A0A060D7Z4_MAIZE Loading...

GRAS transcription factor

AlphaFold DB , UniProt , Accession A0A060D7Z4, Species MAIZE (Zea mays, Maize), Gene GRAS85, Length 586 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	35.5	Very low	39.6	Very low	54 Å²	54	86.3 Å²	86.3	27%	0.266	45%	0.447	S	S	.	.				0	-53.1	0	-88.9	-152.3	-150.1	0	0	111.1	T3 L4 F5 L545	M1-T3 PolarHBondContact O-N 2.85Å; M1-L4 WeakPolarHBondContact O-CA 3.42Å; M1-L4 WeakPolarHBondContact O-CB 3.32Å; M1-L4 PolarHBondContact O-N 3.46Å; M1-F5 HydrophobicContact CB-CD2 4.19Å; M1-F5 HydrophobicContact CB-CE2 4.04Å; M1-F5 HydrophobicContact CG-CE2 4.29Å; M1-F5 WeakPolarHBondContact O-CD2 3.26Å; M1-F5 PolarHBondContact O-N 3.04Å; M1-F5 HydrophobicContact SD-CE2 3.92Å; M1-L545 HydrophobicContact CE-CD1 4.41Å
2	D	36.4	Very low	39.8	Very low	132 Å²	132	83.8 Å²	83.8	71%	0.706	45%	0.449	S	S	*	.	H	α-helix	trans	-58.2	-30.8	177.3	-68.9	-35.6	0	0	0	114.2	R6	D2-R6 WeakPolarHBondContact O-CB 3.27Å; D2-R6 PolarHBondContact O-N 2.88Å
3	T	42.4	Very low	40.1	Very low	81 Å²	81	81.5 Å²	81.5	50%	0.497	44%	0.443	S	S	.	.	H	α-helix	trans	-69.2	-37.1	172.3	14.6	0	0	0	0	113.2	M1 S7 E313	M1-T3 PolarHBondContact O-N 2.85Å; T3-S7 WeakPolarHBondContact O-CB 3.39Å; T3-S7 PolarHBondContact O-N 3.12Å; T3-S7 VanDerWaalsContact O-N 3.11Å; T3-S7 PolarHBondContact O-OG 3.1Å; T3-E313 PolarHBondContact OG1-OE1 3.14Å
4	L	39.7	Very low	40.6	Very low	41 Å²	41	83.6 Å²	83.6	22%	0.215	45%	0.448	C	S	.	.	H	α-helix	trans	-72.4	-34.2	173.2	-91.3	149.7	0	0	0	112.2	M1 V8 P309 T310	M1-L4 WeakPolarHBondContact O-CA 3.42Å; M1-L4 WeakPolarHBondContact O-CB 3.32Å; M1-L4 PolarHBondContact O-N 3.46Å; L4-V8 WeakPolarHBondContact O-CG2 3.28Å; L4-V8 PolarHBondContact O-N 3.41Å; L4-P309 HydrophobicContact CD1-CB 3.57Å; L4-P309 HydrophobicContact CD2-CB 3.64Å; L4-P309 HydrophobicContact CD2-CG 4.2Å; L4-P309 HydrophobicContact CG-CB 4.13Å; L4-T310 HydrophobicContact CD1-CG2 3.97Å
5	F	39.6	Very low	41.1	Very low	69 Å²	69	86.7 Å²	86.7	30%	0.303	46%	0.459	S	S	.	.	H	α-helix	trans	-72.7	-40	173.3	-73.2	-68	0	0	0	111.9	M1 S9 E262	M1-F5 HydrophobicContact CB-CD2 4.19Å; M1-F5 HydrophobicContact CB-CE2 4.04Å; M1-F5 HydrophobicContact CG-CE2 4.29Å; M1-F5 WeakPolarHBondContact O-CD2 3.26Å; M1-F5 PolarHBondContact O-N 3.04Å; M1-F5 HydrophobicContact SD-CE2 3.92Å; F5-S9 VanDerWaalsContact O-CB 3.24Å; F5-S9 WeakPolarHBondContact O-CB 3.43Å; F5-S9 PolarHBondContact O-N 3.32Å; F5-S9 VanDerWaalsContact O-N 3.13Å; F5-S9 PolarHBondContact O-OG 2.91Å; F5-E262 HydrophobicContact CZ-CB 4.45Å
6	R	39.8	Very low	41.6	Very low	193 Å²	193	89.3 Å²	89.3	73%	0.728	47%	0.468	S	S	*	.	H	α-helix	trans	-69.2	-43.1	178	-87.3	-174.5	174.7	-177.9	-0	113.7	D2 V8 S9 L10	D2-R6 WeakPolarHBondContact O-CB 3.27Å; D2-R6 PolarHBondContact O-N 2.88Å; R6-V8 PolarHBondContact O-N 3.09Å; R6-S9 PolarHBondContact O-N 3.07Å; R6-L10 WeakPolarHBondContact O-CB 3.37Å; R6-L10 WeakPolarHBondContact O-CD1 3.48Å; R6-L10 VanDerWaalsContact O-CG 3.29Å; R6-L10 WeakPolarHBondContact O-CG 3.29Å; R6-L10 PolarHBondContact O-N 2.98Å; R6-L10 VanDerWaalsContact O-N 3.11Å
7	S	38	Very low	42.1	Very low	54 Å²	54	92.2 Å²	92.2	38%	0.378	48%	0.478	S	S	.	.	H	α-helix	trans	-72.1	-27.9	-175.6	48.7	0	0	0	0	113.6	T3	T3-S7 WeakPolarHBondContact O-CB 3.39Å; T3-S7 PolarHBondContact O-N 3.12Å; T3-S7 VanDerWaalsContact O-N 3.11Å; T3-S7 PolarHBondContact O-OG 3.1Å
8	V	43	Very low	42.5	Very low	59 Å²	59	94.7 Å²	94.7	36%	0.358	49%	0.487	S	S	.	.	H	α-helix	trans	-86.5	-29.9	175.5	-178.9	0	0	0	0	112.3	L4 R6	L4-V8 WeakPolarHBondContact O-CG2 3.28Å; L4-V8 PolarHBondContact O-N 3.41Å; R6-V8 PolarHBondContact O-N 3.09Å
9	S	39.8	Very low	43	Very low	71 Å²	71	97.2 Å²	97.2	50%	0.497	50%	0.496	S	S	.	.	H	α-helix	trans	-70	-40.2	175.2	-56.3	0	0	0	0	112.5	F5 R6 Q11 A12 S13	F5-S9 VanDerWaalsContact O-CB 3.24Å; F5-S9 WeakPolarHBondContact O-CB 3.43Å; F5-S9 PolarHBondContact O-N 3.32Å; F5-S9 VanDerWaalsContact O-N 3.13Å; F5-S9 PolarHBondContact O-OG 2.91Å; R6-S9 PolarHBondContact O-N 3.07Å; S9-Q11 VanDerWaalsContact C-N 3.3Å; S9-Q11 PolarHBondContact O-N 3.26Å; S9-A12 PolarHBondContact O-N 3.2Å; S9-S13 PolarHBondContact O-N 3.41Å; S9-S13 VanDerWaalsContact O-N 3.12Å; S9-S13 PolarHBondContact O-OG 2.92Å; S9-S13 VanDerWaalsContact O-OG 3.09Å
10	L	37.9	Very low	43.3	Very low	101 Å²	101	98.3 Å²	98.3	53%	0.529	50%	0.5	S	S	.	.	H	α-helix	trans	-61.7	-36.7	-179.4	-76.9	164.5	0	0	0	112.2	R6 S13 E14	R6-L10 WeakPolarHBondContact O-CB 3.37Å; R6-L10 WeakPolarHBondContact O-CD1 3.48Å; R6-L10 VanDerWaalsContact O-CG 3.29Å; R6-L10 WeakPolarHBondContact O-CG 3.29Å; R6-L10 PolarHBondContact O-N 2.98Å; R6-L10 VanDerWaalsContact O-N 3.11Å; L10-S13 WeakPolarHBondContact CA-OG 3.43Å; L10-S13 PolarHBondContact O-N 3.45Å; L10-S13 PolarHBondContact O-OG 3.44Å; L10-E14 WeakPolarHBondContact O-CB 3.27Å; L10-E14 WeakPolarHBondContact O-CG 3.5Å; L10-E14 PolarHBondContact O-N 3.49Å
11	Q	43.4	Very low	43.5	Very low	94 Å²	94	96.8 Å²	96.8	44%	0.439	50%	0.498	S	S	.	.	H	α-helix	trans	-72	-30.8	176.6	-86.6	179.3	-9.1	0	0	113.9	S9 Q15	S9-Q11 VanDerWaalsContact C-N 3.3Å; S9-Q11 PolarHBondContact O-N 3.26Å; Q11-Q15 WeakPolarHBondContact O-CG 3.42Å; Q11-Q15 PolarHBondContact O-N 3.19Å; Q11-Q15 VanDerWaalsContact O-N 3.16Å
12	A	42.2	Very low	44.1	Very low	57 Å²	57	97 Å²	97	47%	0.471	51%	0.509	S	S	.	.	H	α-helix	trans	-73.2	-36.3	175.7	0	0	0	0	0	111.8	S9 Q16	S9-A12 PolarHBondContact O-N 3.2Å; A12-Q16 PolarHBondContact O-N 3.28Å
13	S	43.9	Very low	44.7	Very low	53 Å²	53	94 Å²	94	37%	0.371	50%	0.498	S	S	.	.	H	α-helix	trans	-71.6	-36.9	174	45.9	0	0	0	0	113.1	S9 L10 Q17	S9-S13 PolarHBondContact O-N 3.41Å; S9-S13 VanDerWaalsContact O-N 3.12Å; S9-S13 PolarHBondContact O-OG 2.92Å; S9-S13 VanDerWaalsContact O-OG 3.09Å; L10-S13 WeakPolarHBondContact CA-OG 3.43Å; L10-S13 PolarHBondContact O-N 3.45Å; L10-S13 PolarHBondContact O-OG 3.44Å; S13-Q17 WeakPolarHBondContact O-CB 3.31Å; S13-Q17 PolarHBondContact O-N 3.32Å
14	E	46.7	Very low	44.9	Very low	111 Å²	111	99.6 Å²	99.6	52%	0.519	51%	0.511	S	S	.	.	H	α-helix	trans	-70.4	-37.4	178	-77.5	178.1	158.4	0	0	112.3	L10 Q17 Q18	L10-E14 WeakPolarHBondContact O-CB 3.27Å; L10-E14 WeakPolarHBondContact O-CG 3.5Å; L10-E14 PolarHBondContact O-N 3.49Å; E14-Q17 PolarHBondContact O-N 2.99Å; E14-Q18 WeakPolarHBondContact O-CB 3.37Å; E14-Q18 WeakPolarHBondContact O-CG 3.28Å; E14-Q18 PolarHBondContact O-N 3.46Å
15	Q	48	Very low	45.1	Very low	130 Å²	130	104.8 Å²	104.8	61%	0.607	54%	0.539	S	S	*	.	H	α-helix	trans	-71.1	-35.1	175.4	-74.6	-174.7	-9.1	0	0	112.8	Q11 Q19	Q11-Q15 WeakPolarHBondContact O-CG 3.42Å; Q11-Q15 PolarHBondContact O-N 3.19Å; Q11-Q15 VanDerWaalsContact O-N 3.16Å; Q15-Q19 WeakPolarHBondContact O-CB 3.4Å; Q15-Q19 WeakPolarHBondContact O-CG 3.49Å; Q15-Q19 PolarHBondContact O-N 3.05Å
16	Q	48.8	Very low	45.3	Very low	129 Å²	129	106.1 Å²	106.1	60%	0.603	56%	0.557	S	S	*	*	H	α-helix	trans	-70.8	-36.6	172.5	-84.8	-175.8	-11.3	0	0	112.7	A12 Q20	A12-Q16 PolarHBondContact O-N 3.28Å; Q16-Q20 WeakPolarHBondContact O-CB 3.49Å; Q16-Q20 VanDerWaalsContact O-CG 3.31Å; Q16-Q20 WeakPolarHBondContact O-CG 3.37Å; Q16-Q20 PolarHBondContact O-N 2.9Å
17	Q	49.9	Very low	45.3	Very low	138 Å²	138	107.3 Å²	107.3	65%	0.645	56%	0.561	S	S	*	*	H	α-helix	trans	-69.8	-35.5	174.3	-87	-178.4	-3.5	0	0	112.6	S13 E14 S21	S13-Q17 WeakPolarHBondContact O-CB 3.31Å; S13-Q17 PolarHBondContact O-N 3.32Å; E14-Q17 PolarHBondContact O-N 2.99Å; Q17-S21 WeakPolarHBondContact O-CB 3.46Å; Q17-S21 PolarHBondContact O-N 3.34Å; Q17-S21 PolarHBondContact O-OG 2.81Å
18	Q	50.7	Low	45.3	Very low	137 Å²	137	109.7 Å²	109.7	64%	0.64	58%	0.578	S	S	*	*	H	α-helix	trans	-71.2	-35.4	175	-76.7	177.7	7.6	0	0	112.8	E14 S21 A22	E14-Q18 WeakPolarHBondContact O-CB 3.37Å; E14-Q18 WeakPolarHBondContact O-CG 3.28Å; E14-Q18 PolarHBondContact O-N 3.46Å; Q18-S21 WeakPolarHBondContact CA-OG 3.38Å; Q18-S21 PolarHBondContact O-OG 2.96Å; Q18-A22 VanDerWaalsContact O-CB 3.22Å; Q18-A22 WeakPolarHBondContact O-CB 3.39Å; Q18-A22 PolarHBondContact O-N 3.18Å
19	Q	51.3	Low	44.9	Very low	142 Å²	142	113.6 Å²	113.6	66%	0.664	60%	0.602	S	S	*	*	H	α-helix	trans	-74.4	-32.2	173.9	-74.9	179	0.7	0	0	113.1	Q15 S23	Q15-Q19 WeakPolarHBondContact O-CB 3.4Å; Q15-Q19 WeakPolarHBondContact O-CG 3.49Å; Q15-Q19 PolarHBondContact O-N 3.05Å; Q19-S23 WeakPolarHBondContact O-CB 3.35Å; Q19-S23 PolarHBondContact O-N 2.82Å; Q19-S23 VanDerWaalsContact O-N 3.07Å; Q19-S23 PolarHBondContact O-OG 3.25Å
20	Q	49.2	Very low	44.8	Very low	120 Å²	120	116.8 Å²	116.8	56%	0.561	62%	0.619	S	S	*	*	H	α-helix	trans	-73.7	-36.5	173.4	-74	-179.3	11.1	0	0	112.4	Q16 S23 Y24	Q16-Q20 WeakPolarHBondContact O-CB 3.49Å; Q16-Q20 VanDerWaalsContact O-CG 3.31Å; Q16-Q20 WeakPolarHBondContact O-CG 3.37Å; Q16-Q20 PolarHBondContact O-N 2.9Å; Q20-S23 WeakPolarHBondContact CA-OG 3.43Å; Q20-S23 PolarHBondContact O-OG 3.45Å; Q20-Y24 WeakPolarHBondContact O-CD2 3.32Å; Q20-Y24 PolarHBondContact O-N 2.84Å; Q20-Y24 VanDerWaalsContact O-N 3.12Å
21	S	48.1	Very low	44.8	Very low	67 Å²	67	117.1 Å²	117.1	47%	0.469	63%	0.63	S	S	.	*	H	α-helix	trans	-75	-29.3	175.2	48.9	0	0	0	0	113.4	Q17 Q18	Q17-S21 WeakPolarHBondContact O-CB 3.46Å; Q17-S21 PolarHBondContact O-N 3.34Å; Q17-S21 PolarHBondContact O-OG 2.81Å; Q18-S21 WeakPolarHBondContact CA-OG 3.38Å; Q18-S21 PolarHBondContact O-OG 2.96Å
22	A	48.3	Very low	44.7	Very low	59 Å²	59	118.7 Å²	118.7	49%	0.488	65%	0.651	S	S	.	*	H	α-helix	trans	-73.6	-33.7	171.4	0	0	0	0	0	113.1	Q18 S26	Q18-A22 VanDerWaalsContact O-CB 3.22Å; Q18-A22 WeakPolarHBondContact O-CB 3.39Å; Q18-A22 PolarHBondContact O-N 3.18Å; A22-S26 PolarHBondContact O-OG 3.28Å
23	S	48.6	Very low	44.4	Very low	69 Å²	69	119.2 Å²	119.2	48%	0.483	66%	0.662	S	S	.	*	H	α-helix	trans	-78.8	-26.5	177.9	53.7	0	0	0	0	113.8	Q19 Q20	Q19-S23 WeakPolarHBondContact O-CB 3.35Å; Q19-S23 PolarHBondContact O-N 2.82Å; Q19-S23 VanDerWaalsContact O-N 3.07Å; Q19-S23 PolarHBondContact O-OG 3.25Å; Q20-S23 WeakPolarHBondContact CA-OG 3.43Å; Q20-S23 PolarHBondContact O-OG 3.45Å
24	Y	45.2	Very low	44.1	Very low	198 Å²	198	122 Å²	122	78%	0.776	68%	0.682	S	S	*	*	H	α-helix	trans	-76.9	-21.2	174.6	-96.8	-87.2	0	0	0	114.5	Q20	Q20-Y24 WeakPolarHBondContact O-CD2 3.32Å; Q20-Y24 PolarHBondContact O-N 2.84Å; Q20-Y24 VanDerWaalsContact O-N 3.12Å
25	N	45.1	Very low	43.7	Very low	150 Å²	150	128.1 Å²	128.1	80%	0.802	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	1.2	176.2	-81.3	-19.7	0	0	0	114.4
26	S	43.7	Very low	43.3	Very low	96 Å²	96	126.6 Å²	126.6	67%	0.671	70%	0.704	S	S	*	*	S	Bend	trans	-109.9	7.3	-172.4	-53.5	0	0	0	0	114.6	A22	A22-S26 PolarHBondContact O-OG 3.28Å
27	R	39.2	Very low	42.8	Very low	218 Å²	218	125.7 Å²	125.7	82%	0.823	71%	0.711	S	S	*	*			trans	-132.3	71.3	179.7	-80.7	-176.4	173.3	179	-1.4	112.4
28	S	38.2	Very low	42.4	Very low	104 Å²	104	123.7 Å²	123.7	73%	0.727	71%	0.713	S	S	*	*			trans	-163.8	115.1	150.5	51.3	0	0	0	0	109.3
29	T	35.2	Very low	42	Very low	141 Å²	141	124.8 Å²	124.8	87%	0.865	72%	0.718	S	S	*	*			trans	158.7	100	146.8	39.1	0	0	0	0	109.8
30	T	37.5	Very low	41.4	Very low	138 Å²	138	125 Å²	125	85%	0.847	72%	0.719	S	S	*	*			trans	-141.5	117.9	143.5	36.6	0	0	0	0	109.7
31	S	37.7	Very low	40.9	Very low	108 Å²	108	124.8 Å²	124.8	76%	0.755	73%	0.726	S	S	*	*			trans	53	110.1	148.6	61.6	0	0	0	0	120.2
32	S	40.6	Very low	40.4	Very low	127 Å²	127	128.8 Å²	128.8	89%	0.888	74%	0.742	S	S	*	*				157.1	140.1	92.8	53.3	0	0	0	0	112.1
33	G	36.2	Very low	39.9	Very low	68 Å²	68	130.5 Å²	130.5	70%	0.701	76%	0.756	S	S	*	*			trans	110.7	77.8	150.4	0	0	0	0	0	119.5
34	S	37.5	Very low	39.2	Very low	112 Å²	112	132 Å²	132	78%	0.783	77%	0.766	S	S	*	*				64.3	125.1	122.8	-53.5	0	0	0	0	123
35	R	38.6	Very low	38.9	Very low	240 Å²	240	133.8 Å²	133.8	91%	0.906	77%	0.773	S	S	*	*			trans	78.6	139.2	148.4	-65.2	171.8	165.4	-169.7	-5.1	117.4
36	S	39.2	Very low	38.4	Very low	98 Å²	98	132.5 Å²	132.5	69%	0.685	77%	0.767	S	S	*	*			cis	-171.8	141.7	-8.6	-76.7	0	0	0	0	107.7
37	S	39.1	Very low	38.1	Very low	109 Å²	109	138.1 Å²	138.1	76%	0.762	78%	0.775	S	S	*	*			trans	51.9	119.7	144.3	65.9	0	0	0	0	122.8
38	S	40.9	Very low	37.9	Very low	96 Å²	96	136 Å²	136	67%	0.671	77%	0.768	S	S	*	*				145.4	141.2	97.4	63.3	0	0	0	0	115.7
39	H	42.1	Very low	37.7	Very low	161 Å²	161	139.7 Å²	139.7	75%	0.745	77%	0.767	S	S	*	*			trans	70.3	142.8	159.5	-67.1	-67	0	0	0	119.9
40	Q	39.6	Very low	37.9	Very low	146 Å²	146	140.9 Å²	140.9	68%	0.682	76%	0.762	S	S	*	*			cis	179.4	137.9	-21.2	-141.2	172.2	-0.1	0	0	105.6
41	T	38.9	Very low	37.8	Very low	116 Å²	116	139 Å²	139	71%	0.712	76%	0.755	S	S	*	*			trans	51.5	145.6	141	53	0	0	0	0	120.8
42	D	37.5	Very low	37.8	Very low	151 Å²	151	141.3 Å²	141.3	81%	0.807	76%	0.759	S	S	*	*			cis	-173.3	176	1.1	-138.2	-32.9	0	0	0	107.4
43	A	37.7	Very low	37.6	Very low	95 Å²	95	140.5 Å²	140.5	79%	0.785	75%	0.753	S	S	*	*			trans	121	102.5	151.8	0	0	0	0	0	117.9
44	S	33.4	Very low	37.7	Very low	100 Å²	100	140.6 Å²	140.6	70%	0.699	76%	0.755	S	S	*	*			trans	-64.6	157.4	169.5	49.8	0	0	0	0	117.7
45	Y	38.8	Very low	37.8	Very low	235 Å²	235	142.8 Å²	142.8	92%	0.922	76%	0.763	S	S	*	*			trans	-151.8	137.4	138.3	-100.8	-79	0	0	0	111.3
46	N	34.3	Very low	37.6	Very low	124 Å²	124	135 Å²	135	66%	0.663	76%	0.757	S	S	*	*			trans	-147.3	138.9	-165.7	-156.1	9.6	0	0	0	108
47	Y	37.6	Very low	37.6	Very low	213 Å²	213	134.3 Å²	134.3	84%	0.835	77%	0.765	S	S	*	*			trans	-173	112.8	161.9	-93.4	-72	0	0	0	108.5
48	Y	35.6	Very low	37.3	Very low	173 Å²	173	136.3 Å²	136.3	68%	0.678	77%	0.772	S	S	*	*				57.9	139	64.5	-79.9	-95.1	0	0	0	114.7
49	Y	34.2	Very low	37	Very low	183 Å²	183	135 Å²	135	72%	0.718	77%	0.774	S	S	*	*			cis	-178.6	-179.8	-10.1	-135.4	-105.4	0	0	0	108.6
50	H	38.2	Very low	36.6	Very low	165 Å²	165	134.1 Å²	134.1	76%	0.764	77%	0.77	S	S	*	*			trans	89.7	141.4	156	-77.8	-45.8	0	0	0	120.2
51	S	36.7	Very low	36.3	Very low	99 Å²	99	135 Å²	135	69%	0.692	77%	0.769	S	S	*	*			cis	-174.3	148.8	19.9	19.6	0	0	0	0	114.3
52	N	36.2	Very low	36.2	Very low	156 Å²	156	139.9 Å²	139.9	83%	0.834	78%	0.776	S	S	*	*			trans	52.4	149.8	140.3	-91.4	5.6	0	0	0	122.5
53	S	37.7	Very low	36.1	Very low	110 Å²	110	143.6 Å²	143.6	77%	0.769	78%	0.78	S	S	*	*			cis	179.5	155.4	9.1	31.3	0	0	0	0	110
54	G	38.9	Very low	36	Very low	71 Å²	71	142.3 Å²	142.3	73%	0.732	78%	0.776	S	S	*	*			trans	151.2	93.7	154.8	0	0	0	0	0	119.8
55	V	38.8	Very low	36.2	Very low	158 Å²	158	146 Å²	146	96%	0.958	78%	0.782	S	S	*	*			trans	26.9	138.2	132.1	-168.3	0	0	0	0	119.6
56	G	35.2	Very low	36	Very low	76 Å²	76	142.4 Å²	142.4	78%	0.784	77%	0.774	S	S	*	*			cis	163.5	160.8	6.4	0	0	0	0	0	109.7
57	G	37.6	Very low	36	Very low	83 Å²	83	142.8 Å²	142.8	86%	0.856	78%	0.776	S	S	*	*			trans	140.2	125	165.7	0	0	0	0	0	116.5
58	V	32.6	Very low	35.9	Very low	151 Å²	151	141 Å²	141	92%	0.915	78%	0.775	S	S	*	*			trans	-120	148.1	-165.7	172.7	0	0	0	0	111.9
59	G	35.8	Very low	35.7	Very low	69 Å²	69	140.5 Å²	140.5	71%	0.711	78%	0.779	S	S	*	*			trans	138.3	150.7	153.5	0	0	0	0	0	113.9
60	Q	33.5	Very low	35.6	Very low	142 Å²	142	143.3 Å²	143.3	66%	0.664	79%	0.79	S	S	*	*			cis	177.7	134.5	-37.2	-126.1	-173.9	-1	0	0	106.2
61	Y	32.5	Very low	35.3	Very low	165 Å²	165	144.3 Å²	144.3	65%	0.647	79%	0.788	S	S	*	*			trans	70.6	126.6	156.3	-52.5	-56.8	0	0	0	121.9
62	Y	36.8	Very low	35.1	Very low	218 Å²	218	149.1 Å²	149.1	86%	0.855	80%	0.8	S	S	*	*				-174.6	149.8	89.9	-98.4	-80.8	0	0	0	113.7
63	Y	36	Very low	34.9	Very low	230 Å²	230	149.6 Å²	149.6	90%	0.902	80%	0.797	S	S	*	*			trans	-48.1	166.8	174.1	-82.9	-106.9	0	0	0	115.5
64	G	35.4	Very low	35.1	Very low	67 Å²	67	148.6 Å²	148.6	69%	0.691	79%	0.788	S	S	*	*			cis	-178.9	162.8	11.6	0	0	0	0	0	106
65	Q	37.4	Very low	34.8	Very low	178 Å²	178	156.4 Å²	156.4	83%	0.832	80%	0.797	S	S	*	*				174.1	141.6	74	-161.6	175.4	14.6	0	0	108.9
66	Q	35.2	Very low	34.5	Very low	160 Å²	160	157.2 Å²	157.2	75%	0.748	79%	0.79	S	S	*	*			trans	0.5	143.1	156.4	-65.3	156	-5.7	0	0	118.8
67	N	34.6	Very low	34.4	Very low	132 Å²	132	162.5 Å²	162.5	71%	0.706	79%	0.794	S	S	*	*				-174	150.6	56	-136.8	-3.9	0	0	0	113.5
68	Q	33.9	Very low	34.1	Very low	174 Å²	174	167.4 Å²	167.4	81%	0.813	80%	0.795	S	S	*	*			trans	78	105	151	-73.6	172.9	15.7	0	0	122.4
69	Q	31.9	Very low	34	Very low	163 Å²	163	169 Å²	169	76%	0.762	79%	0.792	S	S	*	*			trans	-67.9	145.8	161.7	-64.3	161.6	-52	0	0	112.4
70	Y	32.9	Very low	33.7	Very low	242 Å²	242	172.4 Å²	172.4	95%	0.949	80%	0.804	S	S	*	*			trans	-139.3	108.1	133.8	-104.6	-84.5	0	0	0	108.5
71	Y	32.1	Very low	33.6	Very low	186 Å²	186	169 Å²	169	73%	0.729	81%	0.807	S	S	*	*			trans	-84.6	132.7	166.3	-105	-94.2	0	0	0	108.5
72	Q	32.5	Very low	33.3	Very low	200 Å²	200	169.6 Å²	169.6	94%	0.935	82%	0.821	S	S	*	*			trans	-151.7	110.7	139.6	-123.2	172.3	-1.8	0	0	108.9
73	E	32.1	Very low	32.9	Very low	166 Å²	166	163 Å²	163	78%	0.776	81%	0.812	S	S	*	*			trans	-90.4	169.7	178.1	-106.8	-135.8	160.7	0	0	111.6
74	P	40.5	Very low	32.6	Very low	89 Å²	89	161.5 Å²	161.5	58%	0.578	81%	0.812	S	S	*	*			trans	-109.2	165.2	-142.4	40.8	-34.8	0	0	0	114.2
75	Y	33.4	Very low	32.2	Very low	235 Å²	235	168.6 Å²	168.6	92%	0.922	82%	0.819	S	S	*	*			trans	-154.7	150.3	157.1	-86.9	-75	0	0	0	112
76	Q	32.9	Very low	31.6	Very low	176 Å²	176	167.1 Å²	167.1	82%	0.822	82%	0.815	S	S	*	*			trans	96.2	91.6	168.2	-56.8	-175.4	-7.3	0	0	115.1
77	Q	32.1	Very low	31.3	Very low	186 Å²	186	169.8 Å²	169.8	87%	0.869	82%	0.82	S	S	*	*				100.9	120	61	-172.3	168.6	30.8	0	0	110.2
78	E	30.9	Very low	31.1	Very low	187 Å²	187	171 Å²	171	87%	0.874	82%	0.823	S	S	*	*			trans	-61.5	140.1	-179	-65	167.6	129.5	0	0	112.8
79	E	31.6	Very low	31	Very low	183 Å²	183	168 Å²	168	86%	0.855	81%	0.813	S	S	*	*			trans	-151.8	114.6	139.6	-119.8	177.8	-177.7	0	0	109.9	G81	E79-G81 PolarHBondContact O-N 3.33Å
80	C	29.7	Very low	30.9	Very low	141 Å²	141	168.7 Å²	168.7	95%	0.953	82%	0.816	S	S	*	*			trans	-63.6	118.9	166.4	-80.8	0	0	0	0	110
81	G	30.1	Very low	30.9	Very low	70 Å²	70	163.6 Å²	163.6	72%	0.722	81%	0.806	S	S	*	*			trans	-126.9	103.7	168.6	0	0	0	0	0	110.8	E79 A83	E79-G81 PolarHBondContact O-N 3.33Å; G81-A83 PolarHBondContact O-N 2.74Å
82	N	27.8	Very low	31	Very low	179 Å²	179	162.5 Å²	162.5	96%	0.957	81%	0.805	S	S	*	*			trans	-57.6	95.8	159.7	-91.7	-26	0	0	0	109.2
83	A	28.2	Very low	30.8	Very low	79 Å²	79	158.6 Å²	158.6	65%	0.653	80%	0.8	S	S	*	*			trans	-168.4	85.7	164.6	0	0	0	0	0	111.2	G81	G81-A83 PolarHBondContact O-N 2.74Å
84	H	29.5	Very low	30.7	Very low	198 Å²	198	156.4 Å²	156.4	92%	0.917	80%	0.803	S	S	*	*			trans	-123.7	82.8	148.1	-97.5	-70.1	0	0	0	109.1
85	R	27	Very low	30.2	Very low	217 Å²	217	157.7 Å²	157.7	82%	0.819	81%	0.814	S	S	*	*			trans	-53.4	133.8	154.6	-81.4	178.3	170.7	173.1	-3.1	109
86	L	25.4	Very low	30	Very low	146 Å²	146	152.5 Å²	152.5	76%	0.764	81%	0.812	S	S	*	*			trans	32.5	101.1	135.6	-58.7	167.2	0	0	0	115.7
87	Y	27.9	Very low	30	Very low	216 Å²	216	149.8 Å²	149.8	85%	0.847	81%	0.812	S	S	*	*			trans	-128.2	102	142.8	-98.3	-89.1	0	0	0	107.4	D89	Y87-D89 PolarHBondContact O-N 2.98Å
88	M	30	Very low	30	Very low	158 Å²	158	146.7 Å²	146.7	78%	0.778	81%	0.811	S	S	*	*			trans	-62.8	120.8	155.3	-68.4	-93.8	-171.8	0	0	105.4	E90	M88-E90 HydrophobicContact CB-CG 4.49Å; M88-E90 PolarHBondContact O-N 2.83Å
89	D	32.2	Very low	30.1	Very low	112 Å²	112	148.7 Å²	148.7	60%	0.599	81%	0.811	S	S	*	*			trans	-70.4	86.1	163.1	-77.6	-31.9	0	0	0	107	Y87 D91	Y87-D89 PolarHBondContact O-N 2.98Å; D89-D91 PolarHBondContact O-N 3.34Å
90	E	29.7	Very low	30.2	Very low	177 Å²	177	148 Å²	148	83%	0.827	81%	0.807	S	S	*	*			trans	-73.1	81.6	155.2	-69.4	-168.4	147.1	0	0	107.6	M88	M88-E90 HydrophobicContact CB-CG 4.49Å; M88-E90 PolarHBondContact O-N 2.83Å
91	D	32.2	Very low	30.3	Very low	135 Å²	135	149.9 Å²	149.9	72%	0.722	80%	0.802	S	S	*	*			trans	-144.7	51.6	170.1	-89.1	-31.6	0	0	0	110.2	D89	D89-D91 PolarHBondContact O-N 3.34Å
92	F	35.7	Very low	30.6	Very low	162 Å²	162	155.6 Å²	155.6	71%	0.711	81%	0.807	S	S	*	*	S	Bend	trans	-145.1	66.9	157	-87.6	-77.8	0	0	0	109.1	L240	F92-L240 HydrophobicContact CE2-CD2 4.35Å; F92-L240 HydrophobicContact CZ-CD2 4.12Å
93	S	27.9	Very low	30.8	Very low	119 Å²	119	155.9 Å²	155.9	83%	0.832	80%	0.802	S	S	*	*			trans	-160.7	86	162.6	-81.5	0	0	0	0	108.9
94	S	30.5	Very low	31	Very low	119 Å²	119	157.9 Å²	157.9	83%	0.832	81%	0.812	S	S	*	*			trans	-169.6	111.1	165.5	-77.5	0	0	0	0	105.5
95	S	29	Very low	31.3	Very low	116 Å²	116	157.8 Å²	157.8	81%	0.811	81%	0.811	S	S	*	*				-165.4	124.7	59.6	-62	0	0	0	0	111.1
96	S	29.8	Very low	31.8	Very low	127 Å²	127	151.2 Å²	151.2	89%	0.888	81%	0.811	S	S	*	*			trans	-165.5	85.1	142.2	-89.6	0	0	0	0	108.4
97	S	32	Very low	32.3	Very low	118 Å²	118	149.3 Å²	149.3	83%	0.825	82%	0.816	S	S	*	*			trans	-101.1	107.7	160.8	-66.5	0	0	0	0	108.2	R99	S97-R99 PolarHBondContact O-N 3.08Å
98	S	32.2	Very low	32.9	Very low	121 Å²	121	143.3 Å²	143.3	85%	0.846	81%	0.812	S	S	*	*			trans	-69.3	111.8	160.2	51.6	0	0	0	0	108.2
99	R	33.2	Very low	33.4	Very low	229 Å²	229	142.6 Å²	142.6	86%	0.864	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-89.9	117.6	164.3	-89.8	-175.2	174.8	171.5	-0.3	108.6	S97 H101	S97-R99 PolarHBondContact O-N 3.08Å; R99-H101 PolarHBondContact O-N 3.04Å
100	Q	34.2	Very low	33.6	Very low	169 Å²	169	145.9 Å²	145.9	79%	0.79	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-61	126.6	166.7	-66.9	-177.8	-15.1	0	0	109.9
101	H	32.6	Very low	34.3	Very low	181 Å²	181	143.6 Å²	143.6	84%	0.838	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-77.8	119.5	167.7	-80.4	-73.6	0	0	0	109.6	R99	R99-H101 PolarHBondContact O-N 3.04Å
102	F	35	Very low	34.4	Very low	190 Å²	190	141.6 Å²	141.6	83%	0.833	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-97.6	126.4	158.5	-95.1	-87.5	0	0	0	109.1
103	H	31.6	Very low	34.9	Very low	184 Å²	184	141 Å²	141	85%	0.852	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-71.5	141	173.5	-75.4	-70.7	0	0	0	111.9
104	S	34.4	Very low	35.4	Very low	122 Å²	122	140.4 Å²	140.4	85%	0.853	84%	0.836	S	S	*	*			trans	-155.9	134.7	142.2	-167	0	0	0	0	111.2
105	H	35.2	Very low	35.9	Very low	195 Å²	195	140.2 Å²	140.2	90%	0.903	84%	0.835	S	S	*	*			trans	-73	148.5	-176.7	-87.6	-87	0	0	0	113.4
106	G	37.8	Very low	36.5	Very low	80 Å²	80	139.2 Å²	139.2	83%	0.825	83%	0.833	S	S	*	*			trans	-166	115.7	163.4	0	0	0	0	0	111.3
107	A	36.2	Very low	37	Very low	105 Å²	105	139.6 Å²	139.6	87%	0.868	83%	0.83	S	S	*	*			trans	-87.9	154.5	-171.4	0	0	0	0	0	114.1
108	A	39.5	Very low	37.5	Very low	91 Å²	91	140.4 Å²	140.4	75%	0.752	83%	0.83	S	S	*	*			trans	151.4	107.8	132.3	0	0	0	0	0	112.1
109	V	40.9	Very low	38	Very low	143 Å²	143	138.7 Å²	138.7	87%	0.867	82%	0.824	S	S	*	*				76.8	114.8	103.9	179.9	0	0	0	0	115.8
110	Q	36.2	Very low	38.5	Very low	180 Å²	180	134.4 Å²	134.4	84%	0.841	82%	0.823	S	S	*	*			trans	-90.7	166.4	164.3	-77.5	-176.1	-24.2	0	0	111.6
111	P	44.1	Very low	38.9	Very low	130 Å²	130	131 Å²	131	84%	0.844	82%	0.823	S	S	*	*				-142.3	162.9	122.6	32	-14.2	0	0	0	115.8
112	A	35.6	Very low	39.5	Very low	92 Å²	92	128 Å²	128	76%	0.76	82%	0.82	S	S	*	*			trans	-97.7	156.4	-172.7	0	0	0	0	0	114.2
113	T	45.8	Very low	39.9	Very low	151 Å²	151	125.7 Å²	125.7	93%	0.926	82%	0.822	S	S	*	*			trans	-147.5	153.7	156.7	49	0	0	0	0	111.6
114	S	38.8	Very low	40.4	Very low	105 Å²	105	122.4 Å²	122.4	73%	0.734	82%	0.817	S	S	*	*			trans	-113.8	145.7	-147.6	45.6	0	0	0	0	115.9
115	S	39.4	Very low	40.5	Very low	115 Å²	115	122.7 Å²	122.7	80%	0.804	82%	0.816	S	S	*	*			trans	50.3	127.4	137.2	58.8	0	0	0	0	124.4
116	A	41.9	Very low	40.8	Very low	95 Å²	95	121.6 Å²	121.6	79%	0.785	82%	0.816	S	S	*	*				157.7	107.2	127	0	0	0	0	0	111.7
117	V	41.2	Very low	40.6	Very low	136 Å²	136	123.3 Å²	123.3	82%	0.824	82%	0.815	S	S	*	*				62.7	111.2	92.1	-173.5	0	0	0	0	117.5
118	T	42.6	Very low	40.5	Very low	134 Å²	134	124.5 Å²	124.5	82%	0.822	81%	0.812	S	S	*	*				173.4	121.8	124.2	10.7	0	0	0	0	111.9
119	A	42.1	Very low	40.3	Very low	86 Å²	86	125.7 Å²	125.7	71%	0.711	82%	0.815	S	S	*	*				64.8	135.5	105.2	0	0	0	0	0	115.4
120	T	43.2	Very low	40	Very low	138 Å²	138	124.5 Å²	124.5	85%	0.847	81%	0.813	S	S	*	*			cis	-176.9	140.8	13.9	19.2	0	0	0	0	105.8
121	A	43.1	Very low	40	Very low	97 Å²	97	122.6 Å²	122.6	80%	0.802	81%	0.813	S	S	*	*				162.7	160.3	95.4	0	0	0	0	0	111.1
122	P	45.3	Very low	39.4	Very low	118 Å²	118	121.2 Å²	121.2	77%	0.766	81%	0.813	S	S	*	*			trans	-122.3	171.5	-147.2	40.7	-27.6	0	0	0	117
123	T	43.1	Very low	39.3	Very low	143 Å²	143	121.5 Å²	121.5	88%	0.877	82%	0.816	S	S	*	*			trans	-171.7	162	153.4	15.2	0	0	0	0	111.5
124	P	42.1	Very low	38.6	Very low	115 Å²	115	118 Å²	118	75%	0.747	81%	0.809	S	S	*	*	P	Polyproline II helix		-99	171.6	-119.8	40.2	-37.8	0	0	0	116.5
125	P	37.2	Very low	38.1	Very low	127 Å²	127	117.1 Å²	117.1	83%	0.825	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-92	140.1	-177.7	35.4	-29.9	0	0	0	113.3
126	L	41.1	Very low	38.1	Very low	173 Å²	173	115.9 Å²	115.9	91%	0.906	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-91.6	118.4	163	-95.1	134.3	0	0	0	109
127	S	33.1	Very low	38.4	Very low	116 Å²	116	119.9 Å²	119.9	81%	0.811	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-85.1	117.1	171	47.5	0	0	0	0	110.6
128	T	35.2	Very low	39.1	Very low	130 Å²	130	116.7 Å²	116.7	80%	0.798	80%	0.795	S	S	*	*			trans	-129.2	116.4	158.4	40.1	0	0	0	0	108.5	S130	T128-S130 PolarHBondContact O-N 3.33Å
129	S	34.1	Very low	40.1	Very low	116 Å²	116	112.3 Å²	112.3	81%	0.811	77%	0.766	S	S	*	*			trans	-60.6	120.2	176.5	48	0	0	0	0	111.9
130	S	35.6	Very low	41	Very low	118 Å²	118	109.3 Å²	109.3	83%	0.825	74%	0.737	S	S	*	*			trans	-86.2	111.7	161	58.8	0	0	0	0	109.2	T128	T128-S130 PolarHBondContact O-N 3.33Å
131	T	34.4	Very low	41.6	Very low	139 Å²	139	109.8 Å²	109.8	85%	0.853	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-66.4	135.9	167.5	12.5	0	0	0	0	110.2
132	A	31.6	Very low	42.2	Very low	101 Å²	101	109.6 Å²	109.6	84%	0.835	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-58.4	129.5	-175	0	0	0	0	0	113.1
133	A	33.4	Very low	42.5	Very low	99 Å²	99	107.3 Å²	107.3	82%	0.818	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-78.1	120.7	157.7	0	0	0	0	0	108	A135	A133-A135 PolarHBondContact O-N 2.98Å
134	G	31.4	Very low	43	Very low	76 Å²	76	104 Å²	104	78%	0.784	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-57.8	131.4	175.8	0	0	0	0	0	111.4	A136	G134-A136 PolarHBondContact O-N 3.43Å
135	A	29.6	Very low	43.4	Very low	88 Å²	88	102.3 Å²	102.3	73%	0.727	68%	0.68	S	S	*	*			trans	-63	112.8	176.9	0	0	0	0	0	110	A133 H137	A133-A135 PolarHBondContact O-N 2.98Å; A135-H137 PolarHBondContact O-N 3.17Å; A135-H137 VanDerWaalsContact O-N 3.12Å
136	A	39.2	Very low	43.8	Very low	88 Å²	88	100.4 Å²	100.4	73%	0.727	67%	0.67	S	S	*	*			trans	-69.7	102.3	167.4	0	0	0	0	0	108.3	G134 A138	G134-A136 PolarHBondContact O-N 3.43Å; A136-A138 PolarHBondContact O-N 3.47Å
137	H	47.9	Very low	43.6	Very low	180 Å²	180	100.3 Å²	100.3	83%	0.833	66%	0.663	S	S	*	*			trans	-65.6	121.9	169.1	-89	-82.4	0	0	0	108.9	A135	A135-H137 PolarHBondContact O-N 3.17Å; A135-H137 VanDerWaalsContact O-N 3.12Å
138	A	55.7	Low	43.9	Very low	68 Å²	68	97.5 Å²	97.5	56%	0.562	64%	0.642	S	S	*	*			trans	-57.3	141.4	175.5	0	0	0	0	0	110.6	A136 F140	A136-A138 PolarHBondContact O-N 3.47Å; A138-F140 WeakPolarHBondContact CB-O 3.46Å; A138-F140 PolarHBondContact O-N 3.06Å
139	L	64.1	Low	44.4	Very low	42 Å²	42	97.1 Å²	97.1	22%	0.22	64%	0.642	C	S	.	*	S	Bend	trans	-63.8	-29.1	179.9	-78.2	172.5	0	0	0	112.6	R191 R228	L139-R191 PolarHBondContact O-NH1 2.89Å; L139-R228 HydrophobicContact CD1-CG 4.05Å
140	F	60.1	Low	44.6	Very low	24 Å²	24	98.7 Å²	98.7	11%	0.105	64%	0.641	C	S	.	*	S	Bend	trans	-136.4	148.3	176.4	-66.4	-76.3	0	0	0	109.2	A138 D144 L145 R191 S193 V196 L229	A138-F140 WeakPolarHBondContact CB-O 3.46Å; A138-F140 PolarHBondContact O-N 3.06Å; F140-D144 HydrophobicContact CB-CB 4.25Å; F140-D144 HydrophobicContact CD1-CB 4.17Å; F140-L145 HydrophobicContact CB-CG 4.49Å; F140-R191 HydrophobicContact CE1-CB 4.1Å; F140-R191 WeakPolarHBondContact CE1-O 3.37Å; F140-R191 HydrophobicContact CZ-CB 4.22Å; F140-S193 VanDerWaalsContact CE1-CB 3.5Å; F140-V196 HydrophobicContact CZ-CG2 4.34Å; F140-L229 HydrophobicContact CD2-CD2 3.74Å; F140-L229 HydrophobicContact CE2-CD2 3.45Å; F140-L229 VanDerWaalsContact CE2-CD2 3.45Å
141	E	56.9	Low	44.6	Very low	147 Å²	147	97 Å²	97	69%	0.687	62%	0.622	S	S	*	*			trans	-78.2	150.6	166.6	-136.8	168.5	-163.4	0	0	108.9	A143 D144	E141-A143 PolarHBondContact O-N 3.43Å; E141-D144 PolarHBondContact N-OD2 3Å; E141-D144 WeakPolarHBondContact O-CB 3.22Å; E141-D144 PolarHBondContact O-N 3.49Å
142	A	55.2	Low	44.7	Very low	93 Å²	93	98 Å²	98	77%	0.769	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-57.6	-25.3	-177.7	0	0	0	0	0	113	D144	A142-D144 VanDerWaalsContact C-N 3.33Å
143	A	51	Low	44.9	Very low	71 Å²	71	98.6 Å²	98.6	59%	0.587	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-68.3	-28.2	174.7	0	0	0	0	0	113.3	E141 L145 S146	E141-A143 PolarHBondContact O-N 3.43Å; A143-L145 PolarHBondContact O-N 3.46Å; A143-S146 PolarHBondContact O-N 2.9Å; A143-S146 PolarHBondContact O-OG 2.93Å
144	D	53.9	Low	44.9	Very low	74 Å²	74	99.9 Å²	99.9	40%	0.396	60%	0.604	S	S	.	*	G	3₁₀ helix	trans	-73.1	-12.6	-176.9	-60.8	-33	0	0	0	113	F140 E141 A142 S193	F140-D144 HydrophobicContact CB-CB 4.25Å; F140-D144 HydrophobicContact CD1-CB 4.17Å; E141-D144 PolarHBondContact N-OD2 3Å; E141-D144 WeakPolarHBondContact O-CB 3.22Å; E141-D144 PolarHBondContact O-N 3.49Å; A142-D144 VanDerWaalsContact C-N 3.33Å; D144-S193 VanDerWaalsContact O-CB 3.23Å; D144-S193 WeakPolarHBondContact O-CB 3.45Å; D144-S193 PolarHBondContact O-OG 3.27Å
145	L	51.2	Low	45.1	Very low	78 Å²	78	105.6 Å²	105.6	41%	0.408	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-104	15.1	-177.5	-59	177.7	0	0	0	113.2	F140 A143 F147 Q197	F140-L145 HydrophobicContact CB-CG 4.49Å; A143-L145 PolarHBondContact O-N 3.46Å; L145-F147 PolarHBondContact O-N 3.28Å; L145-Q197 PolarHBondContact O-NE2 3.21Å; L145-Q197 VanDerWaalsContact O-NE2 3.1Å
146	S	44.5	Very low	45.4	Very low	87 Å²	87	105.6 Å²	105.6	61%	0.608	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-68.8	128.2	176.9	63.8	0	0	0	0	111.9	A143 P148 Q197	A143-S146 PolarHBondContact O-N 2.9Å; A143-S146 PolarHBondContact O-OG 2.93Å; S146-P148 WeakPolarHBondContact O-CD 3.45Å; S146-Q197 PolarHBondContact O-OE1 3.45Å
147	F	36.7	Very low	45.1	Very low	172 Å²	172	106.1 Å²	106.1	75%	0.754	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-61.4	123.5	-178.7	-66.7	-89.3	0	0	0	112.9	L145 Q197	L145-F147 PolarHBondContact O-N 3.28Å; F147-Q197 VanDerWaalsContact CE1-NE2 3.31Å
148	P	40.6	Very low	44.6	Very low	57 Å²	57	103.9 Å²	103.9	37%	0.37	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-75.7	140.2	161	28.6	-28.8	0	0	0	110.2	S146 D150	S146-P148 WeakPolarHBondContact O-CD 3.45Å; P148-D150 VanDerWaalsContact C-N 3.33Å; P148-D150 PolarHBondContact O-N 3.19Å
149	P	44.6	Very low	43.5	Very low	122 Å²	122	105 Å²	105	79%	0.792	61%	0.611	S	S	*	*	S	Bend	trans	-77.5	-5.5	-171.7	28.2	-33.1	0	0	0	115.8
150	D	39.8	Very low	42.2	Very low	148 Å²	148	108.3 Å²	108.3	79%	0.791	64%	0.638	S	S	*	*			trans	-128.8	102	-172.9	-64.1	-46.2	0	0	0	111.8	P148	P148-D150 VanDerWaalsContact C-N 3.33Å; P148-D150 PolarHBondContact O-N 3.19Å
151	L	35.8	Very low	41.2	Very low	82 Å²	82	112.5 Å²	112.5	43%	0.429	67%	0.67	S	S	.	*			trans	-108	102.4	171.3	-72.9	174.2	0	0	0	110	Q198	L151-Q198 HydrophobicContact CD2-CG 3.51Å; L151-Q198 VanDerWaalsContact CD2-NE2 3.3Å
152	N	35	Very low	40.3	Very low	162 Å²	162	111.4 Å²	111.4	87%	0.866	68%	0.679	S	S	*	*			trans	-95.3	106.7	171	-150.8	6.4	0	0	0	108.5
153	L	35.4	Very low	39.2	Very low	112 Å²	112	110.8 Å²	110.8	59%	0.586	68%	0.681	S	S	*	*			trans	-95.8	91.9	-178.3	-65.1	171.3	0	0	0	109.3	W201	L153-W201 HydrophobicContact CD1-CZ3 4.12Å
154	D	33.8	Very low	38.2	Very low	126 Å²	126	111 Å²	111	67%	0.674	69%	0.69	S	S	*	*			trans	-104.7	108.6	171.4	-159.6	-18.2	0	0	0	109.7	S156	D154-S156 PolarHBondContact O-N 3.18Å; D154-S156 VanDerWaalsContact O-N 3.15Å; D154-S156 PolarHBondContact OD1-OG 2.81Å
155	F	37.4	Very low	37.2	Very low	196 Å²	196	113.8 Å²	113.8	86%	0.86	71%	0.714	S	S	*	*			trans	-88.1	64	175.8	-146.3	-85.9	0	0	0	109
156	S	34.6	Very low	36.2	Very low	88 Å²	88	117.3 Å²	117.3	62%	0.615	74%	0.739	S	S	*	*			trans	-92.2	105.3	174.5	-75.7	0	0	0	0	109.7	D154	D154-S156 PolarHBondContact O-N 3.18Å; D154-S156 VanDerWaalsContact O-N 3.15Å; D154-S156 PolarHBondContact OD1-OG 2.81Å
157	S	32.5	Very low	35.6	Very low	100 Å²	100	117.6 Å²	117.6	70%	0.699	75%	0.746	S	S	*	*			trans	-42.4	133.4	173.4	-58.5	0	0	0	0	112.7	A159	S157-A159 PolarHBondContact O-N 3.05Å
158	P	38.9	Very low	35.3	Very low	132 Å²	132	114.4 Å²	114.4	86%	0.857	75%	0.745	S	S	*	*			trans	-77.8	93	169.1	30.2	-28.6	0	0	0	109	S160	P158-S160 PolarHBondContact O-N 3.11Å
159	A	32.4	Very low	34.8	Very low	91 Å²	91	117.5 Å²	117.5	75%	0.752	77%	0.768	S	S	*	*			trans	-74	106.7	158	0	0	0	0	0	108.4	S157	S157-A159 PolarHBondContact O-N 3.05Å
160	S	36.4	Very low	34.1	Very low	112 Å²	112	116.6 Å²	116.6	78%	0.783	77%	0.771	S	S	*	*			trans	154.4	107.7	138.8	50.8	0	0	0	0	112.9	P158	P158-S160 PolarHBondContact O-N 3.11Å
161	S	39.3	Very low	33.8	Very low	113 Å²	113	112.3 Å²	112.3	79%	0.79	76%	0.756	S	S	*	*				170.6	106.8	123.1	41.9	0	0	0	0	111.1
162	S	37.1	Very low	33.7	Very low	124 Å²	124	113.8 Å²	113.8	87%	0.867	77%	0.769	S	S	*	*			trans	40.3	116.4	144.3	57.3	0	0	0	0	120.9
163	G	32.6	Very low	33.9	Very low	79 Å²	79	109.9 Å²	109.9	81%	0.814	77%	0.766	S	S	*	*			trans	133.3	79	140.2	0	0	0	0	0	117.7
164	G	29.2	Very low	35	Very low	76 Å²	76	106.9 Å²	106.9	78%	0.784	76%	0.762	S	S	*	*			trans	50	105.3	140.9	0	0	0	0	0	121.2
165	C	33.7	Very low	37.4	Very low	132 Å²	132	108.5 Å²	108.5	89%	0.892	76%	0.759	S	S	*	*				179	129	109.8	56.3	0	0	0	0	109.8
166	V	30.1	Very low	40.2	Very low	153 Å²	153	102.6 Å²	102.6	93%	0.927	73%	0.731	S	S	*	*			trans	-93.5	108.6	-176.4	-99.3	0	0	0	0	109.4
167	A	32.3	Very low	43.2	Very low	93 Å²	93	98.4 Å²	98.4	77%	0.769	70%	0.702	S	S	*	*			trans	-154	117.7	156.5	0	0	0	0	0	110.5
168	S	30.3	Very low	46.2	Very low	105 Å²	105	94.6 Å²	94.6	73%	0.734	68%	0.675	S	S	*	*			trans	73.4	69.9	169.6	78.2	0	0	0	0	118.9	A170	S168-A170 PolarHBondContact O-N 3.43Å
169	S	28.8	Very low	48.9	Very low	122 Å²	122	93.2 Å²	93.2	85%	0.853	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	16.8	171.7	53	0	0	0	0	115.7
170	A	31.1	Very low	52	Low	103 Å²	103	89.5 Å²	89.5	85%	0.851	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-6	179.5	0	0	0	0	0	114.7	S168	S168-A170 PolarHBondContact O-N 3.43Å
171	A	32.8	Very low	54.9	Low	58 Å²	58	84.1 Å²	84.1	48%	0.479	59%	0.587	S	S	.	*	S	Bend	trans	-104.3	-0.3	-171.3	0	0	0	0	0	115.4	G173	A171-G173 VanDerWaalsContact C-N 3.35Å; A171-G173 PolarHBondContact O-N 3.09Å
172	V	34.5	Very low	57.7	Low	113 Å²	113	81.3 Å²	81.3	69%	0.685	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-22.4	-167.8	-174.9	0	0	0	0	113.1
173	G	39.5	Very low	60.6	Low	79 Å²	79	79 Å²	79	81%	0.814	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-4.1	-179.9	0	0	0	0	0	116.4	A171	A171-G173 VanDerWaalsContact C-N 3.35Å; A171-G173 PolarHBondContact O-N 3.09Å
174	G	58.3	Low	63.7	Low	49 Å²	49	75.3 Å²	75.3	51%	0.505	50%	0.5	S	S	.	.	S	Bend	trans	-105.4	4.9	-167.6	0	0	0	0	0	116.5
175	R	84.3	Confident	67	Low	160 Å²	160	71.7 Å²	71.7	60%	0.604	46%	0.462	S	S	*	.			trans	-133.5	40.1	-170.2	-63.8	-173.5	176.8	-134.2	-0.2	113.3	A177 S178 Q179 E214	R175-A177 VanDerWaalsContact C-N 3.31Å; R175-A177 PolarHBondContact O-N 3.35Å; R175-S178 PolarHBondContact O-N 2.94Å; R175-Q179 PolarHBondContact O-N 3.1Å; R175-E214 WeakPolarHBondContact CA-OE2 3.41Å
176	W	96.3	Very high	70	Confident	73 Å²	73	72.3 Å²	72.3	28%	0.277	45%	0.446	S	S	.	.	H	α-helix	trans	-63.4	-37.1	-176.2	68.3	-95.5	0	0	0	111.9	S178 Q179 L180 L206 E214 Q215 A218	W176-S178 VanDerWaalsContact C-N 3.33Å; W176-S178 PolarHBondContact O-N 3.44Å; W176-Q179 PolarHBondContact O-N 3.39Å; W176-L180 HydrophobicContact CE3-CD2 4.3Å; W176-L180 HydrophobicContact CZ3-CD2 4.21Å; W176-L180 VanDerWaalsContact O-CB 3.31Å; W176-L180 WeakPolarHBondContact O-CB 3.39Å; W176-L180 PolarHBondContact O-N 2.99Å; W176-L206 HydrophobicContact CE3-CD1 3.95Å; W176-L206 HydrophobicContact CH2-CB 3.55Å; W176-L206 HydrophobicContact CH2-CD1 4.32Å; W176-L206 HydrophobicContact CZ2-CB 4.36Å; W176-L206 HydrophobicContact CZ3-CB 3.72Å; W176-L206 HydrophobicContact CZ3-CD1 3.7Å; W176-L206 HydrophobicContact CZ3-CG 4.37Å; W176-E214 HydrophobicContact CD2-CB 4.45Å; W176-E214 HydrophobicContact CZ2-CB 3.76Å; W176-E214 PolarHBondContact N-OE2 3.38Å; W176-Q215 HydrophobicContact CZ2-CG 4.04Å; W176-A218 HydrophobicContact CH2-CB 3.64Å; W176-A218 HydrophobicContact CZ3-CB 4.01Å
177	A	96.6	Very high	73.2	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-66.1	-41.9	-178.6	0	0	0	0	0	109.8	R175 Q179 L180 L181 E214 A218	R175-A177 VanDerWaalsContact C-N 3.31Å; R175-A177 PolarHBondContact O-N 3.35Å; A177-Q179 PolarHBondContact O-N 2.83Å; A177-L180 PolarHBondContact O-N 3.37Å; A177-L181 HydrophobicContact CB-CD1 4.48Å; A177-L181 WeakPolarHBondContact O-CB 3.47Å; A177-L181 WeakPolarHBondContact O-CD1 3.46Å; A177-L181 WeakPolarHBondContact O-CG 3.33Å; A177-L181 PolarHBondContact O-N 3.14Å; A177-E214 HydrophobicContact CB-CB 3.92Å; A177-E214 VanDerWaalsContact CB-O 3.28Å; A177-E214 WeakPolarHBondContact CB-O 3.47Å; A177-E214 VanDerWaalsContact CB-OE2 3.24Å; A177-E214 WeakPolarHBondContact CB-OE2 3.49Å; A177-E214 PolarHBondContact N-OE2 3.3Å; A177-A218 HydrophobicContact CB-CB 4.24Å
178	S	94.9	Very high	76.3	Confident	20 Å²	20	61.1 Å²	61.1	14%	0.14	37%	0.369	C	S	.	.	H	α-helix	trans	-60.2	-44.9	179	-69.1	0	0	0	0	112.5	R175 W176 L182	R175-S178 PolarHBondContact O-N 2.94Å; W176-S178 VanDerWaalsContact C-N 3.33Å; W176-S178 PolarHBondContact O-N 3.44Å; S178-L182 WeakPolarHBondContact O-CB 3.19Å; S178-L182 WeakPolarHBondContact O-CD1 3.44Å; S178-L182 WeakPolarHBondContact O-CG 3.5Å; S178-L182 PolarHBondContact O-N 3.17Å; S178-L182 VanDerWaalsContact O-N 3.17Å
179	Q	95.5	Very high	79.3	Confident	103 Å²	103	57 Å²	57	48%	0.481	34%	0.341	S	S	.	.	H	α-helix	trans	-65.4	-49.8	178.9	-67.6	174.5	-4.7	0	0	111	R175 W176 A177 L181 L182 E183	R175-Q179 PolarHBondContact O-N 3.1Å; W176-Q179 PolarHBondContact O-N 3.39Å; A177-Q179 PolarHBondContact O-N 2.83Å; Q179-L181 PolarHBondContact O-N 3.39Å; Q179-L182 PolarHBondContact O-N 3.08Å; Q179-E183 PolarHBondContact O-N 3.47Å
180	L	97.6	Very high	82.5	Confident	12 Å²	12	54.2 Å²	54.2	6%	0.063	33%	0.326	C	S	.	.	H	α-helix	trans	-65.2	-41.7	-176.4	-176.9	52.4	0	0	0	112.7	W176 A177 E183 C184 L199 M202 L203 L206	W176-L180 HydrophobicContact CE3-CD2 4.3Å; W176-L180 HydrophobicContact CZ3-CD2 4.21Å; W176-L180 VanDerWaalsContact O-CB 3.31Å; W176-L180 WeakPolarHBondContact O-CB 3.39Å; W176-L180 PolarHBondContact O-N 2.99Å; A177-L180 PolarHBondContact O-N 3.37Å; L180-E183 PolarHBondContact O-N 3.19Å; L180-C184 WeakPolarHBondContact O-CB 3.34Å; L180-C184 PolarHBondContact O-N 3.19Å; L180-L199 HydrophobicContact CD1-CB 4.49Å; L180-L199 HydrophobicContact CD1-CD2 3.43Å; L180-L199 VanDerWaalsContact CD1-CD2 3.43Å; L180-M202 HydrophobicContact CD1-CE 3.19Å; L180-M202 HydrophobicContact CD2-CE 3.75Å; L180-M202 HydrophobicContact CD2-CG 4.13Å; L180-M202 HydrophobicContact CG-CE 4.1Å; L180-L203 HydrophobicContact CB-CD2 4.33Å; L180-L203 HydrophobicContact CD2-CD2 3.57Å; L180-L203 HydrophobicContact CD2-CG 3.71Å; L180-L203 HydrophobicContact CG-CD1 4.43Å; L180-L203 HydrophobicContact CG-CD2 3.67Å; L180-L203 HydrophobicContact CG-CG 3.76Å; L180-L206 HydrophobicContact CD2-CD1 4.16Å
181	L	98.3	Very high	85.4	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.5	-41.6	176.6	-73.1	173.2	0	0	0	111.9	A177 Q179 C184 A185 L203 F221 L225 F463 L467	A177-L181 HydrophobicContact CB-CD1 4.48Å; A177-L181 WeakPolarHBondContact O-CB 3.47Å; A177-L181 WeakPolarHBondContact O-CD1 3.46Å; A177-L181 WeakPolarHBondContact O-CG 3.33Å; A177-L181 PolarHBondContact O-N 3.14Å; Q179-L181 PolarHBondContact O-N 3.39Å; L181-C184 PolarHBondContact O-N 2.8Å; L181-A185 WeakPolarHBondContact O-CB 3.32Å; L181-A185 PolarHBondContact O-N 2.85Å; L181-L203 HydrophobicContact CD2-CD1 3.91Å; L181-L203 HydrophobicContact CD2-CD2 3.71Å; L181-L203 HydrophobicContact CD2-CG 4.5Å; L181-L203 HydrophobicContact CG-CD2 4.13Å; L181-F221 HydrophobicContact CD1-CB 3.73Å; L181-F221 HydrophobicContact CD1-CD2 4.1Å; L181-F221 HydrophobicContact CD1-CG 3.96Å; L181-F221 HydrophobicContact CD2-CB 3.5Å; L181-F221 HydrophobicContact CD2-CG 4.48Å; L181-F221 HydrophobicContact CG-CB 4.22Å; L181-L225 HydrophobicContact CD2-CD1 4.36Å; L181-F463 HydrophobicContact CB-CE1 3.99Å; L181-F463 HydrophobicContact CB-CZ 4Å; L181-F463 WeakPolarHBondContact O-CE1 3.46Å; L181-F463 WeakPolarHBondContact O-CZ 3.41Å; L181-L467 HydrophobicContact CB-CD2 4.3Å; L181-L467 HydrophobicContact CD1-CD1 3.76Å
182	L	97.5	Very high	88.4	Confident	53 Å²	53	57.1 Å²	57.1	28%	0.277	31%	0.308	S	S	.	.	H	α-helix	trans	-66.1	-40.5	176.5	-74.4	171.7	0	0	0	112.1	S178 Q179 C184 A185 R186 F463 L467	S178-L182 WeakPolarHBondContact O-CB 3.19Å; S178-L182 WeakPolarHBondContact O-CD1 3.44Å; S178-L182 WeakPolarHBondContact O-CG 3.5Å; S178-L182 PolarHBondContact O-N 3.17Å; S178-L182 VanDerWaalsContact O-N 3.17Å; Q179-L182 PolarHBondContact O-N 3.08Å; L182-C184 VanDerWaalsContact C-N 3.34Å; L182-A185 PolarHBondContact O-N 3.35Å; L182-R186 WeakPolarHBondContact O-CG 3.47Å; L182-R186 PolarHBondContact O-N 2.82Å; L182-F463 HydrophobicContact CD2-CD1 4.16Å; L182-F463 HydrophobicContact CD2-CE1 4.46Å; L182-L467 HydrophobicContact CD1-CD2 4.3Å; L182-L467 HydrophobicContact CD2-CD2 4.13Å; L182-L467 HydrophobicContact CG-CD2 3.78Å
183	E	97.6	Very high	91.3	Very high	77 Å²	77	52.9 Å²	52.9	36%	0.36	28%	0.283	S	S	.	.	H	α-helix	trans	-61.2	-43.8	172.5	-75.5	-173.5	-157.2	0	0	111.7	Q179 L180 A185 R186 A187 R195 L199	Q179-E183 PolarHBondContact O-N 3.47Å; L180-E183 PolarHBondContact O-N 3.19Å; E183-A185 PolarHBondContact O-N 3.3Å; E183-R186 PolarHBondContact O-N 2.88Å; E183-A187 PolarHBondContact O-N 3.46Å; E183-R195 IonicContact OE2-CZ 3.95Å; E183-R195 IonicContact OE2-NH2 2.86Å; E183-R195 PolarHBondContact OE2-NH2 2.89Å; E183-L199 HydrophobicContact CB-CD1 4.04Å; E183-L199 HydrophobicContact CB-CD2 4.47Å
184	C	98.3	Very high	94.1	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.2	-42.9	178.5	-166.1	0	0	0	0	111.2	L180 L181 L182 R186 A187 V188 L199 L203 L225	L180-C184 WeakPolarHBondContact O-CB 3.34Å; L180-C184 PolarHBondContact O-N 3.19Å; L181-C184 PolarHBondContact O-N 2.8Å; L182-C184 VanDerWaalsContact C-N 3.34Å; C184-R186 VanDerWaalsContact C-N 3.34Å; C184-R186 PolarHBondContact O-N 2.83Å; C184-A187 PolarHBondContact O-N 2.84Å; C184-V188 VanDerWaalsContact O-CG2 3.32Å; C184-V188 WeakPolarHBondContact O-CG2 3.34Å; C184-V188 PolarHBondContact O-N 2.89Å; C184-L199 HydrophobicContact CB-CB 3.99Å; C184-L199 HydrophobicContact CB-CD1 4.17Å; C184-L203 HydrophobicContact CB-CD1 3.94Å; C184-L225 HydrophobicContact CB-CD1 4.17Å
185	A	97.8	Very high	95.9	Very high	0 Å²	0	57 Å²	57	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.6	-42.3	175.7	0	0	0	0	0	112.1	L181 L182 E183 V188 A189 F459 L460 F463	L181-A185 WeakPolarHBondContact O-CB 3.32Å; L181-A185 PolarHBondContact O-N 2.85Å; L182-A185 PolarHBondContact O-N 3.35Å; E183-A185 PolarHBondContact O-N 3.3Å; A185-V188 PolarHBondContact O-N 3.33Å; A185-A189 WeakPolarHBondContact O-CB 3.4Å; A185-A189 PolarHBondContact O-N 2.99Å; A185-F459 HydrophobicContact CB-CE1 4.02Å; A185-F459 HydrophobicContact CB-CZ 4.39Å; A185-L460 HydrophobicContact CB-CD2 3.96Å; A185-F463 HydrophobicContact CB-CB 4.4Å; A185-F463 HydrophobicContact CB-CD1 3.5Å; A185-F463 VanDerWaalsContact CB-CD1 3.5Å; A185-F463 HydrophobicContact CB-CD2 3.9Å; A185-F463 HydrophobicContact CB-CE1 3.61Å; A185-F463 HydrophobicContact CB-CE2 3.99Å; A185-F463 HydrophobicContact CB-CG 3.65Å; A185-F463 HydrophobicContact CB-CZ 3.85Å
186	R	97.9	Very high	96.6	Very high	145 Å²	145	49.5 Å²	49.5	55%	0.547	24%	0.237	S	C	.	.	H	α-helix	trans	-61.5	-44.3	174.1	-71	175.7	-165.2	149.9	3.1	112	L182 E183 C184 V188 A189 A190 L460	L182-R186 WeakPolarHBondContact O-CG 3.47Å; L182-R186 PolarHBondContact O-N 2.82Å; E183-R186 PolarHBondContact O-N 2.88Å; C184-R186 VanDerWaalsContact C-N 3.34Å; C184-R186 PolarHBondContact O-N 2.83Å; R186-V188 VanDerWaalsContact C-N 3.35Å; R186-V188 PolarHBondContact O-N 3.18Å; R186-A189 PolarHBondContact O-N 3.3Å; R186-A190 VanDerWaalsContact O-CB 3.3Å; R186-A190 WeakPolarHBondContact O-CB 3.47Å; R186-A190 PolarHBondContact O-N 2.83Å; R186-L460 HydrophobicContact CB-CD2 4.48Å; R186-L460 HydrophobicContact CG-CD1 4.35Å; R186-L460 HydrophobicContact CG-CD2 3.94Å
187	A	97.7	Very high	96.6	Very high	7 Å²	7	47.4 Å²	47.4	6%	0.058	23%	0.23	C	C	.	.	H	α-helix	trans	-63	-40.9	177.1	0	0	0	0	0	112.1	E183 C184 R191 D192 R195 V196 L199	E183-A187 PolarHBondContact O-N 3.46Å; C184-A187 PolarHBondContact O-N 2.84Å; A187-R191 PolarHBondContact O-N 2.79Å; A187-R191 VanDerWaalsContact O-N 3.1Å; A187-D192 PolarHBondContact O-N 3.36Å; A187-R195 HydrophobicContact CB-CB 4Å; A187-R195 HydrophobicContact CB-CG 3.8Å; A187-V196 VanDerWaalsContact C-CG2 3.43Å; A187-V196 HydrophobicContact CB-CG2 3.71Å; A187-L199 HydrophobicContact CB-CD1 4.06Å
188	V	96.6	Very high	96.6	Very high	5 Å²	5	50 Å²	50	3%	0.03	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-43.3	174.5	170.9	0	0	0	0	111	C184 A185 R186 R191 V196 L225 L229 F459	C184-V188 VanDerWaalsContact O-CG2 3.32Å; C184-V188 WeakPolarHBondContact O-CG2 3.34Å; C184-V188 PolarHBondContact O-N 2.89Å; A185-V188 PolarHBondContact O-N 3.33Å; R186-V188 VanDerWaalsContact C-N 3.35Å; R186-V188 PolarHBondContact O-N 3.18Å; V188-R191 PolarHBondContact O-N 2.95Å; V188-V196 HydrophobicContact CB-CG2 4.36Å; V188-V196 HydrophobicContact CG2-CG1 4.2Å; V188-V196 HydrophobicContact CG2-CG2 3.71Å; V188-L225 HydrophobicContact CG2-CD2 4.22Å; V188-L229 HydrophobicContact CG1-CD2 4.17Å; V188-L229 HydrophobicContact CG2-CD1 4.33Å; V188-L229 HydrophobicContact CG2-CD2 4.07Å; V188-L229 HydrophobicContact CG2-CG 4.4Å; V188-F459 HydrophobicContact CB-CE1 4.5Å; V188-F459 HydrophobicContact CG1-CE1 4.31Å; V188-F459 HydrophobicContact CG1-CZ 4.46Å
189	A	94.5	Very high	96.8	Very high	17 Å²	17	49.1 Å²	49.1	14%	0.14	24%	0.235	C	C	.	.	H	α-helix	trans	-68.5	-42.7	-178.8	0	0	0	0	0	112.3	A185 R186 R191 E456 F459 L460	A185-A189 WeakPolarHBondContact O-CB 3.4Å; A185-A189 PolarHBondContact O-N 2.99Å; R186-A189 PolarHBondContact O-N 3.3Å; A189-R191 PolarHBondContact O-N 2.74Å; A189-E456 HydrophobicContact CB-CB 4.03Å; A189-E456 HydrophobicContact CB-CG 3.58Å; A189-F459 HydrophobicContact CB-CD1 3.97Å; A189-F459 HydrophobicContact CB-CE1 4.42Å; A189-L460 HydrophobicContact CB-CD1 4.17Å; A189-L460 HydrophobicContact CB-CD2 4.12Å; A189-L460 HydrophobicContact CB-CG 4.02Å
190	A	94.6	Very high	96.9	Very high	64 Å²	64	45.3 Å²	45.3	53%	0.529	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-4	176.2	0	0	0	0	0	114	R186 D192	R186-A190 VanDerWaalsContact O-CB 3.3Å; R186-A190 WeakPolarHBondContact O-CB 3.47Å; R186-A190 PolarHBondContact O-N 2.83Å; A190-D192 VanDerWaalsContact C-N 3.25Å; A190-D192 PolarHBondContact O-N 3.24Å
191	R	93.2	Very high	96.9	Very high	148 Å²	148	50.3 Å²	50.3	56%	0.558	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	36.8	-175.4	-55.8	179.1	-179.8	-105.4	2.7	113.4	L139 F140 A187 V188 A189 S193	L139-R191 PolarHBondContact O-NH1 2.89Å; F140-R191 HydrophobicContact CE1-CB 4.1Å; F140-R191 WeakPolarHBondContact CE1-O 3.37Å; F140-R191 HydrophobicContact CZ-CB 4.22Å; A187-R191 PolarHBondContact O-N 2.79Å; A187-R191 VanDerWaalsContact O-N 3.1Å; V188-R191 PolarHBondContact O-N 2.95Å; A189-R191 PolarHBondContact O-N 2.74Å; R191-S193 PolarHBondContact O-N 3.29Å
192	D	96	Very high	96.8	Very high	74 Å²	74	52.9 Å²	52.9	40%	0.396	25%	0.249	S	C	.	.			trans	-84.6	86.9	175.1	-175.9	-17.3	0	0	0	109.6	A187 A190 Q194 R195 V196	A187-D192 PolarHBondContact O-N 3.36Å; A190-D192 VanDerWaalsContact C-N 3.25Å; A190-D192 PolarHBondContact O-N 3.24Å; D192-Q194 VanDerWaalsContact C-N 3.3Å; D192-Q194 PolarHBondContact O-N 2.72Å; D192-Q194 PolarHBondContact OD1-N 2.95Å; D192-R195 HydrophobicContact CB-CB 4.07Å; D192-R195 PolarHBondContact O-N 2.93Å; D192-R195 WeakPolarHBondContact OD1-CB 3.25Å; D192-R195 PolarHBondContact OD1-N 3.37Å; D192-R195 VanDerWaalsContact OD2-CB 3.29Å; D192-R195 WeakPolarHBondContact OD2-CB 3.41Å; D192-V196 WeakPolarHBondContact O-CB 3.35Å; D192-V196 VanDerWaalsContact O-CG2 3.25Å; D192-V196 WeakPolarHBondContact O-CG2 3.21Å; D192-V196 PolarHBondContact O-N 3.2Å
193	S	95.2	Very high	96.9	Very high	24 Å²	24	50.3 Å²	50.3	17%	0.168	24%	0.235	C	C	.	.	H	α-helix	trans	-60.2	-38.7	-172.9	68.1	0	0	0	0	113	F140 D144 R191 V196 Q197	F140-S193 VanDerWaalsContact CE1-CB 3.5Å; D144-S193 VanDerWaalsContact O-CB 3.23Å; D144-S193 WeakPolarHBondContact O-CB 3.45Å; D144-S193 PolarHBondContact O-OG 3.27Å; R191-S193 PolarHBondContact O-N 3.29Å; S193-V196 PolarHBondContact O-N 2.74Å; S193-Q197 WeakPolarHBondContact O-CB 3.46Å; S193-Q197 PolarHBondContact O-N 3.03Å
194	Q	96.6	Very high	96.8	Very high	126 Å²	126	51.5 Å²	51.5	59%	0.589	24%	0.244	S	C	*	.	H	α-helix	trans	-64.1	-47.6	178.7	-68.7	-170.1	-15	0	0	110.6	D192 Q197 Q198	D192-Q194 VanDerWaalsContact C-N 3.3Å; D192-Q194 PolarHBondContact O-N 2.72Å; D192-Q194 PolarHBondContact OD1-N 2.95Å; Q194-Q197 PolarHBondContact O-N 3.47Å; Q194-Q198 WeakPolarHBondContact O-CG 3.38Å; Q194-Q198 PolarHBondContact O-N 2.96Å; Q194-Q198 VanDerWaalsContact O-N 3.16Å
195	R	97.5	Very high	96.8	Very high	89 Å²	89	57.2 Å²	57.2	34%	0.336	27%	0.271	S	S	.	.	H	α-helix	trans	-68.3	-38.7	178.4	-171.4	60.3	176.8	170.7	0.8	111.7	E183 A187 D192 Q197 Q198 L199	E183-R195 IonicContact OE2-CZ 3.95Å; E183-R195 IonicContact OE2-NH2 2.86Å; E183-R195 PolarHBondContact OE2-NH2 2.89Å; A187-R195 HydrophobicContact CB-CB 4Å; A187-R195 HydrophobicContact CB-CG 3.8Å; D192-R195 HydrophobicContact CB-CB 4.07Å; D192-R195 PolarHBondContact O-N 2.93Å; D192-R195 WeakPolarHBondContact OD1-CB 3.25Å; D192-R195 PolarHBondContact OD1-N 3.37Å; D192-R195 VanDerWaalsContact OD2-CB 3.29Å; D192-R195 WeakPolarHBondContact OD2-CB 3.41Å; R195-Q197 PolarHBondContact O-N 3.4Å; R195-Q198 PolarHBondContact O-N 2.97Å; R195-L199 HydrophobicContact CG-CD1 3.68Å; R195-L199 HydrophobicContact CG-CG 4.23Å; R195-L199 WeakPolarHBondContact O-CB 3.43Å; R195-L199 WeakPolarHBondContact O-CG 3.21Å; R195-L199 PolarHBondContact O-N 2.97Å
196	V	97.7	Very high	96.8	Very high	3 Å²	3	60.7 Å²	60.7	2%	0.018	29%	0.289	C	S	.	.	H	α-helix	trans	-57.2	-49.2	173.6	169	0	0	0	0	110.5	F140 A187 V188 D192 S193 Q198 L199 M200 L229	F140-V196 HydrophobicContact CZ-CG2 4.34Å; A187-V196 VanDerWaalsContact C-CG2 3.43Å; A187-V196 HydrophobicContact CB-CG2 3.71Å; V188-V196 HydrophobicContact CB-CG2 4.36Å; V188-V196 HydrophobicContact CG2-CG1 4.2Å; V188-V196 HydrophobicContact CG2-CG2 3.71Å; D192-V196 WeakPolarHBondContact O-CB 3.35Å; D192-V196 VanDerWaalsContact O-CG2 3.25Å; D192-V196 WeakPolarHBondContact O-CG2 3.21Å; D192-V196 PolarHBondContact O-N 3.2Å; S193-V196 PolarHBondContact O-N 2.74Å; V196-Q198 VanDerWaalsContact C-N 3.35Å; V196-Q198 PolarHBondContact O-N 3.49Å; V196-L199 PolarHBondContact O-N 3.38Å; V196-M200 HydrophobicContact CG1-CG 3.86Å; V196-M200 WeakPolarHBondContact O-CB 3.25Å; V196-M200 WeakPolarHBondContact O-CG 3.33Å; V196-M200 PolarHBondContact O-N 3.35Å; V196-L229 HydrophobicContact CG1-CD1 3.74Å; V196-L229 HydrophobicContact CG1-CD2 4.22Å
197	Q	96.5	Very high	96.8	Very high	28 Å²	28	54.8 Å²	54.8	13%	0.131	27%	0.271	C	S	.	.	H	α-helix	trans	-59.3	-45.1	-179.5	-176.3	172.4	23	0	0	112.2	L145 S146 F147 S193 Q194 R195 W201	L145-Q197 PolarHBondContact O-NE2 3.21Å; L145-Q197 VanDerWaalsContact O-NE2 3.1Å; S146-Q197 PolarHBondContact O-OE1 3.45Å; F147-Q197 VanDerWaalsContact CE1-NE2 3.31Å; S193-Q197 WeakPolarHBondContact O-CB 3.46Å; S193-Q197 PolarHBondContact O-N 3.03Å; Q194-Q197 PolarHBondContact O-N 3.47Å; R195-Q197 PolarHBondContact O-N 3.4Å; Q197-W201 WeakPolarHBondContact O-CB 3.33Å; Q197-W201 PolarHBondContact O-N 3.04Å
198	Q	97.6	Very high	96.8	Very high	55 Å²	55	56 Å²	56	26%	0.257	28%	0.279	S	S	.	.	H	α-helix	trans	-60.2	-49.6	177	-71.2	176.6	0.3	0	0	112.4	L151 Q194 R195 V196 W201 M202	L151-Q198 HydrophobicContact CD2-CG 3.51Å; L151-Q198 VanDerWaalsContact CD2-NE2 3.3Å; Q194-Q198 WeakPolarHBondContact O-CG 3.38Å; Q194-Q198 PolarHBondContact O-N 2.96Å; Q194-Q198 VanDerWaalsContact O-N 3.16Å; R195-Q198 PolarHBondContact O-N 2.97Å; V196-Q198 VanDerWaalsContact C-N 3.35Å; V196-Q198 PolarHBondContact O-N 3.49Å; Q198-W201 PolarHBondContact O-N 3.32Å; Q198-M202 PolarHBondContact O-N 3.07Å
199	L	98	Very high	96.8	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-71.3	-39.7	-175.5	-65.2	172	0	0	0	111.8	L180 E183 C184 A187 R195 V196 M202 L203	L180-L199 HydrophobicContact CD1-CB 4.49Å; L180-L199 HydrophobicContact CD1-CD2 3.43Å; L180-L199 VanDerWaalsContact CD1-CD2 3.43Å; E183-L199 HydrophobicContact CB-CD1 4.04Å; E183-L199 HydrophobicContact CB-CD2 4.47Å; C184-L199 HydrophobicContact CB-CB 3.99Å; C184-L199 HydrophobicContact CB-CD1 4.17Å; A187-L199 HydrophobicContact CB-CD1 4.06Å; R195-L199 HydrophobicContact CG-CD1 3.68Å; R195-L199 HydrophobicContact CG-CG 4.23Å; R195-L199 WeakPolarHBondContact O-CB 3.43Å; R195-L199 WeakPolarHBondContact O-CG 3.21Å; R195-L199 PolarHBondContact O-N 2.97Å; V196-L199 PolarHBondContact O-N 3.38Å; L199-M202 HydrophobicContact CD2-CE 4.22Å; L199-M202 PolarHBondContact O-N 3.1Å; L199-L203 WeakPolarHBondContact O-CB 3.39Å; L199-L203 WeakPolarHBondContact O-CG 3.29Å; L199-L203 PolarHBondContact O-N 3.4Å
200	M	97.7	Very high	96.9	Very high	23 Å²	23	63.8 Å²	63.8	11%	0.113	31%	0.31	C	S	.	.	H	α-helix	trans	-63	-41.3	175	-70.8	-69.6	-68	0	0	111.5	V196 N204 L222 L225 F226 L229	V196-M200 HydrophobicContact CG1-CG 3.86Å; V196-M200 WeakPolarHBondContact O-CB 3.25Å; V196-M200 WeakPolarHBondContact O-CG 3.33Å; V196-M200 PolarHBondContact O-N 3.35Å; M200-N204 WeakPolarHBondContact O-CB 3.48Å; M200-N204 PolarHBondContact O-N 2.96Å; M200-L222 HydrophobicContact CE-CD1 3.34Å; M200-L222 HydrophobicContact CE-CG 4.5Å; M200-L222 HydrophobicContact SD-CD1 3.54Å; M200-L222 VanDerWaalsContact SD-CD1 3.54Å; M200-L225 HydrophobicContact CE-CB 4.4Å; M200-L225 HydrophobicContact SD-CB 4.01Å; M200-L225 HydrophobicContact SD-CD1 4.47Å; M200-F226 HydrophobicContact CE-CB 3.9Å; M200-F226 HydrophobicContact CE-CD2 4.16Å; M200-L229 HydrophobicContact CE-CD1 4.01Å; M200-L229 HydrophobicContact CG-CD1 4.26Å; M200-L229 HydrophobicContact SD-CD1 4.15Å
201	W	97.7	Very high	96.9	Very high	118 Å²	118	61.7 Å²	61.7	45%	0.447	30%	0.295	S	S	.	.	H	α-helix	trans	-61.3	-50.2	173.9	174.1	77.5	0	0	0	111.1	L153 Q197 Q198 L203 N204 E205	L153-W201 HydrophobicContact CD1-CZ3 4.12Å; Q197-W201 WeakPolarHBondContact O-CB 3.33Å; Q197-W201 PolarHBondContact O-N 3.04Å; Q198-W201 PolarHBondContact O-N 3.32Å; W201-L203 VanDerWaalsContact C-N 3.35Å; W201-L203 PolarHBondContact O-N 2.87Å; W201-N204 WeakPolarHBondContact O-CB 3.43Å; W201-N204 PolarHBondContact O-N 3Å; W201-N204 VanDerWaalsContact O-N 3.08Å; W201-E205 HydrophobicContact CD2-CG 4.31Å; W201-E205 HydrophobicContact CH2-CG 4.43Å; W201-E205 HydrophobicContact CZ2-CG 3.89Å; W201-E205 PolarHBondContact O-N 3.06Å; W201-E205 VanDerWaalsContact O-N 3.07Å
202	M	97.7	Very high	97.1	Very high	53 Å²	53	58.6 Å²	58.6	26%	0.261	29%	0.289	S	S	.	.	H	α-helix	trans	-62.4	-41.2	-179.7	-172.9	163.2	67.3	0	0	112.4	L180 Q198 L199 N204 E205 L206	L180-M202 HydrophobicContact CD1-CE 3.19Å; L180-M202 HydrophobicContact CD2-CE 3.75Å; L180-M202 HydrophobicContact CD2-CG 4.13Å; L180-M202 HydrophobicContact CG-CE 4.1Å; Q198-M202 PolarHBondContact O-N 3.07Å; L199-M202 HydrophobicContact CD2-CE 4.22Å; L199-M202 PolarHBondContact O-N 3.1Å; M202-N204 VanDerWaalsContact C-N 3.31Å; M202-N204 PolarHBondContact O-N 3.37Å; M202-E205 PolarHBondContact O-N 3.12Å; M202-L206 HydrophobicContact CG-CD1 4.02Å; M202-L206 WeakPolarHBondContact O-CG 3.46Å; M202-L206 PolarHBondContact O-N 2.78Å
203	L	97.8	Very high	97.1	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.6	-43.1	173	-79.9	165.1	0	0	0	111.4	L180 L181 C184 L199 W201 E205 L206 A207 A218 L222	L180-L203 HydrophobicContact CB-CD2 4.33Å; L180-L203 HydrophobicContact CD2-CD2 3.57Å; L180-L203 HydrophobicContact CD2-CG 3.71Å; L180-L203 HydrophobicContact CG-CD1 4.43Å; L180-L203 HydrophobicContact CG-CD2 3.67Å; L180-L203 HydrophobicContact CG-CG 3.76Å; L181-L203 HydrophobicContact CD2-CD1 3.91Å; L181-L203 HydrophobicContact CD2-CD2 3.71Å; L181-L203 HydrophobicContact CD2-CG 4.5Å; L181-L203 HydrophobicContact CG-CD2 4.13Å; C184-L203 HydrophobicContact CB-CD1 3.94Å; L199-L203 WeakPolarHBondContact O-CB 3.39Å; L199-L203 WeakPolarHBondContact O-CG 3.29Å; L199-L203 PolarHBondContact O-N 3.4Å; W201-L203 VanDerWaalsContact C-N 3.35Å; W201-L203 PolarHBondContact O-N 2.87Å; L203-E205 VanDerWaalsContact C-N 3.31Å; L203-E205 PolarHBondContact O-N 3.47Å; L203-L206 PolarHBondContact O-N 3.27Å; L203-A207 WeakPolarHBondContact O-CB 3.37Å; L203-A207 PolarHBondContact O-N 3.43Å; L203-A218 HydrophobicContact CD2-CB 4.01Å; L203-L222 HydrophobicContact CB-CD1 3.89Å; L203-L222 HydrophobicContact CB-CD2 4.2Å; L203-L222 HydrophobicContact CB-CG 4.47Å; L203-L222 HydrophobicContact CD1-CD1 4.32Å
204	N	97.1	Very high	97.2	Very high	101 Å²	101	56.4 Å²	56.4	54%	0.54	28%	0.276	S	S	.	.	H	α-helix	trans	-63.1	-36	179.7	-173.3	77.9	0	0	0	112.7	M200 W201 M202 L222	M200-N204 WeakPolarHBondContact O-CB 3.48Å; M200-N204 PolarHBondContact O-N 2.96Å; W201-N204 WeakPolarHBondContact O-CB 3.43Å; W201-N204 PolarHBondContact O-N 3Å; W201-N204 VanDerWaalsContact O-N 3.08Å; M202-N204 VanDerWaalsContact C-N 3.31Å; M202-N204 PolarHBondContact O-N 3.37Å; N204-L222 HydrophobicContact CB-CD2 4.02Å
205	E	97.9	Very high	97.2	Very high	121 Å²	121	53.2 Å²	53.2	57%	0.565	26%	0.261	S	S	*	.	H	α-helix	trans	-72	-29.8	177.3	-64.7	-55.9	118	0	0	113.2	W201 M202 L203	W201-E205 HydrophobicContact CD2-CG 4.31Å; W201-E205 HydrophobicContact CH2-CG 4.43Å; W201-E205 HydrophobicContact CZ2-CG 3.89Å; W201-E205 PolarHBondContact O-N 3.06Å; W201-E205 VanDerWaalsContact O-N 3.07Å; M202-E205 PolarHBondContact O-N 3.12Å; L203-E205 VanDerWaalsContact C-N 3.31Å; L203-E205 PolarHBondContact O-N 3.47Å
206	L	97.4	Very high	97.3	Very high	72 Å²	72	49.1 Å²	49.1	38%	0.377	25%	0.246	S	C	.	.	H	α-helix	trans	-95.5	-30.8	-175.8	-62.9	173.6	0	0	0	113.4	W176 L180 M202 L203 Q215	W176-L206 HydrophobicContact CE3-CD1 3.95Å; W176-L206 HydrophobicContact CH2-CB 3.55Å; W176-L206 HydrophobicContact CH2-CD1 4.32Å; W176-L206 HydrophobicContact CZ2-CB 4.36Å; W176-L206 HydrophobicContact CZ3-CB 3.72Å; W176-L206 HydrophobicContact CZ3-CD1 3.7Å; W176-L206 HydrophobicContact CZ3-CG 4.37Å; L180-L206 HydrophobicContact CD2-CD1 4.16Å; M202-L206 HydrophobicContact CG-CD1 4.02Å; M202-L206 WeakPolarHBondContact O-CG 3.46Å; M202-L206 PolarHBondContact O-N 2.78Å; L203-L206 PolarHBondContact O-N 3.27Å; L206-Q215 PolarHBondContact O-NE2 3.38Å; L206-Q215 VanDerWaalsContact O-NE2 3.13Å
207	A	97.7	Very high	97.3	Very high	22 Å²	22	49 Å²	49	18%	0.182	25%	0.245	C	C	.	.			trans	-71	142.4	-171.9	0	0	0	0	0	112.9	L203 A218 L222	L203-A207 WeakPolarHBondContact O-CB 3.37Å; L203-A207 PolarHBondContact O-N 3.43Å; A207-A218 HydrophobicContact CB-CB 3.85Å; A207-L222 HydrophobicContact CB-CD2 4.3Å
208	S	97.7	Very high	97.4	Very high	32 Å²	32	47.6 Å²	47.6	22%	0.224	24%	0.238	C	C	.	.			trans	-154.4	128.3	170.4	175.5	0	0	0	0	110.1	Y210 G211 Q215 K216	S208-Y210 PolarHBondContact O-N 3.37Å; S208-Y210 VanDerWaalsContact O-N 3.15Å; S208-Y210 PolarHBondContact OG-N 2.96Å; S208-G211 PolarHBondContact O-N 3.45Å; S208-G211 PolarHBondContact OG-N 3.44Å; S208-Q215 PolarHBondContact N-O 2.97Å; S208-Q215 VanDerWaalsContact N-O 3.1Å; S208-Q215 CarbonylContact O-C 2.98Å; S208-Q215 VanDerWaalsContact O-O 3.14Å; S208-K216 WeakPolarHBondContact O-CA 3Å; S208-K216 PolarHBondContact O-N 3.43Å
209	P	96.2	Very high	97.4	Very high	36 Å²	36	46 Å²	46	23%	0.234	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-6.4	175.8	31.5	-35.1	0	0	0	112.7	S219	P209-S219 WeakPolarHBondContact CD-OG 3.47Å
210	Y	96.9	Very high	97.5	Very high	150 Å²	150	46.5 Å²	46.5	59%	0.588	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.6	4.4	-178.7	-49.2	-59.7	0	0	0	112.9	S208 L489	S208-Y210 PolarHBondContact O-N 3.37Å; S208-Y210 VanDerWaalsContact O-N 3.15Å; S208-Y210 PolarHBondContact OG-N 2.96Å; Y210-L489 HydrophobicContact CD1-CD1 4.5Å; Y210-L489 HydrophobicContact CE1-CD1 4.24Å
211	G	95.8	Very high	97.5	Very high	20 Å²	20	45.6 Å²	45.6	21%	0.206	23%	0.23	C	C	.	.	S	Bend	trans	-83.6	-153.8	-178.8	0	0	0	0	0	113.6	S208 K216	S208-G211 PolarHBondContact O-N 3.45Å; S208-G211 PolarHBondContact OG-N 3.44Å; G211-K216 WeakPolarHBondContact O-CE 3.45Å
212	D	95.5	Very high	97.5	Very high	82 Å²	82	40.9 Å²	40.9	44%	0.439	21%	0.214	S	C	.	.			trans	-73.4	-179.8	168.1	66.1	35.4	0	0	0	112.5	E214 Q215 K216	D212-E214 VanDerWaalsContact C-N 3.3Å; D212-E214 PolarHBondContact O-N 2.94Å; D212-E214 WeakPolarHBondContact OD1-CB 3.48Å; D212-E214 PolarHBondContact OD1-N 3.07Å; D212-Q215 PolarHBondContact O-N 3.29Å; D212-Q215 WeakPolarHBondContact OD1-CG 3.28Å; D212-Q215 PolarHBondContact OD1-N 2.87Å; D212-K216 WeakPolarHBondContact O-CB 3.27Å; D212-K216 VanDerWaalsContact O-CG 3.27Å; D212-K216 WeakPolarHBondContact O-CG 3.37Å; D212-K216 PolarHBondContact O-N 3.03Å
213	V	96.6	Very high	97.6	Very high	26 Å²	26	40.3 Å²	40.3	16%	0.158	21%	0.211	C	C	.	.	H	α-helix	trans	-57.9	-41.2	-178.6	174.8	0	0	0	0	111.9	K216 L217 M474 E478	V213-K216 PolarHBondContact O-N 2.91Å; V213-L217 HydrophobicContact CG1-CD1 3.84Å; V213-L217 HydrophobicContact CG1-CG 4.36Å; V213-L217 WeakPolarHBondContact O-CB 2.89Å; V213-L217 VanDerWaalsContact O-CG 3.23Å; V213-L217 WeakPolarHBondContact O-CG 3.2Å; V213-L217 PolarHBondContact O-N 3.27Å; V213-M474 HydrophobicContact CG1-CB 4.04Å; V213-E478 HydrophobicContact CG2-CB 3.67Å; V213-E478 HydrophobicContact CG2-CG 3.79Å
214	E	97.3	Very high	97.6	Very high	26 Å²	26	40.3 Å²	40.3	12%	0.121	21%	0.211	C	C	.	.	H	α-helix	trans	-68.3	-42.8	-179.1	-65.3	-70.1	111.8	0	0	110.8	R175 W176 A177 D212 K216 L217 A218	R175-E214 WeakPolarHBondContact CA-OE2 3.41Å; W176-E214 HydrophobicContact CD2-CB 4.45Å; W176-E214 HydrophobicContact CZ2-CB 3.76Å; W176-E214 PolarHBondContact N-OE2 3.38Å; A177-E214 HydrophobicContact CB-CB 3.92Å; A177-E214 VanDerWaalsContact CB-O 3.28Å; A177-E214 WeakPolarHBondContact CB-O 3.47Å; A177-E214 VanDerWaalsContact CB-OE2 3.24Å; A177-E214 WeakPolarHBondContact CB-OE2 3.49Å; A177-E214 PolarHBondContact N-OE2 3.3Å; D212-E214 VanDerWaalsContact C-N 3.3Å; D212-E214 PolarHBondContact O-N 2.94Å; D212-E214 WeakPolarHBondContact OD1-CB 3.48Å; D212-E214 PolarHBondContact OD1-N 3.07Å; E214-K216 PolarHBondContact O-N 3.4Å; E214-L217 PolarHBondContact O-N 2.91Å; E214-A218 WeakPolarHBondContact O-CB 3.47Å; E214-A218 PolarHBondContact O-N 3.07Å
215	Q	98	Very high	97.6	Very high	60 Å²	60	35.5 Å²	35.5	28%	0.28	19%	0.185	S	C	.	.	H	α-helix	trans	-63.4	-39.8	176.1	-66.4	-172.2	-72.8	0	0	112.5	W176 L206 S208 D212 S219	W176-Q215 HydrophobicContact CZ2-CG 4.04Å; L206-Q215 PolarHBondContact O-NE2 3.38Å; L206-Q215 VanDerWaalsContact O-NE2 3.13Å; S208-Q215 PolarHBondContact N-O 2.97Å; S208-Q215 VanDerWaalsContact N-O 3.1Å; S208-Q215 CarbonylContact O-C 2.98Å; S208-Q215 VanDerWaalsContact O-O 3.14Å; D212-Q215 PolarHBondContact O-N 3.29Å; D212-Q215 WeakPolarHBondContact OD1-CG 3.28Å; D212-Q215 PolarHBondContact OD1-N 2.87Å; Q215-S219 WeakPolarHBondContact O-CB 3.35Å; Q215-S219 PolarHBondContact O-N 2.87Å
216	K	98	Very high	97.6	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.009	18%	0.184	C	C	.	.	H	α-helix	trans	-65.2	-47.9	176.3	-73	168.8	-179.1	176.3	0	111.1	S208 G211 D212 V213 E214 S219 Y220 E478 R488 E492	S208-K216 WeakPolarHBondContact O-CA 3Å; S208-K216 PolarHBondContact O-N 3.43Å; G211-K216 WeakPolarHBondContact O-CE 3.45Å; D212-K216 WeakPolarHBondContact O-CB 3.27Å; D212-K216 VanDerWaalsContact O-CG 3.27Å; D212-K216 WeakPolarHBondContact O-CG 3.37Å; D212-K216 PolarHBondContact O-N 3.03Å; V213-K216 PolarHBondContact O-N 2.91Å; E214-K216 PolarHBondContact O-N 3.4Å; K216-S219 PolarHBondContact O-N 2.98Å; K216-Y220 HydrophobicContact CB-CE2 4.35Å; K216-Y220 WeakPolarHBondContact O-CD2 3.37Å; K216-Y220 PolarHBondContact O-N 3.48Å; K216-E478 IonicContact NZ-OE2 3.7Å; K216-E478 PolarHBondContact NZ-OE2 3.47Å; K216-R488 VanDerWaalsContact NZ-NH2 3.2Å; K216-E492 WeakPolarHBondContact CE-OE1 3.45Å; K216-E492 IonicContact NZ-OE1 2.97Å; K216-E492 PolarHBondContact NZ-OE1 3.02Å; K216-E492 IonicContact NZ-OE2 3.9Å
217	L	98.2	Very high	97.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-58.3	-49.7	176.3	-73	167.8	0	0	0	110.6	V213 E214 S219 Y220 F221 F470 S471 M474	V213-L217 HydrophobicContact CG1-CD1 3.84Å; V213-L217 HydrophobicContact CG1-CG 4.36Å; V213-L217 WeakPolarHBondContact O-CB 2.89Å; V213-L217 VanDerWaalsContact O-CG 3.23Å; V213-L217 WeakPolarHBondContact O-CG 3.2Å; V213-L217 PolarHBondContact O-N 3.27Å; E214-L217 PolarHBondContact O-N 2.91Å; L217-S219 VanDerWaalsContact C-N 3.29Å; L217-S219 PolarHBondContact O-N 3.05Å; L217-Y220 PolarHBondContact O-N 3.29Å; L217-F221 HydrophobicContact CD2-CE2 4.27Å; L217-F221 WeakPolarHBondContact O-CB 3.34Å; L217-F221 WeakPolarHBondContact O-CD2 3.42Å; L217-F221 PolarHBondContact O-N 2.93Å; L217-F470 HydrophobicContact CD2-CB 4.38Å; L217-S471 WeakPolarHBondContact CD1-OG 3.44Å; L217-M474 HydrophobicContact CD2-CB 4.48Å; L217-M474 HydrophobicContact CD2-CG 4Å
218	A	98.5	Very high	97.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-54.4	-45.9	175.5	0	0	0	0	0	111.5	W176 A177 L203 A207 E214 L222	W176-A218 HydrophobicContact CH2-CB 3.64Å; W176-A218 HydrophobicContact CZ3-CB 4.01Å; A177-A218 HydrophobicContact CB-CB 4.24Å; L203-A218 HydrophobicContact CD2-CB 4.01Å; A207-A218 HydrophobicContact CB-CB 3.85Å; E214-A218 WeakPolarHBondContact O-CB 3.47Å; E214-A218 PolarHBondContact O-N 3.07Å; A218-L222 WeakPolarHBondContact O-CB 3.43Å; A218-L222 PolarHBondContact O-N 3.23Å
219	S	98.5	Very high	97.5	Very high	21 Å²	21	32.6 Å²	32.6	15%	0.147	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-50.9	-179.6	-180	0	0	0	0	113.4	P209 Q215 K216 L217 L222 Q223	P209-S219 WeakPolarHBondContact CD-OG 3.47Å; Q215-S219 WeakPolarHBondContact O-CB 3.35Å; Q215-S219 PolarHBondContact O-N 2.87Å; K216-S219 PolarHBondContact O-N 2.98Å; L217-S219 VanDerWaalsContact C-N 3.29Å; L217-S219 PolarHBondContact O-N 3.05Å; S219-L222 PolarHBondContact O-N 2.94Å; S219-Q223 PolarHBondContact O-N 3.24Å
220	Y	98.4	Very high	97.4	Very high	12 Å²	12	34.2 Å²	34.2	5%	0.047	17%	0.169	C	C	.	.	H	α-helix	trans	-69.9	-39	-176.4	-68.2	-60	0	0	0	112.5	K216 L217 Q223 G224 M474 E492 G496	K216-Y220 HydrophobicContact CB-CE2 4.35Å; K216-Y220 WeakPolarHBondContact O-CD2 3.37Å; K216-Y220 PolarHBondContact O-N 3.48Å; L217-Y220 PolarHBondContact O-N 3.29Å; Y220-Q223 PolarHBondContact O-N 3.29Å; Y220-G224 PolarHBondContact O-N 3.42Å; Y220-G224 VanDerWaalsContact O-N 3.13Å; Y220-M474 HydrophobicContact CD2-CE 3.64Å; Y220-M474 HydrophobicContact CE2-CE 3.64Å; Y220-E492 HydrophobicContact CE2-CB 4.33Å; Y220-G496 VanDerWaalsContact CD1-CA 3.43Å
221	F	98.7	Very high	97.4	Very high	3 Å²	3	30.2 Å²	30.2	1%	0.013	17%	0.167	C	C	.	.	H	α-helix	trans	-71.8	-36.6	175.8	-82.4	-93.1	0	0	0	112.3	L181 L217 Q223 G224 L225 F463 L467 F470 I499 V503	L181-F221 HydrophobicContact CD1-CB 3.73Å; L181-F221 HydrophobicContact CD1-CD2 4.1Å; L181-F221 HydrophobicContact CD1-CG 3.96Å; L181-F221 HydrophobicContact CD2-CB 3.5Å; L181-F221 HydrophobicContact CD2-CG 4.48Å; L181-F221 HydrophobicContact CG-CB 4.22Å; L217-F221 HydrophobicContact CD2-CE2 4.27Å; L217-F221 WeakPolarHBondContact O-CB 3.34Å; L217-F221 WeakPolarHBondContact O-CD2 3.42Å; L217-F221 PolarHBondContact O-N 2.93Å; F221-Q223 VanDerWaalsContact C-N 3.29Å; F221-Q223 PolarHBondContact O-N 3.12Å; F221-G224 PolarHBondContact O-N 3.15Å; F221-G224 VanDerWaalsContact O-N 3.17Å; F221-L225 WeakPolarHBondContact O-CG 3.37Å; F221-L225 PolarHBondContact O-N 3.49Å; F221-F463 HydrophobicContact CB-CZ 4.47Å; F221-F463 HydrophobicContact CD1-CD2 4.32Å; F221-F463 HydrophobicContact CD1-CE1 4.26Å; F221-F463 AromaticContact CD1-CE2 3.64Å; F221-F463 HydrophobicContact CD1-CE2 3.64Å; F221-F463 AromaticContact CD1-CZ 3.61Å; F221-F463 HydrophobicContact CD1-CZ 3.61Å; F221-F463 HydrophobicContact CE1-CE2 4.29Å; F221-F463 HydrophobicContact CE1-CZ 4.31Å; F221-F463 HydrophobicContact CG-CZ 4.4Å; F221-L467 HydrophobicContact CD2-CD1 4.29Å; F221-L467 HydrophobicContact CE1-CB 4.16Å; F221-L467 HydrophobicContact CE2-CD1 3.99Å; F221-L467 VanDerWaalsContact CZ-CA 3.45Å; F221-L467 HydrophobicContact CZ-CB 3.97Å; F221-L467 HydrophobicContact CZ-CD1 4.21Å; F221-F470 HydrophobicContact CE2-CB 4.25Å; F221-F470 HydrophobicContact CZ-CB 4.49Å; F221-F470 HydrophobicContact CZ-CD2 4.2Å; F221-I499 HydrophobicContact CB-CG2 4.48Å; F221-I499 HydrophobicContact CD1-CG2 3.89Å; F221-I499 HydrophobicContact CD2-CD1 3.96Å; F221-I499 HydrophobicContact CD2-CG1 4.49Å; F221-I499 HydrophobicContact CD2-CG2 4.05Å; F221-I499 HydrophobicContact CE1-CG2 4.05Å; F221-I499 HydrophobicContact CE2-CD1 3.59Å; F221-I499 HydrophobicContact CE2-CG1 3.97Å; F221-I499 HydrophobicContact CE2-CG2 4.19Å; F221-I499 HydrophobicContact CG-CG2 3.89Å; F221-I499 HydrophobicContact CZ-CD1 4.21Å; F221-I499 HydrophobicContact CZ-CG1 4.06Å; F221-I499 HydrophobicContact CZ-CG2 4.17Å; F221-V503 HydrophobicContact CD1-CG2 4.22Å; F221-V503 HydrophobicContact CE1-CG2 4.33Å
222	L	98.4	Very high	97.4	Very high	20 Å²	20	30.5 Å²	30.5	11%	0.105	17%	0.166	C	C	.	.	H	α-helix	trans	-57.8	-44	172.1	176.2	64.3	0	0	0	110.9	M200 L203 N204 A207 A218 S219 G224 L225 F226	M200-L222 HydrophobicContact CE-CD1 3.34Å; M200-L222 HydrophobicContact CE-CG 4.5Å; M200-L222 HydrophobicContact SD-CD1 3.54Å; M200-L222 VanDerWaalsContact SD-CD1 3.54Å; L203-L222 HydrophobicContact CB-CD1 3.89Å; L203-L222 HydrophobicContact CB-CD2 4.2Å; L203-L222 HydrophobicContact CB-CG 4.47Å; L203-L222 HydrophobicContact CD1-CD1 4.32Å; N204-L222 HydrophobicContact CB-CD2 4.02Å; A207-L222 HydrophobicContact CB-CD2 4.3Å; A218-L222 WeakPolarHBondContact O-CB 3.43Å; A218-L222 PolarHBondContact O-N 3.23Å; S219-L222 PolarHBondContact O-N 2.94Å; L222-G224 VanDerWaalsContact C-N 3.34Å; L222-G224 PolarHBondContact O-N 3.47Å; L222-L225 PolarHBondContact O-N 3.07Å; L222-F226 WeakPolarHBondContact O-CB 3.49Å; L222-F226 PolarHBondContact O-N 2.86Å
223	Q	98.3	Very high	97.4	Very high	41 Å²	41	26.6 Å²	26.6	19%	0.192	15%	0.146	C	C	.	.	H	α-helix	trans	-61.5	-41.8	175.7	-175	174.5	3	0	0	112.2	S219 Y220 F221 A227 V500	S219-Q223 PolarHBondContact O-N 3.24Å; Y220-Q223 PolarHBondContact O-N 3.29Å; F221-Q223 VanDerWaalsContact C-N 3.29Å; F221-Q223 PolarHBondContact O-N 3.12Å; Q223-A227 VanDerWaalsContact O-CB 3.32Å; Q223-A227 WeakPolarHBondContact O-CB 3.36Å; Q223-A227 PolarHBondContact O-N 2.96Å; Q223-V500 HydrophobicContact CG-CG2 4.09Å
224	G	98.1	Very high	97.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62	-47.5	173.7	0	0	0	0	0	112.7	Y220 F221 L222 A227 R228 V503 S504	Y220-G224 PolarHBondContact O-N 3.42Å; Y220-G224 VanDerWaalsContact O-N 3.13Å; F221-G224 PolarHBondContact O-N 3.15Å; F221-G224 VanDerWaalsContact O-N 3.17Å; L222-G224 VanDerWaalsContact C-N 3.34Å; L222-G224 PolarHBondContact O-N 3.47Å; G224-A227 PolarHBondContact O-N 3.19Å; G224-R228 PolarHBondContact O-N 3.44Å; G224-V503 VanDerWaalsContact C-CG1 3.45Å; G224-S504 WeakPolarHBondContact O-CB 3.5Å
225	L	98.1	Very high	97.1	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.6	-44.8	178.6	-73.6	167.8	0	0	0	111.6	L181 C184 V188 M200 F221 L222 A227 R228 L229 F459 F463 V503	L181-L225 HydrophobicContact CD2-CD1 4.36Å; C184-L225 HydrophobicContact CB-CD1 4.17Å; V188-L225 HydrophobicContact CG2-CD2 4.22Å; M200-L225 HydrophobicContact CE-CB 4.4Å; M200-L225 HydrophobicContact SD-CB 4.01Å; M200-L225 HydrophobicContact SD-CD1 4.47Å; F221-L225 WeakPolarHBondContact O-CG 3.37Å; F221-L225 PolarHBondContact O-N 3.49Å; L222-L225 PolarHBondContact O-N 3.07Å; L225-A227 PolarHBondContact O-N 3.2Å; L225-R228 WeakPolarHBondContact O-CB 3.38Å; L225-R228 PolarHBondContact O-N 3.28Å; L225-L229 WeakPolarHBondContact O-CB 3.44Å; L225-L229 VanDerWaalsContact O-CG 3.3Å; L225-L229 WeakPolarHBondContact O-CG 3.44Å; L225-L229 PolarHBondContact O-N 2.88Å; L225-F459 HydrophobicContact CD2-CZ 4.04Å; L225-F463 HydrophobicContact CD1-CE2 4.05Å; L225-F463 HydrophobicContact CD1-CZ 4.11Å; L225-F463 HydrophobicContact CD2-CD2 4.35Å; L225-F463 HydrophobicContact CD2-CE2 3.7Å; L225-F463 HydrophobicContact CD2-CZ 4.45Å; L225-F463 HydrophobicContact CG-CE2 3.89Å; L225-F463 HydrophobicContact CG-CZ 4.45Å; L225-V503 HydrophobicContact CD2-CG1 4.13Å; L225-V503 HydrophobicContact CG-CG1 4.29Å
226	F	97.7	Very high	97	Very high	123 Å²	123	31.5 Å²	31.5	54%	0.539	17%	0.174	S	C	.	.	H	α-helix	trans	-61.1	-44.8	176.5	-174.1	-94.9	0	0	0	111.8	M200 L222 R228 L229 T230	M200-F226 HydrophobicContact CE-CB 3.9Å; M200-F226 HydrophobicContact CE-CD2 4.16Å; L222-F226 WeakPolarHBondContact O-CB 3.49Å; L222-F226 PolarHBondContact O-N 2.86Å; F226-R228 VanDerWaalsContact C-N 3.27Å; F226-R228 PolarHBondContact O-N 3.47Å; F226-L229 PolarHBondContact O-N 2.89Å; F226-T230 HydrophobicContact CD1-CG2 4.31Å; F226-T230 HydrophobicContact CE1-CG2 3.88Å; F226-T230 HydrophobicContact CE2-CG2 4.19Å; F226-T230 HydrophobicContact CZ-CG2 3.82Å; F226-T230 WeakPolarHBondContact O-CG2 3.39Å; F226-T230 PolarHBondContact O-N 3.03Å; F226-T230 PolarHBondContact O-OG1 3.23Å
227	A	97.6	Very high	96.8	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-64.4	-31.8	177	0	0	0	0	0	112.5	Q223 G224 L225 A231 S232 G233 T236	Q223-A227 VanDerWaalsContact O-CB 3.32Å; Q223-A227 WeakPolarHBondContact O-CB 3.36Å; Q223-A227 PolarHBondContact O-N 2.96Å; G224-A227 PolarHBondContact O-N 3.19Å; L225-A227 PolarHBondContact O-N 3.2Å; A227-A231 PolarHBondContact O-N 3.11Å; A227-S232 PolarHBondContact O-N 3.16Å; A227-G233 PolarHBondContact O-N 2.88Å; A227-T236 HydrophobicContact CB-CG2 4.36Å
228	R	96.4	Very high	96.5	Very high	32 Å²	32	38.9 Å²	38.9	12%	0.121	20%	0.204	C	C	.	.	H	α-helix	trans	-68	-51.1	172.7	-173.2	-175.2	-178.6	76.8	5.2	111	L139 G224 L225 F226 T230 A231 D454 V503	L139-R228 HydrophobicContact CD1-CG 4.05Å; G224-R228 PolarHBondContact O-N 3.44Å; L225-R228 WeakPolarHBondContact O-CB 3.38Å; L225-R228 PolarHBondContact O-N 3.28Å; F226-R228 VanDerWaalsContact C-N 3.27Å; F226-R228 PolarHBondContact O-N 3.47Å; R228-T230 VanDerWaalsContact C-N 3.25Å; R228-T230 PolarHBondContact O-N 3.12Å; R228-A231 PolarHBondContact O-N 3.04Å; R228-A231 VanDerWaalsContact O-N 3.08Å; R228-D454 IonicContact CZ-OD1 3.17Å; R228-D454 IonicContact CZ-OD2 2.68Å; R228-D454 IonicContact NH1-OD1 3.76Å; R228-D454 PolarHBondContact NH1-OD1 2.87Å; R228-D454 IonicContact NH1-OD2 2.68Å; R228-D454 IonicContact NH2-OD1 3.37Å; R228-D454 PolarHBondContact NH2-OD1 3.39Å; R228-D454 IonicContact NH2-OD2 3.69Å; R228-D454 PolarHBondContact NH2-OD2 2.99Å; R228-V503 VanDerWaalsContact CD-O 3.32Å; R228-V503 WeakPolarHBondContact CD-O 3.37Å; R228-V503 PolarHBondContact NH1-O 2.89Å; R228-V503 VanDerWaalsContact NH1-O 3.09Å
229	L	95.8	Very high	96.3	Very high	29 Å²	29	43 Å²	43	15%	0.152	23%	0.23	C	C	.	.	H	α-helix	trans	-59.7	-35.3	-178.3	-72.9	168.6	0	0	0	112.9	F140 V188 V196 M200 L225 F226	F140-L229 HydrophobicContact CD2-CD2 3.74Å; F140-L229 HydrophobicContact CE2-CD2 3.45Å; F140-L229 VanDerWaalsContact CE2-CD2 3.45Å; V188-L229 HydrophobicContact CG1-CD2 4.17Å; V188-L229 HydrophobicContact CG2-CD1 4.33Å; V188-L229 HydrophobicContact CG2-CD2 4.07Å; V188-L229 HydrophobicContact CG2-CG 4.4Å; V196-L229 HydrophobicContact CG1-CD1 3.74Å; V196-L229 HydrophobicContact CG1-CD2 4.22Å; M200-L229 HydrophobicContact CE-CD1 4.01Å; M200-L229 HydrophobicContact CG-CD1 4.26Å; M200-L229 HydrophobicContact SD-CD1 4.15Å; L225-L229 WeakPolarHBondContact O-CB 3.44Å; L225-L229 VanDerWaalsContact O-CG 3.3Å; L225-L229 WeakPolarHBondContact O-CG 3.44Å; L225-L229 PolarHBondContact O-N 2.88Å; F226-L229 PolarHBondContact O-N 2.89Å
230	T	95.7	Very high	96.1	Very high	70 Å²	70	43.5 Å²	43.5	43%	0.429	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	4.8	179.4	56.6	0	0	0	0	113.9	F226 R228 S232	F226-T230 HydrophobicContact CD1-CG2 4.31Å; F226-T230 HydrophobicContact CE1-CG2 3.88Å; F226-T230 HydrophobicContact CE2-CG2 4.19Å; F226-T230 HydrophobicContact CZ-CG2 3.82Å; F226-T230 WeakPolarHBondContact O-CG2 3.39Å; F226-T230 PolarHBondContact O-N 3.03Å; F226-T230 PolarHBondContact O-OG1 3.23Å; R228-T230 VanDerWaalsContact C-N 3.25Å; R228-T230 PolarHBondContact O-N 3.12Å; T230-S232 PolarHBondContact O-N 2.88Å; T230-S232 VanDerWaalsContact O-N 3.12Å; T230-S232 PolarHBondContact OG1-OG 2.83Å
231	A	94.9	Very high	95.7	Very high	66 Å²	66	44.4 Å²	44.4	55%	0.545	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	29.8	-174.7	0	0	0	0	0	113.9	A227 R228	A227-A231 PolarHBondContact O-N 3.11Å; R228-A231 PolarHBondContact O-N 3.04Å; R228-A231 VanDerWaalsContact O-N 3.08Å
232	S	96.3	Very high	95.3	Very high	27 Å²	27	45.8 Å²	45.8	19%	0.189	25%	0.253	C	S	.	.			trans	-101.2	1.5	-175	86	0	0	0	0	113.9	A227 T230 Q235 T236	A227-S232 PolarHBondContact O-N 3.16Å; T230-S232 PolarHBondContact O-N 2.88Å; T230-S232 VanDerWaalsContact O-N 3.12Å; T230-S232 PolarHBondContact OG1-OG 2.83Å; S232-Q235 WeakPolarHBondContact O-CA 3.4Å; S232-Q235 WeakPolarHBondContact O-CB 3.46Å; S232-Q235 PolarHBondContact O-N 3.26Å; S232-T236 PolarHBondContact O-N 2.8Å; S232-T236 PolarHBondContact O-OG1 3.31Å; S232-T236 PolarHBondContact OG-OG1 3.35Å
233	G	95	Very high	94.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-42.2	-60.8	-172.9	0	0	0	0	0	115.5	A227 Q235 T236 L237 S504 C505	A227-G233 PolarHBondContact O-N 2.88Å; G233-Q235 VanDerWaalsContact C-N 3.27Å; G233-Q235 PolarHBondContact O-N 3.46Å; G233-T236 PolarHBondContact O-N 3.5Å; G233-L237 WeakPolarHBondContact O-CB 3.41Å; G233-L237 PolarHBondContact O-N 3.19Å; G233-S504 WeakPolarHBondContact CA-OG 3.34Å; G233-C505 VanDerWaalsContact C-SG 3.51Å
234	P	93.3	Very high	94.4	Very high	59 Å²	59	47.8 Å²	47.8	38%	0.383	28%	0.276	S	S	.	.	H	α-helix	trans	-60.3	-33	179.9	-26.8	35.6	0	0	0	114.2	R238	P234-R238 WeakPolarHBondContact O-CB 3.14Å; P234-R238 PolarHBondContact O-N 2.76Å; P234-R238 VanDerWaalsContact O-N 3.17Å
235	Q	94.6	Very high	93.9	Very high	127 Å²	127	48.8 Å²	48.8	59%	0.593	28%	0.281	S	S	*	.	H	α-helix	trans	-72	-46.5	176	-179.2	178.4	-0.5	0	0	110.8	S232 G233 L237 R238 T239	S232-Q235 WeakPolarHBondContact O-CA 3.4Å; S232-Q235 WeakPolarHBondContact O-CB 3.46Å; S232-Q235 PolarHBondContact O-N 3.26Å; G233-Q235 VanDerWaalsContact C-N 3.27Å; G233-Q235 PolarHBondContact O-N 3.46Å; Q235-L237 VanDerWaalsContact C-N 3.34Å; Q235-L237 PolarHBondContact O-N 2.9Å; Q235-R238 PolarHBondContact O-N 2.83Å; Q235-T239 PolarHBondContact O-N 3.07Å; Q235-T239 PolarHBondContact O-OG1 2.88Å; Q235-T239 VanDerWaalsContact O-OG1 3.12Å
236	T	95.7	Very high	93.3	Very high	29 Å²	29	58.1 Å²	58.1	18%	0.178	32%	0.317	C	S	.	.	H	α-helix	trans	-56.4	-49.4	176	-58.2	0	0	0	0	110.5	A227 S232 G233 R238 T239 L240 V500	A227-T236 HydrophobicContact CB-CG2 4.36Å; S232-T236 PolarHBondContact O-N 2.8Å; S232-T236 PolarHBondContact O-OG1 3.31Å; S232-T236 PolarHBondContact OG-OG1 3.35Å; G233-T236 PolarHBondContact O-N 3.5Å; T236-R238 VanDerWaalsContact C-N 3.34Å; T236-R238 PolarHBondContact O-N 2.86Å; T236-T239 PolarHBondContact O-N 3.4Å; T236-L240 HydrophobicContact CG2-CD1 4.07Å; T236-L240 HydrophobicContact CG2-CG 4.45Å; T236-L240 VanDerWaalsContact O-CG 3.31Å; T236-L240 WeakPolarHBondContact O-CG 3.37Å; T236-L240 PolarHBondContact O-N 3.19Å; T236-V500 HydrophobicContact CG2-CG1 4.03Å
237	L	94	Very high	92.5	Very high	39 Å²	39	58 Å²	58	20%	0.204	32%	0.321	C	S	.	.	H	α-helix	trans	-59.7	-43.5	178.9	-176.6	60.8	0	0	0	112	G233 Q235 T239 L240 A241 R497 V500 D501	G233-L237 WeakPolarHBondContact O-CB 3.41Å; G233-L237 PolarHBondContact O-N 3.19Å; Q235-L237 VanDerWaalsContact C-N 3.34Å; Q235-L237 PolarHBondContact O-N 2.9Å; L237-T239 PolarHBondContact O-N 2.94Å; L237-L240 PolarHBondContact O-N 3.25Å; L237-A241 WeakPolarHBondContact O-CB 3.15Å; L237-A241 PolarHBondContact O-N 2.82Å; L237-R497 HydrophobicContact CD1-CB 3.9Å; L237-R497 HydrophobicContact CD1-CG 4.42Å; L237-R497 WeakPolarHBondContact CD1-O 3.32Å; L237-V500 HydrophobicContact CB-CG1 4.34Å; L237-D501 HydrophobicContact CD2-CB 3.95Å
238	R	92.8	Very high	92	Very high	117 Å²	117	59.4 Å²	59.4	44%	0.442	33%	0.33	S	S	.	.	H	α-helix	trans	-61.9	-43.6	177.1	-170.1	-174.6	-57.8	113.3	2.4	112	P234 Q235 T236 A241 A242	P234-R238 WeakPolarHBondContact O-CB 3.14Å; P234-R238 PolarHBondContact O-N 2.76Å; P234-R238 VanDerWaalsContact O-N 3.17Å; Q235-R238 PolarHBondContact O-N 2.83Å; T236-R238 VanDerWaalsContact C-N 3.34Å; T236-R238 PolarHBondContact O-N 2.86Å; R238-A241 PolarHBondContact O-N 3.36Å; R238-A242 VanDerWaalsContact O-CB 3.32Å; R238-A242 WeakPolarHBondContact O-CB 3.43Å; R238-A242 PolarHBondContact O-N 3.41Å
239	T	93.7	Very high	91.8	Very high	87 Å²	87	60.3 Å²	60.3	53%	0.534	34%	0.342	S	S	.	.	H	α-helix	trans	-63.1	-46	178	-60.6	0	0	0	0	111.2	Q235 T236 L237 A241 A242 A243	Q235-T239 PolarHBondContact O-N 3.07Å; Q235-T239 PolarHBondContact O-OG1 2.88Å; Q235-T239 VanDerWaalsContact O-OG1 3.12Å; T236-T239 PolarHBondContact O-N 3.4Å; L237-T239 PolarHBondContact O-N 2.94Å; T239-A241 PolarHBondContact O-N 2.97Å; T239-A242 PolarHBondContact O-N 3.49Å; T239-A243 PolarHBondContact O-N 2.84Å
240	L	93.9	Very high	91.5	Very high	31 Å²	31	59.9 Å²	59.9	16%	0.162	34%	0.338	C	S	.	.	H	α-helix	trans	-63.7	-41.5	177.5	-66.4	173	0	0	0	112.4	F92 T236 L237 A243 S244 R497 V500	F92-L240 HydrophobicContact CE2-CD2 4.35Å; F92-L240 HydrophobicContact CZ-CD2 4.12Å; T236-L240 HydrophobicContact CG2-CD1 4.07Å; T236-L240 HydrophobicContact CG2-CG 4.45Å; T236-L240 VanDerWaalsContact O-CG 3.31Å; T236-L240 WeakPolarHBondContact O-CG 3.37Å; T236-L240 PolarHBondContact O-N 3.19Å; L237-L240 PolarHBondContact O-N 3.25Å; L240-A243 PolarHBondContact O-N 2.97Å; L240-S244 PolarHBondContact O-N 2.8Å; L240-S244 VanDerWaalsContact O-N 3.12Å; L240-R497 HydrophobicContact CB-CG 3.78Å; L240-R497 HydrophobicContact CD1-CG 4.19Å; L240-V500 HydrophobicContact CD1-CG2 4.1Å
241	A	91	Very high	91.4	Very high	32 Å²	32	60 Å²	60	26%	0.264	34%	0.337	S	S	.	.	H	α-helix	trans	-63.5	-45.8	176	0	0	0	0	0	111.2	L237 R238 T239 A243 S244 D245	L237-A241 WeakPolarHBondContact O-CB 3.15Å; L237-A241 PolarHBondContact O-N 2.82Å; R238-A241 PolarHBondContact O-N 3.36Å; T239-A241 PolarHBondContact O-N 2.97Å; A241-A243 VanDerWaalsContact C-N 3.31Å; A241-A243 PolarHBondContact O-N 2.8Å; A241-S244 WeakPolarHBondContact O-CB 3.41Å; A241-S244 PolarHBondContact O-N 2.82Å; A241-S244 VanDerWaalsContact O-N 3.15Å; A241-D245 WeakPolarHBondContact O-CB 3.34Å; A241-D245 VanDerWaalsContact O-CG 3.32Å; A241-D245 PolarHBondContact O-N 3.27Å
242	A	90.1	Very high	91.3	Very high	32 Å²	32	58.3 Å²	58.3	26%	0.264	32%	0.321	S	S	.	.	H	α-helix	trans	-60.9	-38.5	177.8	0	0	0	0	0	112.5	R238 T239 D245 R246	R238-A242 VanDerWaalsContact O-CB 3.32Å; R238-A242 WeakPolarHBondContact O-CB 3.43Å; R238-A242 PolarHBondContact O-N 3.41Å; T239-A242 PolarHBondContact O-N 3.49Å; A242-D245 PolarHBondContact O-N 2.95Å; A242-R246 WeakPolarHBondContact O-CG 3.26Å; A242-R246 PolarHBondContact O-N 3.36Å
243	A	90.5	Very high	91.1	Very high	56 Å²	56	57.9 Å²	57.9	46%	0.463	32%	0.317	S	S	.	.	H	α-helix	trans	-62.9	-45.6	174.2	0	0	0	0	0	111.6	T239 L240 A241 D245 R246	T239-A243 PolarHBondContact O-N 2.84Å; L240-A243 PolarHBondContact O-N 2.97Å; A241-A243 VanDerWaalsContact C-N 3.31Å; A241-A243 PolarHBondContact O-N 2.8Å; A243-D245 VanDerWaalsContact C-N 3.35Å; A243-D245 PolarHBondContact O-N 2.92Å; A243-R246 PolarHBondContact O-N 3.21Å
244	S	87.7	Confident	91	Very high	46 Å²	46	62 Å²	62	32%	0.322	33%	0.332	S	S	.	.	H	α-helix	trans	-63	-39.6	175.8	-169.2	0	0	0	0	112.6	L240 A241 R246 N247 T248 R497	L240-S244 PolarHBondContact O-N 2.8Å; L240-S244 VanDerWaalsContact O-N 3.12Å; A241-S244 WeakPolarHBondContact O-CB 3.41Å; A241-S244 PolarHBondContact O-N 2.82Å; A241-S244 VanDerWaalsContact O-N 3.15Å; S244-R246 VanDerWaalsContact C-N 3.28Å; S244-R246 PolarHBondContact O-N 3.25Å; S244-N247 PolarHBondContact O-N 2.9Å; S244-T248 PolarHBondContact O-OG1 3.07Å; S244-R497 PolarHBondContact OG-NH1 3.39Å
245	D	86.2	Confident	91	Very high	22 Å²	22	66 Å²	66	12%	0.118	34%	0.34	C	S	.	.	H	α-helix	trans	-69.3	-23.6	-178.2	-74.8	-29.1	0	0	0	112.9	A241 A242 A243 N247 T248 A342 R345	A241-D245 WeakPolarHBondContact O-CB 3.34Å; A241-D245 VanDerWaalsContact O-CG 3.32Å; A241-D245 PolarHBondContact O-N 3.27Å; A242-D245 PolarHBondContact O-N 2.95Å; A243-D245 VanDerWaalsContact C-N 3.35Å; A243-D245 PolarHBondContact O-N 2.92Å; D245-N247 VanDerWaalsContact C-N 3.26Å; D245-N247 PolarHBondContact O-N 2.7Å; D245-T248 PolarHBondContact O-N 2.87Å; D245-A342 HydrophobicContact CB-CB 3.88Å; D245-A342 WeakPolarHBondContact OD2-CB 3.35Å; D245-R345 PolarHBondContact O-NE 3.36Å
246	R	86	Confident	91.1	Very high	195 Å²	195	61.5 Å²	61.5	74%	0.736	32%	0.321	S	S	*	.	H	α-helix	trans	-63.9	-33.4	174.7	-76.4	175.1	178.6	-168.2	-0.1	112.1	A242 A243 S244	A242-R246 WeakPolarHBondContact O-CG 3.26Å; A242-R246 PolarHBondContact O-N 3.36Å; A243-R246 PolarHBondContact O-N 3.21Å; S244-R246 VanDerWaalsContact C-N 3.28Å; S244-R246 PolarHBondContact O-N 3.25Å
247	N	81.9	Confident	91	Very high	120 Å²	120	61 Å²	61	64%	0.642	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	5.9	-177.1	-64.1	29.5	0	0	0	112.4	S244 D245 S249 S252	S244-N247 PolarHBondContact O-N 2.9Å; D245-N247 VanDerWaalsContact C-N 3.26Å; D245-N247 PolarHBondContact O-N 2.7Å; N247-S249 PolarHBondContact O-N 3.49Å; N247-S252 WeakPolarHBondContact O-CB 3.23Å; N247-S252 PolarHBondContact O-OG 3.49Å
248	T	86.5	Confident	91	Very high	31 Å²	31	61.9 Å²	61.9	19%	0.19	32%	0.324	C	S	.	.			trans	-81.4	114.5	-178.9	-63	0	0	0	0	110.5	S244 D245 R345	S244-T248 PolarHBondContact O-OG1 3.07Å; D245-T248 PolarHBondContact O-N 2.87Å; T248-R345 WeakPolarHBondContact O-CD 3.49Å
249	S	91.1	Very high	91.2	Very high	52 Å²	52	60 Å²	60	36%	0.364	32%	0.317	S	S	.	.			trans	-136.9	167.2	172.1	71.5	0	0	0	0	109	N247 D251 S252 T253	N247-S249 PolarHBondContact O-N 3.49Å; S249-D251 PolarHBondContact O-N 3.47Å; S249-D251 PolarHBondContact OG-N 2.66Å; S249-S252 PolarHBondContact N-OG 3Å; S249-S252 PolarHBondContact O-N 3.41Å; S249-S252 PolarHBondContact O-OG 3.11Å; S249-S252 PolarHBondContact OG-N 2.78Å; S249-S252 VanDerWaalsContact OG-N 3.17Å; S249-S252 PolarHBondContact OG-OG 2.71Å; S249-T253 WeakPolarHBondContact O-CB 3.23Å; S249-T253 PolarHBondContact O-N 3.14Å; S249-T253 PolarHBondContact O-OG1 3.33Å; S249-T253 VanDerWaalsContact O-OG1 3.1Å
250	F	90.9	Very high	91.4	Very high	19 Å²	19	56.9 Å²	56.9	8%	0.083	30%	0.297	C	S	.	.	H	α-helix	trans	-56.1	-42.7	175.4	172.7	-94.5	0	0	0	110.8	R254 V349 E352 I353	F250-R254 HydrophobicContact CE1-CB 4.44Å; F250-R254 WeakPolarHBondContact O-CB 3.47Å; F250-R254 PolarHBondContact O-N 3.31Å; F250-V349 HydrophobicContact CB-CG2 4.43Å; F250-V349 HydrophobicContact CD2-CG1 4.37Å; F250-E352 HydrophobicContact CB-CG 4.29Å; F250-E352 WeakPolarHBondContact CB-OE2 3.49Å; F250-E352 HydrophobicContact CD1-CG 4.19Å; F250-E352 WeakPolarHBondContact CD1-OE1 3.47Å; F250-E352 HydrophobicContact CD2-CB 4.15Å; F250-E352 HydrophobicContact CD2-CG 3.69Å; F250-E352 HydrophobicContact CE1-CG 4.5Å; F250-E352 HydrophobicContact CE2-CG 4.03Å; F250-E352 HydrophobicContact CG-CB 4.48Å; F250-E352 HydrophobicContact CG-CG 3.78Å; F250-E352 WeakPolarHBondContact CG-OE1 3.32Å; F250-E352 WeakPolarHBondContact CG-OE2 3.37Å; F250-E352 HydrophobicContact CZ-CG 4.43Å; F250-I353 HydrophobicContact CD2-CG1 3.94Å; F250-I353 HydrophobicContact CE2-CG1 3.62Å
251	D	93.1	Very high	91.5	Very high	73 Å²	73	56.1 Å²	56.1	39%	0.39	29%	0.292	S	S	.	.	H	α-helix	trans	-65.1	-43.9	179.4	-74.3	-44.4	0	0	0	113.8	S249 R254 R255	S249-D251 PolarHBondContact O-N 3.47Å; S249-D251 PolarHBondContact OG-N 2.66Å; D251-R254 IonicContact OD1-CZ 3.2Å; D251-R254 IonicContact OD1-NE 3.19Å; D251-R254 IonicContact OD1-NH2 2.81Å; D251-R254 PolarHBondContact OD1-NH2 3.03Å; D251-R255 WeakPolarHBondContact O-CB 3.41Å; D251-R255 PolarHBondContact O-N 2.84Å
252	S	93	Very high	91.7	Very high	30 Å²	30	58.8 Å²	58.8	21%	0.21	30%	0.299	C	S	.	.	H	α-helix	trans	-69.6	-40.6	-180	64.6	0	0	0	0	111.7	N247 S249 T256	N247-S252 WeakPolarHBondContact O-CB 3.23Å; N247-S252 PolarHBondContact O-OG 3.49Å; S249-S252 PolarHBondContact N-OG 3Å; S249-S252 PolarHBondContact O-N 3.41Å; S249-S252 PolarHBondContact O-OG 3.11Å; S249-S252 PolarHBondContact OG-N 2.78Å; S249-S252 VanDerWaalsContact OG-N 3.17Å; S249-S252 PolarHBondContact OG-OG 2.71Å; S252-T256 WeakPolarHBondContact O-CB 3.49Å; S252-T256 PolarHBondContact O-N 3.24Å; S252-T256 PolarHBondContact O-OG1 2.86Å
253	T	90.8	Very high	92.1	Very high	18 Å²	18	58.7 Å²	58.7	11%	0.11	29%	0.294	C	S	.	.	H	α-helix	trans	-62.5	-51.2	174.2	-63.7	0	0	0	0	111.4	S249 R255 T256 A257 F304 V349	S249-T253 WeakPolarHBondContact O-CB 3.23Å; S249-T253 PolarHBondContact O-N 3.14Å; S249-T253 PolarHBondContact O-OG1 3.33Å; S249-T253 VanDerWaalsContact O-OG1 3.1Å; T253-R255 PolarHBondContact O-N 3.09Å; T253-T256 PolarHBondContact O-N 3.2Å; T253-A257 WeakPolarHBondContact O-CB 3.39Å; T253-A257 PolarHBondContact O-N 3.16Å; T253-F304 HydrophobicContact CG2-CB 4.22Å; T253-F304 HydrophobicContact CG2-CD1 3.63Å; T253-F304 HydrophobicContact CG2-CD2 3.35Å; T253-F304 HydrophobicContact CG2-CE1 3.71Å; T253-F304 HydrophobicContact CG2-CE2 3.44Å; T253-F304 VanDerWaalsContact CG2-CE2 3.44Å; T253-F304 HydrophobicContact CG2-CG 3.44Å; T253-F304 VanDerWaalsContact CG2-CG 3.44Å; T253-F304 HydrophobicContact CG2-CZ 3.61Å; T253-V349 HydrophobicContact CG2-CG1 4.5Å
254	R	93.2	Very high	92.4	Very high	87 Å²	87	56 Å²	56	33%	0.328	27%	0.272	S	S	.	.	H	α-helix	trans	-57.6	-49	177.8	176.5	-178.5	62.3	155.7	-2.6	111.2	F250 D251 T256 A257 L258	F250-R254 HydrophobicContact CE1-CB 4.44Å; F250-R254 WeakPolarHBondContact O-CB 3.47Å; F250-R254 PolarHBondContact O-N 3.31Å; D251-R254 IonicContact OD1-CZ 3.2Å; D251-R254 IonicContact OD1-NE 3.19Å; D251-R254 IonicContact OD1-NH2 2.81Å; D251-R254 PolarHBondContact OD1-NH2 3.03Å; R254-T256 PolarHBondContact O-N 3.48Å; R254-A257 PolarHBondContact O-N 2.92Å; R254-L258 HydrophobicContact CG-CD1 3.64Å; R254-L258 HydrophobicContact CG-CG 4.19Å; R254-L258 WeakPolarHBondContact O-CB 3.18Å; R254-L258 VanDerWaalsContact O-CG 3.28Å; R254-L258 WeakPolarHBondContact O-CG 3.08Å; R254-L258 PolarHBondContact O-N 2.84Å
255	R	94.6	Very high	92.9	Very high	143 Å²	143	53.9 Å²	53.9	54%	0.54	26%	0.257	S	S	.	.	H	α-helix	trans	-59.3	-47.8	-178.8	-172.6	-176.2	-57.5	134.4	3.1	111.3	D251 T253 R259 E487	D251-R255 WeakPolarHBondContact O-CB 3.41Å; D251-R255 PolarHBondContact O-N 2.84Å; T253-R255 PolarHBondContact O-N 3.09Å; R255-R259 WeakPolarHBondContact O-CB 3.45Å; R255-R259 PolarHBondContact O-N 2.79Å; R255-E487 WeakPolarHBondContact CD-OE1 3.38Å; R255-E487 HydrophobicContact CG-CG 4.17Å; R255-E487 WeakPolarHBondContact CG-OE1 3.4Å
256	T	95.1	Very high	93.4	Very high	33 Å²	33	53.3 Å²	53.3	20%	0.202	25%	0.253	C	S	.	.	H	α-helix	trans	-64.4	-48.3	-179.4	-52.4	0	0	0	0	111.3	S252 T253 R254 F260 E487 A490 L491	S252-T256 WeakPolarHBondContact O-CB 3.49Å; S252-T256 PolarHBondContact O-N 3.24Å; S252-T256 PolarHBondContact O-OG1 2.86Å; T253-T256 PolarHBondContact O-N 3.2Å; R254-T256 PolarHBondContact O-N 3.48Å; T256-F260 WeakPolarHBondContact O-CB 3.34Å; T256-F260 PolarHBondContact O-N 3.05Å; T256-E487 HydrophobicContact CG2-CB 4.45Å; T256-A490 HydrophobicContact CG2-CB 4.11Å; T256-L491 HydrophobicContact CG2-CD2 4.24Å; T256-L491 HydrophobicContact CG2-CG 4.28Å
257	A	94.2	Very high	93.8	Very high	18 Å²	18	44.7 Å²	44.7	15%	0.149	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-47.5	-178.3	0	0	0	0	0	112.4	T253 R254 F260 Q261 T306	T253-A257 WeakPolarHBondContact O-CB 3.39Å; T253-A257 PolarHBondContact O-N 3.16Å; R254-A257 PolarHBondContact O-N 2.92Å; A257-F260 PolarHBondContact O-N 2.68Å; A257-Q261 WeakPolarHBondContact O-CG 3.48Å; A257-Q261 PolarHBondContact O-N 2.85Å; A257-T306 HydrophobicContact CB-CG2 4.31Å
258	L	95	Very high	94.6	Very high	57 Å²	57	39.1 Å²	39.1	30%	0.298	19%	0.193	S	C	.	.	H	α-helix	trans	-68.6	-39.7	-179.5	-65.7	-177.4	0	0	0	111.8	R254 F260 Q261 E262 T306	R254-L258 HydrophobicContact CG-CD1 3.64Å; R254-L258 HydrophobicContact CG-CG 4.19Å; R254-L258 WeakPolarHBondContact O-CB 3.18Å; R254-L258 VanDerWaalsContact O-CG 3.28Å; R254-L258 WeakPolarHBondContact O-CG 3.08Å; R254-L258 PolarHBondContact O-N 2.84Å; L258-F260 VanDerWaalsContact C-N 3.29Å; L258-F260 PolarHBondContact O-N 2.9Å; L258-Q261 PolarHBondContact O-N 3.26Å; L258-E262 WeakPolarHBondContact O-CB 3.4Å; L258-E262 PolarHBondContact O-N 3.01Å; L258-T306 HydrophobicContact CD2-CG2 4.27Å
259	R	96.5	Very high	95.1	Very high	78 Å²	78	37.7 Å²	37.7	29%	0.294	18%	0.184	S	C	.	.	H	α-helix	trans	-66.2	-35.5	177	-167.1	61	172	172.8	8	111.7	R255 E262 L263 F481 E487	R255-R259 WeakPolarHBondContact O-CB 3.45Å; R255-R259 PolarHBondContact O-N 2.79Å; R259-E262 WeakPolarHBondContact CD-OE2 3.22Å; R259-E262 IonicContact CZ-OE1 3.29Å; R259-E262 IonicContact CZ-OE2 3.55Å; R259-E262 IonicContact NE-OE2 2.75Å; R259-E262 IonicContact NH1-OE1 3.13Å; R259-E262 PolarHBondContact NH1-OE1 3.01Å; R259-E262 IonicContact NH1-OE2 2.9Å; R259-E262 PolarHBondContact NH1-OE2 3.21Å; R259-E262 PolarHBondContact O-N 3.47Å; R259-L263 HydrophobicContact CG-CD1 4.05Å; R259-L263 WeakPolarHBondContact O-CB 3.47Å; R259-L263 WeakPolarHBondContact O-CG 3.49Å; R259-L263 PolarHBondContact O-N 3.08Å; R259-L263 VanDerWaalsContact O-N 3.12Å; R259-F481 HydrophobicContact CG-CE1 4.04Å; R259-E487 HydrophobicContact CB-CB 4.16Å; R259-E487 HydrophobicContact CB-CG 3.84Å; R259-E487 HydrophobicContact CG-CB 4.17Å; R259-E487 HydrophobicContact CG-CG 4.02Å
260	F	97	Very high	95.4	Very high	22 Å²	22	35.2 Å²	35.2	10%	0.096	17%	0.167	C	C	.	.	H	α-helix	trans	-64.3	-44.9	174.1	-170.6	-154.6	0	0	0	111.8	T256 A257 L258 E262 L263 S264 W266 Y473 L477 F481 L491	T256-F260 WeakPolarHBondContact O-CB 3.34Å; T256-F260 PolarHBondContact O-N 3.05Å; A257-F260 PolarHBondContact O-N 2.68Å; L258-F260 VanDerWaalsContact C-N 3.29Å; L258-F260 PolarHBondContact O-N 2.9Å; F260-E262 VanDerWaalsContact C-N 3.33Å; F260-E262 PolarHBondContact O-N 2.87Å; F260-L263 PolarHBondContact O-N 3.44Å; F260-S264 WeakPolarHBondContact O-CA 3.14Å; F260-S264 WeakPolarHBondContact O-CB 3.46Å; F260-S264 PolarHBondContact O-N 2.89Å; F260-W266 HydrophobicContact CE1-CB 4.04Å; F260-W266 HydrophobicContact CE1-CG 4.19Å; F260-W266 HydrophobicContact CE2-CB 3.86Å; F260-W266 HydrophobicContact CE2-CG 4.43Å; F260-W266 HydrophobicContact CZ-CB 3.38Å; F260-W266 HydrophobicContact CZ-CD2 4.25Å; F260-W266 AromaticContact CZ-CG 3.58Å; F260-W266 HydrophobicContact CZ-CG 3.58Å; F260-Y473 HydrophobicContact CZ-CE2 4.32Å; F260-L477 HydrophobicContact CD2-CD2 4.36Å; F260-L477 HydrophobicContact CE2-CD2 3.76Å; F260-L477 HydrophobicContact CZ-CD2 4.42Å; F260-F481 HydrophobicContact CB-CZ 4.18Å; F260-F481 AromaticContact CD2-CE2 3.83Å; F260-F481 HydrophobicContact CD2-CE2 3.83Å; F260-F481 AromaticContact CD2-CZ 3.78Å; F260-F481 HydrophobicContact CD2-CZ 3.78Å; F260-F481 HydrophobicContact CE2-CE2 4.36Å; F260-F481 HydrophobicContact CG-CZ 4.37Å; F260-L491 HydrophobicContact CB-CD1 4.06Å; F260-L491 HydrophobicContact CD1-CD1 4.15Å; F260-L491 HydrophobicContact CD1-CD2 3.89Å; F260-L491 HydrophobicContact CD2-CD1 3.66Å; F260-L491 HydrophobicContact CE1-CD2 4.15Å; F260-L491 HydrophobicContact CE2-CD1 4.07Å; F260-L491 HydrophobicContact CG-CD1 3.7Å; F260-L491 HydrophobicContact CG-CD2 4.24Å; F260-L491 HydrophobicContact CZ-CD1 4.47Å
261	Q	96.7	Very high	95.8	Very high	15 Å²	15	34.8 Å²	34.8	7%	0.07	17%	0.165	C	C	.	.	H	α-helix	trans	-67.4	-30.9	176.3	-74.5	166	15.5	0	0	113.7	A257 L258 S267 T306 Y549	A257-Q261 WeakPolarHBondContact O-CG 3.48Å; A257-Q261 PolarHBondContact O-N 2.85Å; L258-Q261 PolarHBondContact O-N 3.26Å; Q261-S267 WeakPolarHBondContact CG-OG 3.44Å; Q261-S267 PolarHBondContact NE2-OG 2.94Å; Q261-T306 PolarHBondContact NE2-OG1 3.48Å; Q261-Y549 WeakPolarHBondContact O-CE1 3.42Å; Q261-Y549 PolarHBondContact O-OH 3.26Å
262	E	96.3	Very high	96	Very high	87 Å²	87	33 Å²	33	41%	0.407	16%	0.157	S	C	.	.	H	α-helix	trans	-69.5	-38.4	176.5	-173.6	-170.4	163.5	0	0	111.5	F5 L258 R259 F260 Y549	F5-E262 HydrophobicContact CZ-CB 4.45Å; L258-E262 WeakPolarHBondContact O-CB 3.4Å; L258-E262 PolarHBondContact O-N 3.01Å; R259-E262 WeakPolarHBondContact CD-OE2 3.22Å; R259-E262 IonicContact CZ-OE1 3.29Å; R259-E262 IonicContact CZ-OE2 3.55Å; R259-E262 IonicContact NE-OE2 2.75Å; R259-E262 IonicContact NH1-OE1 3.13Å; R259-E262 PolarHBondContact NH1-OE1 3.01Å; R259-E262 IonicContact NH1-OE2 2.9Å; R259-E262 PolarHBondContact NH1-OE2 3.21Å; R259-E262 PolarHBondContact O-N 3.47Å; F260-E262 VanDerWaalsContact C-N 3.33Å; F260-E262 PolarHBondContact O-N 2.87Å; E262-Y549 WeakPolarHBondContact O-CE1 3.42Å
263	L	97	Very high	96.2	Very high	31 Å²	31	31.5 Å²	31.5	16%	0.162	15%	0.147	C	C	.	.	H	α-helix	trans	-102.2	-19.6	-171.2	-62	-178.1	0	0	0	114.3	R259 F260 S480 F481	R259-L263 HydrophobicContact CG-CD1 4.05Å; R259-L263 WeakPolarHBondContact O-CB 3.47Å; R259-L263 WeakPolarHBondContact O-CG 3.49Å; R259-L263 PolarHBondContact O-N 3.08Å; R259-L263 VanDerWaalsContact O-N 3.12Å; F260-L263 PolarHBondContact O-N 3.44Å; L263-S480 WeakPolarHBondContact O-CB 3.16Å; L263-F481 HydrophobicContact CB-CE2 4.44Å; L263-F481 HydrophobicContact CD1-CD1 3.59Å; L263-F481 HydrophobicContact CD1-CE1 3.93Å; L263-F481 HydrophobicContact CD1-CG 3.96Å
264	S	97.4	Very high	96.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.142	C	C	.	.			trans	-138.2	140.2	-179.3	-179.9	0	0	0	0	111.5	F260 W266	F260-S264 WeakPolarHBondContact O-CA 3.14Å; F260-S264 WeakPolarHBondContact O-CB 3.46Å; F260-S264 PolarHBondContact O-N 2.89Å; S264-W266 PolarHBondContact O-N 3.44Å; S264-W266 PolarHBondContact OG-N 2.99Å
265	P	97.4	Very high	96.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	-75.6	-2.4	173.7	30.8	-32.9	0	0	0	113.4	S267 S268 F269 L546 Y549 W553 L571	P265-S267 VanDerWaalsContact C-N 3.32Å; P265-S267 PolarHBondContact O-N 3.41Å; P265-S267 VanDerWaalsContact O-N 3.11Å; P265-S268 PolarHBondContact O-N 3.19Å; P265-S268 VanDerWaalsContact O-N 3.09Å; P265-F269 VanDerWaalsContact O-CB 3.25Å; P265-F269 WeakPolarHBondContact O-CB 3.44Å; P265-F269 PolarHBondContact O-N 2.85Å; P265-L546 HydrophobicContact CB-CD2 3.59Å; P265-L546 HydrophobicContact CG-CD2 3.9Å; P265-Y549 HydrophobicContact CB-CD2 3.75Å; P265-Y549 HydrophobicContact CB-CE2 3.63Å; P265-Y549 HydrophobicContact CB-CG 4.3Å; P265-Y549 HydrophobicContact CG-CD2 4.08Å; P265-Y549 HydrophobicContact CG-CE2 4.41Å; P265-Y549 HydrophobicContact CG-CG 4.22Å; P265-W553 VanDerWaalsContact CD-CE2 3.4Å; P265-W553 VanDerWaalsContact CD-NE1 3.35Å; P265-W553 HydrophobicContact CG-CB 4.13Å; P265-W553 HydrophobicContact CG-CD2 3.32Å; P265-W553 HydrophobicContact CG-CE3 3.82Å; P265-W553 HydrophobicContact CG-CG 3.45Å; P265-W553 VanDerWaalsContact CG-CG 3.45Å; P265-W553 HydrophobicContact CG-CZ2 4.29Å; P265-W553 HydrophobicContact CG-CZ3 4.46Å; P265-L571 HydrophobicContact CB-CD1 4.44Å; P265-L571 HydrophobicContact CB-CD2 4.46Å; P265-L571 HydrophobicContact CG-CD1 4.17Å; P265-L571 HydrophobicContact CG-CD2 4.29Å
266	W	97.3	Very high	97	Very high	11 Å²	11	20.8 Å²	20.8	4%	0.042	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.9	-50.3	-170.1	-164.6	-74.5	0	0	0	114.2	F260 S264 E437 F469 Y473 W553 L578 V579	F260-W266 HydrophobicContact CE1-CB 4.04Å; F260-W266 HydrophobicContact CE1-CG 4.19Å; F260-W266 HydrophobicContact CE2-CB 3.86Å; F260-W266 HydrophobicContact CE2-CG 4.43Å; F260-W266 HydrophobicContact CZ-CB 3.38Å; F260-W266 HydrophobicContact CZ-CD2 4.25Å; F260-W266 AromaticContact CZ-CG 3.58Å; F260-W266 HydrophobicContact CZ-CG 3.58Å; S264-W266 PolarHBondContact O-N 3.44Å; S264-W266 PolarHBondContact OG-N 2.99Å; W266-E437 HydrophobicContact CZ2-CG 4.3Å; W266-E437 PolarHBondContact NE1-OE1 3.47Å; W266-F469 HydrophobicContact CH2-CE2 4.48Å; W266-F469 HydrophobicContact CH2-CZ 4.34Å; W266-F469 HydrophobicContact CZ2-CE2 4.29Å; W266-F469 AromaticContact CZ2-CZ 3.9Å; W266-F469 HydrophobicContact CZ2-CZ 3.9Å; W266-Y473 HydrophobicContact CD2-CD2 4.24Å; W266-Y473 HydrophobicContact CD2-CE2 4.2Å; W266-Y473 AromaticContact CE2-CD2 3.98Å; W266-Y473 HydrophobicContact CE3-CD2 4.05Å; W266-Y473 HydrophobicContact CE3-CE2 4.33Å; W266-Y473 AromaticContact CH2-CD2 3.49Å; W266-Y473 HydrophobicContact CH2-CD2 3.49Å; W266-Y473 VanDerWaalsContact CH2-CD2 3.49Å; W266-Y473 HydrophobicContact CH2-CE2 4.34Å; W266-Y473 HydrophobicContact CH2-CG 4.36Å; W266-Y473 AromaticContact CZ2-CD2 3.63Å; W266-Y473 HydrophobicContact CZ2-CD2 3.63Å; W266-Y473 HydrophobicContact CZ2-CE2 4.14Å; W266-Y473 AromaticContact CZ3-CD2 3.68Å; W266-Y473 HydrophobicContact CZ3-CD2 3.68Å; W266-Y473 HydrophobicContact CZ3-CE2 4.4Å; W266-W553 AromaticContact CE3-CH2 3.72Å; W266-W553 HydrophobicContact CE3-CH2 3.72Å; W266-W553 HydrophobicContact CE3-CZ3 4.41Å; W266-W553 HydrophobicContact CZ3-CH2 4.09Å; W266-L578 HydrophobicContact CH2-CB 3.71Å; W266-L578 HydrophobicContact CH2-CD1 3.63Å; W266-L578 HydrophobicContact CH2-CD2 4.4Å; W266-L578 HydrophobicContact CH2-CG 4.11Å; W266-L578 HydrophobicContact CZ2-CB 4.3Å; W266-L578 HydrophobicContact CZ3-CB 4.16Å; W266-L578 HydrophobicContact CZ3-CD1 3.52Å; W266-L578 HydrophobicContact CZ3-CG 4.41Å; W266-V579 HydrophobicContact CD2-CG2 4.2Å; W266-V579 HydrophobicContact CG-CG2 4.32Å; W266-V579 HydrophobicContact CZ2-CG2 4.21Å
267	S	95.1	Very high	97.1	Very high	14 Å²	14	19.6 Å²	19.6	10%	0.098	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-37.7	175.6	58.6	0	0	0	0	113.1	Q261 P265 F269 G270 H271	Q261-S267 WeakPolarHBondContact CG-OG 3.44Å; Q261-S267 PolarHBondContact NE2-OG 2.94Å; P265-S267 VanDerWaalsContact C-N 3.32Å; P265-S267 PolarHBondContact O-N 3.41Å; P265-S267 VanDerWaalsContact O-N 3.11Å; S267-F269 VanDerWaalsContact C-N 3.25Å; S267-F269 PolarHBondContact O-N 3.47Å; S267-G270 PolarHBondContact O-N 3.29Å; S267-H271 PolarHBondContact O-N 2.98Å; S267-H271 VanDerWaalsContact O-N 3.15Å
268	S	97.2	Very high	97.3	Very high	3 Å²	3	18.8 Å²	18.8	2%	0.021	10%	0.095	C	C	.	.	H	α-helix	trans	-63.7	-31.3	-174.8	-55.2	0	0	0	0	112.5	P265 H271 V272 Y549	P265-S268 PolarHBondContact O-N 3.19Å; P265-S268 VanDerWaalsContact O-N 3.09Å; S268-H271 PolarHBondContact O-N 2.83Å; S268-V272 WeakPolarHBondContact O-CG2 3.48Å; S268-V272 PolarHBondContact O-N 3.2Å; S268-Y549 PolarHBondContact OG-OH 2.9Å
269	F	98.1	Very high	97.4	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-56.6	-53.8	175	168.1	-97.2	0	0	0	111.3	P265 S267 H271 V272 A273 V542 L545 M555 I569 F570 L571 V579 A581	P265-F269 VanDerWaalsContact O-CB 3.25Å; P265-F269 WeakPolarHBondContact O-CB 3.44Å; P265-F269 PolarHBondContact O-N 2.85Å; S267-F269 VanDerWaalsContact C-N 3.25Å; S267-F269 PolarHBondContact O-N 3.47Å; F269-H271 VanDerWaalsContact C-N 3.32Å; F269-H271 PolarHBondContact O-N 3.39Å; F269-V272 PolarHBondContact O-N 2.53Å; F269-A273 PolarHBondContact O-N 3.42Å; F269-A273 VanDerWaalsContact O-N 3.08Å; F269-V542 HydrophobicContact CD2-CG1 3.56Å; F269-V542 HydrophobicContact CE2-CG1 3.55Å; F269-L545 HydrophobicContact CB-CD2 4.37Å; F269-M555 HydrophobicContact CE2-CG 4.23Å; F269-I569 HydrophobicContact CE2-CD1 3.81Å; F269-I569 HydrophobicContact CE2-CG1 4.3Å; F269-I569 HydrophobicContact CZ-CB 4.34Å; F269-I569 HydrophobicContact CZ-CD1 3.69Å; F269-I569 HydrophobicContact CZ-CG1 3.69Å; F269-F570 VanDerWaalsContact CZ-C 3.47Å; F269-L571 HydrophobicContact CB-CB 4.41Å; F269-L571 HydrophobicContact CB-CD1 4.38Å; F269-L571 HydrophobicContact CB-CD2 3.9Å; F269-L571 HydrophobicContact CB-CG 4.47Å; F269-L571 HydrophobicContact CD1-CB 3.67Å; F269-L571 HydrophobicContact CD1-CD2 4.44Å; F269-L571 HydrophobicContact CD2-CB 3.88Å; F269-L571 HydrophobicContact CD2-CD1 4.01Å; F269-L571 HydrophobicContact CD2-CG 4.42Å; F269-L571 HydrophobicContact CE1-CB 3.78Å; F269-L571 HydrophobicContact CE2-CB 3.97Å; F269-L571 HydrophobicContact CG-CB 3.73Å; F269-L571 HydrophobicContact CG-CD1 4.23Å; F269-L571 HydrophobicContact CG-CD2 4.14Å; F269-L571 HydrophobicContact CG-CG 4.25Å; F269-L571 HydrophobicContact CZ-CB 3.92Å; F269-L571 VanDerWaalsContact CZ-N 3.3Å; F269-V579 HydrophobicContact CD1-CB 4.37Å; F269-V579 HydrophobicContact CD1-CG1 4.09Å; F269-V579 HydrophobicContact CE1-CG1 4.4Å; F269-A581 HydrophobicContact CD1-CB 4.4Å; F269-A581 HydrophobicContact CE1-CB 3.7Å; F269-A581 HydrophobicContact CZ-CB 4.29Å
270	G	97.5	Very high	97.3	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.01	8%	0.08	C	C	.	.	H	α-helix	trans	-62.9	-39.2	177.5	0	0	0	0	0	112.4	S267 A274	S267-G270 PolarHBondContact O-N 3.29Å; G270-A274 WeakPolarHBondContact O-CB 3.33Å; G270-A274 PolarHBondContact O-N 3.12Å
271	H	98.2	Very high	97.3	Very high	9 Å²	9	14.7 Å²	14.7	4%	0.042	8%	0.08	C	C	.	.	H	α-helix	trans	-60.9	-47.5	176.6	-64.4	160.5	0	0	0	112.4	S267 S268 F269 N275 T303 T306 Q307 L403	S267-H271 PolarHBondContact O-N 2.98Å; S267-H271 VanDerWaalsContact O-N 3.15Å; S268-H271 PolarHBondContact O-N 2.83Å; F269-H271 VanDerWaalsContact C-N 3.32Å; F269-H271 PolarHBondContact O-N 3.39Å; H271-N275 WeakPolarHBondContact O-CB 3.19Å; H271-N275 PolarHBondContact O-N 3.45Å; H271-N275 PolarHBondContact O-OD1 3.44Å; H271-T303 PolarHBondContact NE2-OG1 3.3Å; H271-T306 PolarHBondContact CE1-OG1 3.48Å; H271-T306 VanDerWaalsContact CE1-OG1 3.31Å; H271-Q307 HydrophobicContact CB-CB 4.35Å; H271-Q307 HydrophobicContact CB-CG 3.99Å; H271-Q307 VanDerWaalsContact CD2-CB 3.49Å; H271-Q307 WeakPolarHBondContact CD2-CB 3.49Å; H271-Q307 PolarHBondContact CD2-OE1 2.86Å; H271-L403 WeakPolarHBondContact CD2-CD1 3.5Å; H271-L403 WeakPolarHBondContact NE2-CD1 3.49Å
272	V	98.3	Very high	97.2	Very high	35 Å²	35	14 Å²	14	21%	0.212	8%	0.077	C	C	.	.	H	α-helix	trans	-65.6	-48.7	-179.2	171.6	0	0	0	0	110.8	S268 F269 A274 N275 G276 D541 V542 L545	S268-V272 WeakPolarHBondContact O-CG2 3.48Å; S268-V272 PolarHBondContact O-N 3.2Å; F269-V272 PolarHBondContact O-N 2.53Å; V272-A274 PolarHBondContact O-N 3.13Å; V272-N275 PolarHBondContact O-N 3.11Å; V272-G276 PolarHBondContact O-N 3.06Å; V272-D541 HydrophobicContact CG1-CB 3.76Å; V272-V542 HydrophobicContact CB-CG2 4.39Å; V272-V542 HydrophobicContact CG1-CG2 3.84Å; V272-L545 HydrophobicContact CB-CD2 4.24Å; V272-L545 HydrophobicContact CG2-CD1 4.48Å; V272-L545 HydrophobicContact CG2-CD2 3.91Å
273	A	98.1	Very high	97	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-60.5	-47.2	179.3	0	0	0	0	0	112	F269 G276 A277 F534 V542 I569 A581	F269-A273 PolarHBondContact O-N 3.42Å; F269-A273 VanDerWaalsContact O-N 3.08Å; A273-G276 PolarHBondContact O-N 3.38Å; A273-A277 PolarHBondContact O-N 2.87Å; A273-F534 HydrophobicContact CB-CE1 4.16Å; A273-F534 HydrophobicContact CB-CZ 4Å; A273-F534 VanDerWaalsContact O-CE1 3.31Å; A273-F534 WeakPolarHBondContact O-CE1 3.27Å; A273-V542 HydrophobicContact CB-CG2 4.16Å; A273-I569 HydrophobicContact CB-CD1 4.16Å; A273-A581 HydrophobicContact CB-CB 3.89Å
274	A	98.4	Very high	96.8	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.008	9%	0.087	C	C	.	.	H	α-helix	trans	-67	-43.9	179.5	0	0	0	0	0	112.4	G270 V272 G276 A277 I278 N401 T433 V435	G270-A274 WeakPolarHBondContact O-CB 3.33Å; G270-A274 PolarHBondContact O-N 3.12Å; V272-A274 PolarHBondContact O-N 3.13Å; A274-G276 VanDerWaalsContact C-N 3.3Å; A274-G276 PolarHBondContact O-N 2.83Å; A274-A277 PolarHBondContact O-N 3.41Å; A274-I278 WeakPolarHBondContact O-CB 3.15Å; A274-I278 VanDerWaalsContact O-CG1 3.23Å; A274-I278 WeakPolarHBondContact O-CG1 3.49Å; A274-I278 PolarHBondContact O-N 2.62Å; A274-N401 WeakPolarHBondContact CB-OD1 3.32Å; A274-T433 HydrophobicContact CB-CG2 3.95Å; A274-V435 HydrophobicContact CB-CG2 4.5Å
275	N	98.4	Very high	96.5	Very high	12 Å²	12	16.3 Å²	16.3	6%	0.064	9%	0.088	C	C	.	.	H	α-helix	trans	-61	-40.9	177.6	-76.6	-0.6	0	0	0	111.5	H271 V272 I278 L279 Q307 T310 L311	H271-N275 WeakPolarHBondContact O-CB 3.19Å; H271-N275 PolarHBondContact O-N 3.45Å; H271-N275 PolarHBondContact O-OD1 3.44Å; V272-N275 PolarHBondContact O-N 3.11Å; N275-I278 PolarHBondContact O-N 3.05Å; N275-L279 WeakPolarHBondContact O-CB 3.4Å; N275-L279 PolarHBondContact O-N 3.28Å; N275-Q307 PolarHBondContact ND2-O 3.47Å; N275-Q307 WeakPolarHBondContact OD1-CG 3.37Å; N275-Q307 PolarHBondContact OD1-NE2 3.11Å; N275-T310 PolarHBondContact ND2-OG1 2.93Å; N275-T310 VanDerWaalsContact ND2-OG1 3.08Å; N275-L311 HydrophobicContact CB-CD1 4.27Å
276	G	97.5	Very high	96.1	Very high	10 Å²	10	18.2 Å²	18.2	10%	0.103	10%	0.104	C	C	.	.	H	α-helix	trans	-57	-55.5	175.5	0	0	0	0	0	112.4	V272 A273 A274 I278 L279 E280	V272-G276 PolarHBondContact O-N 3.06Å; A273-G276 PolarHBondContact O-N 3.38Å; A274-G276 VanDerWaalsContact C-N 3.3Å; A274-G276 PolarHBondContact O-N 2.83Å; G276-I278 PolarHBondContact O-N 2.73Å; G276-L279 PolarHBondContact O-N 2.78Å; G276-E280 WeakPolarHBondContact O-CG 3.2Å; G276-E280 PolarHBondContact O-N 2.84Å
277	A	97.8	Very high	95.7	Very high	8 Å²	8	22 Å²	22	7%	0.066	14%	0.137	C	C	.	.	H	α-helix	trans	-62.4	-38.6	179.1	0	0	0	0	0	113.5	A273 A274 S281 T433 F534 A583	A273-A277 PolarHBondContact O-N 2.87Å; A274-A277 PolarHBondContact O-N 3.41Å; A277-S281 VanDerWaalsContact O-CB 3.25Å; A277-S281 WeakPolarHBondContact O-CB 3.17Å; A277-S281 PolarHBondContact O-N 3.1Å; A277-S281 VanDerWaalsContact O-N 3.07Å; A277-T433 HydrophobicContact CB-CG2 4.15Å; A277-F534 HydrophobicContact CB-CD1 4.09Å; A277-F534 HydrophobicContact CB-CE1 3.78Å; A277-A583 HydrophobicContact CB-CB 3.84Å
278	I	98.3	Very high	95.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.7	-46.9	176.1	-70.5	167.8	0	0	0	110.5	A274 N275 G276 S281 F282 I297 W308 L311 A399 N401 V431 T433	A274-I278 WeakPolarHBondContact O-CB 3.15Å; A274-I278 VanDerWaalsContact O-CG1 3.23Å; A274-I278 WeakPolarHBondContact O-CG1 3.49Å; A274-I278 PolarHBondContact O-N 2.62Å; N275-I278 PolarHBondContact O-N 3.05Å; G276-I278 PolarHBondContact O-N 2.73Å; I278-S281 PolarHBondContact O-N 3.37Å; I278-F282 HydrophobicContact CG2-CD2 3.68Å; I278-F282 HydrophobicContact CG2-CE2 3.46Å; I278-F282 VanDerWaalsContact CG2-CE2 3.46Å; I278-F282 HydrophobicContact CG2-CG 4.34Å; I278-F282 HydrophobicContact CG2-CZ 3.98Å; I278-F282 WeakPolarHBondContact O-CB 3.3Å; I278-F282 WeakPolarHBondContact O-CG 3.49Å; I278-F282 PolarHBondContact O-N 2.82Å; I278-I297 HydrophobicContact CG2-CD1 4.16Å; I278-W308 HydrophobicContact CD1-CH2 4.31Å; I278-W308 HydrophobicContact CD1-CZ3 4.29Å; I278-L311 HydrophobicContact CG2-CD2 4.26Å; I278-A399 HydrophobicContact CG1-CB 4.15Å; I278-A399 HydrophobicContact CG2-CB 4.14Å; I278-N401 HydrophobicContact CD1-CB 4.27Å; I278-V431 HydrophobicContact CG1-CG1 4.26Å; I278-T433 HydrophobicContact CD1-CG2 4.23Å; I278-T433 HydrophobicContact CG1-CG2 3.9Å
279	L	96.5	Very high	94.8	Very high	10 Å²	10	27.3 Å²	27.3	5%	0.052	18%	0.18	C	C	.	.	H	α-helix	trans	-64	-46.6	-177.5	-176.8	62.2	0	0	0	111.6	N275 G276 S281 F282 L283 L311 A314 L315	N275-L279 WeakPolarHBondContact O-CB 3.4Å; N275-L279 PolarHBondContact O-N 3.28Å; G276-L279 PolarHBondContact O-N 2.78Å; L279-S281 PolarHBondContact O-N 2.81Å; L279-F282 PolarHBondContact O-N 3.19Å; L279-L283 HydrophobicContact CD1-CD1 4.16Å; L279-L283 HydrophobicContact CD1-CG 4.24Å; L279-L283 HydrophobicContact CG-CD1 4.05Å; L279-L283 HydrophobicContact CG-CG 4.49Å; L279-L283 WeakPolarHBondContact O-CB 3.43Å; L279-L283 VanDerWaalsContact O-CG 3.25Å; L279-L283 WeakPolarHBondContact O-CG 3.42Å; L279-L283 PolarHBondContact O-N 2.87Å; L279-L311 HydrophobicContact CB-CD1 4.11Å; L279-L311 HydrophobicContact CD1-CD1 4.37Å; L279-A314 HydrophobicContact CD2-CB 3.69Å; L279-L315 HydrophobicContact CD1-CD2 3.63Å; L279-L315 HydrophobicContact CD1-CG 4.03Å
280	E	95.8	Very high	94.1	Very high	49 Å²	49	33.3 Å²	33.3	23%	0.229	22%	0.222	C	C	.	.	H	α-helix	trans	-57.9	-49.5	174.6	-72.1	177.7	165.2	0	0	111	G276 F282 L283 E284 S535	G276-E280 WeakPolarHBondContact O-CG 3.2Å; G276-E280 PolarHBondContact O-N 2.84Å; E280-F282 VanDerWaalsContact C-N 3.34Å; E280-F282 PolarHBondContact O-N 3.1Å; E280-L283 PolarHBondContact O-N 2.98Å; E280-E284 WeakPolarHBondContact O-CG 3.17Å; E280-E284 PolarHBondContact O-N 3.13Å; E280-S535 VanDerWaalsContact OE1-CB 3.22Å; E280-S535 WeakPolarHBondContact OE1-CB 3.49Å; E280-S535 PolarHBondContact OE1-OG 3.24Å
281	S	96.1	Very high	93.4	Very high	13 Å²	13	38.9 Å²	38.9	9%	0.091	25%	0.248	C	C	.	.	H	α-helix	trans	-57.6	-45.5	178.3	-171	0	0	0	0	112.2	A277 I278 L279 A285 R430	A277-S281 VanDerWaalsContact O-CB 3.25Å; A277-S281 WeakPolarHBondContact O-CB 3.17Å; A277-S281 PolarHBondContact O-N 3.1Å; A277-S281 VanDerWaalsContact O-N 3.07Å; I278-S281 PolarHBondContact O-N 3.37Å; L279-S281 PolarHBondContact O-N 2.81Å; S281-A285 PolarHBondContact O-N 2.85Å; S281-R430 WeakPolarHBondContact O-CD 3.34Å; S281-R430 PolarHBondContact O-NE 2.81Å; S281-R430 WeakPolarHBondContact OG-CD 3.29Å; S281-R430 VanDerWaalsContact OG-CG 3.29Å; S281-R430 WeakPolarHBondContact OG-CG 3.45Å; S281-R430 PolarHBondContact OG-NE 3.45Å
282	F	95.2	Very high	92.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-68.1	-41.1	179.1	-77.2	-9.3	0	0	0	113.2	I278 L279 E280 E284 A285 A286 F295 I297 L326 A397 A399	I278-F282 HydrophobicContact CG2-CD2 3.68Å; I278-F282 HydrophobicContact CG2-CE2 3.46Å; I278-F282 VanDerWaalsContact CG2-CE2 3.46Å; I278-F282 HydrophobicContact CG2-CG 4.34Å; I278-F282 HydrophobicContact CG2-CZ 3.98Å; I278-F282 WeakPolarHBondContact O-CB 3.3Å; I278-F282 WeakPolarHBondContact O-CG 3.49Å; I278-F282 PolarHBondContact O-N 2.82Å; L279-F282 PolarHBondContact O-N 3.19Å; E280-F282 VanDerWaalsContact C-N 3.34Å; E280-F282 PolarHBondContact O-N 3.1Å; F282-E284 VanDerWaalsContact C-N 3.35Å; F282-A285 WeakPolarHBondContact O-CB 3.41Å; F282-A285 PolarHBondContact O-N 3.46Å; F282-A286 PolarHBondContact O-N 3.12Å; F282-F295 HydrophobicContact CB-CD1 4.14Å; F282-F295 HydrophobicContact CB-CD2 3.95Å; F282-F295 HydrophobicContact CB-CE1 3.9Å; F282-F295 HydrophobicContact CB-CE2 3.65Å; F282-F295 HydrophobicContact CB-CG 4.19Å; F282-F295 HydrophobicContact CB-CZ 3.65Å; F282-F295 HydrophobicContact CD1-CD1 4.08Å; F282-F295 HydrophobicContact CD1-CE1 4.49Å; F282-F295 HydrophobicContact CD1-CG 4.26Å; F282-F295 HydrophobicContact CD2-CB 3.85Å; F282-F295 HydrophobicContact CD2-CD1 4.27Å; F282-F295 AromaticContact CD2-CD2 3.63Å; F282-F295 HydrophobicContact CD2-CD2 3.63Å; F282-F295 HydrophobicContact CD2-CE2 4.2Å; F282-F295 AromaticContact CD2-CG 3.67Å; F282-F295 HydrophobicContact CD2-CG 3.67Å; F282-F295 HydrophobicContact CE1-CB 4.41Å; F282-F295 HydrophobicContact CE2-CB 3.65Å; F282-F295 HydrophobicContact CE2-CD2 4.29Å; F282-F295 HydrophobicContact CE2-CG 4.02Å; F282-F295 HydrophobicContact CG-CB 4.32Å; F282-F295 AromaticContact CG-CD1 3.93Å; F282-F295 HydrophobicContact CG-CD1 3.93Å; F282-F295 AromaticContact CG-CD2 3.92Å; F282-F295 HydrophobicContact CG-CD2 3.92Å; F282-F295 HydrophobicContact CG-CE1 4.19Å; F282-F295 HydrophobicContact CG-CE2 4.15Å; F282-F295 AromaticContact CG-CG 3.8Å; F282-F295 HydrophobicContact CG-CG 3.8Å; F282-F295 HydrophobicContact CG-CZ 4.31Å; F282-F295 HydrophobicContact CZ-CB 3.94Å; F282-F295 HydrophobicContact CZ-CG 4.43Å; F282-F295 VanDerWaalsContact O-CZ 3.31Å; F282-F295 WeakPolarHBondContact O-CZ 3.01Å; F282-I297 HydrophobicContact CE2-CD1 4.11Å; F282-I297 HydrophobicContact CE2-CG1 3.83Å; F282-I297 HydrophobicContact CZ-CG1 3.92Å; F282-L326 HydrophobicContact CE2-CD1 4.25Å; F282-A397 HydrophobicContact CD1-CB 4.11Å; F282-A397 HydrophobicContact CE1-CB 4.17Å; F282-A397 WeakPolarHBondContact CE1-O 3.49Å; F282-A399 HydrophobicContact CE1-CB 3.7Å; F282-A399 HydrophobicContact CE2-CB 4.4Å; F282-A399 HydrophobicContact CZ-CB 3.46Å; F282-A399 VanDerWaalsContact CZ-CB 3.46Å
283	L	91.6	Very high	91.9	Very high	43 Å²	43	43.1 Å²	43.1	23%	0.225	28%	0.275	C	S	.	.	H	α-helix	trans	-65.2	-39	176.3	-69.5	176.4	0	0	0	111.6	L279 E280 A285 A286 A287 R318	L279-L283 HydrophobicContact CD1-CD1 4.16Å; L279-L283 HydrophobicContact CD1-CG 4.24Å; L279-L283 HydrophobicContact CG-CD1 4.05Å; L279-L283 HydrophobicContact CG-CG 4.49Å; L279-L283 WeakPolarHBondContact O-CB 3.43Å; L279-L283 VanDerWaalsContact O-CG 3.25Å; L279-L283 WeakPolarHBondContact O-CG 3.42Å; L279-L283 PolarHBondContact O-N 2.87Å; E280-L283 PolarHBondContact O-N 2.98Å; L283-A285 VanDerWaalsContact C-N 3.32Å; L283-A285 PolarHBondContact O-N 3.03Å; L283-A286 PolarHBondContact O-N 3.07Å; L283-A287 WeakPolarHBondContact O-CB 3.22Å; L283-A287 PolarHBondContact O-N 2.99Å; L283-R318 HydrophobicContact CD1-CB 4.36Å
284	E	92.2	Very high	91.7	Very high	119 Å²	119	48.8 Å²	48.8	56%	0.556	30%	0.296	S	S	*	.	H	α-helix	trans	-62.2	-38.3	171.6	-72.5	176.1	177.9	0	0	112.3	E280 F282 A287 A288 R430	E280-E284 WeakPolarHBondContact O-CG 3.17Å; E280-E284 PolarHBondContact O-N 3.13Å; F282-E284 VanDerWaalsContact C-N 3.35Å; E284-A287 PolarHBondContact O-N 3.23Å; E284-A288 VanDerWaalsContact O-CB 3.28Å; E284-A288 WeakPolarHBondContact O-CB 3.31Å; E284-A288 PolarHBondContact O-N 3.23Å; E284-R430 VanDerWaalsContact CB-NH2 3.27Å; E284-R430 IonicContact OE2-NH2 3.51Å
285	A	90.7	Very high	91.6	Very high	4 Å²	4	48.8 Å²	48.8	3%	0.033	30%	0.296	C	S	.	.	H	α-helix	trans	-63.4	-44.7	176.2	0	0	0	0	0	111.3	S281 F282 L283 A288 S289 A397	S281-A285 PolarHBondContact O-N 2.85Å; F282-A285 WeakPolarHBondContact O-CB 3.41Å; F282-A285 PolarHBondContact O-N 3.46Å; L283-A285 VanDerWaalsContact C-N 3.32Å; L283-A285 PolarHBondContact O-N 3.03Å; A285-A288 PolarHBondContact O-N 2.76Å; A285-S289 PolarHBondContact O-N 2.75Å; A285-A397 HydrophobicContact CB-CB 4.05Å
286	A	89.5	Confident	91.5	Very high	40 Å²	40	48.4 Å²	48.4	33%	0.331	29%	0.294	S	S	.	.	H	α-helix	trans	-64	-41.6	176.8	0	0	0	0	0	111.8	F282 L283 A288 S289 Q293 F295	F282-A286 PolarHBondContact O-N 3.12Å; L283-A286 PolarHBondContact O-N 3.07Å; A286-A288 VanDerWaalsContact C-N 3.35Å; A286-A288 PolarHBondContact O-N 2.93Å; A286-S289 PolarHBondContact O-N 3.35Å; A286-Q293 HydrophobicContact CB-CG 4.4Å; A286-F295 HydrophobicContact CB-CZ 4.18Å
287	A	88.7	Confident	91.6	Very high	90 Å²	90	48 Å²	48	74%	0.744	29%	0.289	S	S	*	.	H	α-helix	trans	-69.5	-30.1	178.8	0	0	0	0	0	113.5	L283 E284 S289	L283-A287 WeakPolarHBondContact O-CB 3.22Å; L283-A287 PolarHBondContact O-N 2.99Å; E284-A287 PolarHBondContact O-N 3.23Å; A287-S289 VanDerWaalsContact C-N 3.34Å
288	A	88.5	Confident	91.6	Very high	87 Å²	87	47.6 Å²	47.6	72%	0.719	29%	0.286	S	S	*	.	H	α-helix	trans	-81.5	-9.7	-179	0	0	0	0	0	114.1	E284 A285 A286	E284-A288 VanDerWaalsContact O-CB 3.28Å; E284-A288 WeakPolarHBondContact O-CB 3.31Å; E284-A288 PolarHBondContact O-N 3.23Å; A285-A288 PolarHBondContact O-N 2.76Å; A286-A288 VanDerWaalsContact C-N 3.35Å; A286-A288 PolarHBondContact O-N 2.93Å
289	S	85.3	Confident	91.6	Very high	43 Å²	43	47.6 Å²	47.6	30%	0.301	29%	0.286	S	S	.	.			trans	-117.6	140.9	-175	-173.9	0	0	0	0	111.7	A285 A286 A287 E291 Q293	A285-S289 PolarHBondContact O-N 2.75Å; A286-S289 PolarHBondContact O-N 3.35Å; A287-S289 VanDerWaalsContact C-N 3.34Å; S289-E291 VanDerWaalsContact C-N 3.29Å; S289-E291 PolarHBondContact OG-N 2.62Å; S289-E291 VanDerWaalsContact OG-N 3.14Å; S289-E291 PolarHBondContact OG-O 3.35Å; S289-Q293 PolarHBondContact OG-NE2 2.94Å
290	S	82.9	Confident	91.6	Very high	126 Å²	126	47.2 Å²	47.2	88%	0.881	28%	0.284	S	S	*	.	S	Bend	trans	-78.9	-15.9	169	55.3	0	0	0	0	112.9
291	E	82.8	Confident	91.6	Very high	117 Å²	117	45.8 Å²	45.8	55%	0.547	28%	0.279	S	S	.	.	S	Bend	trans	-98.2	142.3	-178	-66.6	-175.8	176.7	0	0	111.3	S289 Q293 T395	S289-E291 VanDerWaalsContact C-N 3.29Å; S289-E291 PolarHBondContact OG-N 2.62Å; S289-E291 VanDerWaalsContact OG-N 3.14Å; S289-E291 PolarHBondContact OG-O 3.35Å; E291-Q293 PolarHBondContact O-N 3.04Å; E291-Q293 VanDerWaalsContact O-N 3.07Å; E291-Q293 PolarHBondContact O-NE2 2.95Å; E291-T395 HydrophobicContact CB-CG2 4.45Å; E291-T395 VanDerWaalsContact OE2-CG2 3.26Å; E291-T395 WeakPolarHBondContact OE2-CG2 3.34Å
292	P	80.5	Confident	91.3	Very high	106 Å²	106	48.5 Å²	48.5	69%	0.688	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-57.6	118.1	178.2	24.2	-33.2	0	0	0	110
293	Q	86.1	Confident	91.1	Very high	28 Å²	28	49.1 Å²	49.1	13%	0.131	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-77.4	145.1	179.8	-63.4	-59.5	-74.3	0	0	110.5	A286 S289 E291 F295 P324 T395	A286-Q293 HydrophobicContact CB-CG 4.4Å; S289-Q293 PolarHBondContact OG-NE2 2.94Å; E291-Q293 PolarHBondContact O-N 3.04Å; E291-Q293 VanDerWaalsContact O-N 3.07Å; E291-Q293 PolarHBondContact O-NE2 2.95Å; Q293-F295 HydrophobicContact CB-CD1 4.28Å; Q293-F295 HydrophobicContact CB-CE1 3.67Å; Q293-F295 HydrophobicContact CB-CZ 4.47Å; Q293-P324 WeakPolarHBondContact O-CB 3.48Å; Q293-T395 PolarHBondContact OE1-O 3.5Å; Q293-T395 VanDerWaalsContact OE1-O 3.09Å
294	R	92.8	Very high	91.1	Very high	118 Å²	118	50.4 Å²	50.4	45%	0.445	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	138.4	164.8	-70.1	-175.8	170.8	-162.4	2.5	108.5	H325 G392 T395 T396 A397	R294-H325 HydrophobicContact CG-CB 4.36Å; R294-G392 VanDerWaalsContact CD-CA 3.49Å; R294-T395 PolarHBondContact N-O 3.39Å; R294-T396 CarbonylContact O-C 3.49Å; R294-T396 VanDerWaalsContact O-CA 3.27Å; R294-T396 WeakPolarHBondContact O-CA 3.34Å; R294-A397 PolarHBondContact O-N 3.48Å
295	F	95.7	Very high	91.3	Very high	1 Å²	1	45 Å²	45	0%	0.004	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	138.2	178.1	-59.1	-24.1	0	0	0	109.6	F282 A286 Q293 L315 P324 H325 L326 S327 A397	F282-F295 HydrophobicContact CB-CD1 4.14Å; F282-F295 HydrophobicContact CB-CD2 3.95Å; F282-F295 HydrophobicContact CB-CE1 3.9Å; F282-F295 HydrophobicContact CB-CE2 3.65Å; F282-F295 HydrophobicContact CB-CG 4.19Å; F282-F295 HydrophobicContact CB-CZ 3.65Å; F282-F295 HydrophobicContact CD1-CD1 4.08Å; F282-F295 HydrophobicContact CD1-CE1 4.49Å; F282-F295 HydrophobicContact CD1-CG 4.26Å; F282-F295 HydrophobicContact CD2-CB 3.85Å; F282-F295 HydrophobicContact CD2-CD1 4.27Å; F282-F295 AromaticContact CD2-CD2 3.63Å; F282-F295 HydrophobicContact CD2-CD2 3.63Å; F282-F295 HydrophobicContact CD2-CE2 4.2Å; F282-F295 AromaticContact CD2-CG 3.67Å; F282-F295 HydrophobicContact CD2-CG 3.67Å; F282-F295 HydrophobicContact CE1-CB 4.41Å; F282-F295 HydrophobicContact CE2-CB 3.65Å; F282-F295 HydrophobicContact CE2-CD2 4.29Å; F282-F295 HydrophobicContact CE2-CG 4.02Å; F282-F295 HydrophobicContact CG-CB 4.32Å; F282-F295 AromaticContact CG-CD1 3.93Å; F282-F295 HydrophobicContact CG-CD1 3.93Å; F282-F295 AromaticContact CG-CD2 3.92Å; F282-F295 HydrophobicContact CG-CD2 3.92Å; F282-F295 HydrophobicContact CG-CE1 4.19Å; F282-F295 HydrophobicContact CG-CE2 4.15Å; F282-F295 AromaticContact CG-CG 3.8Å; F282-F295 HydrophobicContact CG-CG 3.8Å; F282-F295 HydrophobicContact CG-CZ 4.31Å; F282-F295 HydrophobicContact CZ-CB 3.94Å; F282-F295 HydrophobicContact CZ-CG 4.43Å; F282-F295 VanDerWaalsContact O-CZ 3.31Å; F282-F295 WeakPolarHBondContact O-CZ 3.01Å; A286-F295 HydrophobicContact CB-CZ 4.18Å; Q293-F295 HydrophobicContact CB-CD1 4.28Å; Q293-F295 HydrophobicContact CB-CE1 3.67Å; Q293-F295 HydrophobicContact CB-CZ 4.47Å; F295-L315 HydrophobicContact CD2-CD2 4.2Å; F295-L315 HydrophobicContact CE2-CD2 3.99Å; F295-P324 HydrophobicContact CD2-CB 4.03Å; F295-P324 HydrophobicContact CD2-CG 3.68Å; F295-P324 HydrophobicContact CE2-CB 3.72Å; F295-P324 HydrophobicContact CE2-CG 3.09Å; F295-P324 HydrophobicContact CZ-CB 3.99Å; F295-P324 HydrophobicContact CZ-CG 3.65Å; F295-H325 PolarHBondContact N-O 3.43Å; F295-L326 HydrophobicContact CB-CD1 3.78Å; F295-L326 WeakPolarHBondContact O-CA 3.45Å; F295-S327 PolarHBondContact O-N 3.45Å; F295-A397 HydrophobicContact CD1-CB 4.05Å; F295-A397 HydrophobicContact CE1-CB 4.45Å
296	H	97.6	Very high	91.6	Very high	5 Å²	5	46.1 Å²	46.1	2%	0.023	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	129.7	172.4	-158.9	158.1	0	0	0	109.6	S327 T329 L389 T396 A397 L398 A399	H296-S327 CarbonylContact C-O 3.58Å; H296-S327 WeakPolarHBondContact CA-O 3.35Å; H296-S327 PolarHBondContact CD2-O 3.35Å; H296-T329 PolarHBondContact NE2-OG1 2.96Å; H296-L389 WeakPolarHBondContact ND1-CA 3.15Å; H296-L389 PolarHBondContact ND1-O 2.87Å; H296-T396 HydrophobicContact CB-CG2 3.68Å; H296-A397 PolarHBondContact N-O 3.4Å; H296-L398 HydrophobicContact CB-CD1 4.2Å; H296-L398 CarbonylContact O-C 3.56Å; H296-L398 WeakPolarHBondContact O-CA 3.42Å; H296-A399 PolarHBondContact O-N 2.95Å
297	I	98.3	Very high	92	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	121.3	171.5	-57.9	172.8	0	0	0	109.4	I278 F282 D299 W308 L311 L326 S327 I328 T329 A399 N401	I278-I297 HydrophobicContact CG2-CD1 4.16Å; F282-I297 HydrophobicContact CE2-CD1 4.11Å; F282-I297 HydrophobicContact CE2-CG1 3.83Å; F282-I297 HydrophobicContact CZ-CG1 3.92Å; I297-D299 HydrophobicContact CG2-CB 4.48Å; I297-W308 HydrophobicContact CD1-CE3 4.07Å; I297-W308 HydrophobicContact CD1-CH2 4.27Å; I297-W308 HydrophobicContact CD1-CZ3 3.71Å; I297-W308 HydrophobicContact CG2-CH2 3.59Å; I297-W308 HydrophobicContact CG2-CZ2 3.89Å; I297-W308 HydrophobicContact CG2-CZ3 4.14Å; I297-L311 HydrophobicContact CD1-CD2 3.39Å; I297-L326 HydrophobicContact CD1-CD1 3.87Å; I297-L326 HydrophobicContact CG1-CD1 3.98Å; I297-S327 PolarHBondContact N-O 2.91Å; I297-I328 HydrophobicContact CB-CG1 4.29Å; I297-I328 HydrophobicContact CD1-CG1 4.45Å; I297-I328 WeakPolarHBondContact O-CA 3.43Å; I297-T329 PolarHBondContact O-N 3.36Å; I297-A399 CarbonylContact C-O 3.45Å; I297-A399 WeakPolarHBondContact CA-O 3.12Å; I297-A399 HydrophobicContact CG1-CB 4.32Å; I297-N401 HydrophobicContact CG2-CB 4.24Å
298	L	98.2	Very high	92.5	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	109.2	160.4	175.4	62.3	0	0	0	108.3	L300 T329 V331 L384 L387 L389 A399 I400 N401 L427	L298-L300 HydrophobicContact CD1-CD2 4.02Å; L298-L300 HydrophobicContact CD2-CD2 4.41Å; L298-L300 HydrophobicContact CG-CD2 4.06Å; L298-L300 HydrophobicContact CG-CG 4.22Å; L298-T329 WeakPolarHBondContact CA-O 3.41Å; L298-T329 HydrophobicContact CD1-CG2 4.37Å; L298-V331 HydrophobicContact CD1-CG2 3.97Å; L298-L384 HydrophobicContact CD2-CD2 4.13Å; L298-L387 HydrophobicContact CD1-CD1 3.73Å; L298-L387 HydrophobicContact CD2-CD1 4.39Å; L298-L389 HydrophobicContact CB-CD1 4.12Å; L298-L389 HydrophobicContact CD1-CD1 4.47Å; L298-L389 HydrophobicContact CD1-CD2 4.4Å; L298-L389 HydrophobicContact CD2-CD1 3.97Å; L298-L389 HydrophobicContact CG-CD1 4.41Å; L298-A399 PolarHBondContact N-O 3.21Å; L298-I400 HydrophobicContact CB-CG1 4.28Å; L298-I400 HydrophobicContact CD2-CG1 4.34Å; L298-I400 HydrophobicContact CD2-CG2 4.22Å; L298-N401 PolarHBondContact O-N 3.16Å; L298-L427 HydrophobicContact CD2-CD1 4.13Å
299	D	98.3	Very high	92.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	107.9	-178.9	173.7	38.7	0	0	0	111	I297 S301 W308 I328 T329 T330 V331 N401	I297-D299 HydrophobicContact CG2-CB 4.48Å; D299-S301 VanDerWaalsContact CG-OG 3.3Å; D299-S301 WeakPolarHBondContact OD1-CB 3.15Å; D299-S301 PolarHBondContact OD1-OG 3.19Å; D299-S301 PolarHBondContact OD2-OG 2.91Å; D299-S301 VanDerWaalsContact OD2-OG 3.12Å; D299-W308 HydrophobicContact CB-CZ2 3.61Å; D299-W308 VanDerWaalsContact CG-CZ2 3.45Å; D299-W308 WeakPolarHBondContact OD1-CZ2 3.37Å; D299-W308 PolarHBondContact OD2-NE1 3.45Å; D299-I328 HydrophobicContact CB-CG2 4.23Å; D299-T329 PolarHBondContact N-O 3.03Å; D299-T330 CarbonylContact O-C 3.54Å; D299-T330 WeakPolarHBondContact O-CA 3.42Å; D299-T330 PolarHBondContact OD2-OG1 3.45Å; D299-V331 PolarHBondContact O-N 3.31Å; D299-N401 PolarHBondContact OD1-ND2 2.99Å
300	L	97.2	Very high	93.4	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.016	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	81.8	172.3	-52.1	-177.7	0	0	0	107.8	L298 V331 L379 N401 L403 S405 F420 L424	L298-L300 HydrophobicContact CD1-CD2 4.02Å; L298-L300 HydrophobicContact CD2-CD2 4.41Å; L298-L300 HydrophobicContact CG-CD2 4.06Å; L298-L300 HydrophobicContact CG-CG 4.22Å; L300-V331 HydrophobicContact CD2-CB 3.56Å; L300-V331 HydrophobicContact CD2-CG1 4.36Å; L300-V331 HydrophobicContact CD2-CG2 3.42Å; L300-V331 VanDerWaalsContact CD2-CG2 3.42Å; L300-L379 HydrophobicContact CD1-CD2 4.38Å; L300-L379 HydrophobicContact CD2-CD1 4.44Å; L300-N401 PolarHBondContact N-O 3.09Å; L300-L403 PolarHBondContact O-N 3.5Å; L300-S405 WeakPolarHBondContact O-CB 3.41Å; L300-S405 PolarHBondContact O-OG 3.12Å; L300-F420 HydrophobicContact CD1-CE1 4.21Å; L300-F420 HydrophobicContact CD1-CZ 3.8Å; L300-L424 HydrophobicContact CD1-CD2 4.36Å
301	S	94.9	Very high	94.1	Very high	18 Å²	18	31 Å²	31	13%	0.126	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	165.9	-176.7	73.1	0	0	0	0	114	D299 L403	D299-S301 VanDerWaalsContact CG-OG 3.3Å; D299-S301 WeakPolarHBondContact OD1-CB 3.15Å; D299-S301 PolarHBondContact OD1-OG 3.19Å; D299-S301 PolarHBondContact OD2-OG 2.91Å; D299-S301 VanDerWaalsContact OD2-OG 3.12Å; S301-L403 WeakPolarHBondContact CA-O 3.47Å
302	N	89.4	Confident	94.7	Very high	70 Å²	70	25.4 Å²	25.4	37%	0.374	14%	0.135	S	C	.	.	S	Bend	trans	-115.5	17.3	172.9	60.9	19	0	0	0	112.9	N404 R407	N302-N404 PolarHBondContact ND2-O 3.36Å; N302-R407 PolarHBondContact ND2-NH2 2.82Å
303	T	92.3	Very high	95.4	Very high	14 Å²	14	22.8 Å²	22.8	9%	0.086	11%	0.113	C	C	.	.	S	Bend	trans	-99.2	18	-175.5	50.9	0	0	0	0	114	H271 C305 T306 L403	H271-T303 PolarHBondContact NE2-OG1 3.3Å; T303-C305 PolarHBondContact O-N 3.11Å; T303-C305 VanDerWaalsContact O-N 3.09Å; T303-T306 WeakPolarHBondContact O-CG2 3.24Å; T303-T306 PolarHBondContact O-N 3.13Å; T303-T306 VanDerWaalsContact O-N 3.14Å; T303-T306 PolarHBondContact O-OG1 3.49Å; T303-L403 HydrophobicContact CG2-CD2 3.48Å; T303-L403 VanDerWaalsContact CG2-CD2 3.48Å
304	F	92.2	Very high	95.8	Very high	69 Å²	69	22.7 Å²	22.7	30%	0.303	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	42.1	173.7	-61.4	-80.2	0	0	0	113.6	T253 T306 V349 M350 I353	T253-F304 HydrophobicContact CG2-CB 4.22Å; T253-F304 HydrophobicContact CG2-CD1 3.63Å; T253-F304 HydrophobicContact CG2-CD2 3.35Å; T253-F304 HydrophobicContact CG2-CE1 3.71Å; T253-F304 HydrophobicContact CG2-CE2 3.44Å; T253-F304 VanDerWaalsContact CG2-CE2 3.44Å; T253-F304 HydrophobicContact CG2-CG 3.44Å; T253-F304 VanDerWaalsContact CG2-CG 3.44Å; T253-F304 HydrophobicContact CG2-CZ 3.61Å; F304-T306 PolarHBondContact O-N 3.37Å; F304-T306 VanDerWaalsContact O-N 3.11Å; F304-V349 HydrophobicContact CD1-CG1 4.25Å; F304-V349 HydrophobicContact CE1-CG1 4.42Å; F304-M350 HydrophobicContact CD1-SD 4.14Å; F304-I353 HydrophobicContact CB-CD1 3.82Å; F304-I353 HydrophobicContact CD1-CD1 4.08Å; F304-I353 HydrophobicContact CG-CD1 4.44Å
305	C	96.4	Very high	95.9	Very high	5 Å²	5	17.1 Å²	17.1	3%	0.034	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	17.2	177.2	-55.9	0	0	0	0	116.1	T303 Q307 W308 P309 I353	T303-C305 PolarHBondContact O-N 3.11Å; T303-C305 VanDerWaalsContact O-N 3.09Å; C305-Q307 PolarHBondContact O-N 3.17Å; C305-Q307 VanDerWaalsContact O-N 3.16Å; C305-W308 PolarHBondContact O-N 2.69Å; C305-P309 VanDerWaalsContact O-CD 3.27Å; C305-P309 WeakPolarHBondContact O-CD 3.33Å; C305-I353 HydrophobicContact CB-CG2 3.77Å
306	T	96.7	Very high	95.7	Very high	29 Å²	29	18.2 Å²	18.2	18%	0.178	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-17.6	177.1	57.5	0	0	0	0	113.7	A257 L258 Q261 H271 T303 F304	A257-T306 HydrophobicContact CB-CG2 4.31Å; L258-T306 HydrophobicContact CD2-CG2 4.27Å; Q261-T306 PolarHBondContact NE2-OG1 3.48Å; H271-T306 PolarHBondContact CE1-OG1 3.48Å; H271-T306 VanDerWaalsContact CE1-OG1 3.31Å; T303-T306 WeakPolarHBondContact O-CG2 3.24Å; T303-T306 PolarHBondContact O-N 3.13Å; T303-T306 VanDerWaalsContact O-N 3.14Å; T303-T306 PolarHBondContact O-OG1 3.49Å; F304-T306 PolarHBondContact O-N 3.37Å; F304-T306 VanDerWaalsContact O-N 3.11Å
307	Q	97.6	Very high	95.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-38.2	177.2	-178.9	171	-9.3	0	0	113	H271 N275 C305 T310 N401	H271-Q307 HydrophobicContact CB-CB 4.35Å; H271-Q307 HydrophobicContact CB-CG 3.99Å; H271-Q307 VanDerWaalsContact CD2-CB 3.49Å; H271-Q307 WeakPolarHBondContact CD2-CB 3.49Å; H271-Q307 PolarHBondContact CD2-OE1 2.86Å; N275-Q307 PolarHBondContact ND2-O 3.47Å; N275-Q307 WeakPolarHBondContact OD1-CG 3.37Å; N275-Q307 PolarHBondContact OD1-NE2 3.11Å; C305-Q307 PolarHBondContact O-N 3.17Å; C305-Q307 VanDerWaalsContact O-N 3.16Å; Q307-T310 PolarHBondContact O-OG1 2.57Å; Q307-N401 PolarHBondContact NE2-OD1 3.17Å; Q307-N401 PolarHBondContact OE1-ND2 3.25Å
308	W	98.2	Very high	94.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-79.1	-29.9	-161.8	-55.2	129.7	0	0	0	115.9	I278 I297 D299 C305 T310 L311 L312 I328 I357 N401	I278-W308 HydrophobicContact CD1-CH2 4.31Å; I278-W308 HydrophobicContact CD1-CZ3 4.29Å; I297-W308 HydrophobicContact CD1-CE3 4.07Å; I297-W308 HydrophobicContact CD1-CH2 4.27Å; I297-W308 HydrophobicContact CD1-CZ3 3.71Å; I297-W308 HydrophobicContact CG2-CH2 3.59Å; I297-W308 HydrophobicContact CG2-CZ2 3.89Å; I297-W308 HydrophobicContact CG2-CZ3 4.14Å; D299-W308 HydrophobicContact CB-CZ2 3.61Å; D299-W308 VanDerWaalsContact CG-CZ2 3.45Å; D299-W308 WeakPolarHBondContact OD1-CZ2 3.37Å; D299-W308 PolarHBondContact OD2-NE1 3.45Å; C305-W308 PolarHBondContact O-N 2.69Å; W308-T310 VanDerWaalsContact C-N 3.28Å; W308-T310 PolarHBondContact O-N 3.36Å; W308-L311 HydrophobicContact CE3-CB 4.38Å; W308-L311 HydrophobicContact CE3-CD2 3.75Å; W308-L311 HydrophobicContact CZ3-CD2 3.8Å; W308-L311 PolarHBondContact O-N 3.22Å; W308-L311 VanDerWaalsContact O-N 3.12Å; W308-L312 WeakPolarHBondContact O-CG 3.48Å; W308-L312 PolarHBondContact O-N 3.37Å; W308-I328 HydrophobicContact CB-CD1 3.75Å; W308-I328 HydrophobicContact CD2-CD1 3.82Å; W308-I328 HydrophobicContact CE3-CD1 4.25Å; W308-I328 HydrophobicContact CG-CD1 3.56Å; W308-I357 HydrophobicContact CB-CD1 3.58Å; W308-I357 HydrophobicContact CG-CD1 4.39Å; W308-N401 HydrophobicContact CH2-CB 3.74Å; W308-N401 HydrophobicContact CZ2-CB 4.14Å
309	P	97.2	Very high	93.8	Very high	19 Å²	19	30 Å²	30	12%	0.123	17%	0.165	C	C	.	.	H	α-helix	trans	-56.9	-37	175.7	-31	38.3	0	0	0	114.5	L4 C305 L312 E313 F360	L4-P309 HydrophobicContact CD1-CB 3.57Å; L4-P309 HydrophobicContact CD2-CB 3.64Å; L4-P309 HydrophobicContact CD2-CG 4.2Å; L4-P309 HydrophobicContact CG-CB 4.13Å; C305-P309 VanDerWaalsContact O-CD 3.27Å; C305-P309 WeakPolarHBondContact O-CD 3.33Å; P309-L312 PolarHBondContact O-N 3.39Å; P309-E313 PolarHBondContact O-N 2.94Å; P309-E313 VanDerWaalsContact O-N 3.15Å; P309-F360 HydrophobicContact CB-CD1 4.25Å; P309-F360 HydrophobicContact CB-CE1 3.93Å; P309-F360 HydrophobicContact CB-CZ 4.41Å; P309-F360 WeakPolarHBondContact O-CE1 3.27Å
310	T	95.9	Very high	92.3	Very high	47 Å²	47	36 Å²	36	29%	0.288	20%	0.201	S	C	.	.	H	α-helix	trans	-73.4	-30.5	177.3	53.5	0	0	0	0	112.5	L4 N275 Q307 W308 A314	L4-T310 HydrophobicContact CD1-CG2 3.97Å; N275-T310 PolarHBondContact ND2-OG1 2.93Å; N275-T310 VanDerWaalsContact ND2-OG1 3.08Å; Q307-T310 PolarHBondContact O-OG1 2.57Å; W308-T310 VanDerWaalsContact C-N 3.28Å; W308-T310 PolarHBondContact O-N 3.36Å; T310-A314 WeakPolarHBondContact O-CB 3.36Å; T310-A314 PolarHBondContact O-N 3.1Å
311	L	97.3	Very high	91	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-69.1	-40.7	172.9	-175.2	65.2	0	0	0	111.7	N275 I278 L279 I297 W308 E313 A314 L315	N275-L311 HydrophobicContact CB-CD1 4.27Å; I278-L311 HydrophobicContact CG2-CD2 4.26Å; L279-L311 HydrophobicContact CB-CD1 4.11Å; L279-L311 HydrophobicContact CD1-CD1 4.37Å; I297-L311 HydrophobicContact CD1-CD2 3.39Å; W308-L311 HydrophobicContact CE3-CB 4.38Å; W308-L311 HydrophobicContact CE3-CD2 3.75Å; W308-L311 HydrophobicContact CZ3-CD2 3.8Å; W308-L311 PolarHBondContact O-N 3.22Å; W308-L311 VanDerWaalsContact O-N 3.12Å; L311-E313 VanDerWaalsContact C-N 3.32Å; L311-E313 PolarHBondContact O-N 3.31Å; L311-A314 PolarHBondContact O-N 2.74Å; L311-L315 HydrophobicContact CG-CD1 4.26Å; L311-L315 WeakPolarHBondContact O-CG 3.47Å; L311-L315 PolarHBondContact O-N 3.41Å
312	L	97	Very high	90.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-42	174.8	-73.5	169.5	0	0	0	111.7	W308 P309 L315 A316 L326 I357 F360 A361 V366 F368	W308-L312 WeakPolarHBondContact O-CG 3.48Å; W308-L312 PolarHBondContact O-N 3.37Å; P309-L312 PolarHBondContact O-N 3.39Å; L312-L315 PolarHBondContact O-N 2.99Å; L312-A316 WeakPolarHBondContact O-CB 3.44Å; L312-A316 PolarHBondContact O-N 3.24Å; L312-L326 HydrophobicContact CD2-CD2 3.82Å; L312-I357 HydrophobicContact CD1-CD1 4.25Å; L312-I357 HydrophobicContact CD1-CG1 3.8Å; L312-F360 HydrophobicContact CB-CD1 4.35Å; L312-F360 HydrophobicContact CB-CE1 4.1Å; L312-F360 HydrophobicContact CD1-CD1 3.88Å; L312-F360 HydrophobicContact CD1-CE1 4.41Å; L312-A361 HydrophobicContact CD1-CB 4.01Å; L312-A361 HydrophobicContact CD2-CB 4.06Å; L312-V366 HydrophobicContact CD2-CB 4.1Å; L312-V366 HydrophobicContact CD2-CG1 3.82Å; L312-V366 HydrophobicContact CD2-CG2 4.22Å; L312-F368 HydrophobicContact CD1-CE2 4.48Å; L312-F368 HydrophobicContact CD2-CD2 3.81Å; L312-F368 HydrophobicContact CD2-CE2 4.08Å
313	E	95.1	Very high	90.4	Very high	51 Å²	51	46.1 Å²	46.1	24%	0.238	26%	0.256	C	S	.	.	H	α-helix	trans	-62.6	-43.2	174.1	-174.9	176.7	-158.7	0	0	112	T3 P309 L311 A316 T317 M364	T3-E313 PolarHBondContact OG1-OE1 3.14Å; P309-E313 PolarHBondContact O-N 2.94Å; P309-E313 VanDerWaalsContact O-N 3.15Å; L311-E313 VanDerWaalsContact C-N 3.32Å; L311-E313 PolarHBondContact O-N 3.31Å; E313-A316 PolarHBondContact O-N 2.94Å; E313-T317 WeakPolarHBondContact O-CG2 3.41Å; E313-T317 PolarHBondContact O-N 2.84Å; E313-T317 PolarHBondContact O-OG1 2.99Å; E313-M364 HydrophobicContact CB-CE 4.3Å; E313-M364 HydrophobicContact CG-CE 4.13Å
314	A	94.2	Very high	90.3	Very high	25 Å²	25	46.4 Å²	46.4	21%	0.207	26%	0.258	C	S	.	.	H	α-helix	trans	-66.7	-39	178.2	0	0	0	0	0	112.9	L279 T310 L311 T317 R318	L279-A314 HydrophobicContact CD2-CB 3.69Å; T310-A314 WeakPolarHBondContact O-CB 3.36Å; T310-A314 PolarHBondContact O-N 3.1Å; L311-A314 PolarHBondContact O-N 2.74Å; A314-T317 PolarHBondContact O-N 2.91Å; A314-T317 PolarHBondContact O-OG1 3.2Å; A314-R318 WeakPolarHBondContact O-CB 3.44Å; A314-R318 WeakPolarHBondContact O-CG 3.36Å; A314-R318 PolarHBondContact O-N 3.46Å; A314-R318 VanDerWaalsContact O-N 3.11Å
315	L	93.4	Very high	90.4	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-65	-45.1	175.3	-77.9	168.4	0	0	0	111.8	L279 F295 L311 L312 T317 S319 L326	L279-L315 HydrophobicContact CD1-CD2 3.63Å; L279-L315 HydrophobicContact CD1-CG 4.03Å; F295-L315 HydrophobicContact CD2-CD2 4.2Å; F295-L315 HydrophobicContact CE2-CD2 3.99Å; L311-L315 HydrophobicContact CG-CD1 4.26Å; L311-L315 WeakPolarHBondContact O-CG 3.47Å; L311-L315 PolarHBondContact O-N 3.41Å; L312-L315 PolarHBondContact O-N 2.99Å; L315-T317 PolarHBondContact O-N 2.89Å; L315-S319 PolarHBondContact O-N 3.45Å; L315-S319 PolarHBondContact O-OG 3.15Å; L315-L326 HydrophobicContact CD1-CB 4.44Å; L315-L326 HydrophobicContact CD1-CD2 3.74Å
316	A	92.5	Very high	90.4	Very high	25 Å²	25	45.3 Å²	45.3	21%	0.207	25%	0.253	C	S	.	.	H	α-helix	trans	-62.3	-30	179	0	0	0	0	0	113.2	L312 E313 M364 V366	L312-A316 WeakPolarHBondContact O-CB 3.44Å; L312-A316 PolarHBondContact O-N 3.24Å; E313-A316 PolarHBondContact O-N 2.94Å; A316-M364 HydrophobicContact CB-CB 4.26Å; A316-M364 HydrophobicContact CB-CE 4.09Å; A316-M364 WeakPolarHBondContact CB-O 3.23Å; A316-V366 HydrophobicContact CB-CG2 3.95Å
317	T	91.1	Very high	90.4	Very high	103 Å²	103	44.8 Å²	44.8	63%	0.632	25%	0.25	S	S	*	.	H	α-helix	trans	-94.4	-21.5	-175.3	50.8	0	0	0	0	114.4	E313 A314 L315	E313-T317 WeakPolarHBondContact O-CG2 3.41Å; E313-T317 PolarHBondContact O-N 2.84Å; E313-T317 PolarHBondContact O-OG1 2.99Å; A314-T317 PolarHBondContact O-N 2.91Å; A314-T317 PolarHBondContact O-OG1 3.2Å; L315-T317 PolarHBondContact O-N 2.89Å
318	R	85.8	Confident	90.4	Very high	126 Å²	126	44.8 Å²	44.8	48%	0.475	25%	0.25	S	S	.	.	H	α-helix	trans	-99	-17.8	-177.6	-66.4	-179.4	80.4	138	-2	114.3	L283 A314	L283-R318 HydrophobicContact CD1-CB 4.36Å; A314-R318 WeakPolarHBondContact O-CB 3.44Å; A314-R318 WeakPolarHBondContact O-CG 3.36Å; A314-R318 PolarHBondContact O-N 3.46Å; A314-R318 VanDerWaalsContact O-N 3.11Å
319	S	76.4	Confident	90.4	Very high	24 Å²	24	45 Å²	45	17%	0.168	25%	0.252	C	S	.	.			trans	-78.4	118.2	172.8	-66.6	0	0	0	0	110	L315 P324	L315-S319 PolarHBondContact O-N 3.45Å; L315-S319 PolarHBondContact O-OG 3.15Å; S319-P324 VanDerWaalsContact OG-CD 3.27Å; S319-P324 WeakPolarHBondContact OG-CD 3.31Å
320	T	66.6	Low	90.4	Very high	124 Å²	124	44.3 Å²	44.3	76%	0.761	25%	0.247	S	C	*	.	S	Bend	trans	-74.4	-34.1	-172.4	52.1	0	0	0	0	114
321	D	69.8	Low	90.5	Very high	157 Å²	157	42.2 Å²	42.2	84%	0.84	23%	0.234	S	C	*	.	S	Bend	trans	-133.4	-36.2	-170.2	-57.7	-68.2	0	0	0	114.1
322	D	83.1	Confident	90.3	Very high	122 Å²	122	42.8 Å²	42.8	65%	0.652	24%	0.238	S	C	*	.			trans	-141.3	120.1	177.7	-169.4	18.5	0	0	0	110.5	P324	D322-P324 WeakPolarHBondContact O-CD 3.34Å
323	T	89.7	Confident	89.9	Confident	26 Å²	26	45.2 Å²	45.2	16%	0.16	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-79.7	117.4	179.2	-55.4	0	0	0	0	109.2	V366 P367	T323-V366 HydrophobicContact CG2-CB 4.34Å; T323-V366 HydrophobicContact CG2-CG1 4.14Å; T323-V366 HydrophobicContact CG2-CG2 4.08Å; T323-P367 WeakPolarHBondContact O-CD 3.49Å
324	P	90.4	Very high	89.4	Confident	20 Å²	20	43.3 Å²	43.3	13%	0.13	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-64.8	151.5	-175.7	25.5	-32.6	0	0	0	111.6	Q293 F295 S319 D322 L326	Q293-P324 WeakPolarHBondContact O-CB 3.48Å; F295-P324 HydrophobicContact CD2-CB 4.03Å; F295-P324 HydrophobicContact CD2-CG 3.68Å; F295-P324 HydrophobicContact CE2-CB 3.72Å; F295-P324 HydrophobicContact CE2-CG 3.09Å; F295-P324 HydrophobicContact CZ-CB 3.99Å; F295-P324 HydrophobicContact CZ-CG 3.65Å; S319-P324 VanDerWaalsContact OG-CD 3.27Å; S319-P324 WeakPolarHBondContact OG-CD 3.31Å; D322-P324 WeakPolarHBondContact O-CD 3.34Å; P324-L326 PolarHBondContact O-N 2.87Å
325	H	93.7	Very high	88.7	Confident	50 Å²	50	44 Å²	44	23%	0.231	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	131.1	175.8	178.4	-81.7	0	0	0	111.1	R294 F295 S327 P367 S369	R294-H325 HydrophobicContact CG-CB 4.36Å; F295-H325 PolarHBondContact N-O 3.43Å; H325-S327 PolarHBondContact CE1-OG 3.15Å; H325-P367 CarbonylContact C-O 3.57Å; H325-P367 VanDerWaalsContact CA-O 3.29Å; H325-P367 WeakPolarHBondContact CA-O 3.35Å; H325-P367 HydrophobicContact CB-CB 4.13Å; H325-S369 PolarHBondContact CE1-OG 3.17Å
326	L	96.1	Very high	87.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.5	174.7	178.7	65.8	0	0	0	111.6	F282 F295 I297 L312 L315 P324 I328 V366 P367 F368 S369	F282-L326 HydrophobicContact CE2-CD1 4.25Å; F295-L326 HydrophobicContact CB-CD1 3.78Å; F295-L326 WeakPolarHBondContact O-CA 3.45Å; I297-L326 HydrophobicContact CD1-CD1 3.87Å; I297-L326 HydrophobicContact CG1-CD1 3.98Å; L312-L326 HydrophobicContact CD2-CD2 3.82Å; L315-L326 HydrophobicContact CD1-CB 4.44Å; L315-L326 HydrophobicContact CD1-CD2 3.74Å; P324-L326 PolarHBondContact O-N 2.87Å; L326-I328 HydrophobicContact CD1-CG1 4.48Å; L326-I328 HydrophobicContact CD2-CD1 4.08Å; L326-I328 HydrophobicContact CD2-CG1 4.18Å; L326-I328 HydrophobicContact CG-CG1 4.12Å; L326-V366 HydrophobicContact CB-CG1 4.42Å; L326-P367 PolarHBondContact N-O 2.84Å; L326-F368 HydrophobicContact CB-CD2 4.18Å; L326-F368 HydrophobicContact CD2-CD2 4.28Å; L326-F368 HydrophobicContact CD2-CE2 4.24Å; L326-F368 HydrophobicContact CG-CD2 4.23Å; L326-F368 HydrophobicContact CG-CE2 4.36Å; L326-F368 VanDerWaalsContact O-CA 3.28Å; L326-F368 WeakPolarHBondContact O-CA 3.45Å; L326-F368 WeakPolarHBondContact O-CD2 3.44Å; L326-S369 PolarHBondContact O-N 2.73Å
327	S	97.2	Very high	87.2	Confident	18 Å²	18	51 Å²	51	13%	0.126	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	137.6	165.4	-60.3	0	0	0	0	110.4	F295 H296 I297 H325 S369	F295-S327 PolarHBondContact O-N 3.45Å; H296-S327 CarbonylContact C-O 3.58Å; H296-S327 WeakPolarHBondContact CA-O 3.35Å; H296-S327 PolarHBondContact CD2-O 3.35Å; I297-S327 PolarHBondContact N-O 2.91Å; H325-S327 PolarHBondContact CE1-OG 3.15Å; S327-S369 WeakPolarHBondContact CA-O 3.23Å; S327-S369 PolarHBondContact OG-OG 3.21Å
328	I	98	Very high	86.8	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	117.2	168.6	-58.6	-178.7	0	0	0	109.2	I297 D299 W308 L326 F368 S369 F370 R371	I297-I328 HydrophobicContact CB-CG1 4.29Å; I297-I328 HydrophobicContact CD1-CG1 4.45Å; I297-I328 WeakPolarHBondContact O-CA 3.43Å; D299-I328 HydrophobicContact CB-CG2 4.23Å; W308-I328 HydrophobicContact CB-CD1 3.75Å; W308-I328 HydrophobicContact CD2-CD1 3.82Å; W308-I328 HydrophobicContact CE3-CD1 4.25Å; W308-I328 HydrophobicContact CG-CD1 3.56Å; L326-I328 HydrophobicContact CD1-CG1 4.48Å; L326-I328 HydrophobicContact CD2-CD1 4.08Å; L326-I328 HydrophobicContact CD2-CG1 4.18Å; L326-I328 HydrophobicContact CG-CG1 4.12Å; I328-F368 HydrophobicContact CB-CE2 4.4Å; I328-F368 HydrophobicContact CD1-CE2 3.72Å; I328-F368 HydrophobicContact CD1-CZ 4.13Å; I328-F368 HydrophobicContact CG1-CE2 3.82Å; I328-F368 HydrophobicContact CG1-CZ 4.34Å; I328-S369 PolarHBondContact N-O 2.87Å; I328-F370 HydrophobicContact CB-CD2 4.11Å; I328-F370 HydrophobicContact CG2-CD2 4.22Å; I328-F370 HydrophobicContact CG2-CE2 4.25Å; I328-F370 WeakPolarHBondContact O-CA 3.37Å; I328-R371 PolarHBondContact O-N 3.48Å
329	T	98	Very high	86.8	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.031	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	107.7	169.2	-64.7	0	0	0	0	108.6	H296 I297 L298 D299 R371 V373 L389	H296-T329 PolarHBondContact NE2-OG1 2.96Å; I297-T329 PolarHBondContact O-N 3.36Å; L298-T329 WeakPolarHBondContact CA-O 3.41Å; L298-T329 HydrophobicContact CD1-CG2 4.37Å; D299-T329 PolarHBondContact N-O 3.03Å; T329-R371 CarbonylContact C-O 3.53Å; T329-R371 VanDerWaalsContact CA-O 3.32Å; T329-R371 WeakPolarHBondContact CA-O 3.11Å; T329-V373 HydrophobicContact CG2-CG2 3.84Å; T329-L389 HydrophobicContact CG2-CD2 4.2Å
330	T	98.1	Very high	87.4	Confident	4 Å²	4	47.8 Å²	47.8	3%	0.025	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	131.3	178.2	-171.9	0	0	0	0	111	D299 V332 M350 F370 R371 A372 V373	D299-T330 CarbonylContact O-C 3.54Å; D299-T330 WeakPolarHBondContact O-CA 3.42Å; D299-T330 PolarHBondContact OD2-OG1 3.45Å; T330-V332 HydrophobicContact CG2-CG2 4.37Å; T330-M350 HydrophobicContact CG2-CE 3.62Å; T330-F370 HydrophobicContact CG2-CE1 4.26Å; T330-F370 HydrophobicContact CG2-CE2 3.8Å; T330-F370 HydrophobicContact CG2-CZ 3.42Å; T330-F370 VanDerWaalsContact CG2-CZ 3.42Å; T330-R371 PolarHBondContact N-O 3.25Å; T330-A372 HydrophobicContact CG2-CB 3.98Å; T330-A372 WeakPolarHBondContact O-CA 3.48Å; T330-V373 PolarHBondContact O-N 3.23Å
331	V	96.6	Very high	88.5	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	120.8	176.3	179	0	0	0	0	109.4	L298 D299 L300 V373 H375 L379 L382	L298-V331 HydrophobicContact CD1-CG2 3.97Å; D299-V331 PolarHBondContact O-N 3.31Å; L300-V331 HydrophobicContact CD2-CB 3.56Å; L300-V331 HydrophobicContact CD2-CG1 4.36Å; L300-V331 HydrophobicContact CD2-CG2 3.42Å; L300-V331 VanDerWaalsContact CD2-CG2 3.42Å; V331-V373 CarbonylContact C-O 3.6Å; V331-V373 WeakPolarHBondContact CA-O 3.43Å; V331-H375 HydrophobicContact CG1-CB 4.02Å; V331-L379 HydrophobicContact CG1-CD1 4.2Å; V331-L382 HydrophobicContact CB-CD2 4.46Å; V331-L382 HydrophobicContact CG1-CD2 3.96Å; V331-L382 HydrophobicContact CG2-CD2 3.79Å
332	V	93.9	Very high	89.3	Confident	15 Å²	15	38.1 Å²	38.1	9%	0.091	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	91.8	-176.3	-175.4	0	0	0	0	108.4	T330 R346 M350 A372 V373 H375	T330-V332 HydrophobicContact CG2-CG2 4.37Å; V332-R346 VanDerWaalsContact CG1-CD 3.42Å; V332-R346 HydrophobicContact CG1-CG 3.72Å; V332-M350 HydrophobicContact CG1-CG 4.09Å; V332-M350 HydrophobicContact CG2-CE 3.77Å; V332-M350 HydrophobicContact CG2-CG 3.77Å; V332-M350 HydrophobicContact CG2-SD 4.05Å; V332-A372 HydrophobicContact CG2-CB 4.44Å; V332-V373 PolarHBondContact N-O 3.18Å; V332-H375 PolarHBondContact O-N 2.95Å
333	S	88	Confident	89.6	Confident	51 Å²	51	34.2 Å²	34.2	36%	0.357	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	141.5	-179.3	-57.8	0	0	0	0	112.2	R346 H375	S333-R346 PolarHBondContact O-NH1 2.53Å; S333-H375 CarbonylContact C-O 3.55Å; S333-H375 WeakPolarHBondContact CA-O 3.18Å
334	A	84.6	Confident	89.7	Confident	10 Å²	10	37.2 Å²	37.2	8%	0.083	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	143.5	169.9	0	0	0	0	0	110.4	A338 V343 H375 G377	A334-A338 HydrophobicContact CB-CB 4.45Å; A334-V343 HydrophobicContact CB-CG2 4.28Å; A334-H375 PolarHBondContact N-O 2.78Å; A334-G377 PolarHBondContact O-N 2.82Å; A334-G377 VanDerWaalsContact O-N 3.16Å
335	A	79.6	Confident	89.8	Confident	39 Å²	39	39.9 Å²	39.9	32%	0.322	24%	0.243	S	C	.	.			trans	-57.3	140.8	174.2	0	0	0	0	0	109.7	S337 A338 M511	A335-S337 PolarHBondContact O-N 3.45Å; A335-A338 HydrophobicContact CB-CB 4.41Å; A335-A338 WeakPolarHBondContact O-CB 3.29Å; A335-A338 PolarHBondContact O-N 3.09Å; A335-M511 HydrophobicContact CB-CE 3.9Å
336	P	76.1	Confident	89.7	Confident	100 Å²	100	40.4 Å²	40.4	65%	0.649	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-28.6	-176.3	-13.8	11.7	0	0	0	114.3
337	S	79.1	Confident	89.6	Confident	73 Å²	73	43.5 Å²	43.5	51%	0.51	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	15.8	180	65.2	0	0	0	0	114.1	A335	A335-S337 PolarHBondContact O-N 3.45Å
338	A	82.3	Confident	89.5	Confident	28 Å²	28	50.6 Å²	50.6	23%	0.231	28%	0.281	C	S	.	.			trans	-62.1	129.8	177.5	0	0	0	0	0	110.4	A334 A335 V343	A334-A338 HydrophobicContact CB-CB 4.45Å; A335-A338 HydrophobicContact CB-CB 4.41Å; A335-A338 WeakPolarHBondContact O-CB 3.29Å; A335-A338 PolarHBondContact O-N 3.09Å; A338-V343 HydrophobicContact CB-CG2 4.12Å
339	P	85.7	Confident	89.3	Confident	58 Å²	58	50.8 Å²	50.8	38%	0.377	28%	0.282	S	S	.	.			trans	-57.6	143.1	175.7	-23.4	32.8	0	0	0	111.5	V341 A342 V343	P339-V341 PolarHBondContact O-N 2.87Å; P339-A342 WeakPolarHBondContact O-CA 3.48Å; P339-A342 WeakPolarHBondContact O-CB 3.24Å; P339-A342 PolarHBondContact O-N 2.98Å; P339-V343 PolarHBondContact O-N 3.3Å
340	T	88.2	Confident	89.3	Confident	100 Å²	100	50.8 Å²	50.8	61%	0.613	28%	0.282	S	S	*	.	H	α-helix	trans	-50.4	-38.6	179.4	-51.7	0	0	0	0	112.8	A342 V343 Q344	T340-A342 VanDerWaalsContact C-N 3.32Å; T340-A342 PolarHBondContact O-N 3.07Å; T340-V343 PolarHBondContact O-N 3.2Å; T340-Q344 HydrophobicContact CG2-CG 4.45Å; T340-Q344 WeakPolarHBondContact O-CG 3.38Å; T340-Q344 PolarHBondContact O-N 3.26Å
341	V	90	Very high	89.2	Confident	73 Å²	73	57.3 Å²	57.3	44%	0.442	31%	0.306	S	S	.	.	H	α-helix	trans	-63.7	-37	178.9	-172.2	0	0	0	0	111.9	P339 R345	P339-V341 PolarHBondContact O-N 2.87Å; V341-R345 VanDerWaalsContact CG1-CZ 3.48Å; V341-R345 PolarHBondContact O-N 3.44Å
342	A	87.5	Confident	89.2	Confident	5 Å²	5	60.1 Å²	60.1	4%	0.041	32%	0.319	C	S	.	.	H	α-helix	trans	-67.5	-43.4	176.5	0	0	0	0	0	111.3	D245 P339 T340 Q344 R345 R346	D245-A342 HydrophobicContact CB-CB 3.88Å; D245-A342 WeakPolarHBondContact OD2-CB 3.35Å; P339-A342 WeakPolarHBondContact O-CA 3.48Å; P339-A342 WeakPolarHBondContact O-CB 3.24Å; P339-A342 PolarHBondContact O-N 2.98Å; T340-A342 VanDerWaalsContact C-N 3.32Å; T340-A342 PolarHBondContact O-N 3.07Å; A342-Q344 PolarHBondContact O-N 3.37Å; A342-R345 PolarHBondContact O-N 3.32Å; A342-R346 PolarHBondContact O-N 2.93Å
343	V	89.6	Confident	89.3	Confident	40 Å²	40	60.2 Å²	60.2	24%	0.242	32%	0.319	C	S	.	.	H	α-helix	trans	-59.4	-47.4	174.9	178.9	0	0	0	0	110.6	A334 A338 P339 T340 R345 R346 Q347	A334-V343 HydrophobicContact CB-CG2 4.28Å; A338-V343 HydrophobicContact CB-CG2 4.12Å; P339-V343 PolarHBondContact O-N 3.3Å; T340-V343 PolarHBondContact O-N 3.2Å; V343-R345 PolarHBondContact O-N 2.93Å; V343-R346 PolarHBondContact O-N 3.15Å; V343-Q347 WeakPolarHBondContact O-CG 3.35Å; V343-Q347 PolarHBondContact O-N 3.38Å
344	Q	92.1	Very high	89.8	Confident	90 Å²	90	58.1 Å²	58.1	42%	0.421	31%	0.305	S	S	.	.	H	α-helix	trans	-62.3	-38.8	177.4	-72.9	175.8	-11.5	0	0	112.9	T340 A342 Q347 R348	T340-Q344 HydrophobicContact CG2-CG 4.45Å; T340-Q344 WeakPolarHBondContact O-CG 3.38Å; T340-Q344 PolarHBondContact O-N 3.26Å; A342-Q344 PolarHBondContact O-N 3.37Å; Q344-Q347 PolarHBondContact O-N 2.93Å; Q344-R348 WeakPolarHBondContact O-CG 3.09Å; Q344-R348 PolarHBondContact O-N 3.18Å
345	R	91.8	Very high	90.4	Very high	76 Å²	76	63.2 Å²	63.2	29%	0.287	33%	0.327	S	S	.	.	H	α-helix	trans	-62	-47	174.1	-83.2	-166.5	-88.8	-93.6	2.1	111.1	D245 T248 V341 A342 V343 Q347 R348 V349	D245-R345 PolarHBondContact O-NE 3.36Å; T248-R345 WeakPolarHBondContact O-CD 3.49Å; V341-R345 VanDerWaalsContact CG1-CZ 3.48Å; V341-R345 PolarHBondContact O-N 3.44Å; A342-R345 PolarHBondContact O-N 3.32Å; V343-R345 PolarHBondContact O-N 2.93Å; R345-Q347 VanDerWaalsContact C-N 3.33Å; R345-Q347 PolarHBondContact O-N 3.08Å; R345-R348 WeakPolarHBondContact O-CB 3.28Å; R345-R348 PolarHBondContact O-N 3.43Å; R345-R348 VanDerWaalsContact O-N 3.12Å; R345-V349 WeakPolarHBondContact O-CG2 3.42Å; R345-V349 PolarHBondContact O-N 2.65Å
346	R	91.2	Very high	91.2	Very high	60 Å²	60	66.6 Å²	66.6	23%	0.226	33%	0.332	C	S	.	.	H	α-helix	trans	-61.7	-39.6	177.3	-166.2	172.3	-63.4	156.4	6.9	112.3	V332 S333 A342 V343 R348 V349 M350	V332-R346 VanDerWaalsContact CG1-CD 3.42Å; V332-R346 HydrophobicContact CG1-CG 3.72Å; S333-R346 PolarHBondContact O-NH1 2.53Å; A342-R346 PolarHBondContact O-N 2.93Å; V343-R346 PolarHBondContact O-N 3.15Å; R346-R348 PolarHBondContact O-N 2.84Å; R346-V349 PolarHBondContact O-N 3.22Å; R346-M350 WeakPolarHBondContact O-CG 3.44Å; R346-M350 PolarHBondContact O-N 3.47Å
347	Q	94.2	Very high	92.2	Very high	66 Å²	66	62.2 Å²	62.2	31%	0.308	30%	0.303	S	S	.	.	H	α-helix	trans	-59.8	-41.5	172.7	-74.4	175	-10.4	0	0	112.8	V343 Q344 R345 M350 R351 H374	V343-Q347 WeakPolarHBondContact O-CG 3.35Å; V343-Q347 PolarHBondContact O-N 3.38Å; Q344-Q347 PolarHBondContact O-N 2.93Å; R345-Q347 VanDerWaalsContact C-N 3.33Å; R345-Q347 PolarHBondContact O-N 3.08Å; Q347-M350 PolarHBondContact O-N 2.78Å; Q347-R351 WeakPolarHBondContact O-CB 3.49Å; Q347-R351 PolarHBondContact O-N 3.48Å; Q347-H374 VanDerWaalsContact CG-CE1 3.44Å; Q347-H374 WeakPolarHBondContact CG-CE1 3.34Å
348	R	94.7	Very high	93.1	Very high	166 Å²	166	62.2 Å²	62.2	63%	0.626	30%	0.295	S	S	*	.	H	α-helix	trans	-63.2	-45.6	175.2	-69.6	174.9	-165.5	-106.1	2.4	111.4	Q344 R345 R346 M350 R351 E352	Q344-R348 WeakPolarHBondContact O-CG 3.09Å; Q344-R348 PolarHBondContact O-N 3.18Å; R345-R348 WeakPolarHBondContact O-CB 3.28Å; R345-R348 PolarHBondContact O-N 3.43Å; R345-R348 VanDerWaalsContact O-N 3.12Å; R346-R348 PolarHBondContact O-N 2.84Å; R348-M350 VanDerWaalsContact C-N 3.34Å; R348-M350 PolarHBondContact O-N 2.95Å; R348-R351 PolarHBondContact O-N 3.3Å; R348-E352 WeakPolarHBondContact O-CB 3.07Å; R348-E352 PolarHBondContact O-N 3.44Å
349	V	94.5	Very high	93.8	Very high	5 Å²	5	65.6 Å²	65.6	3%	0.03	30%	0.304	C	S	.	.	H	α-helix	trans	-57.1	-47.6	176.1	174.1	0	0	0	0	110.9	F250 T253 F304 R345 R346 E352 I353	F250-V349 HydrophobicContact CB-CG2 4.43Å; F250-V349 HydrophobicContact CD2-CG1 4.37Å; T253-V349 HydrophobicContact CG2-CG1 4.5Å; F304-V349 HydrophobicContact CD1-CG1 4.25Å; F304-V349 HydrophobicContact CE1-CG1 4.42Å; R345-V349 WeakPolarHBondContact O-CG2 3.42Å; R345-V349 PolarHBondContact O-N 2.65Å; R346-V349 PolarHBondContact O-N 3.22Å; V349-E352 PolarHBondContact O-N 2.79Å; V349-I353 HydrophobicContact CG1-CD1 3.81Å; V349-I353 HydrophobicContact CG1-CG1 4.5Å; V349-I353 WeakPolarHBondContact O-CG1 3.19Å; V349-I353 PolarHBondContact O-N 3.27Å
350	M	96.8	Very high	94.4	Very high	5 Å²	5	64.6 Å²	64.6	3%	0.025	29%	0.294	C	S	.	.	H	α-helix	trans	-69.7	-35.2	-178.4	-68.6	-59	-53.1	0	0	113.5	F304 T330 V332 R346 Q347 R348 E352 I353 G354 F370 A372	F304-M350 HydrophobicContact CD1-SD 4.14Å; T330-M350 HydrophobicContact CG2-CE 3.62Å; V332-M350 HydrophobicContact CG1-CG 4.09Å; V332-M350 HydrophobicContact CG2-CE 3.77Å; V332-M350 HydrophobicContact CG2-CG 3.77Å; V332-M350 HydrophobicContact CG2-SD 4.05Å; R346-M350 WeakPolarHBondContact O-CG 3.44Å; R346-M350 PolarHBondContact O-N 3.47Å; Q347-M350 PolarHBondContact O-N 2.78Å; R348-M350 VanDerWaalsContact C-N 3.34Å; R348-M350 PolarHBondContact O-N 2.95Å; M350-E352 VanDerWaalsContact C-N 3.29Å; M350-E352 PolarHBondContact O-N 2.97Å; M350-I353 PolarHBondContact O-N 3.37Å; M350-I353 HydrophobicContact SD-CD1 3.75Å; M350-G354 PolarHBondContact O-N 3.18Å; M350-F370 HydrophobicContact CE-CZ 4.08Å; M350-A372 HydrophobicContact CB-CB 4.26Å; M350-A372 HydrophobicContact CE-CB 4.34Å
351	R	96.8	Very high	94.8	Very high	141 Å²	141	59.8 Å²	59.8	53%	0.532	27%	0.265	S	S	.	.	H	α-helix	trans	-60.7	-43	172.1	-173.2	-176.4	-59.2	112.1	3.4	111.2	Q347 R348 G354 Q355	Q347-R351 WeakPolarHBondContact O-CB 3.49Å; Q347-R351 PolarHBondContact O-N 3.48Å; R348-R351 PolarHBondContact O-N 3.3Å; R351-G354 PolarHBondContact O-N 3.36Å; R351-Q355 WeakPolarHBondContact O-CG 3.41Å; R351-Q355 PolarHBondContact O-N 3.39Å; R351-Q355 VanDerWaalsContact O-N 3.09Å
352	E	96.5	Very high	95.2	Very high	62 Å²	62	65.1 Å²	65.1	29%	0.29	28%	0.277	S	S	.	.	H	α-helix	trans	-70.4	-35.2	-179.9	176.9	169.4	-176.3	0	0	112.4	F250 R348 V349 M350 R356	F250-E352 HydrophobicContact CB-CG 4.29Å; F250-E352 WeakPolarHBondContact CB-OE2 3.49Å; F250-E352 HydrophobicContact CD1-CG 4.19Å; F250-E352 WeakPolarHBondContact CD1-OE1 3.47Å; F250-E352 HydrophobicContact CD2-CB 4.15Å; F250-E352 HydrophobicContact CD2-CG 3.69Å; F250-E352 HydrophobicContact CE1-CG 4.5Å; F250-E352 HydrophobicContact CE2-CG 4.03Å; F250-E352 HydrophobicContact CG-CB 4.48Å; F250-E352 HydrophobicContact CG-CG 3.78Å; F250-E352 WeakPolarHBondContact CG-OE1 3.32Å; F250-E352 WeakPolarHBondContact CG-OE2 3.37Å; F250-E352 HydrophobicContact CZ-CG 4.43Å; R348-E352 WeakPolarHBondContact O-CB 3.07Å; R348-E352 PolarHBondContact O-N 3.44Å; V349-E352 PolarHBondContact O-N 2.79Å; M350-E352 VanDerWaalsContact C-N 3.29Å; M350-E352 PolarHBondContact O-N 2.97Å; E352-R356 PolarHBondContact O-N 3.29Å; E352-R356 PolarHBondContact O-NH1 2.75Å; E352-R356 IonicContact OE1-CZ 3.53Å; E352-R356 IonicContact OE1-NH1 3.21Å; E352-R356 PolarHBondContact OE1-NH1 3.26Å; E352-R356 IonicContact OE1-NH2 2.7Å; E352-R356 PolarHBondContact OE1-NH2 3.02Å
353	I	96.7	Very high	95.6	Very high	17 Å²	17	71.1 Å²	71.1	9%	0.087	31%	0.308	C	S	.	.	H	α-helix	trans	-62.7	-49.9	168.7	-71.2	165.4	0	0	0	110.5	F250 F304 C305 V349 M350 Q355 R356 I357	F250-I353 HydrophobicContact CD2-CG1 3.94Å; F250-I353 HydrophobicContact CE2-CG1 3.62Å; F304-I353 HydrophobicContact CB-CD1 3.82Å; F304-I353 HydrophobicContact CD1-CD1 4.08Å; F304-I353 HydrophobicContact CG-CD1 4.44Å; C305-I353 HydrophobicContact CB-CG2 3.77Å; V349-I353 HydrophobicContact CG1-CD1 3.81Å; V349-I353 HydrophobicContact CG1-CG1 4.5Å; V349-I353 WeakPolarHBondContact O-CG1 3.19Å; V349-I353 PolarHBondContact O-N 3.27Å; M350-I353 PolarHBondContact O-N 3.37Å; M350-I353 HydrophobicContact SD-CD1 3.75Å; I353-Q355 PolarHBondContact O-N 3.21Å; I353-R356 PolarHBondContact O-N 3.05Å; I353-R356 VanDerWaalsContact O-N 3.07Å; I353-I357 WeakPolarHBondContact O-CG2 3.41Å; I353-I357 PolarHBondContact O-N 3.37Å
354	G	97.3	Very high	95.8	Very high	6 Å²	6	72 Å²	72	6%	0.062	31%	0.31	C	S	.	.	H	α-helix	trans	-53.8	-49.5	-179.3	0	0	0	0	0	112.8	M350 R351 R356 I357 E358 F370	M350-G354 PolarHBondContact O-N 3.18Å; R351-G354 PolarHBondContact O-N 3.36Å; G354-R356 VanDerWaalsContact C-N 3.29Å; G354-R356 PolarHBondContact O-N 2.95Å; G354-I357 WeakPolarHBondContact O-CG2 3.4Å; G354-I357 PolarHBondContact O-N 3.1Å; G354-E358 WeakPolarHBondContact O-CB 3.22Å; G354-E358 VanDerWaalsContact O-CG 3.32Å; G354-E358 WeakPolarHBondContact O-CG 3.16Å; G354-E358 PolarHBondContact O-N 2.85Å; G354-F370 VanDerWaalsContact CA-CD1 3.42Å; G354-F370 VanDerWaalsContact CA-CE1 3.48Å
355	Q	97.2	Very high	95.8	Very high	118 Å²	118	70.2 Å²	70.2	55%	0.551	32%	0.315	S	S	*	.	H	α-helix	trans	-59.9	-38.1	177.5	-70.7	172.4	2.4	0	0	112.9	R351 I353 K359	R351-Q355 WeakPolarHBondContact O-CG 3.41Å; R351-Q355 PolarHBondContact O-N 3.39Å; R351-Q355 VanDerWaalsContact O-N 3.09Å; I353-Q355 PolarHBondContact O-N 3.21Å; Q355-K359 WeakPolarHBondContact O-CB 3.33Å; Q355-K359 PolarHBondContact O-N 3.47Å; Q355-K359 VanDerWaalsContact O-N 3.11Å
356	R	97	Very high	96	Very high	109 Å²	109	66.8 Å²	66.8	41%	0.411	30%	0.303	S	S	.	.	H	α-helix	trans	-75.1	-40.6	-179.9	-74.5	-164.2	-178.4	82.4	-4.7	112.5	E352 I353 G354 K359 F360	E352-R356 PolarHBondContact O-N 3.29Å; E352-R356 PolarHBondContact O-NH1 2.75Å; E352-R356 IonicContact OE1-CZ 3.53Å; E352-R356 IonicContact OE1-NH1 3.21Å; E352-R356 PolarHBondContact OE1-NH1 3.26Å; E352-R356 IonicContact OE1-NH2 2.7Å; E352-R356 PolarHBondContact OE1-NH2 3.02Å; I353-R356 PolarHBondContact O-N 3.05Å; I353-R356 VanDerWaalsContact O-N 3.07Å; G354-R356 VanDerWaalsContact C-N 3.29Å; G354-R356 PolarHBondContact O-N 2.95Å; R356-K359 PolarHBondContact O-N 3.04Å; R356-F360 WeakPolarHBondContact O-CB 3.34Å; R356-F360 PolarHBondContact O-N 3Å
357	I	97.4	Very high	96.2	Very high	9 Å²	9	66.8 Å²	66.8	5%	0.046	31%	0.311	C	S	.	.	H	α-helix	trans	-68.1	-38.2	177.6	-168.5	170.4	0	0	0	111.4	W308 L312 I353 G354 F360 A361 F368 F370	W308-I357 HydrophobicContact CB-CD1 3.58Å; W308-I357 HydrophobicContact CG-CD1 4.39Å; L312-I357 HydrophobicContact CD1-CD1 4.25Å; L312-I357 HydrophobicContact CD1-CG1 3.8Å; I353-I357 WeakPolarHBondContact O-CG2 3.41Å; I353-I357 PolarHBondContact O-N 3.37Å; G354-I357 WeakPolarHBondContact O-CG2 3.4Å; G354-I357 PolarHBondContact O-N 3.1Å; I357-F360 PolarHBondContact O-N 3.46Å; I357-A361 WeakPolarHBondContact O-CB 3.33Å; I357-A361 PolarHBondContact O-N 3Å; I357-F368 HydrophobicContact CD1-CZ 3.98Å; I357-F368 HydrophobicContact CG1-CE1 4.13Å; I357-F368 HydrophobicContact CG1-CZ 3.89Å; I357-F368 HydrophobicContact CG2-CE1 4.03Å; I357-F368 HydrophobicContact CG2-CZ 4.24Å; I357-F370 HydrophobicContact CG2-CB 4.29Å; I357-F370 HydrophobicContact CG2-CD1 4.37Å; I357-F370 HydrophobicContact CG2-CD2 3.9Å; I357-F370 HydrophobicContact CG2-CE2 4.27Å; I357-F370 HydrophobicContact CG2-CG 3.93Å
358	E	97.9	Very high	96.3	Very high	73 Å²	73	65.3 Å²	65.3	34%	0.341	30%	0.303	S	S	.	.	H	α-helix	trans	-64.4	-40.1	173	-72.2	176.8	160.3	0	0	112.6	G354 R362 F368 F370	G354-E358 WeakPolarHBondContact O-CB 3.22Å; G354-E358 VanDerWaalsContact O-CG 3.32Å; G354-E358 WeakPolarHBondContact O-CG 3.16Å; G354-E358 PolarHBondContact O-N 2.85Å; E358-R362 WeakPolarHBondContact O-CG 3.38Å; E358-R362 PolarHBondContact O-N 2.9Å; E358-R362 VanDerWaalsContact O-N 3.14Å; E358-F368 HydrophobicContact CB-CD1 4.41Å; E358-F368 HydrophobicContact CG-CD1 3.97Å; E358-F368 HydrophobicContact CG-CE1 3.87Å; E358-F370 HydrophobicContact CG-CB 4.06Å
359	K	97.8	Very high	96.4	Very high	99 Å²	99	59.6 Å²	59.6	43%	0.43	29%	0.289	S	S	.	.	H	α-helix	trans	-63.4	-43.3	172.7	-176.1	177.8	177.8	178.9	0	111	Q355 R356 R362 L363	Q355-K359 WeakPolarHBondContact O-CB 3.33Å; Q355-K359 PolarHBondContact O-N 3.47Å; Q355-K359 VanDerWaalsContact O-N 3.11Å; R356-K359 PolarHBondContact O-N 3.04Å; K359-R362 PolarHBondContact O-N 2.52Å; K359-L363 HydrophobicContact CG-CD1 4.36Å; K359-L363 WeakPolarHBondContact O-CG 3.39Å; K359-L363 PolarHBondContact O-N 2.68Å
360	F	97.4	Very high	96.5	Very high	36 Å²	36	60.6 Å²	60.6	16%	0.158	29%	0.293	C	S	.	.	H	α-helix	trans	-63.4	-45.5	178.4	-176.9	-99.7	0	0	0	111.8	P309 L312 R356 I357 R362 L363 M364	P309-F360 HydrophobicContact CB-CD1 4.25Å; P309-F360 HydrophobicContact CB-CE1 3.93Å; P309-F360 HydrophobicContact CB-CZ 4.41Å; P309-F360 WeakPolarHBondContact O-CE1 3.27Å; L312-F360 HydrophobicContact CB-CD1 4.35Å; L312-F360 HydrophobicContact CB-CE1 4.1Å; L312-F360 HydrophobicContact CD1-CD1 3.88Å; L312-F360 HydrophobicContact CD1-CE1 4.41Å; R356-F360 WeakPolarHBondContact O-CB 3.34Å; R356-F360 PolarHBondContact O-N 3Å; I357-F360 PolarHBondContact O-N 3.46Å; F360-R362 VanDerWaalsContact C-N 3.34Å; F360-R362 PolarHBondContact O-N 3.03Å; F360-L363 WeakPolarHBondContact O-CB 3.46Å; F360-L363 PolarHBondContact O-N 3.28Å; F360-L363 VanDerWaalsContact O-N 3.1Å; F360-M364 HydrophobicContact CD1-CG 4.18Å; F360-M364 HydrophobicContact CE1-CG 3.74Å; F360-M364 HydrophobicContact CE2-CG 4.28Å; F360-M364 HydrophobicContact CE2-SD 4.36Å; F360-M364 HydrophobicContact CZ-CG 3.8Å; F360-M364 HydrophobicContact CZ-SD 4.03Å; F360-M364 WeakPolarHBondContact O-CG 3.35Å; F360-M364 PolarHBondContact O-N 2.68Å
361	A	97.5	Very high	96.5	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58.2	-44.2	176.4	0	0	0	0	0	112.2	L312 I357 L363 M364 G365 V366 F368	L312-A361 HydrophobicContact CD1-CB 4.01Å; L312-A361 HydrophobicContact CD2-CB 4.06Å; I357-A361 WeakPolarHBondContact O-CB 3.33Å; I357-A361 PolarHBondContact O-N 3Å; A361-L363 VanDerWaalsContact C-N 3.35Å; A361-L363 PolarHBondContact O-N 3.18Å; A361-M364 CarbonylContact O-C 3.56Å; A361-M364 PolarHBondContact O-N 3.2Å; A361-G365 PolarHBondContact O-N 3.46Å; A361-G365 VanDerWaalsContact O-N 3.08Å; A361-V366 HydrophobicContact CB-CB 4.43Å; A361-V366 PolarHBondContact O-N 3.32Å; A361-F368 HydrophobicContact CB-CB 3.4Å; A361-F368 HydrophobicContact CB-CD1 3.57Å; A361-F368 HydrophobicContact CB-CD2 4.15Å; A361-F368 HydrophobicContact CB-CE1 4.33Å; A361-F368 HydrophobicContact CB-CG 3.44Å; A361-F368 VanDerWaalsContact CB-CG 3.44Å
362	R	96.5	Very high	96.5	Very high	184 Å²	184	60.6 Å²	60.6	69%	0.694	30%	0.3	S	S	*	.	H	α-helix	trans	-60.8	-40.5	173.8	-75	-174.4	-67.9	172.9	-3.6	113	E358 K359 F360 M364 G365	E358-R362 WeakPolarHBondContact O-CG 3.38Å; E358-R362 PolarHBondContact O-N 2.9Å; E358-R362 VanDerWaalsContact O-N 3.14Å; K359-R362 PolarHBondContact O-N 2.52Å; F360-R362 VanDerWaalsContact C-N 3.34Å; F360-R362 PolarHBondContact O-N 3.03Å; R362-M364 VanDerWaalsContact C-N 3.28Å; R362-M364 PolarHBondContact O-N 3.38Å; R362-G365 PolarHBondContact O-N 3.22Å
363	L	95.9	Very high	96.5	Very high	132 Å²	132	58.8 Å²	58.8	69%	0.691	29%	0.293	S	S	*	.	H	α-helix	trans	-65.6	-33	176.7	-72	171	0	0	0	112.3	K359 F360 A361 G365	K359-L363 HydrophobicContact CG-CD1 4.36Å; K359-L363 WeakPolarHBondContact O-CG 3.39Å; K359-L363 PolarHBondContact O-N 2.68Å; F360-L363 WeakPolarHBondContact O-CB 3.46Å; F360-L363 PolarHBondContact O-N 3.28Å; F360-L363 VanDerWaalsContact O-N 3.1Å; A361-L363 VanDerWaalsContact C-N 3.35Å; A361-L363 PolarHBondContact O-N 3.18Å; L363-G365 VanDerWaalsContact C-N 3.3Å
364	M	93.9	Very high	96.4	Very high	59 Å²	59	61.3 Å²	61.3	29%	0.291	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.8	175.6	-64.5	-54.8	-53.6	0	0	113.5	E313 A316 F360 A361 R362 V366	E313-M364 HydrophobicContact CB-CE 4.3Å; E313-M364 HydrophobicContact CG-CE 4.13Å; A316-M364 HydrophobicContact CB-CB 4.26Å; A316-M364 HydrophobicContact CB-CE 4.09Å; A316-M364 WeakPolarHBondContact CB-O 3.23Å; F360-M364 HydrophobicContact CD1-CG 4.18Å; F360-M364 HydrophobicContact CE1-CG 3.74Å; F360-M364 HydrophobicContact CE2-CG 4.28Å; F360-M364 HydrophobicContact CE2-SD 4.36Å; F360-M364 HydrophobicContact CZ-CG 3.8Å; F360-M364 HydrophobicContact CZ-SD 4.03Å; F360-M364 WeakPolarHBondContact O-CG 3.35Å; F360-M364 PolarHBondContact O-N 2.68Å; A361-M364 CarbonylContact O-C 3.56Å; A361-M364 PolarHBondContact O-N 3.2Å; R362-M364 VanDerWaalsContact C-N 3.28Å; R362-M364 PolarHBondContact O-N 3.38Å; M364-V366 HydrophobicContact CB-CG2 4.08Å
365	G	93.7	Very high	96.1	Very high	51 Å²	51	62.3 Å²	62.3	53%	0.526	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	17.7	-177.2	0	0	0	0	0	114.7	A361 R362 L363	A361-G365 PolarHBondContact O-N 3.46Å; A361-G365 VanDerWaalsContact O-N 3.08Å; R362-G365 PolarHBondContact O-N 3.22Å; L363-G365 VanDerWaalsContact C-N 3.3Å
366	V	95.1	Very high	95.6	Very high	5 Å²	5	60.1 Å²	60.1	3%	0.03	31%	0.309	C	S	.	.			trans	-91	120.4	179.6	-174.6	0	0	0	0	109.9	L312 A316 T323 L326 A361 M364 F368	L312-V366 HydrophobicContact CD2-CB 4.1Å; L312-V366 HydrophobicContact CD2-CG1 3.82Å; L312-V366 HydrophobicContact CD2-CG2 4.22Å; A316-V366 HydrophobicContact CB-CG2 3.95Å; T323-V366 HydrophobicContact CG2-CB 4.34Å; T323-V366 HydrophobicContact CG2-CG1 4.14Å; T323-V366 HydrophobicContact CG2-CG2 4.08Å; L326-V366 HydrophobicContact CB-CG1 4.42Å; A361-V366 HydrophobicContact CB-CB 4.43Å; A361-V366 PolarHBondContact O-N 3.32Å; M364-V366 HydrophobicContact CB-CG2 4.08Å; V366-F368 WeakPolarHBondContact O-CB 3.07Å; V366-F368 PolarHBondContact O-N 2.85Å
367	P	94.8	Very high	95	Very high	60 Å²	60	55.3 Å²	55.3	39%	0.39	29%	0.294	S	S	.	.			trans	-62.7	121.1	168.7	-16.9	30.3	0	0	0	109.3	T323 H325 L326	T323-P367 WeakPolarHBondContact O-CD 3.49Å; H325-P367 CarbonylContact C-O 3.57Å; H325-P367 VanDerWaalsContact CA-O 3.29Å; H325-P367 WeakPolarHBondContact CA-O 3.35Å; H325-P367 HydrophobicContact CB-CB 4.13Å; L326-P367 PolarHBondContact N-O 2.84Å
368	F	96.7	Very high	94.5	Very high	34 Å²	34	55.4 Å²	55.4	15%	0.149	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	143.1	-162.8	179.7	-100.6	0	0	0	113.7	L312 L326 I328 I357 E358 A361 V366 F370	L312-F368 HydrophobicContact CD1-CE2 4.48Å; L312-F368 HydrophobicContact CD2-CD2 3.81Å; L312-F368 HydrophobicContact CD2-CE2 4.08Å; L326-F368 HydrophobicContact CB-CD2 4.18Å; L326-F368 HydrophobicContact CD2-CD2 4.28Å; L326-F368 HydrophobicContact CD2-CE2 4.24Å; L326-F368 HydrophobicContact CG-CD2 4.23Å; L326-F368 HydrophobicContact CG-CE2 4.36Å; L326-F368 VanDerWaalsContact O-CA 3.28Å; L326-F368 WeakPolarHBondContact O-CA 3.45Å; L326-F368 WeakPolarHBondContact O-CD2 3.44Å; I328-F368 HydrophobicContact CB-CE2 4.4Å; I328-F368 HydrophobicContact CD1-CE2 3.72Å; I328-F368 HydrophobicContact CD1-CZ 4.13Å; I328-F368 HydrophobicContact CG1-CE2 3.82Å; I328-F368 HydrophobicContact CG1-CZ 4.34Å; I357-F368 HydrophobicContact CD1-CZ 3.98Å; I357-F368 HydrophobicContact CG1-CE1 4.13Å; I357-F368 HydrophobicContact CG1-CZ 3.89Å; I357-F368 HydrophobicContact CG2-CE1 4.03Å; I357-F368 HydrophobicContact CG2-CZ 4.24Å; E358-F368 HydrophobicContact CB-CD1 4.41Å; E358-F368 HydrophobicContact CG-CD1 3.97Å; E358-F368 HydrophobicContact CG-CE1 3.87Å; A361-F368 HydrophobicContact CB-CB 3.4Å; A361-F368 HydrophobicContact CB-CD1 3.57Å; A361-F368 HydrophobicContact CB-CD2 4.15Å; A361-F368 HydrophobicContact CB-CE1 4.33Å; A361-F368 HydrophobicContact CB-CG 3.44Å; A361-F368 VanDerWaalsContact CB-CG 3.44Å; V366-F368 WeakPolarHBondContact O-CB 3.07Å; V366-F368 PolarHBondContact O-N 2.85Å; F368-F370 HydrophobicContact CE1-CB 3.63Å; F368-F370 HydrophobicContact CZ-CB 3.89Å; F368-F370 HydrophobicContact CZ-CD2 4.19Å
369	S	96.3	Very high	94.2	Very high	47 Å²	47	52.2 Å²	52.2	33%	0.329	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	141.9	169.8	68.7	0	0	0	0	111.2	H325 L326 S327 I328	H325-S369 PolarHBondContact CE1-OG 3.17Å; L326-S369 PolarHBondContact O-N 2.73Å; S327-S369 WeakPolarHBondContact CA-O 3.23Å; S327-S369 PolarHBondContact OG-OG 3.21Å; I328-S369 PolarHBondContact N-O 2.87Å
370	F	97.4	Very high	93.8	Very high	26 Å²	26	49.1 Å²	49.1	11%	0.114	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	132.6	-179.4	-179	-96.4	0	0	0	111.5	I328 T330 M350 G354 I357 E358 F368 A372	I328-F370 HydrophobicContact CB-CD2 4.11Å; I328-F370 HydrophobicContact CG2-CD2 4.22Å; I328-F370 HydrophobicContact CG2-CE2 4.25Å; I328-F370 WeakPolarHBondContact O-CA 3.37Å; T330-F370 HydrophobicContact CG2-CE1 4.26Å; T330-F370 HydrophobicContact CG2-CE2 3.8Å; T330-F370 HydrophobicContact CG2-CZ 3.42Å; T330-F370 VanDerWaalsContact CG2-CZ 3.42Å; M350-F370 HydrophobicContact CE-CZ 4.08Å; G354-F370 VanDerWaalsContact CA-CD1 3.42Å; G354-F370 VanDerWaalsContact CA-CE1 3.48Å; I357-F370 HydrophobicContact CG2-CB 4.29Å; I357-F370 HydrophobicContact CG2-CD1 4.37Å; I357-F370 HydrophobicContact CG2-CD2 3.9Å; I357-F370 HydrophobicContact CG2-CE2 4.27Å; I357-F370 HydrophobicContact CG2-CG 3.93Å; E358-F370 HydrophobicContact CG-CB 4.06Å; F368-F370 HydrophobicContact CE1-CB 3.63Å; F368-F370 HydrophobicContact CZ-CB 3.89Å; F368-F370 HydrophobicContact CZ-CD2 4.19Å; F370-A372 HydrophobicContact CE1-CB 4.15Å
371	R	96.9	Very high	93.4	Very high	111 Å²	111	52.7 Å²	52.7	42%	0.419	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	123.9	177.5	-176.2	177.8	173.9	179	-6.1	110.1	I328 T329 T330 V373 L387	I328-R371 PolarHBondContact O-N 3.48Å; T329-R371 CarbonylContact C-O 3.53Å; T329-R371 VanDerWaalsContact CA-O 3.32Å; T329-R371 WeakPolarHBondContact CA-O 3.11Å; T330-R371 PolarHBondContact N-O 3.25Å; R371-V373 HydrophobicContact CG-CG2 4.11Å; R371-L387 PolarHBondContact NH1-O 2.92Å
372	A	96.9	Very high	93.2	Very high	34 Å²	34	53.6 Å²	53.6	28%	0.281	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	118.7	169.5	0	0	0	0	0	109.9	T330 V332 M350 F370	T330-A372 HydrophobicContact CG2-CB 3.98Å; T330-A372 WeakPolarHBondContact O-CA 3.48Å; V332-A372 HydrophobicContact CG2-CB 4.44Å; M350-A372 HydrophobicContact CB-CB 4.26Å; M350-A372 HydrophobicContact CE-CB 4.34Å; F370-A372 HydrophobicContact CE1-CB 4.15Å
373	V	96.1	Very high	93.1	Very high	25 Å²	25	49.4 Å²	49.4	15%	0.152	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	121.5	176.4	178.5	0	0	0	0	108.7	T329 T330 V331 V332 R371 L387	T329-V373 HydrophobicContact CG2-CG2 3.84Å; T330-V373 PolarHBondContact O-N 3.23Å; V331-V373 CarbonylContact C-O 3.6Å; V331-V373 WeakPolarHBondContact CA-O 3.43Å; V332-V373 PolarHBondContact N-O 3.18Å; R371-V373 HydrophobicContact CG-CG2 4.11Å; V373-L387 HydrophobicContact CB-CD2 4.34Å; V373-L387 HydrophobicContact CG1-CD2 3.93Å; V373-L387 HydrophobicContact CG2-CD2 4.02Å
374	H	94	Very high	93	Very high	70 Å²	70	43.5 Å²	43.5	32%	0.324	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	118.2	-179.6	-69.1	-81.1	0	0	0	110	Q347	Q347-H374 VanDerWaalsContact CG-CE1 3.44Å; Q347-H374 WeakPolarHBondContact CG-CE1 3.34Å
375	H	91.6	Very high	92.8	Very high	26 Å²	26	46 Å²	46	12%	0.12	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.6	179.1	-177.3	59	0	0	0	110.1	V331 V332 S333 A334 D378 L382	V331-H375 HydrophobicContact CG1-CB 4.02Å; V332-H375 PolarHBondContact O-N 2.95Å; S333-H375 CarbonylContact C-O 3.55Å; S333-H375 WeakPolarHBondContact CA-O 3.18Å; A334-H375 PolarHBondContact N-O 2.78Å; H375-D378 PolarHBondContact NE2-O 3.28Å; H375-L382 HydrophobicContact CB-CD1 4.15Å
376	A	87.4	Confident	92.8	Very high	72 Å²	72	46.5 Å²	46.5	60%	0.595	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.3	174.9	0	0	0	0	0	108.4
377	G	84.4	Confident	92.7	Very high	9 Å²	9	46.5 Å²	46.5	9%	0.093	27%	0.269	C	S	.	.	S	Bend	trans	116.4	-165.3	-178	0	0	0	0	0	113.1	A334	A334-G377 PolarHBondContact O-N 2.82Å; A334-G377 VanDerWaalsContact O-N 3.16Å
378	D	87.3	Confident	92.5	Very high	10 Å²	10	48 Å²	48	5%	0.053	27%	0.273	C	S	.	.			trans	-70.5	138.6	177.7	-174.6	-59.7	0	0	0	110	H375 A380 E381 V410 R416	H375-D378 PolarHBondContact NE2-O 3.28Å; D378-A380 PolarHBondContact O-N 3.38Å; D378-A380 VanDerWaalsContact OD1-CB 3.23Å; D378-A380 WeakPolarHBondContact OD1-CB 3.43Å; D378-A380 PolarHBondContact OD1-N 2.97Å; D378-E381 WeakPolarHBondContact O-CB 3.41Å; D378-E381 PolarHBondContact O-N 3.46Å; D378-V410 WeakPolarHBondContact OD2-CA 3.38Å; D378-V410 WeakPolarHBondContact OD2-CB 2.87Å; D378-V410 WeakPolarHBondContact OD2-CG2 3.19Å; D378-V410 PolarHBondContact OD2-N 3.06Å; D378-R416 IonicContact OD1-NH1 3.25Å; D378-R416 PolarHBondContact OD1-NH1 3.32Å; D378-R416 IonicContact OD2-CZ 3.89Å; D378-R416 IonicContact OD2-NH1 3.19Å; D378-R416 PolarHBondContact OD2-NH1 2.6Å
379	L	89.7	Confident	92.4	Very high	6 Å²	6	46.9 Å²	46.9	3%	0.031	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-61.4	-26.3	-177.9	-175.8	62.7	0	0	0	113.1	L300 V331 E381 L382 V409 F420	L300-L379 HydrophobicContact CD1-CD2 4.38Å; L300-L379 HydrophobicContact CD2-CD1 4.44Å; V331-L379 HydrophobicContact CG1-CD1 4.2Å; L379-E381 PolarHBondContact O-N 3.5Å; L379-L382 HydrophobicContact CD1-CB 4.49Å; L379-L382 HydrophobicContact CD1-CD2 4.06Å; L379-L382 WeakPolarHBondContact O-CB 3.46Å; L379-L382 PolarHBondContact O-N 3Å; L379-V409 HydrophobicContact CB-CG2 3.96Å; L379-V409 HydrophobicContact CD2-CG2 4.34Å; L379-V409 HydrophobicContact CG-CG2 4.44Å; L379-F420 HydrophobicContact CD1-CZ 4.42Å; L379-F420 HydrophobicContact CD2-CE1 4.01Å; L379-F420 HydrophobicContact CD2-CZ 3.83Å; L379-F420 HydrophobicContact CG-CE1 4.26Å; L379-F420 HydrophobicContact CG-CE2 4.02Å; L379-F420 HydrophobicContact CG-CZ 3.67Å; L379-F420 WeakPolarHBondContact O-CE2 3.37Å
380	A	89.8	Confident	91.9	Very high	34 Å²	34	49.9 Å²	49.9	28%	0.281	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-69.5	-13.6	174.8	0	0	0	0	0	114.2	D378 L382 V409 R416 F420	D378-A380 PolarHBondContact O-N 3.38Å; D378-A380 VanDerWaalsContact OD1-CB 3.23Å; D378-A380 WeakPolarHBondContact OD1-CB 3.43Å; D378-A380 PolarHBondContact OD1-N 2.97Å; A380-L382 VanDerWaalsContact C-N 3.35Å; A380-V409 HydrophobicContact CB-CG1 3.86Å; A380-R416 HydrophobicContact CB-CG 3.67Å; A380-F420 HydrophobicContact CB-CB 4.24Å; A380-F420 HydrophobicContact CB-CD2 4.33Å
381	E	90.7	Very high	90.7	Very high	111 Å²	111	53.6 Å²	53.6	52%	0.519	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-90.4	-1.8	174.4	-69.6	159.5	-160.6	0	0	112.6	D378 L379 D383 R416	D378-E381 WeakPolarHBondContact O-CB 3.41Å; D378-E381 PolarHBondContact O-N 3.46Å; L379-E381 PolarHBondContact O-N 3.5Å; E381-D383 PolarHBondContact O-N 3.12Å; E381-R416 IonicContact OE1-CZ 3.35Å; E381-R416 IonicContact OE1-NH1 2.88Å; E381-R416 PolarHBondContact OE1-NH1 2.99Å; E381-R416 IonicContact OE1-NH2 2.84Å; E381-R416 PolarHBondContact OE1-NH2 3.29Å
382	L	92.1	Very high	89.4	Confident	20 Å²	20	49.3 Å²	49.3	11%	0.105	28%	0.284	C	S	.	.	S	Bend	trans	-66.7	122.8	174.1	179	66.5	0	0	0	110	V331 H375 L379 A380 L384 L387	V331-L382 HydrophobicContact CB-CD2 4.46Å; V331-L382 HydrophobicContact CG1-CD2 3.96Å; V331-L382 HydrophobicContact CG2-CD2 3.79Å; H375-L382 HydrophobicContact CB-CD1 4.15Å; L379-L382 HydrophobicContact CD1-CB 4.49Å; L379-L382 HydrophobicContact CD1-CD2 4.06Å; L379-L382 WeakPolarHBondContact O-CB 3.46Å; L379-L382 PolarHBondContact O-N 3Å; A380-L382 VanDerWaalsContact C-N 3.35Å; L382-L384 HydrophobicContact CD2-CD2 3.68Å; L382-L384 HydrophobicContact CG-CD2 4.14Å; L382-L384 PolarHBondContact O-N 3.44Å; L382-L387 HydrophobicContact CD2-CD1 4.32Å
383	D	93.6	Very high	88.5	Confident	95 Å²	95	49.5 Å²	49.5	51%	0.508	29%	0.29	S	S	.	.			trans	-73	96.8	168.9	-174.7	-5.8	0	0	0	109.6	E381 D385 A386	E381-D383 PolarHBondContact O-N 3.12Å; D383-D385 VanDerWaalsContact C-N 3.31Å; D383-D385 PolarHBondContact OD1-N 3.44Å; D383-D385 VanDerWaalsContact OD1-N 3.08Å; D383-A386 HydrophobicContact CB-CB 4.1Å; D383-A386 PolarHBondContact OD1-N 2.98Å; D383-A386 WeakPolarHBondContact OD2-CB 3.05Å
384	L	94.3	Very high	87.7	Confident	8 Å²	8	53.4 Å²	53.4	4%	0.042	32%	0.324	C	S	.	.	S	Bend	trans	-69.2	-29.2	179.5	-67.4	175.3	0	0	0	112.5	L298 L382 A386 L387 F420 L424 L427	L298-L384 HydrophobicContact CD2-CD2 4.13Å; L382-L384 HydrophobicContact CD2-CD2 3.68Å; L382-L384 HydrophobicContact CG-CD2 4.14Å; L382-L384 PolarHBondContact O-N 3.44Å; L384-A386 VanDerWaalsContact C-N 3.33Å; L384-L387 HydrophobicContact CD2-CD1 3.9Å; L384-L387 WeakPolarHBondContact O-CB 3.44Å; L384-L387 PolarHBondContact O-N 3.29Å; L384-F420 HydrophobicContact CD1-CE2 4.32Å; L384-L424 HydrophobicContact CD1-CD2 3.89Å; L384-L427 HydrophobicContact CB-CD1 4.24Å; L384-L427 HydrophobicContact CB-CD2 4.27Å; L384-L427 HydrophobicContact CD1-CD1 4.18Å; L384-L427 HydrophobicContact CD2-CD1 4.49Å
385	D	90.9	Very high	87	Confident	112 Å²	112	51.9 Å²	51.9	60%	0.599	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-73.1	-31.1	-177.7	-63.4	-46.3	0	0	0	110.5	D383 L387	D383-D385 VanDerWaalsContact C-N 3.31Å; D383-D385 PolarHBondContact OD1-N 3.44Å; D383-D385 VanDerWaalsContact OD1-N 3.08Å; D385-L387 PolarHBondContact O-N 3.05Å
386	A	93	Very high	87.1	Confident	61 Å²	61	51.2 Å²	51.2	50%	0.504	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-73	-5.1	174.8	0	0	0	0	0	115	D383 L384 D388	D383-A386 HydrophobicContact CB-CB 4.1Å; D383-A386 PolarHBondContact OD1-N 2.98Å; D383-A386 WeakPolarHBondContact OD2-CB 3.05Å; L384-A386 VanDerWaalsContact C-N 3.33Å; A386-D388 VanDerWaalsContact C-N 3.29Å
387	L	93.8	Very high	87.4	Confident	6 Å²	6	48.3 Å²	48.3	3%	0.031	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-76.6	-16.8	179.8	-62.1	-178.7	0	0	0	113.5	L298 R371 V373 L382 L384 D385 L389	L298-L387 HydrophobicContact CD1-CD1 3.73Å; L298-L387 HydrophobicContact CD2-CD1 4.39Å; R371-L387 PolarHBondContact NH1-O 2.92Å; V373-L387 HydrophobicContact CB-CD2 4.34Å; V373-L387 HydrophobicContact CG1-CD2 3.93Å; V373-L387 HydrophobicContact CG2-CD2 4.02Å; L382-L387 HydrophobicContact CD2-CD1 4.32Å; L384-L387 HydrophobicContact CD2-CD1 3.9Å; L384-L387 WeakPolarHBondContact O-CB 3.44Å; L384-L387 PolarHBondContact O-N 3.29Å; D385-L387 PolarHBondContact O-N 3.05Å; L387-L389 HydrophobicContact CB-CD1 4.36Å; L387-L389 HydrophobicContact CB-CD2 3.84Å; L387-L389 HydrophobicContact CB-CG 3.82Å; L387-L389 HydrophobicContact CD1-CD1 4.43Å
388	D	90.1	Very high	88	Confident	90 Å²	90	48.1 Å²	48.1	48%	0.481	29%	0.29	S	S	.	.			trans	51.2	52.7	-179.1	-152.6	-2.9	0	0	0	113.8	A386 R390 D391	A386-D388 VanDerWaalsContact C-N 3.29Å; D388-R390 PolarHBondContact O-N 3.45Å; D388-D391 PolarHBondContact O-N 3.37Å; D388-D391 VanDerWaalsContact OD2-OD1 3.1Å
389	L	93.3	Very high	88.6	Confident	11 Å²	11	47.6 Å²	47.6	6%	0.058	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-1.7	-172.6	-57.7	172.9	0	0	0	113.8	H296 L298 T329 L387 L398 L427	H296-L389 WeakPolarHBondContact ND1-CA 3.15Å; H296-L389 PolarHBondContact ND1-O 2.87Å; L298-L389 HydrophobicContact CB-CD1 4.12Å; L298-L389 HydrophobicContact CD1-CD1 4.47Å; L298-L389 HydrophobicContact CD1-CD2 4.4Å; L298-L389 HydrophobicContact CD2-CD1 3.97Å; L298-L389 HydrophobicContact CG-CD1 4.41Å; T329-L389 HydrophobicContact CG2-CD2 4.2Å; L387-L389 HydrophobicContact CB-CD1 4.36Å; L387-L389 HydrophobicContact CB-CD2 3.84Å; L387-L389 HydrophobicContact CB-CG 3.82Å; L387-L389 HydrophobicContact CD1-CD1 4.43Å; L389-L398 HydrophobicContact CB-CD1 4.15Å; L389-L398 HydrophobicContact CD1-CD1 4.17Å; L389-L398 HydrophobicContact CD1-CD2 4.27Å; L389-L427 HydrophobicContact CD1-CD1 3.99Å
390	R	87.4	Confident	89	Confident	110 Å²	110	47.3 Å²	47.3	42%	0.415	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	27.3	-178.5	-64.8	-169.7	176.5	-176.6	-3.8	113.1	D388 G392 G393 L427 D428	D388-R390 PolarHBondContact O-N 3.45Å; R390-G392 PolarHBondContact O-N 3.43Å; R390-G393 PolarHBondContact O-N 3.4Å; R390-L427 PolarHBondContact NH2-O 3.46Å; R390-D428 PolarHBondContact NH2-O 3.12Å; R390-D428 IonicContact NH2-OD2 3.32Å; R390-D428 PolarHBondContact NH2-OD2 2.97Å
391	D	72	Confident	89.4	Confident	105 Å²	105	45.7 Å²	45.7	56%	0.561	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47	-24.6	171.7	-78.7	-25.8	0	0	0	114.5	D388 G393	D388-D391 PolarHBondContact O-N 3.37Å; D388-D391 VanDerWaalsContact OD2-OD1 3.1Å; D391-G393 VanDerWaalsContact C-N 3.34Å
392	G	68.9	Low	89.7	Confident	21 Å²	21	40.4 Å²	40.4	22%	0.216	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-0.9	176.8	0	0	0	0	0	116	R294 R390 T396	R294-G392 VanDerWaalsContact CD-CA 3.49Å; R390-G392 PolarHBondContact O-N 3.43Å; G392-T396 WeakPolarHBondContact CA-OG1 3.31Å
393	G	79.2	Confident	89.9	Confident	38 Å²	38	39.8 Å²	39.8	39%	0.392	25%	0.245	S	C	.	.			trans	85.8	-171.8	-173.1	0	0	0	0	0	113.3	R390 D391 T395 T396	R390-G393 PolarHBondContact O-N 3.4Å; D391-G393 VanDerWaalsContact C-N 3.34Å; G393-T395 PolarHBondContact O-N 3.22Å; G393-T395 VanDerWaalsContact O-N 3.1Å; G393-T396 WeakPolarHBondContact O-CB 3.45Å; G393-T396 PolarHBondContact O-N 2.97Å; G393-T396 VanDerWaalsContact O-N 3.12Å; G393-T396 PolarHBondContact O-OG1 2.9Å
394	A	77.7	Confident	89.8	Confident	107 Å²	107	36.1 Å²	36.1	88%	0.884	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-16.7	-174.5	0	0	0	0	0	114.5	T396	A394-T396 VanDerWaalsContact C-N 3.26Å; A394-T396 PolarHBondContact O-N 3.17Å
395	T	80.7	Confident	89.6	Confident	37 Å²	37	36.5 Å²	36.5	23%	0.227	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	7.1	177.3	59.2	0	0	0	0	113.6	E291 Q293 R294 G393 A397	E291-T395 HydrophobicContact CB-CG2 4.45Å; E291-T395 VanDerWaalsContact OE2-CG2 3.26Å; E291-T395 WeakPolarHBondContact OE2-CG2 3.34Å; Q293-T395 PolarHBondContact OE1-O 3.5Å; Q293-T395 VanDerWaalsContact OE1-O 3.09Å; R294-T395 PolarHBondContact N-O 3.39Å; G393-T395 PolarHBondContact O-N 3.22Å; G393-T395 VanDerWaalsContact O-N 3.1Å; T395-A397 PolarHBondContact O-N 3.25Å
396	T	92.4	Very high	89.6	Confident	13 Å²	13	31.5 Å²	31.5	8%	0.08	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	110	179	-52.8	0	0	0	0	110.4	R294 H296 G392 G393 A394 L398	R294-T396 CarbonylContact O-C 3.49Å; R294-T396 VanDerWaalsContact O-CA 3.27Å; R294-T396 WeakPolarHBondContact O-CA 3.34Å; H296-T396 HydrophobicContact CB-CG2 3.68Å; G392-T396 WeakPolarHBondContact CA-OG1 3.31Å; G393-T396 WeakPolarHBondContact O-CB 3.45Å; G393-T396 PolarHBondContact O-N 2.97Å; G393-T396 VanDerWaalsContact O-N 3.12Å; G393-T396 PolarHBondContact O-OG1 2.9Å; A394-T396 VanDerWaalsContact C-N 3.26Å; A394-T396 PolarHBondContact O-N 3.17Å; T396-L398 PolarHBondContact O-N 3.46Å
397	A	95.1	Very high	89.1	Confident	10 Å²	10	29.9 Å²	29.9	8%	0.083	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	114.1	169.8	0	0	0	0	0	109.6	F282 A285 R294 F295 H296 T395	F282-A397 HydrophobicContact CD1-CB 4.11Å; F282-A397 HydrophobicContact CE1-CB 4.17Å; F282-A397 WeakPolarHBondContact CE1-O 3.49Å; A285-A397 HydrophobicContact CB-CB 4.05Å; R294-A397 PolarHBondContact O-N 3.48Å; F295-A397 HydrophobicContact CD1-CB 4.05Å; F295-A397 HydrophobicContact CE1-CB 4.45Å; H296-A397 PolarHBondContact N-O 3.4Å; T395-A397 PolarHBondContact O-N 3.25Å
398	L	97.1	Very high	88.3	Confident	5 Å²	5	30.5 Å²	30.5	3%	0.026	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	127.5	-178.2	178.3	63.5	0	0	0	111.1	H296 L389 T396 I400 L427 P429 R430	H296-L398 HydrophobicContact CB-CD1 4.2Å; H296-L398 CarbonylContact O-C 3.56Å; H296-L398 WeakPolarHBondContact O-CA 3.42Å; L389-L398 HydrophobicContact CB-CD1 4.15Å; L389-L398 HydrophobicContact CD1-CD1 4.17Å; L389-L398 HydrophobicContact CD1-CD2 4.27Å; T396-L398 PolarHBondContact O-N 3.46Å; L398-I400 HydrophobicContact CG-CG1 4.4Å; L398-L427 HydrophobicContact CD2-CB 3.88Å; L398-P429 HydrophobicContact CD2-CB 4.36Å; L398-P429 HydrophobicContact CG-CB 4.3Å; L398-P429 CarbonylContact O-C 3.58Å; L398-R430 PolarHBondContact O-N 3.37Å
399	A	98.4	Very high	88.1	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	142.2	163.4	0	0	0	0	0	110	I278 F282 H296 I297 L298 V431	I278-A399 HydrophobicContact CG1-CB 4.15Å; I278-A399 HydrophobicContact CG2-CB 4.14Å; F282-A399 HydrophobicContact CE1-CB 3.7Å; F282-A399 HydrophobicContact CE2-CB 4.4Å; F282-A399 HydrophobicContact CZ-CB 3.46Å; F282-A399 VanDerWaalsContact CZ-CB 3.46Å; H296-A399 PolarHBondContact O-N 2.95Å; I297-A399 CarbonylContact C-O 3.45Å; I297-A399 WeakPolarHBondContact CA-O 3.12Å; I297-A399 HydrophobicContact CG1-CB 4.32Å; L298-A399 PolarHBondContact N-O 3.21Å; A399-V431 WeakPolarHBondContact CA-O 3.29Å; A399-V431 HydrophobicContact CB-CG1 3.65Å
400	I	98.4	Very high	87.4	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	122	172.3	-57.4	176.6	0	0	0	108	L298 L398 L424 L427 P429 V431 V432 T433	L298-I400 HydrophobicContact CB-CG1 4.28Å; L298-I400 HydrophobicContact CD2-CG1 4.34Å; L298-I400 HydrophobicContact CD2-CG2 4.22Å; L398-I400 HydrophobicContact CG-CG1 4.4Å; I400-L424 HydrophobicContact CD1-CB 4.11Å; I400-L424 HydrophobicContact CD1-CD2 4.18Å; I400-L424 HydrophobicContact CG2-CD2 4.24Å; I400-L427 HydrophobicContact CD1-CB 4.35Å; I400-L427 HydrophobicContact CD1-CD1 3.87Å; I400-P429 HydrophobicContact CD1-CB 3.76Å; I400-P429 HydrophobicContact CD1-CG 3.82Å; I400-P429 HydrophobicContact CG1-CB 3.83Å; I400-P429 HydrophobicContact CG1-CG 4.38Å; I400-V431 PolarHBondContact N-O 2.6Å; I400-V432 HydrophobicContact CB-CG1 4.22Å; I400-V432 HydrophobicContact CB-CG2 4.17Å; I400-V432 HydrophobicContact CD1-CG2 4.43Å; I400-V432 HydrophobicContact CG2-CG1 4.36Å; I400-V432 CarbonylContact O-C 3.54Å; I400-V432 VanDerWaalsContact O-CA 3.26Å; I400-V432 WeakPolarHBondContact O-CA 3.31Å; I400-T433 PolarHBondContact O-N 2.97Å
401	N	98.6	Very high	86.3	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	107.7	179.3	-179.7	75.3	0	0	0	110.3	A274 I278 I297 L298 D299 L300 Q307 W308 T433	A274-N401 WeakPolarHBondContact CB-OD1 3.32Å; I278-N401 HydrophobicContact CD1-CB 4.27Å; I297-N401 HydrophobicContact CG2-CB 4.24Å; L298-N401 PolarHBondContact O-N 3.16Å; D299-N401 PolarHBondContact OD1-ND2 2.99Å; L300-N401 PolarHBondContact N-O 3.09Å; Q307-N401 PolarHBondContact NE2-OD1 3.17Å; Q307-N401 PolarHBondContact OE1-ND2 3.25Å; W308-N401 HydrophobicContact CH2-CB 3.74Å; W308-N401 HydrophobicContact CZ2-CB 4.14Å; N401-T433 WeakPolarHBondContact CA-OG1 3.1Å; N401-T433 PolarHBondContact OD1-OG1 2.86Å
402	C	97.6	Very high	85.6	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	104.6	176.2	-60.9	0	0	0	0	109	L406 T433 V434 V435	C402-L406 HydrophobicContact CB-CD1 4.21Å; C402-L406 HydrophobicContact CB-CD2 4.04Å; C402-L406 HydrophobicContact CB-CG 3.97Å; C402-T433 PolarHBondContact N-O 2.89Å; C402-V434 HydrophobicContact CB-CG2 4.45Å; C402-V434 CarbonylContact O-C 3.45Å; C402-V434 WeakPolarHBondContact O-CA 3.42Å; C402-V435 PolarHBondContact O-N 3.03Å
403	L	96.3	Very high	85.1	Confident	7 Å²	7	19.1 Å²	19.1	4%	0.037	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	105.8	177.8	-170.2	155.2	0	0	0	110.3	H271 L300 S301 T303 S405 V435	H271-L403 WeakPolarHBondContact CD2-CD1 3.5Å; H271-L403 WeakPolarHBondContact NE2-CD1 3.49Å; L300-L403 PolarHBondContact O-N 3.5Å; S301-L403 WeakPolarHBondContact CA-O 3.47Å; T303-L403 HydrophobicContact CG2-CD2 3.48Å; T303-L403 VanDerWaalsContact CG2-CD2 3.48Å; L403-S405 PolarHBondContact O-N 3.18Å; L403-V435 HydrophobicContact CB-CB 4.39Å; L403-V435 HydrophobicContact CD1-CB 4.41Å; L403-V435 HydrophobicContact CG-CB 3.99Å; L403-V435 HydrophobicContact CG-CG1 4.17Å
404	N	91.2	Very high	84.1	Confident	18 Å²	18	19.7 Å²	19.7	10%	0.096	15%	0.146	C	C	.	.	S	Bend	trans	57.9	33	173.3	-146.5	18.8	0	0	0	113.1	N302 R407 V435 E437	N302-N404 PolarHBondContact ND2-O 3.36Å; N404-R407 PolarHBondContact ND2-NH1 3.29Å; N404-R407 PolarHBondContact ND2-NH2 3.09Å; N404-R407 PolarHBondContact O-NE 3.26Å; N404-R407 PolarHBondContact OD1-NE 3.46Å; N404-R407 PolarHBondContact OD1-NH1 3.21Å; N404-V435 PolarHBondContact N-O 2.67Å; N404-E437 PolarHBondContact ND2-OE1 2.98Å
405	S	89.5	Confident	84.1	Confident	16 Å²	16	24.7 Å²	24.7	11%	0.112	14%	0.142	C	C	.	.			trans	-120.1	-25	-170.6	59.1	0	0	0	0	112.5	L300 L403 R407 G408 E436	L300-S405 WeakPolarHBondContact O-CB 3.41Å; L300-S405 PolarHBondContact O-OG 3.12Å; L403-S405 PolarHBondContact O-N 3.18Å; S405-R407 VanDerWaalsContact C-N 3.29Å; S405-R407 PolarHBondContact O-N 3.19Å; S405-G408 WeakPolarHBondContact O-CA 3.42Å; S405-G408 PolarHBondContact O-N 3.03Å; S405-E436 PolarHBondContact N-OE1 2.84Å; S405-E436 VanDerWaalsContact N-OE1 3.12Å
406	L	90.1	Very high	84.3	Confident	7 Å²	7	26.9 Å²	26.9	4%	0.037	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-70.4	-29.3	-179.5	-56.8	-178.6	0	0	0	111.3	C402 G408 V409 F420 V434 E436 W520	C402-L406 HydrophobicContact CB-CD1 4.21Å; C402-L406 HydrophobicContact CB-CD2 4.04Å; C402-L406 HydrophobicContact CB-CG 3.97Å; L406-G408 PolarHBondContact O-N 3.14Å; L406-V409 WeakPolarHBondContact O-CB 3.44Å; L406-V409 PolarHBondContact O-N 2.86Å; L406-F420 HydrophobicContact CD2-CD1 4.06Å; L406-F420 HydrophobicContact CD2-CE1 3.73Å; L406-V434 HydrophobicContact CD1-CG1 3.68Å; L406-V434 HydrophobicContact CD1-CG2 4.31Å; L406-E436 WeakPolarHBondContact CA-OE1 3.4Å; L406-E436 HydrophobicContact CB-CG 4.49Å; L406-E436 VanDerWaalsContact CB-OE1 3.3Å; L406-E436 WeakPolarHBondContact CB-OE1 3.24Å; L406-E436 PolarHBondContact N-OE1 3.04Å; L406-W520 HydrophobicContact CB-CE3 4.48Å; L406-W520 HydrophobicContact CB-CH2 3.3Å; L406-W520 HydrophobicContact CB-CZ2 3.65Å; L406-W520 HydrophobicContact CB-CZ3 3.76Å; L406-W520 HydrophobicContact CD1-CD2 4.47Å; L406-W520 HydrophobicContact CD1-CE3 4Å; L406-W520 HydrophobicContact CD1-CH2 4.3Å; L406-W520 HydrophobicContact CD1-CZ3 3.92Å; L406-W520 HydrophobicContact CG-CH2 4.42Å; L406-W520 HydrophobicContact CG-CZ3 4.45Å
407	R	84.1	Confident	84.2	Confident	26 Å²	26	26.7 Å²	26.7	10%	0.098	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-56.3	-27.9	168	69.6	-178.9	-178.2	-162.6	0.9	113.4	N302 N404 S405 V409 R417 E437 M511 R514	N302-R407 PolarHBondContact ND2-NH2 2.82Å; N404-R407 PolarHBondContact ND2-NH1 3.29Å; N404-R407 PolarHBondContact ND2-NH2 3.09Å; N404-R407 PolarHBondContact O-NE 3.26Å; N404-R407 PolarHBondContact OD1-NE 3.46Å; N404-R407 PolarHBondContact OD1-NH1 3.21Å; S405-R407 VanDerWaalsContact C-N 3.29Å; S405-R407 PolarHBondContact O-N 3.19Å; R407-V409 VanDerWaalsContact C-N 3.26Å; R407-V409 PolarHBondContact O-N 2.77Å; R407-R417 PolarHBondContact O-NH2 2.9Å; R407-E437 VanDerWaalsContact NH1-CD 3.27Å; R407-E437 IonicContact NH1-OE1 3.81Å; R407-E437 PolarHBondContact NH1-OE1 3.11Å; R407-E437 IonicContact NH1-OE2 2.69Å; R407-E437 PolarHBondContact NH1-OE2 3.28Å; R407-M511 CarbonylContact C-O 3.58Å; R407-R514 HydrophobicContact CB-CG 4.47Å
408	G	77.5	Confident	83.9	Confident	19 Å²	19	28.5 Å²	28.5	20%	0.196	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-76.1	-10.5	178.9	0	0	0	0	0	114	S405 L406 V410	S405-G408 WeakPolarHBondContact O-CA 3.42Å; S405-G408 PolarHBondContact O-N 3.03Å; L406-G408 PolarHBondContact O-N 3.14Å; G408-V410 PolarHBondContact O-N 3.31Å
409	V	84.3	Confident	83.6	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.006	17%	0.173	C	C	.	.	S	Bend	trans	-74.9	109.6	163	-179.6	0	0	0	0	106.7	L379 A380 L406 R407 R416 R417 F420	L379-V409 HydrophobicContact CB-CG2 3.96Å; L379-V409 HydrophobicContact CD2-CG2 4.34Å; L379-V409 HydrophobicContact CG-CG2 4.44Å; A380-V409 HydrophobicContact CB-CG1 3.86Å; L406-V409 WeakPolarHBondContact O-CB 3.44Å; L406-V409 PolarHBondContact O-N 2.86Å; R407-V409 VanDerWaalsContact C-N 3.26Å; R407-V409 PolarHBondContact O-N 2.77Å; V409-R416 HydrophobicContact CG1-CB 4.4Å; V409-R416 HydrophobicContact CG1-CG 3.92Å; V409-R417 HydrophobicContact CB-CG 3.93Å; V409-R417 HydrophobicContact CG1-CB 4.48Å; V409-R417 HydrophobicContact CG1-CG 3.68Å; V409-R417 PolarHBondContact O-NE 3.43Å; V409-R417 PolarHBondContact O-NH2 2.83Å; V409-F420 HydrophobicContact CG2-CB 4.41Å; V409-F420 HydrophobicContact CG2-CD1 3.89Å; V409-F420 HydrophobicContact CG2-CE1 4.36Å; V409-F420 HydrophobicContact CG2-CG 4.09Å
410	V	79	Confident	83.3	Confident	18 Å²	18	31.3 Å²	31.3	11%	0.109	18%	0.175	C	C	.	.			trans	-59.8	131.4	-175.4	-179.5	0	0	0	0	107.9	D378 G408 G412 R416 S508 M511	D378-V410 WeakPolarHBondContact OD2-CA 3.38Å; D378-V410 WeakPolarHBondContact OD2-CB 2.87Å; D378-V410 WeakPolarHBondContact OD2-CG2 3.19Å; D378-V410 PolarHBondContact OD2-N 3.06Å; G408-V410 PolarHBondContact O-N 3.31Å; V410-G412 PolarHBondContact O-N 3.36Å; V410-G412 VanDerWaalsContact O-N 3.11Å; V410-R416 WeakPolarHBondContact O-CD 3.49Å; V410-S508 VanDerWaalsContact CG1-C 3.45Å; V410-S508 WeakPolarHBondContact CG1-O 3.24Å; V410-M511 HydrophobicContact CG2-CG 4.13Å
411	P	64.3	Low	83.1	Confident	11 Å²	11	31.8 Å²	31.8	7%	0.071	18%	0.18	C	C	.	.			trans	-57.2	-32.4	-175.2	-27.6	34.5	0	0	0	112.8	G413 V442 F444 R513	P411-G413 CarbonylContact O-C 3.52Å; P411-G413 WeakPolarHBondContact O-CA 3.36Å; P411-G413 PolarHBondContact O-N 3.03Å; P411-V442 HydrophobicContact CB-CG1 4.41Å; P411-V442 HydrophobicContact CG-CG2 4.49Å; P411-F444 HydrophobicContact CB-CZ 4.5Å; P411-R513 HydrophobicContact CG-CB 3.81Å; P411-R513 HydrophobicContact CG-CG 4.44Å
412	G	57.9	Low	82.9	Confident	29 Å²	29	33.6 Å²	33.6	30%	0.299	20%	0.195	S	C	.	.	S	Bend	trans	37.2	17.7	158	0	0	0	0	0	119.8	V410	V410-G412 PolarHBondContact O-N 3.36Å; V410-G412 VanDerWaalsContact O-N 3.11Å
413	G	58.8	Low	82.8	Confident	40 Å²	40	34.7 Å²	34.7	41%	0.412	20%	0.202	S	C	.	.	S	Bend	trans	106.3	127	-158.5	0	0	0	0	0	112.6	P411 R415 R416	P411-G413 CarbonylContact O-C 3.52Å; P411-G413 WeakPolarHBondContact O-CA 3.36Å; P411-G413 PolarHBondContact O-N 3.03Å; G413-R415 PolarHBondContact O-N 3.43Å; G413-R416 PolarHBondContact O-N 2.98Å
414	V	58.1	Low	82.8	Confident	50 Å²	50	34.5 Å²	34.5	30%	0.303	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-37.9	-34.7	-175	179.6	0	0	0	0	114.2	F444 R523	V414-F444 HydrophobicContact CB-CE1 4.11Å; V414-F444 HydrophobicContact CG2-CD1 3.61Å; V414-F444 HydrophobicContact CG2-CE1 3.45Å; V414-F444 VanDerWaalsContact CG2-CE1 3.45Å; V414-F444 HydrophobicContact CG2-CZ 4.38Å; V414-R523 PolarHBondContact O-NH1 3.28Å; V414-R523 VanDerWaalsContact O-NH1 3.1Å
415	R	76.1	Confident	83	Confident	211 Å²	211	37.3 Å²	37.3	80%	0.796	21%	0.211	S	C	*	.	H	α-helix	trans	-79.1	-17.2	-172.7	-66.8	-174.7	153.9	-164.5	-7	116	G413 D418 A419	G413-R415 PolarHBondContact O-N 3.43Å; R415-D418 PolarHBondContact O-N 3.04Å; R415-A419 WeakPolarHBondContact O-CB 3.44Å; R415-A419 PolarHBondContact O-N 3.31Å
416	R	85.3	Confident	83.3	Confident	83 Å²	83	43.8 Å²	43.8	31%	0.313	23%	0.233	S	C	.	.	H	α-helix	trans	-69	-45.9	-174.5	-165.9	179.7	-106.8	-114.1	5.5	111.8	D378 A380 E381 V409 V410 G413 D418 A419 F420	D378-R416 IonicContact OD1-NH1 3.25Å; D378-R416 PolarHBondContact OD1-NH1 3.32Å; D378-R416 IonicContact OD2-CZ 3.89Å; D378-R416 IonicContact OD2-NH1 3.19Å; D378-R416 PolarHBondContact OD2-NH1 2.6Å; A380-R416 HydrophobicContact CB-CG 3.67Å; E381-R416 IonicContact OE1-CZ 3.35Å; E381-R416 IonicContact OE1-NH1 2.88Å; E381-R416 PolarHBondContact OE1-NH1 2.99Å; E381-R416 IonicContact OE1-NH2 2.84Å; E381-R416 PolarHBondContact OE1-NH2 3.29Å; V409-R416 HydrophobicContact CG1-CB 4.4Å; V409-R416 HydrophobicContact CG1-CG 3.92Å; V410-R416 WeakPolarHBondContact O-CD 3.49Å; G413-R416 PolarHBondContact O-N 2.98Å; R416-D418 VanDerWaalsContact C-N 3.34Å; R416-D418 PolarHBondContact O-N 3.45Å; R416-A419 PolarHBondContact O-N 3.43Å; R416-F420 PolarHBondContact O-N 3.32Å
417	R	90	Very high	83.5	Confident	9 Å²	9	44.4 Å²	44.4	3%	0.034	24%	0.236	C	C	.	.	H	α-helix	trans	-62.4	-39.7	173	-73.9	177.4	177.3	-178.3	-4	112.2	R407 V409 F420 G421 R513 E515 W520	R407-R417 PolarHBondContact O-NH2 2.9Å; V409-R417 HydrophobicContact CB-CG 3.93Å; V409-R417 HydrophobicContact CG1-CB 4.48Å; V409-R417 HydrophobicContact CG1-CG 3.68Å; V409-R417 PolarHBondContact O-NE 3.43Å; V409-R417 PolarHBondContact O-NH2 2.83Å; R417-F420 PolarHBondContact O-N 2.8Å; R417-G421 PolarHBondContact O-N 3.36Å; R417-R513 PolarHBondContact NH1-O 3.3Å; R417-R513 PolarHBondContact NH2-O 2.75Å; R417-E515 VanDerWaalsContact CD-OE1 3.24Å; R417-E515 WeakPolarHBondContact CD-OE1 3.25Å; R417-E515 IonicContact CZ-OE1 3.54Å; R417-E515 IonicContact NE-OE1 2.78Å; R417-E515 IonicContact NH1-OE1 2.8Å; R417-E515 PolarHBondContact NH1-OE1 3.1Å; R417-W520 HydrophobicContact CG-CH2 4.3Å
418	D	90	Very high	84	Confident	48 Å²	48	47.2 Å²	47.2	26%	0.257	25%	0.253	S	S	.	.	H	α-helix	trans	-67.1	-43.3	177.7	-61.7	-23.4	0	0	0	111.8	R415 R416 F420 G421 A422 R523	R415-D418 PolarHBondContact O-N 3.04Å; R416-D418 VanDerWaalsContact C-N 3.34Å; R416-D418 PolarHBondContact O-N 3.45Å; D418-F420 VanDerWaalsContact C-N 3.31Å; D418-F420 PolarHBondContact O-N 3.17Å; D418-G421 PolarHBondContact O-N 2.96Å; D418-A422 WeakPolarHBondContact O-CB 3.19Å; D418-A422 PolarHBondContact O-N 3.11Å; D418-R523 VanDerWaalsContact CG-NH1 3.33Å; D418-R523 WeakPolarHBondContact OD1-CG 3.34Å; D418-R523 IonicContact OD1-CZ 3.5Å; D418-R523 IonicContact OD1-NH1 2.67Å; D418-R523 PolarHBondContact OD1-NH1 2.78Å; D418-R523 IonicContact OD2-NH1 3.74Å
419	A	90.4	Very high	84.9	Confident	56 Å²	56	46.4 Å²	46.4	46%	0.463	24%	0.244	S	C	.	.	H	α-helix	trans	-64.1	-37.2	176	0	0	0	0	0	111.8	R415 R416 A422 S423	R415-A419 WeakPolarHBondContact O-CB 3.44Å; R415-A419 PolarHBondContact O-N 3.31Å; R416-A419 PolarHBondContact O-N 3.43Å; A419-A422 PolarHBondContact O-N 2.68Å; A419-S423 WeakPolarHBondContact O-CB 3.25Å; A419-S423 PolarHBondContact O-N 2.85Å; A419-S423 PolarHBondContact O-OG 2.8Å
420	F	92.8	Very high	85.5	Confident	9 Å²	9	50.7 Å²	50.7	4%	0.039	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-47.9	172.8	-173.1	-111.7	0	0	0	111.2	L300 L379 A380 L384 L406 V409 R416 R417 D418 A422 S423 L424	L300-F420 HydrophobicContact CD1-CE1 4.21Å; L300-F420 HydrophobicContact CD1-CZ 3.8Å; L379-F420 HydrophobicContact CD1-CZ 4.42Å; L379-F420 HydrophobicContact CD2-CE1 4.01Å; L379-F420 HydrophobicContact CD2-CZ 3.83Å; L379-F420 HydrophobicContact CG-CE1 4.26Å; L379-F420 HydrophobicContact CG-CE2 4.02Å; L379-F420 HydrophobicContact CG-CZ 3.67Å; L379-F420 WeakPolarHBondContact O-CE2 3.37Å; A380-F420 HydrophobicContact CB-CB 4.24Å; A380-F420 HydrophobicContact CB-CD2 4.33Å; L384-F420 HydrophobicContact CD1-CE2 4.32Å; L406-F420 HydrophobicContact CD2-CD1 4.06Å; L406-F420 HydrophobicContact CD2-CE1 3.73Å; V409-F420 HydrophobicContact CG2-CB 4.41Å; V409-F420 HydrophobicContact CG2-CD1 3.89Å; V409-F420 HydrophobicContact CG2-CE1 4.36Å; V409-F420 HydrophobicContact CG2-CG 4.09Å; R416-F420 PolarHBondContact O-N 3.32Å; R417-F420 PolarHBondContact O-N 2.8Å; D418-F420 VanDerWaalsContact C-N 3.31Å; D418-F420 PolarHBondContact O-N 3.17Å; F420-A422 VanDerWaalsContact C-N 3.33Å; F420-A422 PolarHBondContact O-N 2.68Å; F420-S423 WeakPolarHBondContact O-CA 3.43Å; F420-S423 WeakPolarHBondContact O-CB 3.11Å; F420-S423 PolarHBondContact O-N 2.88Å; F420-L424 HydrophobicContact CD1-CD1 4.3Å; F420-L424 HydrophobicContact CD1-CG 4.47Å; F420-L424 HydrophobicContact CE1-CD1 3.94Å; F420-L424 HydrophobicContact CE1-CD2 4.14Å; F420-L424 HydrophobicContact CE1-CG 4.18Å; F420-L424 HydrophobicContact CE2-CD2 4.43Å; F420-L424 HydrophobicContact CZ-CD2 3.92Å; F420-L424 HydrophobicContact CZ-CG 4.41Å; F420-L424 PolarHBondContact O-N 3.12Å
421	G	93.6	Very high	86.4	Confident	10 Å²	10	50.1 Å²	50.1	10%	0.103	26%	0.256	C	S	.	.	H	α-helix	trans	-55.8	-45.2	174.1	0	0	0	0	0	112.8	R417 D418 S423 L424 R425	R417-G421 PolarHBondContact O-N 3.36Å; D418-G421 PolarHBondContact O-N 2.96Å; G421-S423 PolarHBondContact O-N 3.1Å; G421-L424 WeakPolarHBondContact O-CB 3.43Å; G421-L424 PolarHBondContact O-N 2.76Å; G421-R425 PolarHBondContact O-N 3.47Å
422	A	94	Very high	88	Confident	37 Å²	37	49.6 Å²	49.6	31%	0.306	25%	0.253	S	S	.	.	H	α-helix	trans	-62.4	-31.2	174.4	0	0	0	0	0	112.5	D418 A419 F420 R425 R426	D418-A422 WeakPolarHBondContact O-CB 3.19Å; D418-A422 PolarHBondContact O-N 3.11Å; A419-A422 PolarHBondContact O-N 2.68Å; F420-A422 VanDerWaalsContact C-N 3.33Å; F420-A422 PolarHBondContact O-N 2.68Å; A422-R425 WeakPolarHBondContact O-CB 3.48Å; A422-R425 PolarHBondContact O-N 3.14Å; A422-R426 WeakPolarHBondContact O-CG 3.45Å; A422-R426 PolarHBondContact O-N 3.44Å
423	S	95.2	Very high	89.9	Confident	23 Å²	23	48.2 Å²	48.2	16%	0.161	24%	0.239	C	C	.	.	H	α-helix	trans	-71.6	-37.6	175.6	-55.4	0	0	0	0	112.4	A419 F420 G421 R425 R426	A419-S423 WeakPolarHBondContact O-CB 3.25Å; A419-S423 PolarHBondContact O-N 2.85Å; A419-S423 PolarHBondContact O-OG 2.8Å; F420-S423 WeakPolarHBondContact O-CA 3.43Å; F420-S423 WeakPolarHBondContact O-CB 3.11Å; F420-S423 PolarHBondContact O-N 2.88Å; G421-S423 PolarHBondContact O-N 3.1Å; S423-R425 VanDerWaalsContact C-N 3.3Å; S423-R425 PolarHBondContact O-N 2.81Å; S423-R426 VanDerWaalsContact CA-NH1 3.29Å; S423-R426 VanDerWaalsContact CB-NH2 3.26Å; S423-R426 PolarHBondContact O-N 2.9Å; S423-R426 PolarHBondContact OG-NH1 3.01Å; S423-R426 PolarHBondContact OG-NH2 3.42Å
424	L	96.1	Very high	91.8	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-39.3	169.3	-57.2	-179.3	0	0	0	111.4	L300 L384 I400 F420 G421 R426 L427 P429 F529	L300-L424 HydrophobicContact CD1-CD2 4.36Å; L384-L424 HydrophobicContact CD1-CD2 3.89Å; I400-L424 HydrophobicContact CD1-CB 4.11Å; I400-L424 HydrophobicContact CD1-CD2 4.18Å; I400-L424 HydrophobicContact CG2-CD2 4.24Å; F420-L424 HydrophobicContact CD1-CD1 4.3Å; F420-L424 HydrophobicContact CD1-CG 4.47Å; F420-L424 HydrophobicContact CE1-CD1 3.94Å; F420-L424 HydrophobicContact CE1-CD2 4.14Å; F420-L424 HydrophobicContact CE1-CG 4.18Å; F420-L424 HydrophobicContact CE2-CD2 4.43Å; F420-L424 HydrophobicContact CZ-CD2 3.92Å; F420-L424 HydrophobicContact CZ-CG 4.41Å; F420-L424 PolarHBondContact O-N 3.12Å; G421-L424 WeakPolarHBondContact O-CB 3.43Å; G421-L424 PolarHBondContact O-N 2.76Å; L424-R426 VanDerWaalsContact C-N 3.3Å; L424-R426 PolarHBondContact O-N 2.86Å; L424-L427 WeakPolarHBondContact O-CB 3.5Å; L424-L427 PolarHBondContact O-N 3.26Å; L424-P429 WeakPolarHBondContact O-CD 3.37Å; L424-F529 HydrophobicContact CB-CZ 4.31Å
425	R	96.6	Very high	93.7	Very high	78 Å²	78	44.3 Å²	44.3	29%	0.294	21%	0.207	S	C	.	.	H	α-helix	trans	-62.5	-33.6	177.3	-178.9	63.2	179.6	76.3	-6.2	113.1	G421 A422 S423 L427 D428 A527 G528 F529 P586	G421-R425 PolarHBondContact O-N 3.47Å; A422-R425 WeakPolarHBondContact O-CB 3.48Å; A422-R425 PolarHBondContact O-N 3.14Å; S423-R425 VanDerWaalsContact C-N 3.3Å; S423-R425 PolarHBondContact O-N 2.81Å; R425-L427 VanDerWaalsContact C-N 3.29Å; R425-L427 PolarHBondContact O-N 3.1Å; R425-D428 PolarHBondContact O-N 2.8Å; R425-A527 WeakPolarHBondContact CB-O 3.3Å; R425-A527 VanDerWaalsContact CG-O 3.28Å; R425-A527 WeakPolarHBondContact CG-O 3.33Å; R425-G528 PolarHBondContact NE-O 2.87Å; R425-F529 VanDerWaalsContact CA-CZ 3.46Å; R425-F529 HydrophobicContact CB-CE2 3.7Å; R425-F529 HydrophobicContact CB-CZ 3.72Å; R425-F529 HydrophobicContact CG-CZ 4.45Å; R425-P586 VanDerWaalsContact CZ-CB 3.44Å; R425-P586 PolarHBondContact NE-OXT 2.9Å; R425-P586 VanDerWaalsContact NE-OXT 3.1Å; R425-P586 PolarHBondContact NH2-OXT 2.92Å
426	R	95.2	Very high	94.7	Very high	151 Å²	151	34.4 Å²	34.4	57%	0.57	17%	0.17	S	C	*	.	H	α-helix	trans	-67.9	-26.3	178.5	-71.4	-164.7	-52.8	-80.8	0.2	113.5	A422 S423 L424 D428	A422-R426 WeakPolarHBondContact O-CG 3.45Å; A422-R426 PolarHBondContact O-N 3.44Å; S423-R426 VanDerWaalsContact CA-NH1 3.29Å; S423-R426 VanDerWaalsContact CB-NH2 3.26Å; S423-R426 PolarHBondContact O-N 2.9Å; S423-R426 PolarHBondContact OG-NH1 3.01Å; S423-R426 PolarHBondContact OG-NH2 3.42Å; L424-R426 VanDerWaalsContact C-N 3.3Å; L424-R426 PolarHBondContact O-N 2.86Å; R426-D428 PolarHBondContact O-N 2.75Å
427	L	94.9	Very high	95.2	Very high	21 Å²	21	31.1 Å²	31.1	11%	0.11	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-9.2	174.6	-62.2	176.9	0	0	0	112.9	L298 L384 L389 R390 L398 I400 L424 R425	L298-L427 HydrophobicContact CD2-CD1 4.13Å; L384-L427 HydrophobicContact CB-CD1 4.24Å; L384-L427 HydrophobicContact CB-CD2 4.27Å; L384-L427 HydrophobicContact CD1-CD1 4.18Å; L384-L427 HydrophobicContact CD2-CD1 4.49Å; L389-L427 HydrophobicContact CD1-CD1 3.99Å; R390-L427 PolarHBondContact NH2-O 3.46Å; L398-L427 HydrophobicContact CD2-CB 3.88Å; I400-L427 HydrophobicContact CD1-CB 4.35Å; I400-L427 HydrophobicContact CD1-CD1 3.87Å; L424-L427 WeakPolarHBondContact O-CB 3.5Å; L424-L427 PolarHBondContact O-N 3.26Å; R425-L427 VanDerWaalsContact C-N 3.29Å; R425-L427 PolarHBondContact O-N 3.1Å
428	D	94.3	Very high	95.5	Very high	85 Å²	85	32 Å²	32	46%	0.455	16%	0.163	S	C	.	.			trans	49.5	59.2	-179.2	-178.5	50.9	0	0	0	111.6	R390 R425 R426	R390-D428 PolarHBondContact NH2-O 3.12Å; R390-D428 IonicContact NH2-OD2 3.32Å; R390-D428 PolarHBondContact NH2-OD2 2.97Å; R425-D428 PolarHBondContact O-N 2.8Å; R426-D428 PolarHBondContact O-N 2.75Å
429	P	96.5	Very high	95.7	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.006	15%	0.151	C	C	.	.			trans	-74.5	146.7	-179.3	33.2	-37.1	0	0	0	110.6	L398 I400 L424 V431 V432 F529 P586	L398-P429 HydrophobicContact CD2-CB 4.36Å; L398-P429 HydrophobicContact CG-CB 4.3Å; L398-P429 CarbonylContact O-C 3.58Å; I400-P429 HydrophobicContact CD1-CB 3.76Å; I400-P429 HydrophobicContact CD1-CG 3.82Å; I400-P429 HydrophobicContact CG1-CB 3.83Å; I400-P429 HydrophobicContact CG1-CG 4.38Å; L424-P429 WeakPolarHBondContact O-CD 3.37Å; P429-V431 VanDerWaalsContact C-N 3.34Å; P429-V432 HydrophobicContact CB-CG2 4.06Å; P429-V432 HydrophobicContact CG-CG2 3.45Å; P429-V432 VanDerWaalsContact CG-CG2 3.45Å; P429-F529 HydrophobicContact CG-CE1 3.98Å; P429-F529 HydrophobicContact CG-CZ 4.38Å; P429-P586 HydrophobicContact CG-CG 4.39Å; P429-P586 WeakPolarHBondContact O-CD 3.43Å; P429-P586 WeakPolarHBondContact O-CG 3.21Å
430	R	96.2	Very high	95.9	Very high	92 Å²	92	30 Å²	30	35%	0.347	14%	0.144	S	C	.	.	S	Bend	trans	-67.7	-37.9	172.6	-166.7	-176.8	172.8	87.1	2	112	S281 E284 L398	S281-R430 WeakPolarHBondContact O-CD 3.34Å; S281-R430 PolarHBondContact O-NE 2.81Å; S281-R430 WeakPolarHBondContact OG-CD 3.29Å; S281-R430 VanDerWaalsContact OG-CG 3.29Å; S281-R430 WeakPolarHBondContact OG-CG 3.45Å; S281-R430 PolarHBondContact OG-NE 3.45Å; E284-R430 VanDerWaalsContact CB-NH2 3.27Å; E284-R430 IonicContact OE2-NH2 3.51Å; L398-R430 PolarHBondContact O-N 3.37Å
431	V	97.9	Very high	95.9	Very high	5 Å²	5	29.5 Å²	29.5	3%	0.03	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	143.1	177.4	64.1	0	0	0	0	110.7	I278 A399 I400 P429 T433 A583 W584	I278-V431 HydrophobicContact CG1-CG1 4.26Å; A399-V431 WeakPolarHBondContact CA-O 3.29Å; A399-V431 HydrophobicContact CB-CG1 3.65Å; I400-V431 PolarHBondContact N-O 2.6Å; P429-V431 VanDerWaalsContact C-N 3.34Å; V431-T433 HydrophobicContact CG2-CG2 4.42Å; V431-A583 HydrophobicContact CG2-CB 4.44Å; V431-W584 CarbonylContact C-O 3.54Å; V431-W584 WeakPolarHBondContact CA-O 3.42Å
432	V	98.4	Very high	95.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	119	169	-174.9	0	0	0	0	108.5	I400 P429 V434 M524 F529 A583 W584	I400-V432 HydrophobicContact CB-CG1 4.22Å; I400-V432 HydrophobicContact CB-CG2 4.17Å; I400-V432 HydrophobicContact CD1-CG2 4.43Å; I400-V432 HydrophobicContact CG2-CG1 4.36Å; I400-V432 CarbonylContact O-C 3.54Å; I400-V432 VanDerWaalsContact O-CA 3.26Å; I400-V432 WeakPolarHBondContact O-CA 3.31Å; P429-V432 HydrophobicContact CB-CG2 4.06Å; P429-V432 HydrophobicContact CG-CG2 3.45Å; P429-V432 VanDerWaalsContact CG-CG2 3.45Å; V432-V434 HydrophobicContact CG1-CG2 4.18Å; V432-M524 HydrophobicContact CB-CE 4.26Å; V432-M524 HydrophobicContact CG1-CE 4Å; V432-F529 HydrophobicContact CB-CE1 4.5Å; V432-F529 HydrophobicContact CG2-CD1 4.25Å; V432-F529 HydrophobicContact CG2-CE1 3.53Å; V432-F529 HydrophobicContact CG2-CZ 3.9Å; V432-A583 CarbonylContact O-C 3.54Å; V432-A583 WeakPolarHBondContact O-CA 3.5Å; V432-W584 HydrophobicContact CB-CB 4.3Å; V432-W584 PolarHBondContact N-O 3.36Å; V432-W584 PolarHBondContact O-N 3.15Å
433	T	98.5	Very high	94.8	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.006	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.7	172.4	51.7	0	0	0	0	109.4	A274 A277 I278 I400 N401 C402 V431 S582	A274-T433 HydrophobicContact CB-CG2 3.95Å; A277-T433 HydrophobicContact CB-CG2 4.15Å; I278-T433 HydrophobicContact CD1-CG2 4.23Å; I278-T433 HydrophobicContact CG1-CG2 3.9Å; I400-T433 PolarHBondContact O-N 2.97Å; N401-T433 WeakPolarHBondContact CA-OG1 3.1Å; N401-T433 PolarHBondContact OD1-OG1 2.86Å; C402-T433 PolarHBondContact N-O 2.89Å; V431-T433 HydrophobicContact CG2-CG2 4.42Å; T433-S582 WeakPolarHBondContact CA-O 3.19Å
434	V	97.8	Very high	93.3	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	119.9	178.9	-178.7	0	0	0	0	108.8	C402 L406 V432 E436 M524 W580 A581 S582	C402-V434 HydrophobicContact CB-CG2 4.45Å; C402-V434 CarbonylContact O-C 3.45Å; C402-V434 WeakPolarHBondContact O-CA 3.42Å; L406-V434 HydrophobicContact CD1-CG1 3.68Å; L406-V434 HydrophobicContact CD1-CG2 4.31Å; V432-V434 HydrophobicContact CG1-CG2 4.18Å; V434-E436 HydrophobicContact CG1-CG 4Å; V434-M524 HydrophobicContact CG2-CE 4.19Å; V434-M524 HydrophobicContact CG2-SD 4.32Å; V434-W580 HydrophobicContact CB-CZ3 4.42Å; V434-W580 HydrophobicContact CG1-CE3 4.45Å; V434-W580 HydrophobicContact CG1-CZ3 3.81Å; V434-A581 CarbonylContact O-C 3.5Å; V434-A581 WeakPolarHBondContact O-CA 3.44Å; V434-S582 PolarHBondContact N-O 2.76Å; V434-S582 PolarHBondContact O-N 3.33Å; V434-S582 PolarHBondContact O-OG 3.35Å
435	V	97.8	Very high	91.2	Very high	7 Å²	7	36.1 Å²	36.1	4%	0.042	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	113.9	173.9	-179.8	0	0	0	0	108.2	A274 C402 L403 N404 V579 W580 A581	A274-V435 HydrophobicContact CB-CG2 4.5Å; C402-V435 PolarHBondContact O-N 3.03Å; L403-V435 HydrophobicContact CB-CB 4.39Å; L403-V435 HydrophobicContact CD1-CB 4.41Å; L403-V435 HydrophobicContact CG-CB 3.99Å; L403-V435 HydrophobicContact CG-CG1 4.17Å; N404-V435 PolarHBondContact N-O 2.67Å; V435-V579 HydrophobicContact CG1-CG1 3.76Å; V435-W580 CarbonylContact C-O 3.38Å; V435-W580 VanDerWaalsContact CA-O 3.23Å; V435-W580 WeakPolarHBondContact CA-O 3.46Å; V435-A581 HydrophobicContact CG2-CB 4.07Å
436	E	96.4	Very high	89	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.009	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	157.1	-177.1	-76.8	-68.8	152.8	0	0	111.3	S405 L406 V434 V579 W580	S405-E436 PolarHBondContact N-OE1 2.84Å; S405-E436 VanDerWaalsContact N-OE1 3.12Å; L406-E436 WeakPolarHBondContact CA-OE1 3.4Å; L406-E436 HydrophobicContact CB-CG 4.49Å; L406-E436 VanDerWaalsContact CB-OE1 3.3Å; L406-E436 WeakPolarHBondContact CB-OE1 3.24Å; L406-E436 PolarHBondContact N-OE1 3.04Å; V434-E436 HydrophobicContact CG1-CG 4Å; E436-V579 WeakPolarHBondContact O-CA 3.21Å; E436-W580 HydrophobicContact CB-CE3 4.44Å; E436-W580 PolarHBondContact N-O 2.62Å; E436-W580 PolarHBondContact O-N 3.37Å
437	E	96.9	Very high	86.5	Confident	14 Å²	14	37.1 Å²	37.1	7%	0.065	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	131.1	177.3	-74.8	168.4	-169.9	0	0	111	W266 N404 R407 A439 F469 R514 L578	W266-E437 HydrophobicContact CZ2-CG 4.3Å; W266-E437 PolarHBondContact NE1-OE1 3.47Å; N404-E437 PolarHBondContact ND2-OE1 2.98Å; R407-E437 VanDerWaalsContact NH1-CD 3.27Å; R407-E437 IonicContact NH1-OE1 3.81Å; R407-E437 PolarHBondContact NH1-OE1 3.11Å; R407-E437 IonicContact NH1-OE2 2.69Å; R407-E437 PolarHBondContact NH1-OE2 3.28Å; E437-A439 PolarHBondContact O-N 3.28Å; E437-A439 VanDerWaalsContact O-N 3.1Å; E437-F469 HydrophobicContact CB-CE2 3.97Å; E437-F469 HydrophobicContact CB-CZ 3.78Å; E437-F469 HydrophobicContact CG-CZ 4.07Å; E437-F469 WeakPolarHBondContact OE2-CZ 3.21Å; E437-R514 HydrophobicContact CB-CG 4.28Å; E437-R514 IonicContact OE2-CZ 2.84Å; E437-R514 IonicContact OE2-NE 3.61Å; E437-R514 PolarHBondContact OE2-NE 3.31Å; E437-R514 IonicContact OE2-NH2 3.44Å; E437-R514 PolarHBondContact OE2-NH2 3.24Å; E437-L578 CarbonylContact C-O 3.6Å; E437-L578 WeakPolarHBondContact CA-O 3.31Å
438	E	95.6	Very high	84.5	Confident	29 Å²	29	37.8 Å²	37.8	14%	0.136	21%	0.205	C	C	.	.			trans	-81.7	88.6	-171.6	-173.8	63.1	-163.6	0	0	111.7	R468 T516 A517 F570 P577 L578	E438-R468 PolarHBondContact O-NH2 2.95Å; E438-T516 WeakPolarHBondContact OE1-CA 3.19Å; E438-T516 WeakPolarHBondContact OE1-CB 3.31Å; E438-T516 WeakPolarHBondContact OE1-CG2 2.99Å; E438-T516 WeakPolarHBondContact OE2-CA 3.48Å; E438-A517 PolarHBondContact OE1-N 2.93Å; E438-A517 WeakPolarHBondContact OE2-CB 3.39Å; E438-A517 PolarHBondContact OE2-N 3.1Å; E438-F570 HydrophobicContact CB-CE1 4.34Å; E438-F570 HydrophobicContact CG-CE1 3.93Å; E438-P577 HydrophobicContact CG-CB 4.28Å; E438-L578 PolarHBondContact N-O 3.41Å
439	A	95.3	Very high	82.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.209	C	C	.	.			trans	-150.2	138	173	0	0	0	0	0	112.5	E437 L441 E465 F469 R514 E515	E437-A439 PolarHBondContact O-N 3.28Å; E437-A439 VanDerWaalsContact O-N 3.1Å; A439-L441 HydrophobicContact CB-CD1 4.11Å; A439-L441 HydrophobicContact CB-CG 3.89Å; A439-L441 PolarHBondContact O-N 3.24Å; A439-L441 VanDerWaalsContact O-N 3.14Å; A439-E465 WeakPolarHBondContact CA-OE1 3.38Å; A439-F469 HydrophobicContact CB-CB 4.07Å; A439-F469 HydrophobicContact CB-CD2 3.73Å; A439-F469 HydrophobicContact CB-CE2 4.38Å; A439-F469 HydrophobicContact CB-CG 3.93Å; A439-R514 HydrophobicContact CB-CB 4.12Å; A439-R514 CarbonylContact O-C 3.59Å; A439-R514 WeakPolarHBondContact O-CB 3.27Å; A439-R514 VanDerWaalsContact O-O 3.06Å; A439-E515 CarbonylContact O-C 3.6Å; A439-E515 WeakPolarHBondContact O-CA 3.49Å; A439-E515 PolarHBondContact O-N 3.32Å
440	D	93.7	Very high	80.4	Confident	60 Å²	60	44.8 Å²	44.8	32%	0.321	24%	0.243	S	C	.	.			trans	-88.7	66.7	179.6	-173.2	11.1	0	0	0	112.6	V442 K461 E465 T516	D440-V442 VanDerWaalsContact C-N 3.31Å; D440-V442 PolarHBondContact O-N 2.91Å; D440-K461 PolarHBondContact O-NZ 2.79Å; D440-K461 IonicContact OD1-NZ 3.86Å; D440-K461 PolarHBondContact OD1-NZ 3.28Å; D440-K461 WeakPolarHBondContact OD2-CE 3.32Å; D440-K461 IonicContact OD2-NZ 2.68Å; D440-K461 PolarHBondContact OD2-NZ 3.38Å; D440-E465 HydrophobicContact CB-CG 4.29Å; D440-E465 PolarHBondContact N-OE1 2.71Å; D440-T516 HydrophobicContact CB-CG2 3.79Å
441	L	93.6	Very high	78.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.268	C	S	.	.			trans	-92.3	13.3	-174.9	-60.7	176.4	0	0	0	113.7	A439 V462 E465 L502 R513 R514	A439-L441 HydrophobicContact CB-CD1 4.11Å; A439-L441 HydrophobicContact CB-CG 3.89Å; A439-L441 PolarHBondContact O-N 3.24Å; A439-L441 VanDerWaalsContact O-N 3.14Å; L441-V462 HydrophobicContact CD2-CG1 4.42Å; L441-E465 HydrophobicContact CD2-CB 4.08Å; L441-E465 HydrophobicContact CD2-CG 3.79Å; L441-E465 HydrophobicContact CG-CG 4.46Å; L441-L502 HydrophobicContact CB-CD2 4.27Å; L441-L502 HydrophobicContact CD1-CD1 3.76Å; L441-L502 HydrophobicContact CD1-CD2 4.09Å; L441-R513 WeakPolarHBondContact O-CG 3.49Å; L441-R513 PolarHBondContact O-NH1 3.14Å; L441-R514 HydrophobicContact CD1-CB 4.08Å; L441-R514 HydrophobicContact CD1-CG 4.24Å; L441-R514 HydrophobicContact CG-CB 4.46Å; L441-R514 PolarHBondContact N-O 2.64Å; L441-R514 VanDerWaalsContact N-O 3.11Å
442	V	88.3	Confident	76.1	Confident	11 Å²	11	51 Å²	51	7%	0.067	28%	0.281	C	S	.	.			trans	-107.8	116.4	169.8	-161.8	0	0	0	0	109.9	P411 D440 F444 K461 R513 E515	P411-V442 HydrophobicContact CB-CG1 4.41Å; P411-V442 HydrophobicContact CG-CG2 4.49Å; D440-V442 VanDerWaalsContact C-N 3.31Å; D440-V442 PolarHBondContact O-N 2.91Å; V442-F444 HydrophobicContact CB-CD2 3.78Å; V442-F444 HydrophobicContact CB-CE2 3.78Å; V442-F444 HydrophobicContact CG1-CD1 4.21Å; V442-F444 HydrophobicContact CG1-CD2 3.23Å; V442-F444 HydrophobicContact CG1-CE1 4.14Å; V442-F444 HydrophobicContact CG1-CE2 3.16Å; V442-F444 HydrophobicContact CG1-CG 3.78Å; V442-F444 HydrophobicContact CG1-CZ 3.64Å; V442-F444 HydrophobicContact CG2-CE2 4.2Å; V442-F444 PolarHBondContact O-N 3.5Å; V442-K461 PolarHBondContact O-NZ 3.35Å; V442-R513 HydrophobicContact CG2-CB 4.18Å; V442-E515 HydrophobicContact CB-CG 4.44Å; V442-E515 HydrophobicContact CG2-CG 3.53Å
443	A	75.8	Confident	74.2	Confident	28 Å²	28	52.4 Å²	52.4	23%	0.231	30%	0.296	C	S	.	.			trans	-89.2	85.1	167.3	0	0	0	0	0	107.2	A458 K461 V462	A443-A458 HydrophobicContact CB-CB 3.52Å; A443-K461 HydrophobicContact CB-CD 4.15Å; A443-V462 HydrophobicContact CB-CG2 4.08Å
444	F	62.8	Low	72.9	Confident	79 Å²	79	56.3 Å²	56.3	35%	0.346	32%	0.316	S	S	.	.			trans	-81	123.5	173.9	-85.7	-66.8	0	0	0	109.6	P411 V414 V442 R523	P411-F444 HydrophobicContact CB-CZ 4.5Å; V414-F444 HydrophobicContact CB-CE1 4.11Å; V414-F444 HydrophobicContact CG2-CD1 3.61Å; V414-F444 HydrophobicContact CG2-CE1 3.45Å; V414-F444 VanDerWaalsContact CG2-CE1 3.45Å; V414-F444 HydrophobicContact CG2-CZ 4.38Å; V442-F444 HydrophobicContact CB-CD2 3.78Å; V442-F444 HydrophobicContact CB-CE2 3.78Å; V442-F444 HydrophobicContact CG1-CD1 4.21Å; V442-F444 HydrophobicContact CG1-CD2 3.23Å; V442-F444 HydrophobicContact CG1-CE1 4.14Å; V442-F444 HydrophobicContact CG1-CE2 3.16Å; V442-F444 HydrophobicContact CG1-CG 3.78Å; V442-F444 HydrophobicContact CG1-CZ 3.64Å; V442-F444 HydrophobicContact CG2-CE2 4.2Å; V442-F444 PolarHBondContact O-N 3.5Å; F444-R523 VanDerWaalsContact CE2-NH2 3.32Å
445	D	53.5	Low	72.3	Confident	93 Å²	93	59.7 Å²	59.7	50%	0.497	34%	0.337	S	S	.	.			trans	-104.3	114.4	143.1	177.7	-4.7	0	0	0	105.8	D447 A448	D445-D447 PolarHBondContact O-N 2.94Å; D445-D447 PolarHBondContact OD1-N 2.89Å; D445-A448 HydrophobicContact CB-CB 3.57Å; D445-A448 WeakPolarHBondContact O-CB 3.27Å; D445-A448 PolarHBondContact O-N 3.08Å
446	P	48.8	Very low	71.8	Confident	100 Å²	100	64 Å²	64	65%	0.649	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.2	179.2	24.8	-31.4	0	0	0	113.4
447	D	43.8	Very low	71.6	Confident	150 Å²	150	67.4 Å²	67.4	80%	0.802	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-2.2	179.2	-61.9	-40.3	0	0	0	112.8	D445 S449	D445-D447 PolarHBondContact O-N 2.94Å; D445-D447 PolarHBondContact OD1-N 2.89Å; D447-S449 PolarHBondContact O-N 3.07Å
448	A	52.2	Low	71.2	Confident	35 Å²	35	67.3 Å²	67.3	29%	0.289	39%	0.386	S	S	.	.			trans	-70.7	125.5	178.1	0	0	0	0	0	112	D445 S452	D445-A448 HydrophobicContact CB-CB 3.57Å; D445-A448 WeakPolarHBondContact O-CB 3.27Å; D445-A448 PolarHBondContact O-N 3.08Å; A448-S452 WeakPolarHBondContact CA-OG 3.49Å; A448-S452 WeakPolarHBondContact CB-OG 3.48Å
449	S	53.4	Low	71.2	Confident	76 Å²	76	66.4 Å²	66.4	53%	0.531	38%	0.382	S	S	.	.			trans	-57.5	152.2	162.6	61	0	0	0	0	109.7	D447 E451 S452	D447-S449 PolarHBondContact O-N 3.07Å; S449-E451 PolarHBondContact O-N 3.09Å; S449-S452 PolarHBondContact N-OG 3.12Å; S449-S452 PolarHBondContact O-N 3.43Å; S449-S452 PolarHBondContact O-OG 3.37Å
450	E	52.3	Low	71.2	Confident	157 Å²	157	68.7 Å²	68.7	73%	0.734	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-20.4	-177.9	-66.2	-172.7	173.9	0	0	114.2
451	E	50.9	Low	71.2	Confident	186 Å²	186	69.5 Å²	69.5	87%	0.869	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-14	178.3	-62.8	-172	160.3	0	0	114.4	S449	S449-E451 PolarHBondContact O-N 3.09Å
452	S	53	Low	71.3	Confident	42 Å²	42	69.9 Å²	69.9	29%	0.294	40%	0.397	S	S	.	.			trans	-96.3	2.8	-172.9	58	0	0	0	0	114.9	A448 S449 D454 T455	A448-S452 WeakPolarHBondContact CA-OG 3.49Å; A448-S452 WeakPolarHBondContact CB-OG 3.48Å; S449-S452 PolarHBondContact N-OG 3.12Å; S449-S452 PolarHBondContact O-N 3.43Å; S449-S452 PolarHBondContact O-OG 3.37Å; S452-D454 PolarHBondContact O-N 3.36Å; S452-D454 VanDerWaalsContact O-N 3.1Å; S452-T455 WeakPolarHBondContact O-CG2 3.38Å
453	G	57.9	Low	71.7	Confident	30 Å²	30	69.6 Å²	69.6	31%	0.309	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-5.8	-178.3	0	0	0	0	0	116.2
454	D	71.3	Confident	72.8	Confident	83 Å²	83	69.3 Å²	69.3	44%	0.444	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	42.1	-176.7	-159.4	32.1	0	0	0	112.4	R228 S452	R228-D454 IonicContact CZ-OD1 3.17Å; R228-D454 IonicContact CZ-OD2 2.68Å; R228-D454 IonicContact NH1-OD1 3.76Å; R228-D454 PolarHBondContact NH1-OD1 2.87Å; R228-D454 IonicContact NH1-OD2 2.68Å; R228-D454 IonicContact NH2-OD1 3.37Å; R228-D454 PolarHBondContact NH2-OD1 3.39Å; R228-D454 IonicContact NH2-OD2 3.69Å; R228-D454 PolarHBondContact NH2-OD2 2.99Å; S452-D454 PolarHBondContact O-N 3.36Å; S452-D454 VanDerWaalsContact O-N 3.1Å
455	T	84.5	Confident	74.4	Confident	71 Å²	71	67.4 Å²	67.4	44%	0.436	39%	0.387	S	S	.	.			trans	-68	156	170.1	65.9	0	0	0	0	111.2	S452 A457 A458 F459	S452-T455 WeakPolarHBondContact O-CG2 3.38Å; T455-A457 VanDerWaalsContact C-N 3.26Å; T455-A457 PolarHBondContact O-N 3.06Å; T455-A458 PolarHBondContact O-N 3.16Å; T455-A458 VanDerWaalsContact O-N 3.16Å; T455-A458 VanDerWaalsContact OG1-CB 3.24Å; T455-A458 WeakPolarHBondContact OG1-CB 3.43Å; T455-A458 PolarHBondContact OG1-N 3.43Å; T455-A458 VanDerWaalsContact OG1-N 3.09Å; T455-F459 WeakPolarHBondContact O-CB 3.48Å; T455-F459 PolarHBondContact O-N 2.94Å
456	E	88.6	Confident	76.5	Confident	99 Å²	99	63.1 Å²	63.1	46%	0.463	37%	0.365	S	S	.	.	H	α-helix	trans	-52.7	-44.8	172.6	153.8	164.4	-152.4	0	0	111.8	A189 F459 L460	A189-E456 HydrophobicContact CB-CB 4.03Å; A189-E456 HydrophobicContact CB-CG 3.58Å; E456-F459 PolarHBondContact O-N 2.82Å; E456-L460 HydrophobicContact CG-CD1 3.99Å; E456-L460 WeakPolarHBondContact O-CB 3.3Å; E456-L460 VanDerWaalsContact O-CG 3.32Å; E456-L460 WeakPolarHBondContact O-CG 3.43Å; E456-L460 PolarHBondContact O-N 3.05Å
457	A	90.9	Very high	78.9	Confident	72 Å²	72	58.7 Å²	58.7	60%	0.595	34%	0.336	S	S	*	.	H	α-helix	trans	-64	-42.9	178.4	0	0	0	0	0	112.3	T455 L460 K461	T455-A457 VanDerWaalsContact C-N 3.26Å; T455-A457 PolarHBondContact O-N 3.06Å; A457-L460 PolarHBondContact O-N 3.39Å; A457-K461 WeakPolarHBondContact O-CB 3.36Å; A457-K461 PolarHBondContact O-N 2.94Å
458	A	90	Very high	81.4	Confident	12 Å²	12	55 Å²	55	10%	0.099	31%	0.31	C	S	.	.	H	α-helix	trans	-63.3	-44	176.2	0	0	0	0	0	111.7	A443 T455 K461 V462	A443-A458 HydrophobicContact CB-CB 3.52Å; T455-A458 PolarHBondContact O-N 3.16Å; T455-A458 VanDerWaalsContact O-N 3.16Å; T455-A458 VanDerWaalsContact OG1-CB 3.24Å; T455-A458 WeakPolarHBondContact OG1-CB 3.43Å; T455-A458 PolarHBondContact OG1-N 3.43Å; T455-A458 VanDerWaalsContact OG1-N 3.09Å; A458-K461 PolarHBondContact O-N 2.83Å; A458-V462 VanDerWaalsContact O-CG2 3.29Å; A458-V462 WeakPolarHBondContact O-CG2 3.48Å; A458-V462 PolarHBondContact O-N 3.21Å
459	F	93.7	Very high	83.6	Confident	11 Å²	11	53.3 Å²	53.3	5%	0.048	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-50.6	176	171.9	-109.3	0	0	0	111.4	A185 V188 A189 L225 T455 E456 K461 V462 F463 V503	A185-F459 HydrophobicContact CB-CE1 4.02Å; A185-F459 HydrophobicContact CB-CZ 4.39Å; V188-F459 HydrophobicContact CB-CE1 4.5Å; V188-F459 HydrophobicContact CG1-CE1 4.31Å; V188-F459 HydrophobicContact CG1-CZ 4.46Å; A189-F459 HydrophobicContact CB-CD1 3.97Å; A189-F459 HydrophobicContact CB-CE1 4.42Å; L225-F459 HydrophobicContact CD2-CZ 4.04Å; T455-F459 WeakPolarHBondContact O-CB 3.48Å; T455-F459 PolarHBondContact O-N 2.94Å; E456-F459 PolarHBondContact O-N 2.82Å; F459-K461 PolarHBondContact O-N 3.33Å; F459-V462 PolarHBondContact O-N 3.07Å; F459-F463 HydrophobicContact CE2-CD2 4.25Å; F459-F463 AromaticContact CZ-CD2 3.93Å; F459-F463 HydrophobicContact CZ-CD2 3.93Å; F459-F463 VanDerWaalsContact O-CB 3.24Å; F459-F463 WeakPolarHBondContact O-CB 3.48Å; F459-F463 PolarHBondContact O-N 3.14Å; F459-V503 HydrophobicContact CE2-CG1 4.21Å
460	L	95.7	Very high	85.7	Confident	47 Å²	47	49.9 Å²	49.9	25%	0.246	27%	0.272	C	S	.	.	H	α-helix	trans	-63.9	-38.2	-179.6	-69.7	175.1	0	0	0	112.6	A185 R186 A189 E456 A457 G464	A185-L460 HydrophobicContact CB-CD2 3.96Å; R186-L460 HydrophobicContact CB-CD2 4.48Å; R186-L460 HydrophobicContact CG-CD1 4.35Å; R186-L460 HydrophobicContact CG-CD2 3.94Å; A189-L460 HydrophobicContact CB-CD1 4.17Å; A189-L460 HydrophobicContact CB-CD2 4.12Å; A189-L460 HydrophobicContact CB-CG 4.02Å; E456-L460 HydrophobicContact CG-CD1 3.99Å; E456-L460 WeakPolarHBondContact O-CB 3.3Å; E456-L460 VanDerWaalsContact O-CG 3.32Å; E456-L460 WeakPolarHBondContact O-CG 3.43Å; E456-L460 PolarHBondContact O-N 3.05Å; A457-L460 PolarHBondContact O-N 3.39Å; L460-G464 PolarHBondContact O-N 3.24Å
461	K	95.1	Very high	87.9	Confident	78 Å²	78	43.5 Å²	43.5	34%	0.339	25%	0.245	S	C	.	.	H	α-helix	trans	-57.9	-55.8	172.9	177.3	-169.7	-175.6	-89.7	0	110.8	D440 V442 A443 A457 A458 F459 F463 G464 E465	D440-K461 PolarHBondContact O-NZ 2.79Å; D440-K461 IonicContact OD1-NZ 3.86Å; D440-K461 PolarHBondContact OD1-NZ 3.28Å; D440-K461 WeakPolarHBondContact OD2-CE 3.32Å; D440-K461 IonicContact OD2-NZ 2.68Å; D440-K461 PolarHBondContact OD2-NZ 3.38Å; V442-K461 PolarHBondContact O-NZ 3.35Å; A443-K461 HydrophobicContact CB-CD 4.15Å; A457-K461 WeakPolarHBondContact O-CB 3.36Å; A457-K461 PolarHBondContact O-N 2.94Å; A458-K461 PolarHBondContact O-N 2.83Å; F459-K461 PolarHBondContact O-N 3.33Å; K461-F463 VanDerWaalsContact C-N 3.32Å; K461-F463 PolarHBondContact O-N 2.86Å; K461-G464 PolarHBondContact O-N 3.24Å; K461-E465 WeakPolarHBondContact O-CB 3.42Å; K461-E465 PolarHBondContact O-N 3.03Å
462	V	95	Very high	90.1	Very high	8 Å²	8	34.9 Å²	34.9	5%	0.048	21%	0.206	C	C	.	.	H	α-helix	trans	-64.8	-39	-176.2	173.5	0	0	0	0	110.7	L441 A443 A458 F459 G466 L502	L441-V462 HydrophobicContact CD2-CG1 4.42Å; A443-V462 HydrophobicContact CB-CG2 4.08Å; A458-V462 VanDerWaalsContact O-CG2 3.29Å; A458-V462 WeakPolarHBondContact O-CG2 3.48Å; A458-V462 PolarHBondContact O-N 3.21Å; F459-V462 PolarHBondContact O-N 3.07Å; V462-G466 PolarHBondContact O-N 2.85Å; V462-L502 HydrophobicContact CG1-CD2 4.41Å
463	F	97.5	Very high	92.2	Very high	4 Å²	4	34 Å²	34	2%	0.018	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-49.8	177.3	-171.2	-80.1	0	0	0	111.3	L181 L182 A185 F221 L225 F459 K461 G466 L467 V503	L181-F463 HydrophobicContact CB-CE1 3.99Å; L181-F463 HydrophobicContact CB-CZ 4Å; L181-F463 WeakPolarHBondContact O-CE1 3.46Å; L181-F463 WeakPolarHBondContact O-CZ 3.41Å; L182-F463 HydrophobicContact CD2-CD1 4.16Å; L182-F463 HydrophobicContact CD2-CE1 4.46Å; A185-F463 HydrophobicContact CB-CB 4.4Å; A185-F463 HydrophobicContact CB-CD1 3.5Å; A185-F463 VanDerWaalsContact CB-CD1 3.5Å; A185-F463 HydrophobicContact CB-CD2 3.9Å; A185-F463 HydrophobicContact CB-CE1 3.61Å; A185-F463 HydrophobicContact CB-CE2 3.99Å; A185-F463 HydrophobicContact CB-CG 3.65Å; A185-F463 HydrophobicContact CB-CZ 3.85Å; F221-F463 HydrophobicContact CB-CZ 4.47Å; F221-F463 HydrophobicContact CD1-CD2 4.32Å; F221-F463 HydrophobicContact CD1-CE1 4.26Å; F221-F463 AromaticContact CD1-CE2 3.64Å; F221-F463 HydrophobicContact CD1-CE2 3.64Å; F221-F463 AromaticContact CD1-CZ 3.61Å; F221-F463 HydrophobicContact CD1-CZ 3.61Å; F221-F463 HydrophobicContact CE1-CE2 4.29Å; F221-F463 HydrophobicContact CE1-CZ 4.31Å; F221-F463 HydrophobicContact CG-CZ 4.4Å; L225-F463 HydrophobicContact CD1-CE2 4.05Å; L225-F463 HydrophobicContact CD1-CZ 4.11Å; L225-F463 HydrophobicContact CD2-CD2 4.35Å; L225-F463 HydrophobicContact CD2-CE2 3.7Å; L225-F463 HydrophobicContact CD2-CZ 4.45Å; L225-F463 HydrophobicContact CG-CE2 3.89Å; L225-F463 HydrophobicContact CG-CZ 4.45Å; F459-F463 HydrophobicContact CE2-CD2 4.25Å; F459-F463 AromaticContact CZ-CD2 3.93Å; F459-F463 HydrophobicContact CZ-CD2 3.93Å; F459-F463 VanDerWaalsContact O-CB 3.24Å; F459-F463 WeakPolarHBondContact O-CB 3.48Å; F459-F463 PolarHBondContact O-N 3.14Å; K461-F463 VanDerWaalsContact C-N 3.32Å; K461-F463 PolarHBondContact O-N 2.86Å; F463-G466 PolarHBondContact O-N 3.28Å; F463-L467 HydrophobicContact CE1-CD2 4.46Å; F463-L467 VanDerWaalsContact O-CB 3.31Å; F463-L467 WeakPolarHBondContact O-CB 3.3Å; F463-L467 PolarHBondContact O-N 3.08Å; F463-V503 HydrophobicContact CD2-CG1 4.33Å; F463-V503 HydrophobicContact CD2-CG2 4.05Å; F463-V503 HydrophobicContact CE2-CG1 4.36Å; F463-V503 HydrophobicContact CE2-CG2 4.26Å
464	G	97.6	Very high	94.1	Very high	23 Å²	23	32.7 Å²	32.7	24%	0.237	18%	0.182	C	C	.	.	H	α-helix	trans	-63.5	-43	179.8	0	0	0	0	0	112.6	L460 K461 L467 R468	L460-G464 PolarHBondContact O-N 3.24Å; K461-G464 PolarHBondContact O-N 3.24Å; G464-L467 PolarHBondContact O-N 2.76Å; G464-R468 PolarHBondContact O-N 3.02Å
465	E	97.2	Very high	95.3	Very high	39 Å²	39	31 Å²	31	18%	0.182	17%	0.172	C	C	.	.	H	α-helix	trans	-69.5	-39.6	177.7	179.2	62.7	179	0	0	112.4	A439 D440 L441 K461 L467 R468 F469	A439-E465 WeakPolarHBondContact CA-OE1 3.38Å; D440-E465 HydrophobicContact CB-CG 4.29Å; D440-E465 PolarHBondContact N-OE1 2.71Å; L441-E465 HydrophobicContact CD2-CB 4.08Å; L441-E465 HydrophobicContact CD2-CG 3.79Å; L441-E465 HydrophobicContact CG-CG 4.46Å; K461-E465 WeakPolarHBondContact O-CB 3.42Å; K461-E465 PolarHBondContact O-N 3.03Å; E465-L467 VanDerWaalsContact C-N 3.35Å; E465-R468 VanDerWaalsContact CD-NE 3.34Å; E465-R468 WeakPolarHBondContact O-CB 3.43Å; E465-R468 PolarHBondContact O-N 3.32Å; E465-R468 IonicContact OE1-CZ 2.76Å; E465-R468 IonicContact OE1-NE 2.71Å; E465-R468 PolarHBondContact OE1-NE 3.31Å; E465-R468 IonicContact OE1-NH2 2.76Å; E465-R468 PolarHBondContact OE1-NH2 3.18Å; E465-R468 IonicContact OE2-CZ 3.01Å; E465-R468 IonicContact OE2-NE 3.88Å; E465-R468 PolarHBondContact OE2-NE 2.9Å; E465-R468 IonicContact OE2-NH2 2.87Å; E465-F469 WeakPolarHBondContact O-CB 3.36Å; E465-F469 PolarHBondContact O-N 3.12Å
466	G	97.7	Very high	95.9	Very high	3 Å²	3	27.6 Å²	27.6	3%	0.031	15%	0.152	C	C	.	.	H	α-helix	trans	-60	-46.1	172.5	0	0	0	0	0	111.3	V462 F463 R468 F469 F470	V462-G466 PolarHBondContact O-N 2.85Å; F463-G466 PolarHBondContact O-N 3.28Å; G466-R468 VanDerWaalsContact C-N 3.35Å; G466-R468 PolarHBondContact O-N 3.29Å; G466-F469 PolarHBondContact O-N 3.38Å; G466-F470 WeakPolarHBondContact O-CB 3.5Å; G466-F470 WeakPolarHBondContact O-CD2 3.41Å; G466-F470 PolarHBondContact O-N 3.34Å
467	L	98	Very high	96.3	Very high	6 Å²	6	22.9 Å²	22.9	3%	0.031	13%	0.13	C	C	.	.	H	α-helix	trans	-60	-44.1	176.4	178.3	61.6	0	0	0	111.5	L181 L182 F221 F463 G464 E465 S471	L181-L467 HydrophobicContact CB-CD2 4.3Å; L181-L467 HydrophobicContact CD1-CD1 3.76Å; L182-L467 HydrophobicContact CD1-CD2 4.3Å; L182-L467 HydrophobicContact CD2-CD2 4.13Å; L182-L467 HydrophobicContact CG-CD2 3.78Å; F221-L467 HydrophobicContact CD2-CD1 4.29Å; F221-L467 HydrophobicContact CE1-CB 4.16Å; F221-L467 HydrophobicContact CE2-CD1 3.99Å; F221-L467 VanDerWaalsContact CZ-CA 3.45Å; F221-L467 HydrophobicContact CZ-CB 3.97Å; F221-L467 HydrophobicContact CZ-CD1 4.21Å; F463-L467 HydrophobicContact CE1-CD2 4.46Å; F463-L467 VanDerWaalsContact O-CB 3.31Å; F463-L467 WeakPolarHBondContact O-CB 3.3Å; F463-L467 PolarHBondContact O-N 3.08Å; G464-L467 PolarHBondContact O-N 2.76Å; E465-L467 VanDerWaalsContact C-N 3.35Å; L467-S471 WeakPolarHBondContact O-CB 3.36Å; L467-S471 PolarHBondContact O-N 2.92Å; L467-S471 PolarHBondContact O-OG 2.84Å
468	R	97.2	Very high	96.5	Very high	72 Å²	72	21.8 Å²	21.8	27%	0.272	11%	0.112	S	C	.	.	H	α-helix	trans	-57	-53.5	174.1	-178	-157.7	65.5	77.3	-11.4	111.1	E438 G464 E465 G466 S471 A472	E438-R468 PolarHBondContact O-NH2 2.95Å; G464-R468 PolarHBondContact O-N 3.02Å; E465-R468 VanDerWaalsContact CD-NE 3.34Å; E465-R468 WeakPolarHBondContact O-CB 3.43Å; E465-R468 PolarHBondContact O-N 3.32Å; E465-R468 IonicContact OE1-CZ 2.76Å; E465-R468 IonicContact OE1-NE 2.71Å; E465-R468 PolarHBondContact OE1-NE 3.31Å; E465-R468 IonicContact OE1-NH2 2.76Å; E465-R468 PolarHBondContact OE1-NH2 3.18Å; E465-R468 IonicContact OE2-CZ 3.01Å; E465-R468 IonicContact OE2-NE 3.88Å; E465-R468 PolarHBondContact OE2-NE 2.9Å; E465-R468 IonicContact OE2-NH2 2.87Å; G466-R468 VanDerWaalsContact C-N 3.35Å; G466-R468 PolarHBondContact O-N 3.29Å; R468-S471 PolarHBondContact O-N 2.91Å; R468-A472 PolarHBondContact O-N 3.09Å
469	F	97.9	Very high	96.8	Very high	1 Å²	1	24.8 Å²	24.8	0%	0.004	12%	0.124	C	C	.	.	H	α-helix	trans	-64.2	-50.1	-175.1	177.4	-96	0	0	0	112	W266 E437 A439 E465 G466 S471 A472 Y473 L578	W266-F469 HydrophobicContact CH2-CE2 4.48Å; W266-F469 HydrophobicContact CH2-CZ 4.34Å; W266-F469 HydrophobicContact CZ2-CE2 4.29Å; W266-F469 AromaticContact CZ2-CZ 3.9Å; W266-F469 HydrophobicContact CZ2-CZ 3.9Å; E437-F469 HydrophobicContact CB-CE2 3.97Å; E437-F469 HydrophobicContact CB-CZ 3.78Å; E437-F469 HydrophobicContact CG-CZ 4.07Å; E437-F469 WeakPolarHBondContact OE2-CZ 3.21Å; A439-F469 HydrophobicContact CB-CB 4.07Å; A439-F469 HydrophobicContact CB-CD2 3.73Å; A439-F469 HydrophobicContact CB-CE2 4.38Å; A439-F469 HydrophobicContact CB-CG 3.93Å; E465-F469 WeakPolarHBondContact O-CB 3.36Å; E465-F469 PolarHBondContact O-N 3.12Å; G466-F469 PolarHBondContact O-N 3.38Å; F469-S471 VanDerWaalsContact C-N 3.33Å; F469-S471 PolarHBondContact O-N 2.95Å; F469-A472 PolarHBondContact O-N 3.35Å; F469-Y473 PolarHBondContact O-N 2.84Å; F469-L578 HydrophobicContact CD2-CD2 4.17Å; F469-L578 HydrophobicContact CE2-CD2 4.32Å
470	F	98.1	Very high	96.9	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.018	12%	0.122	C	C	.	.	H	α-helix	trans	-70.7	-27.2	-179.2	-71.5	-65.7	0	0	0	113	L217 F221 G466 Y473 M474 A495 A498 I499 L502	L217-F470 HydrophobicContact CD2-CB 4.38Å; F221-F470 HydrophobicContact CE2-CB 4.25Å; F221-F470 HydrophobicContact CZ-CB 4.49Å; F221-F470 HydrophobicContact CZ-CD2 4.2Å; G466-F470 WeakPolarHBondContact O-CB 3.5Å; G466-F470 WeakPolarHBondContact O-CD2 3.41Å; G466-F470 PolarHBondContact O-N 3.34Å; F470-Y473 PolarHBondContact O-N 3.47Å; F470-M474 WeakPolarHBondContact O-CB 3.42Å; F470-M474 WeakPolarHBondContact O-CG 3.26Å; F470-M474 PolarHBondContact O-N 3.43Å; F470-A495 HydrophobicContact CD1-CB 3.79Å; F470-A495 HydrophobicContact CE1-CB 3.83Å; F470-A498 HydrophobicContact CE1-CB 4.19Å; F470-A498 HydrophobicContact CZ-CB 3.69Å; F470-I499 HydrophobicContact CB-CD1 4.14Å; F470-I499 HydrophobicContact CB-CG1 4.49Å; F470-I499 HydrophobicContact CD1-CD1 4.32Å; F470-I499 HydrophobicContact CD1-CG1 4.27Å; F470-I499 HydrophobicContact CD2-CD1 4Å; F470-I499 HydrophobicContact CD2-CG1 3.42Å; F470-I499 VanDerWaalsContact CD2-CG1 3.42Å; F470-I499 HydrophobicContact CE1-CG1 4.4Å; F470-I499 HydrophobicContact CE2-CG1 3.6Å; F470-I499 HydrophobicContact CG-CD1 3.89Å; F470-I499 HydrophobicContact CG-CG1 3.81Å; F470-I499 HydrophobicContact CZ-CG1 4.1Å; F470-L502 HydrophobicContact CE2-CD1 3.67Å; F470-L502 HydrophobicContact CZ-CD1 4.15Å
471	S	97.6	Very high	97	Very high	22 Å²	22	22.4 Å²	22.4	15%	0.154	11%	0.112	C	C	.	.	H	α-helix	trans	-61.5	-47.3	170.3	-60.6	0	0	0	0	111.1	L217 L467 R468 F469 M474 D475	L217-S471 WeakPolarHBondContact CD1-OG 3.44Å; L467-S471 WeakPolarHBondContact O-CB 3.36Å; L467-S471 PolarHBondContact O-N 2.92Å; L467-S471 PolarHBondContact O-OG 2.84Å; R468-S471 PolarHBondContact O-N 2.91Å; F469-S471 VanDerWaalsContact C-N 3.33Å; F469-S471 PolarHBondContact O-N 2.95Å; S471-M474 PolarHBondContact O-N 2.93Å; S471-D475 VanDerWaalsContact O-CB 3.26Å; S471-D475 WeakPolarHBondContact O-CB 3.35Å; S471-D475 PolarHBondContact O-N 3.3Å
472	A	97.1	Very high	97	Very high	6 Å²	6	21.6 Å²	21.6	5%	0.05	12%	0.115	C	C	.	.	H	α-helix	trans	-65.4	-39.5	177.3	0	0	0	0	0	112.3	R468 F469 S476 Q576 L578	R468-A472 PolarHBondContact O-N 3.09Å; F469-A472 PolarHBondContact O-N 3.35Å; A472-S476 WeakPolarHBondContact O-CB 3.15Å; A472-S476 PolarHBondContact O-N 3.46Å; A472-Q576 VanDerWaalsContact CB-OE1 3.26Å; A472-L578 HydrophobicContact CB-CD1 4Å; A472-L578 HydrophobicContact CB-CD2 3.73Å; A472-L578 HydrophobicContact CB-CG 4.49Å
473	Y	97.8	Very high	97	Very high	24 Å²	24	29.4 Å²	29.4	9%	0.094	15%	0.148	C	C	.	.	H	α-helix	trans	-59.6	-53	174.3	-177	-105.4	0	0	0	111.6	F260 W266 F469 F470 D475 S476 L477 A495	F260-Y473 HydrophobicContact CZ-CE2 4.32Å; W266-Y473 HydrophobicContact CD2-CD2 4.24Å; W266-Y473 HydrophobicContact CD2-CE2 4.2Å; W266-Y473 AromaticContact CE2-CD2 3.98Å; W266-Y473 HydrophobicContact CE3-CD2 4.05Å; W266-Y473 HydrophobicContact CE3-CE2 4.33Å; W266-Y473 AromaticContact CH2-CD2 3.49Å; W266-Y473 HydrophobicContact CH2-CD2 3.49Å; W266-Y473 VanDerWaalsContact CH2-CD2 3.49Å; W266-Y473 HydrophobicContact CH2-CE2 4.34Å; W266-Y473 HydrophobicContact CH2-CG 4.36Å; W266-Y473 AromaticContact CZ2-CD2 3.63Å; W266-Y473 HydrophobicContact CZ2-CD2 3.63Å; W266-Y473 HydrophobicContact CZ2-CE2 4.14Å; W266-Y473 AromaticContact CZ3-CD2 3.68Å; W266-Y473 HydrophobicContact CZ3-CD2 3.68Å; W266-Y473 HydrophobicContact CZ3-CE2 4.4Å; F469-Y473 PolarHBondContact O-N 2.84Å; F470-Y473 PolarHBondContact O-N 3.47Å; Y473-D475 PolarHBondContact O-N 3.02Å; Y473-S476 PolarHBondContact O-N 3.03Å; Y473-S476 PolarHBondContact O-OG 3.48Å; Y473-L477 HydrophobicContact CD1-CD1 3.93Å; Y473-L477 HydrophobicContact CD1-CG 4.44Å; Y473-L477 HydrophobicContact CE1-CD1 3.38Å; Y473-L477 HydrophobicContact CE1-CG 4.15Å; Y473-L477 WeakPolarHBondContact O-CG 3.38Å; Y473-L477 PolarHBondContact O-N 2.91Å; Y473-A495 HydrophobicContact CD1-CB 3.92Å; Y473-A495 HydrophobicContact CE1-CB 3.77Å
474	M	97.3	Very high	96.8	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-63.5	-41	-179.4	-68.4	-67.4	-173.3	0	0	112.1	V213 L217 Y220 F470 S471 L477 E478 E492 A495	V213-M474 HydrophobicContact CG1-CB 4.04Å; L217-M474 HydrophobicContact CD2-CB 4.48Å; L217-M474 HydrophobicContact CD2-CG 4Å; Y220-M474 HydrophobicContact CD2-CE 3.64Å; Y220-M474 HydrophobicContact CE2-CE 3.64Å; F470-M474 WeakPolarHBondContact O-CB 3.42Å; F470-M474 WeakPolarHBondContact O-CG 3.26Å; F470-M474 PolarHBondContact O-N 3.43Å; S471-M474 PolarHBondContact O-N 2.93Å; M474-L477 PolarHBondContact O-N 2.83Å; M474-E478 WeakPolarHBondContact O-CB 3.13Å; M474-E478 PolarHBondContact O-N 3.05Å; M474-E492 HydrophobicContact CE-CB 4.17Å; M474-E492 HydrophobicContact CE-CG 4.39Å; M474-E492 HydrophobicContact SD-CB 4.17Å; M474-E492 HydrophobicContact SD-CG 3.72Å; M474-A495 HydrophobicContact CE-CB 3.79Å
475	D	96.6	Very high	96.8	Very high	47 Å²	47	35 Å²	35	25%	0.251	18%	0.179	S	C	.	.	H	α-helix	trans	-59.3	-45.8	173.8	-178	74.9	0	0	0	111.3	S471 Y473 L477 E478 E479 W573 K574	S471-D475 VanDerWaalsContact O-CB 3.26Å; S471-D475 WeakPolarHBondContact O-CB 3.35Å; S471-D475 PolarHBondContact O-N 3.3Å; Y473-D475 PolarHBondContact O-N 3.02Å; D475-L477 VanDerWaalsContact C-N 3.31Å; D475-L477 PolarHBondContact O-N 3.31Å; D475-E478 PolarHBondContact O-N 3.46Å; D475-E479 PolarHBondContact O-N 3.44Å; D475-E479 VanDerWaalsContact O-N 3.09Å; D475-W573 PolarHBondContact OD2-NE1 3.42Å; D475-K574 IonicContact OD1-NZ 3.75Å; D475-K574 PolarHBondContact OD1-NZ 2.67Å; D475-K574 WeakPolarHBondContact OD2-CE 3.16Å; D475-K574 IonicContact OD2-NZ 3.4Å; D475-K574 PolarHBondContact OD2-NZ 3.37Å
476	S	97	Very high	96.7	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.4	-35.9	177.5	81.3	0	0	0	0	112.9	A472 Y473 S480	A472-S476 WeakPolarHBondContact O-CB 3.15Å; A472-S476 PolarHBondContact O-N 3.46Å; Y473-S476 PolarHBondContact O-N 3.03Å; Y473-S476 PolarHBondContact O-OG 3.48Å; S476-S480 WeakPolarHBondContact O-CB 3.48Å; S476-S480 PolarHBondContact O-N 2.96Å; S476-S480 PolarHBondContact O-OG 3.16Å
477	L	97.4	Very high	96.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-71.3	-42.6	176.2	-69.9	-174	0	0	0	111.9	F260 Y473 M474 D475 E479 S480 F481 R488 L491 E492	F260-L477 HydrophobicContact CD2-CD2 4.36Å; F260-L477 HydrophobicContact CE2-CD2 3.76Å; F260-L477 HydrophobicContact CZ-CD2 4.42Å; Y473-L477 HydrophobicContact CD1-CD1 3.93Å; Y473-L477 HydrophobicContact CD1-CG 4.44Å; Y473-L477 HydrophobicContact CE1-CD1 3.38Å; Y473-L477 HydrophobicContact CE1-CG 4.15Å; Y473-L477 WeakPolarHBondContact O-CG 3.38Å; Y473-L477 PolarHBondContact O-N 2.91Å; M474-L477 PolarHBondContact O-N 2.83Å; D475-L477 VanDerWaalsContact C-N 3.31Å; D475-L477 PolarHBondContact O-N 3.31Å; L477-E479 VanDerWaalsContact C-N 3.27Å; L477-E479 PolarHBondContact O-N 3.43Å; L477-S480 PolarHBondContact O-N 3.36Å; L477-F481 HydrophobicContact CD2-CD2 4.02Å; L477-F481 HydrophobicContact CD2-CE2 3.6Å; L477-F481 WeakPolarHBondContact O-CB 3.47Å; L477-F481 PolarHBondContact O-N 2.86Å; L477-R488 HydrophobicContact CB-CG 4.22Å; L477-L491 HydrophobicContact CD1-CB 3.86Å; L477-L491 HydrophobicContact CD2-CD1 3.82Å; L477-E492 HydrophobicContact CD1-CG 4.07Å
478	E	96.2	Very high	96.6	Very high	50 Å²	50	41 Å²	41	23%	0.234	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-39.4	178.7	-169.4	64.5	-138.7	0	0	111	V213 K216 M474 D475 R488	V213-E478 HydrophobicContact CG2-CB 3.67Å; V213-E478 HydrophobicContact CG2-CG 3.79Å; K216-E478 IonicContact NZ-OE2 3.7Å; K216-E478 PolarHBondContact NZ-OE2 3.47Å; M474-E478 WeakPolarHBondContact O-CB 3.13Å; M474-E478 PolarHBondContact O-N 3.05Å; D475-E478 PolarHBondContact O-N 3.46Å; E478-R488 IonicContact OE1-CZ 3.82Å; E478-R488 IonicContact OE1-NH1 3.35Å; E478-R488 PolarHBondContact OE1-NH1 3.4Å; E478-R488 IonicContact OE2-CZ 3.92Å; E478-R488 IonicContact OE2-NH1 3.85Å; E478-R488 PolarHBondContact OE2-NH1 2.99Å; E478-R488 IonicContact OE2-NH2 2.79Å
479	E	96.1	Very high	96.6	Very high	75 Å²	75	39.2 Å²	39.2	35%	0.35	21%	0.205	S	C	.	.	H	α-helix	trans	-80.7	-25.3	177.3	-70.8	-165.8	-169.4	0	0	114.2	D475 L477 R550 W573 K574	D475-E479 PolarHBondContact O-N 3.44Å; D475-E479 VanDerWaalsContact O-N 3.09Å; L477-E479 VanDerWaalsContact C-N 3.27Å; L477-E479 PolarHBondContact O-N 3.43Å; E479-R550 VanDerWaalsContact O-CD 3.31Å; E479-R550 WeakPolarHBondContact O-CD 3.33Å; E479-R550 VanDerWaalsContact O-CZ 3.3Å; E479-R550 PolarHBondContact O-NH1 2.95Å; E479-W573 HydrophobicContact CB-CH2 3.99Å; E479-W573 HydrophobicContact CB-CZ2 3.84Å; E479-W573 HydrophobicContact CG-CZ2 4.19Å; E479-W573 WeakPolarHBondContact OE2-CH2 3.38Å; E479-W573 WeakPolarHBondContact OE2-CZ2 3.36Å; E479-K574 WeakPolarHBondContact OE1-CE 3.32Å; E479-K574 IonicContact OE1-NZ 2.76Å; E479-K574 PolarHBondContact OE1-NZ 3.38Å; E479-K574 IonicContact OE2-NZ 2.65Å
480	S	95.7	Very high	96.5	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.007	22%	0.222	C	C	.	.	H	α-helix	trans	-85.9	-32.7	-178.3	-60.8	0	0	0	0	112.8	L263 S476 L477	L263-S480 WeakPolarHBondContact O-CB 3.16Å; S476-S480 WeakPolarHBondContact O-CB 3.48Å; S476-S480 PolarHBondContact O-N 2.96Å; S476-S480 PolarHBondContact O-OG 3.16Å; L477-S480 PolarHBondContact O-N 3.36Å
481	F	96.8	Very high	96.4	Very high	6 Å²	6	42.2 Å²	42.2	3%	0.026	23%	0.227	C	C	.	.	S	Bend	trans	-106.8	152.8	-170.1	-75.7	-103.3	0	0	0	114.1	R259 F260 L263 L477 S485 E487 R488 L491	R259-F481 HydrophobicContact CG-CE1 4.04Å; F260-F481 HydrophobicContact CB-CZ 4.18Å; F260-F481 AromaticContact CD2-CE2 3.83Å; F260-F481 HydrophobicContact CD2-CE2 3.83Å; F260-F481 AromaticContact CD2-CZ 3.78Å; F260-F481 HydrophobicContact CD2-CZ 3.78Å; F260-F481 HydrophobicContact CE2-CE2 4.36Å; F260-F481 HydrophobicContact CG-CZ 4.37Å; L263-F481 HydrophobicContact CB-CE2 4.44Å; L263-F481 HydrophobicContact CD1-CD1 3.59Å; L263-F481 HydrophobicContact CD1-CE1 3.93Å; L263-F481 HydrophobicContact CD1-CG 3.96Å; L477-F481 HydrophobicContact CD2-CD2 4.02Å; L477-F481 HydrophobicContact CD2-CE2 3.6Å; L477-F481 WeakPolarHBondContact O-CB 3.47Å; L477-F481 PolarHBondContact O-N 2.86Å; F481-S485 WeakPolarHBondContact CD1-OG 3.48Å; F481-E487 HydrophobicContact CE1-CB 4.08Å; F481-R488 HydrophobicContact CB-CB 3.82Å; F481-R488 HydrophobicContact CB-CG 3.91Å; F481-R488 HydrophobicContact CD1-CB 3.87Å; F481-R488 HydrophobicContact CD2-CG 4.41Å; F481-R488 HydrophobicContact CG-CB 3.85Å; F481-R488 HydrophobicContact CG-CG 4.1Å; F481-L491 HydrophobicContact CE1-CD1 4.31Å; F481-L491 HydrophobicContact CE2-CD1 3.94Å; F481-L491 HydrophobicContact CZ-CD1 3.51Å
482	P	95.8	Very high	96.4	Very high	61 Å²	61	41.3 Å²	41.3	40%	0.396	22%	0.22	S	C	.	.			trans	-59.6	147	166.3	-21.3	32.7	0	0	0	112.4	T484 S485	P482-T484 PolarHBondContact O-N 3.31Å; P482-T484 VanDerWaalsContact O-N 3.1Å; P482-S485 WeakPolarHBondContact O-CB 3.47Å; P482-S485 PolarHBondContact O-N 3.09Å; P482-S485 VanDerWaalsContact O-N 3.09Å
483	K	93.9	Very high	96.4	Very high	172 Å²	172	45.9 Å²	45.9	75%	0.748	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-31.3	-177	-67.6	-172.1	176.9	-173.3	0	114.8	R488	K483-R488 PolarHBondContact O-NH2 3.27Å
484	T	94.2	Very high	96.3	Very high	133 Å²	133	45.8 Å²	45.8	82%	0.816	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.2	24.2	-177.4	53.6	0	0	0	0	113.2	P482 N486	P482-T484 PolarHBondContact O-N 3.31Å; P482-T484 VanDerWaalsContact O-N 3.1Å; T484-N486 PolarHBondContact O-N 2.89Å
485	S	96.9	Very high	96.3	Very high	13 Å²	13	46 Å²	46	9%	0.091	25%	0.245	C	C	.	.			trans	-74.8	123.3	179.4	172.6	0	0	0	0	112.3	F481 P482 E487 R488 L489	F481-S485 WeakPolarHBondContact CD1-OG 3.48Å; P482-S485 WeakPolarHBondContact O-CB 3.47Å; P482-S485 PolarHBondContact O-N 3.09Å; P482-S485 VanDerWaalsContact O-N 3.09Å; S485-E487 VanDerWaalsContact C-N 3.29Å; S485-E487 PolarHBondContact OG-N 3.2Å; S485-E487 PolarHBondContact OG-OE2 3.09Å; S485-R488 PolarHBondContact O-N 3.18Å; S485-R488 PolarHBondContact OG-N 3.2Å; S485-R488 VanDerWaalsContact OG-N 3.09Å; S485-L489 PolarHBondContact O-N 2.68Å
486	N	95.7	Very high	96.4	Very high	121 Å²	121	43.9 Å²	43.9	65%	0.647	23%	0.234	S	C	*	.	H	α-helix	trans	-68.2	-31.2	172.2	-72.7	-46.3	0	0	0	111.9	T484 L489 A490	T484-N486 PolarHBondContact O-N 2.89Å; N486-L489 PolarHBondContact O-N 3.49Å; N486-A490 WeakPolarHBondContact O-CB 3.5Å; N486-A490 PolarHBondContact O-N 3.43Å
487	E	96.2	Very high	96.4	Very high	33 Å²	33	47 Å²	47	15%	0.154	25%	0.245	C	C	.	.	H	α-helix	trans	-67.3	-42	176.8	-58.8	72.9	-156.1	0	0	110.4	R255 T256 R259 F481 S485 A490 L491	R255-E487 WeakPolarHBondContact CD-OE1 3.38Å; R255-E487 HydrophobicContact CG-CG 4.17Å; R255-E487 WeakPolarHBondContact CG-OE1 3.4Å; T256-E487 HydrophobicContact CG2-CB 4.45Å; R259-E487 HydrophobicContact CB-CB 4.16Å; R259-E487 HydrophobicContact CB-CG 3.84Å; R259-E487 HydrophobicContact CG-CB 4.17Å; R259-E487 HydrophobicContact CG-CG 4.02Å; F481-E487 HydrophobicContact CE1-CB 4.08Å; S485-E487 VanDerWaalsContact C-N 3.29Å; S485-E487 PolarHBondContact OG-N 3.2Å; S485-E487 PolarHBondContact OG-OE2 3.09Å; E487-A490 WeakPolarHBondContact O-CB 3.36Å; E487-A490 PolarHBondContact O-N 3.44Å; E487-L491 WeakPolarHBondContact O-CG 3.34Å; E487-L491 PolarHBondContact O-N 3.47Å; E487-L491 VanDerWaalsContact O-N 3.07Å
488	R	97.3	Very high	96.3	Very high	19 Å²	19	47.1 Å²	47.1	7%	0.072	25%	0.246	C	C	.	.	H	α-helix	trans	-57	-50.7	170.8	-168.8	-175.3	74	-179.4	3.6	110.7	K216 L477 E478 F481 K483 S485 A490 L491 E492	K216-R488 VanDerWaalsContact NZ-NH2 3.2Å; L477-R488 HydrophobicContact CB-CG 4.22Å; E478-R488 IonicContact OE1-CZ 3.82Å; E478-R488 IonicContact OE1-NH1 3.35Å; E478-R488 PolarHBondContact OE1-NH1 3.4Å; E478-R488 IonicContact OE2-CZ 3.92Å; E478-R488 IonicContact OE2-NH1 3.85Å; E478-R488 PolarHBondContact OE2-NH1 2.99Å; E478-R488 IonicContact OE2-NH2 2.79Å; F481-R488 HydrophobicContact CB-CB 3.82Å; F481-R488 HydrophobicContact CB-CG 3.91Å; F481-R488 HydrophobicContact CD1-CB 3.87Å; F481-R488 HydrophobicContact CD2-CG 4.41Å; F481-R488 HydrophobicContact CG-CB 3.85Å; F481-R488 HydrophobicContact CG-CG 4.1Å; K483-R488 PolarHBondContact O-NH2 3.27Å; S485-R488 PolarHBondContact O-N 3.18Å; S485-R488 PolarHBondContact OG-N 3.2Å; S485-R488 VanDerWaalsContact OG-N 3.09Å; R488-A490 VanDerWaalsContact C-N 3.26Å; R488-A490 PolarHBondContact O-N 3.04Å; R488-L491 WeakPolarHBondContact O-CB 3.41Å; R488-L491 PolarHBondContact O-N 2.72Å; R488-L491 VanDerWaalsContact O-N 3.08Å; R488-E492 WeakPolarHBondContact CD-OE1 3.5Å; R488-E492 HydrophobicContact CG-CG 4.31Å; R488-E492 WeakPolarHBondContact CG-OE1 3.47Å; R488-E492 IonicContact CZ-OE1 3.52Å; R488-E492 IonicContact NE-OE1 3.66Å; R488-E492 PolarHBondContact NE-OE1 2.9Å; R488-E492 VanDerWaalsContact O-CG 3.3Å; R488-E492 WeakPolarHBondContact O-CG 3.32Å; R488-E492 PolarHBondContact O-N 3.3Å
489	L	96.6	Very high	96.4	Very high	34 Å²	34	44.8 Å²	44.8	18%	0.178	24%	0.236	C	C	.	.	H	α-helix	trans	-59.2	-36.9	178.7	-178.3	62	0	0	0	112.4	Y210 S485 N486 E492 R493	Y210-L489 HydrophobicContact CD1-CD1 4.5Å; Y210-L489 HydrophobicContact CE1-CD1 4.24Å; S485-L489 PolarHBondContact O-N 2.68Å; N486-L489 PolarHBondContact O-N 3.49Å; L489-E492 PolarHBondContact O-N 3.01Å; L489-R493 HydrophobicContact CD1-CG 4.34Å; L489-R493 WeakPolarHBondContact O-CB 3.5Å; L489-R493 VanDerWaalsContact O-CG 3.27Å; L489-R493 WeakPolarHBondContact O-CG 3.43Å; L489-R493 PolarHBondContact O-N 3.01Å
490	A	95.7	Very high	96.5	Very high	44 Å²	44	41.2 Å²	41.2	36%	0.364	22%	0.219	S	C	.	.	H	α-helix	trans	-64.9	-40.1	176	0	0	0	0	0	112.3	T256 N486 E487 R488 G494	T256-A490 HydrophobicContact CG2-CB 4.11Å; N486-A490 WeakPolarHBondContact O-CB 3.5Å; N486-A490 PolarHBondContact O-N 3.43Å; E487-A490 WeakPolarHBondContact O-CB 3.36Å; E487-A490 PolarHBondContact O-N 3.44Å; R488-A490 VanDerWaalsContact C-N 3.26Å; R488-A490 PolarHBondContact O-N 3.04Å; A490-G494 PolarHBondContact O-N 3.01Å
491	L	96.8	Very high	96.4	Very high	24 Å²	24	41.5 Å²	41.5	13%	0.126	22%	0.221	C	C	.	.	H	α-helix	trans	-67.1	-46.1	174.9	-66.1	170.2	0	0	0	111.6	T256 F260 L477 F481 E487 R488 R493 G494 A495	T256-L491 HydrophobicContact CG2-CD2 4.24Å; T256-L491 HydrophobicContact CG2-CG 4.28Å; F260-L491 HydrophobicContact CB-CD1 4.06Å; F260-L491 HydrophobicContact CD1-CD1 4.15Å; F260-L491 HydrophobicContact CD1-CD2 3.89Å; F260-L491 HydrophobicContact CD2-CD1 3.66Å; F260-L491 HydrophobicContact CE1-CD2 4.15Å; F260-L491 HydrophobicContact CE2-CD1 4.07Å; F260-L491 HydrophobicContact CG-CD1 3.7Å; F260-L491 HydrophobicContact CG-CD2 4.24Å; F260-L491 HydrophobicContact CZ-CD1 4.47Å; L477-L491 HydrophobicContact CD1-CB 3.86Å; L477-L491 HydrophobicContact CD2-CD1 3.82Å; F481-L491 HydrophobicContact CE1-CD1 4.31Å; F481-L491 HydrophobicContact CE2-CD1 3.94Å; F481-L491 HydrophobicContact CZ-CD1 3.51Å; E487-L491 WeakPolarHBondContact O-CG 3.34Å; E487-L491 PolarHBondContact O-N 3.47Å; E487-L491 VanDerWaalsContact O-N 3.07Å; R488-L491 WeakPolarHBondContact O-CB 3.41Å; R488-L491 PolarHBondContact O-N 2.72Å; R488-L491 VanDerWaalsContact O-N 3.08Å; L491-R493 VanDerWaalsContact C-N 3.35Å; L491-R493 PolarHBondContact O-N 3.46Å; L491-G494 CarbonylContact O-C 3.53Å; L491-G494 VanDerWaalsContact O-CA 3.31Å; L491-G494 WeakPolarHBondContact O-CA 3.18Å; L491-G494 PolarHBondContact O-N 3.37Å; L491-A495 PolarHBondContact O-N 3.05Å
492	E	98	Very high	96.3	Very high	3 Å²	3	41.7 Å²	41.7	1%	0.014	22%	0.222	C	C	.	.	H	α-helix	trans	-59.1	-43.9	176.7	-67.5	171.2	165.7	0	0	111.4	K216 Y220 M474 L477 R488 L489 G494 A495 G496	K216-E492 WeakPolarHBondContact CE-OE1 3.45Å; K216-E492 IonicContact NZ-OE1 2.97Å; K216-E492 PolarHBondContact NZ-OE1 3.02Å; K216-E492 IonicContact NZ-OE2 3.9Å; Y220-E492 HydrophobicContact CE2-CB 4.33Å; M474-E492 HydrophobicContact CE-CB 4.17Å; M474-E492 HydrophobicContact CE-CG 4.39Å; M474-E492 HydrophobicContact SD-CB 4.17Å; M474-E492 HydrophobicContact SD-CG 3.72Å; L477-E492 HydrophobicContact CD1-CG 4.07Å; R488-E492 WeakPolarHBondContact CD-OE1 3.5Å; R488-E492 HydrophobicContact CG-CG 4.31Å; R488-E492 WeakPolarHBondContact CG-OE1 3.47Å; R488-E492 IonicContact CZ-OE1 3.52Å; R488-E492 IonicContact NE-OE1 3.66Å; R488-E492 PolarHBondContact NE-OE1 2.9Å; R488-E492 VanDerWaalsContact O-CG 3.3Å; R488-E492 WeakPolarHBondContact O-CG 3.32Å; R488-E492 PolarHBondContact O-N 3.3Å; L489-E492 PolarHBondContact O-N 3.01Å; E492-G494 VanDerWaalsContact C-N 3.26Å; E492-G494 PolarHBondContact O-N 2.73Å; E492-A495 WeakPolarHBondContact O-CB 3.43Å; E492-A495 PolarHBondContact O-N 3.13Å; E492-G496 PolarHBondContact O-N 3.4Å
493	R	97	Very high	96.4	Very high	102 Å²	102	39 Å²	39	39%	0.385	20%	0.204	S	C	.	.	H	α-helix	trans	-65.2	-30.4	173.6	-73.6	174.8	175	-175.9	-2.9	112.5	L489 L491 R497	L489-R493 HydrophobicContact CD1-CG 4.34Å; L489-R493 WeakPolarHBondContact O-CB 3.5Å; L489-R493 VanDerWaalsContact O-CG 3.27Å; L489-R493 WeakPolarHBondContact O-CG 3.43Å; L489-R493 PolarHBondContact O-N 3.01Å; L491-R493 VanDerWaalsContact C-N 3.35Å; L491-R493 PolarHBondContact O-N 3.46Å; R493-R497 WeakPolarHBondContact O-CG 3.1Å; R493-R497 PolarHBondContact O-N 3.28Å; R493-R497 VanDerWaalsContact O-N 3.16Å; R493-R497 PolarHBondContact O-NH1 2.83Å
494	G	95.6	Very high	96.4	Very high	22 Å²	22	31.5 Å²	31.5	23%	0.227	17%	0.173	C	C	.	.	H	α-helix	trans	-61.9	-50.5	170	0	0	0	0	0	111.8	A490 L491 E492 G496 R497 A498	A490-G494 PolarHBondContact O-N 3.01Å; L491-G494 CarbonylContact O-C 3.53Å; L491-G494 VanDerWaalsContact O-CA 3.31Å; L491-G494 WeakPolarHBondContact O-CA 3.18Å; L491-G494 PolarHBondContact O-N 3.37Å; E492-G494 VanDerWaalsContact C-N 3.26Å; E492-G494 PolarHBondContact O-N 2.73Å; G494-G496 VanDerWaalsContact C-N 3.33Å; G494-G496 PolarHBondContact O-N 3.23Å; G494-R497 PolarHBondContact O-N 2.96Å; G494-A498 PolarHBondContact O-N 3.46Å
495	A	97.5	Very high	96.3	Very high	6 Å²	6	25.5 Å²	25.5	5%	0.05	14%	0.137	C	C	.	.	H	α-helix	trans	-60.7	-40.8	174.2	0	0	0	0	0	112.2	F470 Y473 M474 L491 E492 R497 A498 I499	F470-A495 HydrophobicContact CD1-CB 3.79Å; F470-A495 HydrophobicContact CE1-CB 3.83Å; Y473-A495 HydrophobicContact CD1-CB 3.92Å; Y473-A495 HydrophobicContact CE1-CB 3.77Å; M474-A495 HydrophobicContact CE-CB 3.79Å; L491-A495 PolarHBondContact O-N 3.05Å; E492-A495 WeakPolarHBondContact O-CB 3.43Å; E492-A495 PolarHBondContact O-N 3.13Å; A495-R497 VanDerWaalsContact C-N 3.32Å; A495-R497 PolarHBondContact O-N 2.88Å; A495-A498 WeakPolarHBondContact O-CA 3.18Å; A495-A498 WeakPolarHBondContact O-CB 3.35Å; A495-A498 PolarHBondContact O-N 3.17Å; A495-I499 WeakPolarHBondContact O-CG1 3.35Å; A495-I499 PolarHBondContact O-N 3.48Å
496	G	98	Very high	95.9	Very high	2 Å²	2	27.4 Å²	27.4	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-56.8	-42.1	175.3	0	0	0	0	0	113.3	Y220 E492 G494 I499 V500	Y220-G496 VanDerWaalsContact CD1-CA 3.43Å; E492-G496 PolarHBondContact O-N 3.4Å; G494-G496 VanDerWaalsContact C-N 3.33Å; G494-G496 PolarHBondContact O-N 3.23Å; G496-I499 PolarHBondContact O-N 2.92Å; G496-V500 WeakPolarHBondContact O-CG2 3.48Å; G496-V500 PolarHBondContact O-N 3.44Å
497	R	96.7	Very high	95.5	Very high	65 Å²	65	23 Å²	23	25%	0.245	13%	0.126	C	C	.	.	H	α-helix	trans	-64	-41	173.3	-69.7	-169.3	-54.1	-87.5	3.8	112.1	L237 L240 S244 R493 G494 A495 I499 V500 D501	L237-R497 HydrophobicContact CD1-CB 3.9Å; L237-R497 HydrophobicContact CD1-CG 4.42Å; L237-R497 WeakPolarHBondContact CD1-O 3.32Å; L240-R497 HydrophobicContact CB-CG 3.78Å; L240-R497 HydrophobicContact CD1-CG 4.19Å; S244-R497 PolarHBondContact OG-NH1 3.39Å; R493-R497 WeakPolarHBondContact O-CG 3.1Å; R493-R497 PolarHBondContact O-N 3.28Å; R493-R497 VanDerWaalsContact O-N 3.16Å; R493-R497 PolarHBondContact O-NH1 2.83Å; G494-R497 PolarHBondContact O-N 2.96Å; A495-R497 VanDerWaalsContact C-N 3.32Å; A495-R497 PolarHBondContact O-N 2.88Å; R497-I499 VanDerWaalsContact C-N 3.33Å; R497-V500 PolarHBondContact O-N 2.85Å; R497-D501 PolarHBondContact O-N 3.31Å
498	A	96.4	Very high	94.9	Very high	3 Å²	3	24.2 Å²	24.2	3%	0.025	14%	0.139	C	C	.	.	H	α-helix	trans	-64.7	-38.9	177.7	0	0	0	0	0	112.2	F470 G494 A495 D501 L502 E512	F470-A498 HydrophobicContact CE1-CB 4.19Å; F470-A498 HydrophobicContact CZ-CB 3.69Å; G494-A498 PolarHBondContact O-N 3.46Å; A495-A498 WeakPolarHBondContact O-CA 3.18Å; A495-A498 WeakPolarHBondContact O-CB 3.35Å; A495-A498 PolarHBondContact O-N 3.17Å; A498-D501 PolarHBondContact O-N 3.43Å; A498-L502 WeakPolarHBondContact O-CD1 3.33Å; A498-L502 VanDerWaalsContact O-CG 3.3Å; A498-L502 WeakPolarHBondContact O-CG 3.45Å; A498-L502 PolarHBondContact O-N 2.93Å; A498-E512 HydrophobicContact CB-CB 4.35Å; A498-E512 VanDerWaalsContact CB-CD 3.48Å; A498-E512 HydrophobicContact CB-CG 3.79Å; A498-E512 WeakPolarHBondContact CB-OE2 3.18Å
499	I	98.1	Very high	94.3	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-61	-46.6	173.2	-68.5	162.5	0	0	0	110.6	F221 F470 A495 G496 R497 D501 L502 V503	F221-I499 HydrophobicContact CB-CG2 4.48Å; F221-I499 HydrophobicContact CD1-CG2 3.89Å; F221-I499 HydrophobicContact CD2-CD1 3.96Å; F221-I499 HydrophobicContact CD2-CG1 4.49Å; F221-I499 HydrophobicContact CD2-CG2 4.05Å; F221-I499 HydrophobicContact CE1-CG2 4.05Å; F221-I499 HydrophobicContact CE2-CD1 3.59Å; F221-I499 HydrophobicContact CE2-CG1 3.97Å; F221-I499 HydrophobicContact CE2-CG2 4.19Å; F221-I499 HydrophobicContact CG-CG2 3.89Å; F221-I499 HydrophobicContact CZ-CD1 4.21Å; F221-I499 HydrophobicContact CZ-CG1 4.06Å; F221-I499 HydrophobicContact CZ-CG2 4.17Å; F470-I499 HydrophobicContact CB-CD1 4.14Å; F470-I499 HydrophobicContact CB-CG1 4.49Å; F470-I499 HydrophobicContact CD1-CD1 4.32Å; F470-I499 HydrophobicContact CD1-CG1 4.27Å; F470-I499 HydrophobicContact CD2-CD1 4Å; F470-I499 HydrophobicContact CD2-CG1 3.42Å; F470-I499 VanDerWaalsContact CD2-CG1 3.42Å; F470-I499 HydrophobicContact CE1-CG1 4.4Å; F470-I499 HydrophobicContact CE2-CG1 3.6Å; F470-I499 HydrophobicContact CG-CD1 3.89Å; F470-I499 HydrophobicContact CG-CG1 3.81Å; F470-I499 HydrophobicContact CZ-CG1 4.1Å; A495-I499 WeakPolarHBondContact O-CG1 3.35Å; A495-I499 PolarHBondContact O-N 3.48Å; G496-I499 PolarHBondContact O-N 2.92Å; R497-I499 VanDerWaalsContact C-N 3.33Å; I499-D501 VanDerWaalsContact C-N 3.34Å; I499-D501 PolarHBondContact O-N 2.85Å; I499-L502 PolarHBondContact O-N 3.26Å; I499-V503 HydrophobicContact CG2-CG2 4.09Å; I499-V503 WeakPolarHBondContact O-CB 3.47Å; I499-V503 VanDerWaalsContact O-CG2 3.26Å; I499-V503 WeakPolarHBondContact O-CG2 3.32Å; I499-V503 PolarHBondContact O-N 3.48Å
500	V	97.5	Very high	93.9	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.7	-44	176.5	171.5	0	0	0	0	111.2	Q223 T236 L237 L240 G496 R497 S504	Q223-V500 HydrophobicContact CG-CG2 4.09Å; T236-V500 HydrophobicContact CG2-CG1 4.03Å; L237-V500 HydrophobicContact CB-CG1 4.34Å; L240-V500 HydrophobicContact CD1-CG2 4.1Å; G496-V500 WeakPolarHBondContact O-CG2 3.48Å; G496-V500 PolarHBondContact O-N 3.44Å; R497-V500 PolarHBondContact O-N 2.85Å; V500-S504 WeakPolarHBondContact CG1-OG 3.38Å; V500-S504 WeakPolarHBondContact O-CB 3.33Å; V500-S504 PolarHBondContact O-N 2.94Å; V500-S504 PolarHBondContact O-OG 3.44Å
501	D	94.7	Very high	93.5	Very high	8 Å²	8	30 Å²	30	4%	0.043	16%	0.157	C	C	.	.	H	α-helix	trans	-57.4	-52.5	175.8	-174.7	51	0	0	0	111.3	L237 R497 A498 I499 V503 C505 S510 M511 E512	L237-D501 HydrophobicContact CD2-CB 3.95Å; R497-D501 PolarHBondContact O-N 3.31Å; A498-D501 PolarHBondContact O-N 3.43Å; I499-D501 VanDerWaalsContact C-N 3.34Å; I499-D501 PolarHBondContact O-N 2.85Å; D501-V503 PolarHBondContact O-N 2.95Å; D501-C505 VanDerWaalsContact O-CB 3.25Å; D501-C505 WeakPolarHBondContact O-CB 3.35Å; D501-C505 PolarHBondContact O-N 2.78Å; D501-C505 WeakPolarHBondContact OD1-CB 3.5Å; D501-S510 WeakPolarHBondContact OD2-CA 3.31Å; D501-S510 VanDerWaalsContact OD2-CB 3.27Å; D501-S510 WeakPolarHBondContact OD2-CB 3.38Å; D501-S510 PolarHBondContact OD2-OG 3.25Å; D501-M511 PolarHBondContact OD2-N 3.25Å; D501-E512 HydrophobicContact CB-CB 4.45Å; D501-E512 HydrophobicContact CB-CG 4.03Å; D501-E512 WeakPolarHBondContact OD2-CB 3.41Å; D501-E512 WeakPolarHBondContact OD2-CG 3.3Å; D501-E512 PolarHBondContact OD2-N 2.78Å
502	L	94.9	Very high	93.2	Very high	9 Å²	9	30.9 Å²	30.9	5%	0.047	16%	0.16	C	C	.	.	H	α-helix	trans	-65.6	-39	-176.2	-70.6	164.2	0	0	0	113.8	L441 V462 F470 A498 I499 E512 R513	L441-L502 HydrophobicContact CB-CD2 4.27Å; L441-L502 HydrophobicContact CD1-CD1 3.76Å; L441-L502 HydrophobicContact CD1-CD2 4.09Å; V462-L502 HydrophobicContact CG1-CD2 4.41Å; F470-L502 HydrophobicContact CE2-CD1 3.67Å; F470-L502 HydrophobicContact CZ-CD1 4.15Å; A498-L502 WeakPolarHBondContact O-CD1 3.33Å; A498-L502 VanDerWaalsContact O-CG 3.3Å; A498-L502 WeakPolarHBondContact O-CG 3.45Å; A498-L502 PolarHBondContact O-N 2.93Å; I499-L502 PolarHBondContact O-N 3.26Å; L502-E512 HydrophobicContact CD1-CB 4.24Å; L502-E512 HydrophobicContact CD2-CB 4.04Å; L502-E512 HydrophobicContact CG-CB 3.89Å; L502-R513 HydrophobicContact CD2-CG 3.82Å
503	V	96.6	Very high	92.9	Very high	5 Å²	5	31.4 Å²	31.4	3%	0.03	16%	0.162	C	C	.	.	H	α-helix	trans	-84.2	-36.4	-174	176.5	0	0	0	0	111.8	F221 G224 L225 R228 F459 F463 I499 D501	F221-V503 HydrophobicContact CD1-CG2 4.22Å; F221-V503 HydrophobicContact CE1-CG2 4.33Å; G224-V503 VanDerWaalsContact C-CG1 3.45Å; L225-V503 HydrophobicContact CD2-CG1 4.13Å; L225-V503 HydrophobicContact CG-CG1 4.29Å; R228-V503 VanDerWaalsContact CD-O 3.32Å; R228-V503 WeakPolarHBondContact CD-O 3.37Å; R228-V503 PolarHBondContact NH1-O 2.89Å; R228-V503 VanDerWaalsContact NH1-O 3.09Å; F459-V503 HydrophobicContact CE2-CG1 4.21Å; F463-V503 HydrophobicContact CD2-CG1 4.33Å; F463-V503 HydrophobicContact CD2-CG2 4.05Å; F463-V503 HydrophobicContact CE2-CG1 4.36Å; F463-V503 HydrophobicContact CE2-CG2 4.26Å; I499-V503 HydrophobicContact CG2-CG2 4.09Å; I499-V503 WeakPolarHBondContact O-CB 3.47Å; I499-V503 VanDerWaalsContact O-CG2 3.26Å; I499-V503 WeakPolarHBondContact O-CG2 3.32Å; I499-V503 PolarHBondContact O-N 3.48Å; D501-V503 PolarHBondContact O-N 2.95Å
504	S	94.9	Very high	92.8	Very high	14 Å²	14	27 Å²	27	10%	0.098	15%	0.145	C	C	.	.	H	α-helix	trans	-120.3	-17.7	-166.3	73.4	0	0	0	0	115.9	G224 G233 V500	G224-S504 WeakPolarHBondContact O-CB 3.5Å; G233-S504 WeakPolarHBondContact CA-OG 3.34Å; V500-S504 WeakPolarHBondContact CG1-OG 3.38Å; V500-S504 WeakPolarHBondContact O-CB 3.33Å; V500-S504 PolarHBondContact O-N 2.94Å; V500-S504 PolarHBondContact O-OG 3.44Å
505	C	91.9	Very high	92.6	Very high	7 Å²	7	26 Å²	26	5%	0.047	14%	0.135	C	C	.	.	S	Bend	trans	-91.5	151.1	179.8	-63.4	0	0	0	0	111.3	G233 D501	G233-C505 VanDerWaalsContact C-SG 3.51Å; D501-C505 VanDerWaalsContact O-CB 3.25Å; D501-C505 WeakPolarHBondContact O-CB 3.35Å; D501-C505 PolarHBondContact O-N 2.78Å; D501-C505 WeakPolarHBondContact OD1-CB 3.5Å
506	P	88.2	Confident	92.4	Very high	53 Å²	53	27.4 Å²	27.4	34%	0.344	14%	0.143	S	C	.	.			trans	-53.8	131	175.6	-27.1	35.2	0	0	0	111.5	S508 K509 S510	P506-S508 PolarHBondContact O-N 2.87Å; P506-S508 VanDerWaalsContact O-N 3.1Å; P506-K509 PolarHBondContact O-N 3.01Å; P506-S510 PolarHBondContact O-N 2.92Å
507	P	87.4	Confident	92.3	Very high	28 Å²	28	27.3 Å²	27.3	18%	0.182	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-53.3	-36	-178.6	-28.1	33.6	0	0	0	113.9	K509 S510 R513	P507-K509 PolarHBondContact O-N 2.89Å; P507-S510 PolarHBondContact O-N 3.41Å; P507-R513 PolarHBondContact O-NE 3.32Å
508	S	82.7	Confident	92	Very high	60 Å²	60	26.9 Å²	26.9	42%	0.42	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-71.4	-1.4	179	59.7	0	0	0	0	115.2	V410 P506	V410-S508 VanDerWaalsContact CG1-C 3.45Å; V410-S508 WeakPolarHBondContact CG1-O 3.24Å; P506-S508 PolarHBondContact O-N 2.87Å; P506-S508 VanDerWaalsContact O-N 3.1Å
509	K	84.9	Confident	91.8	Very high	154 Å²	154	27.8 Å²	27.8	67%	0.67	15%	0.152	S	C	*	.	G	3₁₀ helix	trans	-125.1	-4.4	177	-63	-175.5	-179.5	177.7	0	113.3	P506 P507	P506-K509 PolarHBondContact O-N 3.01Å; P507-K509 PolarHBondContact O-N 2.89Å
510	S	88.2	Confident	91.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.154	C	C	.	.			trans	-75.2	136.1	-176.8	172.1	0	0	0	0	111.1	D501 P506 P507 E512 R513	D501-S510 WeakPolarHBondContact OD2-CA 3.31Å; D501-S510 VanDerWaalsContact OD2-CB 3.27Å; D501-S510 WeakPolarHBondContact OD2-CB 3.38Å; D501-S510 PolarHBondContact OD2-OG 3.25Å; P506-S510 PolarHBondContact O-N 2.92Å; P507-S510 PolarHBondContact O-N 3.41Å; S510-E512 PolarHBondContact OG-N 3.28Å; S510-R513 WeakPolarHBondContact OG-CG 3.38Å
511	M	86.8	Confident	91.3	Very high	63 Å²	63	28.2 Å²	28.2	31%	0.31	15%	0.154	S	C	.	.	S	Bend	trans	-105.4	5	177.9	-63.4	-178.1	-62.5	0	0	112.3	A335 R407 V410 D501	A335-M511 HydrophobicContact CB-CE 3.9Å; R407-M511 CarbonylContact C-O 3.58Å; V410-M511 HydrophobicContact CG2-CG 4.13Å; D501-M511 PolarHBondContact OD2-N 3.25Å
512	E	91.6	Very high	91.1	Very high	44 Å²	44	33.8 Å²	33.8	21%	0.206	17%	0.174	C	C	.	.			trans	-106.9	1.9	-174.3	-66.1	-68.9	160.7	0	0	112.9	A498 D501 L502 S510 R514	A498-E512 HydrophobicContact CB-CB 4.35Å; A498-E512 VanDerWaalsContact CB-CD 3.48Å; A498-E512 HydrophobicContact CB-CG 3.79Å; A498-E512 WeakPolarHBondContact CB-OE2 3.18Å; D501-E512 HydrophobicContact CB-CB 4.45Å; D501-E512 HydrophobicContact CB-CG 4.03Å; D501-E512 WeakPolarHBondContact OD2-CB 3.41Å; D501-E512 WeakPolarHBondContact OD2-CG 3.3Å; D501-E512 PolarHBondContact OD2-N 2.78Å; L502-E512 HydrophobicContact CD1-CB 4.24Å; L502-E512 HydrophobicContact CD2-CB 4.04Å; L502-E512 HydrophobicContact CG-CB 3.89Å; S510-E512 PolarHBondContact OG-N 3.28Å; E512-R514 PolarHBondContact O-N 3.46Å; E512-R514 PolarHBondContact O-NH1 2.96Å; E512-R514 IonicContact OE2-CZ 3.3Å; E512-R514 IonicContact OE2-NH1 3.51Å; E512-R514 PolarHBondContact OE2-NH1 2.97Å; E512-R514 IonicContact OE2-NH2 3.56Å; E512-R514 PolarHBondContact OE2-NH2 2.8Å
513	R	92.2	Very high	91	Very high	14 Å²	14	33.9 Å²	33.9	5%	0.053	17%	0.174	C	C	.	.			trans	-78.4	84.2	-176.8	-69.4	-176	177.3	-76.3	-3.7	112	P411 R417 L441 V442 L502 P507 S510	P411-R513 HydrophobicContact CG-CB 3.81Å; P411-R513 HydrophobicContact CG-CG 4.44Å; R417-R513 PolarHBondContact NH1-O 3.3Å; R417-R513 PolarHBondContact NH2-O 2.75Å; L441-R513 WeakPolarHBondContact O-CG 3.49Å; L441-R513 PolarHBondContact O-NH1 3.14Å; V442-R513 HydrophobicContact CG2-CB 4.18Å; L502-R513 HydrophobicContact CD2-CG 3.82Å; P507-R513 PolarHBondContact O-NE 3.32Å; S510-R513 WeakPolarHBondContact OG-CG 3.38Å
514	R	93.9	Very high	90.9	Very high	9 Å²	9	34 Å²	34	3%	0.034	17%	0.174	C	C	.	.			trans	-61.2	158	171.8	-62.6	156.4	-177.4	72.5	-2.3	111.6	R407 E437 A439 L441 E512	R407-R514 HydrophobicContact CB-CG 4.47Å; E437-R514 HydrophobicContact CB-CG 4.28Å; E437-R514 IonicContact OE2-CZ 2.84Å; E437-R514 IonicContact OE2-NE 3.61Å; E437-R514 PolarHBondContact OE2-NE 3.31Å; E437-R514 IonicContact OE2-NH2 3.44Å; E437-R514 PolarHBondContact OE2-NH2 3.24Å; A439-R514 HydrophobicContact CB-CB 4.12Å; A439-R514 CarbonylContact O-C 3.59Å; A439-R514 WeakPolarHBondContact O-CB 3.27Å; A439-R514 VanDerWaalsContact O-O 3.06Å; L441-R514 HydrophobicContact CD1-CB 4.08Å; L441-R514 HydrophobicContact CD1-CG 4.24Å; L441-R514 HydrophobicContact CG-CB 4.46Å; L441-R514 PolarHBondContact N-O 2.64Å; L441-R514 VanDerWaalsContact N-O 3.11Å; E512-R514 PolarHBondContact O-N 3.46Å; E512-R514 PolarHBondContact O-NH1 2.96Å; E512-R514 IonicContact OE2-CZ 3.3Å; E512-R514 IonicContact OE2-NH1 3.51Å; E512-R514 PolarHBondContact OE2-NH1 2.97Å; E512-R514 IonicContact OE2-NH2 3.56Å; E512-R514 PolarHBondContact OE2-NH2 2.8Å
515	E	92.4	Very high	90.8	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.009	19%	0.188	C	C	.	.			trans	-128	157.7	172	-79.9	-178	-135.4	0	0	109.1	R417 A439 V442 S519 W520 R523	R417-E515 VanDerWaalsContact CD-OE1 3.24Å; R417-E515 WeakPolarHBondContact CD-OE1 3.25Å; R417-E515 IonicContact CZ-OE1 3.54Å; R417-E515 IonicContact NE-OE1 2.78Å; R417-E515 IonicContact NH1-OE1 2.8Å; R417-E515 PolarHBondContact NH1-OE1 3.1Å; A439-E515 CarbonylContact O-C 3.6Å; A439-E515 WeakPolarHBondContact O-CA 3.49Å; A439-E515 PolarHBondContact O-N 3.32Å; V442-E515 HydrophobicContact CB-CG 4.44Å; V442-E515 HydrophobicContact CG2-CG 3.53Å; E515-S519 VanDerWaalsContact OE2-CB 3.23Å; E515-S519 WeakPolarHBondContact OE2-CB 3.4Å; E515-S519 PolarHBondContact OE2-OG 3.27Å; E515-W520 HydrophobicContact CB-CD2 4.48Å; E515-W520 HydrophobicContact CB-CZ2 4.32Å; E515-W520 PolarHBondContact O-NE1 3.32Å; E515-R523 IonicContact OE1-CZ 3.81Å; E515-R523 IonicContact OE1-NE 2.78Å; E515-R523 PolarHBondContact OE1-NE 2.63Å; E515-R523 IonicContact OE1-NH2 3.78Å; E515-R523 PolarHBondContact OE1-NH2 3.33Å; E515-R523 IonicContact OE2-CZ 2.71Å; E515-R523 IonicContact OE2-NE 3.28Å; E515-R523 PolarHBondContact OE2-NE 3.09Å; E515-R523 IonicContact OE2-NH2 3.37Å; E515-R523 PolarHBondContact OE2-NH2 3.21Å
516	T	93.6	Very high	90.9	Very high	34 Å²	34	42.1 Å²	42.1	21%	0.209	22%	0.216	C	C	.	.			trans	-70.9	157.8	175.5	60.4	0	0	0	0	111.9	E438 D440 V518 S519 W520	E438-T516 WeakPolarHBondContact OE1-CA 3.19Å; E438-T516 WeakPolarHBondContact OE1-CB 3.31Å; E438-T516 WeakPolarHBondContact OE1-CG2 2.99Å; E438-T516 WeakPolarHBondContact OE2-CA 3.48Å; D440-T516 HydrophobicContact CB-CG2 3.79Å; T516-V518 PolarHBondContact O-N 2.91Å; T516-S519 PolarHBondContact O-N 3.25Å; T516-S519 PolarHBondContact OG1-N 3.35Å; T516-W520 PolarHBondContact O-N 3.15Å
517	A	94.5	Very high	91.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-51.6	-39.3	172.6	0	0	0	0	0	112.2	E438 S519 W520 A521 A565 F570 W580	E438-A517 PolarHBondContact OE1-N 2.93Å; E438-A517 WeakPolarHBondContact OE2-CB 3.39Å; E438-A517 PolarHBondContact OE2-N 3.1Å; A517-S519 VanDerWaalsContact C-N 3.34Å; A517-S519 PolarHBondContact O-N 3.34Å; A517-W520 PolarHBondContact O-N 2.93Å; A517-A521 WeakPolarHBondContact O-CB 3.33Å; A517-A521 PolarHBondContact O-N 3.38Å; A517-A565 HydrophobicContact CB-CB 4.13Å; A517-F570 HydrophobicContact CB-CE1 3.76Å; A517-F570 HydrophobicContact CB-CZ 3.55Å; A517-W580 HydrophobicContact CB-CB 4.15Å; A517-W580 HydrophobicContact CB-CD2 3.52Å; A517-W580 HydrophobicContact CB-CE3 4.13Å; A517-W580 HydrophobicContact CB-CG 3.53Å; A517-W580 HydrophobicContact CB-CZ2 4.27Å
518	V	91.7	Very high	91.6	Very high	57 Å²	57	40.7 Å²	40.7	35%	0.345	21%	0.214	S	C	.	.	H	α-helix	trans	-60.6	-44.7	177.2	177.9	0	0	0	0	111.1	T516 R522 A564 A565	T516-V518 PolarHBondContact O-N 2.91Å; V518-R522 WeakPolarHBondContact O-CB 3.35Å; V518-R522 PolarHBondContact O-N 2.77Å; V518-A564 HydrophobicContact CG1-CB 3.8Å; V518-A564 HydrophobicContact CG2-CB 4.25Å; V518-A565 HydrophobicContact CG2-CB 4.29Å
519	S	90.9	Very high	92.3	Very high	21 Å²	21	38 Å²	38	15%	0.147	20%	0.195	C	C	.	.	H	α-helix	trans	-69.7	-45.2	-179.6	-166.1	0	0	0	0	111.3	E515 T516 A517 A521 R522 R523	E515-S519 VanDerWaalsContact OE2-CB 3.23Å; E515-S519 WeakPolarHBondContact OE2-CB 3.4Å; E515-S519 PolarHBondContact OE2-OG 3.27Å; T516-S519 PolarHBondContact O-N 3.25Å; T516-S519 PolarHBondContact OG1-N 3.35Å; A517-S519 VanDerWaalsContact C-N 3.34Å; A517-S519 PolarHBondContact O-N 3.34Å; S519-A521 PolarHBondContact O-N 3.2Å; S519-R522 WeakPolarHBondContact O-CB 3.48Å; S519-R522 PolarHBondContact O-N 3.24Å; S519-R523 WeakPolarHBondContact O-CG 3.23Å; S519-R523 PolarHBondContact O-N 3.3Å
520	W	92.4	Very high	92.7	Very high	10 Å²	10	33.4 Å²	33.4	4%	0.038	18%	0.182	C	C	.	.	H	α-helix	trans	-60.2	-44.7	174.9	-76.1	122.7	0	0	0	112.5	L406 R417 E515 T516 A517 R522 R523 M524 W580	L406-W520 HydrophobicContact CB-CE3 4.48Å; L406-W520 HydrophobicContact CB-CH2 3.3Å; L406-W520 HydrophobicContact CB-CZ2 3.65Å; L406-W520 HydrophobicContact CB-CZ3 3.76Å; L406-W520 HydrophobicContact CD1-CD2 4.47Å; L406-W520 HydrophobicContact CD1-CE3 4Å; L406-W520 HydrophobicContact CD1-CH2 4.3Å; L406-W520 HydrophobicContact CD1-CZ3 3.92Å; L406-W520 HydrophobicContact CG-CH2 4.42Å; L406-W520 HydrophobicContact CG-CZ3 4.45Å; R417-W520 HydrophobicContact CG-CH2 4.3Å; E515-W520 HydrophobicContact CB-CD2 4.48Å; E515-W520 HydrophobicContact CB-CZ2 4.32Å; E515-W520 PolarHBondContact O-NE1 3.32Å; T516-W520 PolarHBondContact O-N 3.15Å; A517-W520 PolarHBondContact O-N 2.93Å; W520-R522 VanDerWaalsContact C-N 3.3Å; W520-R522 PolarHBondContact O-N 2.97Å; W520-R523 WeakPolarHBondContact O-CB 3.28Å; W520-R523 PolarHBondContact O-N 2.9Å; W520-R523 VanDerWaalsContact O-N 3.1Å; W520-M524 WeakPolarHBondContact O-CG 3.01Å; W520-M524 PolarHBondContact O-N 2.94Å; W520-W580 HydrophobicContact CB-CE3 4.28Å; W520-W580 HydrophobicContact CB-CH2 3.68Å; W520-W580 HydrophobicContact CB-CZ3 3.32Å; W520-W580 AromaticContact CG-CZ3 3.92Å; W520-W580 HydrophobicContact CG-CZ3 3.92Å
521	A	93.1	Very high	93	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.8	-40.3	176.9	0	0	0	0	0	112.2	A517 S519 R525 A565 W580 W584	A517-A521 WeakPolarHBondContact O-CB 3.33Å; A517-A521 PolarHBondContact O-N 3.38Å; S519-A521 PolarHBondContact O-N 3.2Å; A521-R525 WeakPolarHBondContact O-CG 3.43Å; A521-R525 PolarHBondContact O-N 2.87Å; A521-R525 VanDerWaalsContact O-N 3.07Å; A521-R525 PolarHBondContact O-NE 3.41Å; A521-A565 HydrophobicContact CB-CB 4.12Å; A521-W580 HydrophobicContact CB-CZ2 4.48Å; A521-W584 HydrophobicContact CB-CH2 3.69Å; A521-W584 HydrophobicContact CB-CZ2 3.99Å
522	R	91.5	Very high	93.4	Very high	125 Å²	125	35.2 Å²	35.2	47%	0.472	20%	0.197	S	C	.	.	H	α-helix	trans	-61.1	-47.1	172.5	-178.7	-178.1	63.5	108.7	1.7	111.3	V518 S519 W520 R525 S526	V518-R522 WeakPolarHBondContact O-CB 3.35Å; V518-R522 PolarHBondContact O-N 2.77Å; S519-R522 WeakPolarHBondContact O-CB 3.48Å; S519-R522 PolarHBondContact O-N 3.24Å; W520-R522 VanDerWaalsContact C-N 3.3Å; W520-R522 PolarHBondContact O-N 2.97Å; R522-R525 PolarHBondContact O-N 2.89Å; R522-S526 WeakPolarHBondContact O-CB 3.26Å; R522-S526 PolarHBondContact O-N 3.42Å; R522-S526 PolarHBondContact O-OG 3.36Å; R522-S526 VanDerWaalsContact O-OG 3.13Å
523	R	91.7	Very high	93.5	Very high	11 Å²	11	37.2 Å²	37.2	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-61.6	-43.9	178.8	-66.8	-179.1	-177.2	-80.2	8.6	112.3	V414 D418 F444 E515 S519 W520 R525 S526 A527	V414-R523 PolarHBondContact O-NH1 3.28Å; V414-R523 VanDerWaalsContact O-NH1 3.1Å; D418-R523 VanDerWaalsContact CG-NH1 3.33Å; D418-R523 WeakPolarHBondContact OD1-CG 3.34Å; D418-R523 IonicContact OD1-CZ 3.5Å; D418-R523 IonicContact OD1-NH1 2.67Å; D418-R523 PolarHBondContact OD1-NH1 2.78Å; D418-R523 IonicContact OD2-NH1 3.74Å; F444-R523 VanDerWaalsContact CE2-NH2 3.32Å; E515-R523 IonicContact OE1-CZ 3.81Å; E515-R523 IonicContact OE1-NE 2.78Å; E515-R523 PolarHBondContact OE1-NE 2.63Å; E515-R523 IonicContact OE1-NH2 3.78Å; E515-R523 PolarHBondContact OE1-NH2 3.33Å; E515-R523 IonicContact OE2-CZ 2.71Å; E515-R523 IonicContact OE2-NE 3.28Å; E515-R523 PolarHBondContact OE2-NE 3.09Å; E515-R523 IonicContact OE2-NH2 3.37Å; E515-R523 PolarHBondContact OE2-NH2 3.21Å; S519-R523 WeakPolarHBondContact O-CG 3.23Å; S519-R523 PolarHBondContact O-N 3.3Å; W520-R523 WeakPolarHBondContact O-CB 3.28Å; W520-R523 PolarHBondContact O-N 2.9Å; W520-R523 VanDerWaalsContact O-N 3.1Å; R523-R525 PolarHBondContact O-N 2.95Å; R523-S526 PolarHBondContact O-N 3.35Å; R523-A527 WeakPolarHBondContact O-CB 3.33Å; R523-A527 PolarHBondContact O-N 2.76Å
524	M	93.9	Very high	93.6	Very high	7 Å²	7	38 Å²	38	3%	0.034	23%	0.226	C	C	.	.	H	α-helix	trans	-60.3	-46.1	176.8	-69	-58.4	-72.3	0	0	111.3	V432 V434 W520 S526 A527 G528 F529 W584	V432-M524 HydrophobicContact CB-CE 4.26Å; V432-M524 HydrophobicContact CG1-CE 4Å; V434-M524 HydrophobicContact CG2-CE 4.19Å; V434-M524 HydrophobicContact CG2-SD 4.32Å; W520-M524 WeakPolarHBondContact O-CG 3.01Å; W520-M524 PolarHBondContact O-N 2.94Å; M524-S526 PolarHBondContact O-N 2.65Å; M524-A527 PolarHBondContact O-N 3.25Å; M524-G528 PolarHBondContact O-N 3.46Å; M524-F529 HydrophobicContact CB-CB 4.37Å; M524-F529 HydrophobicContact CE-CB 4.15Å; M524-F529 HydrophobicContact CE-CD1 4.37Å; M524-F529 HydrophobicContact CE-CD2 3.64Å; M524-F529 HydrophobicContact CE-CE2 4.05Å; M524-F529 HydrophobicContact CE-CG 3.81Å; M524-F529 WeakPolarHBondContact O-CB 3.11Å; M524-F529 PolarHBondContact O-N 2.9Å; M524-F529 HydrophobicContact SD-CD2 4.32Å; M524-W584 HydrophobicContact CB-CD2 3.71Å; M524-W584 HydrophobicContact CB-CE3 3.59Å; M524-W584 HydrophobicContact CB-CG 4.45Å; M524-W584 HydrophobicContact CB-CH2 3.93Å; M524-W584 HydrophobicContact CB-CZ2 4.01Å; M524-W584 HydrophobicContact CB-CZ3 3.69Å; M524-W584 HydrophobicContact CE-CB 3.75Å; M524-W584 HydrophobicContact CE-CD2 4.05Å; M524-W584 HydrophobicContact CE-CG 3.54Å; M524-W584 HydrophobicContact CG-CD2 3.94Å; M524-W584 HydrophobicContact CG-CE3 4.34Å; M524-W584 HydrophobicContact CG-CG 4.36Å; M524-W584 HydrophobicContact CG-CZ2 4.13Å
525	R	94.5	Very high	93.7	Very high	102 Å²	102	39.1 Å²	39.1	39%	0.385	24%	0.235	S	C	.	.	H	α-helix	trans	-60.8	-44.7	174.2	-72.7	-175.6	-73.9	-99.3	8	112.6	A521 R522 R523 A527 G528 F529 A564 A565 W584	A521-R525 WeakPolarHBondContact O-CG 3.43Å; A521-R525 PolarHBondContact O-N 2.87Å; A521-R525 VanDerWaalsContact O-N 3.07Å; A521-R525 PolarHBondContact O-NE 3.41Å; R522-R525 PolarHBondContact O-N 2.89Å; R523-R525 PolarHBondContact O-N 2.95Å; R525-A527 VanDerWaalsContact C-N 3.25Å; R525-A527 PolarHBondContact O-N 3.41Å; R525-G528 PolarHBondContact O-N 2.97Å; R525-F529 WeakPolarHBondContact CA-O 3.22Å; R525-A564 PolarHBondContact NH2-O 3.47Å; R525-A565 PolarHBondContact NH1-O 2.95Å; R525-W584 HydrophobicContact CG-CZ3 4.12Å
526	S	93	Very high	93.8	Very high	91 Å²	91	45.1 Å²	45.1	64%	0.636	26%	0.263	S	S	*	.	H	α-helix	trans	-64.6	-28.8	177.1	-65.8	0	0	0	0	113.3	R522 R523 M524 G528	R522-S526 WeakPolarHBondContact O-CB 3.26Å; R522-S526 PolarHBondContact O-N 3.42Å; R522-S526 PolarHBondContact O-OG 3.36Å; R522-S526 VanDerWaalsContact O-OG 3.13Å; R523-S526 PolarHBondContact O-N 3.35Å; M524-S526 PolarHBondContact O-N 2.65Å; S526-G528 PolarHBondContact O-N 2.61Å
527	A	94.5	Very high	93.9	Very high	15 Å²	15	48.3 Å²	48.3	12%	0.124	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	1.7	172.8	0	0	0	0	0	113.5	R425 R523 M524 R525 F529	R425-A527 WeakPolarHBondContact CB-O 3.3Å; R425-A527 VanDerWaalsContact CG-O 3.28Å; R425-A527 WeakPolarHBondContact CG-O 3.33Å; R523-A527 WeakPolarHBondContact O-CB 3.33Å; R523-A527 PolarHBondContact O-N 2.76Å; M524-A527 PolarHBondContact O-N 3.25Å; R525-A527 VanDerWaalsContact C-N 3.25Å; R525-A527 PolarHBondContact O-N 3.41Å; A527-F529 HydrophobicContact CB-CD2 3.96Å; A527-F529 HydrophobicContact CB-CE2 4.17Å
528	G	96	Very high	94	Very high	35 Å²	35	48.4 Å²	48.4	36%	0.361	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.5	30.2	178.9	0	0	0	0	0	113.7	R425 M524 R525 S526 P586	R425-G528 PolarHBondContact NE-O 2.87Å; M524-G528 PolarHBondContact O-N 3.46Å; R525-G528 PolarHBondContact O-N 2.97Å; S526-G528 PolarHBondContact O-N 2.61Å; G528-P586 CarbonylContact O-C 3.07Å
529	F	96.2	Very high	94.2	Very high	5 Å²	5	46.1 Å²	46.1	2%	0.022	27%	0.266	C	S	.	.			trans	-105.1	146.9	170.5	-66.2	-82.7	0	0	0	112.1	L424 R425 P429 V432 M524 R525 A527 W584 R585 P586	L424-F529 HydrophobicContact CB-CZ 4.31Å; R425-F529 VanDerWaalsContact CA-CZ 3.46Å; R425-F529 HydrophobicContact CB-CE2 3.7Å; R425-F529 HydrophobicContact CB-CZ 3.72Å; R425-F529 HydrophobicContact CG-CZ 4.45Å; P429-F529 HydrophobicContact CG-CE1 3.98Å; P429-F529 HydrophobicContact CG-CZ 4.38Å; V432-F529 HydrophobicContact CB-CE1 4.5Å; V432-F529 HydrophobicContact CG2-CD1 4.25Å; V432-F529 HydrophobicContact CG2-CE1 3.53Å; V432-F529 HydrophobicContact CG2-CZ 3.9Å; M524-F529 HydrophobicContact CB-CB 4.37Å; M524-F529 HydrophobicContact CE-CB 4.15Å; M524-F529 HydrophobicContact CE-CD1 4.37Å; M524-F529 HydrophobicContact CE-CD2 3.64Å; M524-F529 HydrophobicContact CE-CE2 4.05Å; M524-F529 HydrophobicContact CE-CG 3.81Å; M524-F529 WeakPolarHBondContact O-CB 3.11Å; M524-F529 PolarHBondContact O-N 2.9Å; M524-F529 HydrophobicContact SD-CD2 4.32Å; R525-F529 WeakPolarHBondContact CA-O 3.22Å; A527-F529 HydrophobicContact CB-CD2 3.96Å; A527-F529 HydrophobicContact CB-CE2 4.17Å; F529-W584 HydrophobicContact CB-CB 4.14Å; F529-W584 HydrophobicContact CB-CE3 4.15Å; F529-W584 HydrophobicContact CD1-CB 4.4Å; F529-W584 HydrophobicContact CG-CB 4.48Å; F529-R585 CarbonylContact C-O 3.57Å; F529-R585 VanDerWaalsContact CA-O 3.27Å; F529-R585 WeakPolarHBondContact CA-O 3.42Å; F529-P586 HydrophobicContact CE1-CG 4.43Å
530	S	94.9	Very high	94.5	Very high	57 Å²	57	48.6 Å²	48.6	40%	0.399	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	140.3	172	-56.5	0	0	0	0	110.3	W584 R585	S530-W584 CarbonylContact O-C 3.56Å; S530-W584 WeakPolarHBondContact O-CA 3.29Å; S530-R585 PolarHBondContact N-O 2.98Å; S530-R585 PolarHBondContact O-N 2.84Å
531	P	94.5	Very high	94.7	Very high	54 Å²	54	52.4 Å²	52.4	35%	0.351	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	146.9	177.9	29.4	-34.8	0	0	0	111.5	A567 W584	P531-A567 HydrophobicContact CB-CB 3.3Å; P531-A567 HydrophobicContact CG-CB 4.23Å; P531-W584 HydrophobicContact CB-CE3 4.06Å; P531-W584 HydrophobicContact CB-CH2 4.13Å; P531-W584 HydrophobicContact CB-CZ3 3.77Å; P531-W584 HydrophobicContact CG-CZ3 4.29Å
532	V	94.1	Very high	94.9	Very high	46 Å²	46	52.4 Å²	52.4	28%	0.279	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	122	173.1	-179.3	0	0	0	0	107.4	A583 R585	V532-A583 HydrophobicContact CB-CB 4.03Å; V532-A583 PolarHBondContact N-O 3.19Å; V532-R585 HydrophobicContact CG2-CB 3.95Å; V532-R585 HydrophobicContact CG2-CG 3.77Å
533	A	93.6	Very high	95.2	Very high	87 Å²	87	49.8 Å²	49.8	72%	0.719	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-69.1	139.1	173.9	0	0	0	0	0	109.5
534	F	95.3	Very high	95.4	Very high	30 Å²	30	51.8 Å²	51.8	13%	0.132	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-66.4	142.9	168.5	-66.6	-66.7	0	0	0	109.4	A273 A277 V538 I569 A581 A583	A273-F534 HydrophobicContact CB-CE1 4.16Å; A273-F534 HydrophobicContact CB-CZ 4Å; A273-F534 VanDerWaalsContact O-CE1 3.31Å; A273-F534 WeakPolarHBondContact O-CE1 3.27Å; A277-F534 HydrophobicContact CB-CD1 4.09Å; A277-F534 HydrophobicContact CB-CE1 3.78Å; F534-V538 HydrophobicContact CB-CB 4.23Å; F534-V538 HydrophobicContact CB-CG1 4.13Å; F534-V538 HydrophobicContact CD1-CB 4.46Å; F534-V538 HydrophobicContact CD1-CG1 3.73Å; F534-V538 HydrophobicContact CE1-CG1 4.46Å; F534-V538 HydrophobicContact CG-CG1 4.14Å; F534-I569 HydrophobicContact CD2-CD1 4.22Å; F534-I569 HydrophobicContact CD2-CG1 3.93Å; F534-I569 HydrophobicContact CD2-CG2 4.21Å; F534-I569 HydrophobicContact CE2-CD1 4.29Å; F534-I569 HydrophobicContact CE2-CG1 3.78Å; F534-A581 WeakPolarHBondContact CE2-O 3.42Å; F534-A581 HydrophobicContact CZ-CB 4.43Å; F534-A583 HydrophobicContact CE1-CB 4.07Å; F534-A583 HydrophobicContact CZ-CB 4.33Å
535	S	95	Very high	95.6	Very high	33 Å²	33	51.5 Å²	51.5	23%	0.231	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-68.1	163.7	172.9	71.9	0	0	0	0	111	E280 D537 V538 A539	E280-S535 VanDerWaalsContact OE1-CB 3.22Å; E280-S535 WeakPolarHBondContact OE1-CB 3.49Å; E280-S535 PolarHBondContact OE1-OG 3.24Å; S535-D537 PolarHBondContact O-N 3.5Å; S535-D537 PolarHBondContact OG-N 3.44Å; S535-V538 PolarHBondContact O-N 3.32Å; S535-V538 WeakPolarHBondContact OG-CG2 3.48Å; S535-V538 PolarHBondContact OG-N 2.87Å; S535-V538 VanDerWaalsContact OG-N 3.13Å; S535-A539 PolarHBondContact O-N 2.92Å
536	E	95.5	Very high	95.7	Very high	127 Å²	127	47.5 Å²	47.5	59%	0.593	29%	0.289	S	S	*	.	H	α-helix	trans	-62.9	-30.5	171.7	-74.4	-59.2	153.2	0	0	112.2	A539 D540 R543	E536-A539 PolarHBondContact O-N 3.31Å; E536-D540 WeakPolarHBondContact O-CB 3.12Å; E536-D540 PolarHBondContact O-N 3.17Å; E536-R543 IonicContact OE2-CZ 3.83Å; E536-R543 IonicContact OE2-NH1 3.64Å; E536-R543 PolarHBondContact OE2-NH1 3.48Å; E536-R543 IonicContact OE2-NH2 2.72Å; E536-R543 PolarHBondContact OE2-NH2 3.43Å
537	D	96	Very high	95.9	Very high	102 Å²	102	52.1 Å²	52.1	55%	0.545	29%	0.293	S	S	.	.	H	α-helix	trans	-62.1	-46.6	175	-68.6	-13.8	0	0	0	110.6	S535 D540 D541	S535-D537 PolarHBondContact O-N 3.5Å; S535-D537 PolarHBondContact OG-N 3.44Å; D537-D540 PolarHBondContact O-N 3.48Å; D537-D541 PolarHBondContact O-N 3.33Å
538	V	96.2	Very high	95.9	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.012	31%	0.313	C	S	.	.	H	α-helix	trans	-65.3	-40.6	176.2	177	0	0	0	0	111.1	F534 S535 D540 D541 V542	F534-V538 HydrophobicContact CB-CB 4.23Å; F534-V538 HydrophobicContact CB-CG1 4.13Å; F534-V538 HydrophobicContact CD1-CB 4.46Å; F534-V538 HydrophobicContact CD1-CG1 3.73Å; F534-V538 HydrophobicContact CE1-CG1 4.46Å; F534-V538 HydrophobicContact CG-CG1 4.14Å; S535-V538 PolarHBondContact O-N 3.32Å; S535-V538 WeakPolarHBondContact OG-CG2 3.48Å; S535-V538 PolarHBondContact OG-N 2.87Å; S535-V538 VanDerWaalsContact OG-N 3.13Å; V538-D540 VanDerWaalsContact C-N 3.33Å; V538-D540 PolarHBondContact O-N 3.19Å; V538-D541 PolarHBondContact O-N 2.96Å; V538-V542 WeakPolarHBondContact O-CG2 3.19Å; V538-V542 PolarHBondContact O-N 3.34Å
539	A	95.6	Very high	95.9	Very high	8 Å²	8	57.9 Å²	57.9	7%	0.066	30%	0.301	C	S	.	.	H	α-helix	trans	-62.8	-40.1	176.1	0	0	0	0	0	111.6	S535 E536 V542 R543 M555	S535-A539 PolarHBondContact O-N 2.92Å; E536-A539 PolarHBondContact O-N 3.31Å; A539-V542 PolarHBondContact O-N 3.48Å; A539-R543 WeakPolarHBondContact O-CG 3.5Å; A539-R543 PolarHBondContact O-N 3.01Å; A539-M555 HydrophobicContact CB-CE 4.31Å
540	D	97	Very high	95.7	Very high	74 Å²	74	65.1 Å²	65.1	40%	0.396	33%	0.328	S	S	.	.	H	α-helix	trans	-68	-37.3	175.8	-85	-22.7	0	0	0	113.1	E536 D537 V538 V542 R543 S544	E536-D540 WeakPolarHBondContact O-CB 3.12Å; E536-D540 PolarHBondContact O-N 3.17Å; D537-D540 PolarHBondContact O-N 3.48Å; V538-D540 VanDerWaalsContact C-N 3.33Å; V538-D540 PolarHBondContact O-N 3.19Å; D540-V542 VanDerWaalsContact C-N 3.34Å; D540-R543 PolarHBondContact O-N 3.26Å; D540-R543 IonicContact OD1-CZ 2.64Å; D540-R543 IonicContact OD1-NH1 3.04Å; D540-R543 PolarHBondContact OD1-NH1 3.1Å; D540-S544 WeakPolarHBondContact O-CB 3.23Å; D540-S544 PolarHBondContact O-N 3.13Å; D540-S544 PolarHBondContact O-OG 3.07Å
541	D	97.1	Very high	95.6	Very high	90 Å²	90	71.3 Å²	71.3	48%	0.481	35%	0.351	S	S	.	.	H	α-helix	trans	-61.9	-42.6	172.5	-82.2	-19.1	0	0	0	111.3	V272 D537 V538 S544 L545	V272-D541 HydrophobicContact CG1-CB 3.76Å; D537-D541 PolarHBondContact O-N 3.33Å; V538-D541 PolarHBondContact O-N 2.96Å; D541-S544 PolarHBondContact O-N 3.34Å; D541-L545 WeakPolarHBondContact O-CB 3.25Å; D541-L545 PolarHBondContact O-N 3.42Å
542	V	97.2	Very high	95.5	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-66.2	-48.1	175.7	174.2	0	0	0	0	111	F269 V272 A273 V538 A539 D540 S544 L545 L546 M555 I569	F269-V542 HydrophobicContact CD2-CG1 3.56Å; F269-V542 HydrophobicContact CE2-CG1 3.55Å; V272-V542 HydrophobicContact CB-CG2 4.39Å; V272-V542 HydrophobicContact CG1-CG2 3.84Å; A273-V542 HydrophobicContact CB-CG2 4.16Å; V538-V542 WeakPolarHBondContact O-CG2 3.19Å; V538-V542 PolarHBondContact O-N 3.34Å; A539-V542 PolarHBondContact O-N 3.48Å; D540-V542 VanDerWaalsContact C-N 3.34Å; V542-S544 VanDerWaalsContact C-N 3.25Å; V542-S544 PolarHBondContact O-N 2.95Å; V542-L545 WeakPolarHBondContact O-CB 3.45Å; V542-L545 PolarHBondContact O-N 2.88Å; V542-L545 VanDerWaalsContact O-N 3.14Å; V542-L546 WeakPolarHBondContact O-CG 3.39Å; V542-L546 PolarHBondContact O-N 3.28Å; V542-M555 HydrophobicContact CB-SD 3.92Å; V542-M555 HydrophobicContact CG1-CB 4.44Å; V542-M555 HydrophobicContact CG1-CG 4.14Å; V542-M555 HydrophobicContact CG1-SD 3.5Å; V542-M555 VanDerWaalsContact CG1-SD 3.5Å; V542-I569 HydrophobicContact CG1-CD1 4.29Å; V542-I569 HydrophobicContact CG2-CD1 4.12Å
543	R	96.6	Very high	95.7	Very high	69 Å²	69	69 Å²	69	26%	0.26	34%	0.339	S	S	.	.	H	α-helix	trans	-57.2	-41.6	175.8	-68.8	167.7	-160.1	131.6	-0.2	110.8	E536 A539 D540 L546 R547 M555	E536-R543 IonicContact OE2-CZ 3.83Å; E536-R543 IonicContact OE2-NH1 3.64Å; E536-R543 PolarHBondContact OE2-NH1 3.48Å; E536-R543 IonicContact OE2-NH2 2.72Å; E536-R543 PolarHBondContact OE2-NH2 3.43Å; A539-R543 WeakPolarHBondContact O-CG 3.5Å; A539-R543 PolarHBondContact O-N 3.01Å; D540-R543 PolarHBondContact O-N 3.26Å; D540-R543 IonicContact OD1-CZ 2.64Å; D540-R543 IonicContact OD1-NH1 3.04Å; D540-R543 PolarHBondContact OD1-NH1 3.1Å; R543-L546 PolarHBondContact O-N 3.08Å; R543-R547 WeakPolarHBondContact O-CG 3.42Å; R543-R547 PolarHBondContact O-N 2.98Å; R543-M555 HydrophobicContact CG-CE 4.08Å
544	S	97	Very high	95.8	Very high	54 Å²	54	66.2 Å²	66.2	38%	0.378	31%	0.314	S	S	.	.	H	α-helix	trans	-68.4	-36.2	177.9	-62.4	0	0	0	0	112.7	D540 D541 V542	D540-S544 WeakPolarHBondContact O-CB 3.23Å; D540-S544 PolarHBondContact O-N 3.13Å; D540-S544 PolarHBondContact O-OG 3.07Å; D541-S544 PolarHBondContact O-N 3.34Å; V542-S544 VanDerWaalsContact C-N 3.25Å; V542-S544 PolarHBondContact O-N 2.95Å
545	L	97.4	Very high	95.8	Very high	1 Å²	1	66.5 Å²	66.5	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-57.8	-49.9	169.9	163.9	77.3	0	0	0	110.8	M1 F269 V272 D541 V542 R547 R548 Y549	M1-L545 HydrophobicContact CE-CD1 4.41Å; F269-L545 HydrophobicContact CB-CD2 4.37Å; V272-L545 HydrophobicContact CB-CD2 4.24Å; V272-L545 HydrophobicContact CG2-CD1 4.48Å; V272-L545 HydrophobicContact CG2-CD2 3.91Å; D541-L545 WeakPolarHBondContact O-CB 3.25Å; D541-L545 PolarHBondContact O-N 3.42Å; V542-L545 WeakPolarHBondContact O-CB 3.45Å; V542-L545 PolarHBondContact O-N 2.88Å; V542-L545 VanDerWaalsContact O-N 3.14Å; L545-R547 VanDerWaalsContact C-N 3.32Å; L545-R547 PolarHBondContact O-N 3.47Å; L545-R548 WeakPolarHBondContact O-CB 3.42Å; L545-R548 PolarHBondContact O-N 3.23Å; L545-R548 VanDerWaalsContact O-N 3.14Å; L545-Y549 HydrophobicContact CD1-CE2 3.55Å; L545-Y549 HydrophobicContact CG-CE2 3.96Å; L545-Y549 VanDerWaalsContact O-CD2 3.3Å; L545-Y549 WeakPolarHBondContact O-CD2 3.46Å; L545-Y549 WeakPolarHBondContact O-CE2 3.22Å
546	L	97.1	Very high	95.6	Very high	17 Å²	17	68 Å²	68	9%	0.089	32%	0.317	C	S	.	.	H	α-helix	trans	-64.9	-33.5	-174.3	-63.3	-173.1	0	0	0	113.1	P265 V542 R543 R548 Y549 W553 M555 L571	P265-L546 HydrophobicContact CB-CD2 3.59Å; P265-L546 HydrophobicContact CG-CD2 3.9Å; V542-L546 WeakPolarHBondContact O-CG 3.39Å; V542-L546 PolarHBondContact O-N 3.28Å; R543-L546 PolarHBondContact O-N 3.08Å; L546-R548 PolarHBondContact O-N 3.4Å; L546-Y549 PolarHBondContact O-N 2.83Å; L546-W553 HydrophobicContact CD2-CB 4.38Å; L546-M555 HydrophobicContact CD1-CB 3.87Å; L546-L571 HydrophobicContact CD1-CD1 4.22Å; L546-L571 HydrophobicContact CD2-CD1 3.62Å
547	R	96.4	Very high	95.1	Very high	189 Å²	189	65 Å²	65	71%	0.713	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-15.8	174.8	-70.3	174.6	-170.8	143.1	1.1	114.2	R543 L545	R543-R547 WeakPolarHBondContact O-CG 3.42Å; R543-R547 PolarHBondContact O-N 2.98Å; L545-R547 VanDerWaalsContact C-N 3.32Å; L545-R547 PolarHBondContact O-N 3.47Å
548	R	95.2	Very high	94.3	Very high	143 Å²	143	60.4 Å²	60.4	54%	0.54	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-13.7	178	-60.6	-175.5	-71.4	-166.3	-11.9	113.6	L545 L546	L545-R548 WeakPolarHBondContact O-CB 3.42Å; L545-R548 PolarHBondContact O-N 3.23Å; L545-R548 VanDerWaalsContact O-N 3.14Å; L546-R548 PolarHBondContact O-N 3.4Å
549	Y	95.5	Very high	92.6	Very high	28 Å²	28	63.4 Å²	63.4	11%	0.11	31%	0.312	C	S	.	.	S	Bend	trans	-102	173.8	-177.9	-62.2	-82.6	0	0	0	111.2	Q261 E262 P265 S268 L545 L546	Q261-Y549 WeakPolarHBondContact O-CE1 3.42Å; Q261-Y549 PolarHBondContact O-OH 3.26Å; E262-Y549 WeakPolarHBondContact O-CE1 3.42Å; P265-Y549 HydrophobicContact CB-CD2 3.75Å; P265-Y549 HydrophobicContact CB-CE2 3.63Å; P265-Y549 HydrophobicContact CB-CG 4.3Å; P265-Y549 HydrophobicContact CG-CD2 4.08Å; P265-Y549 HydrophobicContact CG-CE2 4.41Å; P265-Y549 HydrophobicContact CG-CG 4.22Å; S268-Y549 PolarHBondContact OG-OH 2.9Å; L545-Y549 HydrophobicContact CD1-CE2 3.55Å; L545-Y549 HydrophobicContact CG-CE2 3.96Å; L545-Y549 VanDerWaalsContact O-CD2 3.3Å; L545-Y549 WeakPolarHBondContact O-CD2 3.46Å; L545-Y549 WeakPolarHBondContact O-CE2 3.22Å; L546-Y549 PolarHBondContact O-N 2.83Å
550	R	91.7	Very high	90.6	Very high	157 Å²	157	69.8 Å²	69.8	59%	0.592	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-59.8	154.4	173.4	-64.5	-176.6	179.2	-159.6	-3.7	110.8	E479	E479-R550 VanDerWaalsContact O-CD 3.31Å; E479-R550 WeakPolarHBondContact O-CD 3.33Å; E479-R550 VanDerWaalsContact O-CZ 3.3Å; E479-R550 PolarHBondContact O-NH1 2.95Å
551	E	92.5	Very high	88.3	Confident	186 Å²	186	70.7 Å²	70.7	87%	0.869	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	152.7	170.2	-63.7	-177.9	176.9	0	0	110.9
552	G	93.4	Very high	85.9	Confident	29 Å²	29	75 Å²	75	30%	0.299	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	111.2	-20.2	-177.2	0	0	0	0	0	113.8	W573 K574	G552-W573 CarbonylContact O-C 3.13Å; G552-W573 WeakPolarHBondContact O-CA 3.48Å; G552-K574 PolarHBondContact O-N 3.4Å
553	W	97.3	Very high	83.7	Confident	24 Å²	24	76.4 Å²	76.4	9%	0.091	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	132.8	171.6	-64.2	103.1	0	0	0	111.7	P265 W266 L546 L571 A572 W573	P265-W553 VanDerWaalsContact CD-CE2 3.4Å; P265-W553 VanDerWaalsContact CD-NE1 3.35Å; P265-W553 HydrophobicContact CG-CB 4.13Å; P265-W553 HydrophobicContact CG-CD2 3.32Å; P265-W553 HydrophobicContact CG-CE3 3.82Å; P265-W553 HydrophobicContact CG-CG 3.45Å; P265-W553 VanDerWaalsContact CG-CG 3.45Å; P265-W553 HydrophobicContact CG-CZ2 4.29Å; P265-W553 HydrophobicContact CG-CZ3 4.46Å; W266-W553 AromaticContact CE3-CH2 3.72Å; W266-W553 HydrophobicContact CE3-CH2 3.72Å; W266-W553 HydrophobicContact CE3-CZ3 4.41Å; W266-W553 HydrophobicContact CZ3-CH2 4.09Å; L546-W553 HydrophobicContact CD2-CB 4.38Å; W553-L571 HydrophobicContact CD2-CD1 4.41Å; W553-L571 HydrophobicContact CE3-CD1 3.62Å; W553-L571 HydrophobicContact CE3-CD2 3.86Å; W553-L571 HydrophobicContact CE3-CG 3.63Å; W553-L571 HydrophobicContact CZ3-CD1 4.28Å; W553-L571 HydrophobicContact CZ3-CD2 3.68Å; W553-L571 HydrophobicContact CZ3-CG 3.78Å; W553-A572 WeakPolarHBondContact CA-O 3.35Å; W553-W573 AromaticContact CD1-CE3 3.86Å; W553-W573 AromaticContact CD1-CZ3 3.58Å; W553-W573 HydrophobicContact CD2-CD2 4.49Å; W553-W573 AromaticContact CD2-CE3 3.47Å; W553-W573 HydrophobicContact CD2-CE3 3.47Å; W553-W573 VanDerWaalsContact CD2-CE3 3.47Å; W553-W573 HydrophobicContact CD2-CZ3 4.02Å; W553-W573 AromaticContact CE2-CE3 3.25Å; W553-W573 AromaticContact CE2-CZ3 3.55Å; W553-W573 HydrophobicContact CE3-CB 4.08Å; W553-W573 AromaticContact CE3-CE3 3.97Å; W553-W573 HydrophobicContact CE3-CE3 3.97Å; W553-W573 AromaticContact CG-CE3 3.86Å; W553-W573 HydrophobicContact CG-CE3 3.86Å; W553-W573 HydrophobicContact CG-CZ3 4.03Å; W553-W573 HydrophobicContact CH2-CB 3.95Å; W553-W573 HydrophobicContact CH2-CD2 4.26Å; W553-W573 HydrophobicContact CH2-CE3 4.05Å; W553-W573 HydrophobicContact CH2-CG 4.26Å; W553-W573 HydrophobicContact CZ2-CD2 4.08Å; W553-W573 AromaticContact CZ2-CE3 3.57Å; W553-W573 HydrophobicContact CZ2-CE3 3.57Å; W553-W573 HydrophobicContact CZ2-CZ3 4.08Å; W553-W573 HydrophobicContact CZ3-CB 3.66Å; W553-W573 HydrophobicContact CZ3-CE3 4.25Å; W553-W573 HydrophobicContact CZ3-CG 4.4Å; W553-W573 AromaticContact NE1-CE3 3.51Å; W553-W573 AromaticContact NE1-CZ3 3.26Å; W553-W573 VanDerWaalsContact NE1-CZ3 3.26Å
554	S	96.2	Very high	81.7	Confident	27 Å²	27	76.4 Å²	76.4	19%	0.189	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	152.2	173.9	56	0	0	0	0	111.5	A572 E575	S554-A572 PolarHBondContact N-O 3.4Å; S554-A572 PolarHBondContact O-N 3.01Å; S554-E575 PolarHBondContact OG-OE1 3.39Å
555	M	95.5	Very high	80.2	Confident	36 Å²	36	73.8 Å²	73.8	18%	0.177	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	135.5	169.2	-175.6	-172.6	82.9	0	0	108.3	F269 A539 V542 R543 L546 I569 F570	F269-M555 HydrophobicContact CE2-CG 4.23Å; A539-M555 HydrophobicContact CB-CE 4.31Å; V542-M555 HydrophobicContact CB-SD 3.92Å; V542-M555 HydrophobicContact CG1-CB 4.44Å; V542-M555 HydrophobicContact CG1-CG 4.14Å; V542-M555 HydrophobicContact CG1-SD 3.5Å; V542-M555 VanDerWaalsContact CG1-SD 3.5Å; R543-M555 HydrophobicContact CG-CE 4.08Å; L546-M555 HydrophobicContact CD1-CB 3.87Å; M555-I569 HydrophobicContact CG-CB 4.29Å; M555-I569 HydrophobicContact CG-CD1 4.31Å; M555-I569 HydrophobicContact SD-CD1 3.86Å; M555-I569 HydrophobicContact SD-CG2 4.44Å; M555-F570 CarbonylContact C-O 3.57Å; M555-F570 VanDerWaalsContact CA-O 3.29Å; M555-F570 WeakPolarHBondContact CA-O 3.4Å
556	R	91.5	Very high	78.8	Confident	65 Å²	65	76.5 Å²	76.5	25%	0.245	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	139.8	173.5	-64.5	-173.9	175.1	-178.6	-0.9	111.2	I569 F570 E575	R556-I569 CarbonylContact O-C 3.49Å; R556-I569 WeakPolarHBondContact O-CA 3.41Å; R556-F570 HydrophobicContact CB-CB 4.33Å; R556-F570 PolarHBondContact N-O 2.86Å; R556-F570 PolarHBondContact O-N 3.41Å; R556-E575 IonicContact CZ-OE2 2.77Å; R556-E575 IonicContact NE-OE2 2.9Å; R556-E575 PolarHBondContact NH1-O 3.16Å; R556-E575 PolarHBondContact NH2-O 3.48Å; R556-E575 IonicContact NH2-OE2 3.35Å; R556-E575 PolarHBondContact NH2-OE2 3.33Å
557	D	85	Confident	77.9	Confident	64 Å²	64	76 Å²	76	34%	0.342	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	139.4	172.8	-63.1	-42.7	0	0	0	110.5	G559 L560	D557-G559 PolarHBondContact O-N 2.99Å; D557-L560 HydrophobicContact CB-CD1 4.09Å; D557-L560 HydrophobicContact CB-CG 4.16Å
558	T	78.2	Confident	77.8	Confident	6 Å²	6	67.5 Å²	67.5	4%	0.037	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-12.7	177.5	55.1	0	0	0	0	113.5	S563 A567 G568 F570	T558-S563 WeakPolarHBondContact O-CB 3.41Å; T558-S563 PolarHBondContact O-OG 3.04Å; T558-A567 WeakPolarHBondContact CG2-O 3.43Å; T558-A567 PolarHBondContact OG1-N 3.03Å; T558-A567 PolarHBondContact OG1-O 3.47Å; T558-G568 WeakPolarHBondContact CB-O 3.3Å; T558-G568 VanDerWaalsContact CG2-C 3.49Å; T558-G568 WeakPolarHBondContact CG2-O 3.34Å; T558-G568 PolarHBondContact N-O 3.4Å; T558-G568 PolarHBondContact OG1-N 3.39Å; T558-G568 PolarHBondContact OG1-O 3.47Å; T558-F570 HydrophobicContact CG2-CD2 3.73Å; T558-F570 HydrophobicContact CG2-CE2 3.51Å; T558-F570 HydrophobicContact CG2-CZ 4.18Å
559	G	61.3	Low	77.8	Confident	65 Å²	65	61 Å²	61	67%	0.67	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-8.7	-177.7	0	0	0	0	0	115.6	D557	D557-G559 PolarHBondContact O-N 2.99Å
560	L	53.2	Low	77.8	Confident	142 Å²	142	60.5 Å²	60.5	74%	0.743	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-26.7	179.9	-69.9	174.3	0	0	0	113	D557	D557-L560 HydrophobicContact CB-CD1 4.09Å; D557-L560 HydrophobicContact CB-CG 4.16Å
561	D	48.1	Very low	78.1	Confident	92 Å²	92	53 Å²	53	49%	0.492	32%	0.322	S	S	.	.	S	Bend	trans	-97.9	152.6	168.3	-64.4	-32.4	0	0	0	107.4	S563	D561-S563 PolarHBondContact O-N 3.1Å
562	D	46.6	Very low	78.3	Confident	181 Å²	181	44.1 Å²	44.1	97%	0.968	28%	0.28	S	S	*	.			trans	-58.7	27.8	174.1	-75.5	-44.8	0	0	0	114.2	A564	D562-A564 PolarHBondContact O-N 3.46Å
563	S	52.5	Low	78.5	Confident	30 Å²	30	42.9 Å²	42.9	21%	0.21	27%	0.266	C	S	.	.			trans	-63.1	107.5	175.4	114.2	0	0	0	0	109	T558 D561 A565 G566	T558-S563 WeakPolarHBondContact O-CB 3.41Å; T558-S563 PolarHBondContact O-OG 3.04Å; D561-S563 PolarHBondContact O-N 3.1Å; S563-A565 PolarHBondContact O-N 2.87Å; S563-G566 PolarHBondContact O-N 3.35Å
564	A	54.5	Low	78.4	Confident	68 Å²	68	46.2 Å²	46.2	56%	0.562	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	0.8	174.4	0	0	0	0	0	113.9	V518 R525 D562	V518-A564 HydrophobicContact CG1-CB 3.8Å; V518-A564 HydrophobicContact CG2-CB 4.25Å; R525-A564 PolarHBondContact NH2-O 3.47Å; D562-A564 PolarHBondContact O-N 3.46Å
565	A	64.2	Low	78.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-45.1	170.9	0	0	0	0	0	110.1	A517 V518 A521 R525 S563 A567	A517-A565 HydrophobicContact CB-CB 4.13Å; V518-A565 HydrophobicContact CG2-CB 4.29Å; A521-A565 HydrophobicContact CB-CB 4.12Å; R525-A565 PolarHBondContact NH1-O 2.95Å; S563-A565 PolarHBondContact O-N 2.87Å; A565-A567 PolarHBondContact O-N 2.85Å
566	G	68.2	Low	78.2	Confident	57 Å²	57	51.5 Å²	51.5	59%	0.588	30%	0.303	S	S	*	.			trans	61.3	13.6	-179.4	0	0	0	0	0	114.7	S563	S563-G566 PolarHBondContact O-N 3.35Å
567	A	79	Confident	78.3	Confident	7 Å²	7	50.1 Å²	50.1	6%	0.058	30%	0.302	C	S	.	.	S	Bend	trans	-156.7	137.6	-172.3	0	0	0	0	0	112.1	P531 T558 A565 W580 W584	P531-A567 HydrophobicContact CB-CB 3.3Å; P531-A567 HydrophobicContact CG-CB 4.23Å; T558-A567 WeakPolarHBondContact CG2-O 3.43Å; T558-A567 PolarHBondContact OG1-N 3.03Å; T558-A567 PolarHBondContact OG1-O 3.47Å; A565-A567 PolarHBondContact O-N 2.85Å; A567-W580 PolarHBondContact O-NE1 3.49Å; A567-W584 HydrophobicContact CB-CH2 4.03Å; A567-W584 HydrophobicContact CB-CZ2 4.13Å
568	G	93.4	Very high	78.9	Confident	10 Å²	10	47 Å²	47	10%	0.103	29%	0.286	C	S	.	.			trans	91.3	-170.3	175.3	0	0	0	0	0	114.8	T558 A581	T558-G568 WeakPolarHBondContact CB-O 3.3Å; T558-G568 VanDerWaalsContact CG2-C 3.49Å; T558-G568 WeakPolarHBondContact CG2-O 3.34Å; T558-G568 PolarHBondContact N-O 3.4Å; T558-G568 PolarHBondContact OG1-N 3.39Å; T558-G568 PolarHBondContact OG1-O 3.47Å; G568-A581 CarbonylContact C-O 3.52Å; G568-A581 WeakPolarHBondContact CA-O 3.22Å
569	I	95.9	Very high	79.8	Confident	6 Å²	6	47 Å²	47	3%	0.031	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	152.7	-177.7	53	169.2	0	0	0	110	F269 A273 F534 V542 M555 R556 A581	F269-I569 HydrophobicContact CE2-CD1 3.81Å; F269-I569 HydrophobicContact CE2-CG1 4.3Å; F269-I569 HydrophobicContact CZ-CB 4.34Å; F269-I569 HydrophobicContact CZ-CD1 3.69Å; F269-I569 HydrophobicContact CZ-CG1 3.69Å; A273-I569 HydrophobicContact CB-CD1 4.16Å; F534-I569 HydrophobicContact CD2-CD1 4.22Å; F534-I569 HydrophobicContact CD2-CG1 3.93Å; F534-I569 HydrophobicContact CD2-CG2 4.21Å; F534-I569 HydrophobicContact CE2-CD1 4.29Å; F534-I569 HydrophobicContact CE2-CG1 3.78Å; V542-I569 HydrophobicContact CG1-CD1 4.29Å; V542-I569 HydrophobicContact CG2-CD1 4.12Å; M555-I569 HydrophobicContact CG-CB 4.29Å; M555-I569 HydrophobicContact CG-CD1 4.31Å; M555-I569 HydrophobicContact SD-CD1 3.86Å; M555-I569 HydrophobicContact SD-CG2 4.44Å; R556-I569 CarbonylContact O-C 3.49Å; R556-I569 WeakPolarHBondContact O-CA 3.41Å; I569-A581 HydrophobicContact CG1-CB 4.22Å; I569-A581 PolarHBondContact N-O 2.86Å; I569-A581 PolarHBondContact O-N 3.02Å
570	F	96.5	Very high	81.5	Confident	18 Å²	18	43.9 Å²	43.9	8%	0.079	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	140.2	175	-71.2	-70.2	0	0	0	111.5	F269 E438 A517 M555 R556 T558 P577 V579 W580	F269-F570 VanDerWaalsContact CZ-C 3.47Å; E438-F570 HydrophobicContact CB-CE1 4.34Å; E438-F570 HydrophobicContact CG-CE1 3.93Å; A517-F570 HydrophobicContact CB-CE1 3.76Å; A517-F570 HydrophobicContact CB-CZ 3.55Å; M555-F570 CarbonylContact C-O 3.57Å; M555-F570 VanDerWaalsContact CA-O 3.29Å; M555-F570 WeakPolarHBondContact CA-O 3.4Å; R556-F570 HydrophobicContact CB-CB 4.33Å; R556-F570 PolarHBondContact N-O 2.86Å; R556-F570 PolarHBondContact O-N 3.41Å; T558-F570 HydrophobicContact CG2-CD2 3.73Å; T558-F570 HydrophobicContact CG2-CE2 3.51Å; T558-F570 HydrophobicContact CG2-CZ 4.18Å; F570-P577 HydrophobicContact CB-CB 4.22Å; F570-P577 HydrophobicContact CD1-CB 3.88Å; F570-P577 HydrophobicContact CE1-CB 4.33Å; F570-P577 HydrophobicContact CG-CB 4.02Å; F570-V579 CarbonylContact C-O 3.54Å; F570-V579 WeakPolarHBondContact CA-O 3.4Å; F570-W580 HydrophobicContact CD1-CB 3.81Å; F570-W580 HydrophobicContact CD1-CG 4.34Å; F570-W580 HydrophobicContact CE1-CB 3.68Å; F570-W580 AromaticContact CE1-CD1 3.87Å; F570-W580 HydrophobicContact CE1-CG 4Å
571	L	97.8	Very high	83.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	122.1	155.2	-179.2	66.9	0	0	0	108	P265 F269 L546 W553 L578 V579	P265-L571 HydrophobicContact CB-CD1 4.44Å; P265-L571 HydrophobicContact CB-CD2 4.46Å; P265-L571 HydrophobicContact CG-CD1 4.17Å; P265-L571 HydrophobicContact CG-CD2 4.29Å; F269-L571 HydrophobicContact CB-CB 4.41Å; F269-L571 HydrophobicContact CB-CD1 4.38Å; F269-L571 HydrophobicContact CB-CD2 3.9Å; F269-L571 HydrophobicContact CB-CG 4.47Å; F269-L571 HydrophobicContact CD1-CB 3.67Å; F269-L571 HydrophobicContact CD1-CD2 4.44Å; F269-L571 HydrophobicContact CD2-CB 3.88Å; F269-L571 HydrophobicContact CD2-CD1 4.01Å; F269-L571 HydrophobicContact CD2-CG 4.42Å; F269-L571 HydrophobicContact CE1-CB 3.78Å; F269-L571 HydrophobicContact CE2-CB 3.97Å; F269-L571 HydrophobicContact CG-CB 3.73Å; F269-L571 HydrophobicContact CG-CD1 4.23Å; F269-L571 HydrophobicContact CG-CD2 4.14Å; F269-L571 HydrophobicContact CG-CG 4.25Å; F269-L571 HydrophobicContact CZ-CB 3.92Å; F269-L571 VanDerWaalsContact CZ-N 3.3Å; L546-L571 HydrophobicContact CD1-CD1 4.22Å; L546-L571 HydrophobicContact CD2-CD1 3.62Å; W553-L571 HydrophobicContact CD2-CD1 4.41Å; W553-L571 HydrophobicContact CE3-CD1 3.62Å; W553-L571 HydrophobicContact CE3-CD2 3.86Å; W553-L571 HydrophobicContact CE3-CG 3.63Å; W553-L571 HydrophobicContact CZ3-CD1 4.28Å; W553-L571 HydrophobicContact CZ3-CD2 3.68Å; W553-L571 HydrophobicContact CZ3-CG 3.78Å; L571-L578 PolarHBondContact O-N 2.81Å; L571-V579 HydrophobicContact CB-CB 4.05Å; L571-V579 HydrophobicContact CD2-CB 4.38Å; L571-V579 HydrophobicContact CD2-CG2 4.23Å; L571-V579 PolarHBondContact N-O 3.45Å; L571-V579 PolarHBondContact O-N 2.98Å
572	A	97	Very high	86	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	141.1	175.3	0	0	0	0	0	111.1	W553 S554 Q576	W553-A572 WeakPolarHBondContact CA-O 3.35Å; S554-A572 PolarHBondContact N-O 3.4Å; S554-A572 PolarHBondContact O-N 3.01Å; A572-Q576 CarbonylContact C-O 3.57Å; A572-Q576 WeakPolarHBondContact CA-O 3.36Å; A572-Q576 WeakPolarHBondContact CB-O 3.24Å
573	W	97	Very high	88.4	Confident	3 Å²	3	24.2 Å²	24.2	1%	0.011	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	121.8	168.5	176.4	-113.8	0	0	0	108.5	D475 E479 G552 W553 E575 Q576 L578	D475-W573 PolarHBondContact OD2-NE1 3.42Å; E479-W573 HydrophobicContact CB-CH2 3.99Å; E479-W573 HydrophobicContact CB-CZ2 3.84Å; E479-W573 HydrophobicContact CG-CZ2 4.19Å; E479-W573 WeakPolarHBondContact OE2-CH2 3.38Å; E479-W573 WeakPolarHBondContact OE2-CZ2 3.36Å; G552-W573 CarbonylContact O-C 3.13Å; G552-W573 WeakPolarHBondContact O-CA 3.48Å; W553-W573 AromaticContact CD1-CE3 3.86Å; W553-W573 AromaticContact CD1-CZ3 3.58Å; W553-W573 HydrophobicContact CD2-CD2 4.49Å; W553-W573 AromaticContact CD2-CE3 3.47Å; W553-W573 HydrophobicContact CD2-CE3 3.47Å; W553-W573 VanDerWaalsContact CD2-CE3 3.47Å; W553-W573 HydrophobicContact CD2-CZ3 4.02Å; W553-W573 AromaticContact CE2-CE3 3.25Å; W553-W573 AromaticContact CE2-CZ3 3.55Å; W553-W573 HydrophobicContact CE3-CB 4.08Å; W553-W573 AromaticContact CE3-CE3 3.97Å; W553-W573 HydrophobicContact CE3-CE3 3.97Å; W553-W573 AromaticContact CG-CE3 3.86Å; W553-W573 HydrophobicContact CG-CE3 3.86Å; W553-W573 HydrophobicContact CG-CZ3 4.03Å; W553-W573 HydrophobicContact CH2-CB 3.95Å; W553-W573 HydrophobicContact CH2-CD2 4.26Å; W553-W573 HydrophobicContact CH2-CE3 4.05Å; W553-W573 HydrophobicContact CH2-CG 4.26Å; W553-W573 HydrophobicContact CZ2-CD2 4.08Å; W553-W573 AromaticContact CZ2-CE3 3.57Å; W553-W573 HydrophobicContact CZ2-CE3 3.57Å; W553-W573 HydrophobicContact CZ2-CZ3 4.08Å; W553-W573 HydrophobicContact CZ3-CB 3.66Å; W553-W573 HydrophobicContact CZ3-CE3 4.25Å; W553-W573 HydrophobicContact CZ3-CG 4.4Å; W553-W573 AromaticContact NE1-CE3 3.51Å; W553-W573 AromaticContact NE1-CZ3 3.26Å; W553-W573 VanDerWaalsContact NE1-CZ3 3.26Å; W573-E575 PolarHBondContact O-N 3.42Å; W573-Q576 PolarHBondContact N-O 3.06Å; W573-Q576 WeakPolarHBondContact O-CB 3.37Å; W573-Q576 PolarHBondContact O-N 2.92Å; W573-L578 HydrophobicContact CB-CD1 3.51Å; W573-L578 HydrophobicContact CB-CG 4.49Å; W573-L578 HydrophobicContact CG-CD1 4.37Å
574	K	95.1	Very high	90.5	Very high	94 Å²	94	22.8 Å²	22.8	41%	0.409	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.5	52.9	-175.4	-62.9	175.5	179.2	167.6	0	111.2	D475 E479 G552 Q576	D475-K574 IonicContact OD1-NZ 3.75Å; D475-K574 PolarHBondContact OD1-NZ 2.67Å; D475-K574 WeakPolarHBondContact OD2-CE 3.16Å; D475-K574 IonicContact OD2-NZ 3.4Å; D475-K574 PolarHBondContact OD2-NZ 3.37Å; E479-K574 WeakPolarHBondContact OE1-CE 3.32Å; E479-K574 IonicContact OE1-NZ 2.76Å; E479-K574 PolarHBondContact OE1-NZ 3.38Å; E479-K574 IonicContact OE2-NZ 2.65Å; G552-K574 PolarHBondContact O-N 3.4Å; K574-Q576 PolarHBondContact O-N 2.86Å; K574-Q576 VanDerWaalsContact O-N 3.14Å
575	E	92.4	Very high	92.5	Very high	112 Å²	112	26.8 Å²	26.8	52%	0.523	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	3.4	179.3	-57	-48.4	110.8	0	0	115.9	S554 R556 W573	S554-E575 PolarHBondContact OG-OE1 3.39Å; R556-E575 IonicContact CZ-OE2 2.77Å; R556-E575 IonicContact NE-OE2 2.9Å; R556-E575 PolarHBondContact NH1-O 3.16Å; R556-E575 PolarHBondContact NH2-O 3.48Å; R556-E575 IonicContact NH2-OE2 3.35Å; R556-E575 PolarHBondContact NH2-OE2 3.33Å; W573-E575 PolarHBondContact O-N 3.42Å
576	Q	94.2	Very high	94	Very high	62 Å²	62	29.2 Å²	29.2	29%	0.29	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	117.3	176.2	-176.3	167.9	26.4	0	0	111.3	A472 A572 W573 K574 L578	A472-Q576 VanDerWaalsContact CB-OE1 3.26Å; A572-Q576 CarbonylContact C-O 3.57Å; A572-Q576 WeakPolarHBondContact CA-O 3.36Å; A572-Q576 WeakPolarHBondContact CB-O 3.24Å; W573-Q576 PolarHBondContact N-O 3.06Å; W573-Q576 WeakPolarHBondContact O-CB 3.37Å; W573-Q576 PolarHBondContact O-N 2.92Å; K574-Q576 PolarHBondContact O-N 2.86Å; K574-Q576 VanDerWaalsContact O-N 3.14Å; Q576-L578 HydrophobicContact CG-CD2 4.23Å; Q576-L578 PolarHBondContact O-N 2.99Å
577	P	95.1	Very high	95.3	Very high	35 Å²	35	27.9 Å²	27.9	23%	0.227	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	131.9	173.4	-23.9	35	0	0	0	112.1	E438 F570	E438-P577 HydrophobicContact CG-CB 4.28Å; F570-P577 HydrophobicContact CB-CB 4.22Å; F570-P577 HydrophobicContact CD1-CB 3.88Å; F570-P577 HydrophobicContact CE1-CB 4.33Å; F570-P577 HydrophobicContact CG-CB 4.02Å
578	L	96.6	Very high	96.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	-29.7	-177.9	-66	177.4	0	0	0	114	W266 E437 E438 F469 A472 L571 W573 Q576	W266-L578 HydrophobicContact CH2-CB 3.71Å; W266-L578 HydrophobicContact CH2-CD1 3.63Å; W266-L578 HydrophobicContact CH2-CD2 4.4Å; W266-L578 HydrophobicContact CH2-CG 4.11Å; W266-L578 HydrophobicContact CZ2-CB 4.3Å; W266-L578 HydrophobicContact CZ3-CB 4.16Å; W266-L578 HydrophobicContact CZ3-CD1 3.52Å; W266-L578 HydrophobicContact CZ3-CG 4.41Å; E437-L578 CarbonylContact C-O 3.6Å; E437-L578 WeakPolarHBondContact CA-O 3.31Å; E438-L578 PolarHBondContact N-O 3.41Å; F469-L578 HydrophobicContact CD2-CD2 4.17Å; F469-L578 HydrophobicContact CE2-CD2 4.32Å; A472-L578 HydrophobicContact CB-CD1 4Å; A472-L578 HydrophobicContact CB-CD2 3.73Å; A472-L578 HydrophobicContact CB-CG 4.49Å; L571-L578 PolarHBondContact O-N 2.81Å; W573-L578 HydrophobicContact CB-CD1 3.51Å; W573-L578 HydrophobicContact CB-CG 4.49Å; W573-L578 HydrophobicContact CG-CD1 4.37Å; Q576-L578 HydrophobicContact CG-CD2 4.23Å; Q576-L578 PolarHBondContact O-N 2.99Å
579	V	97.5	Very high	96.3	Very high	4 Å²	4	30 Å²	30	2%	0.024	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	132.3	175.6	-174.4	0	0	0	0	108.6	W266 F269 V435 E436 F570 L571	W266-V579 HydrophobicContact CD2-CG2 4.2Å; W266-V579 HydrophobicContact CG-CG2 4.32Å; W266-V579 HydrophobicContact CZ2-CG2 4.21Å; F269-V579 HydrophobicContact CD1-CB 4.37Å; F269-V579 HydrophobicContact CD1-CG1 4.09Å; F269-V579 HydrophobicContact CE1-CG1 4.4Å; V435-V579 HydrophobicContact CG1-CG1 3.76Å; E436-V579 WeakPolarHBondContact O-CA 3.21Å; F570-V579 CarbonylContact C-O 3.54Å; F570-V579 WeakPolarHBondContact CA-O 3.4Å; L571-V579 HydrophobicContact CB-CB 4.05Å; L571-V579 HydrophobicContact CD2-CB 4.38Å; L571-V579 HydrophobicContact CD2-CG2 4.23Å; L571-V579 PolarHBondContact N-O 3.45Å; L571-V579 PolarHBondContact O-N 2.98Å
580	W	97	Very high	96.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	134	174.8	173.1	61.3	0	0	0	109.3	V434 V435 E436 A517 W520 A521 A567 F570 S582 W584	V434-W580 HydrophobicContact CB-CZ3 4.42Å; V434-W580 HydrophobicContact CG1-CE3 4.45Å; V434-W580 HydrophobicContact CG1-CZ3 3.81Å; V435-W580 CarbonylContact C-O 3.38Å; V435-W580 VanDerWaalsContact CA-O 3.23Å; V435-W580 WeakPolarHBondContact CA-O 3.46Å; E436-W580 HydrophobicContact CB-CE3 4.44Å; E436-W580 PolarHBondContact N-O 2.62Å; E436-W580 PolarHBondContact O-N 3.37Å; A517-W580 HydrophobicContact CB-CB 4.15Å; A517-W580 HydrophobicContact CB-CD2 3.52Å; A517-W580 HydrophobicContact CB-CE3 4.13Å; A517-W580 HydrophobicContact CB-CG 3.53Å; A517-W580 HydrophobicContact CB-CZ2 4.27Å; W520-W580 HydrophobicContact CB-CE3 4.28Å; W520-W580 HydrophobicContact CB-CH2 3.68Å; W520-W580 HydrophobicContact CB-CZ3 3.32Å; W520-W580 AromaticContact CG-CZ3 3.92Å; W520-W580 HydrophobicContact CG-CZ3 3.92Å; A521-W580 HydrophobicContact CB-CZ2 4.48Å; A567-W580 PolarHBondContact O-NE1 3.49Å; F570-W580 HydrophobicContact CD1-CB 3.81Å; F570-W580 HydrophobicContact CD1-CG 4.34Å; F570-W580 HydrophobicContact CE1-CB 3.68Å; F570-W580 AromaticContact CE1-CD1 3.87Å; F570-W580 HydrophobicContact CE1-CG 4Å; W580-S582 WeakPolarHBondContact CH2-OG 3.44Å; W580-S582 WeakPolarHBondContact CZ2-OG 3.34Å; W580-W584 AromaticContact CH2-CZ2 3.95Å; W580-W584 HydrophobicContact CH2-CZ2 3.95Å; W580-W584 AromaticContact CZ2-CZ2 3.99Å; W580-W584 HydrophobicContact CZ2-CZ2 3.99Å
581	A	97.8	Very high	96.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	137.4	171.4	0	0	0	0	0	109.6	F269 A273 V434 V435 F534 G568 I569	F269-A581 HydrophobicContact CD1-CB 4.4Å; F269-A581 HydrophobicContact CE1-CB 3.7Å; F269-A581 HydrophobicContact CZ-CB 4.29Å; A273-A581 HydrophobicContact CB-CB 3.89Å; V434-A581 CarbonylContact O-C 3.5Å; V434-A581 WeakPolarHBondContact O-CA 3.44Å; V435-A581 HydrophobicContact CG2-CB 4.07Å; F534-A581 WeakPolarHBondContact CE2-O 3.42Å; F534-A581 HydrophobicContact CZ-CB 4.43Å; G568-A581 CarbonylContact C-O 3.52Å; G568-A581 WeakPolarHBondContact CA-O 3.22Å; I569-A581 HydrophobicContact CG1-CB 4.22Å; I569-A581 PolarHBondContact N-O 2.86Å; I569-A581 PolarHBondContact O-N 3.02Å
582	S	97	Very high	96.2	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.014	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	158.4	178.6	59.4	0	0	0	0	111.9	T433 V434 W580 W584	T433-S582 WeakPolarHBondContact CA-O 3.19Å; V434-S582 PolarHBondContact N-O 2.76Å; V434-S582 PolarHBondContact O-N 3.33Å; V434-S582 PolarHBondContact O-OG 3.35Å; W580-S582 WeakPolarHBondContact CH2-OG 3.44Å; W580-S582 WeakPolarHBondContact CZ2-OG 3.34Å; S582-W584 PolarHBondContact OG-NE1 3.38Å
583	A	97.5	Very high	96.2	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.008	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	147.9	173.7	0	0	0	0	0	110.2	A277 V431 V432 V532 F534	A277-A583 HydrophobicContact CB-CB 3.84Å; V431-A583 HydrophobicContact CG2-CB 4.44Å; V432-A583 CarbonylContact O-C 3.54Å; V432-A583 WeakPolarHBondContact O-CA 3.5Å; V532-A583 HydrophobicContact CB-CB 4.03Å; V532-A583 PolarHBondContact N-O 3.19Å; F534-A583 HydrophobicContact CE1-CB 4.07Å; F534-A583 HydrophobicContact CZ-CB 4.33Å
584	W	97.5	Very high	96.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	152.3	-172.9	-56.8	84.5	0	0	0	110.6	V431 V432 A521 M524 R525 F529 S530 P531 A567 W580 S582	V431-W584 CarbonylContact C-O 3.54Å; V431-W584 WeakPolarHBondContact CA-O 3.42Å; V432-W584 HydrophobicContact CB-CB 4.3Å; V432-W584 PolarHBondContact N-O 3.36Å; V432-W584 PolarHBondContact O-N 3.15Å; A521-W584 HydrophobicContact CB-CH2 3.69Å; A521-W584 HydrophobicContact CB-CZ2 3.99Å; M524-W584 HydrophobicContact CB-CD2 3.71Å; M524-W584 HydrophobicContact CB-CE3 3.59Å; M524-W584 HydrophobicContact CB-CG 4.45Å; M524-W584 HydrophobicContact CB-CH2 3.93Å; M524-W584 HydrophobicContact CB-CZ2 4.01Å; M524-W584 HydrophobicContact CB-CZ3 3.69Å; M524-W584 HydrophobicContact CE-CB 3.75Å; M524-W584 HydrophobicContact CE-CD2 4.05Å; M524-W584 HydrophobicContact CE-CG 3.54Å; M524-W584 HydrophobicContact CG-CD2 3.94Å; M524-W584 HydrophobicContact CG-CE3 4.34Å; M524-W584 HydrophobicContact CG-CG 4.36Å; M524-W584 HydrophobicContact CG-CZ2 4.13Å; R525-W584 HydrophobicContact CG-CZ3 4.12Å; F529-W584 HydrophobicContact CB-CB 4.14Å; F529-W584 HydrophobicContact CB-CE3 4.15Å; F529-W584 HydrophobicContact CD1-CB 4.4Å; F529-W584 HydrophobicContact CG-CB 4.48Å; S530-W584 CarbonylContact O-C 3.56Å; S530-W584 WeakPolarHBondContact O-CA 3.29Å; P531-W584 HydrophobicContact CB-CE3 4.06Å; P531-W584 HydrophobicContact CB-CH2 4.13Å; P531-W584 HydrophobicContact CB-CZ3 3.77Å; P531-W584 HydrophobicContact CG-CZ3 4.29Å; A567-W584 HydrophobicContact CB-CH2 4.03Å; A567-W584 HydrophobicContact CB-CZ2 4.13Å; W580-W584 AromaticContact CH2-CZ2 3.95Å; W580-W584 HydrophobicContact CH2-CZ2 3.95Å; W580-W584 AromaticContact CZ2-CZ2 3.99Å; W580-W584 HydrophobicContact CZ2-CZ2 3.99Å; S582-W584 PolarHBondContact OG-NE1 3.38Å
585	R	96.4	Very high	96.2	Very high	151 Å²	151	34.9 Å²	34.9	57%	0.57	17%	0.166	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-133.8	155.6	172.4	67.8	-178.3	-179.6	-169.8	-1.2	111.1	F529 S530 V532	F529-R585 CarbonylContact C-O 3.57Å; F529-R585 VanDerWaalsContact CA-O 3.27Å; F529-R585 WeakPolarHBondContact CA-O 3.42Å; S530-R585 PolarHBondContact N-O 2.98Å; S530-R585 PolarHBondContact O-N 2.84Å; V532-R585 HydrophobicContact CG2-CB 3.95Å; V532-R585 HydrophobicContact CG2-CG 3.77Å
586	P	95.2	Very high	96.5	Very high	52 Å²	52	27.9 Å²	27.9	34%	0.338	13%	0.134	S	C	.	.			trans	-53.5	0	179.4	-31.7	38.8	0	0	0	117.4	R425 P429 G528 F529	R425-P586 VanDerWaalsContact CZ-CB 3.44Å; R425-P586 PolarHBondContact NE-OXT 2.9Å; R425-P586 VanDerWaalsContact NE-OXT 3.1Å; R425-P586 PolarHBondContact NH2-OXT 2.92Å; P429-P586 HydrophobicContact CG-CG 4.39Å; P429-P586 WeakPolarHBondContact O-CD 3.43Å; P429-P586 WeakPolarHBondContact O-CG 3.21Å; G528-P586 CarbonylContact O-C 3.07Å; F529-P586 HydrophobicContact CE1-CG 4.43Å

Retrieved 586 of 586 residues in 432.5 ms (Link to these results)

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