	A	27.7	Very low	26.8	Very low	89 Å²	89	147.7 Å²	147.7	74%	0.736	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-67.2	146.4	-171.6	0	0	0	0	0	114.1
630	C	23.4	Very low	27.1	Very low	125 Å²	125	145.6 Å²	145.6	85%	0.845	80%	0.801	S	S	*	*			trans	62.2	106.4	148.1	-62.7	0	0	0	0	118.8
631	S	28.8	Very low	26.7	Very low	121 Å²	121	150.8 Å²	150.8	85%	0.846	81%	0.806	S	S	*	*				-165.9	126.9	86.3	56.3	0	0	0	0	110.1
632	T	27.4	Very low	26.5	Very low	123 Å²	123	150.3 Å²	150.3	76%	0.755	80%	0.801	S	S	*	*			trans	-81	149.1	174.2	30.5	0	0	0	0	110.3
633	N	29	Very low	26.8	Very low	139 Å²	139	150 Å²	150	74%	0.743	80%	0.799	S	S	*	*			trans	84.7	86	151	-57.7	-8.9	0	0	0	117
634	E	26	Very low	27.4	Very low	189 Å²	189	147.4 Å²	147.4	88%	0.883	79%	0.789	S	S	*	*				-41.7	143.3	125.1	-82.8	178.3	136.8	0	0	111.1
635	M	26.5	Very low	27.6	Very low	179 Å²	179	149.9 Å²	149.9	88%	0.882	80%	0.798	S	S	*	*			trans	85.3	61.5	-178.4	-54.9	-153.2	-167.8	0	0	116.6
636	T	30.5	Very low	27.6	Very low	139 Å²	139	150.3 Å²	150.3	85%	0.853	80%	0.795	S	S	*	*				-111.7	107	116.6	24.9	0	0	0	0	108.8	R638	T636-R638 PolarHBondContact O-N 3.47Å
637	N	25.8	Very low	27.8	Very low	123 Å²	123	153 Å²	153	66%	0.658	79%	0.794	S	S	*	*			trans	-10.1	126.6	147.3	-81	-43.6	0	0	0	113	L639	N637-L639 PolarHBondContact O-N 3.21Å
638	R	25	Very low	27.8	Very low	233 Å²	233	159.1 Å²	159.1	88%	0.879	80%	0.801	S	S	*	*	S	Bend		51.9	29.2	86.2	-77.2	-171.6	162.2	-166	-3	114.5	T636	T636-R638 PolarHBondContact O-N 3.47Å
639	L	29.9	Very low	27.8	Very low	147 Å²	147	159.7 Å²	159.7	77%	0.77	80%	0.795	S	S	*	*			trans	-142.5	27.4	169.7	-106.4	160	0	0	0	115.3	N637	N637-L639 PolarHBondContact O-N 3.21Å
640	L	33.8	Very low	27.9	Very low	147 Å²	147	161.3 Å²	161.3	77%	0.77	79%	0.79	S	S	*	*			trans	-128	21	159.7	-82.2	163.9	0	0	0	113	F642	L640-F642 PolarHBondContact O-N 3.42Å
641	W	22.7	Very low	28	Very low	243 Å²	243	160.2 Å²	160.2	92%	0.92	78%	0.78	S	S	*	*	S	Bend	trans	-74.5	8.7	155.3	-118.3	82.8	0	0	0	112.5
642	F	23.4	Very low	27.9	Very low	172 Å²	172	160.9 Å²	160.9	75%	0.754	77%	0.774	S	S	*	*	S	Bend	trans	-136.3	128.2	162.9	-87.4	-88.3	0	0	0	108.7	L640	L640-F642 PolarHBondContact O-N 3.42Å
643	L	28.5	Very low	28.5	Very low	136 Å²	136	164.4 Å²	164.4	71%	0.712	80%	0.799	S	S	*	*	S	Bend	trans	86.4	59.6	175.1	-51.1	166.6	0	0	0	117.3
644	H	35.4	Very low	28.5	Very low	151 Å²	151	165.7 Å²	165.7	70%	0.699	80%	0.802	S	S	*	*	S	Bend		-150.2	9	127.8	-113.7	-68.4	0	0	0	116	F646	H644-F646 PolarHBondContact O-N 3.4Å
645	F	25.1	Very low	28.6	Very low	210 Å²	210	164.4 Å²	164.4	92%	0.921	80%	0.797	S	S	*	*	S	Bend	trans	-62.3	8.2	153.7	-123.9	-85	0	0	0	113.6
646	F	27.9	Very low	28.7	Very low	171 Å²	171	163.6 Å²	163.6	75%	0.75	79%	0.793	S	S	*	*			trans	-139.6	91.5	166.8	-86.7	-83.6	0	0	0	111.3	H644	H644-F646 PolarHBondContact O-N 3.4Å
647	K	31.7	Very low	28.6	Very low	152 Å²	152	165.1 Å²	165.1	66%	0.661	79%	0.789	S	S	*	*			trans	-159.3	67.9	131.7	-117.6	-177.6	-174.3	-175.4	0	110.1	L650	K647-L650 HydrophobicContact CD-CD1 4.24Å
648	R	26.4	Very low	28.8	Very low	248 Å²	248	167.7 Å²	167.7	94%	0.936	80%	0.797	S	S	*	*			trans	-112.1	75.2	150.9	-125.2	-170.2	-172.8	-176.8	2.5	106.7
649	T	28.3	Very low	29	Very low	117 Å²	117	163.3 Å²	163.3	72%	0.718	79%	0.792	S	S	*	*			trans	177.7	82.8	156.8	43.7	0	0	0	0	108.7
650	L	30.1	Very low	29	Very low	122 Å²	122	164.5 Å²	164.5	64%	0.639	79%	0.793	S	S	*	*			trans	-135.2	102.7	138.8	-88.6	134.2	0	0	0	102.2	K647	K647-L650 HydrophobicContact CD-CD1 4.24Å
651	T	25.2	Very low	28.6	Very low	102 Å²	102	165.8 Å²	165.8	63%	0.626	80%	0.795	S	S	*	*				41.8	121.7	85.2	62.3	0	0	0	0	110.4
652	D	27.9	Very low	29.1	Very low	135 Å²	135	159.4 Å²	159.4	72%	0.722	79%	0.785	S	S	*	*			cis	-167.4	-176.3	14.7	-87.9	-33.8	0	0	0	104.7
653	P	39.4	Very low	29.6	Very low	197 Å²	197	158.3 Å²	158.3	100%	1.279	79%	0.787	S	S	*	*			trans	-63	0	139.3	31.3	-31.5	0	0	0	111.2

Retrieved 653 of 653 residues in 402.3 ms (Link to these results)

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