A0A087YJC2_POEFO Loading...

PiggyBac transposable element derived 5

AlphaFold DB , UniProt , Accession A0A087YJC2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 542 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.4	Very low	33.2	Very low	228 Å²	228	114.5 Å²	114.5	100%	1.123	63%	0.63	S	S	*	*				0	-30.2	0	-78.6	-160.4	-88.6	0	0	114.4	E3	M1-E3 VanDerWaalsContact C-N 3.26Å; M1-E3 PolarHBondContact O-N 3.08Å
2	A	33.4	Very low	33.4	Very low	74 Å²	74	112.8 Å²	112.8	61%	0.612	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	2.9	178.2	0	0	0	0	0	116	R6	A2-R6 PolarHBondContact O-NE 2.87Å
3	E	27.7	Very low	33.5	Very low	150 Å²	150	113.4 Å²	113.4	70%	0.701	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	-23.8	-176.5	-147.1	171.8	-173.1	0	0	112.4	M1	M1-E3 VanDerWaalsContact C-N 3.26Å; M1-E3 PolarHBondContact O-N 3.08Å
4	C	31.9	Very low	33.8	Very low	102 Å²	102	107.6 Å²	107.6	69%	0.689	59%	0.589	S	S	*	*	H	α-helix	trans	-77.2	-35.5	174.8	-156.5	0	0	0	0	111.7	R6 K7 A8	C4-R6 VanDerWaalsContact C-N 3.32Å; C4-R6 PolarHBondContact O-N 3.11Å; C4-K7 PolarHBondContact O-N 2.82Å; C4-A8 PolarHBondContact O-N 3.28Å
5	G	30.5	Very low	33.8	Very low	41 Å²	41	102.7 Å²	102.7	42%	0.423	57%	0.568	S	S	.	*	H	α-helix	trans	-66.3	-30.1	173.4	0	0	0	0	0	113.8	L9	G5-L9 PolarHBondContact O-N 2.82Å
6	R	29.8	Very low	33.9	Very low	175 Å²	175	105.1 Å²	105.1	66%	0.66	57%	0.566	S	S	*	*	H	α-helix	trans	-72.6	-31.1	175.6	-82.4	-174.6	-95.9	-178.3	-7	113.1	A2 C4 S10	A2-R6 PolarHBondContact O-NE 2.87Å; C4-R6 VanDerWaalsContact C-N 3.32Å; C4-R6 PolarHBondContact O-N 3.11Å; R6-S10 PolarHBondContact O-N 2.76Å
7	K	34.3	Very low	33.9	Very low	155 Å²	155	102.6 Å²	102.6	67%	0.674	56%	0.559	S	S	*	*	H	α-helix	trans	-75.1	-34.6	174.6	-79.3	-179.9	175.9	176.1	0	113.1	C4 S10 L11	C4-K7 PolarHBondContact O-N 2.82Å; K7-S10 PolarHBondContact O-N 2.65Å; K7-S10 PolarHBondContact O-OG 3.3Å; K7-L11 PolarHBondContact O-N 2.76Å
8	A	35.9	Very low	34.2	Very low	61 Å²	61	104.6 Å²	104.6	50%	0.504	56%	0.557	S	S	.	*	H	α-helix	trans	-69.8	-39.7	176.3	0	0	0	0	0	112.7	C4 S10 L11 L12	C4-A8 PolarHBondContact O-N 3.28Å; A8-S10 VanDerWaalsContact C-N 3.31Å; A8-S10 PolarHBondContact O-N 3.15Å; A8-L11 PolarHBondContact O-N 3.18Å; A8-L12 PolarHBondContact O-N 3.33Å; A8-L12 VanDerWaalsContact O-N 3.17Å
9	L	30.9	Very low	34.2	Very low	100 Å²	100	105.1 Å²	105.1	52%	0.524	55%	0.551	S	S	.	*	H	α-helix	trans	-60.9	-39.1	169.2	-88.6	155.4	0	0	0	111.5	G5 L11 L12 E13	G5-L9 PolarHBondContact O-N 2.82Å; L9-L11 VanDerWaalsContact C-N 3.32Å; L9-L11 PolarHBondContact O-N 3.25Å; L9-L12 PolarHBondContact O-N 2.67Å; L9-E13 VanDerWaalsContact O-CB 3.22Å; L9-E13 WeakPolarHBondContact O-CB 3.15Å; L9-E13 WeakPolarHBondContact O-CG 3.27Å; L9-E13 PolarHBondContact O-N 2.74Å
10	S	37.6	Very low	34.1	Very low	60 Å²	60	107.3 Å²	107.3	42%	0.42	56%	0.558	S	S	.	*	H	α-helix	trans	-67.6	-25.2	176.6	86.8	0	0	0	0	114.5	R6 K7 A8 A14	R6-S10 PolarHBondContact O-N 2.76Å; K7-S10 PolarHBondContact O-N 2.65Å; K7-S10 PolarHBondContact O-OG 3.3Å; A8-S10 VanDerWaalsContact C-N 3.31Å; A8-S10 PolarHBondContact O-N 3.15Å; S10-A14 WeakPolarHBondContact O-CA 3.32Å; S10-A14 WeakPolarHBondContact O-CB 2.81Å; S10-A14 PolarHBondContact O-N 2.7Å
11	L	35.9	Very low	34	Very low	114 Å²	114	106 Å²	106	60%	0.597	56%	0.559	S	S	*	*	H	α-helix	trans	-81.3	-34.3	175.7	-86.7	164.5	0	0	0	112.1	K7 A8 L9 A14 A15	K7-L11 PolarHBondContact O-N 2.76Å; A8-L11 PolarHBondContact O-N 3.18Å; L9-L11 VanDerWaalsContact C-N 3.32Å; L9-L11 PolarHBondContact O-N 3.25Å; L11-A14 CarbonylContact O-C 3.42Å; L11-A15 VanDerWaalsContact O-CB 3.25Å; L11-A15 WeakPolarHBondContact O-CB 3.44Å; L11-A15 PolarHBondContact O-N 3.11Å
12	L	35.5	Very low	33.8	Very low	93 Å²	93	97 Å²	97	49%	0.487	52%	0.515	S	S	.	.	H	α-helix	trans	-77.3	-37.5	174.5	-159	87	0	0	0	111.4	A8 L9 A15 R16	A8-L12 PolarHBondContact O-N 3.33Å; A8-L12 VanDerWaalsContact O-N 3.17Å; L9-L12 PolarHBondContact O-N 2.67Å; L12-A15 PolarHBondContact O-N 2.96Å; L12-R16 VanDerWaalsContact O-CB 3.28Å; L12-R16 WeakPolarHBondContact O-CB 3.4Å; L12-R16 PolarHBondContact O-N 3.14Å
13	E	35.2	Very low	33.8	Very low	121 Å²	121	100 Å²	100	57%	0.565	52%	0.516	S	S	*	.	H	α-helix	trans	-69.9	-32.9	167.5	-74.7	172	158.2	0	0	110.8	L9 A15 S17	L9-E13 VanDerWaalsContact O-CB 3.22Å; L9-E13 WeakPolarHBondContact O-CB 3.15Å; L9-E13 WeakPolarHBondContact O-CG 3.27Å; L9-E13 PolarHBondContact O-N 2.74Å; E13-A15 VanDerWaalsContact C-N 3.34Å; E13-S17 VanDerWaalsContact O-CA 3.23Å; E13-S17 WeakPolarHBondContact O-CA 3.13Å; E13-S17 WeakPolarHBondContact O-CB 3.27Å; E13-S17 PolarHBondContact O-N 2.8Å
14	A	36.8	Very low	34.1	Very low	33 Å²	33	96 Å²	96	27%	0.273	50%	0.499	S	S	.	.	H	α-helix	trans	-75.5	-21.2	169.3	0	0	0	0	0	112.5	S10 L11 R18	S10-A14 WeakPolarHBondContact O-CA 3.32Å; S10-A14 WeakPolarHBondContact O-CB 2.81Å; S10-A14 PolarHBondContact O-N 2.7Å; L11-A14 CarbonylContact O-C 3.42Å; A14-R18 WeakPolarHBondContact O-CA 3.2Å; A14-R18 WeakPolarHBondContact O-CB 3.1Å; A14-R18 WeakPolarHBondContact O-CD 3.31Å; A14-R18 WeakPolarHBondContact O-CG 2.96Å; A14-R18 PolarHBondContact O-N 3.38Å; A14-R18 PolarHBondContact O-NE 2.67Å
15	A	34.2	Very low	34.2	Very low	33 Å²	33	92 Å²	92	27%	0.273	47%	0.472	S	S	.	.	H	α-helix	trans	-82	-48.5	172.7	0	0	0	0	0	110.2	L11 L12 E13 R18 Y19	L11-A15 VanDerWaalsContact O-CB 3.25Å; L11-A15 WeakPolarHBondContact O-CB 3.44Å; L11-A15 PolarHBondContact O-N 3.11Å; L12-A15 PolarHBondContact O-N 2.96Å; E13-A15 VanDerWaalsContact C-N 3.34Å; A15-R18 CarbonylContact O-C 3.5Å; A15-R18 WeakPolarHBondContact O-CA 3.19Å; A15-R18 PolarHBondContact O-N 2.67Å; A15-R18 VanDerWaalsContact O-N 3.13Å; A15-Y19 WeakPolarHBondContact O-CB 3.33Å; A15-Y19 WeakPolarHBondContact O-CD2 3.34Å; A15-Y19 PolarHBondContact O-N 2.77Å
16	R	34.7	Very low	34.3	Very low	141 Å²	141	94.8 Å²	94.8	53%	0.532	48%	0.477	S	S	.	.	H	α-helix	trans	-60.1	-48.1	169.9	-87.7	-175.2	167.4	166.4	-2.9	111.6	L12 R18 Y19 E20	L12-R16 VanDerWaalsContact O-CB 3.28Å; L12-R16 WeakPolarHBondContact O-CB 3.4Å; L12-R16 PolarHBondContact O-N 3.14Å; R16-R18 VanDerWaalsContact C-N 3.35Å; R16-R18 PolarHBondContact O-N 3.32Å; R16-Y19 CarbonylContact O-C 3.6Å; R16-Y19 WeakPolarHBondContact O-CA 3.35Å; R16-Y19 PolarHBondContact O-N 3.38Å; R16-E20 WeakPolarHBondContact O-CA 3.33Å; R16-E20 WeakPolarHBondContact O-CB 2.95Å; R16-E20 WeakPolarHBondContact O-CG 3.19Å; R16-E20 PolarHBondContact O-N 3.41Å
17	S	34.9	Very low	34.6	Very low	63 Å²	63	91.1 Å²	91.1	44%	0.441	47%	0.471	S	S	.	.	H	α-helix	trans	-65.1	-35.1	170.4	-174.5	0	0	0	0	110.8	E13 Y19 S21	E13-S17 VanDerWaalsContact O-CA 3.23Å; E13-S17 WeakPolarHBondContact O-CA 3.13Å; E13-S17 WeakPolarHBondContact O-CB 3.27Å; E13-S17 PolarHBondContact O-N 2.8Å; S17-Y19 VanDerWaalsContact C-N 3.27Å; S17-Y19 PolarHBondContact O-N 3.47Å; S17-S21 WeakPolarHBondContact O-CA 3.39Å; S17-S21 WeakPolarHBondContact O-CB 3.44Å; S17-S21 PolarHBondContact O-N 3.06Å; S17-S21 PolarHBondContact O-OG 3.46Å
18	R	39.3	Very low	34.8	Very low	139 Å²	139	85.4 Å²	85.4	53%	0.525	45%	0.449	S	S	.	.	H	α-helix	trans	-65.9	-27.1	168.1	-84.6	174.5	-82.5	-148.7	-1.7	112.7	A14 A15 R16 L22	A14-R18 WeakPolarHBondContact O-CA 3.2Å; A14-R18 WeakPolarHBondContact O-CB 3.1Å; A14-R18 WeakPolarHBondContact O-CD 3.31Å; A14-R18 WeakPolarHBondContact O-CG 2.96Å; A14-R18 PolarHBondContact O-N 3.38Å; A14-R18 PolarHBondContact O-NE 2.67Å; A15-R18 CarbonylContact O-C 3.5Å; A15-R18 WeakPolarHBondContact O-CA 3.19Å; A15-R18 PolarHBondContact O-N 2.67Å; A15-R18 VanDerWaalsContact O-N 3.13Å; R16-R18 VanDerWaalsContact C-N 3.35Å; R16-R18 PolarHBondContact O-N 3.32Å; R18-L22 WeakPolarHBondContact O-CA 2.96Å; R18-L22 WeakPolarHBondContact O-CB 3.46Å; R18-L22 WeakPolarHBondContact O-CD1 3.41Å; R18-L22 WeakPolarHBondContact O-CG 3.38Å; R18-L22 PolarHBondContact O-N 3.13Å
19	Y	33.2	Very low	34.7	Very low	114 Å²	114	84.5 Å²	84.5	45%	0.447	43%	0.434	S	S	.	.	H	α-helix	trans	-91.3	-21.2	178.4	-81.9	-70.8	0	0	0	113.9	A15 R16 S17 L22	A15-Y19 WeakPolarHBondContact O-CB 3.33Å; A15-Y19 WeakPolarHBondContact O-CD2 3.34Å; A15-Y19 PolarHBondContact O-N 2.77Å; R16-Y19 CarbonylContact O-C 3.6Å; R16-Y19 WeakPolarHBondContact O-CA 3.35Å; R16-Y19 PolarHBondContact O-N 3.38Å; S17-Y19 VanDerWaalsContact C-N 3.27Å; S17-Y19 PolarHBondContact O-N 3.47Å; Y19-L22 HydrophobicContact CD1-CD1 3.77Å; Y19-L22 HydrophobicContact CE1-CD1 4.12Å; Y19-L22 HydrophobicContact CG-CD1 4.39Å; Y19-L22 CarbonylContact O-C 3.58Å
20	E	32.1	Very low	34.7	Very low	148 Å²	148	81.8 Å²	81.8	69%	0.692	43%	0.429	S	S	*	.	H	α-helix	trans	-95.8	-33.4	175	-72.5	172.8	166.3	0	0	110.3	R16 L22 Q23	R16-E20 WeakPolarHBondContact O-CA 3.33Å; R16-E20 WeakPolarHBondContact O-CB 2.95Å; R16-E20 WeakPolarHBondContact O-CG 3.19Å; R16-E20 PolarHBondContact O-N 3.41Å; E20-L22 CarbonylContact O-C 3.49Å; E20-Q23 PolarHBondContact O-N 2.94Å
21	S	33.1	Very low	34.3	Very low	82 Å²	82	88 Å²	88	57%	0.573	45%	0.452	S	S	*	.	S	Bend	trans	-84	-14.5	164.8	95.6	0	0	0	0	112.9	S17 Q23	S17-S21 WeakPolarHBondContact O-CA 3.39Å; S17-S21 WeakPolarHBondContact O-CB 3.44Å; S17-S21 PolarHBondContact O-N 3.06Å; S17-S21 PolarHBondContact O-OG 3.46Å; S21-Q23 PolarHBondContact O-N 3.24Å
22	L	32	Very low	34.2	Very low	38 Å²	38	86.1 Å²	86.1	20%	0.199	45%	0.448	C	S	.	.			trans	-71.9	68.7	135.8	-71.9	160.9	0	0	0	104.5	R18 Y19 E20 I24	R18-L22 WeakPolarHBondContact O-CA 2.96Å; R18-L22 WeakPolarHBondContact O-CB 3.46Å; R18-L22 WeakPolarHBondContact O-CD1 3.41Å; R18-L22 WeakPolarHBondContact O-CG 3.38Å; R18-L22 PolarHBondContact O-N 3.13Å; Y19-L22 HydrophobicContact CD1-CD1 3.77Å; Y19-L22 HydrophobicContact CE1-CD1 4.12Å; Y19-L22 HydrophobicContact CG-CD1 4.39Å; Y19-L22 CarbonylContact O-C 3.58Å; E20-L22 CarbonylContact O-C 3.49Å; L22-I24 HydrophobicContact CB-CG1 3.91Å; L22-I24 HydrophobicContact CD2-CG1 4.4Å; L22-I24 PolarHBondContact O-N 2.5Å
23	Q	35.3	Very low	34	Very low	137 Å²	137	85.1 Å²	85.1	64%	0.64	46%	0.46	S	S	*	.				-23.2	73.2	97.9	-71.2	-167.5	-12.8	0	0	111.2	E20 S21 S25	E20-Q23 PolarHBondContact O-N 2.94Å; S21-Q23 PolarHBondContact O-N 3.24Å; Q23-S25 WeakPolarHBondContact O-CA 3.45Å; Q23-S25 PolarHBondContact O-N 3.22Å
24	I	33.9	Very low	33.8	Very low	66 Å²	66	87.4 Å²	87.4	34%	0.338	48%	0.476	S	S	.	.			trans	-62.8	71.6	146.9	-55.7	-177.8	0	0	0	102.8	L22 D26 F29 Y468	L22-I24 HydrophobicContact CB-CG1 3.91Å; L22-I24 HydrophobicContact CD2-CG1 4.4Å; L22-I24 PolarHBondContact O-N 2.5Å; I24-D26 PolarHBondContact O-N 3.39Å; I24-F29 HydrophobicContact CG2-CD2 3.86Å; I24-F29 HydrophobicContact CG2-CE2 3.76Å; I24-Y468 HydrophobicContact CD1-CD2 4.11Å; I24-Y468 HydrophobicContact CG2-CD2 4Å; I24-Y468 HydrophobicContact CG2-CE2 3.54Å
25	S	33	Very low	33.8	Very low	18 Å²	18	93 Å²	93	13%	0.126	50%	0.502	C	S	.	.			trans	-52.4	142.3	-136.4	52.5	0	0	0	0	111.4	Q23 D27 V28 F29	Q23-S25 WeakPolarHBondContact O-CA 3.45Å; Q23-S25 PolarHBondContact O-N 3.22Å; S25-D27 PolarHBondContact O-N 3.48Å; S25-D27 WeakPolarHBondContact OG-CB 3.39Å; S25-V28 CarbonylContact O-C 3.55Å; S25-V28 WeakPolarHBondContact O-CA 3.19Å; S25-V28 WeakPolarHBondContact O-CB 3.24Å; S25-V28 PolarHBondContact O-N 2.97Å; S25-V28 VanDerWaalsContact OG-CB 3.28Å; S25-V28 WeakPolarHBondContact OG-CB 3.19Å; S25-V28 WeakPolarHBondContact OG-CG2 3.49Å; S25-V28 PolarHBondContact OG-N 2.88Å; S25-F29 PolarHBondContact O-N 3.44Å
26	D	32.5	Very low	34	Very low	100 Å²	100	95 Å²	95	54%	0.535	51%	0.514	S	S	.	.	H	α-helix	trans	-51.9	-19.4	158.9	-66.6	-48.7	0	0	0	110.2	I24 G30	I24-D26 PolarHBondContact O-N 3.39Å; D26-G30 WeakPolarHBondContact O-CA 3.35Å; D26-G30 PolarHBondContact O-N 3.28Å
27	D	36.3	Very low	34.2	Very low	97 Å²	97	91.2 Å²	91.2	52%	0.519	51%	0.509	S	S	.	.	H	α-helix	trans	-73	-27.6	167.1	-62.2	-27.9	0	0	0	114.6	S25 Y514	S25-D27 PolarHBondContact O-N 3.48Å; S25-D27 WeakPolarHBondContact OG-CB 3.39Å; D27-Y514 PolarHBondContact O-OH 3.01Å
28	V	37.9	Very low	34.6	Very low	35 Å²	35	91.4 Å²	91.4	21%	0.212	51%	0.505	C	S	.	.	H	α-helix	trans	-82.8	-35.7	175.3	163.2	0	0	0	0	110.5	S25 K475 K509	S25-V28 CarbonylContact O-C 3.55Å; S25-V28 WeakPolarHBondContact O-CA 3.19Å; S25-V28 WeakPolarHBondContact O-CB 3.24Å; S25-V28 PolarHBondContact O-N 2.97Å; S25-V28 VanDerWaalsContact OG-CB 3.28Å; S25-V28 WeakPolarHBondContact OG-CB 3.19Å; S25-V28 WeakPolarHBondContact OG-CG2 3.49Å; S25-V28 PolarHBondContact OG-N 2.88Å; V28-K475 PolarHBondContact O-NZ 3.28Å; V28-K509 VanDerWaalsContact C-NZ 3.3Å; V28-K509 VanDerWaalsContact CA-CE 3.44Å; V28-K509 PolarHBondContact O-NZ 2.86Å
29	F	35	Very low	35.2	Very low	43 Å²	43	85.9 Å²	85.9	19%	0.189	49%	0.486	C	S	.	.	H	α-helix	trans	-109.7	-19.6	-174.7	-72.5	-78.1	0	0	0	116.9	I24 S25 Y468 K475 Y476	I24-F29 HydrophobicContact CG2-CD2 3.86Å; I24-F29 HydrophobicContact CG2-CE2 3.76Å; S25-F29 PolarHBondContact O-N 3.44Å; F29-Y468 AromaticContact CE2-CE2 3.66Å; F29-Y468 HydrophobicContact CE2-CE2 3.66Å; F29-Y468 AromaticContact CZ-CE2 3.9Å; F29-Y468 HydrophobicContact CZ-CE2 3.9Å; F29-K475 VanDerWaalsContact CA-NZ 3.29Å; F29-K475 HydrophobicContact CD1-CD 3.49Å; F29-K475 VanDerWaalsContact CD1-CD 3.49Å; F29-K475 HydrophobicContact CE1-CD 3.79Å; F29-K475 PolarHBondContact O-NZ 3.44Å; F29-Y476 AromaticContact CE1-CE2 3.92Å; F29-Y476 HydrophobicContact CE1-CE2 3.92Å; F29-Y476 HydrophobicContact CZ-CE2 4.33Å
30	G	31.1	Very low	35.9	Very low	42 Å²	42	83.4 Å²	83.4	43%	0.433	48%	0.483	S	S	.	.			trans	69.4	142	-167.6	0	0	0	0	0	110.3	D26 S32	D26-G30 WeakPolarHBondContact O-CA 3.35Å; D26-G30 PolarHBondContact O-N 3.28Å; G30-S32 PolarHBondContact O-N 2.98Å
31	E	27.8	Very low	36.7	Very low	192 Å²	192	76.4 Å²	76.4	90%	0.897	45%	0.451	S	S	*	.			trans	-36.5	111.9	-177.9	-66.6	-178.6	163.4	0	0	112.4
32	S	33.8	Very low	37.5	Very low	73 Å²	73	74.9 Å²	74.9	51%	0.51	43%	0.433	S	S	.	.			trans	-93.4	122.6	174.5	59	0	0	0	0	110	G30	G30-S32 PolarHBondContact O-N 2.98Å
33	G	33	Very low	38	Very low	72 Å²	72	74.1 Å²	74.1	74%	0.742	43%	0.431	S	S	*	.			trans	-62.1	162.3	167.4	0	0	0	0	0	113.2	D35	G33-D35 VanDerWaalsContact C-N 3.31Å; G33-D35 PolarHBondContact O-N 3.12Å
34	D	31.1	Very low	37.9	Very low	170 Å²	170	72.9 Å²	72.9	91%	0.909	43%	0.433	S	S	*	.	S	Bend	trans	-75.4	25.9	-161.4	-110.6	-8	0	0	0	117.4	S36	D34-S36 PolarHBondContact O-N 3.48Å
35	D	35.7	Very low	38	Very low	151 Å²	151	73.1 Å²	73.1	81%	0.807	44%	0.44	S	S	*	.			trans	-98.4	94.5	-175.4	-97.2	-29.3	0	0	0	113.7	G33	G33-D35 VanDerWaalsContact C-N 3.31Å; G33-D35 PolarHBondContact O-N 3.12Å
36	S	38	Very low	38	Very low	75 Å²	75	75.8 Å²	75.8	52%	0.524	47%	0.47	S	S	.	.			trans	-99.1	18.9	169.5	83.1	0	0	0	0	113.4	D34 D38	D34-S36 PolarHBondContact O-N 3.48Å; S36-D38 VanDerWaalsContact C-N 3.3Å; S36-D38 PolarHBondContact O-N 3.08Å
37	S	39.8	Very low	38	Very low	61 Å²	61	78.4 Å²	78.4	43%	0.427	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-26.3	-168.6	58.5	0	0	0	0	115
38	D	42	Very low	37.9	Very low	67 Å²	67	76 Å²	76	36%	0.358	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-2.5	-166.3	-64.4	-5.2	0	0	0	114.3	S36 T286	S36-D38 VanDerWaalsContact C-N 3.3Å; S36-D38 PolarHBondContact O-N 3.08Å; D38-T286 WeakPolarHBondContact O-CG2 3.42Å
39	N	52.3	Low	37.7	Very low	22 Å²	22	79.7 Å²	79.7	12%	0.118	49%	0.493	C	S	.	.			trans	-79.8	125.1	174.7	-176.2	-25.4	0	0	0	109.4	F41 Y42 S43	N39-F41 PolarHBondContact O-N 3.42Å; N39-F41 VanDerWaalsContact O-N 3.11Å; N39-F41 VanDerWaalsContact OD1-CD2 3.28Å; N39-F41 WeakPolarHBondContact OD1-CD2 3.25Å; N39-F41 PolarHBondContact OD1-N 3.07Å; N39-Y42 HydrophobicContact CB-CD2 3.53Å; N39-Y42 HydrophobicContact CB-CE2 4.3Å; N39-Y42 HydrophobicContact CB-CG 4.31Å; N39-Y42 WeakPolarHBondContact ND2-CD2 3.41Å; N39-Y42 VanDerWaalsContact ND2-CE2 3.26Å; N39-Y42 WeakPolarHBondContact ND2-CE2 3.21Å; N39-Y42 CarbonylContact O-C 3.58Å; N39-Y42 WeakPolarHBondContact O-CA 3.24Å; N39-Y42 PolarHBondContact O-N 3.35Å; N39-S43 PolarHBondContact O-N 3.26Å
40	P	48.6	Very low	37.9	Very low	62 Å²	62	79.5 Å²	79.5	40%	0.403	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.9	-177.2	24.8	-35.6	0	0	0	113.5	Y42	P40-Y42 VanDerWaalsContact C-N 3.26Å; P40-Y42 PolarHBondContact O-N 3.37Å
41	F	48.3	Very low	38.1	Very low	2 Å²	2	82.4 Å²	82.4	1%	0.009	50%	0.503	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-27.7	170.6	-64.7	-74.9	0	0	0	111.8	N39 W423 F429 F431 I446 R448 V459 F462 A463 L466	N39-F41 PolarHBondContact O-N 3.42Å; N39-F41 VanDerWaalsContact O-N 3.11Å; N39-F41 VanDerWaalsContact OD1-CD2 3.28Å; N39-F41 WeakPolarHBondContact OD1-CD2 3.25Å; N39-F41 PolarHBondContact OD1-N 3.07Å; F41-W423 HydrophobicContact CD1-CZ3 4.06Å; F41-F429 HydrophobicContact CD1-CD1 4.45Å; F41-F429 HydrophobicContact CD1-CE1 4.42Å; F41-F429 HydrophobicContact CE1-CB 4.44Å; F41-F429 AromaticContact CE1-CD1 3.59Å; F41-F429 HydrophobicContact CE1-CD1 3.59Å; F41-F429 HydrophobicContact CE1-CD2 4.49Å; F41-F429 AromaticContact CE1-CE1 3.88Å; F41-F429 HydrophobicContact CE1-CE1 3.88Å; F41-F429 AromaticContact CE1-CG 3.92Å; F41-F429 HydrophobicContact CE1-CG 3.92Å; F41-F429 HydrophobicContact CE1-CZ 4.45Å; F41-F429 AromaticContact CZ-CD1 3.86Å; F41-F429 HydrophobicContact CZ-CD1 3.86Å; F41-F429 HydrophobicContact CZ-CE1 4.07Å; F41-F431 AromaticContact CE1-CZ 3.88Å; F41-F431 HydrophobicContact CE1-CZ 3.88Å; F41-F431 AromaticContact CZ-CZ 3.84Å; F41-F431 HydrophobicContact CZ-CZ 3.84Å; F41-I446 WeakPolarHBondContact O-CD1 3.03Å; F41-R448 PolarHBondContact O-NH2 2.76Å; F41-R448 VanDerWaalsContact O-NH2 3.16Å; F41-V459 HydrophobicContact CD1-CG1 4.31Å; F41-V459 HydrophobicContact CE1-CG1 4.18Å; F41-F462 HydrophobicContact CE2-CD1 4.21Å; F41-F462 HydrophobicContact CZ-CD1 4.24Å; F41-A463 HydrophobicContact CB-CB 4.15Å; F41-A463 HydrophobicContact CD1-CB 4.5Å; F41-A463 HydrophobicContact CD2-CB 3.92Å; F41-A463 HydrophobicContact CG-CB 3.93Å; F41-L466 HydrophobicContact CD2-CD2 4.29Å; F41-L466 HydrophobicContact CE2-CD2 3.9Å
42	Y	49.6	Very low	38.4	Very low	50 Å²	50	77.5 Å²	77.5	20%	0.196	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-14.9	-172.4	-58.8	-97.2	0	0	0	115.2	N39 P40 I445 I446 R448 A463	N39-Y42 HydrophobicContact CB-CD2 3.53Å; N39-Y42 HydrophobicContact CB-CE2 4.3Å; N39-Y42 HydrophobicContact CB-CG 4.31Å; N39-Y42 WeakPolarHBondContact ND2-CD2 3.41Å; N39-Y42 VanDerWaalsContact ND2-CE2 3.26Å; N39-Y42 WeakPolarHBondContact ND2-CE2 3.21Å; N39-Y42 CarbonylContact O-C 3.58Å; N39-Y42 WeakPolarHBondContact O-CA 3.24Å; N39-Y42 PolarHBondContact O-N 3.35Å; P40-Y42 VanDerWaalsContact C-N 3.26Å; P40-Y42 PolarHBondContact O-N 3.37Å; Y42-I445 HydrophobicContact CE1-CG2 4.16Å; Y42-I446 HydrophobicContact CD1-CB 4.35Å; Y42-I446 HydrophobicContact CD1-CD1 3.51Å; Y42-I446 HydrophobicContact CD1-CG1 3.55Å; Y42-I446 HydrophobicContact CD1-CG2 3.89Å; Y42-I446 HydrophobicContact CE1-CD1 4.08Å; Y42-I446 HydrophobicContact CE1-CG1 3.69Å; Y42-I446 HydrophobicContact CE1-CG2 4.37Å; Y42-I446 HydrophobicContact CG-CD1 3.92Å; Y42-I446 HydrophobicContact CG-CG1 4.42Å; Y42-R448 VanDerWaalsContact C-NH2 3.32Å; Y42-R448 PolarHBondContact O-NH2 3.3Å; Y42-R448 VanDerWaalsContact O-NH2 3.12Å; Y42-A463 HydrophobicContact CE2-CB 4.17Å
43	S	42.8	Very low	38.5	Very low	22 Å²	22	78.7 Å²	78.7	15%	0.154	48%	0.477	C	S	.	.			trans	-64.7	144.7	-172.7	-169.1	0	0	0	0	114.9	N39 K426 R448	N39-S43 PolarHBondContact O-N 3.26Å; S43-K426 WeakPolarHBondContact O-CE 3.41Å; S43-K426 PolarHBondContact O-NZ 2.95Å; S43-R448 PolarHBondContact O-NH1 2.78Å
44	T	34	Very low	38.5	Very low	111 Å²	111	77.4 Å²	77.4	68%	0.681	45%	0.453	S	S	*	.			trans	-109.9	-17.9	-174.4	53.4	0	0	0	0	114.7	K426	T44-K426 PolarHBondContact O-NZ 3.34Å; T44-K426 VanDerWaalsContact O-NZ 3.11Å
45	S	36.5	Very low	38.3	Very low	71 Å²	71	72.2 Å²	72.2	50%	0.497	43%	0.434	S	S	.	.			trans	-70.6	145.8	-178.1	50	0	0	0	0	114.7	D47 K426	S45-D47 PolarHBondContact O-N 2.86Å; S45-K426 PolarHBondContact O-NZ 2.86Å
46	G	32.1	Very low	38	Very low	73 Å²	73	72.7 Å²	72.7	75%	0.753	43%	0.431	S	S	*	.	S	Bend	trans	-76.2	-10.7	-166.2	0	0	0	0	0	116.8	S48	G46-S48 PolarHBondContact O-N 3.43Å
47	D	32.2	Very low	37.9	Very low	155 Å²	155	73 Å²	73	83%	0.829	44%	0.438	S	S	*	.			trans	-105.6	69.9	-169.7	-60.7	-35	0	0	0	112.2	S45	S45-D47 PolarHBondContact O-N 2.86Å
48	S	35.3	Very low	37.3	Very low	46 Å²	46	73.4 Å²	73.4	32%	0.322	45%	0.451	S	S	.	.			trans	-132.6	90.5	168	-84.2	0	0	0	0	110.5	G46 S50	G46-S48 PolarHBondContact O-N 3.43Å; S48-S50 PolarHBondContact O-N 2.76Å; S48-S50 VanDerWaalsContact O-N 3.16Å
49	D	32.6	Very low	36.6	Very low	113 Å²	113	79.1 Å²	79.1	60%	0.604	48%	0.476	S	S	*	.			trans	-63.7	107	162.3	-87	-30.9	0	0	0	109.1	D51 N52 Y53	D49-D51 PolarHBondContact O-N 2.95Å; D49-D51 VanDerWaalsContact O-N 3.15Å; D49-N52 HydrophobicContact CB-CB 3.99Å; D49-N52 PolarHBondContact O-N 3.31Å; D49-N52 VanDerWaalsContact O-N 3.12Å; D49-N52 PolarHBondContact OD2-ND2 3.08Å; D49-Y53 PolarHBondContact O-N 2.63Å
50	S	40	Very low	35.3	Very low	40 Å²	40	86.6 Å²	86.6	28%	0.28	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-21.8	176.5	57.4	0	0	0	0	113.3	S48 I54	S48-S50 PolarHBondContact O-N 2.76Å; S48-S50 VanDerWaalsContact O-N 3.16Å; S50-I54 VanDerWaalsContact O-CG1 3.3Å; S50-I54 WeakPolarHBondContact O-CG1 3.49Å; S50-I54 PolarHBondContact O-N 3.26Å
51	D	34.3	Very low	34.4	Very low	102 Å²	102	91.9 Å²	91.9	55%	0.545	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-24.2	177.3	-71.2	-21	0	0	0	112.9	D49 I54 A55	D49-D51 PolarHBondContact O-N 2.95Å; D49-D51 VanDerWaalsContact O-N 3.15Å; D51-I54 CarbonylContact O-C 2.95Å; D51-I54 VanDerWaalsContact O-CA 3.25Å; D51-I54 WeakPolarHBondContact O-CA 3.46Å; D51-I54 PolarHBondContact O-N 3.28Å; D51-A55 VanDerWaalsContact O-CB 3.29Å; D51-A55 WeakPolarHBondContact O-CB 3.34Å; D51-A55 PolarHBondContact O-N 2.94Å
52	N	34	Very low	33.3	Very low	89 Å²	89	99 Å²	99	48%	0.476	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-74.2	-33.6	172.1	-85.9	-32.1	0	0	0	112	D49 I54 A55	D49-N52 HydrophobicContact CB-CB 3.99Å; D49-N52 PolarHBondContact O-N 3.31Å; D49-N52 VanDerWaalsContact O-N 3.12Å; D49-N52 PolarHBondContact OD2-ND2 3.08Å; N52-I54 PolarHBondContact O-N 3.37Å; N52-A55 PolarHBondContact O-N 2.8Å
53	Y	35.8	Very low	32.2	Very low	98 Å²	98	104.9 Å²	104.9	38%	0.384	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-65.8	-12.4	164.7	-78.9	-91.7	0	0	0	113	D49 C287 R386	D49-Y53 PolarHBondContact O-N 2.63Å; Y53-C287 HydrophobicContact CD1-CB 4.29Å; Y53-C287 HydrophobicContact CE1-CB 3.48Å; Y53-C287 VanDerWaalsContact CE1-CB 3.48Å; Y53-C287 PolarHBondContact OH-O 3.47Å; Y53-R386 PolarHBondContact O-NH2 3.5Å
54	I	33.6	Very low	31.4	Very low	46 Å²	46	110.9 Å²	110.9	24%	0.236	62%	0.618	C	S	.	*	G	3₁₀ helix	trans	-116.1	13.2	175.6	-53.7	175.9	0	0	0	112	S50 D51 N52 R386	S50-I54 VanDerWaalsContact O-CG1 3.3Å; S50-I54 WeakPolarHBondContact O-CG1 3.49Å; S50-I54 PolarHBondContact O-N 3.26Å; D51-I54 CarbonylContact O-C 2.95Å; D51-I54 VanDerWaalsContact O-CA 3.25Å; D51-I54 WeakPolarHBondContact O-CA 3.46Å; D51-I54 PolarHBondContact O-N 3.28Å; N52-I54 PolarHBondContact O-N 3.37Å; I54-R386 HydrophobicContact CG2-CG 3.94Å; I54-R386 WeakPolarHBondContact O-CD 3.5Å; I54-R386 PolarHBondContact O-NE 3.2Å; I54-R386 PolarHBondContact O-NH1 3.32Å; I54-R386 VanDerWaalsContact O-NH1 3.15Å
55	A	28	Very low	31	Very low	61 Å²	61	114.3 Å²	114.3	50%	0.504	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-120.4	-28.3	175.6	0	0	0	0	0	116.5	D51 N52 R386	D51-A55 VanDerWaalsContact O-CB 3.29Å; D51-A55 WeakPolarHBondContact O-CB 3.34Å; D51-A55 PolarHBondContact O-N 2.94Å; N52-A55 PolarHBondContact O-N 2.8Å; A55-R386 VanDerWaalsContact N-NH2 3.18Å; A55-R386 PolarHBondContact O-NH1 3.29Å
56	E	28.9	Very low	30.5	Very low	161 Å²	161	118.9 Å²	118.9	75%	0.752	64%	0.639	S	S	*	*			trans	-109.8	93.2	-174.2	-60.3	-168.2	159.3	0	0	115.5
57	A	34.7	Very low	30.2	Very low	81 Å²	81	124.6 Å²	124.6	67%	0.669	65%	0.646	S	S	*	*	S	Bend	trans	-169.2	59	157.6	0	0	0	0	0	109.4
58	G	27.4	Very low	29.9	Very low	69 Å²	69	125.6 Å²	125.6	71%	0.711	65%	0.645	S	S	*	*	S	Bend	trans	178.8	108.4	176.6	0	0	0	0	0	110.4
59	E	28.3	Very low	29.4	Very low	187 Å²	187	132.4 Å²	132.4	87%	0.874	67%	0.671	S	S	*	*			trans	-41.8	128.6	177.5	-66.9	150.4	171.7	0	0	113.6
60	Q	25	Very low	29	Very low	180 Å²	180	135.1 Å²	135.1	84%	0.841	68%	0.68	S	S	*	*			trans	-101	106.5	146	-77.5	-173.9	2	0	0	107.3	Q62	Q60-Q62 PolarHBondContact O-N 3.11Å
61	E	28.7	Very low	28.2	Very low	173 Å²	173	141.5 Å²	141.5	81%	0.808	71%	0.705	S	S	*	*			trans	-68.4	104.8	159	-78.7	-177.4	142.8	0	0	108.2
62	Q	26.1	Very low	28.2	Very low	151 Å²	151	141.2 Å²	141.2	71%	0.706	71%	0.709	S	S	*	*			trans	-125.6	98.9	150.1	-81.1	-175.6	4.5	0	0	108.3	Q60 H64	Q60-Q62 PolarHBondContact O-N 3.11Å; Q62-H64 PolarHBondContact O-N 2.81Å
63	Q	25.9	Very low	27.7	Very low	173 Å²	173	146.1 Å²	146.1	81%	0.808	73%	0.726	S	S	*	*			trans	-65.8	105.6	163	-70	175	7.1	0	0	108.1
64	H	25.6	Very low	27.1	Very low	149 Å²	149	153.4 Å²	153.4	69%	0.69	75%	0.753	S	S	*	*			trans	-112.8	90.1	158.2	-87.5	-63.8	0	0	0	109.1	Q62 H66	Q62-H64 PolarHBondContact O-N 2.81Å; H64-H66 PolarHBondContact O-N 3.38Å
65	H	26.8	Very low	26.7	Very low	183 Å²	183	154.7 Å²	154.7	85%	0.847	78%	0.777	S	S	*	*			trans	-68.2	115.1	158.7	-98.3	-50.2	0	0	0	108.6
66	H	24.8	Very low	26.5	Very low	167 Å²	167	159.3 Å²	159.3	77%	0.773	79%	0.793	S	S	*	*			trans	-85.6	110.8	159.3	-84.4	31.6	0	0	0	108.7	H64	H64-H66 PolarHBondContact O-N 3.38Å
67	Q	26.1	Very low	26.5	Very low	192 Å²	192	161.1 Å²	161.1	90%	0.897	80%	0.799	S	S	*	*			trans	-140.1	124.2	150.9	-101.2	-179.3	7.6	0	0	108.9
68	H	25.6	Very low	25.9	Very low	176 Å²	176	164.1 Å²	164.1	82%	0.815	80%	0.804	S	S	*	*			trans	-62.6	137.9	176	-83.5	-91.9	0	0	0	111.8
69	H	25.3	Very low	25.9	Very low	189 Å²	189	167.1 Å²	167.1	88%	0.875	81%	0.812	S	S	*	*			trans	-166.9	157.6	133.4	-97.1	-56.9	0	0	0	112.4
70	H	25.2	Very low	25.8	Very low	170 Å²	170	161.9 Å²	161.9	79%	0.787	81%	0.808	S	S	*	*			trans	-70.5	145	-158.3	-81	-82.2	0	0	0	118.5
71	H	23.3	Very low	25.8	Very low	174 Å²	174	162.4 Å²	162.4	81%	0.806	81%	0.81	S	S	*	*			trans	29.3	162.5	135.6	-92	8.5	0	0	0	123.2
72	P	33.4	Very low	25.7	Very low	96 Å²	96	160 Å²	160	62%	0.623	81%	0.813	S	S	*	*			cis	-143	174.7	-36.8	39.1	-19.9	0	0	0	115.8
73	K	23.9	Very low	25.6	Very low	192 Å²	192	156.8 Å²	156.8	84%	0.835	82%	0.82	S	S	*	*			trans	66.5	119	146.7	-84.2	-177.4	-178.4	-179.6	0	121.9
74	R	23.5	Very low	25.6	Very low	252 Å²	252	152.3 Å²	152.3	95%	0.951	82%	0.82	S	S	*	*				152.7	139.3	109.5	-98.1	178.7	176.6	-168.2	-0.8	113.5
75	G	24.6	Very low	25.7	Very low	73 Å²	73	151.6 Å²	151.6	75%	0.753	83%	0.832	S	S	*	*			trans	117	88.8	132	0	0	0	0	0	119.3
76	D	24	Very low	25.6	Very low	157 Å²	157	146.6 Å²	146.6	84%	0.84	83%	0.83	S	S	*	*			trans	22.8	126.1	133	-91.7	-14.9	0	0	0	120.9
77	K	27.6	Very low	25.7	Very low	199 Å²	199	142 Å²	142	87%	0.865	83%	0.828	S	S	*	*				-176.9	136.3	100.7	-102.1	176.2	-179.2	177.9	0	113.8
78	D	23.1	Very low	26	Very low	145 Å²	145	137.1 Å²	137.1	78%	0.775	83%	0.829	S	S	*	*			trans	-33.4	155.2	160.4	-72.3	-50.1	0	0	0	114.9
79	C	26.9	Very low	26.2	Very low	132 Å²	132	134.3 Å²	134.3	89%	0.892	83%	0.829	S	S	*	*				-164	146.1	73.3	-62	0	0	0	0	113.5
80	G	25.5	Very low	26.7	Very low	76 Å²	76	130.1 Å²	130.1	78%	0.784	83%	0.827	S	S	*	*				111.8	90.7	128.7	0	0	0	0	0	118.3
81	H	25.6	Very low	27.2	Very low	191 Å²	191	126.1 Å²	126.1	88%	0.884	83%	0.832	S	S	*	*			trans	-58.9	144.4	167.3	-77.9	43.8	0	0	0	114.1
82	S	27	Very low	28.1	Very low	124 Å²	124	121 Å²	121	87%	0.867	83%	0.826	S	S	*	*				-151.1	117.4	128.9	44.6	0	0	0	0	109.5
83	G	24.4	Very low	29	Very low	83 Å²	83	120.4 Å²	120.4	86%	0.856	82%	0.824	S	S	*	*			trans	-78.1	141.1	179.7	0	0	0	0	0	111.9
84	G	24.8	Very low	31.2	Very low	78 Å²	78	116.7 Å²	116.7	80%	0.804	82%	0.823	S	S	*	*			trans	-139.6	90.4	164.5	0	0	0	0	0	108.4
85	S	27.6	Very low	33.7	Very low	134 Å²	134	105.8 Å²	105.8	94%	0.937	79%	0.788	S	S	*	*			trans	-65.3	128.1	167.4	-62.7	0	0	0	0	109.4
86	G	25.6	Very low	36.6	Very low	78 Å²	78	103.3 Å²	103.3	80%	0.804	76%	0.759	S	S	*	*			trans	177.5	95.4	171.8	0	0	0	0	0	114.5
87	G	27.1	Very low	39.5	Very low	71 Å²	71	101.4 Å²	101.4	73%	0.732	76%	0.755	S	S	*	*			trans	84.7	89.8	147.7	0	0	0	0	0	116.8	S89	G87-S89 PolarHBondContact O-N 3.35Å; G87-S89 VanDerWaalsContact O-N 3.09Å
88	G	31.5	Very low	42.3	Very low	89 Å²	89	93.9 Å²	93.9	92%	0.918	73%	0.734	S	S	*	*			trans	-58.2	111.4	156.5	0	0	0	0	0	109.9
89	S	30.5	Very low	45.6	Very low	118 Å²	118	88 Å²	88	83%	0.825	70%	0.704	S	S	*	*			trans	-92.2	117.9	161.2	-75.8	0	0	0	0	108.1	G87	G87-S89 PolarHBondContact O-N 3.35Å; G87-S89 VanDerWaalsContact O-N 3.09Å
90	A	34.7	Very low	48.8	Very low	100 Å²	100	82.9 Å²	82.9	83%	0.826	67%	0.668	S	S	*	*			trans	-48.1	136.7	174.1	0	0	0	0	0	111.1	G92	A90-G92 PolarHBondContact O-N 3.04Å
91	G	35.6	Very low	52	Low	86 Å²	86	82 Å²	82	89%	0.887	65%	0.648	S	S	*	*			trans	-59.8	100.9	179.6	0	0	0	0	0	112
92	G	42.5	Very low	55.1	Low	67 Å²	67	80.3 Å²	80.3	69%	0.691	63%	0.633	S	S	*	*			trans	-73	124.8	160.1	0	0	0	0	0	108.6	A90 S94	A90-G92 PolarHBondContact O-N 3.04Å; G92-S94 PolarHBondContact O-N 3.2Å
93	S	53.9	Low	58.2	Low	83 Å²	83	77.5 Å²	77.5	58%	0.58	61%	0.614	S	S	*	*			trans	-50.8	112.3	167.2	170.1	0	0	0	0	108.5	G95 Q395	S93-G95 PolarHBondContact O-N 3.38Å; S93-Q395 PolarHBondContact O-NE2 3.5Å
94	S	69	Low	61.5	Low	115 Å²	115	77.6 Å²	77.6	80%	0.804	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-70	119.4	177.3	45.3	0	0	0	0	108.8	G92	G92-S94 PolarHBondContact O-N 3.2Å
95	G	75.9	Confident	64.8	Low	22 Å²	22	73.9 Å²	73.9	23%	0.227	55%	0.554	C	S	.	*	P	Polyproline II helix	trans	-67.2	168.9	177.6	0	0	0	0	0	111.9	S93	S93-G95 PolarHBondContact O-N 3.38Å
96	P	84.8	Confident	67.9	Low	21 Å²	21	72.5 Å²	72.5	14%	0.136	53%	0.533	C	S	.	.	S	Bend	trans	-58.6	149.8	173.5	25	-31.4	0	0	0	110.5	G98 S99 T385 C390 L398	P96-G98 PolarHBondContact O-N 3.04Å; P96-S99 WeakPolarHBondContact CD-OG 3.4Å; P96-S99 WeakPolarHBondContact O-CB 3.48Å; P96-S99 PolarHBondContact O-N 3.5Å; P96-S99 VanDerWaalsContact O-N 3.11Å; P96-S99 PolarHBondContact O-OG 2.92Å; P96-T385 HydrophobicContact CG-CG2 4.27Å; P96-C390 HydrophobicContact CB-CB 4.11Å; P96-C390 HydrophobicContact CG-CB 3.91Å; P96-L398 HydrophobicContact CG-CB 4.29Å; P96-L398 HydrophobicContact CG-CD1 3.49Å; P96-L398 VanDerWaalsContact CG-CD1 3.49Å
97	P	85.4	Confident	71.3	Confident	117 Å²	117	76.5 Å²	76.5	76%	0.76	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	135	-177.6	-26.6	34.4	0	0	0	112.5	S99	P97-S99 PolarHBondContact O-N 3.45Å
98	G	87.3	Confident	74.4	Confident	42 Å²	42	78.2 Å²	78.2	43%	0.433	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	-3.1	179	0	0	0	0	0	115.7	P96 T391 G392	P96-G98 PolarHBondContact O-N 3.04Å; G98-T391 CarbonylContact O-C 3.58Å; G98-T391 VanDerWaalsContact O-CA 3.32Å; G98-T391 WeakPolarHBondContact O-CA 3.45Å; G98-G392 PolarHBondContact O-N 3.03Å
99	S	92.3	Very high	77.4	Confident	20 Å²	20	75.9 Å²	75.9	14%	0.14	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-69.2	153.3	173.2	62.3	0	0	0	0	112.1	P96 P97 L393	P96-S99 WeakPolarHBondContact CD-OG 3.4Å; P96-S99 WeakPolarHBondContact O-CB 3.48Å; P96-S99 PolarHBondContact O-N 3.5Å; P96-S99 VanDerWaalsContact O-N 3.11Å; P96-S99 PolarHBondContact O-OG 2.92Å; P97-S99 PolarHBondContact O-N 3.45Å; S99-L393 WeakPolarHBondContact CA-O 3.45Å; S99-L393 WeakPolarHBondContact CB-O 3.11Å
100	L	94.4	Very high	80.6	Confident	25 Å²	25	70.5 Å²	70.5	13%	0.131	46%	0.457	C	S	.	.	B	Isolated β-bridge	trans	-96.7	140.2	-174.9	-58.5	177	0	0	0	111	Q104 A105 E108 G392 L393 Q395	L100-Q104 HydrophobicContact CB-CB 4.02Å; L100-Q104 HydrophobicContact CD2-CB 4.24Å; L100-A105 HydrophobicContact CB-CB 4.12Å; L100-A105 HydrophobicContact CD1-CB 4.47Å; L100-E108 HydrophobicContact CD1-CB 3.91Å; L100-E108 HydrophobicContact CD1-CG 3.81Å; L100-G392 WeakPolarHBondContact CD1-O 3.35Å; L100-L393 PolarHBondContact N-O 3.08Å; L100-Q395 VanDerWaalsContact O-CB 3.26Å; L100-Q395 WeakPolarHBondContact O-CB 3.49Å; L100-Q395 PolarHBondContact O-N 2.92Å
101	T	93.1	Very high	83.5	Confident	59 Å²	59	68.3 Å²	68.3	36%	0.362	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-63.7	168.3	164.8	69.6	0	0	0	0	110.3	S103 Q104 A105	T101-S103 PolarHBondContact O-N 3.42Å; T101-S103 PolarHBondContact OG1-OG 3.36Å; T101-Q104 PolarHBondContact O-N 3.32Å; T101-Q104 VanDerWaalsContact OG1-CG 3.31Å; T101-Q104 WeakPolarHBondContact OG1-CG 3.47Å; T101-Q104 PolarHBondContact OG1-N 3.13Å; T101-Q104 PolarHBondContact OG1-OE1 3.42Å; T101-A105 VanDerWaalsContact O-CB 3.3Å; T101-A105 WeakPolarHBondContact O-CB 3.43Å; T101-A105 PolarHBondContact O-N 2.83Å
102	R	89.3	Confident	86.3	Confident	154 Å²	154	69.3 Å²	69.3	58%	0.581	42%	0.416	S	S	*	.	H	α-helix	trans	-57.9	-46.9	179.9	-176.1	175.7	-175.7	155.5	9.1	112.6	A105 E106	R102-A105 PolarHBondContact O-N 3.13Å; R102-E106 WeakPolarHBondContact CG-OE1 3.4Å; R102-E106 IonicContact NE-OE1 3.15Å; R102-E106 PolarHBondContact NE-OE1 3.35Å; R102-E106 VanDerWaalsContact NE-OE1 3.15Å; R102-E106 WeakPolarHBondContact O-CG 3.4Å; R102-E106 PolarHBondContact O-N 3.29Å; R102-E106 VanDerWaalsContact O-N 3.09Å
103	S	92	Very high	88.6	Confident	66 Å²	66	70.6 Å²	70.6	46%	0.462	41%	0.41	S	S	.	.	H	α-helix	trans	-64.2	-44.4	179.6	57.1	0	0	0	0	111.8	T101 A105 E106 E107	T101-S103 PolarHBondContact O-N 3.42Å; T101-S103 PolarHBondContact OG1-OG 3.36Å; S103-A105 VanDerWaalsContact C-N 3.31Å; S103-A105 PolarHBondContact O-N 2.93Å; S103-E106 PolarHBondContact O-N 3.06Å; S103-E107 WeakPolarHBondContact O-CG 3.26Å; S103-E107 PolarHBondContact O-N 3.43Å
104	Q	94.3	Very high	90.5	Very high	84 Å²	84	70 Å²	70	39%	0.393	40%	0.4	S	S	.	.	H	α-helix	trans	-62.4	-39.1	176.4	-70.9	173.4	-30.8	0	0	112.1	L100 T101 E107 E108	L100-Q104 HydrophobicContact CB-CB 4.02Å; L100-Q104 HydrophobicContact CD2-CB 4.24Å; T101-Q104 PolarHBondContact O-N 3.32Å; T101-Q104 VanDerWaalsContact OG1-CG 3.31Å; T101-Q104 WeakPolarHBondContact OG1-CG 3.47Å; T101-Q104 PolarHBondContact OG1-N 3.13Å; T101-Q104 PolarHBondContact OG1-OE1 3.42Å; Q104-E107 PolarHBondContact O-N 3.32Å; Q104-E108 VanDerWaalsContact O-CB 3.26Å; Q104-E108 WeakPolarHBondContact O-CB 3.5Å; Q104-E108 VanDerWaalsContact O-CG 3.31Å; Q104-E108 WeakPolarHBondContact O-CG 3.39Å; Q104-E108 PolarHBondContact O-N 3.2Å
105	A	93.9	Very high	91.5	Very high	1 Å²	1	70.4 Å²	70.4	1%	0.008	39%	0.389	C	S	.	.	H	α-helix	trans	-63	-44	177.4	0	0	0	0	0	111.6	L100 T101 R102 S103 E108 G109 W110 P394	L100-A105 HydrophobicContact CB-CB 4.12Å; L100-A105 HydrophobicContact CD1-CB 4.47Å; T101-A105 VanDerWaalsContact O-CB 3.3Å; T101-A105 WeakPolarHBondContact O-CB 3.43Å; T101-A105 PolarHBondContact O-N 2.83Å; R102-A105 PolarHBondContact O-N 3.13Å; S103-A105 VanDerWaalsContact C-N 3.31Å; S103-A105 PolarHBondContact O-N 2.93Å; A105-E108 CarbonylContact O-C 3.5Å; A105-E108 PolarHBondContact O-N 3.09Å; A105-G109 PolarHBondContact O-N 3.33Å; A105-W110 HydrophobicContact CB-CB 4.09Å; A105-W110 HydrophobicContact CB-CG 4.34Å; A105-W110 VanDerWaalsContact O-CB 3.26Å; A105-W110 WeakPolarHBondContact O-CB 3.36Å; A105-W110 PolarHBondContact O-N 3.47Å; A105-P394 HydrophobicContact CB-CB 3.87Å; A105-P394 HydrophobicContact CB-CG 3.89Å
106	E	93.6	Very high	92.1	Very high	104 Å²	104	73.2 Å²	73.2	49%	0.486	40%	0.399	S	S	.	.	H	α-helix	trans	-63.9	-43.7	176.7	-70.6	167.8	-170.3	0	0	111.4	R102 S103 E108 G109	R102-E106 WeakPolarHBondContact CG-OE1 3.4Å; R102-E106 IonicContact NE-OE1 3.15Å; R102-E106 PolarHBondContact NE-OE1 3.35Å; R102-E106 VanDerWaalsContact NE-OE1 3.15Å; R102-E106 WeakPolarHBondContact O-CG 3.4Å; R102-E106 PolarHBondContact O-N 3.29Å; R102-E106 VanDerWaalsContact O-N 3.09Å; S103-E106 PolarHBondContact O-N 3.06Å; E106-E108 VanDerWaalsContact C-N 3.29Å; E106-E108 PolarHBondContact O-N 2.76Å; E106-G109 PolarHBondContact O-N 3.42Å
107	E	95.4	Very high	92.2	Very high	163 Å²	163	73 Å²	73	76%	0.762	40%	0.397	S	S	*	.	H	α-helix	trans	-60	-38.3	173.2	-72.7	170.3	-169.6	0	0	112.4	S103 Q104 G109	S103-E107 WeakPolarHBondContact O-CG 3.26Å; S103-E107 PolarHBondContact O-N 3.43Å; Q104-E107 PolarHBondContact O-N 3.32Å; E107-G109 PolarHBondContact O-N 2.87Å
108	E	93.1	Very high	92	Very high	106 Å²	106	72.5 Å²	72.5	50%	0.495	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	3.5	175.4	-78.4	-77.2	168	0	0	113.6	L100 Q104 A105 E106 K415	L100-E108 HydrophobicContact CD1-CB 3.91Å; L100-E108 HydrophobicContact CD1-CG 3.81Å; Q104-E108 VanDerWaalsContact O-CB 3.26Å; Q104-E108 WeakPolarHBondContact O-CB 3.5Å; Q104-E108 VanDerWaalsContact O-CG 3.31Å; Q104-E108 WeakPolarHBondContact O-CG 3.39Å; Q104-E108 PolarHBondContact O-N 3.2Å; A105-E108 CarbonylContact O-C 3.5Å; A105-E108 PolarHBondContact O-N 3.09Å; E106-E108 VanDerWaalsContact C-N 3.29Å; E106-E108 PolarHBondContact O-N 2.76Å; E108-K415 WeakPolarHBondContact O-CD 3.43Å; E108-K415 WeakPolarHBondContact O-CE 3.14Å; E108-K415 PolarHBondContact O-NZ 2.93Å; E108-K415 IonicContact OE2-NZ 2.81Å; E108-K415 PolarHBondContact OE2-NZ 2.93Å
109	G	95	Very high	91.9	Very high	41 Å²	41	72 Å²	72	42%	0.423	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	16	174	0	0	0	0	0	115.4	A105 E106 E107	A105-G109 PolarHBondContact O-N 3.33Å; E106-G109 PolarHBondContact O-N 3.42Å; E107-G109 PolarHBondContact O-N 2.87Å
110	W	97	Very high	91.6	Very high	4 Å²	4	73.1 Å²	73.1	2%	0.015	39%	0.388	C	S	.	.			trans	-75.9	131.2	169.2	-71	98.1	0	0	0	110.9	A105 L366 G392 L393 P394 M413 M414 K415 L420	A105-W110 HydrophobicContact CB-CB 4.09Å; A105-W110 HydrophobicContact CB-CG 4.34Å; A105-W110 VanDerWaalsContact O-CB 3.26Å; A105-W110 WeakPolarHBondContact O-CB 3.36Å; A105-W110 PolarHBondContact O-N 3.47Å; W110-L366 HydrophobicContact CZ2-CD1 4.14Å; W110-L366 HydrophobicContact CZ2-CD2 4.11Å; W110-G392 PolarHBondContact NE1-O 3.29Å; W110-L393 HydrophobicContact CH2-CD2 4.16Å; W110-L393 HydrophobicContact CZ2-CD2 3.85Å; W110-P394 HydrophobicContact CB-CG 4Å; W110-P394 HydrophobicContact CD2-CG 3.56Å; W110-P394 HydrophobicContact CE3-CG 4.05Å; W110-P394 HydrophobicContact CG-CG 3.54Å; W110-M413 HydrophobicContact CB-CE 3.92Å; W110-M413 HydrophobicContact CE3-CB 3.91Å; W110-M413 HydrophobicContact CZ3-CB 4.44Å; W110-M414 CarbonylContact C-O 3.49Å; W110-M414 VanDerWaalsContact CA-O 3.27Å; W110-M414 WeakPolarHBondContact CA-O 3.08Å; W110-M414 VanDerWaalsContact CE3-C 3.48Å; W110-K415 HydrophobicContact CD2-CB 3.66Å; W110-K415 HydrophobicContact CD2-CD 4.49Å; W110-K415 HydrophobicContact CE3-CB 3.8Å; W110-K415 HydrophobicContact CG-CB 4.18Å; W110-K415 HydrophobicContact CH2-CB 4.17Å; W110-K415 HydrophobicContact CZ2-CB 4.05Å; W110-K415 HydrophobicContact CZ2-CD 4.4Å; W110-K415 HydrophobicContact CZ3-CB 4.04Å; W110-L420 HydrophobicContact CH2-CB 3.89Å; W110-L420 HydrophobicContact CZ3-CB 3.65Å
111	T	95.7	Very high	91	Very high	55 Å²	55	76.9 Å²	76.9	34%	0.337	41%	0.413	S	S	.	.	B	Isolated β-bridge	trans	-140.2	152.7	-179.5	-178.7	0	0	0	0	111.8	T113 M413 M414	T111-T113 VanDerWaalsContact C-N 3.27Å; T111-T113 WeakPolarHBondContact OG1-CB 3.09Å; T111-T113 PolarHBondContact OG1-N 2.97Å; T111-T113 PolarHBondContact OG1-OG1 3.06Å; T111-M413 CarbonylContact O-C 3.59Å; T111-M413 VanDerWaalsContact O-CA 3.31Å; T111-M413 WeakPolarHBondContact O-CA 3.28Å; T111-M414 PolarHBondContact N-O 3.38Å; T111-M414 PolarHBondContact O-N 2.88Å
112	E	93.8	Very high	90.5	Very high	107 Å²	107	75.8 Å²	75.8	50%	0.5	40%	0.403	S	S	.	.	S	Bend	trans	-84.1	-5.8	169.3	-65.1	-179.2	161.6	0	0	111.8	L114 M413	E112-L114 PolarHBondContact O-N 3.35Å; E112-L114 VanDerWaalsContact O-N 3.15Å; E112-M413 HydrophobicContact CG-CE 4.47Å; E112-M413 HydrophobicContact CG-CG 4.02Å
113	T	92.6	Very high	89.8	Confident	94 Å²	94	77.2 Å²	77.2	58%	0.577	41%	0.413	S	S	*	.			trans	-72.9	106.3	174.7	-55.8	0	0	0	0	109.7	T111	T111-T113 VanDerWaalsContact C-N 3.27Å; T111-T113 WeakPolarHBondContact OG1-CB 3.09Å; T111-T113 PolarHBondContact OG1-N 2.97Å; T111-T113 PolarHBondContact OG1-OG1 3.06Å
114	L	92.2	Very high	89.1	Confident	70 Å²	70	77.5 Å²	77.5	37%	0.366	41%	0.407	S	S	.	.			trans	-81.4	142.8	-174.9	-51.9	-176.2	0	0	0	112	E112 V412 M414 P438 T439	E112-L114 PolarHBondContact O-N 3.35Å; E112-L114 VanDerWaalsContact O-N 3.15Å; L114-V412 HydrophobicContact CD2-CB 3.84Å; L114-V412 HydrophobicContact CD2-CG1 3.76Å; L114-M414 HydrophobicContact CB-SD 4.32Å; L114-M414 HydrophobicContact CD2-CG 4.06Å; L114-M414 HydrophobicContact CD2-SD 4.14Å; L114-P438 HydrophobicContact CD2-CG 4.47Å; L114-T439 HydrophobicContact CB-CG2 3.61Å
115	Q	90.4	Very high	88.6	Confident	123 Å²	123	78.6 Å²	78.6	58%	0.575	42%	0.42	S	S	*	.			trans	-128	150.9	175.8	-60.5	-179	22.4	0	0	109.7	M414	Q115-M414 HydrophobicContact CB-CE 4.46Å; Q115-M414 HydrophobicContact CB-SD 4.45Å; Q115-M414 PolarHBondContact N-SD 2.98Å
116	D	88.1	Confident	88.3	Confident	81 Å²	81	84 Å²	84	43%	0.433	44%	0.441	S	S	.	.			trans	-71.9	133.4	175.3	-165.7	30.7	0	0	0	110	S437 T439 K440	D116-S437 WeakPolarHBondContact CA-OG 3.44Å; D116-S437 WeakPolarHBondContact OD1-CB 3.3Å; D116-S437 PolarHBondContact OD1-OG 2.86Å; D116-T439 PolarHBondContact OD1-OG1 2.69Å; D116-K440 VanDerWaalsContact CG-NZ 3.28Å; D116-K440 VanDerWaalsContact OD1-CE 3.22Å; D116-K440 WeakPolarHBondContact OD1-CE 3.33Å; D116-K440 IonicContact OD1-NZ 2.67Å; D116-K440 PolarHBondContact OD1-NZ 2.95Å; D116-K440 WeakPolarHBondContact OD2-CE 3.39Å; D116-K440 IonicContact OD2-NZ 3.62Å; D116-K440 PolarHBondContact OD2-NZ 3.4Å
117	V	86.8	Confident	88.3	Confident	17 Å²	17	79.3 Å²	79.3	10%	0.103	42%	0.42	C	S	.	.			trans	-107.6	125.8	174.7	-176.8	0	0	0	0	108.3	M414 S437	V117-M414 HydrophobicContact CG2-CE 3.63Å; V117-S437 PolarHBondContact N-OG 2.85Å
118	T	82.9	Confident	88.2	Confident	106 Å²	106	73.9 Å²	73.9	65%	0.65	40%	0.399	S	S	*	.			trans	-112.5	118.5	174.9	-60	0	0	0	0	109.6
119	V	83.4	Confident	88.2	Confident	32 Å²	32	71.6 Å²	71.6	19%	0.194	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-81.6	128.6	169.1	179.5	0	0	0	0	108.3	V356 Y378 A435	V119-V356 HydrophobicContact CG1-CG2 4.45Å; V119-Y378 HydrophobicContact CG1-CD1 4.45Å; V119-Y378 HydrophobicContact CG1-CD2 3.65Å; V119-Y378 HydrophobicContact CG1-CE2 3.86Å; V119-Y378 HydrophobicContact CG1-CG 3.98Å; V119-Y378 HydrophobicContact CG2-CD1 4.11Å; V119-Y378 HydrophobicContact CG2-CG 4.19Å; V119-A435 HydrophobicContact CG2-CB 4.44Å; V119-A435 WeakPolarHBondContact CG2-O 3.35Å
120	P	86.3	Confident	88	Confident	44 Å²	44	73.9 Å²	73.9	29%	0.286	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-57.9	148.7	174.7	-23.2	33.6	0	0	0	111.6	Q268 N354 Y378	P120-Q268 PolarHBondContact O-NE2 3.33Å; P120-N354 HydrophobicContact CB-CB 4.45Å; P120-Y378 WeakPolarHBondContact CD-OH 3.47Å; P120-Y378 WeakPolarHBondContact CG-OH 3.48Å
121	P	82.3	Confident	87.7	Confident	104 Å²	104	81.3 Å²	81.3	68%	0.675	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-62.2	146.9	180	26	-33.7	0	0	0	111.4	K123 N354	P121-K123 PolarHBondContact O-N 3.22Å; P121-N354 PolarHBondContact O-ND2 2.91Å
122	Y	83.4	Confident	87.6	Confident	36 Å²	36	79.9 Å²	79.9	14%	0.141	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-70.2	120	171.3	-156.3	-116.3	0	0	0	109.3	E124 P266 Q268 K353 A355	Y122-E124 VanDerWaalsContact C-N 3.35Å; Y122-E124 HydrophobicContact CD1-CB 4.34Å; Y122-E124 VanDerWaalsContact CD1-O 3.28Å; Y122-E124 WeakPolarHBondContact CD1-O 3.4Å; Y122-E124 HydrophobicContact CE1-CB 3.95Å; Y122-P266 WeakPolarHBondContact CE1-O 3.36Å; Y122-P266 PolarHBondContact OH-O 3.23Å; Y122-Q268 HydrophobicContact CD1-CB 4.09Å; Y122-Q268 HydrophobicContact CD2-CB 3.72Å; Y122-Q268 HydrophobicContact CD2-CG 3.64Å; Y122-Q268 HydrophobicContact CE2-CB 4.36Å; Y122-Q268 HydrophobicContact CE2-CG 4.42Å; Y122-Q268 HydrophobicContact CG-CB 3.57Å; Y122-Q268 HydrophobicContact CG-CG 3.9Å; Y122-K353 WeakPolarHBondContact CD2-O 3.11Å; Y122-K353 HydrophobicContact CE2-CB 4.02Å; Y122-K353 WeakPolarHBondContact CE2-O 3.3Å; Y122-A355 HydrophobicContact CE2-CB 4.31Å
123	K	72.9	Confident	87.7	Confident	183 Å²	183	78.6 Å²	78.6	80%	0.796	42%	0.415	S	S	*	.			trans	-80.9	-15.5	-172.1	-64.9	179.7	-179.3	173	0	113.5	P121	P121-K123 PolarHBondContact O-N 3.22Å
124	E	77.8	Confident	87.9	Confident	72 Å²	72	76.3 Å²	76.3	34%	0.336	41%	0.406	S	S	.	.	S	Bend	trans	-103.2	142.8	-173.9	-66.1	-179.4	-159.4	0	0	112	Y122 K353	Y122-E124 VanDerWaalsContact C-N 3.35Å; Y122-E124 HydrophobicContact CD1-CB 4.34Å; Y122-E124 VanDerWaalsContact CD1-O 3.28Å; Y122-E124 WeakPolarHBondContact CD1-O 3.4Å; Y122-E124 HydrophobicContact CE1-CB 3.95Å; E124-K353 VanDerWaalsContact CD-NZ 3.27Å; E124-K353 WeakPolarHBondContact OE1-CE 3.3Å; E124-K353 IonicContact OE1-NZ 2.93Å; E124-K353 PolarHBondContact OE1-NZ 3.28Å; E124-K353 IonicContact OE2-NZ 2.8Å; E124-K353 PolarHBondContact OE2-NZ 3.42Å
125	T	84.4	Confident	88	Confident	108 Å²	108	78.9 Å²	78.9	66%	0.663	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-76.6	132	164.6	56.1	0	0	0	0	109.5	R265	T125-R265 WeakPolarHBondContact O-CB 3.36Å; T125-R265 WeakPolarHBondContact O-CD 3.35Å
126	Y	87.2	Confident	88.4	Confident	115 Å²	115	73.5 Å²	73.5	45%	0.451	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-86.3	157.2	175.9	72.2	-91.3	0	0	0	112	R265 P266 T310	Y126-R265 CarbonylContact C-O 3.48Å; Y126-R265 VanDerWaalsContact CA-O 3.23Å; Y126-R265 WeakPolarHBondContact CA-O 2.92Å; Y126-R265 WeakPolarHBondContact CB-O 3.43Å; Y126-P266 VanDerWaalsContact CB-C 3.47Å; Y126-P266 WeakPolarHBondContact CB-O 3.44Å; Y126-T310 HydrophobicContact CD2-CG2 4.19Å; Y126-T310 HydrophobicContact CE2-CG2 4.2Å
127	G	92.8	Very high	88.8	Confident	5 Å²	5	71.9 Å²	71.9	5%	0.052	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	129.3	-174.4	178.8	0	0	0	0	0	113.8	V129 R265	G127-V129 PolarHBondContact O-N 3.16Å; G127-R265 PolarHBondContact N-O 2.88Å; G127-R265 PolarHBondContact O-N 3.02Å
128	P	94.3	Very high	89.3	Confident	48 Å²	48	71.2 Å²	71.2	31%	0.312	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	136.4	175.4	-23.6	33.4	0	0	0	111.8	T263 L507 M510	P128-T263 WeakPolarHBondContact CA-O 3.17Å; P128-L507 HydrophobicContact CB-CD2 4.02Å; P128-L507 HydrophobicContact CG-CD2 3.89Å; P128-M510 HydrophobicContact CG-CB 3.8Å; P128-M510 HydrophobicContact CG-SD 4.41Å
129	V	93.9	Very high	90	Very high	59 Å²	59	67.4 Å²	67.4	36%	0.358	37%	0.366	S	S	.	.	S	Bend	trans	-75.1	-34.4	176.2	173.8	0	0	0	0	111.1	G127 C262 T263 R265	G127-V129 PolarHBondContact O-N 3.16Å; V129-C262 WeakPolarHBondContact CB-O 3.36Å; V129-C262 WeakPolarHBondContact CG1-O 3.37Å; V129-C262 WeakPolarHBondContact CG2-O 3.39Å; V129-T263 PolarHBondContact N-O 2.98Å; V129-R265 HydrophobicContact CG2-CG 3.82Å
130	Q	88.9	Confident	90.7	Very high	88 Å²	88	68.8 Å²	68.8	41%	0.411	37%	0.372	S	S	.	.	S	Bend	trans	-117.5	143.4	-179.6	65.9	179.4	40.2	0	0	110.9	M132	Q130-M132 HydrophobicContact CG-SD 4.49Å; Q130-M132 PolarHBondContact NE2-SD 3.1Å
131	K	91.8	Very high	91.3	Very high	161 Å²	161	66.8 Å²	66.8	70%	0.7	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-86.5	122.3	173.8	-170.5	173.5	-177.9	178.3	0	109.3	D512	K131-D512 WeakPolarHBondContact CE-OD2 3.28Å; K131-D512 IonicContact NZ-OD1 3.25Å; K131-D512 IonicContact NZ-OD2 2.63Å; K131-D512 PolarHBondContact NZ-OD2 3.19Å
132	M	94.4	Very high	92.1	Very high	25 Å²	25	61.8 Å²	61.8	12%	0.123	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-84.9	145.3	174.8	-64.8	-64.2	-72.8	0	0	110.5	Q130 A136 D140 F141 L144	Q130-M132 HydrophobicContact CG-SD 4.49Å; Q130-M132 PolarHBondContact NE2-SD 3.1Å; M132-A136 HydrophobicContact CB-CB 4.09Å; M132-A136 HydrophobicContact CE-CB 4.07Å; M132-D140 HydrophobicContact CE-CB 3.9Å; M132-F141 HydrophobicContact CB-CE1 3.88Å; M132-F141 HydrophobicContact CB-CZ 3.62Å; M132-F141 HydrophobicContact CG-CD1 4.19Å; M132-F141 HydrophobicContact CG-CE1 3.47Å; M132-F141 VanDerWaalsContact CG-CE1 3.47Å; M132-F141 HydrophobicContact CG-CZ 3.76Å; M132-L144 HydrophobicContact CE-CD1 4.49Å; M132-L144 HydrophobicContact CE-CD2 4.42Å; M132-L144 HydrophobicContact SD-CD1 4.17Å; M132-L144 HydrophobicContact SD-CD2 4.25Å
133	P	95.4	Very high	92.7	Very high	80 Å²	80	62.1 Å²	62.1	52%	0.519	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-57.1	150.6	173.1	-23.3	33.1	0	0	0	112	T135 A136	P133-T135 PolarHBondContact O-N 3.28Å; P133-T135 VanDerWaalsContact O-N 3.14Å; P133-A136 WeakPolarHBondContact O-CB 3.5Å; P133-A136 PolarHBondContact O-N 2.85Å
134	A	95.4	Very high	93.9	Very high	45 Å²	45	54.8 Å²	54.8	37%	0.372	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-18.1	176.2	0	0	0	0	0	113.3	D512 A513 V516	A134-D512 HydrophobicContact CB-CB 4.14Å; A134-A513 WeakPolarHBondContact O-CA 3.22Å; A134-V516 HydrophobicContact CB-CG2 3.96Å
135	T	96.1	Very high	94.9	Very high	124 Å²	124	51.4 Å²	51.4	76%	0.761	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-0.8	174.6	57	0	0	0	0	113.5	P133 T137	P133-T135 PolarHBondContact O-N 3.28Å; P133-T135 VanDerWaalsContact O-N 3.14Å; T135-T137 PolarHBondContact O-N 3.04Å
136	A	97.3	Very high	95.5	Very high	10 Å²	10	46.2 Å²	46.2	8%	0.083	25%	0.251	C	S	.	.			trans	-61.5	134.9	-176.1	0	0	0	0	0	111.7	M132 P133 D140 F141 A513	M132-A136 HydrophobicContact CB-CB 4.09Å; M132-A136 HydrophobicContact CE-CB 4.07Å; P133-A136 WeakPolarHBondContact O-CB 3.5Å; P133-A136 PolarHBondContact O-N 2.85Å; A136-D140 VanDerWaalsContact CA-OD2 3.27Å; A136-D140 WeakPolarHBondContact CA-OD2 3.5Å; A136-D140 HydrophobicContact CB-CB 4.2Å; A136-F141 HydrophobicContact CB-CD2 4.45Å; A136-F141 HydrophobicContact CB-CE2 3.69Å; A136-F141 HydrophobicContact CB-CZ 4.16Å; A136-A513 HydrophobicContact CB-CB 4.4Å
137	T	97.1	Very high	96	Very high	48 Å²	48	42.3 Å²	42.3	29%	0.294	24%	0.24	S	C	.	.			trans	-94.8	174.2	-174.9	81.9	0	0	0	0	112.5	T135 L139 D140 F141 E531	T135-T137 PolarHBondContact O-N 3.04Å; T137-L139 VanDerWaalsContact C-N 3.26Å; T137-L139 PolarHBondContact O-N 3.28Å; T137-L139 PolarHBondContact OG1-N 3.12Å; T137-D140 PolarHBondContact N-OD2 3.25Å; T137-D140 PolarHBondContact O-N 3.12Å; T137-D140 PolarHBondContact OG1-N 2.96Å; T137-F141 WeakPolarHBondContact O-CD2 3.17Å; T137-F141 PolarHBondContact O-N 3.07Å; T137-E531 WeakPolarHBondContact CB-OE1 3.32Å; T137-E531 WeakPolarHBondContact CB-OE2 3.4Å; T137-E531 PolarHBondContact OG1-OE2 3.48Å
138	A	97.9	Very high	96.1	Very high	2 Å²	2	46.1 Å²	46.1	2%	0.017	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-36.7	177	0	0	0	0	0	111.9	F141 F142 F524 R527 L528 E531	A138-F141 PolarHBondContact O-N 3.17Å; A138-F142 WeakPolarHBondContact O-CB 3.49Å; A138-F142 PolarHBondContact O-N 3.15Å; A138-F524 HydrophobicContact CB-CD2 4.02Å; A138-F524 HydrophobicContact CB-CE1 4.49Å; A138-F524 HydrophobicContact CB-CE2 3.76Å; A138-F524 HydrophobicContact CB-CG 4.5Å; A138-F524 HydrophobicContact CB-CZ 4.01Å; A138-R527 HydrophobicContact CB-CB 4.07Å; A138-R527 HydrophobicContact CB-CG 3.82Å; A138-L528 HydrophobicContact CB-CB 4.08Å; A138-E531 PolarHBondContact N-OE2 2.86Å
139	L	97.9	Very high	96.3	Very high	27 Å²	27	49.1 Å²	49.1	14%	0.141	27%	0.272	C	S	.	.	H	α-helix	trans	-63.8	-41.9	173.5	-177.8	61.4	0	0	0	111.9	T137 F141 F142 Q143 L528 E531 L532	T137-L139 VanDerWaalsContact C-N 3.26Å; T137-L139 PolarHBondContact O-N 3.28Å; T137-L139 PolarHBondContact OG1-N 3.12Å; L139-F141 VanDerWaalsContact C-N 3.31Å; L139-F141 PolarHBondContact O-N 3.18Å; L139-F142 HydrophobicContact CD1-CD1 4.11Å; L139-F142 PolarHBondContact O-N 3.02Å; L139-F142 VanDerWaalsContact O-N 3.11Å; L139-Q143 HydrophobicContact CD1-CG 3.93Å; L139-Q143 HydrophobicContact CG-CG 4.17Å; L139-Q143 WeakPolarHBondContact O-CB 3.3Å; L139-Q143 WeakPolarHBondContact O-CG 3.29Å; L139-Q143 PolarHBondContact O-N 3.2Å; L139-L528 HydrophobicContact CB-CD1 4.46Å; L139-L528 HydrophobicContact CD1-CD1 4.25Å; L139-E531 WeakPolarHBondContact CA-OE2 3.43Å; L139-E531 HydrophobicContact CB-CB 3.99Å; L139-E531 WeakPolarHBondContact CB-OE2 3.26Å; L139-E531 HydrophobicContact CD2-CB 4.39Å; L139-E531 PolarHBondContact N-OE2 3.36Å; L139-L532 HydrophobicContact CD1-CD2 3.74Å; L139-L532 HydrophobicContact CD1-CG 4.26Å
140	D	97.8	Very high	96.4	Very high	61 Å²	61	46.9 Å²	46.9	33%	0.326	26%	0.259	S	S	.	.	H	α-helix	trans	-58.4	-44.2	178	-67.1	-33.6	0	0	0	111.4	M132 A136 T137 Q143	M132-D140 HydrophobicContact CE-CB 3.9Å; A136-D140 VanDerWaalsContact CA-OD2 3.27Å; A136-D140 WeakPolarHBondContact CA-OD2 3.5Å; A136-D140 HydrophobicContact CB-CB 4.2Å; T137-D140 PolarHBondContact N-OD2 3.25Å; T137-D140 PolarHBondContact O-N 3.12Å; T137-D140 PolarHBondContact OG1-N 2.96Å; D140-Q143 PolarHBondContact O-N 2.66Å
141	F	98.4	Very high	96.8	Very high	1 Å²	1	42.8 Å²	42.8	0%	0.004	24%	0.24	C	C	.	.	H	α-helix	trans	-68	-37.4	175.4	-74.5	-80.4	0	0	0	112.7	M132 A136 T137 A138 L139 L144 A504 L507 Y508 S511 A513 F524	M132-F141 HydrophobicContact CB-CE1 3.88Å; M132-F141 HydrophobicContact CB-CZ 3.62Å; M132-F141 HydrophobicContact CG-CD1 4.19Å; M132-F141 HydrophobicContact CG-CE1 3.47Å; M132-F141 VanDerWaalsContact CG-CE1 3.47Å; M132-F141 HydrophobicContact CG-CZ 3.76Å; A136-F141 HydrophobicContact CB-CD2 4.45Å; A136-F141 HydrophobicContact CB-CE2 3.69Å; A136-F141 HydrophobicContact CB-CZ 4.16Å; T137-F141 WeakPolarHBondContact O-CD2 3.17Å; T137-F141 PolarHBondContact O-N 3.07Å; A138-F141 PolarHBondContact O-N 3.17Å; L139-F141 VanDerWaalsContact C-N 3.31Å; L139-F141 PolarHBondContact O-N 3.18Å; F141-L144 HydrophobicContact CD1-CD1 4.35Å; F141-L144 WeakPolarHBondContact O-CB 3.47Å; F141-L144 WeakPolarHBondContact O-CG 3.45Å; F141-L144 PolarHBondContact O-N 3.47Å; F141-A504 HydrophobicContact CB-CB 4Å; F141-A504 WeakPolarHBondContact O-CB 3.48Å; F141-L507 HydrophobicContact CD1-CB 3.79Å; F141-L507 HydrophobicContact CE1-CB 4.1Å; F141-Y508 HydrophobicContact CD2-CD2 4.02Å; F141-Y508 HydrophobicContact CD2-CG 4.32Å; F141-Y508 VanDerWaalsContact CE1-CA 3.46Å; F141-Y508 AromaticContact CE2-CD2 3.64Å; F141-Y508 HydrophobicContact CE2-CD2 3.64Å; F141-Y508 HydrophobicContact CE2-CG 4.27Å; F141-Y508 HydrophobicContact CZ-CD2 4.2Å; F141-S511 WeakPolarHBondContact CZ-OG 3.4Å; F141-A513 HydrophobicContact CE2-CB 4.14Å; F141-A513 HydrophobicContact CZ-CB 4.35Å; F141-F524 HydrophobicContact CB-CE2 4.47Å; F141-F524 HydrophobicContact CB-CZ 4.11Å
142	F	98.3	Very high	97.1	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-66.1	-39.7	176.3	173.5	-105.8	0	0	0	112.2	A138 L139 L144 F145 V146 I191 I497 I501 L528 L532	A138-F142 WeakPolarHBondContact O-CB 3.49Å; A138-F142 PolarHBondContact O-N 3.15Å; L139-F142 HydrophobicContact CD1-CD1 4.11Å; L139-F142 PolarHBondContact O-N 3.02Å; L139-F142 VanDerWaalsContact O-N 3.11Å; F142-L144 PolarHBondContact O-N 3.45Å; F142-F145 PolarHBondContact O-N 3.49Å; F142-V146 HydrophobicContact CD1-CB 4.29Å; F142-V146 HydrophobicContact CD2-CG2 4.39Å; F142-V146 HydrophobicContact CE1-CB 3.66Å; F142-V146 HydrophobicContact CE1-CG1 4.09Å; F142-V146 HydrophobicContact CE1-CG2 4.04Å; F142-V146 HydrophobicContact CE2-CB 4.18Å; F142-V146 HydrophobicContact CE2-CG2 3.63Å; F142-V146 HydrophobicContact CZ-CB 3.6Å; F142-V146 HydrophobicContact CZ-CG1 4.05Å; F142-V146 HydrophobicContact CZ-CG2 3.44Å; F142-V146 VanDerWaalsContact CZ-CG2 3.44Å; F142-V146 PolarHBondContact O-N 3.25Å; F142-I191 HydrophobicContact CE2-CD1 4.48Å; F142-I191 HydrophobicContact CZ-CD1 4.26Å; F142-I497 HydrophobicContact CE2-CG2 4.39Å; F142-I497 HydrophobicContact CZ-CD1 4.46Å; F142-I501 HydrophobicContact CD2-CG1 3.81Å; F142-I501 HydrophobicContact CE2-CD1 4.49Å; F142-I501 HydrophobicContact CE2-CG1 3.81Å; F142-L528 HydrophobicContact CB-CD1 3.61Å; F142-L528 HydrophobicContact CB-CD2 4.17Å; F142-L528 HydrophobicContact CD1-CD1 4.01Å; F142-L528 HydrophobicContact CD2-CD2 3.92Å; F142-L528 HydrophobicContact CG-CD1 3.8Å; F142-L528 HydrophobicContact CG-CD2 4.04Å; F142-L532 HydrophobicContact CE1-CD2 4.39Å
143	Q	97.6	Very high	97.3	Very high	42 Å²	42	41.1 Å²	41.1	20%	0.196	24%	0.236	C	C	.	.	H	α-helix	trans	-68.4	-12.6	-179.6	-76.9	-176.5	-48.1	0	0	113.5	L139 D140 F145 V146 P147 D148	L139-Q143 HydrophobicContact CD1-CG 3.93Å; L139-Q143 HydrophobicContact CG-CG 4.17Å; L139-Q143 WeakPolarHBondContact O-CB 3.3Å; L139-Q143 WeakPolarHBondContact O-CG 3.29Å; L139-Q143 PolarHBondContact O-N 3.2Å; D140-Q143 PolarHBondContact O-N 2.66Å; Q143-F145 PolarHBondContact O-N 2.82Å; Q143-V146 CarbonylContact O-C 3.56Å; Q143-P147 VanDerWaalsContact O-CA 3.3Å; Q143-P147 WeakPolarHBondContact O-CA 3.16Å; Q143-D148 PolarHBondContact NE2-OD1 3.14Å
144	L	97.9	Very high	97.4	Very high	30 Å²	30	37.3 Å²	37.3	16%	0.157	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-28.6	166.5	-57.6	-176.3	0	0	0	112.4	M132 F141 F142 S259 T263 L507	M132-L144 HydrophobicContact CE-CD1 4.49Å; M132-L144 HydrophobicContact CE-CD2 4.42Å; M132-L144 HydrophobicContact SD-CD1 4.17Å; M132-L144 HydrophobicContact SD-CD2 4.25Å; F141-L144 HydrophobicContact CD1-CD1 4.35Å; F141-L144 WeakPolarHBondContact O-CB 3.47Å; F141-L144 WeakPolarHBondContact O-CG 3.45Å; F141-L144 PolarHBondContact O-N 3.47Å; F142-L144 PolarHBondContact O-N 3.45Å; L144-S259 WeakPolarHBondContact O-CB 3.35Å; L144-S259 PolarHBondContact O-OG 3.23Å; L144-T263 HydrophobicContact CB-CG2 3.99Å; L144-T263 HydrophobicContact CD1-CG2 4.46Å; L144-L507 HydrophobicContact CD1-CD1 3.7Å
145	F	98.3	Very high	97.6	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-28.4	-178.5	-55.9	-72.3	0	0	0	113.1	F142 Q143 P147 L256 F260 T263 F312 A500 N503 A504 L507	F142-F145 PolarHBondContact O-N 3.49Å; Q143-F145 PolarHBondContact O-N 2.82Å; F145-P147 WeakPolarHBondContact O-CD 3.33Å; F145-L256 HydrophobicContact CB-CD1 3.82Å; F145-L256 HydrophobicContact CD1-CD1 4.22Å; F145-L256 HydrophobicContact CG-CD1 4.43Å; F145-F260 AromaticContact CD1-CD1 3.62Å; F145-F260 HydrophobicContact CD1-CD1 3.62Å; F145-F260 AromaticContact CD1-CE1 3.67Å; F145-F260 HydrophobicContact CD1-CE1 3.67Å; F145-F260 AromaticContact CE1-CD1 3.57Å; F145-F260 HydrophobicContact CE1-CD1 3.57Å; F145-F260 AromaticContact CE1-CE1 3.93Å; F145-F260 HydrophobicContact CE1-CE1 3.93Å; F145-T263 HydrophobicContact CE1-CG2 4.45Å; F145-T263 WeakPolarHBondContact CE1-OG1 3.45Å; F145-F312 HydrophobicContact CE1-CE2 4.39Å; F145-F312 AromaticContact CE1-CZ 3.91Å; F145-F312 HydrophobicContact CE1-CZ 3.91Å; F145-F312 AromaticContact CZ-CE2 3.9Å; F145-F312 HydrophobicContact CZ-CE2 3.9Å; F145-F312 AromaticContact CZ-CZ 3.89Å; F145-F312 HydrophobicContact CZ-CZ 3.89Å; F145-A500 HydrophobicContact CB-CB 3.69Å; F145-A500 WeakPolarHBondContact CD2-O 2.84Å; F145-A500 HydrophobicContact CG-CB 4.2Å; F145-N503 HydrophobicContact CE1-CB 4.13Å; F145-N503 HydrophobicContact CE2-CB 4.02Å; F145-N503 HydrophobicContact CZ-CB 3.7Å; F145-A504 HydrophobicContact CD2-CB 4.03Å; F145-A504 HydrophobicContact CE2-CB 3.91Å; F145-L507 HydrophobicContact CE2-CD1 3.9Å; F145-L507 HydrophobicContact CZ-CD1 3.58Å; F145-L507 HydrophobicContact CZ-CG 4.44Å
146	V	97.9	Very high	97.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.178	C	C	.	.	S	Bend	trans	-125.7	70.6	176.2	-169	0	0	0	0	109.4	F142 Q143 C150 I151 M154 F252 I497	F142-V146 HydrophobicContact CD1-CB 4.29Å; F142-V146 HydrophobicContact CD2-CG2 4.39Å; F142-V146 HydrophobicContact CE1-CB 3.66Å; F142-V146 HydrophobicContact CE1-CG1 4.09Å; F142-V146 HydrophobicContact CE1-CG2 4.04Å; F142-V146 HydrophobicContact CE2-CB 4.18Å; F142-V146 HydrophobicContact CE2-CG2 3.63Å; F142-V146 HydrophobicContact CZ-CB 3.6Å; F142-V146 HydrophobicContact CZ-CG1 4.05Å; F142-V146 HydrophobicContact CZ-CG2 3.44Å; F142-V146 VanDerWaalsContact CZ-CG2 3.44Å; F142-V146 PolarHBondContact O-N 3.25Å; Q143-V146 CarbonylContact O-C 3.56Å; V146-C150 HydrophobicContact CG1-CB 4.36Å; V146-I151 HydrophobicContact CG1-CG1 4.18Å; V146-M154 HydrophobicContact CG1-CE 4.27Å; V146-F252 HydrophobicContact CG2-CE2 4.31Å; V146-F252 HydrophobicContact CG2-CZ 4.44Å; V146-I497 HydrophobicContact CG2-CD1 3.73Å
147	P	96.5	Very high	97.7	Very high	32 Å²	32	33.7 Å²	33.7	21%	0.208	18%	0.182	C	C	.	.			trans	-65.2	164.2	-179.6	23.9	-33.3	0	0	0	113	Q143 F145 N149 C150 I151	Q143-P147 VanDerWaalsContact O-CA 3.3Å; Q143-P147 WeakPolarHBondContact O-CA 3.16Å; F145-P147 WeakPolarHBondContact O-CD 3.33Å; P147-N149 VanDerWaalsContact CB-OD1 3.26Å; P147-N149 WeakPolarHBondContact CB-OD1 3.33Å; P147-N149 WeakPolarHBondContact CG-OD1 3.4Å; P147-N149 PolarHBondContact O-N 2.96Å; P147-C150 HydrophobicContact CG-CB 4.49Å; P147-C150 WeakPolarHBondContact O-CA 3.34Å; P147-C150 VanDerWaalsContact O-CB 3.29Å; P147-C150 WeakPolarHBondContact O-CB 3.47Å; P147-C150 PolarHBondContact O-N 3.4Å; P147-I151 PolarHBondContact O-N 3.19Å
148	D	96.1	Very high	97.7	Very high	86 Å²	86	31.4 Å²	31.4	46%	0.46	17%	0.168	S	C	.	.	H	α-helix	trans	-60.6	-29.8	-175.4	-77	-35.3	0	0	0	113.4	Q143 C150 I151 Q152 K184	Q143-D148 PolarHBondContact NE2-OD1 3.14Å; D148-C150 VanDerWaalsContact C-N 3.34Å; D148-C150 PolarHBondContact O-N 3.5Å; D148-I151 PolarHBondContact O-N 3.34Å; D148-Q152 WeakPolarHBondContact O-CB 3.33Å; D148-Q152 PolarHBondContact O-N 2.98Å; D148-K184 VanDerWaalsContact OD1-CE 3.25Å; D148-K184 WeakPolarHBondContact OD1-CE 3.21Å; D148-K184 IonicContact OD1-NZ 2.67Å; D148-K184 PolarHBondContact OD1-NZ 3.18Å
149	N	96.4	Very high	97.7	Very high	110 Å²	110	32.9 Å²	32.9	59%	0.588	18%	0.175	S	C	*	.	H	α-helix	trans	-65.7	-34.5	173.1	65.7	-25.4	0	0	0	112.4	P147 Q152 N153	P147-N149 VanDerWaalsContact CB-OD1 3.26Å; P147-N149 WeakPolarHBondContact CB-OD1 3.33Å; P147-N149 WeakPolarHBondContact CG-OD1 3.4Å; P147-N149 PolarHBondContact O-N 2.96Å; N149-Q152 PolarHBondContact O-N 3.24Å; N149-N153 WeakPolarHBondContact O-CB 3.45Å; N149-N153 PolarHBondContact O-N 2.97Å
150	C	97.1	Very high	97.6	Very high	13 Å²	13	35.4 Å²	35.4	9%	0.088	19%	0.187	C	C	.	.	H	α-helix	trans	-63.6	-45.6	171.4	-67.9	0	0	0	0	110.5	V146 P147 D148 Q152 N153 M154 S255	V146-C150 HydrophobicContact CG1-CB 4.36Å; P147-C150 HydrophobicContact CG-CB 4.49Å; P147-C150 WeakPolarHBondContact O-CA 3.34Å; P147-C150 VanDerWaalsContact O-CB 3.29Å; P147-C150 WeakPolarHBondContact O-CB 3.47Å; P147-C150 PolarHBondContact O-N 3.4Å; D148-C150 VanDerWaalsContact C-N 3.34Å; D148-C150 PolarHBondContact O-N 3.5Å; C150-Q152 VanDerWaalsContact C-N 3.34Å; C150-Q152 PolarHBondContact O-N 3.19Å; C150-N153 WeakPolarHBondContact O-CB 3.34Å; C150-N153 PolarHBondContact O-N 3.31Å; C150-M154 WeakPolarHBondContact O-CG 3.01Å; C150-M154 PolarHBondContact O-N 3.25Å; C150-S255 PolarHBondContact SG-OG 3.18Å
151	I	97.9	Very high	97.5	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-61.5	-44.9	178	-61	174.5	0	0	0	110.3	V146 P147 D148 N153 M154 V155 M183 K184	V146-I151 HydrophobicContact CG1-CG1 4.18Å; P147-I151 PolarHBondContact O-N 3.19Å; D148-I151 PolarHBondContact O-N 3.34Å; I151-N153 VanDerWaalsContact C-N 3.3Å; I151-N153 PolarHBondContact O-N 3.46Å; I151-M154 WeakPolarHBondContact O-CB 3.28Å; I151-M154 PolarHBondContact O-N 3.03Å; I151-M154 VanDerWaalsContact O-N 3.1Å; I151-V155 WeakPolarHBondContact O-CG2 3.48Å; I151-V155 PolarHBondContact O-N 3.32Å; I151-M183 HydrophobicContact CG2-CB 4.1Å; I151-M183 HydrophobicContact CG2-CG 3.99Å; I151-K184 HydrophobicContact CD1-CD 4.32Å; I151-K184 VanDerWaalsContact CD1-CE 3.49Å; I151-K184 HydrophobicContact CD1-CG 3.86Å; I151-K184 HydrophobicContact CG2-CG 4.25Å
152	Q	98	Very high	97.3	Very high	94 Å²	94	35 Å²	35	44%	0.439	18%	0.181	S	C	.	.	H	α-helix	trans	-63.2	-36.9	177.7	-170.3	58.3	30.5	0	0	111.9	D148 N149 C150 V155 T156	D148-Q152 WeakPolarHBondContact O-CB 3.33Å; D148-Q152 PolarHBondContact O-N 2.98Å; N149-Q152 PolarHBondContact O-N 3.24Å; C150-Q152 VanDerWaalsContact C-N 3.34Å; C150-Q152 PolarHBondContact O-N 3.19Å; Q152-V155 WeakPolarHBondContact O-CB 3.18Å; Q152-V155 PolarHBondContact O-N 3.21Å; Q152-T156 PolarHBondContact O-N 3.01Å; Q152-T156 PolarHBondContact O-OG1 2.97Å
153	N	97.6	Very high	97.1	Very high	57 Å²	57	41.5 Å²	41.5	31%	0.305	21%	0.21	S	C	.	.	H	α-helix	trans	-63.1	-42.8	172.4	-179.6	65.3	0	0	0	111.7	N149 C150 I151 V155 T156 Q157 I233	N149-N153 WeakPolarHBondContact O-CB 3.45Å; N149-N153 PolarHBondContact O-N 2.97Å; C150-N153 WeakPolarHBondContact O-CB 3.34Å; C150-N153 PolarHBondContact O-N 3.31Å; I151-N153 VanDerWaalsContact C-N 3.3Å; I151-N153 PolarHBondContact O-N 3.46Å; N153-V155 VanDerWaalsContact C-N 3.29Å; N153-V155 PolarHBondContact O-N 3.43Å; N153-T156 PolarHBondContact O-N 2.9Å; N153-Q157 WeakPolarHBondContact O-CB 3.36Å; N153-Q157 WeakPolarHBondContact O-CG 3.31Å; N153-Q157 PolarHBondContact O-N 3.45Å; N153-I233 PolarHBondContact ND2-O 3.4Å
154	M	98.3	Very high	96.8	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-58.6	-42.2	175.2	-60.4	178.9	-165.4	0	0	111.6	V146 C150 I151 T158 M183 L187 F231 I233 F252 F493	V146-M154 HydrophobicContact CG1-CE 4.27Å; C150-M154 WeakPolarHBondContact O-CG 3.01Å; C150-M154 PolarHBondContact O-N 3.25Å; I151-M154 WeakPolarHBondContact O-CB 3.28Å; I151-M154 PolarHBondContact O-N 3.03Å; I151-M154 VanDerWaalsContact O-N 3.1Å; M154-T158 WeakPolarHBondContact O-CB 3.47Å; M154-T158 PolarHBondContact O-N 3.49Å; M154-T158 PolarHBondContact O-OG1 3.27Å; M154-M183 HydrophobicContact CB-CE 3.95Å; M154-M183 HydrophobicContact CB-CG 3.97Å; M154-M183 HydrophobicContact CB-SD 3.92Å; M154-M183 HydrophobicContact SD-SD 4.48Å; M154-L187 HydrophobicContact SD-CD1 4.3Å; M154-L187 HydrophobicContact SD-CD2 4.43Å; M154-F231 HydrophobicContact CB-CE2 4.33Å; M154-F231 HydrophobicContact CG-CE2 4.41Å; M154-F231 HydrophobicContact SD-CE2 4.18Å; M154-F231 HydrophobicContact SD-CZ 4.4Å; M154-I233 HydrophobicContact CE-CD1 4.05Å; M154-I233 HydrophobicContact CG-CD1 3.57Å; M154-I233 HydrophobicContact SD-CD1 4.06Å; M154-F252 HydrophobicContact CE-CD2 4.04Å; M154-F252 HydrophobicContact CE-CE2 4.01Å; M154-F493 HydrophobicContact CE-CE2 3.78Å; M154-F493 HydrophobicContact CE-CZ 3.72Å; M154-F493 HydrophobicContact SD-CZ 4.12Å
155	V	98.6	Very high	96.4	Very high	7 Å²	7	45.7 Å²	45.7	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-59.2	-55.6	176.1	168.8	0	0	0	0	110.8	I151 Q152 N153 Q157 T158 N159 V178 A180 M183	I151-V155 WeakPolarHBondContact O-CG2 3.48Å; I151-V155 PolarHBondContact O-N 3.32Å; Q152-V155 WeakPolarHBondContact O-CB 3.18Å; Q152-V155 PolarHBondContact O-N 3.21Å; N153-V155 VanDerWaalsContact C-N 3.29Å; N153-V155 PolarHBondContact O-N 3.43Å; V155-Q157 VanDerWaalsContact C-N 3.34Å; V155-Q157 PolarHBondContact O-N 2.96Å; V155-T158 PolarHBondContact O-N 2.99Å; V155-N159 WeakPolarHBondContact O-CB 3.31Å; V155-N159 PolarHBondContact O-N 3.34Å; V155-N159 PolarHBondContact O-ND2 2.96Å; V155-V178 WeakPolarHBondContact CG1-O 3.44Å; V155-A180 HydrophobicContact CG2-CB 4.5Å; V155-M183 HydrophobicContact CG2-CB 3.64Å; V155-M183 HydrophobicContact CG2-CE 4.44Å; V155-M183 HydrophobicContact CG2-CG 4.12Å
156	T	98.2	Very high	96.1	Very high	61 Å²	61	47.7 Å²	47.7	37%	0.374	24%	0.236	S	C	.	.	H	α-helix	trans	-56.6	-49	-178.8	-64.3	0	0	0	0	111.1	Q152 N153 N159 M160	Q152-T156 PolarHBondContact O-N 3.01Å; Q152-T156 PolarHBondContact O-OG1 2.97Å; N153-T156 PolarHBondContact O-N 2.9Å; T156-N159 PolarHBondContact O-N 2.93Å; T156-M160 HydrophobicContact CG2-CG 4.38Å; T156-M160 HydrophobicContact CG2-SD 3.69Å; T156-M160 WeakPolarHBondContact O-CB 3.41Å; T156-M160 WeakPolarHBondContact O-CG 3.15Å; T156-M160 PolarHBondContact O-N 2.82Å
157	Q	97.3	Very high	95.8	Very high	35 Å²	35	54.1 Å²	54.1	16%	0.164	27%	0.266	C	S	.	.	H	α-helix	trans	-71.1	-35.9	-174.6	-64.4	-73.3	-21.9	0	0	112.2	N153 V155 Y161 H232 I233	N153-Q157 WeakPolarHBondContact O-CB 3.36Å; N153-Q157 WeakPolarHBondContact O-CG 3.31Å; N153-Q157 PolarHBondContact O-N 3.45Å; V155-Q157 VanDerWaalsContact C-N 3.34Å; V155-Q157 PolarHBondContact O-N 2.96Å; Q157-Y161 WeakPolarHBondContact O-CB 3.31Å; Q157-Y161 PolarHBondContact O-N 3.36Å; Q157-H232 WeakPolarHBondContact CB-O 3.18Å; Q157-I233 VanDerWaalsContact CG-O 3.25Å; Q157-I233 WeakPolarHBondContact CG-O 3.47Å
158	T	97.5	Very high	95.5	Very high	0 Å²	0	62 Å²	62	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.4	-47	173.4	-62.9	0	0	0	0	111.3	M154 V155 Y161 A162 W175 V178 M183 H232	M154-T158 WeakPolarHBondContact O-CB 3.47Å; M154-T158 PolarHBondContact O-N 3.49Å; M154-T158 PolarHBondContact O-OG1 3.27Å; V155-T158 PolarHBondContact O-N 2.99Å; T158-Y161 PolarHBondContact O-N 2.77Å; T158-A162 WeakPolarHBondContact O-CB 3.5Å; T158-A162 PolarHBondContact O-N 2.83Å; T158-W175 HydrophobicContact CG2-CH2 4.25Å; T158-V178 HydrophobicContact CG2-CG2 4.05Å; T158-M183 HydrophobicContact CG2-CE 4.41Å; T158-H232 PolarHBondContact OG1-N 2.96Å
159	N	97.8	Very high	95.2	Very high	33 Å²	33	63.7 Å²	63.7	18%	0.176	30%	0.295	C	S	.	.	H	α-helix	trans	-65.6	-41	178.3	-72.9	-27.4	0	0	0	112.5	V155 T156 A162 K163 P177 V178	V155-N159 WeakPolarHBondContact O-CB 3.31Å; V155-N159 PolarHBondContact O-N 3.34Å; V155-N159 PolarHBondContact O-ND2 2.96Å; T156-N159 PolarHBondContact O-N 2.93Å; N159-A162 PolarHBondContact O-N 2.82Å; N159-K163 PolarHBondContact O-N 3.01Å; N159-P177 WeakPolarHBondContact OD1-CA 3.38Å; N159-V178 PolarHBondContact ND2-N 2.7Å; N159-V178 PolarHBondContact ND2-O 3.42Å; N159-V178 PolarHBondContact OD1-N 2.63Å
160	M	96.1	Very high	94.8	Very high	80 Å²	80	60.5 Å²	60.5	39%	0.394	29%	0.288	S	S	.	.	H	α-helix	trans	-60.9	-44.7	174.4	-75.4	174.3	68	0	0	112	T156 K164 A235 F236	T156-M160 HydrophobicContact CG2-CG 4.38Å; T156-M160 HydrophobicContact CG2-SD 3.69Å; T156-M160 WeakPolarHBondContact O-CB 3.41Å; T156-M160 WeakPolarHBondContact O-CG 3.15Å; T156-M160 PolarHBondContact O-N 2.82Å; M160-K164 PolarHBondContact O-N 2.69Å; M160-A235 HydrophobicContact CB-CB 4.37Å; M160-F236 HydrophobicContact CB-CE2 4.27Å; M160-F236 HydrophobicContact CE-CD2 4.15Å; M160-F236 HydrophobicContact CE-CE2 3.86Å
161	Y	94.8	Very high	94.1	Very high	53 Å²	53	65.3 Å²	65.3	21%	0.208	32%	0.321	C	S	.	.	H	α-helix	trans	-65	-43.3	177.7	-179.4	-95.1	0	0	0	111.7	Q157 T158 K163 K164 F165 Y230 H232	Q157-Y161 WeakPolarHBondContact O-CB 3.31Å; Q157-Y161 PolarHBondContact O-N 3.36Å; T158-Y161 PolarHBondContact O-N 2.77Å; Y161-K163 PolarHBondContact O-N 3.45Å; Y161-K164 PolarHBondContact O-N 2.74Å; Y161-F165 HydrophobicContact CE1-CB 4.35Å; Y161-F165 HydrophobicContact CE1-CD2 4.21Å; Y161-F165 WeakPolarHBondContact O-CB 3.48Å; Y161-F165 PolarHBondContact O-N 2.82Å; Y161-Y230 AromaticContact CD1-CD1 3.8Å; Y161-Y230 HydrophobicContact CD1-CD1 3.8Å; Y161-Y230 AromaticContact CE1-CD1 3.9Å; Y161-Y230 HydrophobicContact CE1-CD1 3.9Å; Y161-H232 AromaticContact CD1-CE1 3.24Å; Y161-H232 WeakPolarHBondContact CD1-CE1 3.46Å; Y161-H232 AromaticContact CD1-ND1 3.25Å; Y161-H232 VanDerWaalsContact CD1-ND1 3.25Å; Y161-H232 WeakPolarHBondContact CD1-ND1 3.34Å; Y161-H232 AromaticContact CD2-CE1 3.48Å; Y161-H232 VanDerWaalsContact CD2-CE1 3.48Å; Y161-H232 WeakPolarHBondContact CD2-CE1 3.4Å; Y161-H232 AromaticContact CD2-ND1 3.71Å; Y161-H232 AromaticContact CD2-NE2 3.7Å; Y161-H232 AromaticContact CE1-CE1 3.25Å; Y161-H232 WeakPolarHBondContact CE1-CE1 3.47Å; Y161-H232 AromaticContact CE1-ND1 3.78Å; Y161-H232 AromaticContact CE2-CE1 3.47Å; Y161-H232 VanDerWaalsContact CE2-CE1 3.47Å; Y161-H232 WeakPolarHBondContact CE2-CE1 3.37Å; Y161-H232 AromaticContact CE2-NE2 3.59Å; Y161-H232 AromaticContact CG-CE1 3.36Å; Y161-H232 AromaticContact CG-CG 3.85Å; Y161-H232 AromaticContact CG-ND1 3.22Å; Y161-H232 AromaticContact CZ-CE1 3.35Å; Y161-H232 AromaticContact CZ-NE2 3.84Å
162	A	94.7	Very high	93.3	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-58.9	-47.4	177.8	0	0	0	0	0	112.1	T158 N159 K164 F165 Q166 W175 Y230	T158-A162 WeakPolarHBondContact O-CB 3.5Å; T158-A162 PolarHBondContact O-N 2.83Å; N159-A162 PolarHBondContact O-N 2.82Å; A162-K164 PolarHBondContact O-N 2.81Å; A162-F165 PolarHBondContact O-N 3.44Å; A162-Q166 WeakPolarHBondContact O-CG 3.37Å; A162-Q166 PolarHBondContact O-N 3.16Å; A162-W175 HydrophobicContact CB-CD2 4.2Å; A162-W175 HydrophobicContact CB-CH2 4.1Å; A162-W175 HydrophobicContact CB-CZ2 3.28Å; A162-Y230 HydrophobicContact CB-CD1 3.8Å; A162-Y230 HydrophobicContact CB-CD2 3.97Å; A162-Y230 HydrophobicContact CB-CE1 4.16Å; A162-Y230 HydrophobicContact CB-CE2 4.3Å; A162-Y230 HydrophobicContact CB-CG 3.67Å
163	K	94.1	Very high	92.6	Very high	136 Å²	136	72.1 Å²	72.1	59%	0.591	35%	0.353	S	S	*	.	H	α-helix	trans	-55.1	-52.7	176.3	-177.7	179.3	176.5	-179.6	0	111.6	N159 Y161 F165 Q166 E167	N159-K163 PolarHBondContact O-N 3.01Å; Y161-K163 PolarHBondContact O-N 3.45Å; K163-F165 VanDerWaalsContact C-N 3.31Å; K163-F165 PolarHBondContact O-N 3.29Å; K163-Q166 PolarHBondContact O-N 3.44Å; K163-E167 WeakPolarHBondContact CE-OE1 3.33Å; K163-E167 WeakPolarHBondContact O-CG 3.44Å; K163-E167 PolarHBondContact O-N 2.91Å
164	K	91.4	Very high	92	Very high	110 Å²	110	72.1 Å²	72.1	48%	0.478	37%	0.366	S	S	.	.	H	α-helix	trans	-65.1	-35.6	-179.2	-169.2	179.3	-170.2	168.7	0	112.8	M160 Y161 A162 R168 F236	M160-K164 PolarHBondContact O-N 2.69Å; Y161-K164 PolarHBondContact O-N 2.74Å; A162-K164 PolarHBondContact O-N 2.81Å; K164-R168 PolarHBondContact O-N 3.23Å; K164-F236 HydrophobicContact CB-CE1 4.13Å; K164-F236 HydrophobicContact CB-CZ 3.83Å; K164-F236 HydrophobicContact CD-CD1 3.89Å; K164-F236 HydrophobicContact CD-CE1 3.11Å; K164-F236 HydrophobicContact CD-CE2 4.41Å; K164-F236 HydrophobicContact CD-CZ 3.42Å; K164-F236 VanDerWaalsContact CD-CZ 3.42Å; K164-F236 HydrophobicContact CG-CE1 4.23Å; K164-F236 HydrophobicContact CG-CZ 4.27Å
165	F	90.9	Very high	91.8	Very high	51 Å²	51	73.9 Å²	73.9	22%	0.224	37%	0.373	C	S	.	.	H	α-helix	trans	-64	-43.8	176.1	-175	-81.8	0	0	0	110.7	Y161 A162 K163 R168 F169 Y230	Y161-F165 HydrophobicContact CE1-CB 4.35Å; Y161-F165 HydrophobicContact CE1-CD2 4.21Å; Y161-F165 WeakPolarHBondContact O-CB 3.48Å; Y161-F165 PolarHBondContact O-N 2.82Å; A162-F165 PolarHBondContact O-N 3.44Å; K163-F165 VanDerWaalsContact C-N 3.31Å; K163-F165 PolarHBondContact O-N 3.29Å; F165-R168 PolarHBondContact O-N 3.48Å; F165-F169 HydrophobicContact CD1-CB 4.37Å; F165-F169 HydrophobicContact CD1-CD2 4.07Å; F165-F169 AromaticContact CD2-CD2 3.61Å; F165-F169 HydrophobicContact CD2-CD2 3.61Å; F165-F169 AromaticContact CD2-CE2 3.85Å; F165-F169 HydrophobicContact CD2-CE2 3.85Å; F165-F169 HydrophobicContact CE1-CB 4.01Å; F165-F169 HydrophobicContact CE1-CD2 4.02Å; F165-F169 HydrophobicContact CE1-CG 4.37Å; F165-F169 AromaticContact CE2-CD2 3.54Å; F165-F169 HydrophobicContact CE2-CD2 3.54Å; F165-F169 AromaticContact CE2-CE2 3.8Å; F165-F169 HydrophobicContact CE2-CE2 3.8Å; F165-F169 HydrophobicContact CE2-CG 4.39Å; F165-F169 AromaticContact CG-CD2 3.88Å; F165-F169 HydrophobicContact CG-CD2 3.88Å; F165-F169 HydrophobicContact CZ-CB 4.28Å; F165-F169 AromaticContact CZ-CD2 3.76Å; F165-F169 HydrophobicContact CZ-CD2 3.76Å; F165-F169 HydrophobicContact CZ-CE2 4.41Å; F165-F169 HydrophobicContact CZ-CG 4.21Å; F165-F169 WeakPolarHBondContact O-CD2 3.17Å; F165-F169 PolarHBondContact O-N 3.48Å; F165-Y230 HydrophobicContact CB-CD1 4.39Å; F165-Y230 HydrophobicContact CB-CE1 3.78Å; F165-Y230 AromaticContact CD1-CE1 3.58Å; F165-Y230 HydrophobicContact CD1-CE1 3.58Å; F165-Y230 HydrophobicContact CE1-CE1 4.3Å; F165-Y230 AromaticContact CG-CE1 3.7Å; F165-Y230 HydrophobicContact CG-CE1 3.7Å
166	Q	92.1	Very high	91.6	Very high	42 Å²	42	76.6 Å²	76.6	20%	0.196	39%	0.391	C	S	.	.	H	α-helix	trans	-67.1	-39.4	178.5	-71	-177.8	-9	0	0	112.8	A162 K163 R168 G170	A162-Q166 WeakPolarHBondContact O-CG 3.37Å; A162-Q166 PolarHBondContact O-N 3.16Å; K163-Q166 PolarHBondContact O-N 3.44Å; Q166-R168 PolarHBondContact O-N 3Å; Q166-G170 WeakPolarHBondContact CA-O 3.34Å; Q166-G170 CarbonylContact O-C 3.6Å; Q166-G170 WeakPolarHBondContact O-CA 3.27Å; Q166-G170 PolarHBondContact O-N 3.29Å
167	E	91.4	Very high	91.5	Very high	135 Å²	135	78 Å²	78	63%	0.631	40%	0.402	S	S	*	.	H	α-helix	trans	-58.2	-33.1	173.1	-72.8	168	176	0	0	112.3	K163	K163-E167 WeakPolarHBondContact CE-OE1 3.33Å; K163-E167 WeakPolarHBondContact O-CG 3.44Å; K163-E167 PolarHBondContact O-N 2.91Å
168	R	90.4	Very high	91.5	Very high	196 Å²	196	76.6 Å²	76.6	74%	0.74	40%	0.395	S	S	*	.	H	α-helix	trans	-90.9	-36.5	-176.4	-173.4	173.5	-177.3	-164.8	2.6	114.2	K164 F165 Q166	K164-R168 PolarHBondContact O-N 3.23Å; F165-R168 PolarHBondContact O-N 3.48Å; Q166-R168 PolarHBondContact O-N 3Å
169	F	88.9	Confident	91.6	Very high	123 Å²	123	79.8 Å²	79.8	54%	0.539	42%	0.415	S	S	.	.	H	α-helix	trans	-118.1	7.2	-168.9	-59.5	-71.4	0	0	0	113.6	F165	F165-F169 HydrophobicContact CD1-CB 4.37Å; F165-F169 HydrophobicContact CD1-CD2 4.07Å; F165-F169 AromaticContact CD2-CD2 3.61Å; F165-F169 HydrophobicContact CD2-CD2 3.61Å; F165-F169 AromaticContact CD2-CE2 3.85Å; F165-F169 HydrophobicContact CD2-CE2 3.85Å; F165-F169 HydrophobicContact CE1-CB 4.01Å; F165-F169 HydrophobicContact CE1-CD2 4.02Å; F165-F169 HydrophobicContact CE1-CG 4.37Å; F165-F169 AromaticContact CE2-CD2 3.54Å; F165-F169 HydrophobicContact CE2-CD2 3.54Å; F165-F169 AromaticContact CE2-CE2 3.8Å; F165-F169 HydrophobicContact CE2-CE2 3.8Å; F165-F169 HydrophobicContact CE2-CG 4.39Å; F165-F169 AromaticContact CG-CD2 3.88Å; F165-F169 HydrophobicContact CG-CD2 3.88Å; F165-F169 HydrophobicContact CZ-CB 4.28Å; F165-F169 AromaticContact CZ-CD2 3.76Å; F165-F169 HydrophobicContact CZ-CD2 3.76Å; F165-F169 HydrophobicContact CZ-CE2 4.41Å; F165-F169 HydrophobicContact CZ-CG 4.21Å; F165-F169 WeakPolarHBondContact O-CD2 3.17Å; F165-F169 PolarHBondContact O-N 3.48Å
170	G	88.4	Confident	91.6	Very high	43 Å²	43	80 Å²	80	44%	0.443	42%	0.422	S	S	.	.			trans	96.3	154.7	-177.5	0	0	0	0	0	112.8	Q166 E172	Q166-G170 WeakPolarHBondContact CA-O 3.34Å; Q166-G170 CarbonylContact O-C 3.6Å; Q166-G170 WeakPolarHBondContact O-CA 3.27Å; Q166-G170 PolarHBondContact O-N 3.29Å; G170-E172 PolarHBondContact O-N 3.43Å
171	S	82.9	Confident	91.6	Very high	113 Å²	113	82.7 Å²	82.7	79%	0.79	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-65.7	132.1	177.2	47.7	0	0	0	0	110.7
172	E	80.2	Confident	91.8	Very high	54 Å²	54	82.2 Å²	82.2	25%	0.252	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-96.9	118.1	171.3	-172.4	173.3	161	0	0	108.6	G170 W175 K229 Y230	G170-E172 PolarHBondContact O-N 3.43Å; E172-W175 PolarHBondContact O-N 2.89Å; E172-K229 IonicContact OE1-NZ 2.94Å; E172-K229 IonicContact OE2-NZ 3.49Å; E172-K229 PolarHBondContact OE2-NZ 3.44Å; E172-Y230 PolarHBondContact OE2-OH 2.87Å
173	E	83.8	Confident	92	Very high	185 Å²	185	82.2 Å²	82.2	86%	0.864	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	137.7	-178.2	-162.5	175.3	-174	0	0	111.2	W175 K226	E173-W175 PolarHBondContact O-N 3.06Å; E173-K226 PolarHBondContact O-NZ 3.03Å
174	G	83.8	Confident	92.2	Very high	56 Å²	56	78 Å²	78	58%	0.577	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	24.1	178.6	0	0	0	0	0	115.3	K226	G174-K226 VanDerWaalsContact C-NZ 3.32Å; G174-K226 PolarHBondContact O-NZ 2.74Å
175	W	93.9	Very high	92.5	Very high	38 Å²	38	73.3 Å²	73.3	14%	0.144	40%	0.396	C	S	.	.			trans	-83.7	126.2	159.6	174.9	-105.2	0	0	0	110.2	T158 A162 E172 E173 V178 K226 I227 Y230	T158-W175 HydrophobicContact CG2-CH2 4.25Å; A162-W175 HydrophobicContact CB-CD2 4.2Å; A162-W175 HydrophobicContact CB-CH2 4.1Å; A162-W175 HydrophobicContact CB-CZ2 3.28Å; E172-W175 PolarHBondContact O-N 2.89Å; E173-W175 PolarHBondContact O-N 3.06Å; W175-V178 HydrophobicContact CH2-CG2 3.4Å; W175-V178 VanDerWaalsContact CH2-CG2 3.4Å; W175-V178 HydrophobicContact CZ2-CG2 3.94Å; W175-V178 HydrophobicContact CZ3-CG2 4.19Å; W175-K226 HydrophobicContact CE3-CB 4.13Å; W175-K226 HydrophobicContact CZ3-CB 4.18Å; W175-I227 HydrophobicContact CZ3-CG1 4.48Å; W175-Y230 HydrophobicContact CD2-CD2 4.06Å; W175-Y230 HydrophobicContact CD2-CE2 4.02Å; W175-Y230 AromaticContact CE3-CD2 3.56Å; W175-Y230 HydrophobicContact CE3-CD2 3.56Å; W175-Y230 AromaticContact CE3-CE2 3.74Å; W175-Y230 HydrophobicContact CE3-CE2 3.74Å; W175-Y230 AromaticContact CH2-CD2 3.75Å; W175-Y230 HydrophobicContact CH2-CD2 3.75Å; W175-Y230 HydrophobicContact CH2-CG 4.25Å; W175-Y230 HydrophobicContact CZ2-CD2 4.25Å; W175-Y230 AromaticContact CZ3-CD2 3.41Å; W175-Y230 HydrophobicContact CZ3-CD2 3.41Å; W175-Y230 VanDerWaalsContact CZ3-CD2 3.41Å; W175-Y230 HydrophobicContact CZ3-CE2 4.09Å; W175-Y230 HydrophobicContact CZ3-CG 4.31Å
176	C	94.4	Very high	92.8	Very high	64 Å²	64	70.9 Å²	70.9	43%	0.432	39%	0.385	S	S	.	.			trans	-120.4	150.5	165	55.8	0	0	0	0	110	V178 R223	C176-V178 PolarHBondContact O-N 3.33Å; C176-R223 PolarHBondContact O-NH1 2.62Å; C176-R223 PolarHBondContact O-NH2 3.11Å; C176-R223 PolarHBondContact SG-NH1 2.89Å; C176-R223 VanDerWaalsContact SG-NH1 3.43Å; C176-R223 PolarHBondContact SG-NH2 3.04Å; C176-R223 VanDerWaalsContact SG-NH2 3.35Å
177	P	96.9	Very high	93	Very high	91 Å²	91	68.9 Å²	68.9	59%	0.591	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-53.5	133.4	176.4	-26.1	35.1	0	0	0	111.9	N159	N159-P177 WeakPolarHBondContact OD1-CA 3.38Å
178	V	98.1	Very high	93.3	Very high	5 Å²	5	62.4 Å²	62.4	3%	0.03	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-68.2	139.5	176.7	-172.2	0	0	0	0	109.6	V155 T158 N159 W175 C176 E182 M183 I227	V155-V178 WeakPolarHBondContact CG1-O 3.44Å; T158-V178 HydrophobicContact CG2-CG2 4.05Å; N159-V178 PolarHBondContact ND2-N 2.7Å; N159-V178 PolarHBondContact ND2-O 3.42Å; N159-V178 PolarHBondContact OD1-N 2.63Å; W175-V178 HydrophobicContact CH2-CG2 3.4Å; W175-V178 VanDerWaalsContact CH2-CG2 3.4Å; W175-V178 HydrophobicContact CZ2-CG2 3.94Å; W175-V178 HydrophobicContact CZ3-CG2 4.19Å; C176-V178 PolarHBondContact O-N 3.33Å; V178-E182 WeakPolarHBondContact CA-OE2 3.47Å; V178-E182 HydrophobicContact CG1-CB 3.82Å; V178-M183 HydrophobicContact CG1-CB 4.37Å; V178-M183 HydrophobicContact CG1-CE 4.1Å; V178-I227 HydrophobicContact CG1-CD1 4.17Å; V178-I227 HydrophobicContact CG2-CD1 4.29Å; V178-I227 HydrophobicContact CG2-CG1 3.91Å
179	T	98.2	Very high	93.5	Very high	68 Å²	68	53.1 Å²	53.1	42%	0.417	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-97.8	167	172.8	68.8	0	0	0	0	112	Q181 E182 M183	T179-Q181 VanDerWaalsContact C-N 3.26Å; T179-Q181 PolarHBondContact O-N 2.65Å; T179-E182 PolarHBondContact N-OE2 3.03Å; T179-E182 VanDerWaalsContact N-OE2 3.13Å; T179-E182 PolarHBondContact O-N 3.4Å; T179-E182 WeakPolarHBondContact OG1-CG 3.23Å; T179-E182 PolarHBondContact OG1-N 3.23Å; T179-E182 VanDerWaalsContact OG1-N 3.13Å; T179-M183 PolarHBondContact O-N 3.44Å
180	A	98.1	Very high	93.8	Very high	38 Å²	38	47.2 Å²	47.2	31%	0.314	29%	0.285	S	S	.	.	H	α-helix	trans	-60.4	-36.7	173.7	0	0	0	0	0	112.5	V155 M183 K184	V155-A180 HydrophobicContact CG2-CB 4.5Å; A180-M183 PolarHBondContact O-N 2.93Å; A180-K184 WeakPolarHBondContact O-CG 3.45Å; A180-K184 PolarHBondContact O-N 3.44Å
181	Q	97.3	Very high	94.1	Very high	135 Å²	135	45.2 Å²	45.2	63%	0.631	26%	0.264	S	S	*	.	H	α-helix	trans	-65.5	-45.3	175.9	-171.7	179.7	13.7	0	0	111.4	T179 M183 K184 A185	T179-Q181 VanDerWaalsContact C-N 3.26Å; T179-Q181 PolarHBondContact O-N 2.65Å; Q181-M183 VanDerWaalsContact C-N 3.3Å; Q181-M183 PolarHBondContact O-N 3.19Å; Q181-K184 PolarHBondContact O-N 2.89Å; Q181-A185 WeakPolarHBondContact O-CB 3.4Å; Q181-A185 PolarHBondContact O-N 3.35Å
182	E	97.9	Very high	94.6	Very high	43 Å²	43	40 Å²	40	20%	0.201	23%	0.227	C	C	.	.	H	α-helix	trans	-64.3	-34.9	175.2	-73.8	-176.4	115.5	0	0	112.3	V178 T179 A185 F186 M219 R223 I227	V178-E182 WeakPolarHBondContact CA-OE2 3.47Å; V178-E182 HydrophobicContact CG1-CB 3.82Å; T179-E182 PolarHBondContact N-OE2 3.03Å; T179-E182 VanDerWaalsContact N-OE2 3.13Å; T179-E182 PolarHBondContact O-N 3.4Å; T179-E182 WeakPolarHBondContact OG1-CG 3.23Å; T179-E182 PolarHBondContact OG1-N 3.23Å; T179-E182 VanDerWaalsContact OG1-N 3.13Å; E182-A185 PolarHBondContact O-N 3.09Å; E182-F186 WeakPolarHBondContact O-CB 3.46Å; E182-F186 PolarHBondContact O-N 3.37Å; E182-M219 HydrophobicContact CB-CE 4.02Å; E182-M219 HydrophobicContact CG-CE 4.21Å; E182-R223 VanDerWaalsContact CD-NH2 3.32Å; E182-R223 IonicContact OE1-CZ 3.93Å; E182-R223 IonicContact OE1-NE 3.63Å; E182-R223 PolarHBondContact OE1-NE 3.21Å; E182-R223 IonicContact OE1-NH2 3.82Å; E182-R223 PolarHBondContact OE1-NH2 3.06Å; E182-R223 IonicContact OE2-CZ 2.77Å; E182-R223 IonicContact OE2-NE 3.81Å; E182-R223 IonicContact OE2-NH2 2.73Å; E182-R223 PolarHBondContact OE2-NH2 3.01Å; E182-I227 HydrophobicContact CB-CD1 4.33Å
183	M	98.6	Very high	95	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-69	-40.8	175.8	-172.6	59.8	67.7	0	0	111.9	I151 M154 V155 T158 V178 T179 A180 Q181 A185 F186 L187 F231	I151-M183 HydrophobicContact CG2-CB 4.1Å; I151-M183 HydrophobicContact CG2-CG 3.99Å; M154-M183 HydrophobicContact CB-CE 3.95Å; M154-M183 HydrophobicContact CB-CG 3.97Å; M154-M183 HydrophobicContact CB-SD 3.92Å; M154-M183 HydrophobicContact SD-SD 4.48Å; V155-M183 HydrophobicContact CG2-CB 3.64Å; V155-M183 HydrophobicContact CG2-CE 4.44Å; V155-M183 HydrophobicContact CG2-CG 4.12Å; T158-M183 HydrophobicContact CG2-CE 4.41Å; V178-M183 HydrophobicContact CG1-CB 4.37Å; V178-M183 HydrophobicContact CG1-CE 4.1Å; T179-M183 PolarHBondContact O-N 3.44Å; A180-M183 PolarHBondContact O-N 2.93Å; Q181-M183 VanDerWaalsContact C-N 3.3Å; Q181-M183 PolarHBondContact O-N 3.19Å; M183-A185 VanDerWaalsContact C-N 3.33Å; M183-F186 PolarHBondContact O-N 3.08Å; M183-F186 HydrophobicContact SD-CD1 3.94Å; M183-L187 WeakPolarHBondContact O-CG 3.11Å; M183-L187 PolarHBondContact O-N 3.31Å; M183-F231 HydrophobicContact CE-CD2 4.19Å; M183-F231 HydrophobicContact CE-CE2 4.43Å; M183-F231 HydrophobicContact SD-CD2 4.09Å; M183-F231 HydrophobicContact SD-CE2 3.93Å
184	K	98.2	Very high	95.2	Very high	48 Å²	48	28.7 Å²	28.7	21%	0.209	18%	0.175	C	C	.	.	H	α-helix	trans	-58.8	-46.5	170.9	-76.5	179.8	-178.3	-172.8	0	110.8	D148 I151 A180 Q181 F186 L187 G188 L532	D148-K184 VanDerWaalsContact OD1-CE 3.25Å; D148-K184 WeakPolarHBondContact OD1-CE 3.21Å; D148-K184 IonicContact OD1-NZ 2.67Å; D148-K184 PolarHBondContact OD1-NZ 3.18Å; I151-K184 HydrophobicContact CD1-CD 4.32Å; I151-K184 VanDerWaalsContact CD1-CE 3.49Å; I151-K184 HydrophobicContact CD1-CG 3.86Å; I151-K184 HydrophobicContact CG2-CG 4.25Å; A180-K184 WeakPolarHBondContact O-CG 3.45Å; A180-K184 PolarHBondContact O-N 3.44Å; Q181-K184 PolarHBondContact O-N 2.89Å; K184-F186 PolarHBondContact O-N 3.13Å; K184-L187 PolarHBondContact O-N 3.31Å; K184-G188 PolarHBondContact O-N 3.01Å; K184-L532 CarbonylContact C-O 3.49Å; K184-L532 HydrophobicContact CB-CD2 4.24Å; K184-L532 HydrophobicContact CG-CD2 4.39Å
185	A	97.4	Very high	95.3	Very high	11 Å²	11	27 Å²	27	9%	0.091	15%	0.154	C	C	.	.	H	α-helix	trans	-60.1	-47.9	176.2	0	0	0	0	0	111.5	Q181 E182 M183 L187 G188 F189 M219 L532 L533	Q181-A185 WeakPolarHBondContact O-CB 3.4Å; Q181-A185 PolarHBondContact O-N 3.35Å; E182-A185 PolarHBondContact O-N 3.09Å; M183-A185 VanDerWaalsContact C-N 3.33Å; A185-L187 VanDerWaalsContact C-N 3.33Å; A185-L187 PolarHBondContact O-N 3.14Å; A185-G188 CarbonylContact O-C 3.5Å; A185-G188 WeakPolarHBondContact O-CA 3.43Å; A185-G188 PolarHBondContact O-N 2.89Å; A185-F189 HydrophobicContact CB-CE2 4.47Å; A185-F189 WeakPolarHBondContact O-CD2 3.16Å; A185-F189 PolarHBondContact O-N 3.27Å; A185-M219 HydrophobicContact CB-CE 4.15Å; A185-L532 PolarHBondContact N-O 3.11Å; A185-L533 HydrophobicContact CB-CD2 4.04Å; A185-L533 WeakPolarHBondContact O-CD2 3.31Å
186	F	97.6	Very high	94.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-54.6	-45.2	176.6	172.9	-101.3	0	0	0	112.4	E182 M183 K184 F189 V190 F224 I227 L228 F231 W494	E182-F186 WeakPolarHBondContact O-CB 3.46Å; E182-F186 PolarHBondContact O-N 3.37Å; M183-F186 PolarHBondContact O-N 3.08Å; M183-F186 HydrophobicContact SD-CD1 3.94Å; K184-F186 PolarHBondContact O-N 3.13Å; F186-F189 PolarHBondContact O-N 3.47Å; F186-V190 HydrophobicContact CE2-CG2 4.38Å; F186-V190 HydrophobicContact CZ-CG2 4.26Å; F186-V190 WeakPolarHBondContact O-CG2 3.3Å; F186-V190 PolarHBondContact O-N 3.48Å; F186-V190 VanDerWaalsContact O-N 3.16Å; F186-F224 AromaticContact CD2-CD2 3.7Å; F186-F224 HydrophobicContact CD2-CD2 3.7Å; F186-F224 AromaticContact CD2-CE2 3.43Å; F186-F224 HydrophobicContact CD2-CE2 3.43Å; F186-F224 VanDerWaalsContact CD2-CE2 3.43Å; F186-F224 HydrophobicContact CD2-CZ 4.28Å; F186-F224 HydrophobicContact CE2-CD2 4.14Å; F186-F224 AromaticContact CE2-CE2 3.58Å; F186-F224 HydrophobicContact CE2-CE2 3.58Å; F186-F224 AromaticContact CE2-CZ 3.97Å; F186-F224 HydrophobicContact CE2-CZ 3.97Å; F186-F224 HydrophobicContact CG-CE2 4.49Å; F186-I227 HydrophobicContact CB-CG2 4.15Å; F186-I227 HydrophobicContact CD1-CG2 4.23Å; F186-I227 HydrophobicContact CD2-CB 4.11Å; F186-I227 HydrophobicContact CD2-CG2 3.55Å; F186-I227 HydrophobicContact CE2-CB 4.48Å; F186-I227 HydrophobicContact CE2-CG2 3.97Å; F186-I227 HydrophobicContact CG-CG2 3.71Å; F186-I227 HydrophobicContact CZ-CG2 4.47Å; F186-L228 HydrophobicContact CE2-CB 3.98Å; F186-L228 HydrophobicContact CE2-CD1 4.03Å; F186-L228 HydrophobicContact CZ-CB 4.48Å; F186-L228 HydrophobicContact CZ-CD1 3.87Å; F186-F231 HydrophobicContact CD1-CD2 4.23Å; F186-F231 HydrophobicContact CD1-CE2 4.45Å; F186-F231 HydrophobicContact CE1-CB 4.29Å; F186-F231 HydrophobicContact CE1-CD1 4.3Å; F186-F231 AromaticContact CE1-CD2 3.61Å; F186-F231 HydrophobicContact CE1-CD2 3.61Å; F186-F231 AromaticContact CE1-CE2 3.94Å; F186-F231 HydrophobicContact CE1-CE2 3.94Å; F186-F231 AromaticContact CE1-CG 3.8Å; F186-F231 HydrophobicContact CE1-CG 3.8Å; F186-F231 HydrophobicContact CE1-CZ 4.43Å; F186-F231 HydrophobicContact CZ-CB 4.18Å; F186-F231 HydrophobicContact CZ-CD2 4.33Å; F186-F231 HydrophobicContact CZ-CG 4.11Å; F186-W494 AromaticContact CE1-CH2 3.81Å; F186-W494 HydrophobicContact CE1-CH2 3.81Å; F186-W494 HydrophobicContact CE1-CZ2 4.03Å; F186-W494 HydrophobicContact CZ-CH2 4.35Å; F186-W494 HydrophobicContact CZ-CZ2 4.2Å
187	L	97.5	Very high	93.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.7	-44.4	172.8	-66.9	175.2	0	0	0	111.2	M154 M183 K184 A185 F189 V190 I191 F493 W494	M154-L187 HydrophobicContact SD-CD1 4.3Å; M154-L187 HydrophobicContact SD-CD2 4.43Å; M183-L187 WeakPolarHBondContact O-CG 3.11Å; M183-L187 PolarHBondContact O-N 3.31Å; K184-L187 PolarHBondContact O-N 3.31Å; A185-L187 VanDerWaalsContact C-N 3.33Å; A185-L187 PolarHBondContact O-N 3.14Å; L187-F189 PolarHBondContact O-N 2.87Å; L187-V190 PolarHBondContact O-N 2.83Å; L187-I191 HydrophobicContact CB-CD1 4.28Å; L187-I191 VanDerWaalsContact O-CB 3.31Å; L187-I191 WeakPolarHBondContact O-CB 3.5Å; L187-I191 WeakPolarHBondContact O-CD1 3.2Å; L187-I191 WeakPolarHBondContact O-CG1 3Å; L187-I191 PolarHBondContact O-N 3.43Å; L187-F493 HydrophobicContact CD2-CE1 4.36Å; L187-F493 HydrophobicContact CD2-CZ 4.29Å; L187-W494 HydrophobicContact CD2-CH2 3.91Å; L187-W494 HydrophobicContact CD2-CZ3 3.73Å
188	G	96.4	Very high	92.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-56.3	-45.6	176.2	0	0	0	0	0	113.2	K184 A185 I191 S192	K184-G188 PolarHBondContact O-N 3.01Å; A185-G188 CarbonylContact O-C 3.5Å; A185-G188 WeakPolarHBondContact O-CA 3.43Å; A185-G188 PolarHBondContact O-N 2.89Å; G188-I191 PolarHBondContact O-N 3.32Å; G188-S192 WeakPolarHBondContact O-CB 3.48Å; G188-S192 PolarHBondContact O-N 2.93Å
189	F	95.1	Very high	91.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.2	-49.3	174.1	-81.4	-81.9	0	0	0	111.8	A185 F186 L187 S192 V201 I204 W205 I215 K218 M219 F224 L533	A185-F189 HydrophobicContact CB-CE2 4.47Å; A185-F189 WeakPolarHBondContact O-CD2 3.16Å; A185-F189 PolarHBondContact O-N 3.27Å; F186-F189 PolarHBondContact O-N 3.47Å; L187-F189 PolarHBondContact O-N 2.87Å; F189-S192 WeakPolarHBondContact O-CB 3.2Å; F189-S192 PolarHBondContact O-N 2.95Å; F189-S192 PolarHBondContact O-OG 3.17Å; F189-V201 HydrophobicContact CB-CG1 3.93Å; F189-I204 HydrophobicContact CD1-CD1 3.71Å; F189-I204 HydrophobicContact CD1-CG2 4.35Å; F189-I204 HydrophobicContact CE1-CD1 4.46Å; F189-I204 HydrophobicContact CE1-CG2 4.06Å; F189-W205 AromaticContact CD1-CH2 3.29Å; F189-W205 HydrophobicContact CD1-CH2 3.29Å; F189-W205 AromaticContact CD1-CZ2 3.68Å; F189-W205 HydrophobicContact CD1-CZ2 3.68Å; F189-W205 HydrophobicContact CD1-CZ3 4.11Å; F189-W205 AromaticContact CE1-CE2 3.98Å; F189-W205 AromaticContact CE1-CH2 3.32Å; F189-W205 HydrophobicContact CE1-CH2 3.32Å; F189-W205 AromaticContact CE1-CZ2 3.13Å; F189-W205 HydrophobicContact CE1-CZ2 3.13Å; F189-W205 HydrophobicContact CE1-CZ3 4.29Å; F189-W205 HydrophobicContact CE2-CZ2 4.44Å; F189-W205 HydrophobicContact CG-CH2 4.02Å; F189-W205 HydrophobicContact CG-CZ2 4.49Å; F189-W205 HydrophobicContact CZ-CH2 4.11Å; F189-W205 AromaticContact CZ-CZ2 3.62Å; F189-W205 HydrophobicContact CZ-CZ2 3.62Å; F189-I215 HydrophobicContact CD1-CG2 3.57Å; F189-I215 HydrophobicContact CE1-CG2 3.29Å; F189-I215 HydrophobicContact CG-CG2 4.43Å; F189-I215 HydrophobicContact CZ-CG2 3.91Å; F189-I215 WeakPolarHBondContact CZ-O 3.43Å; F189-K218 HydrophobicContact CE2-CB 4.32Å; F189-K218 HydrophobicContact CZ-CB 4.19Å; F189-M219 HydrophobicContact CE2-CB 3.57Å; F189-M219 HydrophobicContact CZ-CB 3.8Å; F189-F224 HydrophobicContact CB-CD2 4.02Å; F189-F224 HydrophobicContact CB-CE2 3.65Å; F189-F224 HydrophobicContact CD2-CD2 4.32Å; F189-F224 HydrophobicContact CG-CD2 4.16Å; F189-F224 HydrophobicContact CG-CE2 4.29Å; F189-L533 HydrophobicContact CD2-CD2 3.76Å; F189-L533 HydrophobicContact CE2-CD2 3.67Å; F189-L533 HydrophobicContact CG-CD2 4.41Å; F189-L533 HydrophobicContact CZ-CD2 4.31Å
190	V	94.8	Very high	90.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-67.5	-43.2	-179.9	-179	0	0	0	0	111.5	F186 L187 S192 T193 V201 F224 I481 H483 W494	F186-V190 HydrophobicContact CE2-CG2 4.38Å; F186-V190 HydrophobicContact CZ-CG2 4.26Å; F186-V190 WeakPolarHBondContact O-CG2 3.3Å; F186-V190 PolarHBondContact O-N 3.48Å; F186-V190 VanDerWaalsContact O-N 3.16Å; L187-V190 PolarHBondContact O-N 2.83Å; V190-S192 VanDerWaalsContact C-N 3.26Å; V190-S192 PolarHBondContact O-N 3.49Å; V190-T193 WeakPolarHBondContact O-CB 3.26Å; V190-T193 PolarHBondContact O-N 2.77Å; V190-T193 PolarHBondContact O-OG1 3.37Å; V190-V201 HydrophobicContact CB-CG2 4.49Å; V190-V201 HydrophobicContact CG2-CG2 4.24Å; V190-F224 HydrophobicContact CG2-CE2 4.18Å; V190-F224 HydrophobicContact CG2-CZ 4.1Å; V190-I481 HydrophobicContact CG1-CD1 4.5Å; V190-I481 HydrophobicContact CG1-CG2 3.65Å; V190-H483 HydrophobicContact CG1-CB 4.01Å; V190-W494 HydrophobicContact CB-CE3 4.41Å; V190-W494 HydrophobicContact CB-CH2 3.72Å; V190-W494 HydrophobicContact CB-CZ2 4.18Å; V190-W494 HydrophobicContact CB-CZ3 3.84Å; V190-W494 HydrophobicContact CG1-CD2 3.81Å; V190-W494 HydrophobicContact CG1-CE3 3.69Å; V190-W494 HydrophobicContact CG1-CH2 3.7Å; V190-W494 HydrophobicContact CG1-CZ2 3.82Å; V190-W494 HydrophobicContact CG1-CZ3 3.62Å; V190-W494 HydrophobicContact CG2-CH2 3.69Å; V190-W494 HydrophobicContact CG2-CZ2 3.88Å; V190-W494 HydrophobicContact CG2-CZ3 4.33Å
191	I	95.4	Very high	89.7	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.1	-33.7	178.7	-70	165.8	0	0	0	111.3	F142 L187 G188 T193 S194 I481 I497 I501 V529 L532	F142-I191 HydrophobicContact CE2-CD1 4.48Å; F142-I191 HydrophobicContact CZ-CD1 4.26Å; L187-I191 HydrophobicContact CB-CD1 4.28Å; L187-I191 VanDerWaalsContact O-CB 3.31Å; L187-I191 WeakPolarHBondContact O-CB 3.5Å; L187-I191 WeakPolarHBondContact O-CD1 3.2Å; L187-I191 WeakPolarHBondContact O-CG1 3Å; L187-I191 PolarHBondContact O-N 3.43Å; G188-I191 PolarHBondContact O-N 3.32Å; I191-T193 PolarHBondContact O-N 3.34Å; I191-S194 VanDerWaalsContact O-CB 3.31Å; I191-S194 WeakPolarHBondContact O-CB 3.49Å; I191-S194 PolarHBondContact O-N 2.65Å; I191-S194 PolarHBondContact O-OG 3.1Å; I191-I481 HydrophobicContact CG1-CD1 4.01Å; I191-I497 HydrophobicContact CD1-CG2 4.14Å; I191-I497 HydrophobicContact CG1-CG2 4.15Å; I191-I501 HydrophobicContact CD1-CD1 4.02Å; I191-I501 HydrophobicContact CG1-CD1 3.97Å; I191-I501 HydrophobicContact CG2-CD1 3.78Å; I191-V529 HydrophobicContact CB-CG2 4.31Å; I191-V529 HydrophobicContact CG2-CG2 3.77Å; I191-L532 HydrophobicContact CD1-CD1 3.62Å
192	S	92.9	Very high	89.3	Confident	3 Å²	3	27.9 Å²	27.9	2%	0.021	14%	0.136	C	C	.	.	H	α-helix	trans	-55	-27.2	177.4	79.3	0	0	0	0	113.7	G188 F189 V190 S194 V195 H196 I204	G188-S192 WeakPolarHBondContact O-CB 3.48Å; G188-S192 PolarHBondContact O-N 2.93Å; F189-S192 WeakPolarHBondContact O-CB 3.2Å; F189-S192 PolarHBondContact O-N 2.95Å; F189-S192 PolarHBondContact O-OG 3.17Å; V190-S192 VanDerWaalsContact C-N 3.26Å; V190-S192 PolarHBondContact O-N 3.49Å; S192-S194 PolarHBondContact O-N 2.84Å; S192-V195 PolarHBondContact O-N 3.04Å; S192-V195 VanDerWaalsContact O-N 3.08Å; S192-H196 PolarHBondContact O-CD2 3.38Å; S192-H196 PolarHBondContact O-N 3.33Å; S192-I204 WeakPolarHBondContact OG-CD1 3.41Å
193	T	89.4	Confident	88.7	Confident	2 Å²	2	27.3 Å²	27.3	1%	0.012	14%	0.137	C	C	.	.	H	α-helix	trans	-65.2	-27.4	175.9	64.4	0	0	0	0	113.1	V190 I191 V195 R197 C198 V201 F482 H483	V190-T193 WeakPolarHBondContact O-CB 3.26Å; V190-T193 PolarHBondContact O-N 2.77Å; V190-T193 PolarHBondContact O-OG1 3.37Å; I191-T193 PolarHBondContact O-N 3.34Å; T193-V195 PolarHBondContact O-N 2.94Å; T193-R197 VanDerWaalsContact O-CA 3.27Å; T193-R197 WeakPolarHBondContact O-CA 3.44Å; T193-R197 PolarHBondContact O-N 3.39Å; T193-C198 WeakPolarHBondContact CB-O 3.48Å; T193-V201 HydrophobicContact CG2-CB 4.25Å; T193-V201 HydrophobicContact CG2-CG2 3.51Å; T193-F482 WeakPolarHBondContact O-CD2 3.16Å; T193-F482 PolarHBondContact OG1-N 2.95Å; T193-H483 PolarHBondContact OG1-N 3.12Å
194	S	88.3	Confident	88.3	Confident	1 Å²	1	28 Å²	28	1%	0.007	14%	0.14	C	C	.	.	H	α-helix	trans	-71.2	-20.7	174.9	72.1	0	0	0	0	113.6	I191 S192 Y479	I191-S194 VanDerWaalsContact O-CB 3.31Å; I191-S194 WeakPolarHBondContact O-CB 3.49Å; I191-S194 PolarHBondContact O-N 2.65Å; I191-S194 PolarHBondContact O-OG 3.1Å; S192-S194 PolarHBondContact O-N 2.84Å; S194-Y479 VanDerWaalsContact CB-O 3.29Å; S194-Y479 WeakPolarHBondContact CB-O 3.32Å
195	V	84.1	Confident	88	Confident	21 Å²	21	27.8 Å²	27.8	13%	0.127	14%	0.138	C	C	.	.	H	α-helix	trans	-95.3	-50.7	-177.9	175.4	0	0	0	0	110.1	S192 T193 E526 V529	S192-V195 PolarHBondContact O-N 3.04Å; S192-V195 VanDerWaalsContact O-N 3.08Å; T193-V195 PolarHBondContact O-N 2.94Å; V195-E526 HydrophobicContact CG1-CG 3.34Å; V195-V529 HydrophobicContact CG2-CG2 4.4Å
196	H	77.6	Confident	87.5	Confident	89 Å²	89	29.8 Å²	29.8	41%	0.412	15%	0.151	S	C	.	.	H	α-helix	trans	-89.5	0.1	-176.1	-58.7	-58.1	0	0	0	113.9	S192 C198	S192-H196 PolarHBondContact O-CD2 3.38Å; S192-H196 PolarHBondContact O-N 3.33Å; H196-C198 VanDerWaalsContact C-N 3.27Å; H196-C198 PolarHBondContact O-N 3.22Å
197	R	73.1	Confident	86.9	Confident	128 Å²	128	35.9 Å²	35.9	48%	0.483	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	46.6	-179.4	-61	-165.4	176.4	138.9	-1.4	113.6	T193 K478 F482	T193-R197 VanDerWaalsContact O-CA 3.27Å; T193-R197 WeakPolarHBondContact O-CA 3.44Å; T193-R197 PolarHBondContact O-N 3.39Å; R197-K478 PolarHBondContact NE-O 3.04Å; R197-K478 VanDerWaalsContact NH2-CD 3.33Å; R197-K478 VanDerWaalsContact NH2-CG 3.3Å; R197-F482 HydrophobicContact CB-CD2 4.49Å; R197-F482 HydrophobicContact CB-CE2 4.21Å; R197-F482 HydrophobicContact CB-CZ 4.32Å; R197-F482 HydrophobicContact CG-CD2 4.37Å; R197-F482 HydrophobicContact CG-CE2 3.73Å; R197-F482 HydrophobicContact CG-CZ 3.97Å
198	C	75.8	Confident	86.1	Confident	13 Å²	13	37.6 Å²	37.6	9%	0.088	21%	0.212	C	C	.	.			trans	-98.8	129.4	175.8	-174.2	0	0	0	0	110.1	T193 H196 S200 S203 F210 F482	T193-C198 WeakPolarHBondContact CB-O 3.48Å; H196-C198 VanDerWaalsContact C-N 3.27Å; H196-C198 PolarHBondContact O-N 3.22Å; C198-S200 PolarHBondContact O-N 2.99Å; C198-S200 PolarHBondContact SG-O 3.49Å; C198-S203 WeakPolarHBondContact SG-CB 3.34Å; C198-S203 PolarHBondContact SG-OG 3.32Å; C198-F210 HydrophobicContact CB-CB 4.33Å; C198-F210 HydrophobicContact CB-CD1 4.06Å; C198-F210 HydrophobicContact CB-CG 4.2Å; C198-F482 WeakPolarHBondContact O-CB 3.48Å
199	E	69	Low	85.4	Confident	119 Å²	119	46.7 Å²	46.7	56%	0.556	25%	0.252	S	S	*	.	S	Bend	trans	-65.5	-28.2	179.8	-62.7	-160.8	118.1	0	0	113.4	K484	E199-K484 IonicContact OE1-NZ 3.44Å; E199-K484 PolarHBondContact OE1-NZ 3.42Å
200	S	80.8	Confident	84.8	Confident	45 Å²	45	51.3 Å²	51.3	32%	0.315	27%	0.272	S	S	.	.			trans	-124.8	122	-177.3	-174.9	0	0	0	0	111.3	C198 L202 S203	C198-S200 PolarHBondContact O-N 2.99Å; C198-S200 PolarHBondContact SG-O 3.49Å; S200-L202 PolarHBondContact O-N 3.39Å; S200-L202 VanDerWaalsContact O-N 3.13Å; S200-L202 PolarHBondContact OG-N 3.39Å; S200-S203 WeakPolarHBondContact O-CB 3.37Å; S200-S203 PolarHBondContact O-N 3Å; S200-S203 VanDerWaalsContact O-N 3.09Å; S200-S203 PolarHBondContact O-OG 2.9Å
201	V	86	Confident	84.4	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.012	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-56.3	-29.9	171.9	-171.4	0	0	0	0	111.1	F189 V190 T193 S203 I204 W205 F224 H483	F189-V201 HydrophobicContact CB-CG1 3.93Å; V190-V201 HydrophobicContact CB-CG2 4.49Å; V190-V201 HydrophobicContact CG2-CG2 4.24Å; T193-V201 HydrophobicContact CG2-CB 4.25Å; T193-V201 HydrophobicContact CG2-CG2 3.51Å; V201-S203 PolarHBondContact O-N 3.38Å; V201-I204 HydrophobicContact CG1-CD1 3.88Å; V201-I204 WeakPolarHBondContact O-CB 3.35Å; V201-I204 WeakPolarHBondContact O-CD1 3.37Å; V201-I204 VanDerWaalsContact O-CG1 3.3Å; V201-I204 WeakPolarHBondContact O-CG1 3.19Å; V201-I204 PolarHBondContact O-N 2.98Å; V201-W205 HydrophobicContact CG1-CZ3 4.26Å; V201-W205 WeakPolarHBondContact O-CZ3 3.44Å; V201-F224 HydrophobicContact CB-CE1 4.11Å; V201-F224 HydrophobicContact CB-CZ 3.9Å; V201-F224 HydrophobicContact CG1-CE1 3.89Å; V201-F224 HydrophobicContact CG1-CE2 3.96Å; V201-F224 HydrophobicContact CG1-CZ 3.44Å; V201-F224 VanDerWaalsContact CG1-CZ 3.44Å; V201-F224 HydrophobicContact CG2-CZ 4.33Å; V201-H483 HydrophobicContact CG2-CB 3.96Å
202	L	88.5	Confident	83.9	Confident	60 Å²	60	56 Å²	56	31%	0.314	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-64.3	-21.8	-178.9	-57.3	-178.6	0	0	0	113.1	S200 I204 W205 Q221 F224 E225	S200-L202 PolarHBondContact O-N 3.39Å; S200-L202 VanDerWaalsContact O-N 3.13Å; S200-L202 PolarHBondContact OG-N 3.39Å; L202-I204 PolarHBondContact O-N 2.95Å; L202-I204 VanDerWaalsContact O-N 3.12Å; L202-W205 PolarHBondContact O-N 3.39Å; L202-W205 VanDerWaalsContact O-N 3.15Å; L202-Q221 HydrophobicContact CD2-CG 4.36Å; L202-F224 HydrophobicContact CD2-CD1 3.98Å; L202-F224 HydrophobicContact CD2-CE1 4.04Å; L202-E225 HydrophobicContact CD2-CG 3.76Å
203	S	87	Confident	83.6	Confident	32 Å²	32	64.3 Å²	64.3	22%	0.224	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-61.7	-20.6	177.5	-62	0	0	0	0	113.1	C198 S200 V201 W205 S206 F210 S211	C198-S203 WeakPolarHBondContact SG-CB 3.34Å; C198-S203 PolarHBondContact SG-OG 3.32Å; S200-S203 WeakPolarHBondContact O-CB 3.37Å; S200-S203 PolarHBondContact O-N 3Å; S200-S203 VanDerWaalsContact O-N 3.09Å; S200-S203 PolarHBondContact O-OG 2.9Å; V201-S203 PolarHBondContact O-N 3.38Å; S203-W205 PolarHBondContact O-N 3.04Å; S203-S206 WeakPolarHBondContact O-CB 3.14Å; S203-S206 PolarHBondContact O-N 2.66Å; S203-S206 PolarHBondContact O-OG 3.13Å; S203-F210 CarbonylContact O-C 3.56Å; S203-S211 WeakPolarHBondContact O-CA 2.79Å
204	I	88.8	Confident	83.4	Confident	13 Å²	13	67.5 Å²	67.5	7%	0.067	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-55.6	-38.4	174.3	-69.4	168.3	0	0	0	112.1	F189 S192 V201 L202 N212 I215 A216	F189-I204 HydrophobicContact CD1-CD1 3.71Å; F189-I204 HydrophobicContact CD1-CG2 4.35Å; F189-I204 HydrophobicContact CE1-CD1 4.46Å; F189-I204 HydrophobicContact CE1-CG2 4.06Å; S192-I204 WeakPolarHBondContact OG-CD1 3.41Å; V201-I204 HydrophobicContact CG1-CD1 3.88Å; V201-I204 WeakPolarHBondContact O-CB 3.35Å; V201-I204 WeakPolarHBondContact O-CD1 3.37Å; V201-I204 VanDerWaalsContact O-CG1 3.3Å; V201-I204 WeakPolarHBondContact O-CG1 3.19Å; V201-I204 PolarHBondContact O-N 2.98Å; L202-I204 PolarHBondContact O-N 2.95Å; L202-I204 VanDerWaalsContact O-N 3.12Å; I204-N212 HydrophobicContact CG2-CB 4.44Å; I204-N212 PolarHBondContact O-N 2.71Å; I204-I215 HydrophobicContact CD1-CG2 4.25Å; I204-I215 HydrophobicContact CG2-CB 4.2Å; I204-I215 HydrophobicContact CG2-CG2 3.88Å; I204-A216 HydrophobicContact CG2-CB 4.01Å
205	W	91.7	Very high	83.4	Confident	45 Å²	45	67.7 Å²	67.7	17%	0.17	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-93.6	-0.8	179.8	-63.4	-91.4	0	0	0	113.7	F189 V201 L202 S203 A216 M219 Q221 F224	F189-W205 AromaticContact CD1-CH2 3.29Å; F189-W205 HydrophobicContact CD1-CH2 3.29Å; F189-W205 AromaticContact CD1-CZ2 3.68Å; F189-W205 HydrophobicContact CD1-CZ2 3.68Å; F189-W205 HydrophobicContact CD1-CZ3 4.11Å; F189-W205 AromaticContact CE1-CE2 3.98Å; F189-W205 AromaticContact CE1-CH2 3.32Å; F189-W205 HydrophobicContact CE1-CH2 3.32Å; F189-W205 AromaticContact CE1-CZ2 3.13Å; F189-W205 HydrophobicContact CE1-CZ2 3.13Å; F189-W205 HydrophobicContact CE1-CZ3 4.29Å; F189-W205 HydrophobicContact CE2-CZ2 4.44Å; F189-W205 HydrophobicContact CG-CH2 4.02Å; F189-W205 HydrophobicContact CG-CZ2 4.49Å; F189-W205 HydrophobicContact CZ-CH2 4.11Å; F189-W205 AromaticContact CZ-CZ2 3.62Å; F189-W205 HydrophobicContact CZ-CZ2 3.62Å; V201-W205 HydrophobicContact CG1-CZ3 4.26Å; V201-W205 WeakPolarHBondContact O-CZ3 3.44Å; L202-W205 PolarHBondContact O-N 3.39Å; L202-W205 VanDerWaalsContact O-N 3.15Å; S203-W205 PolarHBondContact O-N 3.04Å; W205-A216 HydrophobicContact CG-CB 4.24Å; W205-A216 PolarHBondContact NE1-O 3.34Å; W205-M219 WeakPolarHBondContact CZ2-O 3.37Å; W205-M219 PolarHBondContact NE1-O 3.19Å; W205-Q221 HydrophobicContact CB-CB 4.02Å; W205-Q221 HydrophobicContact CB-CG 4.31Å; W205-Q221 HydrophobicContact CD2-CB 3.81Å; W205-Q221 HydrophobicContact CD2-CG 4.14Å; W205-Q221 HydrophobicContact CE3-CB 4.38Å; W205-Q221 HydrophobicContact CE3-CG 4.22Å; W205-Q221 HydrophobicContact CG-CB 3.64Å; W205-Q221 HydrophobicContact CG-CG 4.21Å; W205-F224 HydrophobicContact CH2-CB 3.58Å; W205-F224 AromaticContact CH2-CD1 3.8Å; W205-F224 HydrophobicContact CH2-CD1 3.8Å; W205-F224 AromaticContact CH2-CD2 3.85Å; W205-F224 HydrophobicContact CH2-CD2 3.85Å; W205-F224 HydrophobicContact CH2-CE1 4.49Å; W205-F224 AromaticContact CH2-CG 3.45Å; W205-F224 HydrophobicContact CH2-CG 3.45Å; W205-F224 VanDerWaalsContact CH2-CG 3.45Å; W205-F224 HydrophobicContact CZ2-CB 3.87Å; W205-F224 HydrophobicContact CZ2-CG 4.24Å; W205-F224 HydrophobicContact CZ3-CB 4.41Å; W205-F224 AromaticContact CZ3-CD1 3.93Å; W205-F224 HydrophobicContact CZ3-CD1 3.93Å; W205-F224 HydrophobicContact CZ3-CE1 4.41Å; W205-F224 HydrophobicContact CZ3-CG 4.07Å
206	S	87.6	Confident	83.7	Confident	53 Å²	53	67.2 Å²	67.2	37%	0.371	35%	0.353	S	S	.	.	S	Bend	trans	-74.7	174.5	176.3	76.1	0	0	0	0	111.7	S203 G208 S211	S203-S206 WeakPolarHBondContact O-CB 3.14Å; S203-S206 PolarHBondContact O-N 2.66Å; S203-S206 PolarHBondContact O-OG 3.13Å; S206-G208 PolarHBondContact OG-N 2.85Å; S206-S211 WeakPolarHBondContact O-CB 3.23Å
207	S	84.4	Confident	84.3	Confident	128 Å²	128	68.4 Å²	68.4	90%	0.895	36%	0.362	S	S	*	.	S	Bend	trans	-92.3	6.5	169.3	53.1	0	0	0	0	113.3
208	G	81.2	Confident	85.3	Confident	36 Å²	36	66.3 Å²	66.3	37%	0.371	36%	0.357	S	S	.	.	S	Bend	trans	-86.4	-176	-173.6	0	0	0	0	0	114.6	S206 F210 S211	S206-G208 PolarHBondContact OG-N 2.85Å; G208-F210 PolarHBondContact O-N 3.49Å; G208-F210 VanDerWaalsContact O-N 3.17Å; G208-S211 WeakPolarHBondContact O-CB 3.44Å; G208-S211 PolarHBondContact O-N 2.63Å; G208-S211 PolarHBondContact O-OG 2.8Å
209	F	82.1	Confident	86.2	Confident	191 Å²	191	66.3 Å²	66.3	84%	0.838	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-33.4	-179.3	-176.7	-97.6	0	0	0	114.1	S211	F209-S211 VanDerWaalsContact C-N 3.31Å
210	F	82.4	Confident	87.5	Confident	97 Å²	97	63.6 Å²	63.6	43%	0.425	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	9.8	179.7	-59.5	-72.2	0	0	0	113.7	C198 S203 G208	C198-F210 HydrophobicContact CB-CB 4.33Å; C198-F210 HydrophobicContact CB-CD1 4.06Å; C198-F210 HydrophobicContact CB-CG 4.2Å; S203-F210 CarbonylContact O-C 3.56Å; G208-F210 PolarHBondContact O-N 3.49Å; G208-F210 VanDerWaalsContact O-N 3.17Å
211	S	85.6	Confident	88.1	Confident	54 Å²	54	64.9 Å²	64.9	38%	0.378	35%	0.35	S	S	.	.			trans	-67.5	144	173.6	67.5	0	0	0	0	110.9	S203 S206 G208 F209	S203-S211 WeakPolarHBondContact O-CA 2.79Å; S206-S211 WeakPolarHBondContact O-CB 3.23Å; G208-S211 WeakPolarHBondContact O-CB 3.44Å; G208-S211 PolarHBondContact O-N 2.63Å; G208-S211 PolarHBondContact O-OG 2.8Å; F209-S211 VanDerWaalsContact C-N 3.31Å
212	N	85.7	Confident	88.5	Confident	43 Å²	43	68 Å²	68	23%	0.23	37%	0.373	C	S	.	.			trans	-141.2	98.9	176.1	-171.9	-41.9	0	0	0	109.6	I204 S214 I215 A216	I204-N212 HydrophobicContact CG2-CB 4.44Å; I204-N212 PolarHBondContact O-N 2.71Å; N212-S214 PolarHBondContact O-N 2.83Å; N212-S214 PolarHBondContact OD1-N 3.37Å; N212-I215 HydrophobicContact CB-CB 4.19Å; N212-I215 HydrophobicContact CB-CD1 4.23Å; N212-I215 HydrophobicContact CB-CG1 4.37Å; N212-I215 VanDerWaalsContact ND2-CD1 3.35Å; N212-I215 WeakPolarHBondContact ND2-CD1 3.11Å; N212-I215 PolarHBondContact O-N 2.72Å; N212-I215 WeakPolarHBondContact OD1-CG1 2.85Å; N212-I215 PolarHBondContact OD1-N 2.98Å; N212-A216 VanDerWaalsContact O-CB 3.24Å; N212-A216 WeakPolarHBondContact O-CB 3.05Å; N212-A216 PolarHBondContact O-N 3.27Å
213	R	86.1	Confident	88.8	Confident	178 Å²	178	66.3 Å²	66.3	67%	0.672	36%	0.362	S	S	*	.	H	α-helix	trans	-62.7	-42	-174.2	-174.9	57.3	175.4	161	-0.2	112.5	I215 A216 L217	R213-I215 VanDerWaalsContact C-N 3.31Å; R213-I215 PolarHBondContact O-N 3.24Å; R213-A216 PolarHBondContact O-N 3.48Å; R213-L217 HydrophobicContact CG-CD1 4.39Å; R213-L217 VanDerWaalsContact O-CG 3.32Å; R213-L217 WeakPolarHBondContact O-CG 3.48Å; R213-L217 PolarHBondContact O-N 2.86Å; R213-L217 VanDerWaalsContact O-N 3.08Å
214	S	86.4	Confident	89.2	Confident	69 Å²	69	64.8 Å²	64.8	48%	0.483	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-40	-178.9	-52.4	0	0	0	0	111.9	N212	N212-S214 PolarHBondContact O-N 2.83Å; N212-S214 PolarHBondContact OD1-N 3.37Å
215	I	87.8	Confident	89.4	Confident	6 Å²	6	67.9 Å²	67.9	3%	0.031	37%	0.365	C	S	.	.	H	α-helix	trans	-72.9	-45.3	174.6	-64.2	178.5	0	0	0	110.7	F189 I204 N212 R213 L217 K218 V529 L533 L535	F189-I215 HydrophobicContact CD1-CG2 3.57Å; F189-I215 HydrophobicContact CE1-CG2 3.29Å; F189-I215 HydrophobicContact CG-CG2 4.43Å; F189-I215 HydrophobicContact CZ-CG2 3.91Å; F189-I215 WeakPolarHBondContact CZ-O 3.43Å; I204-I215 HydrophobicContact CD1-CG2 4.25Å; I204-I215 HydrophobicContact CG2-CB 4.2Å; I204-I215 HydrophobicContact CG2-CG2 3.88Å; N212-I215 HydrophobicContact CB-CB 4.19Å; N212-I215 HydrophobicContact CB-CD1 4.23Å; N212-I215 HydrophobicContact CB-CG1 4.37Å; N212-I215 VanDerWaalsContact ND2-CD1 3.35Å; N212-I215 WeakPolarHBondContact ND2-CD1 3.11Å; N212-I215 PolarHBondContact O-N 2.72Å; N212-I215 WeakPolarHBondContact OD1-CG1 2.85Å; N212-I215 PolarHBondContact OD1-N 2.98Å; R213-I215 VanDerWaalsContact C-N 3.31Å; R213-I215 PolarHBondContact O-N 3.24Å; I215-L217 PolarHBondContact O-N 3.41Å; I215-L217 VanDerWaalsContact O-N 3.12Å; I215-K218 WeakPolarHBondContact O-CB 3.37Å; I215-K218 PolarHBondContact O-N 2.89Å; I215-V529 HydrophobicContact CD1-CG1 4.22Å; I215-L533 HydrophobicContact CB-CD1 4.21Å; I215-L533 HydrophobicContact CD1-CD1 4.18Å; I215-L533 HydrophobicContact CG1-CD1 3.8Å; I215-L533 HydrophobicContact CG2-CD1 3.66Å; I215-L535 HydrophobicContact CG1-CD1 4.05Å
216	A	89.3	Confident	89.5	Confident	10 Å²	10	67.7 Å²	67.7	8%	0.083	37%	0.366	C	S	.	.	H	α-helix	trans	-59.1	-25.6	-178.4	0	0	0	0	0	114	I204 W205 N212 R213 K218	I204-A216 HydrophobicContact CG2-CB 4.01Å; W205-A216 HydrophobicContact CG-CB 4.24Å; W205-A216 PolarHBondContact NE1-O 3.34Å; N212-A216 VanDerWaalsContact O-CB 3.24Å; N212-A216 WeakPolarHBondContact O-CB 3.05Å; N212-A216 PolarHBondContact O-N 3.27Å; R213-A216 PolarHBondContact O-N 3.48Å; A216-K218 VanDerWaalsContact C-N 3.28Å; A216-K218 PolarHBondContact O-N 2.96Å
217	L	91.9	Very high	89.9	Confident	115 Å²	115	65.2 Å²	65.2	60%	0.602	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-19.2	176.1	-74.6	169.9	0	0	0	113.5	R213 I215	R213-L217 HydrophobicContact CG-CD1 4.39Å; R213-L217 VanDerWaalsContact O-CG 3.32Å; R213-L217 WeakPolarHBondContact O-CG 3.48Å; R213-L217 PolarHBondContact O-N 2.86Å; R213-L217 VanDerWaalsContact O-N 3.08Å; I215-L217 PolarHBondContact O-N 3.41Å; I215-L217 VanDerWaalsContact O-N 3.12Å
218	K	94.3	Very high	90.4	Very high	84 Å²	84	61 Å²	61	37%	0.365	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-24.8	-178	-68.3	-67.3	-174.5	166	0	113.9	F189 I215 A216 L533 D534 L535	F189-K218 HydrophobicContact CE2-CB 4.32Å; F189-K218 HydrophobicContact CZ-CB 4.19Å; I215-K218 WeakPolarHBondContact O-CB 3.37Å; I215-K218 PolarHBondContact O-N 2.89Å; A216-K218 VanDerWaalsContact C-N 3.28Å; A216-K218 PolarHBondContact O-N 2.96Å; K218-L533 HydrophobicContact CB-CD2 4.33Å; K218-L533 WeakPolarHBondContact CD-O 3.3Å; K218-L533 WeakPolarHBondContact CE-O 3.26Å; K218-L533 HydrophobicContact CG-CB 4.34Å; K218-L533 PolarHBondContact NZ-O 3.15Å; K218-L533 VanDerWaalsContact NZ-O 3.15Å; K218-D534 PolarHBondContact NZ-O 2.69Å; K218-L535 HydrophobicContact CD-CD2 4.25Å; K218-L535 HydrophobicContact CG-CD2 4.01Å
219	M	94.8	Very high	90.8	Very high	12 Å²	12	63.7 Å²	63.7	6%	0.059	32%	0.317	C	S	.	.	S	Bend	trans	-157.6	136.4	176.8	-171.8	178.3	-70.6	0	0	108.9	E182 A185 F189 W205 R223 F224 I227	E182-M219 HydrophobicContact CB-CE 4.02Å; E182-M219 HydrophobicContact CG-CE 4.21Å; A185-M219 HydrophobicContact CB-CE 4.15Å; F189-M219 HydrophobicContact CE2-CB 3.57Å; F189-M219 HydrophobicContact CZ-CB 3.8Å; W205-M219 WeakPolarHBondContact CZ2-O 3.37Å; W205-M219 PolarHBondContact NE1-O 3.19Å; M219-R223 HydrophobicContact CG-CB 3.77Å; M219-R223 HydrophobicContact CG-CG 3.72Å; M219-R223 HydrophobicContact SD-CB 4.37Å; M219-R223 HydrophobicContact SD-CG 3.95Å; M219-F224 HydrophobicContact CG-CB 4.42Å; M219-F224 HydrophobicContact SD-CB 3.89Å; M219-F224 HydrophobicContact SD-CD2 4.48Å; M219-I227 HydrophobicContact CE-CD1 3.65Å; M219-I227 HydrophobicContact SD-CD1 3.76Å
220	S	94.7	Very high	91.4	Very high	62 Å²	62	54.6 Å²	54.6	43%	0.434	28%	0.277	S	S	.	.			trans	-64.3	150	173.5	69.5	0	0	0	0	110.9	S222 R223 F224	S220-S222 PolarHBondContact O-N 3.38Å; S220-S222 PolarHBondContact OG-OG 2.98Å; S220-S222 VanDerWaalsContact OG-OG 3.04Å; S220-R223 PolarHBondContact O-N 3.22Å; S220-R223 VanDerWaalsContact O-N 3.1Å; S220-R223 VanDerWaalsContact OG-CB 3.28Å; S220-R223 WeakPolarHBondContact OG-CB 3.33Å; S220-R223 PolarHBondContact OG-N 3.35Å; S220-R223 VanDerWaalsContact OG-N 3.12Å; S220-F224 PolarHBondContact O-N 2.95Å
221	Q	94.4	Very high	92	Very high	72 Å²	72	50 Å²	50	34%	0.336	26%	0.257	S	S	.	.	H	α-helix	trans	-53.9	-44.1	174.6	-174	-179.3	-18.7	0	0	111.2	L202 W205 R223 F224 E225	L202-Q221 HydrophobicContact CD2-CG 4.36Å; W205-Q221 HydrophobicContact CB-CB 4.02Å; W205-Q221 HydrophobicContact CB-CG 4.31Å; W205-Q221 HydrophobicContact CD2-CB 3.81Å; W205-Q221 HydrophobicContact CD2-CG 4.14Å; W205-Q221 HydrophobicContact CE3-CB 4.38Å; W205-Q221 HydrophobicContact CE3-CG 4.22Å; W205-Q221 HydrophobicContact CG-CB 3.64Å; W205-Q221 HydrophobicContact CG-CG 4.21Å; Q221-R223 VanDerWaalsContact C-N 3.33Å; Q221-R223 PolarHBondContact O-N 2.64Å; Q221-F224 PolarHBondContact O-N 3.43Å; Q221-E225 HydrophobicContact CG-CG 4.35Å; Q221-E225 PolarHBondContact NE2-OE1 2.94Å; Q221-E225 WeakPolarHBondContact O-CB 3.47Å; Q221-E225 WeakPolarHBondContact O-CG 3.38Å; Q221-E225 PolarHBondContact O-N 3.12Å
222	S	93.4	Very high	92.4	Very high	69 Å²	69	47.5 Å²	47.5	48%	0.483	24%	0.239	S	C	.	.	H	α-helix	trans	-61.7	-37.7	179.4	59.6	0	0	0	0	113	S220 K226	S220-S222 PolarHBondContact O-N 3.38Å; S220-S222 PolarHBondContact OG-OG 2.98Å; S220-S222 VanDerWaalsContact OG-OG 3.04Å; S222-K226 WeakPolarHBondContact O-CG 3.42Å; S222-K226 PolarHBondContact O-N 2.75Å
223	R	95.9	Very high	92.8	Very high	24 Å²	24	45.5 Å²	45.5	9%	0.091	23%	0.229	C	C	.	.	H	α-helix	trans	-70.5	-44.1	175.7	-179.9	57.8	173.5	168.3	-1.7	110.9	C176 E182 M219 S220 Q221 E225 K226 I227	C176-R223 PolarHBondContact O-NH1 2.62Å; C176-R223 PolarHBondContact O-NH2 3.11Å; C176-R223 PolarHBondContact SG-NH1 2.89Å; C176-R223 VanDerWaalsContact SG-NH1 3.43Å; C176-R223 PolarHBondContact SG-NH2 3.04Å; C176-R223 VanDerWaalsContact SG-NH2 3.35Å; E182-R223 VanDerWaalsContact CD-NH2 3.32Å; E182-R223 IonicContact OE1-CZ 3.93Å; E182-R223 IonicContact OE1-NE 3.63Å; E182-R223 PolarHBondContact OE1-NE 3.21Å; E182-R223 IonicContact OE1-NH2 3.82Å; E182-R223 PolarHBondContact OE1-NH2 3.06Å; E182-R223 IonicContact OE2-CZ 2.77Å; E182-R223 IonicContact OE2-NE 3.81Å; E182-R223 IonicContact OE2-NH2 2.73Å; E182-R223 PolarHBondContact OE2-NH2 3.01Å; M219-R223 HydrophobicContact CG-CB 3.77Å; M219-R223 HydrophobicContact CG-CG 3.72Å; M219-R223 HydrophobicContact SD-CB 4.37Å; M219-R223 HydrophobicContact SD-CG 3.95Å; S220-R223 PolarHBondContact O-N 3.22Å; S220-R223 VanDerWaalsContact O-N 3.1Å; S220-R223 VanDerWaalsContact OG-CB 3.28Å; S220-R223 WeakPolarHBondContact OG-CB 3.33Å; S220-R223 PolarHBondContact OG-N 3.35Å; S220-R223 VanDerWaalsContact OG-N 3.12Å; Q221-R223 VanDerWaalsContact C-N 3.33Å; Q221-R223 PolarHBondContact O-N 2.64Å; R223-E225 PolarHBondContact O-N 3.41Å; R223-K226 PolarHBondContact O-N 2.82Å; R223-I227 HydrophobicContact CG-CD1 4.28Å; R223-I227 WeakPolarHBondContact O-CG1 3.5Å; R223-I227 PolarHBondContact O-N 3.37Å
224	F	95.4	Very high	93.1	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58.3	-48.1	176.6	174.5	-94.3	0	0	0	111.8	F186 F189 V190 V201 L202 W205 M219 S220 Q221 K226 I227 L228	F186-F224 AromaticContact CD2-CD2 3.7Å; F186-F224 HydrophobicContact CD2-CD2 3.7Å; F186-F224 AromaticContact CD2-CE2 3.43Å; F186-F224 HydrophobicContact CD2-CE2 3.43Å; F186-F224 VanDerWaalsContact CD2-CE2 3.43Å; F186-F224 HydrophobicContact CD2-CZ 4.28Å; F186-F224 HydrophobicContact CE2-CD2 4.14Å; F186-F224 AromaticContact CE2-CE2 3.58Å; F186-F224 HydrophobicContact CE2-CE2 3.58Å; F186-F224 AromaticContact CE2-CZ 3.97Å; F186-F224 HydrophobicContact CE2-CZ 3.97Å; F186-F224 HydrophobicContact CG-CE2 4.49Å; F189-F224 HydrophobicContact CB-CD2 4.02Å; F189-F224 HydrophobicContact CB-CE2 3.65Å; F189-F224 HydrophobicContact CD2-CD2 4.32Å; F189-F224 HydrophobicContact CG-CD2 4.16Å; F189-F224 HydrophobicContact CG-CE2 4.29Å; V190-F224 HydrophobicContact CG2-CE2 4.18Å; V190-F224 HydrophobicContact CG2-CZ 4.1Å; V201-F224 HydrophobicContact CB-CE1 4.11Å; V201-F224 HydrophobicContact CB-CZ 3.9Å; V201-F224 HydrophobicContact CG1-CE1 3.89Å; V201-F224 HydrophobicContact CG1-CE2 3.96Å; V201-F224 HydrophobicContact CG1-CZ 3.44Å; V201-F224 VanDerWaalsContact CG1-CZ 3.44Å; V201-F224 HydrophobicContact CG2-CZ 4.33Å; L202-F224 HydrophobicContact CD2-CD1 3.98Å; L202-F224 HydrophobicContact CD2-CE1 4.04Å; W205-F224 HydrophobicContact CH2-CB 3.58Å; W205-F224 AromaticContact CH2-CD1 3.8Å; W205-F224 HydrophobicContact CH2-CD1 3.8Å; W205-F224 AromaticContact CH2-CD2 3.85Å; W205-F224 HydrophobicContact CH2-CD2 3.85Å; W205-F224 HydrophobicContact CH2-CE1 4.49Å; W205-F224 AromaticContact CH2-CG 3.45Å; W205-F224 HydrophobicContact CH2-CG 3.45Å; W205-F224 VanDerWaalsContact CH2-CG 3.45Å; W205-F224 HydrophobicContact CZ2-CB 3.87Å; W205-F224 HydrophobicContact CZ2-CG 4.24Å; W205-F224 HydrophobicContact CZ3-CB 4.41Å; W205-F224 AromaticContact CZ3-CD1 3.93Å; W205-F224 HydrophobicContact CZ3-CD1 3.93Å; W205-F224 HydrophobicContact CZ3-CE1 4.41Å; W205-F224 HydrophobicContact CZ3-CG 4.07Å; M219-F224 HydrophobicContact CG-CB 4.42Å; M219-F224 HydrophobicContact SD-CB 3.89Å; M219-F224 HydrophobicContact SD-CD2 4.48Å; S220-F224 PolarHBondContact O-N 2.95Å; Q221-F224 PolarHBondContact O-N 3.43Å; F224-K226 VanDerWaalsContact C-N 3.32Å; F224-K226 PolarHBondContact O-N 2.96Å; F224-I227 PolarHBondContact O-N 3.39Å; F224-L228 HydrophobicContact CE1-CB 4.46Å; F224-L228 HydrophobicContact CE1-CD2 4.05Å; F224-L228 WeakPolarHBondContact O-CB 3.22Å; F224-L228 PolarHBondContact O-N 3.17Å
225	E	92.8	Very high	93.1	Very high	77 Å²	77	35.1 Å²	35.1	36%	0.36	18%	0.183	S	C	.	.	H	α-helix	trans	-61.7	-38.5	179.2	-73.7	173	166	0	0	112.2	L202 Q221 R223 L228 K229	L202-E225 HydrophobicContact CD2-CG 3.76Å; Q221-E225 HydrophobicContact CG-CG 4.35Å; Q221-E225 PolarHBondContact NE2-OE1 2.94Å; Q221-E225 WeakPolarHBondContact O-CB 3.47Å; Q221-E225 WeakPolarHBondContact O-CG 3.38Å; Q221-E225 PolarHBondContact O-N 3.12Å; R223-E225 PolarHBondContact O-N 3.41Å; E225-L228 PolarHBondContact O-N 3.17Å; E225-K229 WeakPolarHBondContact O-CB 3.32Å; E225-K229 PolarHBondContact O-N 3.34Å
226	K	93.8	Very high	92.9	Very high	42 Å²	42	38.1 Å²	38.1	18%	0.183	20%	0.196	C	C	.	.	H	α-helix	trans	-63.5	-45.4	173	-75.1	-179.7	-173.3	-177.5	0	111.9	E173 G174 W175 S222 R223 F224 L228 K229 Y230	E173-K226 PolarHBondContact O-NZ 3.03Å; G174-K226 VanDerWaalsContact C-NZ 3.32Å; G174-K226 PolarHBondContact O-NZ 2.74Å; W175-K226 HydrophobicContact CE3-CB 4.13Å; W175-K226 HydrophobicContact CZ3-CB 4.18Å; S222-K226 WeakPolarHBondContact O-CG 3.42Å; S222-K226 PolarHBondContact O-N 2.75Å; R223-K226 PolarHBondContact O-N 2.82Å; F224-K226 VanDerWaalsContact C-N 3.32Å; F224-K226 PolarHBondContact O-N 2.96Å; K226-L228 VanDerWaalsContact C-N 3.34Å; K226-K229 WeakPolarHBondContact O-CB 3.5Å; K226-K229 PolarHBondContact O-N 3.4Å; K226-Y230 WeakPolarHBondContact O-CD2 3.42Å; K226-Y230 PolarHBondContact O-N 2.82Å
227	I	96.3	Very high	92.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.9	-45.5	175.8	-64	175.7	0	0	0	109.9	W175 V178 E182 F186 M219 R223 F224 K229 Y230 F231	W175-I227 HydrophobicContact CZ3-CG1 4.48Å; V178-I227 HydrophobicContact CG1-CD1 4.17Å; V178-I227 HydrophobicContact CG2-CD1 4.29Å; V178-I227 HydrophobicContact CG2-CG1 3.91Å; E182-I227 HydrophobicContact CB-CD1 4.33Å; F186-I227 HydrophobicContact CB-CG2 4.15Å; F186-I227 HydrophobicContact CD1-CG2 4.23Å; F186-I227 HydrophobicContact CD2-CB 4.11Å; F186-I227 HydrophobicContact CD2-CG2 3.55Å; F186-I227 HydrophobicContact CE2-CB 4.48Å; F186-I227 HydrophobicContact CE2-CG2 3.97Å; F186-I227 HydrophobicContact CG-CG2 3.71Å; F186-I227 HydrophobicContact CZ-CG2 4.47Å; M219-I227 HydrophobicContact CE-CD1 3.65Å; M219-I227 HydrophobicContact SD-CD1 3.76Å; R223-I227 HydrophobicContact CG-CD1 4.28Å; R223-I227 WeakPolarHBondContact O-CG1 3.5Å; R223-I227 PolarHBondContact O-N 3.37Å; F224-I227 PolarHBondContact O-N 3.39Å; I227-K229 VanDerWaalsContact C-N 3.31Å; I227-K229 PolarHBondContact O-N 2.77Å; I227-Y230 CarbonylContact O-C 3.59Å; I227-Y230 PolarHBondContact O-N 3.34Å; I227-Y230 VanDerWaalsContact O-N 3.15Å; I227-F231 WeakPolarHBondContact O-CA 3.47Å; I227-F231 WeakPolarHBondContact O-CB 3.47Å; I227-F231 PolarHBondContact O-N 3.15Å
228	L	93.2	Very high	91.3	Very high	41 Å²	41	42.1 Å²	42.1	22%	0.215	21%	0.21	C	C	.	.	H	α-helix	trans	-58	-41.4	177.8	-176.1	63.1	0	0	0	112.4	F186 F224 E225 K226 Y230	F186-L228 HydrophobicContact CE2-CB 3.98Å; F186-L228 HydrophobicContact CE2-CD1 4.03Å; F186-L228 HydrophobicContact CZ-CB 4.48Å; F186-L228 HydrophobicContact CZ-CD1 3.87Å; F224-L228 HydrophobicContact CE1-CB 4.46Å; F224-L228 HydrophobicContact CE1-CD2 4.05Å; F224-L228 WeakPolarHBondContact O-CB 3.22Å; F224-L228 PolarHBondContact O-N 3.17Å; E225-L228 PolarHBondContact O-N 3.17Å; K226-L228 VanDerWaalsContact C-N 3.34Å; L228-Y230 VanDerWaalsContact C-N 3.35Å
229	K	90.6	Very high	89.7	Confident	91 Å²	91	43.7 Å²	43.7	40%	0.396	23%	0.232	S	C	.	.	H	α-helix	trans	-60.3	-43.6	176.5	178	-177.4	-179.3	-179.8	0	111.9	E172 E225 K226 I227	E172-K229 IonicContact OE1-NZ 2.94Å; E172-K229 IonicContact OE2-NZ 3.49Å; E172-K229 PolarHBondContact OE2-NZ 3.44Å; E225-K229 WeakPolarHBondContact O-CB 3.32Å; E225-K229 PolarHBondContact O-N 3.34Å; K226-K229 WeakPolarHBondContact O-CB 3.5Å; K226-K229 PolarHBondContact O-N 3.4Å; I227-K229 VanDerWaalsContact C-N 3.31Å; I227-K229 PolarHBondContact O-N 2.77Å
230	Y	94.4	Very high	87.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-95.2	-9.9	-174.1	-66.4	-58	0	0	0	114.8	Y161 A162 F165 E172 W175 K226 I227 L228 H232	Y161-Y230 AromaticContact CD1-CD1 3.8Å; Y161-Y230 HydrophobicContact CD1-CD1 3.8Å; Y161-Y230 AromaticContact CE1-CD1 3.9Å; Y161-Y230 HydrophobicContact CE1-CD1 3.9Å; A162-Y230 HydrophobicContact CB-CD1 3.8Å; A162-Y230 HydrophobicContact CB-CD2 3.97Å; A162-Y230 HydrophobicContact CB-CE1 4.16Å; A162-Y230 HydrophobicContact CB-CE2 4.3Å; A162-Y230 HydrophobicContact CB-CG 3.67Å; F165-Y230 HydrophobicContact CB-CD1 4.39Å; F165-Y230 HydrophobicContact CB-CE1 3.78Å; F165-Y230 AromaticContact CD1-CE1 3.58Å; F165-Y230 HydrophobicContact CD1-CE1 3.58Å; F165-Y230 HydrophobicContact CE1-CE1 4.3Å; F165-Y230 AromaticContact CG-CE1 3.7Å; F165-Y230 HydrophobicContact CG-CE1 3.7Å; E172-Y230 PolarHBondContact OE2-OH 2.87Å; W175-Y230 HydrophobicContact CD2-CD2 4.06Å; W175-Y230 HydrophobicContact CD2-CE2 4.02Å; W175-Y230 AromaticContact CE3-CD2 3.56Å; W175-Y230 HydrophobicContact CE3-CD2 3.56Å; W175-Y230 AromaticContact CE3-CE2 3.74Å; W175-Y230 HydrophobicContact CE3-CE2 3.74Å; W175-Y230 AromaticContact CH2-CD2 3.75Å; W175-Y230 HydrophobicContact CH2-CD2 3.75Å; W175-Y230 HydrophobicContact CH2-CG 4.25Å; W175-Y230 HydrophobicContact CZ2-CD2 4.25Å; W175-Y230 AromaticContact CZ3-CD2 3.41Å; W175-Y230 HydrophobicContact CZ3-CD2 3.41Å; W175-Y230 VanDerWaalsContact CZ3-CD2 3.41Å; W175-Y230 HydrophobicContact CZ3-CE2 4.09Å; W175-Y230 HydrophobicContact CZ3-CG 4.31Å; K226-Y230 WeakPolarHBondContact O-CD2 3.42Å; K226-Y230 PolarHBondContact O-N 2.82Å; I227-Y230 CarbonylContact O-C 3.59Å; I227-Y230 PolarHBondContact O-N 3.34Å; I227-Y230 VanDerWaalsContact O-N 3.15Å; L228-Y230 VanDerWaalsContact C-N 3.35Å; Y230-H232 PolarHBondContact O-N 3.48Å; Y230-H232 PolarHBondContact O-ND1 3Å
231	F	95.6	Very high	85.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.289	C	S	.	.			trans	-54	122.8	-176.1	177	-108.4	0	0	0	112.5	M154 M183 F186 I227 I233 W489 F493 W494	M154-F231 HydrophobicContact CB-CE2 4.33Å; M154-F231 HydrophobicContact CG-CE2 4.41Å; M154-F231 HydrophobicContact SD-CE2 4.18Å; M154-F231 HydrophobicContact SD-CZ 4.4Å; M183-F231 HydrophobicContact CE-CD2 4.19Å; M183-F231 HydrophobicContact CE-CE2 4.43Å; M183-F231 HydrophobicContact SD-CD2 4.09Å; M183-F231 HydrophobicContact SD-CE2 3.93Å; F186-F231 HydrophobicContact CD1-CD2 4.23Å; F186-F231 HydrophobicContact CD1-CE2 4.45Å; F186-F231 HydrophobicContact CE1-CB 4.29Å; F186-F231 HydrophobicContact CE1-CD1 4.3Å; F186-F231 AromaticContact CE1-CD2 3.61Å; F186-F231 HydrophobicContact CE1-CD2 3.61Å; F186-F231 AromaticContact CE1-CE2 3.94Å; F186-F231 HydrophobicContact CE1-CE2 3.94Å; F186-F231 AromaticContact CE1-CG 3.8Å; F186-F231 HydrophobicContact CE1-CG 3.8Å; F186-F231 HydrophobicContact CE1-CZ 4.43Å; F186-F231 HydrophobicContact CZ-CB 4.18Å; F186-F231 HydrophobicContact CZ-CD2 4.33Å; F186-F231 HydrophobicContact CZ-CG 4.11Å; I227-F231 WeakPolarHBondContact O-CA 3.47Å; I227-F231 WeakPolarHBondContact O-CB 3.47Å; I227-F231 PolarHBondContact O-N 3.15Å; F231-I233 HydrophobicContact CE1-CD1 4.32Å; F231-I233 HydrophobicContact CE2-CD1 4.22Å; F231-I233 HydrophobicContact CZ-CD1 3.62Å; F231-I233 HydrophobicContact CZ-CG1 4.37Å; F231-W489 AromaticContact CD1-CH2 3.82Å; F231-W489 HydrophobicContact CD1-CH2 3.82Å; F231-W489 HydrophobicContact CD1-CZ3 4.2Å; F231-W489 HydrophobicContact CE1-CH2 4.04Å; F231-W489 AromaticContact CE1-CZ3 3.94Å; F231-W489 HydrophobicContact CE1-CZ3 3.94Å; F231-W489 VanDerWaalsContact O-CH2 3.31Å; F231-W489 WeakPolarHBondContact O-CH2 3.44Å; F231-F493 AromaticContact CE1-CD1 3.86Å; F231-F493 HydrophobicContact CE1-CD1 3.86Å; F231-F493 AromaticContact CE1-CE1 3.75Å; F231-F493 HydrophobicContact CE1-CE1 3.75Å; F231-F493 HydrophobicContact CE1-CZ 4.43Å; F231-F493 HydrophobicContact CZ-CD1 4.03Å; F231-F493 AromaticContact CZ-CE1 3.45Å; F231-F493 HydrophobicContact CZ-CE1 3.45Å; F231-F493 VanDerWaalsContact CZ-CE1 3.45Å; F231-F493 AromaticContact CZ-CZ 3.77Å; F231-F493 HydrophobicContact CZ-CZ 3.77Å; F231-W494 HydrophobicContact CE1-CZ2 4.29Å
232	H	93.6	Very high	83.9	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.009	29%	0.286	C	S	.	.			trans	-144.1	143.4	177.5	-76.7	77.4	0	0	0	111.5	Q157 T158 Y161 Y230	Q157-H232 WeakPolarHBondContact CB-O 3.18Å; T158-H232 PolarHBondContact OG1-N 2.96Å; Y161-H232 AromaticContact CD1-CE1 3.24Å; Y161-H232 WeakPolarHBondContact CD1-CE1 3.46Å; Y161-H232 AromaticContact CD1-ND1 3.25Å; Y161-H232 VanDerWaalsContact CD1-ND1 3.25Å; Y161-H232 WeakPolarHBondContact CD1-ND1 3.34Å; Y161-H232 AromaticContact CD2-CE1 3.48Å; Y161-H232 VanDerWaalsContact CD2-CE1 3.48Å; Y161-H232 WeakPolarHBondContact CD2-CE1 3.4Å; Y161-H232 AromaticContact CD2-ND1 3.71Å; Y161-H232 AromaticContact CD2-NE2 3.7Å; Y161-H232 AromaticContact CE1-CE1 3.25Å; Y161-H232 WeakPolarHBondContact CE1-CE1 3.47Å; Y161-H232 AromaticContact CE1-ND1 3.78Å; Y161-H232 AromaticContact CE2-CE1 3.47Å; Y161-H232 VanDerWaalsContact CE2-CE1 3.47Å; Y161-H232 WeakPolarHBondContact CE2-CE1 3.37Å; Y161-H232 AromaticContact CE2-NE2 3.59Å; Y161-H232 AromaticContact CG-CE1 3.36Å; Y161-H232 AromaticContact CG-CG 3.85Å; Y161-H232 AromaticContact CG-ND1 3.22Å; Y161-H232 AromaticContact CZ-CE1 3.35Å; Y161-H232 AromaticContact CZ-NE2 3.84Å; Y230-H232 PolarHBondContact O-N 3.48Å; Y230-H232 PolarHBondContact O-ND1 3Å
233	I	94.6	Very high	81.9	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	29%	0.293	C	S	.	.	S	Bend	trans	-90.7	-35.2	168.1	-55.7	-56.3	0	0	0	111	N153 M154 Q157 F231 K248 I249 F252 W489 F493	N153-I233 PolarHBondContact ND2-O 3.4Å; M154-I233 HydrophobicContact CE-CD1 4.05Å; M154-I233 HydrophobicContact CG-CD1 3.57Å; M154-I233 HydrophobicContact SD-CD1 4.06Å; Q157-I233 VanDerWaalsContact CG-O 3.25Å; Q157-I233 WeakPolarHBondContact CG-O 3.47Å; F231-I233 HydrophobicContact CE1-CD1 4.32Å; F231-I233 HydrophobicContact CE2-CD1 4.22Å; F231-I233 HydrophobicContact CZ-CD1 3.62Å; F231-I233 HydrophobicContact CZ-CG1 4.37Å; I233-K248 WeakPolarHBondContact CB-O 3.2Å; I233-I249 HydrophobicContact CB-CG2 4.4Å; I233-I249 HydrophobicContact CG1-CG2 4.19Å; I233-F252 HydrophobicContact CG2-CB 3.81Å; I233-W489 HydrophobicContact CG1-CZ3 4.12Å; I233-F493 HydrophobicContact CD1-CD2 4.02Å; I233-F493 HydrophobicContact CD1-CE2 3.64Å; I233-F493 HydrophobicContact CD1-CZ 4.02Å; I233-F493 HydrophobicContact CG1-CD2 4.02Å; I233-F493 HydrophobicContact CG1-CE2 4.17Å
234	V	92.3	Very high	80.4	Confident	19 Å²	19	60.1 Å²	60.1	12%	0.115	33%	0.327	C	S	.	.			trans	-137.4	115.8	170.6	-179.8	0	0	0	0	107.6	F236 K248 P251	V234-F236 WeakPolarHBondContact CG1-O 3.35Å; V234-K248 PolarHBondContact N-O 3.21Å; V234-P251 HydrophobicContact CG2-CG 3.71Å
235	A	87.1	Confident	79.1	Confident	9 Å²	9	61.8 Å²	61.8	7%	0.074	34%	0.344	C	S	.	.	S	Bend	trans	-72.9	-38.6	-176.1	0	0	0	0	0	112.2	M160	M160-A235 HydrophobicContact CB-CB 4.37Å
236	F	82.9	Confident	78.7	Confident	70 Å²	70	58.8 Å²	58.8	31%	0.307	33%	0.33	S	S	.	.	S	Bend	trans	-130.9	143.2	-171.1	-49	-50.4	0	0	0	112	M160 K164 V234	M160-F236 HydrophobicContact CB-CE2 4.27Å; M160-F236 HydrophobicContact CE-CD2 4.15Å; M160-F236 HydrophobicContact CE-CE2 3.86Å; K164-F236 HydrophobicContact CB-CE1 4.13Å; K164-F236 HydrophobicContact CB-CZ 3.83Å; K164-F236 HydrophobicContact CD-CD1 3.89Å; K164-F236 HydrophobicContact CD-CE1 3.11Å; K164-F236 HydrophobicContact CD-CE2 4.41Å; K164-F236 HydrophobicContact CD-CZ 3.42Å; K164-F236 VanDerWaalsContact CD-CZ 3.42Å; K164-F236 HydrophobicContact CG-CE1 4.23Å; K164-F236 HydrophobicContact CG-CZ 4.27Å; V234-F236 WeakPolarHBondContact CG1-O 3.35Å
237	R	78.8	Confident	78.4	Confident	139 Å²	139	58.9 Å²	58.9	53%	0.525	33%	0.33	S	S	.	.			trans	-66	133.4	178.4	-160.8	179	-150.2	169.8	2.4	109.6	Y247	R237-Y247 HydrophobicContact CB-CD2 4.32Å; R237-Y247 HydrophobicContact CB-CE2 3.82Å; R237-Y247 HydrophobicContact CG-CD1 4.4Å; R237-Y247 HydrophobicContact CG-CD2 4.05Å; R237-Y247 HydrophobicContact CG-CE1 4.26Å; R237-Y247 HydrophobicContact CG-CE2 3.92Å; R237-Y247 HydrophobicContact CG-CG 4.29Å
238	P	68.3	Low	78.1	Confident	69 Å²	69	61.4 Å²	61.4	45%	0.448	34%	0.341	S	S	.	.			trans	-58.4	147	168.1	-20.1	31.6	0	0	0	110.5	Q240	P238-Q240 PolarHBondContact O-N 3.46Å
239	S	61.7	Low	78	Confident	118 Å²	118	59.4 Å²	59.4	83%	0.825	33%	0.331	S	S	*	.	S	Bend	trans	-70	-10.2	-177.2	42.2	0	0	0	0	114.5
240	Q	55.1	Low	78	Confident	168 Å²	168	57.4 Å²	57.4	79%	0.785	32%	0.322	S	S	*	.	S	Bend	trans	-147.1	140.6	-177.2	-69	-83.3	-49.3	0	0	112	P238 S242	P238-Q240 PolarHBondContact O-N 3.46Å; Q240-S242 PolarHBondContact O-N 2.86Å; Q240-S242 VanDerWaalsContact O-N 3.13Å
241	G	54.2	Low	77.9	Confident	89 Å²	89	60.6 Å²	60.6	92%	0.918	34%	0.343	S	S	*	.			trans	73.1	-2	150.7	0	0	0	0	0	121.2
242	S	51.8	Low	77.9	Confident	38 Å²	38	61 Å²	61	27%	0.266	35%	0.345	S	S	.	.			trans	-78	133.9	-175.2	68.7	0	0	0	0	113.4	Q240 Q244	Q240-S242 PolarHBondContact O-N 2.86Å; Q240-S242 VanDerWaalsContact O-N 3.13Å; S242-Q244 PolarHBondContact O-N 2.93Å
243	N	52.2	Low	78	Confident	118 Å²	118	61.3 Å²	61.3	63%	0.631	35%	0.347	S	S	*	.			trans	-29.4	121.1	170.2	-110.5	-20.1	0	0	0	112.7	G245	N243-G245 PolarHBondContact O-N 3Å
244	Q	63.6	Low	78	Confident	170 Å²	170	65.4 Å²	65.4	79%	0.794	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	92.4	-174.1	-63.3	-133.4	23.2	0	0	110.8	S242	S242-Q244 PolarHBondContact O-N 2.93Å
245	G	69.1	Low	78.2	Confident	35 Å²	35	66 Å²	66	36%	0.361	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	127.3	-30.7	163.7	0	0	0	0	0	116.4	N243 L320	N243-G245 PolarHBondContact O-N 3Å; G245-L320 VanDerWaalsContact CA-CD1 3.49Å
246	L	83.7	Confident	78.6	Confident	15 Å²	15	65.6 Å²	65.6	8%	0.079	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-0.4	178.7	-67.4	178.8	0	0	0	114.5	K248 I249 Q250 V318 L320 V492	L246-K248 PolarHBondContact O-N 2.9Å; L246-I249 HydrophobicContact CB-CG1 4.49Å; L246-I249 HydrophobicContact CD2-CD1 4.15Å; L246-I249 HydrophobicContact CD2-CG1 4.47Å; L246-I249 WeakPolarHBondContact O-CG1 3.31Å; L246-I249 PolarHBondContact O-N 3.39Å; L246-Q250 PolarHBondContact O-N 3.03Å; L246-Q250 VanDerWaalsContact O-N 3.08Å; L246-V318 HydrophobicContact CD1-CB 3.77Å; L246-V318 HydrophobicContact CD1-CG1 3.68Å; L246-V318 HydrophobicContact CD2-CG1 4.25Å; L246-L320 HydrophobicContact CD1-CG 4.48Å; L246-L320 HydrophobicContact CD2-CD1 4.15Å; L246-L320 HydrophobicContact CD2-CD2 3.66Å; L246-L320 HydrophobicContact CD2-CG 4.01Å; L246-L320 HydrophobicContact CG-CD1 3.96Å; L246-L320 HydrophobicContact CG-CD2 4.16Å; L246-L320 HydrophobicContact CG-CG 3.93Å; L246-V492 HydrophobicContact CD2-CG2 4.38Å
247	Y	86.8	Confident	79.2	Confident	44 Å²	44	64 Å²	64	17%	0.173	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-28.7	-178.9	79.4	-91.5	0	0	0	113.9	R237 I249	R237-Y247 HydrophobicContact CB-CD2 4.32Å; R237-Y247 HydrophobicContact CB-CE2 3.82Å; R237-Y247 HydrophobicContact CG-CD1 4.4Å; R237-Y247 HydrophobicContact CG-CD2 4.05Å; R237-Y247 HydrophobicContact CG-CE1 4.26Å; R237-Y247 HydrophobicContact CG-CE2 3.92Å; R237-Y247 HydrophobicContact CG-CG 4.29Å; Y247-I249 PolarHBondContact O-N 2.63Å
248	K	90.1	Very high	80	Confident	52 Å²	52	63 Å²	63	23%	0.226	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-21.2	179.3	-70.8	-165.3	173.4	-160.1	0	114	I233 V234 L246 W489	I233-K248 WeakPolarHBondContact CB-O 3.2Å; V234-K248 PolarHBondContact N-O 3.21Å; L246-K248 PolarHBondContact O-N 2.9Å; K248-W489 HydrophobicContact CB-CB 4.09Å; K248-W489 HydrophobicContact CB-CD2 4.21Å; K248-W489 HydrophobicContact CB-CG 3.93Å; K248-W489 HydrophobicContact CD-CD2 4.45Å; K248-W489 HydrophobicContact CD-CG 4.03Å
249	I	92	Very high	81.4	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.4	-5.4	-176.7	58.9	168.3	0	0	0	113.8	I233 L246 Y247 P251 F252 L253 W489 V492 F493	I233-I249 HydrophobicContact CB-CG2 4.4Å; I233-I249 HydrophobicContact CG1-CG2 4.19Å; L246-I249 HydrophobicContact CB-CG1 4.49Å; L246-I249 HydrophobicContact CD2-CD1 4.15Å; L246-I249 HydrophobicContact CD2-CG1 4.47Å; L246-I249 WeakPolarHBondContact O-CG1 3.31Å; L246-I249 PolarHBondContact O-N 3.39Å; Y247-I249 PolarHBondContact O-N 2.63Å; I249-P251 VanDerWaalsContact C-CD 3.45Å; I249-P251 VanDerWaalsContact C-N 3.33Å; I249-F252 WeakPolarHBondContact O-CB 3.43Å; I249-F252 PolarHBondContact O-N 3.42Å; I249-L253 HydrophobicContact CD1-CD1 3.85Å; I249-L253 HydrophobicContact CD1-CD2 4.44Å; I249-L253 HydrophobicContact CD1-CG 4.19Å; I249-L253 HydrophobicContact CG1-CD1 4.04Å; I249-L253 HydrophobicContact CG1-CG 4.34Å; I249-L253 PolarHBondContact O-N 3.49Å; I249-L253 VanDerWaalsContact O-N 3.12Å; I249-W489 HydrophobicContact CG2-CB 3.99Å; I249-W489 HydrophobicContact CG2-CD2 4.13Å; I249-W489 HydrophobicContact CG2-CE3 3.36Å; I249-W489 HydrophobicContact CG2-CG 4.44Å; I249-W489 HydrophobicContact CG2-CZ3 4.16Å; I249-V492 HydrophobicContact CD1-CB 3.56Å; I249-V492 HydrophobicContact CD1-CG1 3.32Å; I249-F493 HydrophobicContact CG2-CB 4.3Å
250	Q	90.9	Very high	83.1	Confident	48 Å²	48	55 Å²	55	22%	0.224	31%	0.31	C	S	.	.	H	α-helix	trans	-50.6	-45.2	-174.6	-168.4	65.9	53.6	0	0	113.4	L246 F252 L253 D254	L246-Q250 PolarHBondContact O-N 3.03Å; L246-Q250 VanDerWaalsContact O-N 3.08Å; Q250-F252 PolarHBondContact O-N 3.17Å; Q250-L253 PolarHBondContact O-N 3.34Å; Q250-D254 PolarHBondContact NE2-OD1 3.48Å; Q250-D254 PolarHBondContact O-N 3.44Å
251	P	92.1	Very high	84.9	Confident	67 Å²	67	49.6 Å²	49.6	44%	0.435	29%	0.291	S	S	.	.	H	α-helix	trans	-60.5	-32.1	178.8	-24.6	36	0	0	0	113.9	V234 I249 S255	V234-P251 HydrophobicContact CG2-CG 3.71Å; I249-P251 VanDerWaalsContact C-CD 3.45Å; I249-P251 VanDerWaalsContact C-N 3.33Å; P251-S255 WeakPolarHBondContact O-CB 3.29Å; P251-S255 PolarHBondContact O-N 2.95Å; P251-S255 VanDerWaalsContact O-N 3.1Å
252	F	95.8	Very high	86.8	Confident	8 Å²	8	48.5 Å²	48.5	4%	0.035	27%	0.269	C	S	.	.	H	α-helix	trans	-72.5	-41.6	175.2	175.5	-98.6	0	0	0	111.5	V146 M154 I233 I249 Q250 D254 S255 L256 F493 I497	V146-F252 HydrophobicContact CG2-CE2 4.31Å; V146-F252 HydrophobicContact CG2-CZ 4.44Å; M154-F252 HydrophobicContact CE-CD2 4.04Å; M154-F252 HydrophobicContact CE-CE2 4.01Å; I233-F252 HydrophobicContact CG2-CB 3.81Å; I249-F252 WeakPolarHBondContact O-CB 3.43Å; I249-F252 PolarHBondContact O-N 3.42Å; Q250-F252 PolarHBondContact O-N 3.17Å; F252-D254 VanDerWaalsContact C-N 3.33Å; F252-D254 PolarHBondContact O-N 3.36Å; F252-S255 PolarHBondContact O-N 2.94Å; F252-L256 HydrophobicContact CE1-CD2 4.25Å; F252-L256 VanDerWaalsContact O-CB 3.3Å; F252-L256 WeakPolarHBondContact O-CB 3.48Å; F252-L256 PolarHBondContact O-N 3.23Å; F252-F493 AromaticContact CD1-CD2 3.65Å; F252-F493 HydrophobicContact CD1-CD2 3.65Å; F252-F493 AromaticContact CD1-CE2 3.85Å; F252-F493 HydrophobicContact CD1-CE2 3.85Å; F252-F493 AromaticContact CD2-CE2 4Å; F252-F493 HydrophobicContact CD2-CE2 4Å; F252-F493 AromaticContact CE1-CD2 3.72Å; F252-F493 HydrophobicContact CE1-CD2 3.72Å; F252-F493 AromaticContact CE1-CE2 3.75Å; F252-F493 HydrophobicContact CE1-CE2 3.75Å; F252-F493 AromaticContact CE2-CE2 3.91Å; F252-F493 HydrophobicContact CE2-CE2 3.91Å; F252-F493 HydrophobicContact CG-CD2 4.1Å; F252-F493 AromaticContact CG-CE2 3.97Å; F252-F493 HydrophobicContact CG-CE2 3.97Å; F252-F493 HydrophobicContact CZ-CD2 4.25Å; F252-F493 AromaticContact CZ-CE2 3.79Å; F252-F493 HydrophobicContact CZ-CE2 3.79Å; F252-I497 HydrophobicContact CE1-CD1 4.44Å; F252-I497 HydrophobicContact CE2-CD1 4.15Å; F252-I497 HydrophobicContact CZ-CD1 3.56Å; F252-I497 HydrophobicContact CZ-CG1 4.14Å
253	L	95.3	Very high	88.9	Confident	10 Å²	10	47 Å²	47	5%	0.052	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-41.7	175.9	-63.2	178.9	0	0	0	111.5	I249 Q250 L256 Q257 I316 V492 S496	I249-L253 HydrophobicContact CD1-CD1 3.85Å; I249-L253 HydrophobicContact CD1-CD2 4.44Å; I249-L253 HydrophobicContact CD1-CG 4.19Å; I249-L253 HydrophobicContact CG1-CD1 4.04Å; I249-L253 HydrophobicContact CG1-CG 4.34Å; I249-L253 PolarHBondContact O-N 3.49Å; I249-L253 VanDerWaalsContact O-N 3.12Å; Q250-L253 PolarHBondContact O-N 3.34Å; L253-L256 PolarHBondContact O-N 3.19Å; L253-Q257 WeakPolarHBondContact O-CB 3.39Å; L253-Q257 WeakPolarHBondContact O-CG 3.46Å; L253-Q257 PolarHBondContact O-N 2.97Å; L253-I316 HydrophobicContact CD2-CD1 4.08Å; L253-V492 HydrophobicContact CD2-CG1 4.37Å; L253-S496 WeakPolarHBondContact CD2-OG 3.49Å
254	D	93.9	Very high	91	Very high	88 Å²	88	41.7 Å²	41.7	47%	0.471	23%	0.229	S	C	.	.	H	α-helix	trans	-64.5	-46	178	-60.9	-21.4	0	0	0	111	Q250 F252 L256 Q257 Q258	Q250-D254 PolarHBondContact NE2-OD1 3.48Å; Q250-D254 PolarHBondContact O-N 3.44Å; F252-D254 VanDerWaalsContact C-N 3.33Å; F252-D254 PolarHBondContact O-N 3.36Å; D254-L256 VanDerWaalsContact C-N 3.32Å; D254-L256 PolarHBondContact O-N 3.04Å; D254-Q257 PolarHBondContact O-N 3.14Å; D254-Q258 PolarHBondContact O-N 3.36Å
255	S	96.3	Very high	92.5	Very high	32 Å²	32	38.8 Å²	38.8	22%	0.224	21%	0.211	C	C	.	.	H	α-helix	trans	-59.6	-43	175	-171.2	0	0	0	0	111.9	C150 P251 F252 Q258 S259	C150-S255 PolarHBondContact SG-OG 3.18Å; P251-S255 WeakPolarHBondContact O-CB 3.29Å; P251-S255 PolarHBondContact O-N 2.95Å; P251-S255 VanDerWaalsContact O-N 3.1Å; F252-S255 PolarHBondContact O-N 2.94Å; S255-Q258 WeakPolarHBondContact O-CB 3.48Å; S255-Q258 PolarHBondContact O-N 3.48Å; S255-S259 PolarHBondContact O-N 3.41Å; S255-S259 PolarHBondContact O-OG 3.48Å
256	L	96.8	Very high	93.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.9	-41.5	180	-177.1	62.1	0	0	0	111.9	F145 F252 L253 D254 Q258 S259 F260 I316 A500	F145-L256 HydrophobicContact CB-CD1 3.82Å; F145-L256 HydrophobicContact CD1-CD1 4.22Å; F145-L256 HydrophobicContact CG-CD1 4.43Å; F252-L256 HydrophobicContact CE1-CD2 4.25Å; F252-L256 VanDerWaalsContact O-CB 3.3Å; F252-L256 WeakPolarHBondContact O-CB 3.48Å; F252-L256 PolarHBondContact O-N 3.23Å; L253-L256 PolarHBondContact O-N 3.19Å; D254-L256 VanDerWaalsContact C-N 3.32Å; D254-L256 PolarHBondContact O-N 3.04Å; L256-Q258 VanDerWaalsContact C-N 3.32Å; L256-Q258 PolarHBondContact O-N 3.02Å; L256-S259 WeakPolarHBondContact O-CB 3.44Å; L256-S259 PolarHBondContact O-N 3.1Å; L256-F260 HydrophobicContact CD1-CD1 4.31Å; L256-F260 HydrophobicContact CD1-CE1 3.51Å; L256-F260 HydrophobicContact CD1-CE2 4.5Å; L256-F260 HydrophobicContact CD1-CZ 3.63Å; L256-F260 HydrophobicContact CD2-CE2 4.28Å; L256-F260 HydrophobicContact CD2-CZ 3.77Å; L256-F260 HydrophobicContact CG-CE1 3.82Å; L256-F260 HydrophobicContact CG-CE2 3.89Å; L256-F260 HydrophobicContact CG-CZ 3.44Å; L256-F260 VanDerWaalsContact CG-CZ 3.44Å; L256-F260 WeakPolarHBondContact O-CG 3.42Å; L256-F260 PolarHBondContact O-N 3.19Å; L256-I316 HydrophobicContact CD2-CD1 4.1Å; L256-A500 HydrophobicContact CD1-CB 3.98Å
257	Q	95.3	Very high	94	Very high	35 Å²	35	37.1 Å²	37.1	16%	0.164	20%	0.195	C	C	.	.	H	α-helix	trans	-64.4	-37.3	176.4	-74.5	-80.4	56.7	0	0	112.3	L253 D254 F260 S261 I316	L253-Q257 WeakPolarHBondContact O-CB 3.39Å; L253-Q257 WeakPolarHBondContact O-CG 3.46Å; L253-Q257 PolarHBondContact O-N 2.97Å; D254-Q257 PolarHBondContact O-N 3.14Å; Q257-F260 PolarHBondContact O-N 3.44Å; Q257-S261 PolarHBondContact O-N 3.35Å; Q257-S261 PolarHBondContact O-OG 3.49Å; Q257-I316 HydrophobicContact CG-CG1 4.18Å; Q257-I316 VanDerWaalsContact NE2-N 3.17Å; Q257-I316 PolarHBondContact NE2-O 2.99Å
258	Q	95.7	Very high	94.3	Very high	120 Å²	120	37.8 Å²	37.8	56%	0.561	20%	0.199	S	C	*	.	H	α-helix	trans	-63.2	-45.9	171.3	-172.7	62.3	37.7	0	0	110.9	D254 S255 L256 F260 S261 C262	D254-Q258 PolarHBondContact O-N 3.36Å; S255-Q258 WeakPolarHBondContact O-CB 3.48Å; S255-Q258 PolarHBondContact O-N 3.48Å; L256-Q258 VanDerWaalsContact C-N 3.32Å; L256-Q258 PolarHBondContact O-N 3.02Å; Q258-F260 PolarHBondContact O-N 3.3Å; Q258-S261 PolarHBondContact O-N 3.26Å; Q258-C262 PolarHBondContact NE2-SG 3.33Å; Q258-C262 PolarHBondContact O-N 2.82Å; Q258-C262 PolarHBondContact O-SG 2.78Å
259	S	97.2	Very high	94.5	Very high	16 Å²	16	36.1 Å²	36.1	11%	0.112	19%	0.194	C	C	.	.	H	α-helix	trans	-58.5	-44.2	176	-73	0	0	0	0	112.4	L144 S255 L256 S261 C262 T263	L144-S259 WeakPolarHBondContact O-CB 3.35Å; L144-S259 PolarHBondContact O-OG 3.23Å; S255-S259 PolarHBondContact O-N 3.41Å; S255-S259 PolarHBondContact O-OG 3.48Å; L256-S259 WeakPolarHBondContact O-CB 3.44Å; L256-S259 PolarHBondContact O-N 3.1Å; S259-S261 VanDerWaalsContact C-N 3.28Å; S259-S261 PolarHBondContact O-N 3.01Å; S259-C262 PolarHBondContact O-N 2.81Å; S259-T263 VanDerWaalsContact O-CB 3.3Å; S259-T263 WeakPolarHBondContact O-CB 3.49Å; S259-T263 WeakPolarHBondContact O-CG2 3.42Å; S259-T263 PolarHBondContact O-N 3.41Å; S259-T263 PolarHBondContact O-OG1 3.31Å
260	F	96.5	Very high	94.6	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.009	19%	0.194	C	C	.	.	H	α-helix	trans	-57.1	-43.7	176	-63.4	-20.4	0	0	0	112	F145 L256 Q257 Q258 F264 F312 I313 C314 I316 I499 N503	F145-F260 AromaticContact CD1-CD1 3.62Å; F145-F260 HydrophobicContact CD1-CD1 3.62Å; F145-F260 AromaticContact CD1-CE1 3.67Å; F145-F260 HydrophobicContact CD1-CE1 3.67Å; F145-F260 AromaticContact CE1-CD1 3.57Å; F145-F260 HydrophobicContact CE1-CD1 3.57Å; F145-F260 AromaticContact CE1-CE1 3.93Å; F145-F260 HydrophobicContact CE1-CE1 3.93Å; L256-F260 HydrophobicContact CD1-CD1 4.31Å; L256-F260 HydrophobicContact CD1-CE1 3.51Å; L256-F260 HydrophobicContact CD1-CE2 4.5Å; L256-F260 HydrophobicContact CD1-CZ 3.63Å; L256-F260 HydrophobicContact CD2-CE2 4.28Å; L256-F260 HydrophobicContact CD2-CZ 3.77Å; L256-F260 HydrophobicContact CG-CE1 3.82Å; L256-F260 HydrophobicContact CG-CE2 3.89Å; L256-F260 HydrophobicContact CG-CZ 3.44Å; L256-F260 VanDerWaalsContact CG-CZ 3.44Å; L256-F260 WeakPolarHBondContact O-CG 3.42Å; L256-F260 PolarHBondContact O-N 3.19Å; Q257-F260 PolarHBondContact O-N 3.44Å; Q258-F260 PolarHBondContact O-N 3.3Å; F260-F264 PolarHBondContact O-N 2.94Å; F260-F312 HydrophobicContact CB-CE1 4.32Å; F260-F312 HydrophobicContact CD1-CE1 4.46Å; F260-F312 HydrophobicContact CD1-CZ 4.4Å; F260-I313 HydrophobicContact CE2-CG2 4.45Å; F260-C314 WeakPolarHBondContact CB-O 3.13Å; F260-I316 HydrophobicContact CE2-CD1 4.46Å; F260-I316 HydrophobicContact CE2-CG1 4.36Å; F260-I316 HydrophobicContact CE2-CG2 3.98Å; F260-I499 HydrophobicContact CE1-CG2 4.5Å; F260-I499 HydrophobicContact CE2-CG2 4.47Å; F260-I499 HydrophobicContact CZ-CG2 3.76Å; F260-N503 WeakPolarHBondContact CD1-ND2 3.28Å; F260-N503 WeakPolarHBondContact CE1-ND2 3.4Å
261	S	93.1	Very high	94.7	Very high	54 Å²	54	34.6 Å²	34.6	38%	0.378	19%	0.188	S	C	.	.	H	α-helix	trans	-71.7	-34.8	-178	-54.1	0	0	0	0	112.9	Q257 Q258 S259 Q315	Q257-S261 PolarHBondContact O-N 3.35Å; Q257-S261 PolarHBondContact O-OG 3.49Å; Q258-S261 PolarHBondContact O-N 3.26Å; S259-S261 VanDerWaalsContact C-N 3.28Å; S259-S261 PolarHBondContact O-N 3.01Å; S261-Q315 PolarHBondContact OG-NE2 3.34Å
262	C	95	Very high	94.7	Very high	66 Å²	66	31.5 Å²	31.5	45%	0.446	17%	0.168	S	C	.	.	H	α-helix	trans	-80.8	-23.1	180	-73	0	0	0	0	113.9	V129 Q258 S259	V129-C262 WeakPolarHBondContact CB-O 3.36Å; V129-C262 WeakPolarHBondContact CG1-O 3.37Å; V129-C262 WeakPolarHBondContact CG2-O 3.39Å; Q258-C262 PolarHBondContact NE2-SG 3.33Å; Q258-C262 PolarHBondContact O-N 2.82Å; Q258-C262 PolarHBondContact O-SG 2.78Å; S259-C262 PolarHBondContact O-N 2.81Å
263	T	96.3	Very high	94.3	Very high	7 Å²	7	32.4 Å²	32.4	4%	0.043	17%	0.172	C	C	.	.	H	α-helix	trans	-99.1	-22.5	-170.3	55.5	0	0	0	0	113.6	P128 V129 L144 F145 S259	P128-T263 WeakPolarHBondContact CA-O 3.17Å; V129-T263 PolarHBondContact N-O 2.98Å; L144-T263 HydrophobicContact CB-CG2 3.99Å; L144-T263 HydrophobicContact CD1-CG2 4.46Å; F145-T263 HydrophobicContact CE1-CG2 4.45Å; F145-T263 WeakPolarHBondContact CE1-OG1 3.45Å; S259-T263 VanDerWaalsContact O-CB 3.3Å; S259-T263 WeakPolarHBondContact O-CB 3.49Å; S259-T263 WeakPolarHBondContact O-CG2 3.42Å; S259-T263 PolarHBondContact O-N 3.41Å; S259-T263 PolarHBondContact O-OG1 3.31Å
264	F	96.1	Very high	93.8	Very high	7 Å²	7	36.1 Å²	36.1	3%	0.031	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	135	-171.1	-167.9	-99.7	0	0	0	113.7	F260 P266 C307 T310 F312 L507 M510	F260-F264 PolarHBondContact O-N 2.94Å; F264-P266 HydrophobicContact CE1-CB 4.47Å; F264-C307 HydrophobicContact CE1-CB 3.96Å; F264-T310 HydrophobicContact CE2-CG2 4.33Å; F264-T310 HydrophobicContact CZ-CG2 3.68Å; F264-T310 WeakPolarHBondContact CZ-OG1 2.95Å; F264-F312 HydrophobicContact CB-CD1 3.81Å; F264-F312 HydrophobicContact CB-CD2 4.16Å; F264-F312 HydrophobicContact CB-CE1 3.49Å; F264-F312 VanDerWaalsContact CB-CE1 3.49Å; F264-F312 HydrophobicContact CB-CE2 3.85Å; F264-F312 HydrophobicContact CB-CG 4.13Å; F264-F312 HydrophobicContact CB-CZ 3.49Å; F264-F312 VanDerWaalsContact CB-CZ 3.49Å; F264-F312 HydrophobicContact CD1-CB 3.79Å; F264-F312 AromaticContact CD1-CD1 3.44Å; F264-F312 HydrophobicContact CD1-CD1 3.44Å; F264-F312 VanDerWaalsContact CD1-CD1 3.44Å; F264-F312 HydrophobicContact CD1-CD2 4.24Å; F264-F312 HydrophobicContact CD1-CE1 4.04Å; F264-F312 AromaticContact CD1-CG 3.56Å; F264-F312 HydrophobicContact CD1-CG 3.56Å; F264-F312 HydrophobicContact CD2-CB 4.5Å; F264-F312 AromaticContact CD2-CD2 3.99Å; F264-F312 HydrophobicContact CD2-CD2 3.99Å; F264-F312 HydrophobicContact CD2-CE2 4.32Å; F264-F312 HydrophobicContact CD2-CG 4.11Å; F264-F312 HydrophobicContact CE1-CB 3.63Å; F264-F312 HydrophobicContact CE1-CD1 4.17Å; F264-F312 AromaticContact CE1-CG 3.95Å; F264-F312 HydrophobicContact CE1-CG 3.95Å; F264-F312 HydrophobicContact CE2-CB 4.38Å; F264-F312 HydrophobicContact CE2-CG 4.47Å; F264-F312 HydrophobicContact CG-CB 4.24Å; F264-F312 AromaticContact CG-CD1 3.7Å; F264-F312 HydrophobicContact CG-CD1 3.7Å; F264-F312 AromaticContact CG-CD2 3.87Å; F264-F312 HydrophobicContact CG-CD2 3.87Å; F264-F312 AromaticContact CG-CE1 3.93Å; F264-F312 HydrophobicContact CG-CE1 3.93Å; F264-F312 HydrophobicContact CG-CE2 4.07Å; F264-F312 AromaticContact CG-CG 3.66Å; F264-F312 HydrophobicContact CG-CG 3.66Å; F264-F312 HydrophobicContact CG-CZ 4.1Å; F264-F312 HydrophobicContact CZ-CB 3.99Å; F264-F312 HydrophobicContact CZ-CG 4.43Å; F264-L507 HydrophobicContact CD2-CD2 3.8Å; F264-M510 HydrophobicContact CE2-CE 4.26Å; F264-M510 HydrophobicContact CE2-SD 3.84Å
265	R	94.6	Very high	92.9	Very high	108 Å²	108	32.4 Å²	32.4	41%	0.408	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.4	169.1	-67.7	173	-171.9	159.5	3.7	109	T125 Y126 G127 V129	T125-R265 WeakPolarHBondContact O-CB 3.36Å; T125-R265 WeakPolarHBondContact O-CD 3.35Å; Y126-R265 CarbonylContact C-O 3.48Å; Y126-R265 VanDerWaalsContact CA-O 3.23Å; Y126-R265 WeakPolarHBondContact CA-O 2.92Å; Y126-R265 WeakPolarHBondContact CB-O 3.43Å; G127-R265 PolarHBondContact N-O 2.88Å; G127-R265 PolarHBondContact O-N 3.02Å; V129-R265 HydrophobicContact CG2-CG 3.82Å
266	P	93.2	Very high	91.6	Very high	12 Å²	12	33.7 Å²	33.7	8%	0.078	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-72.7	158.6	-179.7	30.3	-34.7	0	0	0	113	Y122 Y126 F264 Q270 C307	Y122-P266 WeakPolarHBondContact CE1-O 3.36Å; Y122-P266 PolarHBondContact OH-O 3.23Å; Y126-P266 VanDerWaalsContact CB-C 3.47Å; Y126-P266 WeakPolarHBondContact CB-O 3.44Å; F264-P266 HydrophobicContact CE1-CB 4.47Å; P266-Q270 HydrophobicContact CB-CG 4.34Å; P266-C307 HydrophobicContact CB-CB 4.14Å
267	S	92.1	Very high	90.1	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.021	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-67	168.6	166.8	57.4	0	0	0	0	111.6	T269 Q270 C307 S309	S267-T269 VanDerWaalsContact C-N 3.28Å; S267-T269 PolarHBondContact O-N 3.49Å; S267-T269 PolarHBondContact OG-O 2.91Å; S267-Q270 PolarHBondContact O-NE2 2.98Å; S267-C307 PolarHBondContact N-SG 2.93Å; S267-C307 PolarHBondContact OG-SG 3.45Å; S267-S309 WeakPolarHBondContact CB-OG 3.35Å; S267-S309 PolarHBondContact OG-OG 3.01Å
268	Q	92.8	Very high	88	Confident	58 Å²	58	35.7 Å²	35.7	27%	0.271	19%	0.185	S	C	.	.	S	Bend	trans	-54.8	-45.8	174.2	-171.2	169.5	26.4	0	0	111.8	P120 Y122 N354 A355 V356	P120-Q268 PolarHBondContact O-NE2 3.33Å; Y122-Q268 HydrophobicContact CD1-CB 4.09Å; Y122-Q268 HydrophobicContact CD2-CB 3.72Å; Y122-Q268 HydrophobicContact CD2-CG 3.64Å; Y122-Q268 HydrophobicContact CE2-CB 4.36Å; Y122-Q268 HydrophobicContact CE2-CG 4.42Å; Y122-Q268 HydrophobicContact CG-CB 3.57Å; Y122-Q268 HydrophobicContact CG-CG 3.9Å; Q268-N354 WeakPolarHBondContact CG-O 3.05Å; Q268-N354 PolarHBondContact NE2-O 2.89Å; Q268-A355 CarbonylContact O-C 3.5Å; Q268-A355 WeakPolarHBondContact O-CA 3.45Å; Q268-V356 HydrophobicContact CG-CG2 4.08Å; Q268-V356 PolarHBondContact O-N 3.34Å
269	T	92.8	Very high	85.7	Confident	18 Å²	18	35.4 Å²	35.4	11%	0.11	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	130.4	-177.4	55.5	0	0	0	0	112	S267 T308 V356 F358	S267-T269 VanDerWaalsContact C-N 3.28Å; S267-T269 PolarHBondContact O-N 3.49Å; S267-T269 PolarHBondContact OG-O 2.91Å; T269-T308 PolarHBondContact O-N 2.98Å; T269-T308 VanDerWaalsContact O-N 3.14Å; T269-T308 PolarHBondContact O-OG1 2.96Å; T269-V356 WeakPolarHBondContact CA-O 3.38Å; T269-V356 HydrophobicContact CG2-CB 4.3Å; T269-F358 HydrophobicContact CG2-CE2 4.12Å
270	Q	94.3	Very high	82.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	163.1	-177.6	-52.2	169.8	24.5	0	0	110	P266 S267 R305 Q306 T308 V356 I357 F358	P266-Q270 HydrophobicContact CB-CG 4.34Å; S267-Q270 PolarHBondContact O-NE2 2.98Å; Q270-R305 HydrophobicContact CB-CG 4.43Å; Q270-Q306 CarbonylContact C-O 3.46Å; Q270-Q306 WeakPolarHBondContact CA-O 3.4Å; Q270-Q306 VanDerWaalsContact CB-O 3.32Å; Q270-Q306 WeakPolarHBondContact CB-O 3.3Å; Q270-T308 VanDerWaalsContact CA-OG1 3.29Å; Q270-T308 WeakPolarHBondContact CA-OG1 3.44Å; Q270-T308 PolarHBondContact N-OG1 2.77Å; Q270-V356 PolarHBondContact N-O 3.19Å; Q270-I357 HydrophobicContact CB-CD1 3.88Å; Q270-I357 CarbonylContact O-C 3.49Å; Q270-I357 WeakPolarHBondContact O-CA 3.34Å; Q270-F358 WeakPolarHBondContact O-CD2 3.43Å; Q270-F358 PolarHBondContact O-N 2.72Å
271	V	92.8	Very high	79.9	Confident	16 Å²	16	44.7 Å²	44.7	10%	0.097	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	145.2	-178.3	62.9	0	0	0	0	111.7	R305 Q306 F358 I469	V271-R305 CarbonylContact O-C 3.08Å; V271-R305 WeakPolarHBondContact O-CA 3.38Å; V271-Q306 HydrophobicContact CG1-CB 3.89Å; V271-Q306 PolarHBondContact N-O 3.2Å; V271-Q306 PolarHBondContact O-N 2.96Å; V271-F358 WeakPolarHBondContact CA-O 3.47Å; V271-F358 HydrophobicContact CB-CB 4.19Å; V271-F358 HydrophobicContact CG2-CB 4.09Å; V271-I469 HydrophobicContact CG1-CD1 3.43Å; V271-I469 VanDerWaalsContact CG1-CD1 3.43Å; V271-I469 HydrophobicContact CG1-CG1 3.84Å
272	L	93.4	Very high	76.9	Confident	2 Å²	2	48 Å²	48	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	120.8	165.6	-58.1	-179.4	0	0	0	109.6	V304 R305 A343 L346 I357 F358 T359 I363	L272-V304 WeakPolarHBondContact CA-O 3.07Å; L272-R305 HydrophobicContact CD2-CB 3.65Å; L272-R305 HydrophobicContact CD2-CG 3.89Å; L272-A343 HydrophobicContact CD1-CB 3.63Å; L272-L346 HydrophobicContact CD2-CB 3.86Å; L272-L346 HydrophobicContact CD2-CD1 3.93Å; L272-I357 HydrophobicContact CD1-CG2 3.81Å; L272-I357 HydrophobicContact CD2-CG2 4.48Å; L272-I357 HydrophobicContact CG-CG2 3.61Å; L272-F358 PolarHBondContact N-O 2.91Å; L272-T359 HydrophobicContact CB-CG2 4.46Å; L272-T359 HydrophobicContact CD1-CG2 4.27Å; L272-I363 HydrophobicContact CB-CD1 3.9Å; L272-I363 HydrophobicContact CD1-CG2 4.41Å
273	H	86.5	Confident	73.9	Confident	27 Å²	27	50 Å²	50	13%	0.125	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	168.2	176.7	71.6	114.2	0	0	0	112.1	W303 V304 Q306 D473	H273-W303 WeakPolarHBondContact O-CA 3.25Å; H273-V304 PolarHBondContact N-O 3.48Å; H273-V304 VanDerWaalsContact NE2-CG2 3.34Å; H273-V304 WeakPolarHBondContact NE2-CG2 3.4Å; H273-V304 PolarHBondContact O-N 3.36Å; H273-Q306 PolarHBondContact NE2-OE1 3.38Å; H273-D473 IonicContact CE1-OD1 2.74Å; H273-D473 IonicContact CE1-OD2 3.6Å; H273-D473 IonicContact ND1-OD2 2.75Å
274	E	84.8	Confident	71	Confident	87 Å²	87	52.8 Å²	52.8	41%	0.407	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-87.7	119.9	162.4	-63.6	-175.2	-122	0	0	106.9	S301 L302 W303	E274-S301 PolarHBondContact OE2-OG 2.75Å; E274-S301 VanDerWaalsContact OE2-OG 3.11Å; E274-L302 WeakPolarHBondContact CA-O 3.22Å; E274-L302 WeakPolarHBondContact CG-O 3.28Å; E274-W303 VanDerWaalsContact CD-NE1 3.32Å; E274-W303 HydrophobicContact CG-CD2 4.16Å; E274-W303 HydrophobicContact CG-CG 3.86Å; E274-W303 PolarHBondContact OE1-NE1 2.89Å; E274-W303 VanDerWaalsContact OE1-NE1 3.09Å
275	P	75.8	Confident	67.8	Low	11 Å²	11	55.6 Å²	55.6	7%	0.071	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-67.9	147.6	179.3	27.8	-32.5	0	0	0	110.1	I277 L302 V304	P275-I277 HydrophobicContact CG-CD1 4.4Å; P275-I277 HydrophobicContact CG-CG1 4.33Å; P275-I277 PolarHBondContact O-N 3.33Å; P275-I277 VanDerWaalsContact O-N 3.13Å; P275-L302 WeakPolarHBondContact CD-O 3.25Å; P275-L302 HydrophobicContact CG-CD2 3.71Å; P275-L302 HydrophobicContact CG-CG 4.22Å; P275-V304 HydrophobicContact CG-CG1 3.84Å; P275-V304 HydrophobicContact CG-CG2 4.36Å
276	L	68.4	Low	64.8	Low	59 Å²	59	52.6 Å²	52.6	31%	0.309	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-64.2	117.1	168.1	-64.9	-173.9	0	0	0	109.4	I284 D473 S477 F480	L276-I284 HydrophobicContact CD1-CD1 3.52Å; L276-I284 HydrophobicContact CD1-CG1 3.43Å; L276-I284 VanDerWaalsContact CD1-CG1 3.43Å; L276-I284 HydrophobicContact CD2-CG1 4.26Å; L276-I284 HydrophobicContact CG-CD1 4.07Å; L276-I284 HydrophobicContact CG-CG1 4.19Å; L276-D473 HydrophobicContact CB-CB 4.02Å; L276-D473 HydrophobicContact CD1-CB 3.73Å; L276-D473 HydrophobicContact CG-CB 3.83Å; L276-D473 PolarHBondContact N-OD2 3.19Å; L276-S477 WeakPolarHBondContact O-CB 3.39Å; L276-F480 WeakPolarHBondContact O-CE2 3.38Å
277	I	64.5	Low	62.3	Low	34 Å²	34	56.7 Å²	56.7	17%	0.174	31%	0.31	C	S	.	.			trans	-118.8	101	172.4	-53.6	146.4	0	0	0	103.2	P275 E279 R298 L302 F480 L495	P275-I277 HydrophobicContact CG-CD1 4.4Å; P275-I277 HydrophobicContact CG-CG1 4.33Å; P275-I277 PolarHBondContact O-N 3.33Å; P275-I277 VanDerWaalsContact O-N 3.13Å; I277-E279 PolarHBondContact O-N 2.72Å; I277-R298 VanDerWaalsContact CG2-NH2 3.26Å; I277-R298 PolarHBondContact O-NH1 2.95Å; I277-R298 PolarHBondContact O-NH2 3.28Å; I277-L302 HydrophobicContact CD1-CB 4.28Å; I277-L302 HydrophobicContact CD1-CD2 4.16Å; I277-F480 HydrophobicContact CB-CD2 4.09Å; I277-F480 HydrophobicContact CB-CE2 3.97Å; I277-F480 HydrophobicContact CG1-CD2 4.21Å; I277-F480 HydrophobicContact CG1-CE2 3.63Å; I277-F480 HydrophobicContact CG2-CD2 3.84Å; I277-F480 HydrophobicContact CG2-CE2 4.15Å; I277-L495 HydrophobicContact CB-CD1 4.46Å; I277-L495 HydrophobicContact CD1-CD1 4.14Å; I277-L495 HydrophobicContact CD1-CD2 3.43Å; I277-L495 VanDerWaalsContact CD1-CD2 3.43Å; I277-L495 HydrophobicContact CD1-CG 4.41Å; I277-L495 HydrophobicContact CG1-CD1 3.71Å; I277-L495 HydrophobicContact CG1-CD2 3.98Å; I277-L495 HydrophobicContact CG1-CG 4.5Å; I277-L495 HydrophobicContact CG2-CD1 3.96Å; I277-L495 HydrophobicContact CG2-CD2 4.37Å
278	D	52.8	Low	59.4	Low	43 Å²	43	61.3 Å²	61.3	23%	0.23	34%	0.338	C	S	.	.			trans	-48.2	130.7	-177.2	-95.4	-14.7	0	0	0	111.4	R298	D278-R298 PolarHBondContact O-NH2 2.85Å; D278-R298 VanDerWaalsContact O-NH2 3.13Å
279	E	46.4	Very low	56.5	Low	113 Å²	113	67.1 Å²	67.1	53%	0.528	37%	0.365	S	S	.	.	S	Bend	trans	-116.2	95.3	138.1	-57.3	-146.6	178	0	0	104.7	I277 R298	I277-E279 PolarHBondContact O-N 2.72Å; E279-R298 IonicContact OE1-CZ 3.66Å; E279-R298 IonicContact OE1-NE 3.91Å; E279-R298 PolarHBondContact OE1-NE 3.46Å; E279-R298 IonicContact OE1-NH2 2.7Å; E279-R298 PolarHBondContact OE1-NH2 2.77Å
280	D	36	Very low	53.5	Low	122 Å²	122	77.4 Å²	77.4	65%	0.652	40%	0.402	S	S	*	.	S	Bend	trans	67.3	139.7	-166.3	-81.5	-41.2	0	0	0	117	V282	D280-V282 PolarHBondContact O-N 3.17Å; D280-V282 VanDerWaalsContact O-N 3.12Å
281	P	35.9	Very low	50.6	Low	92 Å²	92	84.3 Å²	84.3	60%	0.597	44%	0.439	S	S	*	.			trans	-81.3	97.2	-171.3	33.5	-32.1	0	0	0	109.9
282	V	31.1	Very low	47.8	Very low	123 Å²	123	90.1 Å²	90.1	75%	0.745	47%	0.469	S	S	*	.			trans	-138.5	87.2	153.1	-174.7	0	0	0	0	107.4	D280	D280-V282 PolarHBondContact O-N 3.17Å; D280-V282 VanDerWaalsContact O-N 3.12Å
283	F	32	Very low	44.8	Very low	107 Å²	107	100.4 Å²	100.4	47%	0.469	51%	0.507	S	S	.	.			trans	23.4	144.2	138.6	-141.8	-102.6	0	0	0	118.5	T285 D474	F283-T285 HydrophobicContact CB-CG2 4.39Å; F283-T285 HydrophobicContact CD1-CG2 3.86Å; F283-T285 PolarHBondContact O-N 3.2Å; F283-T285 PolarHBondContact O-OG1 2.8Å; F283-D474 HydrophobicContact CD2-CB 4.39Å; F283-D474 VanDerWaalsContact CD2-OD1 3.3Å; F283-D474 WeakPolarHBondContact CD2-OD1 3.42Å; F283-D474 HydrophobicContact CE2-CB 3.86Å; F283-D474 WeakPolarHBondContact CE2-OD1 3.35Å; F283-D474 HydrophobicContact CZ-CB 4.48Å
284	I	35.4	Very low	42.4	Very low	66 Å²	66	109.6 Å²	109.6	34%	0.338	55%	0.547	S	S	.	.	S	Bend	trans	-64.2	70.8	156.2	-60.3	164.3	0	0	0	107.7	L276 C470 D473	L276-I284 HydrophobicContact CD1-CD1 3.52Å; L276-I284 HydrophobicContact CD1-CG1 3.43Å; L276-I284 VanDerWaalsContact CD1-CG1 3.43Å; L276-I284 HydrophobicContact CD2-CG1 4.26Å; L276-I284 HydrophobicContact CG-CD1 4.07Å; L276-I284 HydrophobicContact CG-CG1 4.19Å; I284-C470 HydrophobicContact CD1-CB 3.89Å; I284-C470 HydrophobicContact CG2-CB 4.48Å; I284-D473 HydrophobicContact CD1-CB 4.24Å
285	T	29	Very low	40.6	Very low	67 Å²	67	114.8 Å²	114.8	41%	0.411	56%	0.563	S	S	.	*			trans	-93.2	125.4	156.2	38.8	0	0	0	0	105.6	F283	F283-T285 HydrophobicContact CB-CG2 4.39Å; F283-T285 HydrophobicContact CD1-CG2 3.86Å; F283-T285 PolarHBondContact O-N 3.2Å; F283-T285 PolarHBondContact O-OG1 2.8Å
286	T	31.9	Very low	39.1	Very low	44 Å²	44	123.4 Å²	123.4	27%	0.27	60%	0.599	S	S	.	*			trans	-1.8	129.1	152	40.7	0	0	0	0	115.3	D38 T288	D38-T286 WeakPolarHBondContact O-CG2 3.42Å; T286-T288 VanDerWaalsContact C-N 3.32Å; T286-T288 PolarHBondContact O-N 3.46Å; T286-T288 PolarHBondContact O-OG1 3.14Å
287	C	39.7	Very low	38.4	Very low	98 Å²	98	129.9 Å²	129.9	66%	0.662	63%	0.625	S	S	*	*	S	Bend	trans	-54	94.9	168.1	-50.6	0	0	0	0	110.5	Y53	Y53-C287 HydrophobicContact CD1-CB 4.29Å; Y53-C287 HydrophobicContact CE1-CB 3.48Å; Y53-C287 VanDerWaalsContact CE1-CB 3.48Å; Y53-C287 PolarHBondContact OH-O 3.47Å
288	T	32.3	Very low	38.6	Very low	101 Å²	101	131.1 Å²	131.1	62%	0.62	63%	0.627	S	S	*	*			trans	-148.4	121.6	164.2	43.2	0	0	0	0	108.8	T286	T286-T288 VanDerWaalsContact C-N 3.32Å; T286-T288 PolarHBondContact O-N 3.46Å; T286-T288 PolarHBondContact O-OG1 3.14Å
289	E	30.6	Very low	40	Very low	179 Å²	179	135.9 Å²	135.9	84%	0.836	65%	0.646	S	S	*	*			trans	86.6	89.5	157.4	-56.8	-170.1	159.9	0	0	120.4	D291	E289-D291 PolarHBondContact O-N 3.43Å; E289-D291 VanDerWaalsContact O-N 3.09Å
290	R	31.1	Very low	41.8	Very low	235 Å²	235	130.9 Å²	130.9	89%	0.887	62%	0.622	S	S	*	*				64.7	3.7	108.7	-108.6	-177.9	-157.6	146.7	6.7	123.9
291	D	32.6	Very low	44.1	Very low	145 Å²	145	125.7 Å²	125.7	78%	0.775	60%	0.595	S	S	*	*			trans	-137.4	74	167	-82.1	-45.1	0	0	0	113.1	E289 R293	E289-D291 PolarHBondContact O-N 3.43Å; E289-D291 VanDerWaalsContact O-N 3.09Å; D291-R293 PolarHBondContact O-N 3.16Å
292	L	33.5	Very low	46.6	Very low	138 Å²	138	121.5 Å²	121.5	72%	0.723	57%	0.568	S	S	*	*			trans	-67.8	83	163.8	-71.2	171.3	0	0	0	109.4	K294 R295	L292-K294 PolarHBondContact O-N 2.82Å; L292-R295 VanDerWaalsContact CD2-CZ 3.48Å
293	R	30.6	Very low	49.5	Very low	218 Å²	218	116 Å²	116	82%	0.823	53%	0.534	S	S	*	.			trans	-48	125.5	165.2	-66	-179.4	-170.6	177.4	3.2	108.7	D291 R295	D291-R293 PolarHBondContact O-N 3.16Å; R293-R295 WeakPolarHBondContact O-CG 3.4Å; R293-R295 PolarHBondContact O-N 2.93Å
294	K	35.8	Very low	52.4	Low	219 Å²	219	111 Å²	111	95%	0.952	51%	0.512	S	S	*	.			trans	-41.3	95	-178.3	-64.2	170.1	179.6	173.9	0	112	L292	L292-K294 PolarHBondContact O-N 2.82Å
295	R	46.8	Very low	55.3	Low	196 Å²	196	108 Å²	108	74%	0.74	50%	0.497	S	S	*	.			trans	-85.1	140.2	-177	-54	-174.3	179	154.4	-4	111.5	L292 R293 K297	L292-R295 VanDerWaalsContact CD2-CZ 3.48Å; R293-R295 WeakPolarHBondContact O-CG 3.4Å; R293-R295 PolarHBondContact O-N 2.93Å; R295-K297 PolarHBondContact O-N 2.84Å
296	K	44.1	Very low	58.3	Low	193 Å²	193	104.9 Å²	104.9	84%	0.839	48%	0.477	S	S	*	.			trans	-72.1	105.9	164.6	-95.9	179.5	177.8	171.5	0	108.5	R298	K296-R298 PolarHBondContact O-N 3.37Å
297	K	55.4	Low	61.2	Low	195 Å²	195	102.8 Å²	102.8	85%	0.848	46%	0.464	S	S	*	.			trans	-59.2	125.7	176.9	-69.6	178.7	179.6	174.3	0	110	R295	R295-K297 PolarHBondContact O-N 2.84Å
298	R	68.1	Low	63.4	Low	60 Å²	60	98.3 Å²	98.3	23%	0.226	43%	0.434	C	S	.	.			trans	-57.6	144.2	170.3	-68.5	-174.7	-176.1	146.1	-2.7	110.3	I277 D278 E279 K296 F300 K321	I277-R298 VanDerWaalsContact CG2-NH2 3.26Å; I277-R298 PolarHBondContact O-NH1 2.95Å; I277-R298 PolarHBondContact O-NH2 3.28Å; D278-R298 PolarHBondContact O-NH2 2.85Å; D278-R298 VanDerWaalsContact O-NH2 3.13Å; E279-R298 IonicContact OE1-CZ 3.66Å; E279-R298 IonicContact OE1-NE 3.91Å; E279-R298 PolarHBondContact OE1-NE 3.46Å; E279-R298 IonicContact OE1-NH2 2.7Å; E279-R298 PolarHBondContact OE1-NH2 2.77Å; K296-R298 PolarHBondContact O-N 3.37Å; R298-F300 HydrophobicContact CB-CD1 4.43Å; R298-F300 HydrophobicContact CB-CE1 4.5Å; R298-F300 PolarHBondContact O-N 3.35Å; R298-K321 WeakPolarHBondContact O-CD 3Å
299	K	80.9	Confident	65.9	Low	143 Å²	143	94.9 Å²	94.9	62%	0.622	41%	0.414	S	S	*	.	S	Bend	trans	-80.5	10.6	179.1	-61.6	-175.6	178	-177.2	0	113.5	K321 T488	K299-K321 PolarHBondContact O-N 3.33Å; K299-T488 HydrophobicContact CB-CG2 4.17Å
300	F	84.1	Confident	68.6	Low	8 Å²	8	87 Å²	87	4%	0.035	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	167.8	179.3	71.7	-83.6	0	0	0	111.3	R298 L302 V318 H319 L320 K321 T488 Q491 V492 L495	R298-F300 HydrophobicContact CB-CD1 4.43Å; R298-F300 HydrophobicContact CB-CE1 4.5Å; R298-F300 PolarHBondContact O-N 3.35Å; F300-L302 HydrophobicContact CE2-CB 4.5Å; F300-V318 HydrophobicContact CB-CG1 4.42Å; F300-V318 HydrophobicContact CD2-CG1 4.07Å; F300-H319 CarbonylContact C-O 3.48Å; F300-H319 WeakPolarHBondContact CA-O 3.33Å; F300-H319 WeakPolarHBondContact CB-O 3.09Å; F300-L320 HydrophobicContact CB-CD2 3.9Å; F300-K321 WeakPolarHBondContact O-CE 3.38Å; F300-K321 PolarHBondContact O-NZ 3.39Å; F300-T488 HydrophobicContact CB-CG2 4.38Å; F300-T488 HydrophobicContact CD1-CG2 3.8Å; F300-T488 HydrophobicContact CG-CG2 4.45Å; F300-Q491 HydrophobicContact CE1-CB 3.79Å; F300-Q491 HydrophobicContact CZ-CB 4.26Å; F300-V492 HydrophobicContact CD1-CG2 4.02Å; F300-V492 HydrophobicContact CD2-CG2 3.86Å; F300-V492 HydrophobicContact CE1-CG2 4.03Å; F300-V492 HydrophobicContact CE2-CG2 3.87Å; F300-V492 HydrophobicContact CG-CG2 3.93Å; F300-V492 HydrophobicContact CZ-CG2 3.95Å; F300-L495 HydrophobicContact CE2-CD2 3.95Å; F300-L495 HydrophobicContact CZ-CD2 4.17Å
301	S	85.5	Confident	71.4	Confident	12 Å²	12	75.8 Å²	75.8	8%	0.084	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	150.2	164	-90.5	0	0	0	0	109.4	E274 V318 H319 K321	E274-S301 PolarHBondContact OE2-OG 2.75Å; E274-S301 VanDerWaalsContact OE2-OG 3.11Å; S301-V318 WeakPolarHBondContact O-CA 3.33Å; S301-H319 PolarHBondContact N-O 3.21Å; S301-H319 PolarHBondContact O-N 2.77Å; S301-K321 WeakPolarHBondContact OG-CE 3.35Å; S301-K321 PolarHBondContact OG-NZ 3.25Å
302	L	88.1	Confident	74.2	Confident	5 Å²	5	68.9 Å²	68.9	3%	0.026	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.5	176	170.7	70.8	0	0	0	107.7	E274 P275 I277 F300 V304 I316 S317 V318 L495 I499	E274-L302 WeakPolarHBondContact CA-O 3.22Å; E274-L302 WeakPolarHBondContact CG-O 3.28Å; P275-L302 WeakPolarHBondContact CD-O 3.25Å; P275-L302 HydrophobicContact CG-CD2 3.71Å; P275-L302 HydrophobicContact CG-CG 4.22Å; I277-L302 HydrophobicContact CD1-CB 4.28Å; I277-L302 HydrophobicContact CD1-CD2 4.16Å; F300-L302 HydrophobicContact CE2-CB 4.5Å; L302-V304 HydrophobicContact CD1-CG1 4.37Å; L302-V304 HydrophobicContact CD2-CG1 4.2Å; L302-V304 HydrophobicContact CG-CG1 4.12Å; L302-I316 HydrophobicContact CD1-CB 3.98Å; L302-I316 HydrophobicContact CD1-CG2 4.43Å; L302-S317 WeakPolarHBondContact CA-O 3.32Å; L302-V318 HydrophobicContact CD1-CG2 3.77Å; L302-L495 HydrophobicContact CB-CD2 4.36Å; L302-L495 HydrophobicContact CD2-CD1 4.39Å; L302-L495 HydrophobicContact CD2-CD2 3.55Å; L302-L495 HydrophobicContact CD2-CG 3.95Å; L302-I499 HydrophobicContact CD2-CD1 3.73Å
303	W	91.3	Very high	77.2	Confident	8 Å²	8	62.5 Å²	62.5	3%	0.03	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	149.4	168.2	-62.4	-96.9	0	0	0	109.8	H273 E274 I316 S317 H319 L338 V342 L346	H273-W303 WeakPolarHBondContact O-CA 3.25Å; E274-W303 VanDerWaalsContact CD-NE1 3.32Å; E274-W303 HydrophobicContact CG-CD2 4.16Å; E274-W303 HydrophobicContact CG-CG 3.86Å; E274-W303 PolarHBondContact OE1-NE1 2.89Å; E274-W303 VanDerWaalsContact OE1-NE1 3.09Å; W303-I316 CarbonylContact O-C 3.49Å; W303-I316 WeakPolarHBondContact O-CA 3.24Å; W303-S317 PolarHBondContact N-O 3.45Å; W303-S317 PolarHBondContact O-N 3.09Å; W303-H319 HydrophobicContact CH2-CB 3.95Å; W303-H319 HydrophobicContact CZ3-CB 3.43Å; W303-H319 VanDerWaalsContact CZ3-CB 3.43Å; W303-L338 HydrophobicContact CH2-CD2 4.48Å; W303-V342 HydrophobicContact CB-CG1 3.65Å; W303-V342 HydrophobicContact CD2-CG1 3.83Å; W303-V342 HydrophobicContact CE3-CG1 4.03Å; W303-V342 HydrophobicContact CE3-CG2 4.26Å; W303-V342 HydrophobicContact CG-CG1 3.68Å; W303-V342 HydrophobicContact CZ3-CG2 4.4Å; W303-L346 HydrophobicContact CB-CD1 3.78Å
304	V	93.7	Very high	80.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	150.4	-178.8	-54	0	0	0	0	111.3	L272 H273 P275 L302 Q306 I313 Q315 I316	L272-V304 WeakPolarHBondContact CA-O 3.07Å; H273-V304 PolarHBondContact N-O 3.48Å; H273-V304 VanDerWaalsContact NE2-CG2 3.34Å; H273-V304 WeakPolarHBondContact NE2-CG2 3.4Å; H273-V304 PolarHBondContact O-N 3.36Å; P275-V304 HydrophobicContact CG-CG1 3.84Å; P275-V304 HydrophobicContact CG-CG2 4.36Å; L302-V304 HydrophobicContact CD1-CG1 4.37Å; L302-V304 HydrophobicContact CD2-CG1 4.2Å; L302-V304 HydrophobicContact CG-CG1 4.12Å; V304-Q306 HydrophobicContact CG2-CB 4.5Å; V304-I313 HydrophobicContact CB-CG2 4.01Å; V304-I313 HydrophobicContact CG1-CD1 4.41Å; V304-I313 HydrophobicContact CG1-CG2 4.16Å; V304-I313 HydrophobicContact CG2-CG1 4.47Å; V304-Q315 CarbonylContact C-O 3.38Å; V304-Q315 VanDerWaalsContact CA-O 3.25Å; V304-Q315 WeakPolarHBondContact CA-O 3.25Å; V304-I316 HydrophobicContact CG1-CG2 3.91Å
305	R	96.1	Very high	83.2	Confident	5 Å²	5	42.5 Å²	42.5	2%	0.019	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	117.5	160.7	-177.6	170	61.6	87.6	-5.9	108.2	Q270 V271 L272 C314 Q315 L346 N349	Q270-R305 HydrophobicContact CB-CG 4.43Å; V271-R305 CarbonylContact O-C 3.08Å; V271-R305 WeakPolarHBondContact O-CA 3.38Å; L272-R305 HydrophobicContact CD2-CB 3.65Å; L272-R305 HydrophobicContact CD2-CG 3.89Å; R305-C314 WeakPolarHBondContact O-CB 3.33Å; R305-C314 PolarHBondContact O-N 3.25Å; R305-Q315 HydrophobicContact CB-CB 4.04Å; R305-Q315 PolarHBondContact N-O 3.23Å; R305-Q315 PolarHBondContact O-N 2.9Å; R305-L346 HydrophobicContact CB-CB 4.3Å; R305-L346 WeakPolarHBondContact CD-O 2.97Å; R305-L346 PolarHBondContact NE-O 3.2Å; R305-N349 PolarHBondContact NH2-ND2 2.9Å; R305-N349 PolarHBondContact NH2-OD1 3.12Å
306	Q	92.8	Very high	85.5	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.5	-174.5	-168.1	-178.5	11.8	0	0	111.6	Q270 V271 H273 V304 T308 G311 I313 Y472	Q270-Q306 CarbonylContact C-O 3.46Å; Q270-Q306 WeakPolarHBondContact CA-O 3.4Å; Q270-Q306 VanDerWaalsContact CB-O 3.32Å; Q270-Q306 WeakPolarHBondContact CB-O 3.3Å; V271-Q306 HydrophobicContact CG1-CB 3.89Å; V271-Q306 PolarHBondContact N-O 3.2Å; V271-Q306 PolarHBondContact O-N 2.96Å; H273-Q306 PolarHBondContact NE2-OE1 3.38Å; V304-Q306 HydrophobicContact CG2-CB 4.5Å; Q306-T308 PolarHBondContact O-N 3.25Å; Q306-G311 WeakPolarHBondContact CG-O 3.36Å; Q306-G311 PolarHBondContact NE2-O 3.1Å; Q306-I313 HydrophobicContact CB-CG1 4.39Å; Q306-I313 HydrophobicContact CG-CG1 4.03Å; Q306-Y472 VanDerWaalsContact NE2-CG 3.29Å
307	C	92.3	Very high	87.8	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	118	174.4	177.5	0	0	0	0	110.1	F264 P266 S267 S309 T310 G311 F312	F264-C307 HydrophobicContact CE1-CB 3.96Å; P266-C307 HydrophobicContact CB-CB 4.14Å; S267-C307 PolarHBondContact N-SG 2.93Å; S267-C307 PolarHBondContact OG-SG 3.45Å; C307-S309 PolarHBondContact O-N 3.3Å; C307-T310 PolarHBondContact O-N 3.46Å; C307-T310 PolarHBondContact SG-OG1 3.43Å; C307-G311 VanDerWaalsContact O-CA 3.31Å; C307-G311 WeakPolarHBondContact O-CA 3.31Å; C307-G311 PolarHBondContact O-N 3.25Å; C307-F312 HydrophobicContact CB-CB 4.24Å; C307-F312 WeakPolarHBondContact CB-O 3.41Å; C307-F312 PolarHBondContact N-O 3.08Å
308	T	86.3	Confident	89.5	Confident	5 Å²	5	17.1 Å²	17.1	3%	0.031	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-25.8	-171.5	-43.3	0	0	0	0	113.2	T269 Q270 Q306 H465 Y468	T269-T308 PolarHBondContact O-N 2.98Å; T269-T308 VanDerWaalsContact O-N 3.14Å; T269-T308 PolarHBondContact O-OG1 2.96Å; Q270-T308 VanDerWaalsContact CA-OG1 3.29Å; Q270-T308 WeakPolarHBondContact CA-OG1 3.44Å; Q270-T308 PolarHBondContact N-OG1 2.77Å; Q306-T308 PolarHBondContact O-N 3.25Å; T308-H465 HydrophobicContact CG2-CB 4.15Å; T308-H465 WeakPolarHBondContact CG2-ND1 3.48Å; T308-Y468 HydrophobicContact CG2-CD1 3.92Å; T308-Y468 VanDerWaalsContact O-CD1 3.3Å; T308-Y468 WeakPolarHBondContact O-CD1 3.32Å; T308-Y468 WeakPolarHBondContact O-CE1 3.34Å
309	S	84.4	Confident	90.3	Very high	28 Å²	28	16.8 Å²	16.8	20%	0.196	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-22.2	178.3	-59.2	0	0	0	0	113.8	S267 C307	S267-S309 WeakPolarHBondContact CB-OG 3.35Å; S267-S309 PolarHBondContact OG-OG 3.01Å; C307-S309 PolarHBondContact O-N 3.3Å
310	T	87.7	Confident	90.4	Very high	14 Å²	14	11.9 Å²	11.9	9%	0.086	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.4	-17.1	-172.7	65	0	0	0	0	114.5	Y126 F264 C307 F312 Y468 M510	Y126-T310 HydrophobicContact CD2-CG2 4.19Å; Y126-T310 HydrophobicContact CE2-CG2 4.2Å; F264-T310 HydrophobicContact CE2-CG2 4.33Å; F264-T310 HydrophobicContact CZ-CG2 3.68Å; F264-T310 WeakPolarHBondContact CZ-OG1 2.95Å; C307-T310 PolarHBondContact O-N 3.46Å; C307-T310 PolarHBondContact SG-OG1 3.43Å; T310-F312 PolarHBondContact O-N 3.4Å; T310-F312 WeakPolarHBondContact OG1-CB 3.15Å; T310-F312 PolarHBondContact OG1-N 2.93Å; T310-Y468 PolarHBondContact O-OH 3.09Å; T310-M510 HydrophobicContact CG2-CE 4.01Å; T310-M510 HydrophobicContact CG2-SD 4.05Å
311	G	88.6	Confident	90.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.086	C	C	.	.			trans	76.7	4.2	-170.9	0	0	0	0	0	113.9	Q306 C307 I313 Y468 Y472 I506	Q306-G311 WeakPolarHBondContact CG-O 3.36Å; Q306-G311 PolarHBondContact NE2-O 3.1Å; C307-G311 VanDerWaalsContact O-CA 3.31Å; C307-G311 WeakPolarHBondContact O-CA 3.31Å; C307-G311 PolarHBondContact O-N 3.25Å; G311-I313 PolarHBondContact O-N 2.96Å; G311-Y468 WeakPolarHBondContact CA-OH 3.25Å; G311-Y468 PolarHBondContact N-OH 3.27Å; G311-Y472 WeakPolarHBondContact O-CE2 3.41Å; G311-Y472 VanDerWaalsContact O-CZ 3.3Å; G311-Y472 PolarHBondContact O-OH 2.94Å; G311-I506 WeakPolarHBondContact O-CD1 3.37Å
312	F	93.3	Very high	89.1	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.103	C	C	.	.			trans	-68.2	125.7	-179.1	-169	-84	0	0	0	111.1	F145 F260 F264 C307 T310 C314 N503 I506 L507	F145-F312 HydrophobicContact CE1-CE2 4.39Å; F145-F312 AromaticContact CE1-CZ 3.91Å; F145-F312 HydrophobicContact CE1-CZ 3.91Å; F145-F312 AromaticContact CZ-CE2 3.9Å; F145-F312 HydrophobicContact CZ-CE2 3.9Å; F145-F312 AromaticContact CZ-CZ 3.89Å; F145-F312 HydrophobicContact CZ-CZ 3.89Å; F260-F312 HydrophobicContact CB-CE1 4.32Å; F260-F312 HydrophobicContact CD1-CE1 4.46Å; F260-F312 HydrophobicContact CD1-CZ 4.4Å; F264-F312 HydrophobicContact CB-CD1 3.81Å; F264-F312 HydrophobicContact CB-CD2 4.16Å; F264-F312 HydrophobicContact CB-CE1 3.49Å; F264-F312 VanDerWaalsContact CB-CE1 3.49Å; F264-F312 HydrophobicContact CB-CE2 3.85Å; F264-F312 HydrophobicContact CB-CG 4.13Å; F264-F312 HydrophobicContact CB-CZ 3.49Å; F264-F312 VanDerWaalsContact CB-CZ 3.49Å; F264-F312 HydrophobicContact CD1-CB 3.79Å; F264-F312 AromaticContact CD1-CD1 3.44Å; F264-F312 HydrophobicContact CD1-CD1 3.44Å; F264-F312 VanDerWaalsContact CD1-CD1 3.44Å; F264-F312 HydrophobicContact CD1-CD2 4.24Å; F264-F312 HydrophobicContact CD1-CE1 4.04Å; F264-F312 AromaticContact CD1-CG 3.56Å; F264-F312 HydrophobicContact CD1-CG 3.56Å; F264-F312 HydrophobicContact CD2-CB 4.5Å; F264-F312 AromaticContact CD2-CD2 3.99Å; F264-F312 HydrophobicContact CD2-CD2 3.99Å; F264-F312 HydrophobicContact CD2-CE2 4.32Å; F264-F312 HydrophobicContact CD2-CG 4.11Å; F264-F312 HydrophobicContact CE1-CB 3.63Å; F264-F312 HydrophobicContact CE1-CD1 4.17Å; F264-F312 AromaticContact CE1-CG 3.95Å; F264-F312 HydrophobicContact CE1-CG 3.95Å; F264-F312 HydrophobicContact CE2-CB 4.38Å; F264-F312 HydrophobicContact CE2-CG 4.47Å; F264-F312 HydrophobicContact CG-CB 4.24Å; F264-F312 AromaticContact CG-CD1 3.7Å; F264-F312 HydrophobicContact CG-CD1 3.7Å; F264-F312 AromaticContact CG-CD2 3.87Å; F264-F312 HydrophobicContact CG-CD2 3.87Å; F264-F312 AromaticContact CG-CE1 3.93Å; F264-F312 HydrophobicContact CG-CE1 3.93Å; F264-F312 HydrophobicContact CG-CE2 4.07Å; F264-F312 AromaticContact CG-CG 3.66Å; F264-F312 HydrophobicContact CG-CG 3.66Å; F264-F312 HydrophobicContact CG-CZ 4.1Å; F264-F312 HydrophobicContact CZ-CB 3.99Å; F264-F312 HydrophobicContact CZ-CG 4.43Å; C307-F312 HydrophobicContact CB-CB 4.24Å; C307-F312 WeakPolarHBondContact CB-O 3.41Å; C307-F312 PolarHBondContact N-O 3.08Å; T310-F312 PolarHBondContact O-N 3.4Å; T310-F312 WeakPolarHBondContact OG1-CB 3.15Å; T310-F312 PolarHBondContact OG1-N 2.93Å; F312-C314 PolarHBondContact O-N 2.82Å; F312-C314 PolarHBondContact O-SG 3.48Å; F312-C314 VanDerWaalsContact O-SG 3.41Å; F312-N503 HydrophobicContact CD2-CB 4.01Å; F312-N503 HydrophobicContact CE2-CB 3.56Å; F312-N503 HydrophobicContact CZ-CB 3.99Å; F312-I506 HydrophobicContact CB-CD1 4.39Å; F312-I506 HydrophobicContact CB-CG2 4.33Å; F312-I506 HydrophobicContact CD2-CB 4.4Å; F312-I506 HydrophobicContact CD2-CG2 4.18Å; F312-L507 HydrophobicContact CD2-CD2 4.46Å; F312-L507 HydrophobicContact CE2-CD1 4.3Å; F312-L507 HydrophobicContact CE2-CD2 4.06Å; F312-L507 HydrophobicContact CE2-CG 3.96Å
313	I	95.3	Very high	87.1	Confident	3 Å²	3	23.6 Å²	23.6	2%	0.015	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	115.3	174.8	-71.1	171	0	0	0	108.7	F260 V304 Q306 G311 I316 I499 N503	F260-I313 HydrophobicContact CE2-CG2 4.45Å; V304-I313 HydrophobicContact CB-CG2 4.01Å; V304-I313 HydrophobicContact CG1-CD1 4.41Å; V304-I313 HydrophobicContact CG1-CG2 4.16Å; V304-I313 HydrophobicContact CG2-CG1 4.47Å; Q306-I313 HydrophobicContact CB-CG1 4.39Å; Q306-I313 HydrophobicContact CG-CG1 4.03Å; G311-I313 PolarHBondContact O-N 2.96Å; I313-I316 HydrophobicContact CG2-CG2 3.67Å; I313-I499 HydrophobicContact CB-CG2 3.99Å; I313-I499 HydrophobicContact CD1-CD1 4.38Å; I313-I499 HydrophobicContact CD1-CG1 4.11Å; I313-I499 HydrophobicContact CD1-CG2 3.85Å; I313-I499 HydrophobicContact CG2-CG2 3.97Å; I313-N503 PolarHBondContact N-OD1 2.64Å; I313-N503 PolarHBondContact O-ND2 3.19Å
314	C	96	Very high	84.9	Confident	7 Å²	7	32.9 Å²	32.9	5%	0.047	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-31.7	-172.2	-58.7	0	0	0	0	113.2	F260 R305 F312	F260-C314 WeakPolarHBondContact CB-O 3.13Å; R305-C314 WeakPolarHBondContact O-CB 3.33Å; R305-C314 PolarHBondContact O-N 3.25Å; F312-C314 PolarHBondContact O-N 2.82Å; F312-C314 PolarHBondContact O-SG 3.48Å; F312-C314 VanDerWaalsContact O-SG 3.41Å
315	Q	96.4	Very high	82.2	Confident	10 Å²	10	34.6 Å²	34.6	5%	0.047	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	149.8	178.1	-67.6	-68	-57.8	0	0	110.5	S261 V304 R305 L346 N349	S261-Q315 PolarHBondContact OG-NE2 3.34Å; V304-Q315 CarbonylContact C-O 3.38Å; V304-Q315 VanDerWaalsContact CA-O 3.25Å; V304-Q315 WeakPolarHBondContact CA-O 3.25Å; R305-Q315 HydrophobicContact CB-CB 4.04Å; R305-Q315 PolarHBondContact N-O 3.23Å; R305-Q315 PolarHBondContact O-N 2.9Å; Q315-L346 HydrophobicContact CB-CD2 3.7Å; Q315-N349 PolarHBondContact NE2-ND2 3.04Å
316	I	95.2	Very high	79.5	Confident	12 Å²	12	39.1 Å²	39.1	6%	0.062	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	143.4	173.4	62.9	171.9	0	0	0	111.2	L253 L256 Q257 F260 L302 W303 V304 I313 I499	L253-I316 HydrophobicContact CD2-CD1 4.08Å; L256-I316 HydrophobicContact CD2-CD1 4.1Å; Q257-I316 HydrophobicContact CG-CG1 4.18Å; Q257-I316 VanDerWaalsContact NE2-N 3.17Å; Q257-I316 PolarHBondContact NE2-O 2.99Å; F260-I316 HydrophobicContact CE2-CD1 4.46Å; F260-I316 HydrophobicContact CE2-CG1 4.36Å; F260-I316 HydrophobicContact CE2-CG2 3.98Å; L302-I316 HydrophobicContact CD1-CB 3.98Å; L302-I316 HydrophobicContact CD1-CG2 4.43Å; W303-I316 CarbonylContact O-C 3.49Å; W303-I316 WeakPolarHBondContact O-CA 3.24Å; V304-I316 HydrophobicContact CG1-CG2 3.91Å; I313-I316 HydrophobicContact CG2-CG2 3.67Å; I316-I499 HydrophobicContact CG2-CD1 4.21Å
317	S	92.4	Very high	77.1	Confident	15 Å²	15	47.6 Å²	47.6	11%	0.105	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	125.1	173.1	-177.4	0	0	0	0	109.7	L302 W303 Q345	L302-S317 WeakPolarHBondContact CA-O 3.32Å; W303-S317 PolarHBondContact N-O 3.45Å; W303-S317 PolarHBondContact O-N 3.09Å; S317-Q345 PolarHBondContact OG-OE1 3.34Å
318	V	90.6	Very high	74.8	Confident	24 Å²	24	48.7 Å²	48.7	15%	0.145	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.5	-177.9	-176.5	0	0	0	0	108.8	L246 F300 S301 L302 V492	L246-V318 HydrophobicContact CD1-CB 3.77Å; L246-V318 HydrophobicContact CD1-CG1 3.68Å; L246-V318 HydrophobicContact CD2-CG1 4.25Å; F300-V318 HydrophobicContact CB-CG1 4.42Å; F300-V318 HydrophobicContact CD2-CG1 4.07Å; S301-V318 WeakPolarHBondContact O-CA 3.33Å; L302-V318 HydrophobicContact CD1-CG2 3.77Å; V318-V492 HydrophobicContact CB-CG1 4.43Å; V318-V492 HydrophobicContact CG1-CG1 3.98Å; V318-V492 HydrophobicContact CG1-CG2 3.88Å; V318-V492 HydrophobicContact CG2-CG1 3.8Å
319	H	85.7	Confident	72.7	Confident	54 Å²	54	53.9 Å²	53.9	25%	0.25	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131	174.4	-169.1	75.6	0	0	0	110.2	F300 S301 W303	F300-H319 CarbonylContact C-O 3.48Å; F300-H319 WeakPolarHBondContact CA-O 3.33Å; F300-H319 WeakPolarHBondContact CB-O 3.09Å; S301-H319 PolarHBondContact N-O 3.21Å; S301-H319 PolarHBondContact O-N 2.77Å; W303-H319 HydrophobicContact CH2-CB 3.95Å; W303-H319 HydrophobicContact CZ3-CB 3.43Å; W303-H319 VanDerWaalsContact CZ3-CB 3.43Å
320	L	83.6	Confident	70.6	Confident	39 Å²	39	56.9 Å²	56.9	20%	0.204	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	133.4	173.7	-64.3	-179.6	0	0	0	109.8	G245 L246 F300 E322 T488	G245-L320 VanDerWaalsContact CA-CD1 3.49Å; L246-L320 HydrophobicContact CD1-CG 4.48Å; L246-L320 HydrophobicContact CD2-CD1 4.15Å; L246-L320 HydrophobicContact CD2-CD2 3.66Å; L246-L320 HydrophobicContact CD2-CG 4.01Å; L246-L320 HydrophobicContact CG-CD1 3.96Å; L246-L320 HydrophobicContact CG-CD2 4.16Å; L246-L320 HydrophobicContact CG-CG 3.93Å; F300-L320 HydrophobicContact CB-CD2 3.9Å; L320-E322 PolarHBondContact O-N 2.89Å; L320-T488 HydrophobicContact CD2-CG2 3.82Å
321	K	76.4	Confident	68.4	Low	106 Å²	106	61.3 Å²	61.3	46%	0.461	38%	0.375	S	S	.	.			trans	-82.9	100.1	171.5	-65.8	169.6	178.3	154.8	0	105.5	R298 K299 F300 S301	R298-K321 WeakPolarHBondContact O-CD 3Å; K299-K321 PolarHBondContact O-N 3.33Å; F300-K321 WeakPolarHBondContact O-CE 3.38Å; F300-K321 PolarHBondContact O-NZ 3.39Å; S301-K321 WeakPolarHBondContact OG-CE 3.35Å; S301-K321 PolarHBondContact OG-NZ 3.25Å
322	E	64.9	Low	66.4	Low	92 Å²	92	64.1 Å²	64.1	43%	0.43	39%	0.39	S	S	.	.			trans	-49.5	141.8	-167.3	-72.8	-177.6	161.6	0	0	114.1	L320 L329	L320-E322 PolarHBondContact O-N 2.89Å; E322-L329 WeakPolarHBondContact OE2-CD1 3.3Å
323	G	46.7	Very low	64.1	Low	73 Å²	73	73.3 Å²	73.3	75%	0.753	43%	0.429	S	S	*	.			trans	-113.5	117.3	150.5	0	0	0	0	0	107.7
324	Q	43.8	Very low	62.6	Low	204 Å²	204	76.6 Å²	76.6	95%	0.953	45%	0.447	S	S	*	.	S	Bend	trans	34.8	89.2	164.9	-65.1	-178.8	6.6	0	0	116.6
325	G	37.4	Very low	61.4	Low	36 Å²	36	84 Å²	84	37%	0.371	48%	0.478	S	S	.	.			trans	-137.3	125	156.5	0	0	0	0	0	109.1
326	A	39.5	Very low	60.3	Low	100 Å²	100	85.6 Å²	85.6	83%	0.826	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	136.5	167.4	0	0	0	0	0	108.4
327	D	43.6	Very low	59.5	Low	177 Å²	177	90.3 Å²	90.3	95%	0.947	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	16	179.3	-66.6	-12.7	0	0	0	120.4
328	G	42.3	Very low	59.1	Low	24 Å²	24	90.9 Å²	90.9	25%	0.247	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-18.1	158.9	0	0	0	0	0	114.8	A330	G328-A330 PolarHBondContact O-N 3.29Å
329	L	43.4	Very low	59	Low	113 Å²	113	91 Å²	91	59%	0.592	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	5.7	-156.4	-157.2	69.9	0	0	0	115.1	E322	E322-L329 WeakPolarHBondContact OE2-CD1 3.3Å
330	A	39.6	Very low	59.2	Low	92 Å²	92	89.7 Å²	89.7	76%	0.76	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-21.3	174.4	0	0	0	0	0	113.3	G328	G328-A330 PolarHBondContact O-N 3.29Å
331	T	41.8	Very low	59.5	Low	106 Å²	106	92.2 Å²	92.2	65%	0.65	52%	0.522	S	S	*	.	S	Bend	trans	-100.9	-7.2	-169.8	-1.2	0	0	0	0	115
332	L	46.3	Very low	60.2	Low	60 Å²	60	87.4 Å²	87.4	31%	0.314	50%	0.502	S	S	.	.			trans	-105	8.4	-174.4	-74	165.1	0	0	0	114.6	N334 L338	L332-N334 PolarHBondContact O-N 3.15Å; L332-N334 VanDerWaalsContact O-N 3.12Å; L332-L338 HydrophobicContact CD2-CB 4.15Å; L332-L338 HydrophobicContact CD2-CD1 3.88Å; L332-L338 HydrophobicContact CD2-CD2 4.17Å; L332-L338 HydrophobicContact CD2-CG 4.28Å
333	K	45.9	Very low	61.6	Low	193 Å²	193	83 Å²	83	84%	0.839	48%	0.481	S	S	*	.	S	Bend	trans	-69.3	-4.9	178	-71.8	-173.6	178.7	-179.2	0	113.9
334	N	63.7	Low	64	Low	72 Å²	72	82.6 Å²	82.6	39%	0.385	46%	0.459	S	S	.	.			trans	-125.1	95.6	179.2	-158.2	-6.3	0	0	0	111.5	L332 P336 Q337 L338	L332-N334 PolarHBondContact O-N 3.15Å; L332-N334 VanDerWaalsContact O-N 3.12Å; N334-P336 VanDerWaalsContact C-N 3.33Å; N334-P336 WeakPolarHBondContact OD1-CD 3.46Å; N334-P336 WeakPolarHBondContact OD1-CG 3.18Å; N334-Q337 HydrophobicContact CB-CB 4.3Å; N334-Q337 HydrophobicContact CB-CG 3.9Å; N334-Q337 PolarHBondContact ND2-NE2 3.44Å; N334-Q337 WeakPolarHBondContact O-CB 3.49Å; N334-Q337 PolarHBondContact O-N 2.87Å; N334-L338 PolarHBondContact O-N 3.46Å
335	K	69.5	Low	66.3	Low	161 Å²	161	76.9 Å²	76.9	70%	0.7	43%	0.432	S	S	*	.	H	α-helix	trans	-48.6	-43.2	179.2	-69.5	176.4	-178	169.8	0	113.8	Q337 L338 H339	K335-Q337 VanDerWaalsContact C-N 3.29Å; K335-Q337 PolarHBondContact O-N 3.45Å; K335-L338 PolarHBondContact O-N 3.12Å; K335-H339 PolarHBondContact O-N 3.19Å; K335-H339 VanDerWaalsContact O-N 3.1Å
336	P	73.4	Confident	69.2	Low	44 Å²	44	75.3 Å²	75.3	29%	0.286	42%	0.415	S	S	.	.	H	α-helix	trans	-51.1	-40.2	170.9	-30.9	30.9	0	0	0	115.5	N334 H339 S340 D389	N334-P336 VanDerWaalsContact C-N 3.33Å; N334-P336 WeakPolarHBondContact OD1-CD 3.46Å; N334-P336 WeakPolarHBondContact OD1-CG 3.18Å; P336-H339 PolarHBondContact O-N 3.23Å; P336-S340 WeakPolarHBondContact O-CB 3.25Å; P336-S340 PolarHBondContact O-N 3.44Å; P336-D389 HydrophobicContact CB-CB 4.33Å
337	Q	79.4	Confident	71.9	Confident	111 Å²	111	70.6 Å²	70.6	52%	0.519	38%	0.376	S	S	.	.	H	α-helix	trans	-68.7	-40	-179.8	-66.6	176.4	-3.3	0	0	111.4	N334 K335 S340 L341	N334-Q337 HydrophobicContact CB-CB 4.3Å; N334-Q337 HydrophobicContact CB-CG 3.9Å; N334-Q337 PolarHBondContact ND2-NE2 3.44Å; N334-Q337 WeakPolarHBondContact O-CB 3.49Å; N334-Q337 PolarHBondContact O-N 2.87Å; K335-Q337 VanDerWaalsContact C-N 3.29Å; K335-Q337 PolarHBondContact O-N 3.45Å; Q337-S340 PolarHBondContact O-N 2.93Å; Q337-L341 WeakPolarHBondContact O-CB 3.37Å; Q337-L341 PolarHBondContact O-N 2.57Å
338	L	84.3	Confident	74.2	Confident	27 Å²	27	68.6 Å²	68.6	14%	0.141	36%	0.361	C	S	.	.	H	α-helix	trans	-60.4	-48.3	174.1	173.9	62.7	0	0	0	111.2	W303 L332 N334 K335 S340 L341 V342	W303-L338 HydrophobicContact CH2-CD2 4.48Å; L332-L338 HydrophobicContact CD2-CB 4.15Å; L332-L338 HydrophobicContact CD2-CD1 3.88Å; L332-L338 HydrophobicContact CD2-CD2 4.17Å; L332-L338 HydrophobicContact CD2-CG 4.28Å; N334-L338 PolarHBondContact O-N 3.46Å; K335-L338 PolarHBondContact O-N 3.12Å; L338-S340 VanDerWaalsContact C-N 3.35Å; L338-S340 PolarHBondContact O-N 2.98Å; L338-L341 WeakPolarHBondContact O-CB 3.37Å; L338-L341 PolarHBondContact O-N 3.14Å; L338-V342 HydrophobicContact CD1-CG2 4.1Å; L338-V342 HydrophobicContact CG-CG2 4.5Å; L338-V342 WeakPolarHBondContact O-CG2 3.43Å; L338-V342 PolarHBondContact O-N 3.09Å
339	H	86.8	Confident	76.6	Confident	27 Å²	27	70.3 Å²	70.3	13%	0.125	36%	0.364	C	S	.	.	H	α-helix	trans	-65.6	-38.3	-179	-64.8	165.4	0	0	0	112.6	K335 P336 V342 A343 S362 I363	K335-H339 PolarHBondContact O-N 3.19Å; K335-H339 VanDerWaalsContact O-N 3.1Å; P336-H339 PolarHBondContact O-N 3.23Å; H339-V342 PolarHBondContact O-N 3.12Å; H339-A343 WeakPolarHBondContact O-CB 3.47Å; H339-A343 PolarHBondContact O-N 2.77Å; H339-S362 VanDerWaalsContact CB-O 3.3Å; H339-S362 WeakPolarHBondContact CB-O 3.29Å; H339-S362 WeakPolarHBondContact ND1-CB 3.31Å; H339-S362 PolarHBondContact ND1-O 2.94Å; H339-I363 HydrophobicContact CB-CG1 4.02Å
340	S	89.9	Confident	79	Confident	27 Å²	27	65.1 Å²	65.1	19%	0.189	34%	0.337	C	S	.	.	H	α-helix	trans	-61.1	-45.5	172.6	-179.2	0	0	0	0	111.5	P336 Q337 L338 V342 A343 K344	P336-S340 WeakPolarHBondContact O-CB 3.25Å; P336-S340 PolarHBondContact O-N 3.44Å; Q337-S340 PolarHBondContact O-N 2.93Å; L338-S340 VanDerWaalsContact C-N 3.35Å; L338-S340 PolarHBondContact O-N 2.98Å; S340-V342 PolarHBondContact O-N 2.73Å; S340-A343 PolarHBondContact O-N 3.36Å; S340-K344 WeakPolarHBondContact O-CG 3.39Å; S340-K344 PolarHBondContact O-N 3.39Å
341	L	90.8	Very high	81.6	Confident	92 Å²	92	63.7 Å²	63.7	48%	0.482	32%	0.322	S	S	.	.	H	α-helix	trans	-60.1	-47.7	175.8	-178.6	69.8	0	0	0	111.9	Q337 L338 A343 K344 Q345	Q337-L341 WeakPolarHBondContact O-CB 3.37Å; Q337-L341 PolarHBondContact O-N 2.57Å; L338-L341 WeakPolarHBondContact O-CB 3.37Å; L338-L341 PolarHBondContact O-N 3.14Å; L341-A343 VanDerWaalsContact C-N 3.34Å; L341-A343 PolarHBondContact O-N 3.09Å; L341-K344 PolarHBondContact O-N 3.41Å; L341-Q345 WeakPolarHBondContact O-CG 3.36Å; L341-Q345 PolarHBondContact O-N 3.42Å
342	V	91.3	Very high	84	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.024	31%	0.31	C	S	.	.	H	α-helix	trans	-61.7	-42.7	178.3	170.1	0	0	0	0	111	W303 L338 H339 S340 K344 Q345 L346	W303-V342 HydrophobicContact CB-CG1 3.65Å; W303-V342 HydrophobicContact CD2-CG1 3.83Å; W303-V342 HydrophobicContact CE3-CG1 4.03Å; W303-V342 HydrophobicContact CE3-CG2 4.26Å; W303-V342 HydrophobicContact CG-CG1 3.68Å; W303-V342 HydrophobicContact CZ3-CG2 4.4Å; L338-V342 HydrophobicContact CD1-CG2 4.1Å; L338-V342 HydrophobicContact CG-CG2 4.5Å; L338-V342 WeakPolarHBondContact O-CG2 3.43Å; L338-V342 PolarHBondContact O-N 3.09Å; H339-V342 PolarHBondContact O-N 3.12Å; S340-V342 PolarHBondContact O-N 2.73Å; V342-K344 PolarHBondContact O-N 3.21Å; V342-Q345 PolarHBondContact O-N 3.45Å; V342-L346 HydrophobicContact CG1-CD1 3.86Å; V342-L346 HydrophobicContact CG1-CG 4.34Å; V342-L346 WeakPolarHBondContact O-CG 3.32Å; V342-L346 PolarHBondContact O-N 3.28Å
343	A	95.1	Very high	86.2	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.4	-44.7	176.8	0	0	0	0	0	111.7	L272 H339 S340 L341 Q345 L346 C347 I363 L368 F372	L272-A343 HydrophobicContact CD1-CB 3.63Å; H339-A343 WeakPolarHBondContact O-CB 3.47Å; H339-A343 PolarHBondContact O-N 2.77Å; S340-A343 PolarHBondContact O-N 3.36Å; L341-A343 VanDerWaalsContact C-N 3.34Å; L341-A343 PolarHBondContact O-N 3.09Å; A343-Q345 PolarHBondContact O-N 3.42Å; A343-L346 PolarHBondContact O-N 3.45Å; A343-C347 WeakPolarHBondContact O-CB 3.01Å; A343-C347 PolarHBondContact O-N 3.27Å; A343-C347 VanDerWaalsContact O-N 3.08Å; A343-C347 PolarHBondContact O-SG 3.31Å; A343-I363 HydrophobicContact CB-CG2 3.72Å; A343-L368 HydrophobicContact CB-CD1 4.44Å; A343-L368 HydrophobicContact CB-CD2 3.85Å; A343-F372 HydrophobicContact CB-CE2 4.48Å; A343-F372 HydrophobicContact CB-CZ 4.18Å
344	K	95.6	Very high	88.5	Confident	65 Å²	65	51.8 Å²	51.8	28%	0.283	27%	0.27	S	S	.	.	H	α-helix	trans	-60.2	-44.6	175.9	-68.5	174.7	-172.5	-160	0	112	S340 L341 V342 L346 C347 Q348 L368 E371 F372	S340-K344 WeakPolarHBondContact O-CG 3.39Å; S340-K344 PolarHBondContact O-N 3.39Å; L341-K344 PolarHBondContact O-N 3.41Å; V342-K344 PolarHBondContact O-N 3.21Å; K344-L346 PolarHBondContact O-N 3.21Å; K344-C347 PolarHBondContact O-N 3.36Å; K344-Q348 PolarHBondContact O-N 2.85Å; K344-L368 HydrophobicContact CG-CD1 3.94Å; K344-E371 VanDerWaalsContact CE-CD 3.42Å; K344-E371 WeakPolarHBondContact CE-OE1 3.48Å; K344-E371 WeakPolarHBondContact CE-OE2 3.41Å; K344-E371 IonicContact NZ-OE1 2.59Å; K344-E371 PolarHBondContact NZ-OE1 3.08Å; K344-E371 IonicContact NZ-OE2 2.75Å; K344-E371 PolarHBondContact NZ-OE2 3.48Å; K344-F372 HydrophobicContact CB-CE1 4.5Å; K344-F372 HydrophobicContact CG-CE1 3.96Å; K344-F372 HydrophobicContact CG-CZ 4.44Å
345	Q	93.8	Very high	89.9	Confident	84 Å²	84	48.3 Å²	48.3	39%	0.393	25%	0.252	S	S	.	.	H	α-helix	trans	-60.6	-44.9	176.5	-72.4	176	-13.4	0	0	112.1	S317 L341 V342 A343 C347 Q348	S317-Q345 PolarHBondContact OG-OE1 3.34Å; L341-Q345 WeakPolarHBondContact O-CG 3.36Å; L341-Q345 PolarHBondContact O-N 3.42Å; V342-Q345 PolarHBondContact O-N 3.45Å; A343-Q345 PolarHBondContact O-N 3.42Å; Q345-C347 PolarHBondContact O-N 3.06Å; Q345-Q348 VanDerWaalsContact O-CG 3.29Å; Q345-Q348 WeakPolarHBondContact O-CG 3.34Å; Q345-Q348 PolarHBondContact O-N 2.76Å
346	L	96.3	Very high	91.2	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-67.2	-24.7	179.9	-72.2	173.7	0	0	0	113.1	L272 W303 R305 Q315 V342 A343 K344	L272-L346 HydrophobicContact CD2-CB 3.86Å; L272-L346 HydrophobicContact CD2-CD1 3.93Å; W303-L346 HydrophobicContact CB-CD1 3.78Å; R305-L346 HydrophobicContact CB-CB 4.3Å; R305-L346 WeakPolarHBondContact CD-O 2.97Å; R305-L346 PolarHBondContact NE-O 3.2Å; Q315-L346 HydrophobicContact CB-CD2 3.7Å; V342-L346 HydrophobicContact CG1-CD1 3.86Å; V342-L346 HydrophobicContact CG1-CG 4.34Å; V342-L346 WeakPolarHBondContact O-CG 3.32Å; V342-L346 PolarHBondContact O-N 3.28Å; A343-L346 PolarHBondContact O-N 3.45Å; K344-L346 PolarHBondContact O-N 3.21Å
347	C	96.8	Very high	92.3	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.007	21%	0.206	C	C	.	.	H	α-helix	trans	-103.8	0.2	-177.4	-68.2	0	0	0	0	114.6	A343 K344 Q345 N349 I350 F372 I377	A343-C347 WeakPolarHBondContact O-CB 3.01Å; A343-C347 PolarHBondContact O-N 3.27Å; A343-C347 VanDerWaalsContact O-N 3.08Å; A343-C347 PolarHBondContact O-SG 3.31Å; K344-C347 PolarHBondContact O-N 3.36Å; Q345-C347 PolarHBondContact O-N 3.06Å; C347-N349 PolarHBondContact O-N 2.79Å; C347-N349 VanDerWaalsContact O-N 3.08Å; C347-I350 HydrophobicContact CB-CD1 4.09Å; C347-I350 HydrophobicContact CB-CG1 4.09Å; C347-I350 WeakPolarHBondContact O-CG1 3.34Å; C347-I350 PolarHBondContact O-N 3.18Å; C347-I350 VanDerWaalsContact O-N 3.16Å; C347-F372 HydrophobicContact CB-CE1 4.16Å; C347-F372 HydrophobicContact CB-CE2 4.38Å; C347-F372 HydrophobicContact CB-CZ 3.8Å; C347-I377 HydrophobicContact CB-CD1 4.22Å
348	Q	92.9	Very high	93	Very high	134 Å²	134	33.7 Å²	33.7	63%	0.626	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-59	-28.5	-173.3	70.7	-172	-0.5	0	0	114.2	K344 Q345	K344-Q348 PolarHBondContact O-N 2.85Å; Q345-Q348 VanDerWaalsContact O-CG 3.29Å; Q345-Q348 WeakPolarHBondContact O-CG 3.34Å; Q345-Q348 PolarHBondContact O-N 2.76Å
349	N	91.6	Very high	93.5	Very high	60 Å²	60	32.5 Å²	32.5	32%	0.321	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-95.7	12	-176.5	66.4	-23	0	0	0	114.6	R305 Q315 C347	R305-N349 PolarHBondContact NH2-ND2 2.9Å; R305-N349 PolarHBondContact NH2-OD1 3.12Å; Q315-N349 PolarHBondContact NE2-ND2 3.04Å; C347-N349 PolarHBondContact O-N 2.79Å; C347-N349 VanDerWaalsContact O-N 3.08Å
350	I	93.6	Very high	93.6	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.021	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-123.9	11.5	179.7	59.2	163.4	0	0	0	114.1	C347 K353 A355 I357 I377	C347-I350 HydrophobicContact CB-CD1 4.09Å; C347-I350 HydrophobicContact CB-CG1 4.09Å; C347-I350 WeakPolarHBondContact O-CG1 3.34Å; C347-I350 PolarHBondContact O-N 3.18Å; C347-I350 VanDerWaalsContact O-N 3.16Å; I350-K353 HydrophobicContact CB-CD 4.25Å; I350-K353 HydrophobicContact CG2-CD 4.25Å; I350-K353 WeakPolarHBondContact O-CB 3.05Å; I350-K353 WeakPolarHBondContact O-CG 3.4Å; I350-K353 PolarHBondContact O-N 3.47Å; I350-A355 HydrophobicContact CD1-CB 3.93Å; I350-I357 HydrophobicContact CD1-CD1 3.7Å; I350-I357 HydrophobicContact CD1-CG1 4.23Å; I350-I377 HydrophobicContact CD1-CD1 4.36Å; I350-I377 HydrophobicContact CD1-CG1 4.49Å; I350-I377 HydrophobicContact CD1-CG2 4.48Å; I350-I377 HydrophobicContact CG1-CD1 3.95Å; I350-I377 HydrophobicContact CG1-CG1 4.33Å
351	S	94.1	Very high	93.5	Very high	62 Å²	62	32.6 Å²	32.6	43%	0.434	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	138.1	170.5	-177.3	0	0	0	0	110.9	K353 Q375	S351-K353 VanDerWaalsContact C-N 3.26Å; S351-K353 PolarHBondContact O-N 2.95Å; S351-Q375 CarbonylContact C-O 3.56Å; S351-Q375 WeakPolarHBondContact CA-O 3.48Å; S351-Q375 PolarHBondContact OG-O 3.08Å
352	G	93.1	Very high	93.2	Very high	40 Å²	40	30.1 Å²	30.1	41%	0.412	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	1.2	-179.1	0	0	0	0	0	115.2	Q375	G352-Q375 PolarHBondContact N-O 3.18Å
353	K	91.8	Very high	93.1	Very high	58 Å²	58	30.4 Å²	30.4	25%	0.252	18%	0.175	S	C	.	.	S	Bend	trans	-91.1	-8.2	-174.8	-62	-161.3	177.4	-136.1	0	114.7	Y122 E124 I350 S351 A355	Y122-K353 WeakPolarHBondContact CD2-O 3.11Å; Y122-K353 HydrophobicContact CE2-CB 4.02Å; Y122-K353 WeakPolarHBondContact CE2-O 3.3Å; E124-K353 VanDerWaalsContact CD-NZ 3.27Å; E124-K353 WeakPolarHBondContact OE1-CE 3.3Å; E124-K353 IonicContact OE1-NZ 2.93Å; E124-K353 PolarHBondContact OE1-NZ 3.28Å; E124-K353 IonicContact OE2-NZ 2.8Å; E124-K353 PolarHBondContact OE2-NZ 3.42Å; I350-K353 HydrophobicContact CB-CD 4.25Å; I350-K353 HydrophobicContact CG2-CD 4.25Å; I350-K353 WeakPolarHBondContact O-CB 3.05Å; I350-K353 WeakPolarHBondContact O-CG 3.4Å; I350-K353 PolarHBondContact O-N 3.47Å; S351-K353 VanDerWaalsContact C-N 3.26Å; S351-K353 PolarHBondContact O-N 2.95Å; K353-A355 PolarHBondContact O-N 3.35Å
354	N	94.1	Very high	93	Very high	11 Å²	11	30.5 Å²	30.5	6%	0.059	18%	0.175	C	C	.	.			trans	58.5	34.4	-171.3	-51.1	-44.4	0	0	0	112.8	P120 P121 Q268 D376 Y378	P120-N354 HydrophobicContact CB-CB 4.45Å; P121-N354 PolarHBondContact O-ND2 2.91Å; Q268-N354 WeakPolarHBondContact CG-O 3.05Å; Q268-N354 PolarHBondContact NE2-O 2.89Å; N354-D376 WeakPolarHBondContact CA-O 3Å; N354-D376 PolarHBondContact N-O 2.89Å; N354-Y378 HydrophobicContact CB-CE2 4.07Å
355	A	94.4	Very high	93	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	151.2	177.2	0	0	0	0	0	110.9	Y122 Q268 I350 K353 I357 Y378	Y122-A355 HydrophobicContact CE2-CB 4.31Å; Q268-A355 CarbonylContact O-C 3.5Å; Q268-A355 WeakPolarHBondContact O-CA 3.45Å; I350-A355 HydrophobicContact CD1-CB 3.93Å; K353-A355 PolarHBondContact O-N 3.35Å; A355-I357 HydrophobicContact CB-CD1 4.49Å; A355-Y378 PolarHBondContact O-N 2.94Å
356	V	95.6	Very high	93.1	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.024	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	116.7	174.8	178.1	0	0	0	0	109	V119 Q268 T269 Q270 F358 Y378 A435 Y436	V119-V356 HydrophobicContact CG1-CG2 4.45Å; Q268-V356 HydrophobicContact CG-CG2 4.08Å; Q268-V356 PolarHBondContact O-N 3.34Å; T269-V356 WeakPolarHBondContact CA-O 3.38Å; T269-V356 HydrophobicContact CG2-CB 4.3Å; Q270-V356 PolarHBondContact N-O 3.19Å; V356-F358 HydrophobicContact CG1-CD2 4.46Å; V356-F358 HydrophobicContact CG1-CE2 3.8Å; V356-F358 HydrophobicContact CG1-CZ 4.15Å; V356-Y378 CarbonylContact C-O 3.36Å; V356-Y378 VanDerWaalsContact CA-O 3.3Å; V356-Y378 WeakPolarHBondContact CA-O 3.49Å; V356-A435 HydrophobicContact CG1-CB 3.61Å; V356-A435 HydrophobicContact CG2-CB 4.13Å; V356-Y436 HydrophobicContact CG1-CE2 4.31Å
357	I	96.6	Very high	93.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.3	-176	-55.8	-55.4	0	0	0	111.1	Q270 L272 I350 A355 T359 I377 Y378 C379 C380	Q270-I357 HydrophobicContact CB-CD1 3.88Å; Q270-I357 CarbonylContact O-C 3.49Å; Q270-I357 WeakPolarHBondContact O-CA 3.34Å; L272-I357 HydrophobicContact CD1-CG2 3.81Å; L272-I357 HydrophobicContact CD2-CG2 4.48Å; L272-I357 HydrophobicContact CG-CG2 3.61Å; I350-I357 HydrophobicContact CD1-CD1 3.7Å; I350-I357 HydrophobicContact CD1-CG1 4.23Å; A355-I357 HydrophobicContact CB-CD1 4.49Å; I357-T359 HydrophobicContact CG2-CG2 3.99Å; I357-I377 HydrophobicContact CG1-CG2 3.6Å; I357-Y378 PolarHBondContact N-O 2.76Å; I357-C379 CarbonylContact O-C 3.52Å; I357-C379 VanDerWaalsContact O-CA 3.23Å; I357-C379 WeakPolarHBondContact O-CA 3.42Å; I357-C380 PolarHBondContact O-N 3.49Å
358	F	95.4	Very high	93	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.018	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	135.1	171.8	-70.7	-87	0	0	0	111	T269 Q270 V271 L272 V356 C380 Y436 A461 F462 H465	T269-F358 HydrophobicContact CG2-CE2 4.12Å; Q270-F358 WeakPolarHBondContact O-CD2 3.43Å; Q270-F358 PolarHBondContact O-N 2.72Å; V271-F358 WeakPolarHBondContact CA-O 3.47Å; V271-F358 HydrophobicContact CB-CB 4.19Å; V271-F358 HydrophobicContact CG2-CB 4.09Å; L272-F358 PolarHBondContact N-O 2.91Å; V356-F358 HydrophobicContact CG1-CD2 4.46Å; V356-F358 HydrophobicContact CG1-CE2 3.8Å; V356-F358 HydrophobicContact CG1-CZ 4.15Å; F358-C380 WeakPolarHBondContact CA-O 3.33Å; F358-C380 HydrophobicContact CD1-CB 3.83Å; F358-C380 HydrophobicContact CE1-CB 3.53Å; F358-C380 HydrophobicContact CZ-CB 4.19Å; F358-Y436 HydrophobicContact CE1-CE2 4.07Å; F358-Y436 AromaticContact CZ-CE2 3.67Å; F358-Y436 HydrophobicContact CZ-CE2 3.67Å; F358-Y436 AromaticContact CZ-CZ 3.89Å; F358-Y436 VanDerWaalsContact CZ-OH 3.3Å; F358-Y436 WeakPolarHBondContact CZ-OH 3.39Å; F358-A461 HydrophobicContact CZ-CB 4.37Å; F358-F462 AromaticContact CD1-CD2 3.68Å; F358-F462 HydrophobicContact CD1-CD2 3.68Å; F358-F462 HydrophobicContact CD1-CE2 4.26Å; F358-F462 HydrophobicContact CD1-CG 4.4Å; F358-F462 HydrophobicContact CE1-CB 4.36Å; F358-F462 HydrophobicContact CE1-CD2 4.26Å; F358-H465 AromaticContact CD1-CD2 3.95Å; F358-H465 AromaticContact CD2-CD2 3.67Å; F358-H465 AromaticContact CE1-CD2 3.4Å; F358-H465 VanDerWaalsContact CE1-CD2 3.4Å; F358-H465 WeakPolarHBondContact CE1-CD2 3.42Å; F358-H465 AromaticContact CE2-CD2 3.09Å; F358-H465 WeakPolarHBondContact CE2-CD2 3.19Å; F358-H465 AromaticContact CE2-CG 3.96Å; F358-H465 AromaticContact CE2-NE2 3.13Å; F358-H465 WeakPolarHBondContact CE2-NE2 3.4Å; F358-H465 AromaticContact CZ-CD2 2.93Å; F358-H465 WeakPolarHBondContact CZ-CD2 3.39Å; F358-H465 AromaticContact CZ-NE2 3.21Å; F358-H465 WeakPolarHBondContact CZ-NE2 3.24Å
359	T	93.4	Very high	93.3	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.012	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	142.4	-178.4	63.8	0	0	0	0	112.9	L272 I357 I363 T364 F369 C380 G381 L382 F462	L272-T359 HydrophobicContact CB-CG2 4.46Å; L272-T359 HydrophobicContact CD1-CG2 4.27Å; I357-T359 HydrophobicContact CG2-CG2 3.99Å; T359-I363 HydrophobicContact CG2-CB 4.34Å; T359-I363 HydrophobicContact CG2-CG2 3.75Å; T359-T364 PolarHBondContact O-OG1 3.23Å; T359-T364 PolarHBondContact OG1-OG1 3.22Å; T359-F369 HydrophobicContact CG2-CE1 4.24Å; T359-F369 HydrophobicContact CG2-CZ 4.44Å; T359-F369 WeakPolarHBondContact OG1-CZ 3.32Å; T359-C380 PolarHBondContact N-O 3.13Å; T359-G381 WeakPolarHBondContact O-CA 3.3Å; T359-G381 WeakPolarHBondContact OG1-CA 3.44Å; T359-L382 PolarHBondContact O-N 3.32Å; T359-L382 VanDerWaalsContact O-N 3.12Å; T359-F462 WeakPolarHBondContact O-CE2 3.47Å
360	G	89.5	Confident	93.5	Very high	27 Å²	27	20 Å²	20	28%	0.278	15%	0.145	S	C	.	.			trans	-75.7	167.4	167.2	0	0	0	0	0	112.4	S362 I363 T364	G360-S362 PolarHBondContact O-N 2.91Å; G360-I363 PolarHBondContact O-N 2.9Å; G360-T364 PolarHBondContact O-N 3.44Å; G360-T364 PolarHBondContact O-OG1 3.02Å
361	P	87.8	Confident	93.7	Very high	30 Å²	30	23.1 Å²	23.1	20%	0.195	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-31.1	-172.9	-28	35.5	0	0	0	115.8	I363 L382 K387 S388	P361-I363 VanDerWaalsContact C-N 3.28Å; P361-I363 PolarHBondContact O-N 2.94Å; P361-L382 VanDerWaalsContact CA-O 3.23Å; P361-L382 WeakPolarHBondContact CA-O 3.4Å; P361-L382 HydrophobicContact CG-CB 4.18Å; P361-L382 HydrophobicContact CG-CD2 3.76Å; P361-L382 HydrophobicContact CG-CG 3.96Å; P361-K387 HydrophobicContact CB-CB 3.93Å; P361-K387 CarbonylContact O-C 3.52Å; P361-S388 WeakPolarHBondContact O-CA 3.21Å; P361-S388 WeakPolarHBondContact O-CB 3.42Å; P361-S388 PolarHBondContact O-N 3.4Å; P361-S388 PolarHBondContact O-OG 2.72Å
362	S	84.6	Confident	93.8	Very high	39 Å²	39	20.2 Å²	20.2	27%	0.273	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-19.9	-176.3	65.5	0	0	0	0	113.9	H339 G360 K387	H339-S362 VanDerWaalsContact CB-O 3.3Å; H339-S362 WeakPolarHBondContact CB-O 3.29Å; H339-S362 WeakPolarHBondContact ND1-CB 3.31Å; H339-S362 PolarHBondContact ND1-O 2.94Å; G360-S362 PolarHBondContact O-N 2.91Å; S362-K387 WeakPolarHBondContact CA-O 3.12Å
363	I	88.3	Confident	94	Very high	11 Å²	11	20 Å²	20	6%	0.056	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-27.6	178.7	-63.6	165.7	0	0	0	110.9	L272 H339 A343 T359 G360 P361 S365 L368	L272-I363 HydrophobicContact CB-CD1 3.9Å; L272-I363 HydrophobicContact CD1-CG2 4.41Å; H339-I363 HydrophobicContact CB-CG1 4.02Å; A343-I363 HydrophobicContact CB-CG2 3.72Å; T359-I363 HydrophobicContact CG2-CB 4.34Å; T359-I363 HydrophobicContact CG2-CG2 3.75Å; G360-I363 PolarHBondContact O-N 2.9Å; P361-I363 VanDerWaalsContact C-N 3.28Å; P361-I363 PolarHBondContact O-N 2.94Å; I363-S365 PolarHBondContact O-N 3.04Å; I363-L368 HydrophobicContact CG2-CD2 3.7Å; I363-L368 VanDerWaalsContact O-CD2 3.31Å; I363-L368 WeakPolarHBondContact O-CD2 3.46Å
364	T	92.9	Very high	94.2	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.006	16%	0.156	C	C	.	.			trans	-65.6	120.6	-175.5	-54.7	0	0	0	0	112.5	T359 G360 F369 L382 L383 S388 I432	T359-T364 PolarHBondContact O-OG1 3.23Å; T359-T364 PolarHBondContact OG1-OG1 3.22Å; G360-T364 PolarHBondContact O-N 3.44Å; G360-T364 PolarHBondContact O-OG1 3.02Å; T364-F369 HydrophobicContact CG2-CE2 4.49Å; T364-F369 HydrophobicContact CG2-CZ 4.13Å; T364-L382 WeakPolarHBondContact CB-O 3.32Å; T364-L382 WeakPolarHBondContact CG2-O 3.34Å; T364-L382 PolarHBondContact OG1-O 3.5Å; T364-L383 HydrophobicContact CG2-CD1 4.12Å; T364-S388 WeakPolarHBondContact O-CB 3.17Å; T364-I432 HydrophobicContact CG2-CG2 3.2Å
365	S	95.1	Very high	94.3	Very high	11 Å²	11	27.9 Å²	27.9	8%	0.077	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-154.9	155.2	169.2	77.3	0	0	0	0	112.4	I363 G367 L368 F369	I363-S365 PolarHBondContact O-N 3.04Å; S365-G367 VanDerWaalsContact C-N 3.33Å; S365-G367 PolarHBondContact O-N 3.15Å; S365-L368 WeakPolarHBondContact OG-CB 3.25Å; S365-L368 PolarHBondContact OG-N 3.33Å; S365-F369 PolarHBondContact O-N 2.95Å; S365-F369 VanDerWaalsContact O-N 3.16Å
366	L	96.4	Very high	94.3	Very high	18 Å²	18	31.2 Å²	31.2	9%	0.094	18%	0.184	C	C	.	.	H	α-helix	trans	-60.6	-43	176.9	179.4	64.1	0	0	0	111.8	W110 F369 S370 G392 L393 M418 I432	W110-L366 HydrophobicContact CZ2-CD1 4.14Å; W110-L366 HydrophobicContact CZ2-CD2 4.11Å; L366-F369 PolarHBondContact O-N 3.2Å; L366-S370 WeakPolarHBondContact O-CB 3.47Å; L366-S370 PolarHBondContact O-N 3.45Å; L366-S370 PolarHBondContact O-OG 3.27Å; L366-G392 WeakPolarHBondContact CD2-O 3.28Å; L366-L393 HydrophobicContact CB-CD2 3.96Å; L366-L393 HydrophobicContact CD2-CD2 4.23Å; L366-L393 HydrophobicContact CG-CD2 4.46Å; L366-M418 HydrophobicContact CD1-CG 4.02Å; L366-I432 HydrophobicContact CB-CD1 4.05Å; L366-I432 HydrophobicContact CD1-CD1 3.68Å; L366-I432 HydrophobicContact CG-CD1 4.49Å
367	G	95.8	Very high	94.4	Very high	47 Å²	47	31 Å²	31	49%	0.485	18%	0.183	S	C	.	.	H	α-helix	trans	-62.3	-47.4	-178.9	0	0	0	0	0	112.5	S365 S370 E371	S365-G367 VanDerWaalsContact C-N 3.33Å; S365-G367 PolarHBondContact O-N 3.15Å; G367-S370 PolarHBondContact O-N 3.19Å; G367-E371 PolarHBondContact O-N 2.99Å; G367-E371 VanDerWaalsContact O-N 3.12Å
368	L	96.4	Very high	94.4	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-62.7	-46	178.7	179.1	64.6	0	0	0	111.4	A343 K344 I363 S365 S370 E371 F372	A343-L368 HydrophobicContact CB-CD1 4.44Å; A343-L368 HydrophobicContact CB-CD2 3.85Å; K344-L368 HydrophobicContact CG-CD1 3.94Å; I363-L368 HydrophobicContact CG2-CD2 3.7Å; I363-L368 VanDerWaalsContact O-CD2 3.31Å; I363-L368 WeakPolarHBondContact O-CD2 3.46Å; S365-L368 WeakPolarHBondContact OG-CB 3.25Å; S365-L368 PolarHBondContact OG-N 3.33Å; L368-S370 VanDerWaalsContact C-N 3.31Å; L368-S370 PolarHBondContact O-N 3.13Å; L368-E371 PolarHBondContact O-N 3.41Å; L368-F372 HydrophobicContact CD1-CD1 4.28Å; L368-F372 HydrophobicContact CD1-CD2 4.41Å; L368-F372 HydrophobicContact CD1-CE1 3.87Å; L368-F372 HydrophobicContact CD1-CE2 4.01Å; L368-F372 HydrophobicContact CD1-CZ 3.73Å; L368-F372 HydrophobicContact CD2-CE2 4.31Å; L368-F372 HydrophobicContact CG-CD2 4.28Å; L368-F372 HydrophobicContact CG-CE2 4.09Å; L368-F372 HydrophobicContact CG-CZ 4.32Å; L368-F372 PolarHBondContact O-N 3.5Å
369	F	97.6	Very high	94.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-68	-34.5	-177.2	-77.7	21.7	0	0	0	111.8	T359 T364 S365 L366 E371 S373 C379 M418 I432	T359-F369 HydrophobicContact CG2-CE1 4.24Å; T359-F369 HydrophobicContact CG2-CZ 4.44Å; T359-F369 WeakPolarHBondContact OG1-CZ 3.32Å; T364-F369 HydrophobicContact CG2-CE2 4.49Å; T364-F369 HydrophobicContact CG2-CZ 4.13Å; S365-F369 PolarHBondContact O-N 2.95Å; S365-F369 VanDerWaalsContact O-N 3.16Å; L366-F369 PolarHBondContact O-N 3.2Å; F369-E371 VanDerWaalsContact C-N 3.32Å; F369-S373 WeakPolarHBondContact O-CB 3.21Å; F369-S373 PolarHBondContact O-N 3.01Å; F369-C379 HydrophobicContact CD1-CB 3.74Å; F369-C379 HydrophobicContact CD2-CB 3.4Å; F369-C379 HydrophobicContact CE1-CB 3.62Å; F369-C379 HydrophobicContact CE2-CB 3.23Å; F369-C379 HydrophobicContact CG-CB 3.64Å; F369-C379 HydrophobicContact CZ-CB 3.36Å; F369-M418 HydrophobicContact CB-CE 3.62Å; F369-M418 HydrophobicContact CB-SD 4.2Å; F369-M418 HydrophobicContact CD2-SD 4.19Å; F369-I432 HydrophobicContact CD2-CB 4.49Å; F369-I432 HydrophobicContact CD2-CD1 4.48Å; F369-I432 HydrophobicContact CD2-CG1 4.11Å; F369-I432 HydrophobicContact CD2-CG2 3.84Å; F369-I432 HydrophobicContact CE2-CG2 3.65Å; F369-I432 VanDerWaalsContact CE2-O 3.32Å; F369-I432 WeakPolarHBondContact CE2-O 3.43Å; F369-I432 HydrophobicContact CZ-CG2 4.35Å
370	S	97	Very high	94.6	Very high	49 Å²	49	32.1 Å²	32.1	34%	0.343	19%	0.186	S	C	.	.	H	α-helix	trans	-64.7	-36.9	173.4	-58.8	0	0	0	0	112	L366 G367 L368 K374	L366-S370 WeakPolarHBondContact O-CB 3.47Å; L366-S370 PolarHBondContact O-N 3.45Å; L366-S370 PolarHBondContact O-OG 3.27Å; G367-S370 PolarHBondContact O-N 3.19Å; L368-S370 VanDerWaalsContact C-N 3.31Å; L368-S370 PolarHBondContact O-N 3.13Å; S370-K374 WeakPolarHBondContact O-CG 2.93Å; S370-K374 PolarHBondContact O-N 3.13Å
371	E	96.7	Very high	94.9	Very high	70 Å²	70	30.8 Å²	30.8	33%	0.327	17%	0.173	S	C	.	.	H	α-helix	trans	-72.7	-41	177.1	-172.6	174.3	155.5	0	0	112.7	K344 G367 L368 F369 S373 K374	K344-E371 VanDerWaalsContact CE-CD 3.42Å; K344-E371 WeakPolarHBondContact CE-OE1 3.48Å; K344-E371 WeakPolarHBondContact CE-OE2 3.41Å; K344-E371 IonicContact NZ-OE1 2.59Å; K344-E371 PolarHBondContact NZ-OE1 3.08Å; K344-E371 IonicContact NZ-OE2 2.75Å; K344-E371 PolarHBondContact NZ-OE2 3.48Å; G367-E371 PolarHBondContact O-N 2.99Å; G367-E371 VanDerWaalsContact O-N 3.12Å; L368-E371 PolarHBondContact O-N 3.41Å; F369-E371 VanDerWaalsContact C-N 3.32Å; E371-S373 VanDerWaalsContact C-N 3.31Å; E371-K374 WeakPolarHBondContact O-CB 3.07Å; E371-K374 PolarHBondContact O-N 3.13Å
372	F	97.7	Very high	95.1	Very high	1 Å²	1	31.1 Å²	31.1	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-63.5	-37.8	172.6	-79.1	-2.3	0	0	0	111.9	A343 K344 C347 L368 K374 Q375 D376 I377 C379	A343-F372 HydrophobicContact CB-CE2 4.48Å; A343-F372 HydrophobicContact CB-CZ 4.18Å; K344-F372 HydrophobicContact CB-CE1 4.5Å; K344-F372 HydrophobicContact CG-CE1 3.96Å; K344-F372 HydrophobicContact CG-CZ 4.44Å; C347-F372 HydrophobicContact CB-CE1 4.16Å; C347-F372 HydrophobicContact CB-CE2 4.38Å; C347-F372 HydrophobicContact CB-CZ 3.8Å; L368-F372 HydrophobicContact CD1-CD1 4.28Å; L368-F372 HydrophobicContact CD1-CD2 4.41Å; L368-F372 HydrophobicContact CD1-CE1 3.87Å; L368-F372 HydrophobicContact CD1-CE2 4.01Å; L368-F372 HydrophobicContact CD1-CZ 3.73Å; L368-F372 HydrophobicContact CD2-CE2 4.31Å; L368-F372 HydrophobicContact CG-CD2 4.28Å; L368-F372 HydrophobicContact CG-CE2 4.09Å; L368-F372 HydrophobicContact CG-CZ 4.32Å; L368-F372 PolarHBondContact O-N 3.5Å; F372-K374 PolarHBondContact O-N 2.87Å; F372-Q375 CarbonylContact O-C 3.5Å; F372-Q375 WeakPolarHBondContact O-CA 3.4Å; F372-Q375 WeakPolarHBondContact O-CB 3.4Å; F372-Q375 PolarHBondContact O-N 3.35Å; F372-D376 PolarHBondContact O-N 3.14Å; F372-I377 CarbonylContact C-O 3.51Å; F372-I377 HydrophobicContact CB-CB 3.87Å; F372-I377 HydrophobicContact CB-CG2 3.99Å; F372-I377 WeakPolarHBondContact CB-O 3.34Å; F372-I377 HydrophobicContact CD2-CG2 4.03Å; F372-I377 HydrophobicContact CG-CB 4.29Å; F372-I377 HydrophobicContact CG-CG2 4.07Å; F372-I377 WeakPolarHBondContact O-CB 3.04Å; F372-I377 PolarHBondContact O-N 3.05Å; F372-I377 VanDerWaalsContact O-O 3.13Å; F372-C379 VanDerWaalsContact CD2-SG 3.6Å
373	S	96.2	Very high	95.4	Very high	34 Å²	34	29.7 Å²	29.7	24%	0.238	16%	0.162	C	C	.	.	H	α-helix	trans	-61.6	-29.7	175.7	-164.7	0	0	0	0	113.1	F369 E371 Q375 D376 I377 N434	F369-S373 WeakPolarHBondContact O-CB 3.21Å; F369-S373 PolarHBondContact O-N 3.01Å; E371-S373 VanDerWaalsContact C-N 3.31Å; S373-Q375 PolarHBondContact O-N 3.15Å; S373-D376 PolarHBondContact O-N 3.12Å; S373-I377 PolarHBondContact N-O 3.34Å; S373-N434 WeakPolarHBondContact CB-ND2 3.34Å; S373-N434 PolarHBondContact OG-ND2 3.45Å
374	K	96.3	Very high	95.3	Very high	178 Å²	178	30 Å²	30	77%	0.774	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-13.2	174.5	-65.8	171.8	-175.1	178.5	0	113.1	S370 E371 F372	S370-K374 WeakPolarHBondContact O-CG 2.93Å; S370-K374 PolarHBondContact O-N 3.13Å; E371-K374 WeakPolarHBondContact O-CB 3.07Å; E371-K374 PolarHBondContact O-N 3.13Å; F372-K374 PolarHBondContact O-N 2.87Å
375	Q	96.3	Very high	94.9	Very high	57 Å²	57	31.7 Å²	31.7	27%	0.266	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	15.7	-178.6	-64.5	178.8	57	0	0	111.5	S351 G352 F372 S373 I377	S351-Q375 CarbonylContact C-O 3.56Å; S351-Q375 WeakPolarHBondContact CA-O 3.48Å; S351-Q375 PolarHBondContact OG-O 3.08Å; G352-Q375 PolarHBondContact N-O 3.18Å; F372-Q375 CarbonylContact O-C 3.5Å; F372-Q375 WeakPolarHBondContact O-CA 3.4Å; F372-Q375 WeakPolarHBondContact O-CB 3.4Å; F372-Q375 PolarHBondContact O-N 3.35Å; S373-Q375 PolarHBondContact O-N 3.15Å; Q375-I377 HydrophobicContact CB-CD1 4.12Å; Q375-I377 HydrophobicContact CB-CG1 4.34Å; Q375-I377 PolarHBondContact O-N 3.18Å
376	D	95.3	Very high	94.4	Very high	71 Å²	71	35.1 Å²	35.1	38%	0.38	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	38.4	-173.6	-54.5	-42.2	0	0	0	112.9	N354 F372 S373	N354-D376 WeakPolarHBondContact CA-O 3Å; N354-D376 PolarHBondContact N-O 2.89Å; F372-D376 PolarHBondContact O-N 3.14Å; S373-D376 PolarHBondContact O-N 3.12Å
377	I	96.9	Very high	93.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	114.1	171.7	-59.4	167.1	0	0	0	107.5	C347 I350 I357 F372 S373 Q375	C347-I377 HydrophobicContact CB-CD1 4.22Å; I350-I377 HydrophobicContact CD1-CD1 4.36Å; I350-I377 HydrophobicContact CD1-CG1 4.49Å; I350-I377 HydrophobicContact CD1-CG2 4.48Å; I350-I377 HydrophobicContact CG1-CD1 3.95Å; I350-I377 HydrophobicContact CG1-CG1 4.33Å; I357-I377 HydrophobicContact CG1-CG2 3.6Å; F372-I377 CarbonylContact C-O 3.51Å; F372-I377 HydrophobicContact CB-CB 3.87Å; F372-I377 HydrophobicContact CB-CG2 3.99Å; F372-I377 WeakPolarHBondContact CB-O 3.34Å; F372-I377 HydrophobicContact CD2-CG2 4.03Å; F372-I377 HydrophobicContact CG-CB 4.29Å; F372-I377 HydrophobicContact CG-CG2 4.07Å; F372-I377 WeakPolarHBondContact O-CB 3.04Å; F372-I377 PolarHBondContact O-N 3.05Å; F372-I377 VanDerWaalsContact O-O 3.13Å; S373-I377 PolarHBondContact N-O 3.34Å; Q375-I377 HydrophobicContact CB-CD1 4.12Å; Q375-I377 HydrophobicContact CB-CG1 4.34Å; Q375-I377 PolarHBondContact O-N 3.18Å
378	Y	97.4	Very high	93.4	Very high	28 Å²	28	38 Å²	38	11%	0.11	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	155.6	179.8	-58.3	-86.7	0	0	0	109.8	V119 P120 N354 A355 V356 I357 N434	V119-Y378 HydrophobicContact CG1-CD1 4.45Å; V119-Y378 HydrophobicContact CG1-CD2 3.65Å; V119-Y378 HydrophobicContact CG1-CE2 3.86Å; V119-Y378 HydrophobicContact CG1-CG 3.98Å; V119-Y378 HydrophobicContact CG2-CD1 4.11Å; V119-Y378 HydrophobicContact CG2-CG 4.19Å; P120-Y378 WeakPolarHBondContact CD-OH 3.47Å; P120-Y378 WeakPolarHBondContact CG-OH 3.48Å; N354-Y378 HydrophobicContact CB-CE2 4.07Å; A355-Y378 PolarHBondContact O-N 2.94Å; V356-Y378 CarbonylContact C-O 3.36Å; V356-Y378 VanDerWaalsContact CA-O 3.3Å; V356-Y378 WeakPolarHBondContact CA-O 3.49Å; I357-Y378 PolarHBondContact N-O 2.76Å; Y378-N434 WeakPolarHBondContact CA-OD1 3.41Å; Y378-N434 WeakPolarHBondContact CD1-O 3.46Å
379	C	97.5	Very high	93.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	153.4	-171.5	-59.5	0	0	0	0	113	I357 F369 F372 T433 N434 A435	I357-C379 CarbonylContact O-C 3.52Å; I357-C379 VanDerWaalsContact O-CA 3.23Å; I357-C379 WeakPolarHBondContact O-CA 3.42Å; F369-C379 HydrophobicContact CD1-CB 3.74Å; F369-C379 HydrophobicContact CD2-CB 3.4Å; F369-C379 HydrophobicContact CE1-CB 3.62Å; F369-C379 HydrophobicContact CE2-CB 3.23Å; F369-C379 HydrophobicContact CG-CB 3.64Å; F369-C379 HydrophobicContact CZ-CB 3.36Å; F372-C379 VanDerWaalsContact CD2-SG 3.6Å; C379-T433 VanDerWaalsContact O-CA 3.24Å; C379-T433 WeakPolarHBondContact O-CA 3.2Å; C379-T433 WeakPolarHBondContact O-CB 3.46Å; C379-T433 PolarHBondContact O-OG1 2.76Å; C379-N434 PolarHBondContact N-OD1 2.87Å; C379-N434 PolarHBondContact O-N 2.83Å; C379-N434 PolarHBondContact O-OD1 3.22Å; C379-A435 WeakPolarHBondContact O-CB 3.43Å
380	C	95.9	Very high	92.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	107.3	168.8	-176.7	0	0	0	0	109	I357 F358 T359 Y436	I357-C380 PolarHBondContact O-N 3.49Å; F358-C380 WeakPolarHBondContact CA-O 3.33Å; F358-C380 HydrophobicContact CD1-CB 3.83Å; F358-C380 HydrophobicContact CE1-CB 3.53Å; F358-C380 HydrophobicContact CZ-CB 4.19Å; T359-C380 PolarHBondContact N-O 3.13Å; C380-Y436 HydrophobicContact CB-CD2 3.98Å; C380-Y436 HydrophobicContact CB-CE2 3.84Å
381	G	94.8	Very high	92.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	138.3	-171.4	0	0	0	0	0	112.4	T359 F431 I432	T359-G381 WeakPolarHBondContact O-CA 3.3Å; T359-G381 WeakPolarHBondContact OG1-CA 3.44Å; G381-F431 VanDerWaalsContact O-CA 3.25Å; G381-F431 WeakPolarHBondContact O-CA 3.4Å; G381-I432 PolarHBondContact N-O 2.94Å; G381-I432 PolarHBondContact O-N 2.96Å; G381-I432 VanDerWaalsContact O-N 3.08Å
382	L	91.6	Very high	92.7	Very high	37 Å²	37	39.7 Å²	39.7	19%	0.194	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	135.7	167	-175.6	69.1	0	0	0	108.7	T359 P361 T364 F429 F431 F462	T359-L382 PolarHBondContact O-N 3.32Å; T359-L382 VanDerWaalsContact O-N 3.12Å; P361-L382 VanDerWaalsContact CA-O 3.23Å; P361-L382 WeakPolarHBondContact CA-O 3.4Å; P361-L382 HydrophobicContact CG-CB 4.18Å; P361-L382 HydrophobicContact CG-CD2 3.76Å; P361-L382 HydrophobicContact CG-CG 3.96Å; T364-L382 WeakPolarHBondContact CB-O 3.32Å; T364-L382 WeakPolarHBondContact CG2-O 3.34Å; T364-L382 PolarHBondContact OG1-O 3.5Å; L382-F429 HydrophobicContact CD1-CD1 4.31Å; L382-F431 HydrophobicContact CB-CD1 4.5Å; L382-F431 HydrophobicContact CB-CE1 4.32Å; L382-F431 HydrophobicContact CD1-CD1 4.18Å; L382-F431 HydrophobicContact CD1-CE1 3.65Å; L382-F431 HydrophobicContact CD1-CE2 4.31Å; L382-F431 HydrophobicContact CD1-CZ 3.73Å; L382-F462 HydrophobicContact CB-CE1 4.17Å; L382-F462 HydrophobicContact CB-CE2 4.09Å; L382-F462 HydrophobicContact CB-CZ 3.67Å
383	L	90.8	Very high	92.6	Very high	9 Å²	9	39.6 Å²	39.6	5%	0.047	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	134.4	-179.4	-167.3	97	0	0	0	110.4	T364 L393 L398 L420 R430 I432	T364-L383 HydrophobicContact CG2-CD1 4.12Å; L383-L393 HydrophobicContact CD1-CD1 3.53Å; L383-L393 HydrophobicContact CD2-CD1 3.77Å; L383-L393 HydrophobicContact CG-CD1 4.3Å; L383-L398 HydrophobicContact CD2-CD2 3.29Å; L383-L420 HydrophobicContact CD2-CD1 4.36Å; L383-R430 HydrophobicContact CB-CB 3.98Å; L383-R430 WeakPolarHBondContact CB-O 3.39Å; L383-R430 HydrophobicContact CD2-CB 4.17Å; L383-R430 PolarHBondContact N-O 3.4Å; L383-I432 HydrophobicContact CD1-CG2 4.47Å
384	S	87.2	Confident	92.6	Very high	17 Å²	17	38 Å²	38	12%	0.119	19%	0.19	C	C	.	.			trans	-129.5	129.1	170.2	175.5	0	0	0	0	109.4	R386 K387 S388	S384-R386 PolarHBondContact O-N 2.88Å; S384-R386 PolarHBondContact OG-N 2.75Å; S384-K387 PolarHBondContact O-N 3.12Å; S384-S388 PolarHBondContact N-OG 3.45Å; S384-S388 WeakPolarHBondContact O-CA 3.39Å; S384-S388 WeakPolarHBondContact O-CB 3.45Å; S384-S388 PolarHBondContact O-N 3.11Å; S384-S388 PolarHBondContact O-OG 3.35Å
385	T	85.1	Confident	92.4	Very high	36 Å²	36	31.6 Å²	31.6	22%	0.221	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-13.9	178.5	51.2	0	0	0	0	114.4	P96 L398	P96-T385 HydrophobicContact CG-CG2 4.27Å; T385-L398 HydrophobicContact CG2-CB 4.07Å
386	R	83.8	Confident	92.2	Very high	84 Å²	84	30.9 Å²	30.9	32%	0.317	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-32.4	178.8	-69.3	-165	-63	172.3	-1.4	115.8	Y53 I54 A55 S384	Y53-R386 PolarHBondContact O-NH2 3.5Å; I54-R386 HydrophobicContact CG2-CG 3.94Å; I54-R386 WeakPolarHBondContact O-CD 3.5Å; I54-R386 PolarHBondContact O-NE 3.2Å; I54-R386 PolarHBondContact O-NH1 3.32Å; I54-R386 VanDerWaalsContact O-NH1 3.15Å; A55-R386 VanDerWaalsContact N-NH2 3.18Å; A55-R386 PolarHBondContact O-NH1 3.29Å; S384-R386 PolarHBondContact O-N 2.88Å; S384-R386 PolarHBondContact OG-N 2.75Å
387	K	83.1	Confident	92.1	Very high	113 Å²	113	27.6 Å²	27.6	49%	0.491	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-23.6	-172.3	-64.5	-176.8	-179.8	175.9	0	112	P361 S362 S384	P361-K387 HydrophobicContact CB-CB 3.93Å; P361-K387 CarbonylContact O-C 3.52Å; S362-K387 WeakPolarHBondContact CA-O 3.12Å; S384-K387 PolarHBondContact O-N 3.12Å
388	S	88.3	Confident	91.8	Very high	11 Å²	11	27.9 Å²	27.9	8%	0.077	15%	0.148	C	C	.	.	S	Bend	trans	-92.9	153.2	178.4	-54.3	0	0	0	0	111	P361 T364 S384 C390	P361-S388 WeakPolarHBondContact O-CA 3.21Å; P361-S388 WeakPolarHBondContact O-CB 3.42Å; P361-S388 PolarHBondContact O-N 3.4Å; P361-S388 PolarHBondContact O-OG 2.72Å; T364-S388 WeakPolarHBondContact O-CB 3.17Å; S384-S388 PolarHBondContact N-OG 3.45Å; S384-S388 WeakPolarHBondContact O-CA 3.39Å; S384-S388 WeakPolarHBondContact O-CB 3.45Å; S384-S388 PolarHBondContact O-N 3.11Å; S384-S388 PolarHBondContact O-OG 3.35Å; S388-C390 PolarHBondContact O-N 2.84Å
389	D	90.9	Very high	91.1	Very high	60 Å²	60	28.8 Å²	28.8	32%	0.321	16%	0.156	S	C	.	.	B	Isolated β-bridge	trans	-79	111.1	163.4	175.4	8.8	0	0	0	108.5	P336 T391	P336-D389 HydrophobicContact CB-CB 4.33Å; D389-T391 VanDerWaalsContact C-N 3.34Å; D389-T391 WeakPolarHBondContact OD1-CB 3.26Å; D389-T391 PolarHBondContact OD1-N 3.36Å; D389-T391 PolarHBondContact OD1-OG1 2.98Å
390	C	93.3	Very high	89.9	Confident	4 Å²	4	31.4 Å²	31.4	3%	0.027	17%	0.174	C	C	.	.			trans	-93.4	11.2	-178.7	-64.8	0	0	0	0	113.5	P96 S388 G392 L393 L398	P96-C390 HydrophobicContact CB-CB 4.11Å; P96-C390 HydrophobicContact CG-CB 3.91Å; S388-C390 PolarHBondContact O-N 2.84Å; C390-G392 PolarHBondContact O-N 3.26Å; C390-L393 HydrophobicContact CB-CD1 4.27Å; C390-L393 WeakPolarHBondContact O-CB 3.4Å; C390-L393 PolarHBondContact O-N 3.16Å; C390-L393 VanDerWaalsContact O-N 3.16Å; C390-L398 HydrophobicContact CB-CD1 3.79Å
391	T	93.1	Very high	88.6	Confident	77 Å²	77	34.7 Å²	34.7	47%	0.472	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	128.5	179.4	-55.3	0	0	0	0	111.1	G98 D389 L393	G98-T391 CarbonylContact O-C 3.58Å; G98-T391 VanDerWaalsContact O-CA 3.32Å; G98-T391 WeakPolarHBondContact O-CA 3.45Å; D389-T391 VanDerWaalsContact C-N 3.34Å; D389-T391 WeakPolarHBondContact OD1-CB 3.26Å; D389-T391 PolarHBondContact OD1-N 3.36Å; D389-T391 PolarHBondContact OD1-OG1 2.98Å; T391-L393 VanDerWaalsContact C-N 3.31Å; T391-L393 PolarHBondContact O-N 3.39Å
392	G	94.7	Very high	87	Confident	16 Å²	16	40.7 Å²	40.7	17%	0.165	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	5.6	179.2	0	0	0	0	0	115.3	G98 L100 W110 L366 C390	G98-G392 PolarHBondContact O-N 3.03Å; L100-G392 WeakPolarHBondContact CD1-O 3.35Å; W110-G392 PolarHBondContact NE1-O 3.29Å; L366-G392 WeakPolarHBondContact CD2-O 3.28Å; C390-G392 PolarHBondContact O-N 3.26Å
393	L	96.7	Very high	85.9	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.258	C	S	.	.	S	Bend	trans	-93.1	142.5	176.2	-61.9	-177.3	0	0	0	111.8	S99 L100 W110 L366 L383 C390 T391 Q395 L398 L420 I432	S99-L393 WeakPolarHBondContact CA-O 3.45Å; S99-L393 WeakPolarHBondContact CB-O 3.11Å; L100-L393 PolarHBondContact N-O 3.08Å; W110-L393 HydrophobicContact CH2-CD2 4.16Å; W110-L393 HydrophobicContact CZ2-CD2 3.85Å; L366-L393 HydrophobicContact CB-CD2 3.96Å; L366-L393 HydrophobicContact CD2-CD2 4.23Å; L366-L393 HydrophobicContact CG-CD2 4.46Å; L383-L393 HydrophobicContact CD1-CD1 3.53Å; L383-L393 HydrophobicContact CD2-CD1 3.77Å; L383-L393 HydrophobicContact CG-CD1 4.3Å; C390-L393 HydrophobicContact CB-CD1 4.27Å; C390-L393 WeakPolarHBondContact O-CB 3.4Å; C390-L393 PolarHBondContact O-N 3.16Å; C390-L393 VanDerWaalsContact O-N 3.16Å; T391-L393 VanDerWaalsContact C-N 3.31Å; T391-L393 PolarHBondContact O-N 3.39Å; L393-Q395 PolarHBondContact O-N 2.72Å; L393-L398 HydrophobicContact CB-CD1 3.95Å; L393-L398 HydrophobicContact CD1-CD2 4.35Å; L393-L420 HydrophobicContact CB-CD2 4.5Å; L393-L420 HydrophobicContact CD2-CD2 4.48Å; L393-I432 HydrophobicContact CD2-CD1 4.16Å
394	P	95.7	Very high	84.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-64.1	121.8	177.6	-20.6	31.4	0	0	0	112.8	A105 W110 S396 M397 M413 L420	A105-P394 HydrophobicContact CB-CB 3.87Å; A105-P394 HydrophobicContact CB-CG 3.89Å; W110-P394 HydrophobicContact CB-CG 4Å; W110-P394 HydrophobicContact CD2-CG 3.56Å; W110-P394 HydrophobicContact CE3-CG 4.05Å; W110-P394 HydrophobicContact CG-CG 3.54Å; P394-S396 PolarHBondContact O-N 2.8Å; P394-M397 HydrophobicContact CB-CG 4.38Å; P394-M397 PolarHBondContact O-N 2.8Å; P394-M413 HydrophobicContact CB-CE 4.46Å; P394-M413 HydrophobicContact CB-SD 3.8Å; P394-M413 HydrophobicContact CG-CE 4.31Å; P394-M413 HydrophobicContact CG-SD 3.87Å; P394-L420 HydrophobicContact CG-CD2 4.39Å
395	Q	93.3	Very high	84.4	Confident	44 Å²	44	48.8 Å²	48.8	21%	0.206	29%	0.294	C	S	.	.	H	α-helix	trans	-59.2	-32.9	179.4	-174.2	-176.5	-6	0	0	112.4	S93 L100 L393 M397 L398 V399	S93-Q395 PolarHBondContact O-NE2 3.5Å; L100-Q395 VanDerWaalsContact O-CB 3.26Å; L100-Q395 WeakPolarHBondContact O-CB 3.49Å; L100-Q395 PolarHBondContact O-N 2.92Å; L393-Q395 PolarHBondContact O-N 2.72Å; Q395-M397 PolarHBondContact O-N 3.49Å; Q395-M397 VanDerWaalsContact O-N 3.08Å; Q395-L398 PolarHBondContact O-N 3.33Å; Q395-V399 HydrophobicContact CG-CG2 3.57Å; Q395-V399 PolarHBondContact O-N 3.03Å
396	S	91.5	Very high	84.4	Confident	41 Å²	41	54.4 Å²	54.4	29%	0.287	32%	0.317	S	S	.	.	H	α-helix	trans	-60.2	-17.7	177.5	61.5	0	0	0	0	114.4	P394 R411	P394-S396 PolarHBondContact O-N 2.8Å; S396-R411 PolarHBondContact O-NH1 2.93Å
397	M	92.3	Very high	84.5	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.015	33%	0.326	C	S	.	.	H	α-helix	trans	-99.7	-20.2	175.8	-68	-65.8	-75.5	0	0	112.4	P394 Q395 R411 M413 L420 R430	P394-M397 HydrophobicContact CB-CG 4.38Å; P394-M397 PolarHBondContact O-N 2.8Å; Q395-M397 PolarHBondContact O-N 3.49Å; Q395-M397 VanDerWaalsContact O-N 3.08Å; M397-R411 HydrophobicContact CE-CB 3.97Å; M397-R411 WeakPolarHBondContact CE-O 3.4Å; M397-R411 HydrophobicContact SD-CB 3.96Å; M397-M413 HydrophobicContact CE-CG 4.43Å; M397-M413 HydrophobicContact CG-CB 4.43Å; M397-M413 HydrophobicContact CG-CG 3.84Å; M397-M413 HydrophobicContact CG-SD 3.52Å; M397-M413 VanDerWaalsContact CG-SD 3.52Å; M397-M413 HydrophobicContact SD-CG 3.97Å; M397-M413 HydrophobicContact SD-SD 4.24Å; M397-L420 HydrophobicContact CB-CD2 3.49Å; M397-L420 VanDerWaalsContact CB-CD2 3.49Å; M397-L420 HydrophobicContact CB-CG 4.15Å; M397-L420 HydrophobicContact CE-CG 4.33Å; M397-L420 VanDerWaalsContact CE-O 3.28Å; M397-L420 WeakPolarHBondContact CE-O 3.12Å; M397-L420 HydrophobicContact CG-CD2 3.95Å; M397-L420 HydrophobicContact CG-CG 4.5Å; M397-R430 WeakPolarHBondContact O-CD 3.35Å; M397-R430 PolarHBondContact O-NE 2.81Å
398	L	90	Very high	84.5	Confident	6 Å²	6	51.7 Å²	51.7	3%	0.031	31%	0.306	C	S	.	.	H	α-helix	trans	-93.8	-30.8	-176.8	-58.5	-175.3	0	0	0	113.1	P96 L383 T385 C390 L393 Q395 R430	P96-L398 HydrophobicContact CG-CB 4.29Å; P96-L398 HydrophobicContact CG-CD1 3.49Å; P96-L398 VanDerWaalsContact CG-CD1 3.49Å; L383-L398 HydrophobicContact CD2-CD2 3.29Å; T385-L398 HydrophobicContact CG2-CB 4.07Å; C390-L398 HydrophobicContact CB-CD1 3.79Å; L393-L398 HydrophobicContact CB-CD1 3.95Å; L393-L398 HydrophobicContact CD1-CD2 4.35Å; Q395-L398 PolarHBondContact O-N 3.33Å; L398-R430 PolarHBondContact O-NE 3.16Å; L398-R430 PolarHBondContact O-NH2 3.5Å
399	V	84.4	Confident	84.5	Confident	47 Å²	47	55.9 Å²	55.9	29%	0.285	33%	0.325	S	S	.	.	S	Bend	trans	-91.3	136.8	178.1	-178.9	0	0	0	0	109.4	Q395	Q395-V399 HydrophobicContact CG-CG2 3.57Å; Q395-V399 PolarHBondContact O-N 3.03Å
400	C	71.9	Confident	84.5	Confident	55 Å²	55	55.6 Å²	55.6	37%	0.372	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-75	134.1	174.9	-60	0	0	0	0	109.6	H428 R430	C400-H428 PolarHBondContact SG-CD2 2.9Å; C400-R430 PolarHBondContact SG-NH2 2.93Å
401	S	67.6	Low	84.4	Confident	68 Å²	68	60.1 Å²	60.1	48%	0.476	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-69.3	153.3	169.3	51.1	0	0	0	0	110.3	T403	S401-T403 PolarHBondContact O-N 3.26Å; S401-T403 PolarHBondContact OG-O 3.08Å
402	S	61.2	Low	84.5	Confident	127 Å²	127	57.3 Å²	57.3	89%	0.888	33%	0.327	S	S	*	.	S	Bend	trans	-63.5	-17.3	171.4	50.2	0	0	0	0	113.2
403	T	69	Low	84.5	Confident	98 Å²	98	57 Å²	57	60%	0.601	32%	0.321	S	S	*	.	S	Bend	trans	-82.3	126.9	177.3	-29.7	0	0	0	0	111	S401 A405	S401-T403 PolarHBondContact O-N 3.26Å; S401-T403 PolarHBondContact OG-O 3.08Å; T403-A405 PolarHBondContact O-N 3.49Å
404	P	67.8	Low	84.5	Confident	114 Å²	114	57.1 Å²	57.1	74%	0.74	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-62.9	126.5	173.9	-19.8	31.4	0	0	0	111
405	A	79.6	Confident	84.5	Confident	21 Å²	21	60.2 Å²	60.2	17%	0.174	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-80.6	154.9	173.7	0	0	0	0	0	111.1	T403 Y424	T403-A405 PolarHBondContact O-N 3.49Å; A405-Y424 HydrophobicContact CB-CD1 3.83Å; A405-Y424 HydrophobicContact CB-CD2 3.75Å; A405-Y424 HydrophobicContact CB-CE1 4.34Å; A405-Y424 HydrophobicContact CB-CE2 4.26Å; A405-Y424 HydrophobicContact CB-CG 3.49Å; A405-Y424 VanDerWaalsContact CB-CG 3.49Å; A405-Y424 WeakPolarHBondContact O-CD1 3.3Å; A405-Y424 WeakPolarHBondContact O-CE1 3.13Å
406	Q	85.4	Confident	84.5	Confident	153 Å²	153	61 Å²	61	72%	0.715	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-83.1	146.2	174.3	-69	-175.5	-6	0	0	110.8	G408 Q409 Y424	Q406-G408 PolarHBondContact O-N 3.31Å; Q406-Q409 WeakPolarHBondContact O-CB 3.46Å; Q406-Q409 PolarHBondContact O-N 2.82Å; Q406-Y424 WeakPolarHBondContact O-CD1 3.19Å
407	R	85.9	Confident	84.6	Confident	132 Å²	132	61.7 Å²	61.7	50%	0.498	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	133.3	174.5	-74.5	-164.9	177.7	-175.4	12.9	110.9	Q409 N425 K426	R407-Q409 VanDerWaalsContact C-N 3.27Å; R407-N425 WeakPolarHBondContact CD-OD1 3.45Å; R407-N425 VanDerWaalsContact CG-O 3.3Å; R407-N425 WeakPolarHBondContact CG-O 3.09Å; R407-K426 VanDerWaalsContact NH2-CE 3.32Å
408	G	82.9	Confident	84.8	Confident	8 Å²	8	62 Å²	62	8%	0.082	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	-14.9	-176.7	0	0	0	0	0	114.1	Q406 S410 W423 Y424 P454	Q406-G408 PolarHBondContact O-N 3.31Å; G408-S410 PolarHBondContact O-N 2.95Å; G408-W423 PolarHBondContact O-NE1 3.2Å; G408-Y424 PolarHBondContact N-O 2.86Å; G408-P454 WeakPolarHBondContact CA-O 3.09Å
409	Q	88.5	Confident	85.1	Confident	100 Å²	100	61.8 Å²	61.8	47%	0.467	36%	0.361	S	S	.	.			trans	-65.6	136.1	179.5	-169.7	176.8	13.5	0	0	110.5	Q406 R407 Y424	Q406-Q409 WeakPolarHBondContact O-CB 3.46Å; Q406-Q409 PolarHBondContact O-N 2.82Å; R407-Q409 VanDerWaalsContact C-N 3.27Å; Q409-Y424 PolarHBondContact O-N 2.94Å
410	S	89.7	Confident	85.7	Confident	54 Å²	54	59.6 Å²	59.6	38%	0.378	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	149.7	174.6	67.3	0	0	0	0	112.3	G408 S422	G408-S410 PolarHBondContact O-N 2.95Å; S410-S422 CarbonylContact C-O 3.19Å; S410-S422 WeakPolarHBondContact CA-O 3.37Å
411	R	92.2	Very high	86.8	Confident	98 Å²	98	57 Å²	57	37%	0.37	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	140.9	167	-67.5	178.1	62.2	-147.5	-8	107.8	S396 M397 S422	S396-R411 PolarHBondContact O-NH1 2.93Å; M397-R411 HydrophobicContact CE-CB 3.97Å; M397-R411 WeakPolarHBondContact CE-O 3.4Å; M397-R411 HydrophobicContact SD-CB 3.96Å; R411-S422 PolarHBondContact N-O 3.43Å; R411-S422 PolarHBondContact O-N 3.21Å
412	V	94.1	Very high	88	Confident	19 Å²	19	54.1 Å²	54.1	12%	0.115	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	135.7	179.8	-172.8	0	0	0	0	109.9	L114 M414 L420 I421 P438	L114-V412 HydrophobicContact CD2-CB 3.84Å; L114-V412 HydrophobicContact CD2-CG1 3.76Å; V412-M414 HydrophobicContact CG1-CG 4.45Å; V412-L420 WeakPolarHBondContact CA-O 3.15Å; V412-I421 HydrophobicContact CG1-CG1 4.15Å; V412-I421 HydrophobicContact CG2-CG1 4.11Å; V412-I421 HydrophobicContact CG2-CG2 4.36Å; V412-P438 HydrophobicContact CB-CB 4.48Å; V412-P438 HydrophobicContact CG1-CB 3.69Å; V412-P438 HydrophobicContact CG1-CG 4.35Å; V412-P438 HydrophobicContact CG2-CB 4.38Å
413	M	96	Very high	89.4	Confident	8 Å²	8	48 Å²	48	4%	0.039	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	148.4	163.8	-66.1	-174.4	81	0	0	109	W110 T111 E112 P394 M397 L420	W110-M413 HydrophobicContact CB-CE 3.92Å; W110-M413 HydrophobicContact CE3-CB 3.91Å; W110-M413 HydrophobicContact CZ3-CB 4.44Å; T111-M413 CarbonylContact O-C 3.59Å; T111-M413 VanDerWaalsContact O-CA 3.31Å; T111-M413 WeakPolarHBondContact O-CA 3.28Å; E112-M413 HydrophobicContact CG-CE 4.47Å; E112-M413 HydrophobicContact CG-CG 4.02Å; P394-M413 HydrophobicContact CB-CE 4.46Å; P394-M413 HydrophobicContact CB-SD 3.8Å; P394-M413 HydrophobicContact CG-CE 4.31Å; P394-M413 HydrophobicContact CG-SD 3.87Å; M397-M413 HydrophobicContact CE-CG 4.43Å; M397-M413 HydrophobicContact CG-CB 4.43Å; M397-M413 HydrophobicContact CG-CG 3.84Å; M397-M413 HydrophobicContact CG-SD 3.52Å; M397-M413 VanDerWaalsContact CG-SD 3.52Å; M397-M413 HydrophobicContact SD-CG 3.97Å; M397-M413 HydrophobicContact SD-SD 4.24Å; M413-L420 PolarHBondContact N-O 2.81Å; M413-L420 PolarHBondContact O-N 3.32Å
414	M	95.9	Very high	90.2	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.02	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	145	178.7	-64.7	-173.2	75	0	0	111.8	W110 T111 L114 Q115 V117 V412 M418 P438	W110-M414 CarbonylContact C-O 3.49Å; W110-M414 VanDerWaalsContact CA-O 3.27Å; W110-M414 WeakPolarHBondContact CA-O 3.08Å; W110-M414 VanDerWaalsContact CE3-C 3.48Å; T111-M414 PolarHBondContact N-O 3.38Å; T111-M414 PolarHBondContact O-N 2.88Å; L114-M414 HydrophobicContact CB-SD 4.32Å; L114-M414 HydrophobicContact CD2-CG 4.06Å; L114-M414 HydrophobicContact CD2-SD 4.14Å; Q115-M414 HydrophobicContact CB-CE 4.46Å; Q115-M414 HydrophobicContact CB-SD 4.45Å; Q115-M414 PolarHBondContact N-SD 2.98Å; V117-M414 HydrophobicContact CG2-CE 3.63Å; V412-M414 HydrophobicContact CG1-CG 4.45Å; M414-M418 CarbonylContact C-O 3.59Å; M414-M418 VanDerWaalsContact CA-O 3.22Å; M414-M418 WeakPolarHBondContact CA-O 3.36Å; M414-P438 HydrophobicContact CE-CG 4.01Å; M414-P438 HydrophobicContact CG-CG 4.21Å; M414-P438 HydrophobicContact SD-CG 3.51Å; M414-P438 VanDerWaalsContact SD-CG 3.51Å
415	K	95.5	Very high	90.9	Very high	64 Å²	64	40.7 Å²	40.7	28%	0.278	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	105.3	165.1	175.7	170.3	178.2	154.9	0	108	E108 W110 S417 M418	E108-K415 WeakPolarHBondContact O-CD 3.43Å; E108-K415 WeakPolarHBondContact O-CE 3.14Å; E108-K415 PolarHBondContact O-NZ 2.93Å; E108-K415 IonicContact OE2-NZ 2.81Å; E108-K415 PolarHBondContact OE2-NZ 2.93Å; W110-K415 HydrophobicContact CD2-CB 3.66Å; W110-K415 HydrophobicContact CD2-CD 4.49Å; W110-K415 HydrophobicContact CE3-CB 3.8Å; W110-K415 HydrophobicContact CG-CB 4.18Å; W110-K415 HydrophobicContact CH2-CB 4.17Å; W110-K415 HydrophobicContact CZ2-CB 4.05Å; W110-K415 HydrophobicContact CZ2-CD 4.4Å; W110-K415 HydrophobicContact CZ3-CB 4.04Å; K415-S417 PolarHBondContact O-N 2.98Å; K415-M418 PolarHBondContact N-O 3.41Å; K415-M418 WeakPolarHBondContact O-CB 3.29Å; K415-M418 PolarHBondContact O-N 3.1Å
416	G	93.3	Very high	90.8	Very high	62 Å²	62	41.6 Å²	41.6	64%	0.639	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.8	-124	-169.3	0	0	0	0	0	111.1
417	S	92.9	Very high	90.7	Very high	55 Å²	55	34.5 Å²	34.5	39%	0.385	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-4.4	175.7	58.1	0	0	0	0	114.4	K415	K415-S417 PolarHBondContact O-N 2.98Å
418	M	96.6	Very high	90.7	Very high	10 Å²	10	30.2 Å²	30.2	5%	0.049	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	126.6	-179	-162.5	66	64.2	0	0	110.5	L366 F369 M414 K415 I432 T433 N434	L366-M418 HydrophobicContact CD1-CG 4.02Å; F369-M418 HydrophobicContact CB-CE 3.62Å; F369-M418 HydrophobicContact CB-SD 4.2Å; F369-M418 HydrophobicContact CD2-SD 4.19Å; M414-M418 CarbonylContact C-O 3.59Å; M414-M418 VanDerWaalsContact CA-O 3.22Å; M414-M418 WeakPolarHBondContact CA-O 3.36Å; K415-M418 PolarHBondContact N-O 3.41Å; K415-M418 WeakPolarHBondContact O-CB 3.29Å; K415-M418 PolarHBondContact O-N 3.1Å; M418-I432 HydrophobicContact CG-CD1 3.74Å; M418-I432 HydrophobicContact CG-CG1 3.66Å; M418-I432 HydrophobicContact SD-CD1 3.94Å; M418-I432 HydrophobicContact SD-CG1 3.56Å; M418-I432 VanDerWaalsContact SD-CG1 3.56Å; M418-T433 VanDerWaalsContact SD-C 3.6Å; M418-N434 HydrophobicContact CE-CB 3.92Å; M418-N434 HydrophobicContact SD-CB 3.87Å
419	S	96.5	Very high	90.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	131.4	176.7	-56.4	0	0	0	0	110.6	I432 T433 P438	S419-I432 CarbonylContact O-C 3.54Å; S419-I432 VanDerWaalsContact O-CA 3.3Å; S419-I432 WeakPolarHBondContact O-CA 3.22Å; S419-T433 PolarHBondContact N-O 3.49Å; S419-T433 PolarHBondContact O-N 3.11Å; S419-P438 WeakPolarHBondContact OG-CG 3.43Å
420	L	97.2	Very high	91.2	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	115.1	165.7	177.5	62.7	0	0	0	108.3	W110 L383 L393 P394 M397 V412 M413 F431	W110-L420 HydrophobicContact CH2-CB 3.89Å; W110-L420 HydrophobicContact CZ3-CB 3.65Å; L383-L420 HydrophobicContact CD2-CD1 4.36Å; L393-L420 HydrophobicContact CB-CD2 4.5Å; L393-L420 HydrophobicContact CD2-CD2 4.48Å; P394-L420 HydrophobicContact CG-CD2 4.39Å; M397-L420 HydrophobicContact CB-CD2 3.49Å; M397-L420 VanDerWaalsContact CB-CD2 3.49Å; M397-L420 HydrophobicContact CB-CG 4.15Å; M397-L420 HydrophobicContact CE-CG 4.33Å; M397-L420 VanDerWaalsContact CE-O 3.28Å; M397-L420 WeakPolarHBondContact CE-O 3.12Å; M397-L420 HydrophobicContact CG-CD2 3.95Å; M397-L420 HydrophobicContact CG-CG 4.5Å; V412-L420 WeakPolarHBondContact CA-O 3.15Å; M413-L420 PolarHBondContact N-O 2.81Å; M413-L420 PolarHBondContact O-N 3.32Å; L420-F431 CarbonylContact C-O 3.56Å; L420-F431 WeakPolarHBondContact CA-O 3.47Å; L420-F431 WeakPolarHBondContact CD1-O 3.29Å
421	I	94.3	Very high	91.4	Very high	2 Å²	2	25 Å²	25	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	132.4	-174.7	-58	172.3	0	0	0	108.3	V412 R430 F431 T433 P456 A458	V412-I421 HydrophobicContact CG1-CG1 4.15Å; V412-I421 HydrophobicContact CG2-CG1 4.11Å; V412-I421 HydrophobicContact CG2-CG2 4.36Å; I421-R430 CarbonylContact O-C 3.59Å; I421-R430 VanDerWaalsContact O-CA 3.22Å; I421-R430 WeakPolarHBondContact O-CA 3.3Å; I421-F431 HydrophobicContact CB-CB 4.37Å; I421-F431 PolarHBondContact N-O 2.66Å; I421-F431 PolarHBondContact O-N 3.39Å; I421-T433 HydrophobicContact CD1-CG2 4.02Å; I421-P456 HydrophobicContact CD1-CB 4.27Å; I421-P456 HydrophobicContact CG2-CB 4.28Å; I421-P456 HydrophobicContact CG2-CG 3.8Å; I421-A458 HydrophobicContact CD1-CB 3.72Å
422	S	93.4	Very high	91.6	Very high	6 Å²	6	20.3 Å²	20.3	4%	0.042	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	112.3	167.5	-177.1	0	0	0	0	107.9	S410 R411 H428 F429	S410-S422 CarbonylContact C-O 3.19Å; S410-S422 WeakPolarHBondContact CA-O 3.37Å; R411-S422 PolarHBondContact N-O 3.43Å; R411-S422 PolarHBondContact O-N 3.21Å; S422-H428 PolarHBondContact OG-ND1 3.11Å; S422-F429 WeakPolarHBondContact CA-O 3.36Å
423	W	90.1	Very high	91.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	131.5	179.7	175.3	77.4	0	0	0	109.9	F41 G408 N425 F429 I445 I453 P454 C455 V459	F41-W423 HydrophobicContact CD1-CZ3 4.06Å; G408-W423 PolarHBondContact O-NE1 3.2Å; W423-N425 HydrophobicContact CE3-CB 4.23Å; W423-N425 HydrophobicContact CH2-CB 3.51Å; W423-N425 HydrophobicContact CZ2-CB 4.07Å; W423-N425 HydrophobicContact CZ3-CB 3.58Å; W423-F429 HydrophobicContact CE3-CB 4.21Å; W423-F429 AromaticContact CE3-CD2 3.91Å; W423-F429 HydrophobicContact CE3-CD2 3.91Å; W423-F429 HydrophobicContact CE3-CG 4.35Å; W423-F429 AromaticContact CZ3-CD2 3.92Å; W423-F429 HydrophobicContact CZ3-CD2 3.92Å; W423-F429 HydrophobicContact CZ3-CE2 4.37Å; W423-F429 PolarHBondContact N-O 3.29Å; W423-F429 PolarHBondContact O-N 2.93Å; W423-I445 HydrophobicContact CH2-CD1 3.58Å; W423-I445 HydrophobicContact CZ2-CD1 3.54Å; W423-I445 HydrophobicContact CZ3-CD1 4.27Å; W423-I453 HydrophobicContact CZ2-CG2 3.77Å; W423-P454 PolarHBondContact NE1-O 3.48Å; W423-C455 HydrophobicContact CZ2-CB 4.24Å; W423-V459 HydrophobicContact CB-CG2 4.13Å; W423-V459 HydrophobicContact CD2-CG1 4.18Å; W423-V459 HydrophobicContact CE3-CG1 3.91Å; W423-V459 HydrophobicContact CG-CG2 4.33Å; W423-V459 HydrophobicContact CZ3-CG1 4.16Å
424	Y	87.2	Confident	91.8	Very high	57 Å²	57	19 Å²	19	22%	0.224	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	131.5	-176.9	-173.4	-92.9	0	0	0	111.9	A405 Q406 G408 Q409 H428	A405-Y424 HydrophobicContact CB-CD1 3.83Å; A405-Y424 HydrophobicContact CB-CD2 3.75Å; A405-Y424 HydrophobicContact CB-CE1 4.34Å; A405-Y424 HydrophobicContact CB-CE2 4.26Å; A405-Y424 HydrophobicContact CB-CG 3.49Å; A405-Y424 VanDerWaalsContact CB-CG 3.49Å; A405-Y424 WeakPolarHBondContact O-CD1 3.3Å; A405-Y424 WeakPolarHBondContact O-CE1 3.13Å; Q406-Y424 WeakPolarHBondContact O-CD1 3.19Å; G408-Y424 PolarHBondContact N-O 2.86Å; Q409-Y424 PolarHBondContact O-N 2.94Å; Y424-H428 AromaticContact CD2-CD2 3.84Å; Y424-H428 AromaticContact CD2-CE1 3.81Å; Y424-H428 AromaticContact CD2-NE2 3.65Å
425	N	82.2	Confident	91.7	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.005	11%	0.112	C	C	.	.	S	Bend	trans	-133	-91.9	168.9	-176.8	15.4	0	0	0	110.7	R407 W423 G427 F429	R407-N425 WeakPolarHBondContact CD-OD1 3.45Å; R407-N425 VanDerWaalsContact CG-O 3.3Å; R407-N425 WeakPolarHBondContact CG-O 3.09Å; W423-N425 HydrophobicContact CE3-CB 4.23Å; W423-N425 HydrophobicContact CH2-CB 3.51Å; W423-N425 HydrophobicContact CZ2-CB 4.07Å; W423-N425 HydrophobicContact CZ3-CB 3.58Å; N425-G427 VanDerWaalsContact C-N 3.27Å; N425-G427 PolarHBondContact N-O 2.9Å; N425-F429 HydrophobicContact CB-CE2 4.48Å
426	K	78	Confident	91.5	Very high	39 Å²	39	17.7 Å²	17.7	17%	0.17	10%	0.104	C	C	.	.	S	Bend	trans	-96.6	15.9	168	-68.7	179.2	171.3	179.8	0	112.1	S43 T44 S45 R407	S43-K426 WeakPolarHBondContact O-CE 3.41Å; S43-K426 PolarHBondContact O-NZ 2.95Å; T44-K426 PolarHBondContact O-NZ 3.34Å; T44-K426 VanDerWaalsContact O-NZ 3.11Å; S45-K426 PolarHBondContact O-NZ 2.86Å; R407-K426 VanDerWaalsContact NH2-CE 3.32Å
427	G	82.9	Confident	91.3	Very high	4 Å²	4	15 Å²	15	4%	0.041	8%	0.075	C	C	.	.	S	Bend	trans	160.3	166.2	-165.5	0	0	0	0	0	109.9	N425 F429	N425-G427 VanDerWaalsContact C-N 3.27Å; N425-G427 PolarHBondContact N-O 2.9Å; G427-F429 PolarHBondContact O-N 3.24Å
428	H	85.2	Confident	91	Very high	43 Å²	43	13.1 Å²	13.1	20%	0.199	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	111.7	178.4	-74.4	-83.1	0	0	0	111.2	C400 S422 Y424	C400-H428 PolarHBondContact SG-CD2 2.9Å; S422-H428 PolarHBondContact OG-ND1 3.11Å; Y424-H428 AromaticContact CD2-CD2 3.84Å; Y424-H428 AromaticContact CD2-CE1 3.81Å; Y424-H428 AromaticContact CD2-NE2 3.65Å
429	F	88.3	Confident	90.3	Very high	42 Å²	42	15.8 Å²	15.8	18%	0.184	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	127.2	164.2	-66.4	-91.6	0	0	0	108.9	F41 L382 S422 W423 N425 G427 F431	F41-F429 HydrophobicContact CD1-CD1 4.45Å; F41-F429 HydrophobicContact CD1-CE1 4.42Å; F41-F429 HydrophobicContact CE1-CB 4.44Å; F41-F429 AromaticContact CE1-CD1 3.59Å; F41-F429 HydrophobicContact CE1-CD1 3.59Å; F41-F429 HydrophobicContact CE1-CD2 4.49Å; F41-F429 AromaticContact CE1-CE1 3.88Å; F41-F429 HydrophobicContact CE1-CE1 3.88Å; F41-F429 AromaticContact CE1-CG 3.92Å; F41-F429 HydrophobicContact CE1-CG 3.92Å; F41-F429 HydrophobicContact CE1-CZ 4.45Å; F41-F429 AromaticContact CZ-CD1 3.86Å; F41-F429 HydrophobicContact CZ-CD1 3.86Å; F41-F429 HydrophobicContact CZ-CE1 4.07Å; L382-F429 HydrophobicContact CD1-CD1 4.31Å; S422-F429 WeakPolarHBondContact CA-O 3.36Å; W423-F429 HydrophobicContact CE3-CB 4.21Å; W423-F429 AromaticContact CE3-CD2 3.91Å; W423-F429 HydrophobicContact CE3-CD2 3.91Å; W423-F429 HydrophobicContact CE3-CG 4.35Å; W423-F429 AromaticContact CZ3-CD2 3.92Å; W423-F429 HydrophobicContact CZ3-CD2 3.92Å; W423-F429 HydrophobicContact CZ3-CE2 4.37Å; W423-F429 PolarHBondContact N-O 3.29Å; W423-F429 PolarHBondContact O-N 2.93Å; N425-F429 HydrophobicContact CB-CE2 4.48Å; G427-F429 PolarHBondContact O-N 3.24Å; F429-F431 HydrophobicContact CB-CE2 3.68Å; F429-F431 HydrophobicContact CB-CZ 4.25Å
430	R	92.9	Very high	89.1	Confident	10 Å²	10	20.3 Å²	20.3	4%	0.038	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	138	-177.4	-63.9	177.2	-177.1	86.8	-2.9	109.8	L383 M397 L398 C400 I421	L383-R430 HydrophobicContact CB-CB 3.98Å; L383-R430 WeakPolarHBondContact CB-O 3.39Å; L383-R430 HydrophobicContact CD2-CB 4.17Å; L383-R430 PolarHBondContact N-O 3.4Å; M397-R430 WeakPolarHBondContact O-CD 3.35Å; M397-R430 PolarHBondContact O-NE 2.81Å; L398-R430 PolarHBondContact O-NE 3.16Å; L398-R430 PolarHBondContact O-NH2 3.5Å; C400-R430 PolarHBondContact SG-NH2 2.93Å; I421-R430 CarbonylContact O-C 3.59Å; I421-R430 VanDerWaalsContact O-CA 3.22Å; I421-R430 WeakPolarHBondContact O-CA 3.3Å
431	F	95	Very high	87.3	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145.2	-179.5	-60.2	-94.5	0	0	0	110.3	F41 G381 L382 L420 I421 F429 V459 F462	F41-F431 AromaticContact CE1-CZ 3.88Å; F41-F431 HydrophobicContact CE1-CZ 3.88Å; F41-F431 AromaticContact CZ-CZ 3.84Å; F41-F431 HydrophobicContact CZ-CZ 3.84Å; G381-F431 VanDerWaalsContact O-CA 3.25Å; G381-F431 WeakPolarHBondContact O-CA 3.4Å; L382-F431 HydrophobicContact CB-CD1 4.5Å; L382-F431 HydrophobicContact CB-CE1 4.32Å; L382-F431 HydrophobicContact CD1-CD1 4.18Å; L382-F431 HydrophobicContact CD1-CE1 3.65Å; L382-F431 HydrophobicContact CD1-CE2 4.31Å; L382-F431 HydrophobicContact CD1-CZ 3.73Å; L420-F431 CarbonylContact C-O 3.56Å; L420-F431 WeakPolarHBondContact CA-O 3.47Å; L420-F431 WeakPolarHBondContact CD1-O 3.29Å; I421-F431 HydrophobicContact CB-CB 4.37Å; I421-F431 PolarHBondContact N-O 2.66Å; I421-F431 PolarHBondContact O-N 3.39Å; F429-F431 HydrophobicContact CB-CE2 3.68Å; F429-F431 HydrophobicContact CB-CZ 4.25Å; F431-V459 HydrophobicContact CD2-CG2 3.96Å; F431-V459 HydrophobicContact CE2-CB 4.39Å; F431-V459 HydrophobicContact CE2-CG1 4.19Å; F431-V459 HydrophobicContact CE2-CG2 3.69Å; F431-V459 HydrophobicContact CZ-CG1 4.28Å; F431-V459 HydrophobicContact CZ-CG2 4.35Å; F431-F462 HydrophobicContact CD1-CD2 4.25Å; F431-F462 HydrophobicContact CD1-CG 4.3Å; F431-F462 HydrophobicContact CE1-CB 3.88Å; F431-F462 AromaticContact CE1-CD1 3.85Å; F431-F462 HydrophobicContact CE1-CD1 3.85Å; F431-F462 AromaticContact CE1-CD2 3.98Å; F431-F462 HydrophobicContact CE1-CD2 3.98Å; F431-F462 HydrophobicContact CE1-CE1 4.41Å; F431-F462 AromaticContact CE1-CG 3.62Å; F431-F462 HydrophobicContact CE1-CG 3.62Å
432	I	97	Very high	85.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	135.5	163.2	-177.9	171	0	0	0	108.1	T364 L366 F369 G381 L383 L393 M418 S419	T364-I432 HydrophobicContact CG2-CG2 3.2Å; L366-I432 HydrophobicContact CB-CD1 4.05Å; L366-I432 HydrophobicContact CD1-CD1 3.68Å; L366-I432 HydrophobicContact CG-CD1 4.49Å; F369-I432 HydrophobicContact CD2-CB 4.49Å; F369-I432 HydrophobicContact CD2-CD1 4.48Å; F369-I432 HydrophobicContact CD2-CG1 4.11Å; F369-I432 HydrophobicContact CD2-CG2 3.84Å; F369-I432 HydrophobicContact CE2-CG2 3.65Å; F369-I432 VanDerWaalsContact CE2-O 3.32Å; F369-I432 WeakPolarHBondContact CE2-O 3.43Å; F369-I432 HydrophobicContact CZ-CG2 4.35Å; G381-I432 PolarHBondContact N-O 2.94Å; G381-I432 PolarHBondContact O-N 2.96Å; G381-I432 VanDerWaalsContact O-N 3.08Å; L383-I432 HydrophobicContact CD1-CG2 4.47Å; L393-I432 HydrophobicContact CD2-CD1 4.16Å; M418-I432 HydrophobicContact CG-CD1 3.74Å; M418-I432 HydrophobicContact CG-CG1 3.66Å; M418-I432 HydrophobicContact SD-CD1 3.94Å; M418-I432 HydrophobicContact SD-CG1 3.56Å; M418-I432 VanDerWaalsContact SD-CG1 3.56Å; S419-I432 CarbonylContact O-C 3.54Å; S419-I432 VanDerWaalsContact O-CA 3.3Å; S419-I432 WeakPolarHBondContact O-CA 3.22Å
433	T	96.6	Very high	83.6	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	144	-179.6	-172.5	0	0	0	0	112.8	C379 M418 S419 I421 A435 A458	C379-T433 VanDerWaalsContact O-CA 3.24Å; C379-T433 WeakPolarHBondContact O-CA 3.2Å; C379-T433 WeakPolarHBondContact O-CB 3.46Å; C379-T433 PolarHBondContact O-OG1 2.76Å; M418-T433 VanDerWaalsContact SD-C 3.6Å; S419-T433 PolarHBondContact N-O 3.49Å; S419-T433 PolarHBondContact O-N 3.11Å; I421-T433 HydrophobicContact CD1-CG2 4.02Å; T433-A435 PolarHBondContact OG1-N 3.43Å; T433-A458 HydrophobicContact CG2-CB 3.91Å
434	N	96.1	Very high	82	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-118.2	10	162.9	64.6	-16.3	0	0	0	111.4	S373 Y378 C379 M418	S373-N434 WeakPolarHBondContact CB-ND2 3.34Å; S373-N434 PolarHBondContact OG-ND2 3.45Å; Y378-N434 WeakPolarHBondContact CA-OD1 3.41Å; Y378-N434 WeakPolarHBondContact CD1-O 3.46Å; C379-N434 PolarHBondContact N-OD1 2.87Å; C379-N434 PolarHBondContact O-N 2.83Å; C379-N434 PolarHBondContact O-OD1 3.22Å; M418-N434 HydrophobicContact CE-CB 3.92Å; M418-N434 HydrophobicContact SD-CB 3.87Å
435	A	94.4	Very high	80.6	Confident	10 Å²	10	30.7 Å²	30.7	8%	0.083	16%	0.16	C	C	.	.	S	Bend	trans	-96.7	-20.9	-176.6	0	0	0	0	0	113	V119 V356 C379 T433	V119-A435 HydrophobicContact CG2-CB 4.44Å; V119-A435 WeakPolarHBondContact CG2-O 3.35Å; V356-A435 HydrophobicContact CG1-CB 3.61Å; V356-A435 HydrophobicContact CG2-CB 4.13Å; C379-A435 WeakPolarHBondContact O-CB 3.43Å; T433-A435 PolarHBondContact OG1-N 3.43Å
436	Y	90.9	Very high	79.2	Confident	29 Å²	29	31.4 Å²	31.4	11%	0.114	16%	0.164	C	C	.	.	S	Bend	trans	-130.4	132	-174.7	-63.2	-73.2	0	0	0	110.1	V356 F358 C380 L457 A458 A461	V356-Y436 HydrophobicContact CG1-CE2 4.31Å; F358-Y436 HydrophobicContact CE1-CE2 4.07Å; F358-Y436 AromaticContact CZ-CE2 3.67Å; F358-Y436 HydrophobicContact CZ-CE2 3.67Å; F358-Y436 AromaticContact CZ-CZ 3.89Å; F358-Y436 VanDerWaalsContact CZ-OH 3.3Å; F358-Y436 WeakPolarHBondContact CZ-OH 3.39Å; C380-Y436 HydrophobicContact CB-CD2 3.98Å; C380-Y436 HydrophobicContact CB-CE2 3.84Å; Y436-L457 HydrophobicContact CD1-CB 4.48Å; Y436-L457 HydrophobicContact CD1-CD2 3.67Å; Y436-L457 HydrophobicContact CD1-CG 3.6Å; Y436-L457 HydrophobicContact CE1-CD2 4.48Å; Y436-L457 HydrophobicContact CE1-CG 4.31Å; Y436-L457 HydrophobicContact CG-CG 4.28Å; Y436-A458 HydrophobicContact CD2-CB 4.22Å; Y436-A458 HydrophobicContact CG-CB 4.35Å; Y436-A461 HydrophobicContact CE1-CB 3.86Å; Y436-A461 HydrophobicContact CE2-CB 3.93Å
437	S	88.8	Confident	77.9	Confident	5 Å²	5	38 Å²	38	4%	0.035	19%	0.192	C	C	.	.			trans	-69.4	133.6	177.4	-177.9	0	0	0	0	111.1	D116 V117 T439	D116-S437 WeakPolarHBondContact CA-OG 3.44Å; D116-S437 WeakPolarHBondContact OD1-CB 3.3Å; D116-S437 PolarHBondContact OD1-OG 2.86Å; V117-S437 PolarHBondContact N-OG 2.85Å; S437-T439 VanDerWaalsContact C-N 3.31Å; S437-T439 PolarHBondContact OG-N 3.09Å; S437-T439 PolarHBondContact OG-OG1 3.27Å
438	P	86.6	Confident	76.5	Confident	16 Å²	16	39.5 Å²	39.5	10%	0.104	20%	0.197	C	C	.	.	S	Bend	trans	-79.4	-15.5	176.5	32.4	-34.8	0	0	0	113.3	L114 V412 M414 S419	L114-P438 HydrophobicContact CD2-CG 4.47Å; V412-P438 HydrophobicContact CB-CB 4.48Å; V412-P438 HydrophobicContact CG1-CB 3.69Å; V412-P438 HydrophobicContact CG1-CG 4.35Å; V412-P438 HydrophobicContact CG2-CB 4.38Å; M414-P438 HydrophobicContact CE-CG 4.01Å; M414-P438 HydrophobicContact CG-CG 4.21Å; M414-P438 HydrophobicContact SD-CG 3.51Å; M414-P438 VanDerWaalsContact SD-CG 3.51Å; S419-P438 WeakPolarHBondContact OG-CG 3.43Å
439	T	82.5	Confident	74.8	Confident	66 Å²	66	48.6 Å²	48.6	41%	0.405	24%	0.236	S	C	.	.	S	Bend	trans	-83.7	-19.6	179.4	60.3	0	0	0	0	112.7	L114 D116 S437 E441	L114-T439 HydrophobicContact CB-CG2 3.61Å; D116-T439 PolarHBondContact OD1-OG1 2.69Å; S437-T439 VanDerWaalsContact C-N 3.31Å; S437-T439 PolarHBondContact OG-N 3.09Å; S437-T439 PolarHBondContact OG-OG1 3.27Å; T439-E441 PolarHBondContact O-N 3.41Å
440	K	71.2	Confident	73.1	Confident	95 Å²	95	51.4 Å²	51.4	41%	0.413	26%	0.261	S	S	.	.	S	Bend	trans	-86.2	107.4	175.7	-68.6	178	-179.6	138.5	0	107.9	D116 A442	D116-K440 VanDerWaalsContact CG-NZ 3.28Å; D116-K440 VanDerWaalsContact OD1-CE 3.22Å; D116-K440 WeakPolarHBondContact OD1-CE 3.33Å; D116-K440 IonicContact OD1-NZ 2.67Å; D116-K440 PolarHBondContact OD1-NZ 2.95Å; D116-K440 WeakPolarHBondContact OD2-CE 3.39Å; D116-K440 IonicContact OD2-NZ 3.62Å; D116-K440 PolarHBondContact OD2-NZ 3.4Å; K440-A442 PolarHBondContact O-N 3.47Å
441	E	59.8	Low	71.6	Confident	185 Å²	185	52.6 Å²	52.6	86%	0.864	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.5	129.4	161	-68.5	-176.3	176.3	0	0	107.9	T439	T439-E441 PolarHBondContact O-N 3.41Å
442	A	56	Low	70.6	Confident	15 Å²	15	58 Å²	58	12%	0.124	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	171.8	169.3	0	0	0	0	0	110.4	K440 V444 L457 E460	K440-A442 PolarHBondContact O-N 3.47Å; A442-V444 PolarHBondContact O-N 3.13Å; A442-L457 HydrophobicContact CB-CB 3.51Å; A442-L457 HydrophobicContact CB-CD1 3.27Å; A442-L457 HydrophobicContact CB-CG 3.91Å; A442-E460 WeakPolarHBondContact CB-OE2 3.48Å
443	G	53.9	Low	69.7	Low	21 Å²	21	58.8 Å²	58.8	22%	0.216	31%	0.305	C	S	.	.			trans	-50.3	139.5	-173.8	0	0	0	0	0	111.1	I445 E460	G443-I445 PolarHBondContact O-N 3.23Å; G443-I445 VanDerWaalsContact O-N 3.13Å; G443-E460 PolarHBondContact N-OE2 2.91Å
444	V	56.4	Low	69.1	Low	50 Å²	50	62.3 Å²	62.3	30%	0.303	33%	0.329	S	S	.	.			trans	-30.1	117.8	155	168.3	0	0	0	0	110.3	A442 I446 E452	A442-V444 PolarHBondContact O-N 3.13Å; V444-I446 PolarHBondContact O-N 3.25Å; V444-E452 HydrophobicContact CB-CB 4.26Å; V444-E452 HydrophobicContact CG1-CB 3.3Å; V444-E452 HydrophobicContact CG1-CG 3.5Å; V444-E452 HydrophobicContact CG2-CB 3.98Å; V444-E452 HydrophobicContact CG2-CG 4.45Å; V444-E452 WeakPolarHBondContact CG2-OE2 3.48Å
445	I	57.9	Low	68.6	Low	13 Å²	13	62.9 Å²	62.9	7%	0.067	33%	0.332	C	S	.	.	S	Bend	trans	-60.3	-33.4	-176.4	-60	-177.5	0	0	0	110.3	Y42 W423 G443 I453 C455 V459	Y42-I445 HydrophobicContact CE1-CG2 4.16Å; W423-I445 HydrophobicContact CH2-CD1 3.58Å; W423-I445 HydrophobicContact CZ2-CD1 3.54Å; W423-I445 HydrophobicContact CZ3-CD1 4.27Å; G443-I445 PolarHBondContact O-N 3.23Å; G443-I445 VanDerWaalsContact O-N 3.13Å; I445-I453 PolarHBondContact N-O 3.45Å; I445-I453 VanDerWaalsContact N-O 3.12Å; I445-C455 HydrophobicContact CD1-CB 3.29Å; I445-C455 WeakPolarHBondContact CD1-SG 3.49Å; I445-C455 HydrophobicContact CG1-CB 3.42Å; I445-C455 VanDerWaalsContact CG1-CB 3.42Å; I445-C455 WeakPolarHBondContact CG1-SG 3.43Å; I445-V459 HydrophobicContact CD1-CB 4.34Å; I445-V459 HydrophobicContact CD1-CG1 3.59Å
446	I	53.5	Low	68.2	Low	17 Å²	17	62.9 Å²	62.9	9%	0.087	33%	0.331	C	S	.	.			trans	-149.4	112.6	-165.3	-38.6	175	0	0	0	111.4	F41 Y42 V444 R448 E452	F41-I446 WeakPolarHBondContact O-CD1 3.03Å; Y42-I446 HydrophobicContact CD1-CB 4.35Å; Y42-I446 HydrophobicContact CD1-CD1 3.51Å; Y42-I446 HydrophobicContact CD1-CG1 3.55Å; Y42-I446 HydrophobicContact CD1-CG2 3.89Å; Y42-I446 HydrophobicContact CE1-CD1 4.08Å; Y42-I446 HydrophobicContact CE1-CG1 3.69Å; Y42-I446 HydrophobicContact CE1-CG2 4.37Å; Y42-I446 HydrophobicContact CG-CD1 3.92Å; Y42-I446 HydrophobicContact CG-CG1 4.42Å; V444-I446 PolarHBondContact O-N 3.25Å; I446-R448 HydrophobicContact CB-CG 3.81Å; I446-R448 HydrophobicContact CG2-CB 4.47Å; I446-R448 HydrophobicContact CG2-CG 3.25Å; I446-R448 PolarHBondContact O-N 2.52Å; I446-R448 VanDerWaalsContact O-N 3.14Å; I446-E452 WeakPolarHBondContact O-CA 3.43Å
447	K	50.5	Low	68	Low	176 Å²	176	64 Å²	64	77%	0.765	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	97.7	153.9	-80.1	-175.9	175.5	-178.1	0	108.2	E452	K447-E452 WeakPolarHBondContact CE-OE1 3.4Å; K447-E452 HydrophobicContact CG-CG 4.35Å; K447-E452 WeakPolarHBondContact CG-OE1 3.3Å
448	R	54	Low	68	Low	37 Å²	37	63.8 Å²	63.8	14%	0.14	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	158.5	170	-56.3	-177.9	-179.2	-159.2	-1	109.3	F41 Y42 S43 I446 S450 G451	F41-R448 PolarHBondContact O-NH2 2.76Å; F41-R448 VanDerWaalsContact O-NH2 3.16Å; Y42-R448 VanDerWaalsContact C-NH2 3.32Å; Y42-R448 PolarHBondContact O-NH2 3.3Å; Y42-R448 VanDerWaalsContact O-NH2 3.12Å; S43-R448 PolarHBondContact O-NH1 2.78Å; I446-R448 HydrophobicContact CB-CG 3.81Å; I446-R448 HydrophobicContact CG2-CB 4.47Å; I446-R448 HydrophobicContact CG2-CG 3.25Å; I446-R448 PolarHBondContact O-N 2.52Å; I446-R448 VanDerWaalsContact O-N 3.14Å; R448-S450 WeakPolarHBondContact CB-OG 3.11Å; R448-S450 PolarHBondContact O-N 3.34Å; R448-S450 VanDerWaalsContact O-N 3.09Å; R448-G451 WeakPolarHBondContact CB-O 3.49Å; R448-G451 PolarHBondContact N-O 3.31Å; R448-G451 PolarHBondContact O-N 3.43Å; R448-G451 VanDerWaalsContact O-N 3.09Å
449	K	48.7	Very low	68	Low	234 Å²	234	63 Å²	63	100%	1.017	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-23	163.3	-70.7	-176.8	179.1	176.9	0	112.5
450	S	52.5	Low	68.2	Low	101 Å²	101	62.7 Å²	62.7	71%	0.706	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	2.6	179.6	67.4	0	0	0	0	115.1	R448	R448-S450 WeakPolarHBondContact CB-OG 3.11Å; R448-S450 PolarHBondContact O-N 3.34Å; R448-S450 VanDerWaalsContact O-N 3.09Å
451	G	61.1	Low	68.8	Low	35 Å²	35	58.5 Å²	58.5	36%	0.361	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	115.7	175.8	179.6	0	0	0	0	0	115.7	R448	R448-G451 WeakPolarHBondContact CB-O 3.49Å; R448-G451 PolarHBondContact N-O 3.31Å; R448-G451 PolarHBondContact O-N 3.43Å; R448-G451 VanDerWaalsContact O-N 3.09Å
452	E	73.9	Confident	70.1	Confident	113 Å²	113	50.5 Å²	50.5	53%	0.528	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	132.8	-173.2	-71.6	-164.8	163.2	0	0	111.1	V444 I446 K447	V444-E452 HydrophobicContact CB-CB 4.26Å; V444-E452 HydrophobicContact CG1-CB 3.3Å; V444-E452 HydrophobicContact CG1-CG 3.5Å; V444-E452 HydrophobicContact CG2-CB 3.98Å; V444-E452 HydrophobicContact CG2-CG 4.45Å; V444-E452 WeakPolarHBondContact CG2-OE2 3.48Å; I446-E452 WeakPolarHBondContact O-CA 3.43Å; K447-E452 WeakPolarHBondContact CE-OE1 3.4Å; K447-E452 HydrophobicContact CG-CG 4.35Å; K447-E452 WeakPolarHBondContact CG-OE1 3.3Å
453	I	79.1	Confident	71.3	Confident	16 Å²	16	49.8 Å²	49.8	8%	0.082	27%	0.266	C	S	.	.			trans	-107.9	118.6	177.6	-52.2	177.2	0	0	0	109.7	W423 I445	W423-I453 HydrophobicContact CZ2-CG2 3.77Å; I445-I453 PolarHBondContact N-O 3.45Å; I445-I453 VanDerWaalsContact N-O 3.12Å
454	P	83	Confident	72.5	Confident	75 Å²	75	50.9 Å²	50.9	49%	0.487	27%	0.273	S	S	.	.			trans	-71.5	149	178.5	29.3	-34.2	0	0	0	111.8	G408 W423	G408-P454 WeakPolarHBondContact CA-O 3.09Å; W423-P454 PolarHBondContact NE1-O 3.48Å
455	C	85	Confident	73.5	Confident	11 Å²	11	49.1 Å²	49.1	7%	0.074	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	164.1	174.7	85.9	0	0	0	0	114.4	W423 I445 V459	W423-C455 HydrophobicContact CZ2-CB 4.24Å; I445-C455 HydrophobicContact CD1-CB 3.29Å; I445-C455 WeakPolarHBondContact CD1-SG 3.49Å; I445-C455 HydrophobicContact CG1-CB 3.42Å; I445-C455 VanDerWaalsContact CG1-CB 3.42Å; I445-C455 WeakPolarHBondContact CG1-SG 3.43Å; C455-V459 HydrophobicContact CB-CB 4.18Å; C455-V459 HydrophobicContact CB-CG1 4.43Å
456	P	87.8	Confident	74.3	Confident	10 Å²	10	51.3 Å²	51.3	7%	0.065	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	148.5	167.2	-20.1	33.9	0	0	0	113.4	I421 A458 V459 E460	I421-P456 HydrophobicContact CD1-CB 4.27Å; I421-P456 HydrophobicContact CG2-CB 4.28Å; I421-P456 HydrophobicContact CG2-CG 3.8Å; P456-A458 PolarHBondContact O-N 3.46Å; P456-A458 VanDerWaalsContact O-N 3.1Å; P456-V459 HydrophobicContact CB-CG2 4.26Å; P456-V459 HydrophobicContact CG-CG2 4.23Å; P456-V459 WeakPolarHBondContact O-CB 3.04Å; P456-V459 PolarHBondContact O-N 3.02Å; P456-E460 PolarHBondContact O-N 3.28Å
457	L	86.4	Confident	75.2	Confident	52 Å²	52	52.5 Å²	52.5	27%	0.272	28%	0.283	S	S	.	.	H	α-helix	trans	-49.3	-39.5	177.5	-172.5	55.6	0	0	0	115	Y436 A442 V459 E460 A461	Y436-L457 HydrophobicContact CD1-CB 4.48Å; Y436-L457 HydrophobicContact CD1-CD2 3.67Å; Y436-L457 HydrophobicContact CD1-CG 3.6Å; Y436-L457 HydrophobicContact CE1-CD2 4.48Å; Y436-L457 HydrophobicContact CE1-CG 4.31Å; Y436-L457 HydrophobicContact CG-CG 4.28Å; A442-L457 HydrophobicContact CB-CB 3.51Å; A442-L457 HydrophobicContact CB-CD1 3.27Å; A442-L457 HydrophobicContact CB-CG 3.91Å; L457-V459 PolarHBondContact O-N 3.28Å; L457-E460 PolarHBondContact O-N 3.01Å; L457-A461 VanDerWaalsContact O-CB 3.29Å; L457-A461 WeakPolarHBondContact O-CB 3.4Å; L457-A461 PolarHBondContact O-N 2.9Å
458	A	89.1	Confident	76.3	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.008	25%	0.25	C	C	.	.	H	α-helix	trans	-59.8	-36.6	177.9	0	0	0	0	0	112.3	I421 T433 Y436 P456 F462	I421-A458 HydrophobicContact CD1-CB 3.72Å; T433-A458 HydrophobicContact CG2-CB 3.91Å; Y436-A458 HydrophobicContact CD2-CB 4.22Å; Y436-A458 HydrophobicContact CG-CB 4.35Å; P456-A458 PolarHBondContact O-N 3.46Å; P456-A458 VanDerWaalsContact O-N 3.1Å; A458-F462 WeakPolarHBondContact O-CB 3.49Å; A458-F462 PolarHBondContact O-N 3.47Å
459	V	86.8	Confident	77.1	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-73.1	-47.1	-178.9	-173.5	0	0	0	0	110.3	F41 W423 F431 I445 C455 P456 L457 F462 A463	F41-V459 HydrophobicContact CD1-CG1 4.31Å; F41-V459 HydrophobicContact CE1-CG1 4.18Å; W423-V459 HydrophobicContact CB-CG2 4.13Å; W423-V459 HydrophobicContact CD2-CG1 4.18Å; W423-V459 HydrophobicContact CE3-CG1 3.91Å; W423-V459 HydrophobicContact CG-CG2 4.33Å; W423-V459 HydrophobicContact CZ3-CG1 4.16Å; F431-V459 HydrophobicContact CD2-CG2 3.96Å; F431-V459 HydrophobicContact CE2-CB 4.39Å; F431-V459 HydrophobicContact CE2-CG1 4.19Å; F431-V459 HydrophobicContact CE2-CG2 3.69Å; F431-V459 HydrophobicContact CZ-CG1 4.28Å; F431-V459 HydrophobicContact CZ-CG2 4.35Å; I445-V459 HydrophobicContact CD1-CB 4.34Å; I445-V459 HydrophobicContact CD1-CG1 3.59Å; C455-V459 HydrophobicContact CB-CB 4.18Å; C455-V459 HydrophobicContact CB-CG1 4.43Å; P456-V459 HydrophobicContact CB-CG2 4.26Å; P456-V459 HydrophobicContact CG-CG2 4.23Å; P456-V459 WeakPolarHBondContact O-CB 3.04Å; P456-V459 PolarHBondContact O-N 3.02Å; L457-V459 PolarHBondContact O-N 3.28Å; V459-F462 PolarHBondContact O-N 2.72Å; V459-A463 VanDerWaalsContact O-CB 3.3Å; V459-A463 WeakPolarHBondContact O-CB 3.42Å; V459-A463 PolarHBondContact O-N 3.42Å
460	E	84.9	Confident	78.3	Confident	59 Å²	59	34.1 Å²	34.1	28%	0.276	21%	0.208	S	C	.	.	H	α-helix	trans	-57.7	-51.4	175.4	-174.4	-178.2	-171.5	0	0	110.9	A442 G443 P456 L457 F462 A463 A464	A442-E460 WeakPolarHBondContact CB-OE2 3.48Å; G443-E460 PolarHBondContact N-OE2 2.91Å; P456-E460 PolarHBondContact O-N 3.28Å; L457-E460 PolarHBondContact O-N 3.01Å; E460-F462 PolarHBondContact O-N 3.24Å; E460-A463 PolarHBondContact O-N 2.83Å; E460-A464 PolarHBondContact O-N 3.29Å
461	A	85.3	Confident	79.3	Confident	8 Å²	8	34.4 Å²	34.4	7%	0.066	20%	0.197	C	C	.	.	H	α-helix	trans	-58.1	-49	178.7	0	0	0	0	0	111.3	F358 Y436 L457 A463 A464 H465	F358-A461 HydrophobicContact CZ-CB 4.37Å; Y436-A461 HydrophobicContact CE1-CB 3.86Å; Y436-A461 HydrophobicContact CE2-CB 3.93Å; L457-A461 VanDerWaalsContact O-CB 3.29Å; L457-A461 WeakPolarHBondContact O-CB 3.4Å; L457-A461 PolarHBondContact O-N 2.9Å; A461-A463 PolarHBondContact O-N 3.42Å; A461-A464 PolarHBondContact O-N 3.4Å; A461-H465 PolarHBondContact O-CD2 3.33Å; A461-H465 VanDerWaalsContact O-CG 3.32Å; A461-H465 PolarHBondContact O-N 3.03Å
462	F	85.9	Confident	80.1	Confident	17 Å²	17	33 Å²	33	8%	0.075	18%	0.181	C	C	.	.	H	α-helix	trans	-61.6	-43.1	179.3	-166.6	-79.6	0	0	0	112.2	F41 F358 T359 L382 F431 A458 V459 E460 H465 L466	F41-F462 HydrophobicContact CE2-CD1 4.21Å; F41-F462 HydrophobicContact CZ-CD1 4.24Å; F358-F462 AromaticContact CD1-CD2 3.68Å; F358-F462 HydrophobicContact CD1-CD2 3.68Å; F358-F462 HydrophobicContact CD1-CE2 4.26Å; F358-F462 HydrophobicContact CD1-CG 4.4Å; F358-F462 HydrophobicContact CE1-CB 4.36Å; F358-F462 HydrophobicContact CE1-CD2 4.26Å; T359-F462 WeakPolarHBondContact O-CE2 3.47Å; L382-F462 HydrophobicContact CB-CE1 4.17Å; L382-F462 HydrophobicContact CB-CE2 4.09Å; L382-F462 HydrophobicContact CB-CZ 3.67Å; F431-F462 HydrophobicContact CD1-CD2 4.25Å; F431-F462 HydrophobicContact CD1-CG 4.3Å; F431-F462 HydrophobicContact CE1-CB 3.88Å; F431-F462 AromaticContact CE1-CD1 3.85Å; F431-F462 HydrophobicContact CE1-CD1 3.85Å; F431-F462 AromaticContact CE1-CD2 3.98Å; F431-F462 HydrophobicContact CE1-CD2 3.98Å; F431-F462 HydrophobicContact CE1-CE1 4.41Å; F431-F462 AromaticContact CE1-CG 3.62Å; F431-F462 HydrophobicContact CE1-CG 3.62Å; A458-F462 WeakPolarHBondContact O-CB 3.49Å; A458-F462 PolarHBondContact O-N 3.47Å; V459-F462 PolarHBondContact O-N 2.72Å; E460-F462 PolarHBondContact O-N 3.24Å; F462-H465 PolarHBondContact O-N 2.96Å; F462-L466 HydrophobicContact CE1-CB 4.46Å; F462-L466 HydrophobicContact CE1-CD2 4.45Å; F462-L466 WeakPolarHBondContact O-CB 3.23Å; F462-L466 PolarHBondContact O-N 2.88Å
463	A	81.7	Confident	80	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-42.2	-179.8	0	0	0	0	0	112.1	F41 Y42 V459 E460 A461 L466 S467	F41-A463 HydrophobicContact CB-CB 4.15Å; F41-A463 HydrophobicContact CD1-CB 4.5Å; F41-A463 HydrophobicContact CD2-CB 3.92Å; F41-A463 HydrophobicContact CG-CB 3.93Å; Y42-A463 HydrophobicContact CE2-CB 4.17Å; V459-A463 VanDerWaalsContact O-CB 3.3Å; V459-A463 WeakPolarHBondContact O-CB 3.42Å; V459-A463 PolarHBondContact O-N 3.42Å; E460-A463 PolarHBondContact O-N 2.83Å; A461-A463 PolarHBondContact O-N 3.42Å; A463-L466 PolarHBondContact O-N 3.5Å; A463-S467 PolarHBondContact O-N 2.91Å; A463-S467 VanDerWaalsContact O-N 3.08Å
464	A	78.4	Confident	79.7	Confident	44 Å²	44	30.5 Å²	30.5	36%	0.364	17%	0.171	S	C	.	.	H	α-helix	trans	-62.1	-45.7	174.9	0	0	0	0	0	111.4	E460 A461 S467 Y468	E460-A464 PolarHBondContact O-N 3.29Å; A461-A464 PolarHBondContact O-N 3.4Å; A464-S467 PolarHBondContact O-N 3.08Å; A464-Y468 PolarHBondContact O-N 2.84Å; A464-Y468 VanDerWaalsContact O-N 3.15Å
465	H	77	Confident	79.5	Confident	13 Å²	13	28.7 Å²	28.7	6%	0.06	16%	0.155	C	C	.	.	H	α-helix	trans	-65.2	-42.3	178	-70.1	-48.7	0	0	0	113	T308 F358 A461 F462 S467 Y468 I469	T308-H465 HydrophobicContact CG2-CB 4.15Å; T308-H465 WeakPolarHBondContact CG2-ND1 3.48Å; F358-H465 AromaticContact CD1-CD2 3.95Å; F358-H465 AromaticContact CD2-CD2 3.67Å; F358-H465 AromaticContact CE1-CD2 3.4Å; F358-H465 VanDerWaalsContact CE1-CD2 3.4Å; F358-H465 WeakPolarHBondContact CE1-CD2 3.42Å; F358-H465 AromaticContact CE2-CD2 3.09Å; F358-H465 WeakPolarHBondContact CE2-CD2 3.19Å; F358-H465 AromaticContact CE2-CG 3.96Å; F358-H465 AromaticContact CE2-NE2 3.13Å; F358-H465 WeakPolarHBondContact CE2-NE2 3.4Å; F358-H465 AromaticContact CZ-CD2 2.93Å; F358-H465 WeakPolarHBondContact CZ-CD2 3.39Å; F358-H465 AromaticContact CZ-NE2 3.21Å; F358-H465 WeakPolarHBondContact CZ-NE2 3.24Å; A461-H465 PolarHBondContact O-CD2 3.33Å; A461-H465 VanDerWaalsContact O-CG 3.32Å; A461-H465 PolarHBondContact O-N 3.03Å; F462-H465 PolarHBondContact O-N 2.96Å; H465-S467 PolarHBondContact O-N 2.96Å; H465-Y468 PolarHBondContact O-N 3.48Å; H465-I469 WeakPolarHBondContact O-CG1 3.33Å; H465-I469 PolarHBondContact O-N 2.84Å; H465-I469 VanDerWaalsContact O-N 3.09Å
466	L	76.4	Confident	79.3	Confident	59 Å²	59	28.2 Å²	28.2	31%	0.309	15%	0.152	S	C	.	.	H	α-helix	trans	-60.2	-46.6	176.8	-177.8	62.8	0	0	0	111.1	F41 F462 A463 Y468 I469 C470	F41-L466 HydrophobicContact CD2-CD2 4.29Å; F41-L466 HydrophobicContact CE2-CD2 3.9Å; F462-L466 HydrophobicContact CE1-CB 4.46Å; F462-L466 HydrophobicContact CE1-CD2 4.45Å; F462-L466 WeakPolarHBondContact O-CB 3.23Å; F462-L466 PolarHBondContact O-N 2.88Å; A463-L466 PolarHBondContact O-N 3.5Å; L466-Y468 VanDerWaalsContact C-N 3.28Å; L466-Y468 PolarHBondContact O-N 3.21Å; L466-I469 PolarHBondContact O-N 2.91Å; L466-C470 PolarHBondContact O-N 3.02Å; L466-C470 PolarHBondContact O-SG 3.42Å
467	S	71.3	Confident	78.8	Confident	41 Å²	41	28.1 Å²	28.1	29%	0.287	15%	0.151	S	C	.	.	H	α-helix	trans	-57.1	-42.7	177.9	-177.7	0	0	0	0	112.1	A463 A464 H465 C470 K471	A463-S467 PolarHBondContact O-N 2.91Å; A463-S467 VanDerWaalsContact O-N 3.08Å; A464-S467 PolarHBondContact O-N 3.08Å; H465-S467 PolarHBondContact O-N 2.96Å; S467-C470 PolarHBondContact O-N 3.26Å; S467-K471 WeakPolarHBondContact O-CG 3.34Å; S467-K471 PolarHBondContact O-N 3.12Å; S467-K471 VanDerWaalsContact O-N 3.12Å
468	Y	73.3	Confident	78.6	Confident	17 Å²	17	28.4 Å²	28.4	7%	0.067	15%	0.15	C	C	.	.	H	α-helix	trans	-62.4	-46.9	177.6	178.1	-94.3	0	0	0	112.7	I24 F29 T308 T310 G311 A464 H465 L466 C470 K471 Y472	I24-Y468 HydrophobicContact CD1-CD2 4.11Å; I24-Y468 HydrophobicContact CG2-CD2 4Å; I24-Y468 HydrophobicContact CG2-CE2 3.54Å; F29-Y468 AromaticContact CE2-CE2 3.66Å; F29-Y468 HydrophobicContact CE2-CE2 3.66Å; F29-Y468 AromaticContact CZ-CE2 3.9Å; F29-Y468 HydrophobicContact CZ-CE2 3.9Å; T308-Y468 HydrophobicContact CG2-CD1 3.92Å; T308-Y468 VanDerWaalsContact O-CD1 3.3Å; T308-Y468 WeakPolarHBondContact O-CD1 3.32Å; T308-Y468 WeakPolarHBondContact O-CE1 3.34Å; T310-Y468 PolarHBondContact O-OH 3.09Å; G311-Y468 WeakPolarHBondContact CA-OH 3.25Å; G311-Y468 PolarHBondContact N-OH 3.27Å; A464-Y468 PolarHBondContact O-N 2.84Å; A464-Y468 VanDerWaalsContact O-N 3.15Å; H465-Y468 PolarHBondContact O-N 3.48Å; L466-Y468 VanDerWaalsContact C-N 3.28Å; L466-Y468 PolarHBondContact O-N 3.21Å; Y468-C470 VanDerWaalsContact C-N 3.32Å; Y468-C470 PolarHBondContact O-N 3.06Å; Y468-K471 PolarHBondContact O-N 3.02Å; Y468-Y472 PolarHBondContact O-N 2.93Å
469	I	72.3	Confident	78.4	Confident	12 Å²	12	29.9 Å²	29.9	6%	0.062	16%	0.156	C	C	.	.	H	α-helix	trans	-64.3	-39.5	-179.6	-63.7	-61.5	0	0	0	111.1	V271 H465 L466 K471 Y472 D473	V271-I469 HydrophobicContact CG1-CD1 3.43Å; V271-I469 VanDerWaalsContact CG1-CD1 3.43Å; V271-I469 HydrophobicContact CG1-CG1 3.84Å; H465-I469 WeakPolarHBondContact O-CG1 3.33Å; H465-I469 PolarHBondContact O-N 2.84Å; H465-I469 VanDerWaalsContact O-N 3.09Å; L466-I469 PolarHBondContact O-N 2.91Å; I469-K471 VanDerWaalsContact C-N 3.34Å; I469-K471 PolarHBondContact O-N 2.86Å; I469-Y472 PolarHBondContact O-N 3.43Å; I469-D473 WeakPolarHBondContact O-CB 3.16Å; I469-D473 PolarHBondContact O-N 3.37Å
470	C	73.8	Confident	78.5	Confident	33 Å²	33	30.8 Å²	30.8	22%	0.223	16%	0.16	C	C	.	.	H	α-helix	trans	-59.8	-44.4	174.4	-60.4	0	0	0	0	112	I284 L466 S467 Y468 D473 D474	I284-C470 HydrophobicContact CD1-CB 3.89Å; I284-C470 HydrophobicContact CG2-CB 4.48Å; L466-C470 PolarHBondContact O-N 3.02Å; L466-C470 PolarHBondContact O-SG 3.42Å; S467-C470 PolarHBondContact O-N 3.26Å; Y468-C470 VanDerWaalsContact C-N 3.32Å; Y468-C470 PolarHBondContact O-N 3.06Å; C470-D473 PolarHBondContact O-N 3.06Å; C470-D474 WeakPolarHBondContact O-CB 3.04Å; C470-D474 PolarHBondContact O-N 3.16Å
471	K	73.4	Confident	78.7	Confident	107 Å²	107	28.9 Å²	28.9	47%	0.465	15%	0.152	S	C	.	.	H	α-helix	trans	-64	-39.8	175.8	-70.8	-179	-179.8	-170.3	0	112.3	S467 Y468 I469 K475	S467-K471 WeakPolarHBondContact O-CG 3.34Å; S467-K471 PolarHBondContact O-N 3.12Å; S467-K471 VanDerWaalsContact O-N 3.12Å; Y468-K471 PolarHBondContact O-N 3.02Å; I469-K471 VanDerWaalsContact C-N 3.34Å; I469-K471 PolarHBondContact O-N 2.86Å; K471-K475 VanDerWaalsContact O-CB 3.31Å; K471-K475 WeakPolarHBondContact O-CB 3.43Å; K471-K475 PolarHBondContact O-N 3.49Å
472	Y	76.5	Confident	78.5	Confident	6 Å²	6	30.8 Å²	30.8	2%	0.024	16%	0.158	C	C	.	.	H	α-helix	trans	-62.2	-51.4	176.1	178.8	-84.8	0	0	0	110.9	Q306 G311 Y468 I469 D474 K475 Y476 I506	Q306-Y472 VanDerWaalsContact NE2-CG 3.29Å; G311-Y472 WeakPolarHBondContact O-CE2 3.41Å; G311-Y472 VanDerWaalsContact O-CZ 3.3Å; G311-Y472 PolarHBondContact O-OH 2.94Å; Y468-Y472 PolarHBondContact O-N 2.93Å; I469-Y472 PolarHBondContact O-N 3.43Å; Y472-D474 PolarHBondContact O-N 2.93Å; Y472-K475 PolarHBondContact O-N 2.8Å; Y472-Y476 HydrophobicContact CD1-CD2 4.16Å; Y472-Y476 AromaticContact CD2-CD2 3.26Å; Y472-Y476 HydrophobicContact CD2-CD2 3.26Å; Y472-Y476 AromaticContact CD2-CE2 3.45Å; Y472-Y476 HydrophobicContact CD2-CE2 3.45Å; Y472-Y476 VanDerWaalsContact CD2-CE2 3.45Å; Y472-Y476 HydrophobicContact CD2-CG 4.34Å; Y472-Y476 HydrophobicContact CE1-CD2 4.12Å; Y472-Y476 HydrophobicContact CE1-CG 4.39Å; Y472-Y476 AromaticContact CE2-CD2 3.19Å; Y472-Y476 HydrophobicContact CE2-CD2 3.19Å; Y472-Y476 AromaticContact CE2-CE2 3.41Å; Y472-Y476 HydrophobicContact CE2-CE2 3.41Å; Y472-Y476 VanDerWaalsContact CE2-CE2 3.41Å; Y472-Y476 AromaticContact CE2-CG 3.92Å; Y472-Y476 HydrophobicContact CE2-CG 3.92Å; Y472-Y476 AromaticContact CG-CD2 3.76Å; Y472-Y476 HydrophobicContact CG-CD2 3.76Å; Y472-Y476 HydrophobicContact CG-CE2 4.32Å; Y472-Y476 AromaticContact CZ-CD2 3.65Å; Y472-Y476 AromaticContact CZ-CG 3.95Å; Y472-Y476 WeakPolarHBondContact O-CB 3.3Å; Y472-Y476 WeakPolarHBondContact O-CD2 3.48Å; Y472-Y476 PolarHBondContact O-N 3.48Å; Y472-I506 HydrophobicContact CE2-CD1 4.07Å
473	D	73.1	Confident	78.1	Confident	8 Å²	8	31.3 Å²	31.3	4%	0.043	16%	0.161	C	C	.	.	H	α-helix	trans	-60.7	-46.5	-178.5	-82.9	-9.8	0	0	0	110.3	H273 L276 I284 I469 C470 K475 Y476 S477	H273-D473 IonicContact CE1-OD1 2.74Å; H273-D473 IonicContact CE1-OD2 3.6Å; H273-D473 IonicContact ND1-OD2 2.75Å; L276-D473 HydrophobicContact CB-CB 4.02Å; L276-D473 HydrophobicContact CD1-CB 3.73Å; L276-D473 HydrophobicContact CG-CB 3.83Å; L276-D473 PolarHBondContact N-OD2 3.19Å; I284-D473 HydrophobicContact CD1-CB 4.24Å; I469-D473 WeakPolarHBondContact O-CB 3.16Å; I469-D473 PolarHBondContact O-N 3.37Å; C470-D473 PolarHBondContact O-N 3.06Å; D473-K475 PolarHBondContact O-N 2.95Å; D473-Y476 PolarHBondContact O-N 3.24Å; D473-S477 WeakPolarHBondContact O-CB 3.48Å; D473-S477 PolarHBondContact O-N 3.42Å; D473-S477 PolarHBondContact O-OG 2.75Å
474	D	73.1	Confident	77.8	Confident	67 Å²	67	37 Å²	37	36%	0.358	19%	0.185	S	C	.	.	H	α-helix	trans	-57.5	-46.3	174.5	176.9	55.2	0	0	0	112.5	F283 C470 Y472 K478	F283-D474 HydrophobicContact CD2-CB 4.39Å; F283-D474 VanDerWaalsContact CD2-OD1 3.3Å; F283-D474 WeakPolarHBondContact CD2-OD1 3.42Å; F283-D474 HydrophobicContact CE2-CB 3.86Å; F283-D474 WeakPolarHBondContact CE2-OD1 3.35Å; F283-D474 HydrophobicContact CZ-CB 4.48Å; C470-D474 WeakPolarHBondContact O-CB 3.04Å; C470-D474 PolarHBondContact O-N 3.16Å; Y472-D474 PolarHBondContact O-N 2.93Å; D474-K478 WeakPolarHBondContact O-CD 3.43Å
475	K	77.3	Confident	77.8	Confident	37 Å²	37	35.4 Å²	35.4	16%	0.161	17%	0.172	C	C	.	.	H	α-helix	trans	-69.2	-39.9	-177.3	-175.4	168.2	-176.2	167.5	0	113.4	V28 F29 K471 Y472 D473 K478 Y479	V28-K475 PolarHBondContact O-NZ 3.28Å; F29-K475 VanDerWaalsContact CA-NZ 3.29Å; F29-K475 HydrophobicContact CD1-CD 3.49Å; F29-K475 VanDerWaalsContact CD1-CD 3.49Å; F29-K475 HydrophobicContact CE1-CD 3.79Å; F29-K475 PolarHBondContact O-NZ 3.44Å; K471-K475 VanDerWaalsContact O-CB 3.31Å; K471-K475 WeakPolarHBondContact O-CB 3.43Å; K471-K475 PolarHBondContact O-N 3.49Å; Y472-K475 PolarHBondContact O-N 2.8Å; D473-K475 PolarHBondContact O-N 2.95Å; K475-K478 WeakPolarHBondContact O-CD 3.37Å; K475-K478 WeakPolarHBondContact O-CE 3.17Å; K475-K478 WeakPolarHBondContact O-CG 3.18Å; K475-Y479 WeakPolarHBondContact O-CD2 3.45Å; K475-Y479 WeakPolarHBondContact O-CE2 3.32Å
476	Y	81.1	Confident	77.8	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.008	21%	0.21	C	C	.	.	H	α-helix	trans	-105.5	-26.9	-166.2	-72.4	-72.9	0	0	0	114.3	F29 Y472 D473 K478 Y479 N502 Y505 R521	F29-Y476 AromaticContact CE1-CE2 3.92Å; F29-Y476 HydrophobicContact CE1-CE2 3.92Å; F29-Y476 HydrophobicContact CZ-CE2 4.33Å; Y472-Y476 HydrophobicContact CD1-CD2 4.16Å; Y472-Y476 AromaticContact CD2-CD2 3.26Å; Y472-Y476 HydrophobicContact CD2-CD2 3.26Å; Y472-Y476 AromaticContact CD2-CE2 3.45Å; Y472-Y476 HydrophobicContact CD2-CE2 3.45Å; Y472-Y476 VanDerWaalsContact CD2-CE2 3.45Å; Y472-Y476 HydrophobicContact CD2-CG 4.34Å; Y472-Y476 HydrophobicContact CE1-CD2 4.12Å; Y472-Y476 HydrophobicContact CE1-CG 4.39Å; Y472-Y476 AromaticContact CE2-CD2 3.19Å; Y472-Y476 HydrophobicContact CE2-CD2 3.19Å; Y472-Y476 AromaticContact CE2-CE2 3.41Å; Y472-Y476 HydrophobicContact CE2-CE2 3.41Å; Y472-Y476 VanDerWaalsContact CE2-CE2 3.41Å; Y472-Y476 AromaticContact CE2-CG 3.92Å; Y472-Y476 HydrophobicContact CE2-CG 3.92Å; Y472-Y476 AromaticContact CG-CD2 3.76Å; Y472-Y476 HydrophobicContact CG-CD2 3.76Å; Y472-Y476 HydrophobicContact CG-CE2 4.32Å; Y472-Y476 AromaticContact CZ-CD2 3.65Å; Y472-Y476 AromaticContact CZ-CG 3.95Å; Y472-Y476 WeakPolarHBondContact O-CB 3.3Å; Y472-Y476 WeakPolarHBondContact O-CD2 3.48Å; Y472-Y476 PolarHBondContact O-N 3.48Å; D473-Y476 PolarHBondContact O-N 3.24Å; Y476-K478 VanDerWaalsContact C-N 3.25Å; Y476-K478 PolarHBondContact O-N 3.38Å; Y476-Y479 PolarHBondContact O-N 3.24Å; Y476-N502 HydrophobicContact CD1-CB 4.31Å; Y476-N502 PolarHBondContact O-ND2 3.45Å; Y476-Y505 AromaticContact CE1-CD1 3.68Å; Y476-Y505 HydrophobicContact CE1-CD1 3.68Å; Y476-Y505 HydrophobicContact CE1-CE1 4Å; Y476-R521 HydrophobicContact CD1-CG 4.09Å; Y476-R521 HydrophobicContact CE1-CB 4.43Å; Y476-R521 HydrophobicContact CE1-CG 4Å
477	S	78.5	Confident	78.2	Confident	7 Å²	7	43.4 Å²	43.4	5%	0.049	21%	0.212	C	C	.	.	H	α-helix	trans	-63.8	-33.4	176.5	66.2	0	0	0	0	111.9	L276 D473 Y479 F480	L276-S477 WeakPolarHBondContact O-CB 3.39Å; D473-S477 WeakPolarHBondContact O-CB 3.48Å; D473-S477 PolarHBondContact O-N 3.42Å; D473-S477 PolarHBondContact O-OG 2.75Å; S477-Y479 PolarHBondContact O-N 3.3Å; S477-F480 WeakPolarHBondContact O-CB 3.31Å; S477-F480 WeakPolarHBondContact O-CG 3.37Å; S477-F480 PolarHBondContact O-N 2.91Å
478	K	81.3	Confident	78.9	Confident	58 Å²	58	43.1 Å²	43.1	25%	0.252	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-9.2	176.7	80.2	-167.6	-176	-173.4	0	115.3	R197 D474 K475 Y476	R197-K478 PolarHBondContact NE-O 3.04Å; R197-K478 VanDerWaalsContact NH2-CD 3.33Å; R197-K478 VanDerWaalsContact NH2-CG 3.3Å; D474-K478 WeakPolarHBondContact O-CD 3.43Å; K475-K478 WeakPolarHBondContact O-CD 3.37Å; K475-K478 WeakPolarHBondContact O-CE 3.17Å; K475-K478 WeakPolarHBondContact O-CG 3.18Å; Y476-K478 VanDerWaalsContact C-N 3.25Å; Y476-K478 PolarHBondContact O-N 3.38Å
479	Y	86	Confident	79.6	Confident	32 Å²	32	43.1 Å²	43.1	13%	0.125	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	19.6	175.4	-59.4	-72.9	0	0	0	111.8	S194 K475 Y476 S477 R521 A522	S194-Y479 VanDerWaalsContact CB-O 3.29Å; S194-Y479 WeakPolarHBondContact CB-O 3.32Å; K475-Y479 WeakPolarHBondContact O-CD2 3.45Å; K475-Y479 WeakPolarHBondContact O-CE2 3.32Å; Y476-Y479 PolarHBondContact O-N 3.24Å; S477-Y479 PolarHBondContact O-N 3.3Å; Y479-R521 HydrophobicContact CD2-CB 4.36Å; Y479-R521 HydrophobicContact CD2-CG 3.49Å; Y479-R521 VanDerWaalsContact CD2-CG 3.49Å; Y479-R521 HydrophobicContact CE2-CB 3.9Å; Y479-R521 HydrophobicContact CE2-CG 3.54Å; Y479-R521 HydrophobicContact CG-CG 4.02Å; Y479-A522 HydrophobicContact CE1-CB 3.91Å
480	F	88.1	Confident	80.4	Confident	20 Å²	20	43.3 Å²	43.3	9%	0.088	21%	0.209	C	C	.	.	S	Bend	trans	-72.3	150.6	166.3	-73.5	2.1	0	0	0	110.2	L276 I277 S477 F482 L495 S498 I499 N502	L276-F480 WeakPolarHBondContact O-CE2 3.38Å; I277-F480 HydrophobicContact CB-CD2 4.09Å; I277-F480 HydrophobicContact CB-CE2 3.97Å; I277-F480 HydrophobicContact CG1-CD2 4.21Å; I277-F480 HydrophobicContact CG1-CE2 3.63Å; I277-F480 HydrophobicContact CG2-CD2 3.84Å; I277-F480 HydrophobicContact CG2-CE2 4.15Å; S477-F480 WeakPolarHBondContact O-CB 3.31Å; S477-F480 WeakPolarHBondContact O-CG 3.37Å; S477-F480 PolarHBondContact O-N 2.91Å; F480-F482 WeakPolarHBondContact O-CD2 3.43Å; F480-F482 WeakPolarHBondContact O-CE2 3.41Å; F480-F482 PolarHBondContact O-N 3.17Å; F480-L495 HydrophobicContact CD2-CD1 3.74Å; F480-L495 HydrophobicContact CE2-CD1 3.5Å; F480-L495 VanDerWaalsContact CE2-CD1 3.5Å; F480-L495 HydrophobicContact CG-CD1 4.49Å; F480-L495 HydrophobicContact CZ-CD1 4.05Å; F480-S498 VanDerWaalsContact CD1-CB 3.48Å; F480-I499 HydrophobicContact CZ-CG1 4.5Å; F480-N502 WeakPolarHBondContact CE1-ND2 3.11Å
481	I	88.9	Confident	81.2	Confident	19 Å²	19	44.3 Å²	44.3	10%	0.097	21%	0.21	C	C	.	.			trans	-60.9	119.3	178.1	-70.2	172.5	0	0	0	109	V190 I191 H483 W494 I497 S498	V190-I481 HydrophobicContact CG1-CD1 4.5Å; V190-I481 HydrophobicContact CG1-CG2 3.65Å; I191-I481 HydrophobicContact CG1-CD1 4.01Å; I481-H483 VanDerWaalsContact C-N 3.33Å; I481-H483 HydrophobicContact CG2-CB 3.83Å; I481-W494 HydrophobicContact CB-CB 4.35Å; I481-W494 HydrophobicContact CD1-CB 4.31Å; I481-W494 HydrophobicContact CD1-CE3 3.79Å; I481-W494 HydrophobicContact CG2-CB 4.15Å; I481-W494 HydrophobicContact CG2-CG 4.4Å; I481-I497 HydrophobicContact CD1-CB 4.15Å; I481-I497 HydrophobicContact CD1-CG2 3.69Å; I481-S498 WeakPolarHBondContact CG1-OG 3.23Å; I481-S498 PolarHBondContact N-OG 2.84Å
482	F	80.8	Confident	82	Confident	48 Å²	48	39.2 Å²	39.2	21%	0.211	19%	0.188	C	C	.	.			trans	-79.5	-15.6	-177.6	-80.8	-96.1	0	0	0	113.2	T193 R197 C198 F480 K484	T193-F482 WeakPolarHBondContact O-CD2 3.16Å; T193-F482 PolarHBondContact OG1-N 2.95Å; R197-F482 HydrophobicContact CB-CD2 4.49Å; R197-F482 HydrophobicContact CB-CE2 4.21Å; R197-F482 HydrophobicContact CB-CZ 4.32Å; R197-F482 HydrophobicContact CG-CD2 4.37Å; R197-F482 HydrophobicContact CG-CE2 3.73Å; R197-F482 HydrophobicContact CG-CZ 3.97Å; C198-F482 WeakPolarHBondContact O-CB 3.48Å; F480-F482 WeakPolarHBondContact O-CD2 3.43Å; F480-F482 WeakPolarHBondContact O-CE2 3.41Å; F480-F482 PolarHBondContact O-N 3.17Å; F482-K484 PolarHBondContact O-N 3.43Å; F482-K484 VanDerWaalsContact O-N 3.14Å
483	H	78.8	Confident	82.8	Confident	28 Å²	28	39 Å²	39	13%	0.13	19%	0.187	C	C	.	.			trans	-55.7	120.4	174.4	176.5	65.4	0	0	0	110.7	V190 T193 V201 I481 P485 W494	V190-H483 HydrophobicContact CG1-CB 4.01Å; T193-H483 PolarHBondContact OG1-N 3.12Å; V201-H483 HydrophobicContact CG2-CB 3.96Å; I481-H483 VanDerWaalsContact C-N 3.33Å; I481-H483 HydrophobicContact CG2-CB 3.83Å; H483-P485 WeakPolarHBondContact O-CD 3.47Å; H483-W494 AromaticContact CD2-CD1 4Å; H483-W494 AromaticContact CD2-NE1 3.69Å
484	K	75.5	Confident	83.8	Confident	118 Å²	118	38.9 Å²	38.9	51%	0.513	19%	0.186	S	C	.	.			trans	-96	92.8	-178.8	-67.6	173.5	-178.9	166.3	0	110.8	E199 F482	E199-K484 IonicContact OE1-NZ 3.44Å; E199-K484 PolarHBondContact OE1-NZ 3.42Å; F482-K484 PolarHBondContact O-N 3.43Å; F482-K484 VanDerWaalsContact O-N 3.14Å
485	P	77.2	Confident	84.7	Confident	12 Å²	12	36.2 Å²	36.2	8%	0.078	17%	0.172	C	C	.	.			trans	-77.2	151.3	176.8	35.8	-40.9	0	0	0	111.5	H483 Q490 Q491	H483-P485 WeakPolarHBondContact O-CD 3.47Å; P485-Q490 HydrophobicContact CB-CB 3.5Å; P485-Q490 VanDerWaalsContact CB-CB 3.5Å; P485-Q490 HydrophobicContact CB-CG 4.46Å; P485-Q490 HydrophobicContact CG-CB 3.69Å; P485-Q491 HydrophobicContact CG-CB 4.23Å; P485-Q491 HydrophobicContact CG-CG 3.55Å; P485-Q491 PolarHBondContact O-NE2 3.25Å
486	N	76.5	Confident	85.5	Confident	162 Å²	162	34.5 Å²	34.5	87%	0.866	17%	0.165	S	C	*	.	S	Bend	trans	-78.3	-22	-178.8	-69	-38.1	0	0	0	113.7
487	K	85	Confident	86.3	Confident	78 Å²	78	34.4 Å²	34.4	34%	0.339	16%	0.164	S	C	.	.	S	Bend	trans	-98.2	130.9	-175.9	-57.7	176.9	-174.3	166.2	0	110.3	W489 Q490 Q491	K487-W489 VanDerWaalsContact C-N 3.28Å; K487-W489 HydrophobicContact CD-CZ2 4.47Å; K487-W489 PolarHBondContact O-N 2.76Å; K487-Q490 HydrophobicContact CB-CB 4.42Å; K487-Q490 HydrophobicContact CB-CG 4.17Å; K487-Q490 WeakPolarHBondContact O-CB 3.38Å; K487-Q490 PolarHBondContact O-N 2.91Å; K487-Q491 PolarHBondContact O-N 3.47Å; K487-Q491 VanDerWaalsContact O-N 3.13Å
488	T	86.4	Confident	87	Confident	35 Å²	35	34.2 Å²	34.2	22%	0.215	16%	0.163	C	C	.	.	H	α-helix	trans	-52.4	-43.3	-179.7	-49.8	0	0	0	0	113	K299 F300 L320 Q490 Q491 V492	K299-T488 HydrophobicContact CB-CG2 4.17Å; F300-T488 HydrophobicContact CB-CG2 4.38Å; F300-T488 HydrophobicContact CD1-CG2 3.8Å; F300-T488 HydrophobicContact CG-CG2 4.45Å; L320-T488 HydrophobicContact CD2-CG2 3.82Å; T488-Q490 VanDerWaalsContact C-N 3.27Å; T488-Q490 PolarHBondContact O-N 2.96Å; T488-Q491 WeakPolarHBondContact O-CB 3.3Å; T488-Q491 PolarHBondContact O-N 3.29Å; T488-Q491 VanDerWaalsContact O-N 3.15Å; T488-V492 WeakPolarHBondContact O-CG2 3.18Å; T488-V492 PolarHBondContact O-N 2.95Å
489	W	88.4	Confident	87.7	Confident	16 Å²	16	31.4 Å²	31.4	6%	0.061	15%	0.151	C	C	.	.	H	α-helix	trans	-63.6	-33.1	179.6	74.2	-98.3	0	0	0	112.7	F231 I233 K248 I249 K487 F493	F231-W489 AromaticContact CD1-CH2 3.82Å; F231-W489 HydrophobicContact CD1-CH2 3.82Å; F231-W489 HydrophobicContact CD1-CZ3 4.2Å; F231-W489 HydrophobicContact CE1-CH2 4.04Å; F231-W489 AromaticContact CE1-CZ3 3.94Å; F231-W489 HydrophobicContact CE1-CZ3 3.94Å; F231-W489 VanDerWaalsContact O-CH2 3.31Å; F231-W489 WeakPolarHBondContact O-CH2 3.44Å; I233-W489 HydrophobicContact CG1-CZ3 4.12Å; K248-W489 HydrophobicContact CB-CB 4.09Å; K248-W489 HydrophobicContact CB-CD2 4.21Å; K248-W489 HydrophobicContact CB-CG 3.93Å; K248-W489 HydrophobicContact CD-CD2 4.45Å; K248-W489 HydrophobicContact CD-CG 4.03Å; I249-W489 HydrophobicContact CG2-CB 3.99Å; I249-W489 HydrophobicContact CG2-CD2 4.13Å; I249-W489 HydrophobicContact CG2-CE3 3.36Å; I249-W489 HydrophobicContact CG2-CG 4.44Å; I249-W489 HydrophobicContact CG2-CZ3 4.16Å; K487-W489 VanDerWaalsContact C-N 3.28Å; K487-W489 HydrophobicContact CD-CZ2 4.47Å; K487-W489 PolarHBondContact O-N 2.76Å; W489-F493 WeakPolarHBondContact O-CB 3.3Å; W489-F493 PolarHBondContact O-N 3.47Å
490	Q	89.5	Confident	88.2	Confident	16 Å²	16	29.9 Å²	29.9	8%	0.075	15%	0.145	C	C	.	.	H	α-helix	trans	-71.6	-37.8	175.7	-69.3	175.5	-39.4	0	0	110.7	P485 K487 T488 V492 F493 W494	P485-Q490 HydrophobicContact CB-CB 3.5Å; P485-Q490 VanDerWaalsContact CB-CB 3.5Å; P485-Q490 HydrophobicContact CB-CG 4.46Å; P485-Q490 HydrophobicContact CG-CB 3.69Å; K487-Q490 HydrophobicContact CB-CB 4.42Å; K487-Q490 HydrophobicContact CB-CG 4.17Å; K487-Q490 WeakPolarHBondContact O-CB 3.38Å; K487-Q490 PolarHBondContact O-N 2.91Å; T488-Q490 VanDerWaalsContact C-N 3.27Å; T488-Q490 PolarHBondContact O-N 2.96Å; Q490-V492 VanDerWaalsContact C-N 3.33Å; Q490-V492 PolarHBondContact O-N 3.16Å; Q490-F493 PolarHBondContact O-N 3.46Å; Q490-W494 PolarHBondContact O-N 2.97Å
491	Q	89	Confident	88.7	Confident	54 Å²	54	29 Å²	29	25%	0.252	14%	0.141	S	C	.	.	H	α-helix	trans	-58.9	-47.4	174.5	-62.5	177.2	-5.8	0	0	110.5	F300 P485 K487 T488 F493 L495	F300-Q491 HydrophobicContact CE1-CB 3.79Å; F300-Q491 HydrophobicContact CZ-CB 4.26Å; P485-Q491 HydrophobicContact CG-CB 4.23Å; P485-Q491 HydrophobicContact CG-CG 3.55Å; P485-Q491 PolarHBondContact O-NE2 3.25Å; K487-Q491 PolarHBondContact O-N 3.47Å; K487-Q491 VanDerWaalsContact O-N 3.13Å; T488-Q491 WeakPolarHBondContact O-CB 3.3Å; T488-Q491 PolarHBondContact O-N 3.29Å; T488-Q491 VanDerWaalsContact O-N 3.15Å; Q491-F493 PolarHBondContact O-N 3.46Å; Q491-L495 VanDerWaalsContact O-CB 3.3Å; Q491-L495 WeakPolarHBondContact O-CB 3.35Å; Q491-L495 PolarHBondContact O-N 2.8Å; Q491-L495 VanDerWaalsContact O-N 3.08Å
492	V	90.9	Very high	89	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.006	14%	0.136	C	C	.	.	H	α-helix	trans	-64.2	-40.6	177.1	179	0	0	0	0	111.3	L246 I249 L253 F300 V318 T488 Q490 S496	L246-V492 HydrophobicContact CD2-CG2 4.38Å; I249-V492 HydrophobicContact CD1-CB 3.56Å; I249-V492 HydrophobicContact CD1-CG1 3.32Å; L253-V492 HydrophobicContact CD2-CG1 4.37Å; F300-V492 HydrophobicContact CD1-CG2 4.02Å; F300-V492 HydrophobicContact CD2-CG2 3.86Å; F300-V492 HydrophobicContact CE1-CG2 4.03Å; F300-V492 HydrophobicContact CE2-CG2 3.87Å; F300-V492 HydrophobicContact CG-CG2 3.93Å; F300-V492 HydrophobicContact CZ-CG2 3.95Å; V318-V492 HydrophobicContact CB-CG1 4.43Å; V318-V492 HydrophobicContact CG1-CG1 3.98Å; V318-V492 HydrophobicContact CG1-CG2 3.88Å; V318-V492 HydrophobicContact CG2-CG1 3.8Å; T488-V492 WeakPolarHBondContact O-CG2 3.18Å; T488-V492 PolarHBondContact O-N 2.95Å; Q490-V492 VanDerWaalsContact C-N 3.33Å; Q490-V492 PolarHBondContact O-N 3.16Å; V492-S496 WeakPolarHBondContact O-CB 3.19Å; V492-S496 PolarHBondContact O-N 2.79Å; V492-S496 PolarHBondContact O-OG 3.1Å
493	F	94.1	Very high	89.8	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.1	-52.8	177.4	174.7	-105	0	0	0	112.3	M154 L187 F231 I233 I249 F252 W489 Q490 Q491 L495 S496 I497	M154-F493 HydrophobicContact CE-CE2 3.78Å; M154-F493 HydrophobicContact CE-CZ 3.72Å; M154-F493 HydrophobicContact SD-CZ 4.12Å; L187-F493 HydrophobicContact CD2-CE1 4.36Å; L187-F493 HydrophobicContact CD2-CZ 4.29Å; F231-F493 AromaticContact CE1-CD1 3.86Å; F231-F493 HydrophobicContact CE1-CD1 3.86Å; F231-F493 AromaticContact CE1-CE1 3.75Å; F231-F493 HydrophobicContact CE1-CE1 3.75Å; F231-F493 HydrophobicContact CE1-CZ 4.43Å; F231-F493 HydrophobicContact CZ-CD1 4.03Å; F231-F493 AromaticContact CZ-CE1 3.45Å; F231-F493 HydrophobicContact CZ-CE1 3.45Å; F231-F493 VanDerWaalsContact CZ-CE1 3.45Å; F231-F493 AromaticContact CZ-CZ 3.77Å; F231-F493 HydrophobicContact CZ-CZ 3.77Å; I233-F493 HydrophobicContact CD1-CD2 4.02Å; I233-F493 HydrophobicContact CD1-CE2 3.64Å; I233-F493 HydrophobicContact CD1-CZ 4.02Å; I233-F493 HydrophobicContact CG1-CD2 4.02Å; I233-F493 HydrophobicContact CG1-CE2 4.17Å; I249-F493 HydrophobicContact CG2-CB 4.3Å; F252-F493 AromaticContact CD1-CD2 3.65Å; F252-F493 HydrophobicContact CD1-CD2 3.65Å; F252-F493 AromaticContact CD1-CE2 3.85Å; F252-F493 HydrophobicContact CD1-CE2 3.85Å; F252-F493 AromaticContact CD2-CE2 4Å; F252-F493 HydrophobicContact CD2-CE2 4Å; F252-F493 AromaticContact CE1-CD2 3.72Å; F252-F493 HydrophobicContact CE1-CD2 3.72Å; F252-F493 AromaticContact CE1-CE2 3.75Å; F252-F493 HydrophobicContact CE1-CE2 3.75Å; F252-F493 AromaticContact CE2-CE2 3.91Å; F252-F493 HydrophobicContact CE2-CE2 3.91Å; F252-F493 HydrophobicContact CG-CD2 4.1Å; F252-F493 AromaticContact CG-CE2 3.97Å; F252-F493 HydrophobicContact CG-CE2 3.97Å; F252-F493 HydrophobicContact CZ-CD2 4.25Å; F252-F493 AromaticContact CZ-CE2 3.79Å; F252-F493 HydrophobicContact CZ-CE2 3.79Å; W489-F493 WeakPolarHBondContact O-CB 3.3Å; W489-F493 PolarHBondContact O-N 3.47Å; Q490-F493 PolarHBondContact O-N 3.46Å; Q491-F493 PolarHBondContact O-N 3.46Å; F493-L495 VanDerWaalsContact C-N 3.32Å; F493-L495 PolarHBondContact O-N 3.33Å; F493-S496 WeakPolarHBondContact O-CB 3.19Å; F493-S496 PolarHBondContact O-N 3.4Å; F493-S496 VanDerWaalsContact O-N 3.1Å; F493-I497 HydrophobicContact CD1-CG1 4.49Å; F493-I497 HydrophobicContact CE1-CG1 4.03Å; F493-I497 HydrophobicContact CE2-CD1 4.17Å; F493-I497 HydrophobicContact CE2-CG1 4.06Å; F493-I497 HydrophobicContact CZ-CD1 3.95Å; F493-I497 HydrophobicContact CZ-CG1 3.78Å; F493-I497 WeakPolarHBondContact O-CG1 3.22Å; F493-I497 PolarHBondContact O-N 3.43Å
494	W	93.2	Very high	90.7	Very high	6 Å²	6	24.5 Å²	24.5	2%	0.023	12%	0.12	C	C	.	.	H	α-helix	trans	-67.3	-33.1	-178.5	-63.8	129.1	0	0	0	113.2	F186 L187 V190 F231 I481 H483 Q490 I497 S498	F186-W494 AromaticContact CE1-CH2 3.81Å; F186-W494 HydrophobicContact CE1-CH2 3.81Å; F186-W494 HydrophobicContact CE1-CZ2 4.03Å; F186-W494 HydrophobicContact CZ-CH2 4.35Å; F186-W494 HydrophobicContact CZ-CZ2 4.2Å; L187-W494 HydrophobicContact CD2-CH2 3.91Å; L187-W494 HydrophobicContact CD2-CZ3 3.73Å; V190-W494 HydrophobicContact CB-CE3 4.41Å; V190-W494 HydrophobicContact CB-CH2 3.72Å; V190-W494 HydrophobicContact CB-CZ2 4.18Å; V190-W494 HydrophobicContact CB-CZ3 3.84Å; V190-W494 HydrophobicContact CG1-CD2 3.81Å; V190-W494 HydrophobicContact CG1-CE3 3.69Å; V190-W494 HydrophobicContact CG1-CH2 3.7Å; V190-W494 HydrophobicContact CG1-CZ2 3.82Å; V190-W494 HydrophobicContact CG1-CZ3 3.62Å; V190-W494 HydrophobicContact CG2-CH2 3.69Å; V190-W494 HydrophobicContact CG2-CZ2 3.88Å; V190-W494 HydrophobicContact CG2-CZ3 4.33Å; F231-W494 HydrophobicContact CE1-CZ2 4.29Å; I481-W494 HydrophobicContact CB-CB 4.35Å; I481-W494 HydrophobicContact CD1-CB 4.31Å; I481-W494 HydrophobicContact CD1-CE3 3.79Å; I481-W494 HydrophobicContact CG2-CB 4.15Å; I481-W494 HydrophobicContact CG2-CG 4.4Å; H483-W494 AromaticContact CD2-CD1 4Å; H483-W494 AromaticContact CD2-NE1 3.69Å; Q490-W494 PolarHBondContact O-N 2.97Å; W494-I497 HydrophobicContact CE3-CG1 4.36Å; W494-I497 PolarHBondContact O-N 3.31Å; W494-S498 PolarHBondContact O-N 2.84Å; W494-S498 PolarHBondContact O-OG 2.82Å
495	L	91.5	Very high	91.7	Very high	12 Å²	12	19.1 Å²	19.1	6%	0.063	10%	0.097	C	C	.	.	H	α-helix	trans	-63.2	-43.5	170.7	175.2	55.2	0	0	0	111.6	I277 F300 L302 F480 Q491 F493 I497 S498 I499	I277-L495 HydrophobicContact CB-CD1 4.46Å; I277-L495 HydrophobicContact CD1-CD1 4.14Å; I277-L495 HydrophobicContact CD1-CD2 3.43Å; I277-L495 VanDerWaalsContact CD1-CD2 3.43Å; I277-L495 HydrophobicContact CD1-CG 4.41Å; I277-L495 HydrophobicContact CG1-CD1 3.71Å; I277-L495 HydrophobicContact CG1-CD2 3.98Å; I277-L495 HydrophobicContact CG1-CG 4.5Å; I277-L495 HydrophobicContact CG2-CD1 3.96Å; I277-L495 HydrophobicContact CG2-CD2 4.37Å; F300-L495 HydrophobicContact CE2-CD2 3.95Å; F300-L495 HydrophobicContact CZ-CD2 4.17Å; L302-L495 HydrophobicContact CB-CD2 4.36Å; L302-L495 HydrophobicContact CD2-CD1 4.39Å; L302-L495 HydrophobicContact CD2-CD2 3.55Å; L302-L495 HydrophobicContact CD2-CG 3.95Å; F480-L495 HydrophobicContact CD2-CD1 3.74Å; F480-L495 HydrophobicContact CE2-CD1 3.5Å; F480-L495 VanDerWaalsContact CE2-CD1 3.5Å; F480-L495 HydrophobicContact CG-CD1 4.49Å; F480-L495 HydrophobicContact CZ-CD1 4.05Å; Q491-L495 VanDerWaalsContact O-CB 3.3Å; Q491-L495 WeakPolarHBondContact O-CB 3.35Å; Q491-L495 PolarHBondContact O-N 2.8Å; Q491-L495 VanDerWaalsContact O-N 3.08Å; F493-L495 VanDerWaalsContact C-N 3.32Å; F493-L495 PolarHBondContact O-N 3.33Å; L495-I497 VanDerWaalsContact C-N 3.34Å; L495-I497 PolarHBondContact O-N 3.23Å; L495-S498 WeakPolarHBondContact O-CB 3.49Å; L495-S498 PolarHBondContact O-N 2.85Å; L495-S498 VanDerWaalsContact O-N 3.12Å; L495-I499 HydrophobicContact CD1-CD1 4.45Å; L495-I499 HydrophobicContact CG-CD1 4.47Å; L495-I499 WeakPolarHBondContact O-CG1 3.5Å; L495-I499 PolarHBondContact O-N 2.83Å
496	S	95	Very high	92.6	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.007	9%	0.094	C	C	.	.	H	α-helix	trans	-64.5	-38.2	177.5	-57.3	0	0	0	0	111.9	L253 V492 F493 I499 A500	L253-S496 WeakPolarHBondContact CD2-OG 3.49Å; V492-S496 WeakPolarHBondContact O-CB 3.19Å; V492-S496 PolarHBondContact O-N 2.79Å; V492-S496 PolarHBondContact O-OG 3.1Å; F493-S496 WeakPolarHBondContact O-CB 3.19Å; F493-S496 PolarHBondContact O-N 3.4Å; F493-S496 VanDerWaalsContact O-N 3.1Å; S496-I499 PolarHBondContact O-N 2.81Å; S496-A500 PolarHBondContact O-N 3.28Å
497	I	96.9	Very high	93.5	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-62.2	-42.2	170.9	-67.6	-72	0	0	0	111.1	F142 V146 I191 F252 I481 F493 W494 L495 I499 A500 I501	F142-I497 HydrophobicContact CE2-CG2 4.39Å; F142-I497 HydrophobicContact CZ-CD1 4.46Å; V146-I497 HydrophobicContact CG2-CD1 3.73Å; I191-I497 HydrophobicContact CD1-CG2 4.14Å; I191-I497 HydrophobicContact CG1-CG2 4.15Å; F252-I497 HydrophobicContact CE1-CD1 4.44Å; F252-I497 HydrophobicContact CE2-CD1 4.15Å; F252-I497 HydrophobicContact CZ-CD1 3.56Å; F252-I497 HydrophobicContact CZ-CG1 4.14Å; I481-I497 HydrophobicContact CD1-CB 4.15Å; I481-I497 HydrophobicContact CD1-CG2 3.69Å; F493-I497 HydrophobicContact CD1-CG1 4.49Å; F493-I497 HydrophobicContact CE1-CG1 4.03Å; F493-I497 HydrophobicContact CE2-CD1 4.17Å; F493-I497 HydrophobicContact CE2-CG1 4.06Å; F493-I497 HydrophobicContact CZ-CD1 3.95Å; F493-I497 HydrophobicContact CZ-CG1 3.78Å; F493-I497 WeakPolarHBondContact O-CG1 3.22Å; F493-I497 PolarHBondContact O-N 3.43Å; W494-I497 HydrophobicContact CE3-CG1 4.36Å; W494-I497 PolarHBondContact O-N 3.31Å; L495-I497 VanDerWaalsContact C-N 3.34Å; L495-I497 PolarHBondContact O-N 3.23Å; I497-I499 VanDerWaalsContact C-N 3.31Å; I497-I499 PolarHBondContact O-N 3.42Å; I497-A500 WeakPolarHBondContact O-CB 3.2Å; I497-A500 PolarHBondContact O-N 2.65Å; I497-A500 VanDerWaalsContact O-N 3.15Å; I497-I501 HydrophobicContact CG2-CD1 3.87Å; I497-I501 HydrophobicContact CG2-CG1 4.39Å; I497-I501 VanDerWaalsContact O-CG1 3.31Å; I497-I501 WeakPolarHBondContact O-CG1 3.37Å; I497-I501 PolarHBondContact O-N 3.41Å
498	S	94.8	Very high	94.1	Very high	2 Å²	2	7.9 Å²	7.9	1%	0.014	4%	0.039	C	C	.	.	H	α-helix	trans	-61.2	-41.3	178.4	-56.1	0	0	0	0	111.8	F480 I481 W494 L495 I501 N502	F480-S498 VanDerWaalsContact CD1-CB 3.48Å; I481-S498 WeakPolarHBondContact CG1-OG 3.23Å; I481-S498 PolarHBondContact N-OG 2.84Å; W494-S498 PolarHBondContact O-N 2.84Å; W494-S498 PolarHBondContact O-OG 2.82Å; L495-S498 WeakPolarHBondContact O-CB 3.49Å; L495-S498 PolarHBondContact O-N 2.85Å; L495-S498 VanDerWaalsContact O-N 3.12Å; S498-I501 PolarHBondContact O-N 2.87Å; S498-N502 PolarHBondContact O-N 2.88Å; S498-N502 VanDerWaalsContact O-N 3.11Å
499	I	95.1	Very high	94.5	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-63.1	-45.1	173.2	-67.9	169	0	0	0	110.9	F260 L302 I313 I316 F480 L495 S496 I497 I501 N502 N503	F260-I499 HydrophobicContact CE1-CG2 4.5Å; F260-I499 HydrophobicContact CE2-CG2 4.47Å; F260-I499 HydrophobicContact CZ-CG2 3.76Å; L302-I499 HydrophobicContact CD2-CD1 3.73Å; I313-I499 HydrophobicContact CB-CG2 3.99Å; I313-I499 HydrophobicContact CD1-CD1 4.38Å; I313-I499 HydrophobicContact CD1-CG1 4.11Å; I313-I499 HydrophobicContact CD1-CG2 3.85Å; I313-I499 HydrophobicContact CG2-CG2 3.97Å; I316-I499 HydrophobicContact CG2-CD1 4.21Å; F480-I499 HydrophobicContact CZ-CG1 4.5Å; L495-I499 HydrophobicContact CD1-CD1 4.45Å; L495-I499 HydrophobicContact CG-CD1 4.47Å; L495-I499 WeakPolarHBondContact O-CG1 3.5Å; L495-I499 PolarHBondContact O-N 2.83Å; S496-I499 PolarHBondContact O-N 2.81Å; I497-I499 VanDerWaalsContact C-N 3.31Å; I497-I499 PolarHBondContact O-N 3.42Å; I499-I501 VanDerWaalsContact C-N 3.32Å; I499-I501 PolarHBondContact O-N 2.78Å; I499-N502 PolarHBondContact O-N 2.94Å; I499-N503 PolarHBondContact O-N 3.46Å
500	A	97.5	Very high	94.8	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-57	-43.5	177.2	0	0	0	0	0	112.2	F145 L256 S496 I497 N503 A504	F145-A500 HydrophobicContact CB-CB 3.69Å; F145-A500 WeakPolarHBondContact CD2-O 2.84Å; F145-A500 HydrophobicContact CG-CB 4.2Å; L256-A500 HydrophobicContact CD1-CB 3.98Å; S496-A500 PolarHBondContact O-N 3.28Å; I497-A500 WeakPolarHBondContact O-CB 3.2Å; I497-A500 PolarHBondContact O-N 2.65Å; I497-A500 VanDerWaalsContact O-N 3.15Å; A500-N503 PolarHBondContact O-N 2.98Å; A500-A504 WeakPolarHBondContact O-CB 2.97Å; A500-A504 PolarHBondContact O-N 3.15Å
501	I	97.6	Very high	95.1	Very high	1 Å²	1	10 Å²	10	1%	0.005	5%	0.05	C	C	.	.	H	α-helix	trans	-66.6	-39.9	178.1	-60	163.7	0	0	0	111.1	F142 I191 I497 S498 I499 A504 Y505 F524 L528	F142-I501 HydrophobicContact CD2-CG1 3.81Å; F142-I501 HydrophobicContact CE2-CD1 4.49Å; F142-I501 HydrophobicContact CE2-CG1 3.81Å; I191-I501 HydrophobicContact CD1-CD1 4.02Å; I191-I501 HydrophobicContact CG1-CD1 3.97Å; I191-I501 HydrophobicContact CG2-CD1 3.78Å; I497-I501 HydrophobicContact CG2-CD1 3.87Å; I497-I501 HydrophobicContact CG2-CG1 4.39Å; I497-I501 VanDerWaalsContact O-CG1 3.31Å; I497-I501 WeakPolarHBondContact O-CG1 3.37Å; I497-I501 PolarHBondContact O-N 3.41Å; S498-I501 PolarHBondContact O-N 2.87Å; I499-I501 VanDerWaalsContact C-N 3.32Å; I499-I501 PolarHBondContact O-N 2.78Å; I501-A504 WeakPolarHBondContact O-CB 3.32Å; I501-A504 PolarHBondContact O-N 3.44Å; I501-Y505 PolarHBondContact O-N 3.41Å; I501-F524 HydrophobicContact CG2-CD1 4.47Å; I501-F524 HydrophobicContact CG2-CE1 4.27Å; I501-L528 HydrophobicContact CD1-CD2 4.13Å; I501-L528 HydrophobicContact CG1-CD2 3.83Å; I501-L528 HydrophobicContact CG2-CD2 3.94Å
502	N	95.3	Very high	95.3	Very high	1 Å²	1	11 Å²	11	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-65.5	-43.5	176.4	-72.8	-16.3	0	0	0	111.7	Y476 F480 S498 I499 A504 Y505 I506 R521	Y476-N502 HydrophobicContact CD1-CB 4.31Å; Y476-N502 PolarHBondContact O-ND2 3.45Å; F480-N502 WeakPolarHBondContact CE1-ND2 3.11Å; S498-N502 PolarHBondContact O-N 2.88Å; S498-N502 VanDerWaalsContact O-N 3.11Å; I499-N502 PolarHBondContact O-N 2.94Å; N502-A504 VanDerWaalsContact C-N 3.34Å; N502-A504 PolarHBondContact O-N 3.12Å; N502-Y505 PolarHBondContact O-N 2.74Å; N502-I506 VanDerWaalsContact O-CG1 3.32Å; N502-I506 WeakPolarHBondContact O-CG1 3.3Å; N502-I506 PolarHBondContact O-N 2.86Å; N502-R521 VanDerWaalsContact OD1-CZ 3.25Å; N502-R521 PolarHBondContact OD1-NE 3.28Å; N502-R521 PolarHBondContact OD1-NH2 3.5Å
503	N	96.8	Very high	95.5	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-62.4	-39.7	173.5	-82.8	-0.2	0	0	0	112	F145 F260 F312 I313 I499 A500 Y505 I506 L507	F145-N503 HydrophobicContact CE1-CB 4.13Å; F145-N503 HydrophobicContact CE2-CB 4.02Å; F145-N503 HydrophobicContact CZ-CB 3.7Å; F260-N503 WeakPolarHBondContact CD1-ND2 3.28Å; F260-N503 WeakPolarHBondContact CE1-ND2 3.4Å; F312-N503 HydrophobicContact CD2-CB 4.01Å; F312-N503 HydrophobicContact CE2-CB 3.56Å; F312-N503 HydrophobicContact CZ-CB 3.99Å; I313-N503 PolarHBondContact N-OD1 2.64Å; I313-N503 PolarHBondContact O-ND2 3.19Å; I499-N503 PolarHBondContact O-N 3.46Å; A500-N503 PolarHBondContact O-N 2.98Å; N503-Y505 PolarHBondContact O-N 2.59Å; N503-I506 PolarHBondContact O-N 2.8Å; N503-L507 WeakPolarHBondContact O-CG 3.33Å; N503-L507 PolarHBondContact O-N 3.3Å
504	A	98.1	Very high	95.6	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-59.7	-44.3	173.6	0	0	0	0	0	112.3	F141 F145 A500 I501 N502 I506 L507 Y508 F524	F141-A504 HydrophobicContact CB-CB 4Å; F141-A504 WeakPolarHBondContact O-CB 3.48Å; F145-A504 HydrophobicContact CD2-CB 4.03Å; F145-A504 HydrophobicContact CE2-CB 3.91Å; A500-A504 WeakPolarHBondContact O-CB 2.97Å; A500-A504 PolarHBondContact O-N 3.15Å; I501-A504 WeakPolarHBondContact O-CB 3.32Å; I501-A504 PolarHBondContact O-N 3.44Å; N502-A504 VanDerWaalsContact C-N 3.34Å; N502-A504 PolarHBondContact O-N 3.12Å; A504-I506 VanDerWaalsContact C-N 3.33Å; A504-I506 PolarHBondContact O-N 2.86Å; A504-L507 PolarHBondContact O-N 2.99Å; A504-Y508 WeakPolarHBondContact O-CB 3.42Å; A504-Y508 PolarHBondContact O-N 3.12Å; A504-F524 HydrophobicContact CB-CE1 4.21Å; A504-F524 HydrophobicContact CB-CZ 4.06Å
505	Y	97.1	Very high	95.5	Very high	5 Å²	5	15.6 Å²	15.6	2%	0.02	9%	0.089	C	C	.	.	H	α-helix	trans	-64.3	-36.8	176.1	178.3	-108.8	0	0	0	113	Y476 I501 N502 N503 Y508 K509 Y519 R521 F524	Y476-Y505 AromaticContact CE1-CD1 3.68Å; Y476-Y505 HydrophobicContact CE1-CD1 3.68Å; Y476-Y505 HydrophobicContact CE1-CE1 4Å; I501-Y505 PolarHBondContact O-N 3.41Å; N502-Y505 PolarHBondContact O-N 2.74Å; N503-Y505 PolarHBondContact O-N 2.59Å; Y505-Y508 AromaticContact CD2-CD1 3.97Å; Y505-Y508 HydrophobicContact CD2-CD1 3.97Å; Y505-Y508 HydrophobicContact CE2-CD1 4.17Å; Y505-Y508 HydrophobicContact CE2-CE1 4.41Å; Y505-Y508 PolarHBondContact O-N 3.15Å; Y505-K509 HydrophobicContact CD1-CD 3.93Å; Y505-K509 HydrophobicContact CE1-CD 3.3Å; Y505-K509 HydrophobicContact CE1-CG 4.33Å; Y505-K509 HydrophobicContact CE2-CD 4.01Å; Y505-K509 HydrophobicContact CE2-CG 4.24Å; Y505-K509 PolarHBondContact O-N 2.93Å; Y505-Y519 WeakPolarHBondContact CE2-O 2.87Å; Y505-Y519 PolarHBondContact OH-O 3.47Å; Y505-R521 HydrophobicContact CD1-CB 4.12Å; Y505-R521 HydrophobicContact CD1-CG 4.31Å; Y505-R521 HydrophobicContact CE1-CB 3.72Å; Y505-R521 HydrophobicContact CE1-CG 4.39Å; Y505-R521 HydrophobicContact CE2-CB 4.3Å; Y505-R521 VanDerWaalsContact CZ-N 3.33Å; Y505-R521 PolarHBondContact OH-N 3.04Å; Y505-R521 VanDerWaalsContact OH-N 3.09Å; Y505-F524 HydrophobicContact CD2-CB 3.54Å; Y505-F524 HydrophobicContact CD2-CD1 4.06Å; Y505-F524 AromaticContact CD2-CD2 3.92Å; Y505-F524 HydrophobicContact CD2-CD2 3.92Å; Y505-F524 AromaticContact CD2-CG 3.57Å; Y505-F524 HydrophobicContact CD2-CG 3.57Å; Y505-F524 HydrophobicContact CE2-CB 3.92Å; Y505-F524 HydrophobicContact CE2-CG 4.4Å; Y505-F524 HydrophobicContact CG-CD1 4.46Å; Y505-F524 HydrophobicContact CG-CG 4.39Å
506	I	95.2	Very high	95.6	Very high	5 Å²	5	20.1 Å²	20.1	3%	0.026	12%	0.117	C	C	.	.	H	α-helix	trans	-63.4	-47.1	175.1	-66.7	164.2	0	0	0	110.1	G311 F312 Y472 N502 N503 A504 Y508 K509 M510	G311-I506 WeakPolarHBondContact O-CD1 3.37Å; F312-I506 HydrophobicContact CB-CD1 4.39Å; F312-I506 HydrophobicContact CB-CG2 4.33Å; F312-I506 HydrophobicContact CD2-CB 4.4Å; F312-I506 HydrophobicContact CD2-CG2 4.18Å; Y472-I506 HydrophobicContact CE2-CD1 4.07Å; N502-I506 VanDerWaalsContact O-CG1 3.32Å; N502-I506 WeakPolarHBondContact O-CG1 3.3Å; N502-I506 PolarHBondContact O-N 2.86Å; N503-I506 PolarHBondContact O-N 2.8Å; A504-I506 VanDerWaalsContact C-N 3.33Å; A504-I506 PolarHBondContact O-N 2.86Å; I506-Y508 VanDerWaalsContact C-N 3.34Å; I506-Y508 PolarHBondContact O-N 3.21Å; I506-K509 PolarHBondContact O-N 3.21Å; I506-M510 HydrophobicContact CG2-SD 4.13Å; I506-M510 WeakPolarHBondContact O-CG 3.27Å; I506-M510 PolarHBondContact O-N 3.27Å
507	L	97.1	Very high	95.5	Very high	5 Å²	5	25.1 Å²	25.1	3%	0.026	14%	0.139	C	C	.	.	H	α-helix	trans	-61.8	-42.1	176.5	-68.7	-177.7	0	0	0	112.2	P128 F141 L144 F145 F264 F312 N503 A504 K509 M510 S511	P128-L507 HydrophobicContact CB-CD2 4.02Å; P128-L507 HydrophobicContact CG-CD2 3.89Å; F141-L507 HydrophobicContact CD1-CB 3.79Å; F141-L507 HydrophobicContact CE1-CB 4.1Å; L144-L507 HydrophobicContact CD1-CD1 3.7Å; F145-L507 HydrophobicContact CE2-CD1 3.9Å; F145-L507 HydrophobicContact CZ-CD1 3.58Å; F145-L507 HydrophobicContact CZ-CG 4.44Å; F264-L507 HydrophobicContact CD2-CD2 3.8Å; F312-L507 HydrophobicContact CD2-CD2 4.46Å; F312-L507 HydrophobicContact CE2-CD1 4.3Å; F312-L507 HydrophobicContact CE2-CD2 4.06Å; F312-L507 HydrophobicContact CE2-CG 3.96Å; N503-L507 WeakPolarHBondContact O-CG 3.33Å; N503-L507 PolarHBondContact O-N 3.3Å; A504-L507 PolarHBondContact O-N 2.99Å; L507-K509 PolarHBondContact O-N 3.42Å; L507-M510 CarbonylContact O-C 3.59Å; L507-M510 PolarHBondContact O-N 2.92Å; L507-M510 VanDerWaalsContact O-N 3.14Å; L507-S511 PolarHBondContact O-N 2.94Å
508	Y	97.2	Very high	95.4	Very high	6 Å²	6	32.6 Å²	32.6	2%	0.024	17%	0.167	C	C	.	.	H	α-helix	trans	-56.4	-50.4	176.3	164.3	-115.6	0	0	0	111.4	F141 A504 Y505 I506 M510 S511 A513 Y514 K517 Y519 F524	F141-Y508 HydrophobicContact CD2-CD2 4.02Å; F141-Y508 HydrophobicContact CD2-CG 4.32Å; F141-Y508 VanDerWaalsContact CE1-CA 3.46Å; F141-Y508 AromaticContact CE2-CD2 3.64Å; F141-Y508 HydrophobicContact CE2-CD2 3.64Å; F141-Y508 HydrophobicContact CE2-CG 4.27Å; F141-Y508 HydrophobicContact CZ-CD2 4.2Å; A504-Y508 WeakPolarHBondContact O-CB 3.42Å; A504-Y508 PolarHBondContact O-N 3.12Å; Y505-Y508 AromaticContact CD2-CD1 3.97Å; Y505-Y508 HydrophobicContact CD2-CD1 3.97Å; Y505-Y508 HydrophobicContact CE2-CD1 4.17Å; Y505-Y508 HydrophobicContact CE2-CE1 4.41Å; Y505-Y508 PolarHBondContact O-N 3.15Å; I506-Y508 VanDerWaalsContact C-N 3.34Å; I506-Y508 PolarHBondContact O-N 3.21Å; Y508-M510 PolarHBondContact O-N 2.84Å; Y508-S511 WeakPolarHBondContact O-CB 3.22Å; Y508-S511 PolarHBondContact O-N 3.2Å; Y508-S511 PolarHBondContact O-OG 3.37Å; Y508-A513 HydrophobicContact CD2-CB 4.17Å; Y508-A513 HydrophobicContact CE2-CB 4.1Å; Y508-Y514 HydrophobicContact CD1-CD2 4.01Å; Y508-Y514 AromaticContact CE1-CD2 3.44Å; Y508-Y514 HydrophobicContact CE1-CD2 3.44Å; Y508-Y514 VanDerWaalsContact CE1-CD2 3.44Å; Y508-Y514 HydrophobicContact CE1-CE2 4.05Å; Y508-Y514 HydrophobicContact CE1-CG 4.48Å; Y508-Y514 HydrophobicContact CE2-CD2 4.4Å; Y508-Y514 AromaticContact CZ-CD2 3.68Å; Y508-Y514 VanDerWaalsContact O-CB 3.24Å; Y508-Y514 WeakPolarHBondContact O-CB 3.1Å; Y508-K517 PolarHBondContact OH-O 3.28Å; Y508-Y519 AromaticContact CE1-CD2 3.97Å; Y508-Y519 HydrophobicContact CE1-CD2 3.97Å; Y508-Y519 HydrophobicContact CE1-CG 4.37Å; Y508-Y519 HydrophobicContact CE2-CD2 4.5Å; Y508-Y519 AromaticContact CZ-CD2 3.6Å; Y508-Y519 WeakPolarHBondContact OH-CD2 3.29Å; Y508-Y519 PolarHBondContact OH-N 2.85Å; Y508-Y519 VanDerWaalsContact OH-N 3.13Å; Y508-F524 AromaticContact CD1-CD2 3.59Å; Y508-F524 HydrophobicContact CD1-CD2 3.59Å; Y508-F524 AromaticContact CD1-CE2 3.9Å; Y508-F524 HydrophobicContact CD1-CE2 3.9Å; Y508-F524 AromaticContact CE1-CD2 3.95Å; Y508-F524 HydrophobicContact CE1-CD2 3.95Å; Y508-F524 AromaticContact CG-CD2 3.99Å; Y508-F524 HydrophobicContact CG-CD2 3.99Å; Y508-F524 AromaticContact CG-CE2 3.82Å; Y508-F524 HydrophobicContact CG-CE2 3.82Å
509	K	95.1	Very high	95.4	Very high	20 Å²	20	34 Å²	34	9%	0.087	17%	0.172	C	C	.	.	H	α-helix	trans	-61.1	-27	177.4	-83	172.3	40.4	-175.2	0	115.2	V28 Y505 I506 L507 S511 Y514	V28-K509 VanDerWaalsContact C-NZ 3.3Å; V28-K509 VanDerWaalsContact CA-CE 3.44Å; V28-K509 PolarHBondContact O-NZ 2.86Å; Y505-K509 HydrophobicContact CD1-CD 3.93Å; Y505-K509 HydrophobicContact CE1-CD 3.3Å; Y505-K509 HydrophobicContact CE1-CG 4.33Å; Y505-K509 HydrophobicContact CE2-CD 4.01Å; Y505-K509 HydrophobicContact CE2-CG 4.24Å; Y505-K509 PolarHBondContact O-N 2.93Å; I506-K509 PolarHBondContact O-N 3.21Å; L507-K509 PolarHBondContact O-N 3.42Å; K509-S511 VanDerWaalsContact C-N 3.27Å; K509-Y514 HydrophobicContact CB-CD1 4.44Å; K509-Y514 HydrophobicContact CB-CG 4.43Å; K509-Y514 HydrophobicContact CG-CD1 4.3Å; K509-Y514 HydrophobicContact CG-CD2 3.9Å; K509-Y514 HydrophobicContact CG-CE1 4.18Å; K509-Y514 HydrophobicContact CG-CE2 3.77Å; K509-Y514 HydrophobicContact CG-CG 4.17Å
510	M	94.7	Very high	95.3	Very high	74 Å²	74	36.5 Å²	36.5	37%	0.365	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	6.1	177.1	-62.9	-178.5	79.8	0	0	112.7	P128 F264 T310 I506 L507 Y508	P128-M510 HydrophobicContact CG-CB 3.8Å; P128-M510 HydrophobicContact CG-SD 4.41Å; F264-M510 HydrophobicContact CE2-CE 4.26Å; F264-M510 HydrophobicContact CE2-SD 3.84Å; T310-M510 HydrophobicContact CG2-CE 4.01Å; T310-M510 HydrophobicContact CG2-SD 4.05Å; I506-M510 HydrophobicContact CG2-SD 4.13Å; I506-M510 WeakPolarHBondContact O-CG 3.27Å; I506-M510 PolarHBondContact O-N 3.27Å; L507-M510 CarbonylContact O-C 3.59Å; L507-M510 PolarHBondContact O-N 2.92Å; L507-M510 VanDerWaalsContact O-N 3.14Å; Y508-M510 PolarHBondContact O-N 2.84Å
511	S	94.6	Very high	95.1	Very high	18 Å²	18	36.6 Å²	36.6	13%	0.126	19%	0.19	C	C	.	.	S	Bend	trans	-111.9	161.5	-175.9	79.3	0	0	0	0	112.7	F141 L507 Y508 K509 A513 Y514	F141-S511 WeakPolarHBondContact CZ-OG 3.4Å; L507-S511 PolarHBondContact O-N 2.94Å; Y508-S511 WeakPolarHBondContact O-CB 3.22Å; Y508-S511 PolarHBondContact O-N 3.2Å; Y508-S511 PolarHBondContact O-OG 3.37Å; K509-S511 VanDerWaalsContact C-N 3.27Å; S511-A513 PolarHBondContact O-N 3.15Å; S511-A513 PolarHBondContact OG-N 2.77Å; S511-Y514 WeakPolarHBondContact O-CB 3.31Å; S511-Y514 PolarHBondContact O-N 3.4Å; S511-Y514 VanDerWaalsContact O-N 3.08Å
512	D	94.1	Very high	94.8	Very high	73 Å²	73	37.8 Å²	37.8	39%	0.39	20%	0.2	S	C	.	.	H	α-helix	trans	-60.3	-25.4	174.1	-64	-0.2	0	0	0	112.4	K131 A134 Y514 A515 V516	K131-D512 WeakPolarHBondContact CE-OD2 3.28Å; K131-D512 IonicContact NZ-OD1 3.25Å; K131-D512 IonicContact NZ-OD2 2.63Å; K131-D512 PolarHBondContact NZ-OD2 3.19Å; A134-D512 HydrophobicContact CB-CB 4.14Å; D512-Y514 PolarHBondContact O-N 3.27Å; D512-A515 WeakPolarHBondContact O-CB 3.34Å; D512-A515 PolarHBondContact O-N 3.44Å; D512-A515 VanDerWaalsContact O-N 3.11Å; D512-V516 PolarHBondContact O-N 2.77Å
513	A	94.9	Very high	94.8	Very high	4 Å²	4	42 Å²	42	3%	0.033	22%	0.22	C	C	.	.	H	α-helix	trans	-63.4	-31	176.8	0	0	0	0	0	112.3	A134 A136 F141 Y508 S511 V516 K517	A134-A513 WeakPolarHBondContact O-CA 3.22Å; A136-A513 HydrophobicContact CB-CB 4.4Å; F141-A513 HydrophobicContact CE2-CB 4.14Å; F141-A513 HydrophobicContact CZ-CB 4.35Å; Y508-A513 HydrophobicContact CD2-CB 4.17Å; Y508-A513 HydrophobicContact CE2-CB 4.1Å; S511-A513 PolarHBondContact O-N 3.15Å; S511-A513 PolarHBondContact OG-N 2.77Å; A513-V516 PolarHBondContact O-N 2.95Å; A513-K517 PolarHBondContact O-N 2.75Å
514	Y	95.1	Very high	94.8	Very high	32 Å²	32	42 Å²	42	13%	0.125	22%	0.22	C	C	.	.	H	α-helix	trans	-71.3	-32.5	174.7	-172.3	-114.5	0	0	0	112.6	D27 Y508 K509 S511 D512 V516 K517 R518 Y519	D27-Y514 PolarHBondContact O-OH 3.01Å; Y508-Y514 HydrophobicContact CD1-CD2 4.01Å; Y508-Y514 AromaticContact CE1-CD2 3.44Å; Y508-Y514 HydrophobicContact CE1-CD2 3.44Å; Y508-Y514 VanDerWaalsContact CE1-CD2 3.44Å; Y508-Y514 HydrophobicContact CE1-CE2 4.05Å; Y508-Y514 HydrophobicContact CE1-CG 4.48Å; Y508-Y514 HydrophobicContact CE2-CD2 4.4Å; Y508-Y514 AromaticContact CZ-CD2 3.68Å; Y508-Y514 VanDerWaalsContact O-CB 3.24Å; Y508-Y514 WeakPolarHBondContact O-CB 3.1Å; K509-Y514 HydrophobicContact CB-CD1 4.44Å; K509-Y514 HydrophobicContact CB-CG 4.43Å; K509-Y514 HydrophobicContact CG-CD1 4.3Å; K509-Y514 HydrophobicContact CG-CD2 3.9Å; K509-Y514 HydrophobicContact CG-CE1 4.18Å; K509-Y514 HydrophobicContact CG-CE2 3.77Å; K509-Y514 HydrophobicContact CG-CG 4.17Å; S511-Y514 WeakPolarHBondContact O-CB 3.31Å; S511-Y514 PolarHBondContact O-N 3.4Å; S511-Y514 VanDerWaalsContact O-N 3.08Å; D512-Y514 PolarHBondContact O-N 3.27Å; Y514-V516 VanDerWaalsContact C-N 3.27Å; Y514-V516 PolarHBondContact O-N 2.83Å; Y514-K517 CarbonylContact C-O 3.46Å; Y514-K517 WeakPolarHBondContact CA-O 3.48Å; Y514-K517 CarbonylContact O-C 3.26Å; Y514-K517 VanDerWaalsContact O-C 3.26Å; Y514-R518 HydrophobicContact CD1-CG 4.26Å; Y514-R518 HydrophobicContact CD2-CB 4.32Å; Y514-R518 HydrophobicContact CD2-CG 4.29Å; Y514-R518 HydrophobicContact CE1-CG 3.97Å; Y514-R518 HydrophobicContact CE2-CB 3.81Å; Y514-R518 HydrophobicContact CE2-CG 4.03Å; Y514-R518 HydrophobicContact CG-CG 4.4Å; Y514-R518 WeakPolarHBondContact O-CG 3.42Å; Y514-Y519 WeakPolarHBondContact CE2-O 3.25Å
515	A	91.9	Very high	94.6	Very high	68 Å²	68	42 Å²	42	56%	0.562	22%	0.22	S	C	*	.	H	α-helix	trans	-65.8	-33.6	174.6	0	0	0	0	0	111.7	D512	D512-A515 WeakPolarHBondContact O-CB 3.34Å; D512-A515 PolarHBondContact O-N 3.44Å; D512-A515 VanDerWaalsContact O-N 3.11Å
516	V	93.8	Very high	94.5	Very high	107 Å²	107	45.8 Å²	45.8	65%	0.648	24%	0.238	S	C	*	.	H	α-helix	trans	-72.4	-49	176	176.4	0	0	0	0	111.5	A134 D512 A513 Y514	A134-V516 HydrophobicContact CB-CG2 3.96Å; D512-V516 PolarHBondContact O-N 2.77Å; A513-V516 PolarHBondContact O-N 2.95Å; Y514-V516 VanDerWaalsContact C-N 3.27Å; Y514-V516 PolarHBondContact O-N 2.83Å
517	K	93.6	Very high	94.6	Very high	106 Å²	106	47.8 Å²	47.8	46%	0.461	25%	0.245	S	C	.	.	S	Bend	trans	-137.7	125.7	-179.6	-165.4	165.8	-172.7	-171.8	0	107.9	Y508 A513 Y514 Y519	Y508-K517 PolarHBondContact OH-O 3.28Å; A513-K517 PolarHBondContact O-N 2.75Å; Y514-K517 CarbonylContact C-O 3.46Å; Y514-K517 WeakPolarHBondContact CA-O 3.48Å; Y514-K517 CarbonylContact O-C 3.26Å; Y514-K517 VanDerWaalsContact O-C 3.26Å; K517-Y519 HydrophobicContact CD-CE1 3.77Å; K517-Y519 HydrophobicContact CD-CE2 4.21Å; K517-Y519 VanDerWaalsContact CD-CZ 3.48Å; K517-Y519 VanDerWaalsContact CD-OH 3.27Å; K517-Y519 WeakPolarHBondContact CD-OH 3.15Å; K517-Y519 VanDerWaalsContact CE-CZ 3.47Å; K517-Y519 WeakPolarHBondContact CE-OH 3.48Å; K517-Y519 HydrophobicContact CG-CD1 4.44Å; K517-Y519 HydrophobicContact CG-CE1 3.96Å; K517-Y519 HydrophobicContact CG-CE2 4.42Å; K517-Y519 PolarHBondContact NZ-OH 2.98Å
518	R	94.4	Very high	94.6	Very high	157 Å²	157	47.5 Å²	47.5	59%	0.592	24%	0.244	S	C	*	.			trans	-101.4	92.7	-177.8	-69.8	-175.8	174.9	96.3	-4.4	111.1	Y514	Y514-R518 HydrophobicContact CD1-CG 4.26Å; Y514-R518 HydrophobicContact CD2-CB 4.32Å; Y514-R518 HydrophobicContact CD2-CG 4.29Å; Y514-R518 HydrophobicContact CE1-CG 3.97Å; Y514-R518 HydrophobicContact CE2-CB 3.81Å; Y514-R518 HydrophobicContact CE2-CG 4.03Å; Y514-R518 HydrophobicContact CG-CG 4.4Å; Y514-R518 WeakPolarHBondContact O-CG 3.42Å
519	Y	94.2	Very high	94.5	Very high	32 Å²	32	47.5 Å²	47.5	13%	0.125	24%	0.244	C	C	.	.			trans	-81.4	139	171.4	-61.7	-52.1	0	0	0	111.9	Y505 Y508 Y514 K517 Q523 R527	Y505-Y519 WeakPolarHBondContact CE2-O 2.87Å; Y505-Y519 PolarHBondContact OH-O 3.47Å; Y508-Y519 AromaticContact CE1-CD2 3.97Å; Y508-Y519 HydrophobicContact CE1-CD2 3.97Å; Y508-Y519 HydrophobicContact CE1-CG 4.37Å; Y508-Y519 HydrophobicContact CE2-CD2 4.5Å; Y508-Y519 AromaticContact CZ-CD2 3.6Å; Y508-Y519 WeakPolarHBondContact OH-CD2 3.29Å; Y508-Y519 PolarHBondContact OH-N 2.85Å; Y508-Y519 VanDerWaalsContact OH-N 3.13Å; Y514-Y519 WeakPolarHBondContact CE2-O 3.25Å; K517-Y519 HydrophobicContact CD-CE1 3.77Å; K517-Y519 HydrophobicContact CD-CE2 4.21Å; K517-Y519 VanDerWaalsContact CD-CZ 3.48Å; K517-Y519 VanDerWaalsContact CD-OH 3.27Å; K517-Y519 WeakPolarHBondContact CD-OH 3.15Å; K517-Y519 VanDerWaalsContact CE-CZ 3.47Å; K517-Y519 WeakPolarHBondContact CE-OH 3.48Å; K517-Y519 HydrophobicContact CG-CD1 4.44Å; K517-Y519 HydrophobicContact CG-CE1 3.96Å; K517-Y519 HydrophobicContact CG-CE2 4.42Å; K517-Y519 PolarHBondContact NZ-OH 2.98Å; Y519-Q523 HydrophobicContact CD1-CB 3.89Å; Y519-Q523 HydrophobicContact CG-CB 4.22Å; Y519-R527 HydrophobicContact CE2-CB 4.42Å; Y519-R527 HydrophobicContact CE2-CG 4.13Å
520	S	93.7	Very high	94.5	Very high	53 Å²	53	50 Å²	50	37%	0.371	25%	0.253	S	S	.	.			trans	-66.1	167.5	158.8	78.1	0	0	0	0	110.8	A522 Q523 F524	S520-A522 PolarHBondContact O-N 2.87Å; S520-Q523 PolarHBondContact O-N 3.33Å; S520-Q523 WeakPolarHBondContact OG-CG 3.35Å; S520-Q523 PolarHBondContact OG-N 3.16Å; S520-Q523 PolarHBondContact OG-OE1 3.33Å; S520-F524 WeakPolarHBondContact O-CB 3.03Å; S520-F524 PolarHBondContact O-N 2.89Å
521	R	91.8	Very high	94.6	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.008	24%	0.243	C	C	.	.	H	α-helix	trans	-60.3	-35.9	177.6	178.4	56.7	-172.7	81.4	4.9	112.3	Y476 Y479 N502 Y505 G525	Y476-R521 HydrophobicContact CD1-CG 4.09Å; Y476-R521 HydrophobicContact CE1-CB 4.43Å; Y476-R521 HydrophobicContact CE1-CG 4Å; Y479-R521 HydrophobicContact CD2-CB 4.36Å; Y479-R521 HydrophobicContact CD2-CG 3.49Å; Y479-R521 VanDerWaalsContact CD2-CG 3.49Å; Y479-R521 HydrophobicContact CE2-CB 3.9Å; Y479-R521 HydrophobicContact CE2-CG 3.54Å; Y479-R521 HydrophobicContact CG-CG 4.02Å; N502-R521 VanDerWaalsContact OD1-CZ 3.25Å; N502-R521 PolarHBondContact OD1-NE 3.28Å; N502-R521 PolarHBondContact OD1-NH2 3.5Å; Y505-R521 HydrophobicContact CD1-CB 4.12Å; Y505-R521 HydrophobicContact CD1-CG 4.31Å; Y505-R521 HydrophobicContact CE1-CB 3.72Å; Y505-R521 HydrophobicContact CE1-CG 4.39Å; Y505-R521 HydrophobicContact CE2-CB 4.3Å; Y505-R521 VanDerWaalsContact CZ-N 3.33Å; Y505-R521 PolarHBondContact OH-N 3.04Å; Y505-R521 VanDerWaalsContact OH-N 3.09Å; R521-G525 PolarHBondContact O-N 2.63Å; R521-G525 VanDerWaalsContact O-N 3.16Å
522	A	92	Very high	94.7	Very high	25 Å²	25	47.5 Å²	47.5	21%	0.207	24%	0.239	C	C	.	.	H	α-helix	trans	-66	-51.5	175.5	0	0	0	0	0	110.8	Y479 S520 F524 G525 E526	Y479-A522 HydrophobicContact CE1-CB 3.91Å; S520-A522 PolarHBondContact O-N 2.87Å; A522-F524 VanDerWaalsContact C-N 3.3Å; A522-F524 PolarHBondContact O-N 2.95Å; A522-G525 WeakPolarHBondContact O-CA 3.47Å; A522-G525 PolarHBondContact O-N 2.96Å; A522-E526 PolarHBondContact O-N 3.08Å
523	Q	95.1	Very high	94.8	Very high	89 Å²	89	44.2 Å²	44.2	42%	0.416	22%	0.221	S	C	.	.	H	α-helix	trans	-60.6	-37.6	178.6	-72.1	169.6	-30.8	0	0	112.5	Y519 S520 G525 E526 R527	Y519-Q523 HydrophobicContact CD1-CB 3.89Å; Y519-Q523 HydrophobicContact CG-CB 4.22Å; S520-Q523 PolarHBondContact O-N 3.33Å; S520-Q523 WeakPolarHBondContact OG-CG 3.35Å; S520-Q523 PolarHBondContact OG-N 3.16Å; S520-Q523 PolarHBondContact OG-OE1 3.33Å; Q523-G525 VanDerWaalsContact C-N 3.34Å; Q523-E526 PolarHBondContact O-N 3.07Å; Q523-R527 VanDerWaalsContact O-CB 3.31Å; Q523-R527 WeakPolarHBondContact O-CB 3.4Å; Q523-R527 PolarHBondContact O-N 2.91Å
524	F	96.5	Very high	94.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.6	-42.2	173.7	-178.2	-89.3	0	0	0	111.5	A138 F141 I501 A504 Y505 Y508 S520 A522 R527 L528	A138-F524 HydrophobicContact CB-CD2 4.02Å; A138-F524 HydrophobicContact CB-CE1 4.49Å; A138-F524 HydrophobicContact CB-CE2 3.76Å; A138-F524 HydrophobicContact CB-CG 4.5Å; A138-F524 HydrophobicContact CB-CZ 4.01Å; F141-F524 HydrophobicContact CB-CE2 4.47Å; F141-F524 HydrophobicContact CB-CZ 4.11Å; I501-F524 HydrophobicContact CG2-CD1 4.47Å; I501-F524 HydrophobicContact CG2-CE1 4.27Å; A504-F524 HydrophobicContact CB-CE1 4.21Å; A504-F524 HydrophobicContact CB-CZ 4.06Å; Y505-F524 HydrophobicContact CD2-CB 3.54Å; Y505-F524 HydrophobicContact CD2-CD1 4.06Å; Y505-F524 AromaticContact CD2-CD2 3.92Å; Y505-F524 HydrophobicContact CD2-CD2 3.92Å; Y505-F524 AromaticContact CD2-CG 3.57Å; Y505-F524 HydrophobicContact CD2-CG 3.57Å; Y505-F524 HydrophobicContact CE2-CB 3.92Å; Y505-F524 HydrophobicContact CE2-CG 4.4Å; Y505-F524 HydrophobicContact CG-CD1 4.46Å; Y505-F524 HydrophobicContact CG-CG 4.39Å; Y508-F524 AromaticContact CD1-CD2 3.59Å; Y508-F524 HydrophobicContact CD1-CD2 3.59Å; Y508-F524 AromaticContact CD1-CE2 3.9Å; Y508-F524 HydrophobicContact CD1-CE2 3.9Å; Y508-F524 AromaticContact CE1-CD2 3.95Å; Y508-F524 HydrophobicContact CE1-CD2 3.95Å; Y508-F524 AromaticContact CG-CD2 3.99Å; Y508-F524 HydrophobicContact CG-CD2 3.99Å; Y508-F524 AromaticContact CG-CE2 3.82Å; Y508-F524 HydrophobicContact CG-CE2 3.82Å; S520-F524 WeakPolarHBondContact O-CB 3.03Å; S520-F524 PolarHBondContact O-N 2.89Å; A522-F524 VanDerWaalsContact C-N 3.3Å; A522-F524 PolarHBondContact O-N 2.95Å; F524-R527 PolarHBondContact O-N 3.21Å; F524-L528 WeakPolarHBondContact O-CB 3.26Å; F524-L528 PolarHBondContact O-N 3.35Å
525	G	95.5	Very high	94.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.1	-45.1	174.8	0	0	0	0	0	112.7	R521 A522 Q523 R527 L528 V529	R521-G525 PolarHBondContact O-N 2.63Å; R521-G525 VanDerWaalsContact O-N 3.16Å; A522-G525 WeakPolarHBondContact O-CA 3.47Å; A522-G525 PolarHBondContact O-N 2.96Å; Q523-G525 VanDerWaalsContact C-N 3.34Å; G525-R527 VanDerWaalsContact C-N 3.32Å; G525-R527 PolarHBondContact O-N 2.93Å; G525-L528 PolarHBondContact O-N 3.28Å; G525-V529 VanDerWaalsContact O-CG2 3.3Å; G525-V529 WeakPolarHBondContact O-CG2 3.38Å; G525-V529 PolarHBondContact O-N 3.22Å
526	E	94.4	Very high	93.7	Very high	86 Å²	86	51.6 Å²	51.6	40%	0.402	25%	0.252	S	S	.	.	H	α-helix	trans	-58	-45.8	174	-72.9	171.1	-172.6	0	0	111.4	V195 A522 Q523 V529 R530	V195-E526 HydrophobicContact CG1-CG 3.34Å; A522-E526 PolarHBondContact O-N 3.08Å; Q523-E526 PolarHBondContact O-N 3.07Å; E526-V529 PolarHBondContact O-N 3.01Å; E526-R530 WeakPolarHBondContact O-CG 3.4Å; E526-R530 PolarHBondContact O-N 3.4Å
527	R	96	Very high	92.2	Very high	46 Å²	46	51.1 Å²	51.1	17%	0.174	25%	0.246	C	C	.	.	H	α-helix	trans	-63.1	-44.9	178.9	-176.6	59.7	179.8	-156.9	14	111.6	A138 Y519 Q523 F524 G525 V529 R530 E531 D537	A138-R527 HydrophobicContact CB-CB 4.07Å; A138-R527 HydrophobicContact CB-CG 3.82Å; Y519-R527 HydrophobicContact CE2-CB 4.42Å; Y519-R527 HydrophobicContact CE2-CG 4.13Å; Q523-R527 VanDerWaalsContact O-CB 3.31Å; Q523-R527 WeakPolarHBondContact O-CB 3.4Å; Q523-R527 PolarHBondContact O-N 2.91Å; F524-R527 PolarHBondContact O-N 3.21Å; G525-R527 VanDerWaalsContact C-N 3.32Å; G525-R527 PolarHBondContact O-N 2.93Å; R527-V529 VanDerWaalsContact C-N 3.33Å; R527-V529 PolarHBondContact O-N 3.19Å; R527-R530 PolarHBondContact O-N 3.29Å; R527-E531 WeakPolarHBondContact CD-OE1 3.46Å; R527-E531 WeakPolarHBondContact CG-OE1 3.34Å; R527-E531 IonicContact CZ-OE1 3.82Å; R527-E531 IonicContact NE-OE1 2.95Å; R527-E531 PolarHBondContact NE-OE1 3.32Å; R527-E531 IonicContact NH2-OE1 3.8Å; R527-E531 WeakPolarHBondContact O-CG 3.16Å; R527-E531 PolarHBondContact O-N 2.99Å; R527-D537 IonicContact CZ-OD1 2.76Å; R527-D537 IonicContact CZ-OD2 3.82Å; R527-D537 VanDerWaalsContact CZ-OD2 3.25Å; R527-D537 IonicContact NH1-OD1 2.76Å; R527-D537 PolarHBondContact NH1-OD1 3.24Å; R527-D537 IonicContact NH1-OD2 2.83Å; R527-D537 PolarHBondContact NH1-OD2 3.42Å; R527-D537 IonicContact NH2-OD2 2.87Å; R527-D537 PolarHBondContact NH2-OD2 3.19Å
528	L	97.8	Very high	89.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-44.3	175.7	176.6	60.9	0	0	0	111.6	A138 L139 F142 I501 F524 G525 R530 E531 L532	A138-L528 HydrophobicContact CB-CB 4.08Å; L139-L528 HydrophobicContact CB-CD1 4.46Å; L139-L528 HydrophobicContact CD1-CD1 4.25Å; F142-L528 HydrophobicContact CB-CD1 3.61Å; F142-L528 HydrophobicContact CB-CD2 4.17Å; F142-L528 HydrophobicContact CD1-CD1 4.01Å; F142-L528 HydrophobicContact CD2-CD2 3.92Å; F142-L528 HydrophobicContact CG-CD1 3.8Å; F142-L528 HydrophobicContact CG-CD2 4.04Å; I501-L528 HydrophobicContact CD1-CD2 4.13Å; I501-L528 HydrophobicContact CG1-CD2 3.83Å; I501-L528 HydrophobicContact CG2-CD2 3.94Å; F524-L528 WeakPolarHBondContact O-CB 3.26Å; F524-L528 PolarHBondContact O-N 3.35Å; G525-L528 PolarHBondContact O-N 3.28Å; L528-R530 VanDerWaalsContact C-N 3.34Å; L528-R530 PolarHBondContact O-N 2.93Å; L528-E531 PolarHBondContact O-N 3.28Å; L528-L532 HydrophobicContact CD1-CD1 3.97Å; L528-L532 HydrophobicContact CD1-CG 4.07Å; L528-L532 HydrophobicContact CG-CD1 3.95Å; L528-L532 HydrophobicContact CG-CG 4.47Å; L528-L532 WeakPolarHBondContact O-CB 3.39Å; L528-L532 WeakPolarHBondContact O-CG 3.31Å; L528-L532 PolarHBondContact O-N 3.42Å
529	V	96	Very high	87	Confident	5 Å²	5	47.1 Å²	47.1	3%	0.03	26%	0.255	C	S	.	.	H	α-helix	trans	-60.7	-44.6	176.9	169	0	0	0	0	110.8	I191 V195 I215 G525 E526 R527 L532 L533	I191-V529 HydrophobicContact CB-CG2 4.31Å; I191-V529 HydrophobicContact CG2-CG2 3.77Å; V195-V529 HydrophobicContact CG2-CG2 4.4Å; I215-V529 HydrophobicContact CD1-CG1 4.22Å; G525-V529 VanDerWaalsContact O-CG2 3.3Å; G525-V529 WeakPolarHBondContact O-CG2 3.38Å; G525-V529 PolarHBondContact O-N 3.22Å; E526-V529 PolarHBondContact O-N 3.01Å; R527-V529 VanDerWaalsContact C-N 3.33Å; R527-V529 PolarHBondContact O-N 3.19Å; V529-L532 PolarHBondContact O-N 2.83Å; V529-L533 HydrophobicContact CG1-CD1 3.67Å; V529-L533 WeakPolarHBondContact O-CB 3.43Å; V529-L533 VanDerWaalsContact O-CG 3.26Å; V529-L533 WeakPolarHBondContact O-CG 3.39Å; V529-L533 PolarHBondContact O-N 3.32Å
530	R	95.1	Very high	84.3	Confident	72 Å²	72	51.8 Å²	51.8	27%	0.272	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-45.6	177.7	-69.8	178.1	79.4	-155.8	11.3	112.2	E526 R527 L528 L533 D534 L535 D536 D537	E526-R530 WeakPolarHBondContact O-CG 3.4Å; E526-R530 PolarHBondContact O-N 3.4Å; R527-R530 PolarHBondContact O-N 3.29Å; L528-R530 VanDerWaalsContact C-N 3.34Å; L528-R530 PolarHBondContact O-N 2.93Å; R530-L533 CarbonylContact O-C 3.56Å; R530-L533 PolarHBondContact O-N 3.45Å; R530-D534 PolarHBondContact O-N 3.38Å; R530-L535 HydrophobicContact CB-CB 4.11Å; R530-L535 HydrophobicContact CG-CB 4.32Å; R530-L535 HydrophobicContact CG-CD1 4.21Å; R530-L535 PolarHBondContact O-N 2.82Å; R530-D536 PolarHBondContact NH2-O 3Å; R530-D537 IonicContact CZ-OD1 3.99Å; R530-D537 IonicContact NH1-OD1 3.32Å; R530-D537 PolarHBondContact NH1-OD1 3.41Å; R530-D537 VanDerWaalsContact NH2-CA 3.26Å; R530-D537 IonicContact NH2-OD1 3.06Å
531	E	96.4	Very high	81.6	Confident	35 Å²	35	54.4 Å²	54.4	16%	0.164	30%	0.303	C	S	.	.	H	α-helix	trans	-66.6	-39	179	-70.2	174.6	-159.9	0	0	112.3	T137 A138 L139 R527 L528 L533 D534	T137-E531 WeakPolarHBondContact CB-OE1 3.32Å; T137-E531 WeakPolarHBondContact CB-OE2 3.4Å; T137-E531 PolarHBondContact OG1-OE2 3.48Å; A138-E531 PolarHBondContact N-OE2 2.86Å; L139-E531 WeakPolarHBondContact CA-OE2 3.43Å; L139-E531 HydrophobicContact CB-CB 3.99Å; L139-E531 WeakPolarHBondContact CB-OE2 3.26Å; L139-E531 HydrophobicContact CD2-CB 4.39Å; L139-E531 PolarHBondContact N-OE2 3.36Å; R527-E531 WeakPolarHBondContact CD-OE1 3.46Å; R527-E531 WeakPolarHBondContact CG-OE1 3.34Å; R527-E531 IonicContact CZ-OE1 3.82Å; R527-E531 IonicContact NE-OE1 2.95Å; R527-E531 PolarHBondContact NE-OE1 3.32Å; R527-E531 IonicContact NH2-OE1 3.8Å; R527-E531 WeakPolarHBondContact O-CG 3.16Å; R527-E531 PolarHBondContact O-N 2.99Å; L528-E531 PolarHBondContact O-N 3.28Å; E531-L533 VanDerWaalsContact C-N 3.28Å; E531-L533 PolarHBondContact O-N 3.09Å; E531-D534 PolarHBondContact O-N 3.15Å
532	L	96.9	Very high	78.6	Confident	6 Å²	6	67.2 Å²	67.2	3%	0.031	36%	0.363	C	S	.	.	H	α-helix	trans	-66	-30.2	174.8	-77.2	171.3	0	0	0	113.3	L139 F142 K184 A185 I191 L528 V529	L139-L532 HydrophobicContact CD1-CD2 3.74Å; L139-L532 HydrophobicContact CD1-CG 4.26Å; F142-L532 HydrophobicContact CE1-CD2 4.39Å; K184-L532 CarbonylContact C-O 3.49Å; K184-L532 HydrophobicContact CB-CD2 4.24Å; K184-L532 HydrophobicContact CG-CD2 4.39Å; A185-L532 PolarHBondContact N-O 3.11Å; I191-L532 HydrophobicContact CD1-CD1 3.62Å; L528-L532 HydrophobicContact CD1-CD1 3.97Å; L528-L532 HydrophobicContact CD1-CG 4.07Å; L528-L532 HydrophobicContact CG-CD1 3.95Å; L528-L532 HydrophobicContact CG-CG 4.47Å; L528-L532 WeakPolarHBondContact O-CB 3.39Å; L528-L532 WeakPolarHBondContact O-CG 3.31Å; L528-L532 PolarHBondContact O-N 3.42Å; V529-L532 PolarHBondContact O-N 2.83Å
533	L	95.5	Very high	78	Confident	4 Å²	4	69.3 Å²	69.3	2%	0.021	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	1.6	178.3	-68.3	171.9	0	0	0	112.9	A185 F189 I215 K218 V529 R530 E531 L535	A185-L533 HydrophobicContact CB-CD2 4.04Å; A185-L533 WeakPolarHBondContact O-CD2 3.31Å; F189-L533 HydrophobicContact CD2-CD2 3.76Å; F189-L533 HydrophobicContact CE2-CD2 3.67Å; F189-L533 HydrophobicContact CG-CD2 4.41Å; F189-L533 HydrophobicContact CZ-CD2 4.31Å; I215-L533 HydrophobicContact CB-CD1 4.21Å; I215-L533 HydrophobicContact CD1-CD1 4.18Å; I215-L533 HydrophobicContact CG1-CD1 3.8Å; I215-L533 HydrophobicContact CG2-CD1 3.66Å; K218-L533 HydrophobicContact CB-CD2 4.33Å; K218-L533 WeakPolarHBondContact CD-O 3.3Å; K218-L533 WeakPolarHBondContact CE-O 3.26Å; K218-L533 HydrophobicContact CG-CB 4.34Å; K218-L533 PolarHBondContact NZ-O 3.15Å; K218-L533 VanDerWaalsContact NZ-O 3.15Å; V529-L533 HydrophobicContact CG1-CD1 3.67Å; V529-L533 WeakPolarHBondContact O-CB 3.43Å; V529-L533 VanDerWaalsContact O-CG 3.26Å; V529-L533 WeakPolarHBondContact O-CG 3.39Å; V529-L533 PolarHBondContact O-N 3.32Å; R530-L533 CarbonylContact O-C 3.56Å; R530-L533 PolarHBondContact O-N 3.45Å; E531-L533 VanDerWaalsContact C-N 3.28Å; E531-L533 PolarHBondContact O-N 3.09Å; L533-L535 HydrophobicContact CB-CD1 3.88Å; L533-L535 HydrophobicContact CB-CG 3.79Å; L533-L535 HydrophobicContact CD1-CD1 3.91Å; L533-L535 PolarHBondContact O-N 3.31Å
534	D	93.1	Very high	77.1	Confident	101 Å²	101	68.3 Å²	68.3	54%	0.54	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	41.1	-176.7	-165.2	34.7	0	0	0	111.9	K218 R530 E531	K218-D534 PolarHBondContact NZ-O 2.69Å; R530-D534 PolarHBondContact O-N 3.38Å; E531-D534 PolarHBondContact O-N 3.15Å
535	L	88.9	Confident	76	Confident	37 Å²	37	72.1 Å²	72.1	19%	0.194	39%	0.388	C	S	.	.			trans	-84.7	120.3	179.2	-70.3	170.8	0	0	0	109.3	I215 K218 R530 L533	I215-L535 HydrophobicContact CG1-CD1 4.05Å; K218-L535 HydrophobicContact CD-CD2 4.25Å; K218-L535 HydrophobicContact CG-CD2 4.01Å; R530-L535 HydrophobicContact CB-CB 4.11Å; R530-L535 HydrophobicContact CG-CB 4.32Å; R530-L535 HydrophobicContact CG-CD1 4.21Å; R530-L535 PolarHBondContact O-N 2.82Å; L533-L535 HydrophobicContact CB-CD1 3.88Å; L533-L535 HydrophobicContact CB-CG 3.79Å; L533-L535 HydrophobicContact CD1-CD1 3.91Å; L533-L535 PolarHBondContact O-N 3.31Å
536	D	75.9	Confident	74.9	Confident	121 Å²	121	76.3 Å²	76.3	65%	0.647	41%	0.411	S	S	*	.			trans	-55.7	150.9	176.4	-66.7	-47.1	0	0	0	111.9	R530 C538	R530-D536 PolarHBondContact NH2-O 3Å; D536-C538 HydrophobicContact CB-CB 4.37Å; D536-C538 PolarHBondContact O-N 3.3Å; D536-C538 VanDerWaalsContact O-N 3.08Å
537	D	62.8	Low	73.6	Confident	96 Å²	96	75.7 Å²	75.7	51%	0.513	41%	0.412	S	S	.	.	S	Bend	trans	-68.3	-2.9	177.5	-96.3	-39.1	0	0	0	114.4	R527 R530 S539	R527-D537 IonicContact CZ-OD1 2.76Å; R527-D537 IonicContact CZ-OD2 3.82Å; R527-D537 VanDerWaalsContact CZ-OD2 3.25Å; R527-D537 IonicContact NH1-OD1 2.76Å; R527-D537 PolarHBondContact NH1-OD1 3.24Å; R527-D537 IonicContact NH1-OD2 2.83Å; R527-D537 PolarHBondContact NH1-OD2 3.42Å; R527-D537 IonicContact NH2-OD2 2.87Å; R527-D537 PolarHBondContact NH2-OD2 3.19Å; R530-D537 IonicContact CZ-OD1 3.99Å; R530-D537 IonicContact NH1-OD1 3.32Å; R530-D537 PolarHBondContact NH1-OD1 3.41Å; R530-D537 VanDerWaalsContact NH2-CA 3.26Å; R530-D537 IonicContact NH2-OD1 3.06Å; D537-S539 PolarHBondContact O-N 3.26Å; D537-S539 VanDerWaalsContact O-N 3.11Å
538	C	44.2	Very low	72.1	Confident	99 Å²	99	77.7 Å²	77.7	67%	0.669	43%	0.428	S	S	*	.			trans	-55.2	115.2	178.4	-64.1	0	0	0	0	111.1	D536	D536-C538 HydrophobicContact CB-CB 4.37Å; D536-C538 PolarHBondContact O-N 3.3Å; D536-C538 VanDerWaalsContact O-N 3.08Å
539	S	34.4	Very low	70.3	Confident	81 Å²	81	83.2 Å²	83.2	57%	0.566	46%	0.458	S	S	*	.			trans	-47.5	134.9	169.3	43.8	0	0	0	0	110.9	D537 T541	D537-S539 PolarHBondContact O-N 3.26Å; D537-S539 VanDerWaalsContact O-N 3.11Å; S539-T541 PolarHBondContact O-N 2.95Å; S539-T541 PolarHBondContact OG-OG1 3.09Å
540	P	37.4	Very low	68.3	Low	129 Å²	129	89.2 Å²	89.2	84%	0.838	49%	0.491	S	S	*	.			trans	-75	74	163.2	32.6	-29.9	0	0	0	107.7
541	T	38.5	Very low	66.1	Low	109 Å²	109	90.7 Å²	90.7	67%	0.669	51%	0.509	S	S	*	.			trans	-120.9	85.7	157.6	40.6	0	0	0	0	105.9	S539	S539-T541 PolarHBondContact O-N 2.95Å; S539-T541 PolarHBondContact OG-OG1 3.09Å
542	Q	29.1	Very low	63.4	Low	270 Å²	270	95.7 Å²	95.7	100%	1.262	54%	0.541	S	S	*	.			trans	-166.1	0	135.8	-103	169.7	40	0	0	109.7

Retrieved 542 of 542 residues in 416.8 ms (Link to these results)

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