A0A096N759_PAPAN Loading...

Transcriptional regulator Kaiso

AlphaFold DB (A0A2K5KLL4), UniProt , Accession A0A096N759, Species PAPAN (Papio anubis, Olive baboon), Gene ZBTB33, Length 673 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	48.9	Very low	81.9	Confident	245 Å²	245	158.2 Å²	158.2	100%	1.207	84%	0.835	S	S	*	*				0	136	0	-57.7	-178.6	-168	0	0	106.5
2	E	62.7	Low	82.8	Confident	187 Å²	187	156.4 Å²	156.4	87%	0.874	82%	0.824	S	S	*	*			trans	-75.4	138.9	178.6	-68.3	159.2	130.7	0	0	110.4	R4	E2-R4 PolarHBondContact O-N 2.99Å
3	S	73.2	Confident	83.6	Confident	118 Å²	118	156.2 Å²	156.2	83%	0.825	82%	0.816	S	S	*	*			trans	-73.5	90.2	178.7	35.1	0	0	0	0	110.4	K5	S3-K5 PolarHBondContact O-N 3.33Å
4	R	81.3	Confident	84.4	Confident	245 Å²	245	155.4 Å²	155.4	93%	0.925	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-56.7	120.6	170.9	-68.1	-173.8	175.8	-167	-2.5	109.3	E2	E2-R4 PolarHBondContact O-N 2.99Å
5	K	82.4	Confident	84.9	Confident	199 Å²	199	150.5 Å²	150.5	87%	0.865	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-70.4	127.9	176.9	-64	-178.4	178.9	-178.2	0	109.2	S3	S3-K5 PolarHBondContact O-N 3.33Å
6	L	88.2	Confident	85.3	Confident	168 Å²	168	143.3 Å²	143.3	88%	0.88	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-84.1	133.6	164.9	-178.6	64.2	0	0	0	108.1
7	I	89.6	Confident	85.8	Confident	148 Å²	148	139.1 Å²	139.1	76%	0.759	74%	0.742	S	S	*	*			trans	-108.2	133.2	170	-59.2	176.2	0	0	0	106.9
8	S	92.3	Very high	86.3	Confident	111 Å²	111	135.4 Å²	135.4	78%	0.776	72%	0.722	S	S	*	*			trans	-122.2	139.9	169	-170.6	0	0	0	0	108
9	A	92.7	Very high	86.7	Confident	95 Å²	95	129.8 Å²	129.8	79%	0.785	69%	0.692	S	S	*	*			trans	-138.8	143.3	177	0	0	0	0	0	108.8
10	T	94.1	Very high	87	Confident	119 Å²	119	128.5 Å²	128.5	73%	0.73	69%	0.685	S	S	*	*			trans	-128.1	117.9	-179.1	-55.4	0	0	0	0	108.4
11	D	95	Very high	87.4	Confident	105 Å²	105	124.7 Å²	124.7	56%	0.561	67%	0.668	S	S	*	*			trans	-81.4	116.3	171.2	-175.4	-16.9	0	0	0	109.3	Q13 Y14	D11-Q13 WeakPolarHBondContact OD1-CA 3.28Å; D11-Q13 PolarHBondContact OD1-N 3.08Å; D11-Y14 PolarHBondContact OD1-N 3.5Å
12	I	93.6	Very high	89.6	Confident	137 Å²	137	114.2 Å²	114.2	70%	0.703	62%	0.617	S	S	*	*	S	Bend	trans	-84.9	-14.3	179.4	62.5	173.8	0	0	0	113.3
13	Q	93.4	Very high	91	Very high	153 Å²	153	108 Å²	108	72%	0.715	59%	0.59	S	S	*	*	S	Bend	trans	-96.1	-27.2	179.7	-60.8	-172	-5.6	0	0	112.1	D11 S15 G16 S17	D11-Q13 WeakPolarHBondContact OD1-CA 3.28Å; D11-Q13 PolarHBondContact OD1-N 3.08Å; Q13-S15 VanDerWaalsContact C-N 3.29Å; Q13-S15 PolarHBondContact O-N 3.47Å; Q13-G16 PolarHBondContact O-N 2.87Å; Q13-G16 VanDerWaalsContact O-N 3.13Å; Q13-S17 PolarHBondContact O-N 3.46Å
14	Y	94.1	Very high	92	Very high	146 Å²	146	108.4 Å²	108.4	57%	0.573	58%	0.579	S	S	*	*	H	α-helix	trans	-46	-47.7	-179.2	178.3	-102.2	0	0	0	113.9	D11 S17 L18	D11-Y14 PolarHBondContact OD1-N 3.5Å; Y14-S17 PolarHBondContact O-N 3.01Å; Y14-L18 HydrophobicContact CE1-CD2 3.91Å; Y14-L18 VanDerWaalsContact O-CB 3.23Å; Y14-L18 WeakPolarHBondContact O-CB 3.45Å; Y14-L18 PolarHBondContact O-N 3.2Å
15	S	91.9	Very high	92.6	Very high	81 Å²	81	99.5 Å²	99.5	57%	0.566	55%	0.548	S	S	*	.	H	α-helix	trans	-65.4	-40.4	-176.6	55.6	0	0	0	0	113	Q13 L19	Q13-S15 VanDerWaalsContact C-N 3.29Å; Q13-S15 PolarHBondContact O-N 3.47Å; S15-L19 WeakPolarHBondContact O-CB 3.49Å; S15-L19 PolarHBondContact O-N 2.97Å; S15-L19 VanDerWaalsContact O-N 3.1Å
16	G	90.7	Very high	93.1	Very high	35 Å²	35	91.8 Å²	91.8	36%	0.361	51%	0.513	S	S	.	.	H	α-helix	trans	-70.4	-41.7	175.8	0	0	0	0	0	112.4	Q13 L19 N20	Q13-G16 PolarHBondContact O-N 2.87Å; Q13-G16 VanDerWaalsContact O-N 3.13Å; G16-L19 PolarHBondContact O-N 3.16Å; G16-N20 VanDerWaalsContact O-CG 3.29Å; G16-N20 PolarHBondContact O-N 3.06Å; G16-N20 PolarHBondContact O-ND2 2.85Å
17	S	93.9	Very high	93.2	Very high	73 Å²	73	87 Å²	87	51%	0.51	51%	0.505	S	S	.	.	H	α-helix	trans	-61.1	-50.2	175.9	-169.3	0	0	0	0	111.4	Q13 Y14 L19 N20 S21	Q13-S17 PolarHBondContact O-N 3.46Å; Y14-S17 PolarHBondContact O-N 3.01Å; S17-L19 VanDerWaalsContact C-N 3.33Å; S17-L19 PolarHBondContact O-N 3.41Å; S17-N20 PolarHBondContact O-N 3.37Å; S17-S21 PolarHBondContact O-N 2.86Å; S17-S21 PolarHBondContact O-OG 3.11Å
18	L	94.7	Very high	93.2	Very high	72 Å²	72	86.5 Å²	86.5	38%	0.377	50%	0.499	S	S	.	.	H	α-helix	trans	-57.2	-43.2	176	176.5	61.9	0	0	0	112.3	Y14 S21 L22	Y14-L18 HydrophobicContact CE1-CD2 3.91Å; Y14-L18 VanDerWaalsContact O-CB 3.23Å; Y14-L18 WeakPolarHBondContact O-CB 3.45Å; Y14-L18 PolarHBondContact O-N 3.2Å; L18-S21 PolarHBondContact O-N 2.93Å; L18-L22 HydrophobicContact CD1-CD1 4.16Å; L18-L22 HydrophobicContact CD1-CG 4.32Å; L18-L22 HydrophobicContact CG-CD1 3.99Å; L18-L22 WeakPolarHBondContact O-CB 3.41Å; L18-L22 VanDerWaalsContact O-CG 3.3Å; L18-L22 WeakPolarHBondContact O-CG 3.16Å; L18-L22 PolarHBondContact O-N 2.86Å
19	L	94.3	Very high	93.1	Very high	30 Å²	30	82 Å²	82	16%	0.157	47%	0.47	C	S	.	.	H	α-helix	trans	-67.3	-38.8	-179	-168.4	60.9	0	0	0	112.2	S15 G16 S17 L22 N23 S88	S15-L19 WeakPolarHBondContact O-CB 3.49Å; S15-L19 PolarHBondContact O-N 2.97Å; S15-L19 VanDerWaalsContact O-N 3.1Å; G16-L19 PolarHBondContact O-N 3.16Å; S17-L19 VanDerWaalsContact C-N 3.33Å; S17-L19 PolarHBondContact O-N 3.41Å; L19-L22 PolarHBondContact O-N 2.8Å; L19-N23 PolarHBondContact O-N 2.94Å; L19-S88 VanDerWaalsContact CD2-OG 3.3Å; L19-S88 WeakPolarHBondContact CD2-OG 3.23Å
20	N	93.4	Very high	93	Very high	103 Å²	103	81.7 Å²	81.7	55%	0.551	46%	0.455	S	S	*	.	H	α-helix	trans	-61	-47.6	172.6	-69.8	-25.6	0	0	0	111.4	G16 S17 L22 N23 E24	G16-N20 VanDerWaalsContact O-CG 3.29Å; G16-N20 PolarHBondContact O-N 3.06Å; G16-N20 PolarHBondContact O-ND2 2.85Å; S17-N20 PolarHBondContact O-N 3.37Å; N20-L22 VanDerWaalsContact C-N 3.31Å; N20-L22 PolarHBondContact O-N 2.84Å; N20-N23 WeakPolarHBondContact O-CB 3.36Å; N20-N23 PolarHBondContact O-N 2.91Å; N20-N23 VanDerWaalsContact O-N 3.09Å; N20-E24 PolarHBondContact O-N 2.95Å
21	S	95.3	Very high	92.8	Very high	48 Å²	48	83.7 Å²	83.7	34%	0.336	45%	0.453	S	S	.	.	H	α-helix	trans	-61.8	-36.8	176.8	-58.6	0	0	0	0	112.8	S17 L18 N23 E24 Q25	S17-S21 PolarHBondContact O-N 2.86Å; S17-S21 PolarHBondContact O-OG 3.11Å; L18-S21 PolarHBondContact O-N 2.93Å; S21-N23 VanDerWaalsContact C-N 3.31Å; S21-N23 PolarHBondContact O-N 2.81Å; S21-E24 PolarHBondContact O-N 2.91Å; S21-Q25 WeakPolarHBondContact O-CB 3.42Å; S21-Q25 VanDerWaalsContact O-CG 3.27Å; S21-Q25 WeakPolarHBondContact O-CG 3.3Å; S21-Q25 PolarHBondContact O-N 2.91Å
22	L	94.4	Very high	92.7	Very high	26 Å²	26	79.7 Å²	79.7	14%	0.136	43%	0.433	C	S	.	.	H	α-helix	trans	-66.9	-31.7	174.5	-74.7	166.6	0	0	0	112.5	L18 L19 N20 R26 I49 Y86	L18-L22 HydrophobicContact CD1-CD1 4.16Å; L18-L22 HydrophobicContact CD1-CG 4.32Å; L18-L22 HydrophobicContact CG-CD1 3.99Å; L18-L22 WeakPolarHBondContact O-CB 3.41Å; L18-L22 VanDerWaalsContact O-CG 3.3Å; L18-L22 WeakPolarHBondContact O-CG 3.16Å; L18-L22 PolarHBondContact O-N 2.86Å; L19-L22 PolarHBondContact O-N 2.8Å; N20-L22 VanDerWaalsContact C-N 3.31Å; N20-L22 PolarHBondContact O-N 2.84Å; L22-R26 WeakPolarHBondContact O-CB 3.48Å; L22-R26 PolarHBondContact O-N 3.25Å; L22-I49 HydrophobicContact CD1-CD1 3.8Å; L22-I49 HydrophobicContact CD1-CG1 4.43Å; L22-Y86 HydrophobicContact CB-CD1 4.15Å; L22-Y86 HydrophobicContact CB-CE1 4.08Å; L22-Y86 WeakPolarHBondContact O-CE1 3.13Å
23	N	93.6	Very high	92.7	Very high	57 Å²	57	76.8 Å²	76.8	31%	0.305	42%	0.419	S	S	.	.	H	α-helix	trans	-73	-38.7	175	-166.5	39.4	0	0	0	112.2	L19 N20 S21 R26 G27 Y86	L19-N23 PolarHBondContact O-N 2.94Å; N20-N23 WeakPolarHBondContact O-CB 3.36Å; N20-N23 PolarHBondContact O-N 2.91Å; N20-N23 VanDerWaalsContact O-N 3.09Å; S21-N23 VanDerWaalsContact C-N 3.31Å; S21-N23 PolarHBondContact O-N 2.81Å; N23-R26 WeakPolarHBondContact O-CB 3.38Å; N23-R26 PolarHBondContact O-N 3.27Å; N23-R26 PolarHBondContact OD1-NH1 3.39Å; N23-G27 PolarHBondContact O-N 3.18Å; N23-Y86 HydrophobicContact CB-CD1 4.3Å; N23-Y86 WeakPolarHBondContact CB-O 3.46Å; N23-Y86 WeakPolarHBondContact OD1-CB 3.46Å
24	E	94.2	Very high	92.7	Very high	126 Å²	126	69.5 Å²	69.5	59%	0.589	39%	0.385	S	S	*	.	H	α-helix	trans	-62.5	-48.4	172.2	-174.6	176.9	-170.6	0	0	111	N20 S21 R26 G27 H28	N20-E24 PolarHBondContact O-N 2.95Å; S21-E24 PolarHBondContact O-N 2.91Å; E24-R26 VanDerWaalsContact C-N 3.33Å; E24-R26 PolarHBondContact O-N 2.79Å; E24-G27 WeakPolarHBondContact O-CA 3.49Å; E24-G27 PolarHBondContact O-N 3.05Å; E24-H28 PolarHBondContact O-CD2 2.9Å; E24-H28 VanDerWaalsContact O-CD2 3.24Å; E24-H28 PolarHBondContact O-N 3.3Å; E24-H28 VanDerWaalsContact O-N 3.07Å
25	Q	93.2	Very high	92.7	Very high	58 Å²	58	64.2 Å²	64.2	27%	0.271	37%	0.368	S	S	.	.	H	α-helix	trans	-56.7	-44	173.4	-73.3	171.7	12.6	0	0	112.1	S21 G27 H28 G29 L30	S21-Q25 WeakPolarHBondContact O-CB 3.42Å; S21-Q25 VanDerWaalsContact O-CG 3.27Å; S21-Q25 WeakPolarHBondContact O-CG 3.3Å; S21-Q25 PolarHBondContact O-N 2.91Å; Q25-G27 VanDerWaalsContact C-N 3.34Å; Q25-G27 PolarHBondContact O-N 3.21Å; Q25-H28 CarbonylContact O-C 3.59Å; Q25-H28 PolarHBondContact O-N 3.46Å; Q25-G29 PolarHBondContact O-N 3.36Å; Q25-L30 HydrophobicContact CB-CB 4.13Å; Q25-L30 HydrophobicContact CG-CB 4.35Å; Q25-L30 HydrophobicContact CG-CD1 4.47Å; Q25-L30 PolarHBondContact O-N 3.4Å
26	R	93.1	Very high	92.8	Very high	37 Å²	37	60.3 Å²	60.3	14%	0.14	34%	0.341	C	S	.	.	H	α-helix	trans	-57	-44.5	172.2	165.2	-172.7	166.6	-131	3.2	111.8	L22 N23 E24 H28 G29 N83 Y86	L22-R26 WeakPolarHBondContact O-CB 3.48Å; L22-R26 PolarHBondContact O-N 3.25Å; N23-R26 WeakPolarHBondContact O-CB 3.38Å; N23-R26 PolarHBondContact O-N 3.27Å; N23-R26 PolarHBondContact OD1-NH1 3.39Å; E24-R26 VanDerWaalsContact C-N 3.33Å; E24-R26 PolarHBondContact O-N 2.79Å; R26-H28 VanDerWaalsContact C-N 3.31Å; R26-H28 PolarHBondContact O-N 2.86Å; R26-G29 PolarHBondContact O-N 3.17Å; R26-N83 PolarHBondContact NH1-OD1 2.86Å; R26-N83 PolarHBondContact NH2-OD1 3.16Å; R26-N83 VanDerWaalsContact NH2-OD1 3.13Å; R26-Y86 HydrophobicContact CB-CD1 4.3Å; R26-Y86 HydrophobicContact CB-CE1 4.08Å
27	G	89.4	Confident	92.9	Very high	68 Å²	68	60.1 Å²	60.1	70%	0.701	33%	0.331	S	S	*	.	H	α-helix	trans	-59.4	-40.1	178.2	0	0	0	0	0	113.1	N23 E24 Q25 G29	N23-G27 PolarHBondContact O-N 3.18Å; E24-G27 WeakPolarHBondContact O-CA 3.49Å; E24-G27 PolarHBondContact O-N 3.05Å; Q25-G27 VanDerWaalsContact C-N 3.34Å; Q25-G27 PolarHBondContact O-N 3.21Å; G27-G29 VanDerWaalsContact C-N 3.33Å
28	H	90.8	Very high	92.9	Very high	137 Å²	137	56.6 Å²	56.6	63%	0.634	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-3.1	174.3	-65.4	-68.2	0	0	0	114.1	E24 Q25 R26 L30	E24-H28 PolarHBondContact O-CD2 2.9Å; E24-H28 VanDerWaalsContact O-CD2 3.24Å; E24-H28 PolarHBondContact O-N 3.3Å; E24-H28 VanDerWaalsContact O-N 3.07Å; Q25-H28 CarbonylContact O-C 3.59Å; Q25-H28 PolarHBondContact O-N 3.46Å; R26-H28 VanDerWaalsContact C-N 3.31Å; R26-H28 PolarHBondContact O-N 2.86Å; H28-L30 HydrophobicContact CB-CD1 4.05Å; H28-L30 HydrophobicContact CB-CG 3.86Å; H28-L30 PolarHBondContact O-N 3.2Å
29	G	89.1	Confident	92.7	Very high	16 Å²	16	58.4 Å²	58.4	17%	0.165	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	12.6	-174.8	0	0	0	0	0	114.7	Q25 R26 G27	Q25-G29 PolarHBondContact O-N 3.36Å; R26-G29 PolarHBondContact O-N 3.17Å; G27-G29 VanDerWaalsContact C-N 3.33Å
30	L	90.2	Very high	92.5	Very high	89 Å²	89	63.5 Å²	63.5	47%	0.466	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	141.2	176.2	-62.7	174.4	0	0	0	109.9	Q25 H28 C32 H46	Q25-L30 HydrophobicContact CB-CB 4.13Å; Q25-L30 HydrophobicContact CG-CB 4.35Å; Q25-L30 HydrophobicContact CG-CD1 4.47Å; Q25-L30 PolarHBondContact O-N 3.4Å; H28-L30 HydrophobicContact CB-CD1 4.05Å; H28-L30 HydrophobicContact CB-CG 3.86Å; H28-L30 PolarHBondContact O-N 3.2Å; L30-C32 PolarHBondContact O-N 3.06Å; L30-C32 PolarHBondContact O-SG 2.78Å; L30-H46 PolarHBondContact O-CE1 2.82Å; L30-H46 PolarHBondContact O-NE2 3Å
31	F	91.3	Very high	92.3	Very high	160 Å²	160	63.5 Å²	63.5	70%	0.702	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	10.7	-179.4	-51.1	-68.5	0	0	0	116.7	D33 H46	F31-D33 PolarHBondContact O-N 2.93Å; F31-D33 VanDerWaalsContact O-N 3.17Å; F31-H46 PolarHBondContact O-CD2 2.92Å
32	C	93.3	Very high	92.3	Very high	21 Å²	21	68.8 Å²	68.8	14%	0.142	35%	0.35	C	S	.	.			trans	-77.4	100.7	178.3	-68.8	0	0	0	0	110.5	L30 R44 A45 H46	L30-C32 PolarHBondContact O-N 3.06Å; L30-C32 PolarHBondContact O-SG 2.78Å; C32-R44 HydrophobicContact CB-CB 3.89Å; C32-A45 CarbonylContact C-O 3.53Å; C32-A45 VanDerWaalsContact CA-O 3.28Å; C32-A45 WeakPolarHBondContact CA-O 3.41Å; C32-A45 WeakPolarHBondContact CB-O 3.33Å; C32-H46 VanDerWaalsContact SG-CE1 3.58Å
33	D	91.9	Very high	92.3	Very high	76 Å²	76	68.5 Å²	68.5	41%	0.406	35%	0.348	S	S	.	.			trans	-89.1	-1.3	-178.9	67.3	-39.7	0	0	0	113.9	F31 A45 K47	F31-D33 PolarHBondContact O-N 2.93Å; F31-D33 VanDerWaalsContact O-N 3.17Å; D33-A45 PolarHBondContact N-O 3.07Å; D33-K47 VanDerWaalsContact CG-CB 3.47Å; D33-K47 WeakPolarHBondContact OD1-CB 3.26Å; D33-K47 PolarHBondContact OD1-N 3.47Å; D33-K47 WeakPolarHBondContact OD2-CB 3.27Å; D33-K47 WeakPolarHBondContact OD2-CD 3.46Å
34	V	93.8	Very high	92.3	Very high	1 Å²	1	72.8 Å²	72.8	1%	0.006	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	141.6	173.3	173.4	0	0	0	0	111.8	V36 A45 K47 F61 Q66 V68	V34-V36 HydrophobicContact CG1-CG2 4.06Å; V34-A45 PolarHBondContact N-O 3.06Å; V34-A45 PolarHBondContact O-N 3.14Å; V34-A45 VanDerWaalsContact O-O 3.12Å; V34-K47 HydrophobicContact CG2-CB 3.81Å; V34-K47 HydrophobicContact CG2-CD 4.2Å; V34-K47 HydrophobicContact CG2-CG 4.05Å; V34-F61 HydrophobicContact CB-CE1 4.38Å; V34-F61 HydrophobicContact CB-CZ 4.3Å; V34-F61 HydrophobicContact CG1-CE1 3.86Å; V34-F61 HydrophobicContact CG1-CZ 3.81Å; V34-F61 HydrophobicContact CG2-CD1 4.37Å; V34-F61 HydrophobicContact CG2-CE1 3.69Å; V34-F61 HydrophobicContact CG2-CZ 3.93Å; V34-Q66 CarbonylContact C-O 3.41Å; V34-Q66 WeakPolarHBondContact CA-O 3.13Å; V34-V68 HydrophobicContact CG1-CG2 4.37Å
35	T	94.1	Very high	92.3	Very high	34 Å²	34	66.8 Å²	66.8	21%	0.209	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	118.9	162.6	-59.6	0	0	0	0	110	I37 K42 F43 Q66 V67 V68	T35-I37 HydrophobicContact CG2-CG1 4.41Å; T35-K42 HydrophobicContact CG2-CB 4.04Å; T35-F43 CarbonylContact C-O 3.5Å; T35-F43 WeakPolarHBondContact CA-O 3.37Å; T35-Q66 PolarHBondContact N-O 3.01Å; T35-V67 VanDerWaalsContact O-CA 3.31Å; T35-V67 WeakPolarHBondContact O-CA 3.21Å; T35-V68 PolarHBondContact O-N 3.44Å
36	V	94.1	Very high	92.4	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121.8	170.2	-171.1	0	0	0	0	108.3	V34 V38 F43 L50 F57 V68 L70 F78	V34-V36 HydrophobicContact CG1-CG2 4.06Å; V36-V38 HydrophobicContact CG1-CG2 3.86Å; V36-F43 HydrophobicContact CB-CB 4.49Å; V36-F43 PolarHBondContact N-O 2.85Å; V36-F43 PolarHBondContact O-N 2.8Å; V36-L50 HydrophobicContact CG2-CD1 4.06Å; V36-F57 HydrophobicContact CG1-CZ 4.3Å; V36-F57 HydrophobicContact CG2-CE1 3.98Å; V36-F57 HydrophobicContact CG2-CZ 4.04Å; V36-V68 HydrophobicContact CG1-CB 4.41Å; V36-V68 HydrophobicContact CG1-CG1 4.21Å; V36-V68 HydrophobicContact CG2-CB 4.47Å; V36-L70 HydrophobicContact CG1-CD1 3.64Å; V36-L70 HydrophobicContact CG1-CG 3.76Å; V36-F78 HydrophobicContact CB-CE1 4.03Å; V36-F78 HydrophobicContact CB-CZ 4.02Å; V36-F78 HydrophobicContact CG1-CE1 3.94Å; V36-F78 HydrophobicContact CG1-CE2 4.39Å; V36-F78 HydrophobicContact CG1-CZ 3.74Å; V36-F78 HydrophobicContact CG2-CZ 4.18Å
37	I	93.3	Very high	92.4	Very high	30 Å²	30	65.3 Å²	65.3	15%	0.154	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	129.8	172.8	-54.1	179.3	0	0	0	107.1	T35 R41 K42 V67 V68 E69 L70	T35-I37 HydrophobicContact CG2-CG1 4.41Å; I37-R41 WeakPolarHBondContact CA-O 3.35Å; I37-K42 HydrophobicContact CG1-CG 4.25Å; I37-V67 HydrophobicContact CD1-CG1 3.63Å; I37-V67 HydrophobicContact CG1-CG1 4.05Å; I37-V68 PolarHBondContact N-O 3.14Å; I37-E69 HydrophobicContact CB-CB 3.96Å; I37-E69 HydrophobicContact CG2-CB 4.45Å; I37-L70 PolarHBondContact O-N 3.28Å
38	V	94.3	Very high	92.6	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	118.8	177.3	-167.2	0	0	0	0	107	V36 D40 R41 F43 L70 I73 A75 F78	V36-V38 HydrophobicContact CG1-CG2 3.86Å; V38-D40 PolarHBondContact O-N 2.71Å; V38-R41 PolarHBondContact N-O 2.95Å; V38-R41 PolarHBondContact O-N 3.12Å; V38-F43 HydrophobicContact CB-CD2 4.4Å; V38-F43 HydrophobicContact CB-CE2 4.04Å; V38-F43 HydrophobicContact CG2-CD2 4.02Å; V38-F43 HydrophobicContact CG2-CE2 4.08Å; V38-L70 HydrophobicContact CG1-CB 4.44Å; V38-L70 HydrophobicContact CG2-CB 4.1Å; V38-L70 HydrophobicContact CG2-CD1 4.1Å; V38-L70 HydrophobicContact CG2-CG 4.4Å; V38-I73 WeakPolarHBondContact CG1-O 3.47Å; V38-A75 HydrophobicContact CB-CB 4.18Å; V38-A75 HydrophobicContact CG1-CB 4.17Å; V38-A75 WeakPolarHBondContact O-CB 3.38Å; V38-F78 HydrophobicContact CG1-CB 4.18Å; V38-F78 HydrophobicContact CG2-CB 4.1Å; V38-F78 HydrophobicContact CG2-CD1 3.54Å; V38-F78 HydrophobicContact CG2-CD2 4.36Å; V38-F78 HydrophobicContact CG2-CE1 4.05Å; V38-F78 HydrophobicContact CG2-CG 3.72Å
39	E	90.3	Very high	92.8	Very high	109 Å²	109	63.4 Å²	63.4	51%	0.509	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	-121.3	-170.1	-58.9	173.4	135.2	0	0	111	R74 A75	E39-R74 WeakPolarHBondContact OE2-CA 3.26Å; E39-A75 HydrophobicContact CB-CB 4.38Å; E39-A75 WeakPolarHBondContact OE2-CB 3.08Å; E39-A75 PolarHBondContact OE2-N 3.39Å
40	D	88.7	Confident	93.1	Very high	138 Å²	138	62.7 Å²	62.7	74%	0.738	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-6.6	177.3	67.5	-39.1	0	0	0	113.9	V38	V38-D40 PolarHBondContact O-N 2.71Å
41	R	91.2	Very high	93.3	Very high	103 Å²	103	59.9 Å²	59.9	39%	0.389	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	142.4	-168	-72	170.8	66.9	-145.9	-1.2	112.9	I37 V38 F43 A75	I37-R41 WeakPolarHBondContact CA-O 3.35Å; V38-R41 PolarHBondContact N-O 2.95Å; V38-R41 PolarHBondContact O-N 3.12Å; R41-F43 HydrophobicContact CB-CE2 3.7Å; R41-F43 HydrophobicContact CB-CZ 4.06Å; R41-A75 HydrophobicContact CB-CB 4Å; R41-A75 HydrophobicContact CG-CB 4.34Å; R41-A75 PolarHBondContact NH1-O 3.45Å
42	K	93.5	Very high	93.4	Very high	159 Å²	159	56.3 Å²	56.3	69%	0.691	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	122	-178.2	-55.6	-171.7	-178.8	-179.6	0	110.3	T35 I37	T35-K42 HydrophobicContact CG2-CB 4.04Å; I37-K42 HydrophobicContact CG1-CG 4.25Å
43	F	94.4	Very high	93.5	Very high	19 Å²	19	57.4 Å²	57.4	8%	0.083	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	110.5	-177	-62	-92.3	0	0	0	109.9	T35 V36 V38 R41 A75 F78 A79 L82	T35-F43 CarbonylContact C-O 3.5Å; T35-F43 WeakPolarHBondContact CA-O 3.37Å; V36-F43 HydrophobicContact CB-CB 4.49Å; V36-F43 PolarHBondContact N-O 2.85Å; V36-F43 PolarHBondContact O-N 2.8Å; V38-F43 HydrophobicContact CB-CD2 4.4Å; V38-F43 HydrophobicContact CB-CE2 4.04Å; V38-F43 HydrophobicContact CG2-CD2 4.02Å; V38-F43 HydrophobicContact CG2-CE2 4.08Å; R41-F43 HydrophobicContact CB-CE2 3.7Å; R41-F43 HydrophobicContact CB-CZ 4.06Å; F43-A75 HydrophobicContact CE2-CB 4.15Å; F43-A75 HydrophobicContact CZ-CB 4.22Å; F43-A75 WeakPolarHBondContact CZ-O 3.38Å; F43-F78 HydrophobicContact CB-CD1 4.45Å; F43-F78 HydrophobicContact CB-CE1 3.92Å; F43-F78 HydrophobicContact CD1-CD1 4.23Å; F43-F78 HydrophobicContact CD1-CE1 4.41Å; F43-F78 AromaticContact CD2-CD1 3.68Å; F43-F78 HydrophobicContact CD2-CD1 3.68Å; F43-F78 AromaticContact CD2-CE1 3.95Å; F43-F78 HydrophobicContact CD2-CE1 3.95Å; F43-F78 HydrophobicContact CE1-CD1 4.4Å; F43-F78 AromaticContact CE2-CD1 3.89Å; F43-F78 HydrophobicContact CE2-CD1 3.89Å; F43-F78 AromaticContact CG-CD1 3.86Å; F43-F78 HydrophobicContact CG-CD1 3.86Å; F43-F78 AromaticContact CG-CE1 3.84Å; F43-F78 HydrophobicContact CG-CE1 3.84Å; F43-F78 HydrophobicContact CZ-CD1 4.23Å; F43-A79 HydrophobicContact CE1-CB 3.81Å; F43-A79 HydrophobicContact CZ-CB 4.18Å; F43-L82 HydrophobicContact CB-CD2 3.93Å; F43-L82 HydrophobicContact CD1-CD2 4.09Å; F43-L82 HydrophobicContact CG-CD2 4.35Å
44	R	94.4	Very high	93.6	Very high	148 Å²	148	54 Å²	54	56%	0.558	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	137.2	168.7	-69.3	-178.9	179.5	-117.6	-0.6	109.5	C32	C32-R44 HydrophobicContact CB-CB 3.89Å
45	A	95.1	Very high	93.6	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	165.9	179.9	0	0	0	0	0	111.5	C32 D33 V34 L50 L82	C32-A45 CarbonylContact C-O 3.53Å; C32-A45 VanDerWaalsContact CA-O 3.28Å; C32-A45 WeakPolarHBondContact CA-O 3.41Å; C32-A45 WeakPolarHBondContact CB-O 3.33Å; D33-A45 PolarHBondContact N-O 3.07Å; V34-A45 PolarHBondContact N-O 3.06Å; V34-A45 PolarHBondContact O-N 3.14Å; V34-A45 VanDerWaalsContact O-O 3.12Å; A45-L50 HydrophobicContact CB-CD1 3.68Å; A45-L50 HydrophobicContact CB-CD2 4.49Å; A45-L50 HydrophobicContact CB-CG 4.05Å; A45-L82 HydrophobicContact CB-CD1 4.4Å
46	H	94.9	Very high	93.5	Very high	15 Å²	15	59.1 Å²	59.1	7%	0.069	30%	0.299	C	S	.	.			trans	-95.6	121.3	175.1	-55.5	71.3	0	0	0	109.3	L30 F31 C32 N48 I49 L50 Y86	L30-H46 PolarHBondContact O-CE1 2.82Å; L30-H46 PolarHBondContact O-NE2 3Å; F31-H46 PolarHBondContact O-CD2 2.92Å; C32-H46 VanDerWaalsContact SG-CE1 3.58Å; H46-N48 VanDerWaalsContact C-N 3.27Å; H46-N48 PolarHBondContact O-N 3.1Å; H46-I49 HydrophobicContact CB-CB 4.31Å; H46-I49 HydrophobicContact CB-CG1 3.87Å; H46-I49 PolarHBondContact O-N 3.42Å; H46-I49 VanDerWaalsContact O-N 3.1Å; H46-L50 PolarHBondContact O-N 3.19Å; H46-L50 VanDerWaalsContact O-N 3.1Å; H46-Y86 VanDerWaalsContact CB-OH 3.26Å; H46-Y86 WeakPolarHBondContact CB-OH 3.26Å; H46-Y86 PolarHBondContact N-OH 3.14Å; H46-Y86 AromaticContact ND1-CE1 3.84Å; H46-Y86 AromaticContact ND1-CZ 3.79Å; H46-Y86 PolarHBondContact ND1-OH 2.64Å
47	K	93.2	Very high	93.4	Very high	48 Å²	48	59.1 Å²	59.1	21%	0.209	30%	0.299	C	S	.	.	H	α-helix	trans	-53.5	-41.5	-178.7	-171.9	176.1	-174.7	168.1	0	113.2	D33 V34 I49 S51 F61	D33-K47 VanDerWaalsContact CG-CB 3.47Å; D33-K47 WeakPolarHBondContact OD1-CB 3.26Å; D33-K47 PolarHBondContact OD1-N 3.47Å; D33-K47 WeakPolarHBondContact OD2-CB 3.27Å; D33-K47 WeakPolarHBondContact OD2-CD 3.46Å; V34-K47 HydrophobicContact CG2-CB 3.81Å; V34-K47 HydrophobicContact CG2-CD 4.2Å; V34-K47 HydrophobicContact CG2-CG 4.05Å; K47-I49 PolarHBondContact O-N 3.34Å; K47-S51 WeakPolarHBondContact O-CB 3.24Å; K47-S51 PolarHBondContact O-N 3.17Å; K47-F61 HydrophobicContact CD-CB 4.47Å; K47-F61 HydrophobicContact CD-CD1 4.44Å; K47-F61 HydrophobicContact CD-CG 4.31Å; K47-F61 VanDerWaalsContact CE-CB 3.48Å; K47-F61 HydrophobicContact CG-CB 4.14Å; K47-F61 HydrophobicContact CG-CD1 4.09Å; K47-F61 HydrophobicContact CG-CD2 3.69Å; K47-F61 HydrophobicContact CG-CE1 4.49Å; K47-F61 HydrophobicContact CG-CE2 4.12Å; K47-F61 HydrophobicContact CG-CG 3.7Å
48	N	93.1	Very high	93.4	Very high	129 Å²	129	62.7 Å²	62.7	69%	0.69	32%	0.315	S	S	*	.	H	α-helix	trans	-64.2	-39	-179.6	-67	-18.4	0	0	0	112.2	H46 A52	H46-N48 VanDerWaalsContact C-N 3.27Å; H46-N48 PolarHBondContact O-N 3.1Å; N48-A52 WeakPolarHBondContact O-CB 3.2Å; N48-A52 PolarHBondContact O-N 3.45Å
49	I	95.1	Very high	93.1	Very high	37 Å²	37	69.9 Å²	69.9	19%	0.19	35%	0.349	C	S	.	.	H	α-helix	trans	-72.5	-48.1	179.9	-54.6	-57.5	0	0	0	109.9	L22 H46 K47 S51 A52 S53 I85 Y86	L22-I49 HydrophobicContact CD1-CD1 3.8Å; L22-I49 HydrophobicContact CD1-CG1 4.43Å; H46-I49 HydrophobicContact CB-CB 4.31Å; H46-I49 HydrophobicContact CB-CG1 3.87Å; H46-I49 PolarHBondContact O-N 3.42Å; H46-I49 VanDerWaalsContact O-N 3.1Å; K47-I49 PolarHBondContact O-N 3.34Å; I49-S51 VanDerWaalsContact C-N 3.33Å; I49-S51 PolarHBondContact O-N 2.86Å; I49-A52 PolarHBondContact O-N 3.44Å; I49-A52 VanDerWaalsContact O-N 3.16Å; I49-S53 PolarHBondContact O-N 2.9Å; I49-S53 PolarHBondContact O-OG 2.99Å; I49-I85 HydrophobicContact CG2-CG2 3.68Å; I49-Y86 HydrophobicContact CG1-CE1 4.43Å; I49-Y86 HydrophobicContact CG2-CE1 4.2Å; I49-Y86 HydrophobicContact CG2-CE2 4.15Å
50	L	94.4	Very high	93	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-57.1	-44.6	174	-72.1	-178.3	0	0	0	112.5	V36 A45 H46 A52 S53 S54 F57 F61 L82 I85	V36-L50 HydrophobicContact CG2-CD1 4.06Å; A45-L50 HydrophobicContact CB-CD1 3.68Å; A45-L50 HydrophobicContact CB-CD2 4.49Å; A45-L50 HydrophobicContact CB-CG 4.05Å; H46-L50 PolarHBondContact O-N 3.19Å; H46-L50 VanDerWaalsContact O-N 3.1Å; L50-A52 VanDerWaalsContact C-N 3.31Å; L50-A52 PolarHBondContact O-N 3.41Å; L50-S53 PolarHBondContact O-N 3.47Å; L50-S54 WeakPolarHBondContact O-CB 3.23Å; L50-S54 PolarHBondContact O-N 3.3Å; L50-F57 HydrophobicContact CB-CB 4.06Å; L50-F57 HydrophobicContact CB-CD2 4.1Å; L50-F57 HydrophobicContact CB-CG 4.02Å; L50-F57 HydrophobicContact CD1-CD1 4.28Å; L50-F57 HydrophobicContact CD1-CD2 4.45Å; L50-F57 HydrophobicContact CD1-CE1 4.23Å; L50-F57 HydrophobicContact CD1-CE2 4.4Å; L50-F57 HydrophobicContact CD1-CG 4.4Å; L50-F57 HydrophobicContact CD1-CZ 4.29Å; L50-F57 HydrophobicContact CD2-CD2 3.97Å; L50-F57 HydrophobicContact CD2-CE2 3.9Å; L50-F57 HydrophobicContact CD2-CZ 4.49Å; L50-F57 HydrophobicContact CG-CD2 4.41Å; L50-F61 HydrophobicContact CB-CE2 3.72Å; L50-F61 HydrophobicContact CD1-CE2 3.91Å; L50-F61 HydrophobicContact CD1-CZ 3.91Å; L50-F61 HydrophobicContact CG-CE2 4.49Å; L50-L82 HydrophobicContact CD2-CD1 3.57Å; L50-I85 HydrophobicContact CD2-CD1 4.06Å
51	S	94.3	Very high	93	Very high	30 Å²	30	60.6 Å²	60.6	21%	0.21	30%	0.302	C	S	.	.	H	α-helix	trans	-66.3	-28.5	178.3	-175.3	0	0	0	0	113.5	K47 I49 H58	K47-S51 WeakPolarHBondContact O-CB 3.24Å; K47-S51 PolarHBondContact O-N 3.17Å; I49-S51 VanDerWaalsContact C-N 3.33Å; I49-S51 PolarHBondContact O-N 2.86Å; S51-H58 PolarHBondContact O-ND1 3.38Å; S51-H58 PolarHBondContact OG-ND1 3.49Å
52	A	94.3	Very high	92.5	Very high	86 Å²	86	59 Å²	59	71%	0.711	31%	0.307	S	S	*	.	H	α-helix	trans	-79.2	-35.2	175.2	0	0	0	0	0	112.6	N48 I49 L50	N48-A52 WeakPolarHBondContact O-CB 3.2Å; N48-A52 PolarHBondContact O-N 3.45Å; I49-A52 PolarHBondContact O-N 3.44Å; I49-A52 VanDerWaalsContact O-N 3.16Å; L50-A52 VanDerWaalsContact C-N 3.31Å; L50-A52 PolarHBondContact O-N 3.41Å
53	S	94.4	Very high	91.8	Very high	44 Å²	44	56.2 Å²	56.2	31%	0.308	30%	0.303	S	S	.	.	H	α-helix	trans	-93.9	-12.8	-174.3	-56.7	0	0	0	0	115.1	I49 L50	I49-S53 PolarHBondContact O-N 2.9Å; I49-S53 PolarHBondContact O-OG 2.99Å; L50-S53 PolarHBondContact O-N 3.47Å
54	S	95	Very high	89.9	Confident	3 Å²	3	57.8 Å²	57.8	2%	0.021	32%	0.319	C	S	.	.			trans	-141	125.9	-174.5	159.6	0	0	0	0	111.6	L50 Y56 F57 H58 L108	L50-S54 WeakPolarHBondContact O-CB 3.23Å; L50-S54 PolarHBondContact O-N 3.3Å; S54-Y56 PolarHBondContact OG-N 2.91Å; S54-F57 PolarHBondContact O-N 3.48Å; S54-F57 WeakPolarHBondContact OG-CD2 3.37Å; S54-F57 PolarHBondContact OG-N 2.94Å; S54-H58 WeakPolarHBondContact O-CB 3.37Å; S54-H58 PolarHBondContact O-N 3.46Å; S54-L108 WeakPolarHBondContact CB-O 3.4Å; S54-L108 PolarHBondContact OG-O 3.16Å
55	T	93.6	Very high	88.8	Confident	87 Å²	87	52 Å²	52	53%	0.534	31%	0.306	S	S	.	.	H	α-helix	trans	-69.9	-32.8	176.3	59.4	0	0	0	0	112.3	H58 Q59 G109	T55-H58 WeakPolarHBondContact O-CB 3.17Å; T55-H58 PolarHBondContact O-N 3.13Å; T55-Q59 PolarHBondContact O-N 2.67Å; T55-G109 WeakPolarHBondContact OG1-CA 3.48Å
56	Y	91.8	Very high	88	Confident	56 Å²	56	58.8 Å²	58.8	22%	0.22	34%	0.337	C	S	.	.	H	α-helix	trans	-60.3	-50.8	173	177.3	-90.7	0	0	0	111	S54 H58 Q59 L60 L70 F72 L108	S54-Y56 PolarHBondContact OG-N 2.91Å; Y56-H58 VanDerWaalsContact C-N 3.33Å; Y56-H58 PolarHBondContact O-N 3.34Å; Y56-Q59 PolarHBondContact O-N 3.42Å; Y56-L60 HydrophobicContact CE1-CD2 3.86Å; Y56-L60 WeakPolarHBondContact O-CB 3.3Å; Y56-L60 PolarHBondContact O-N 2.97Å; Y56-L70 HydrophobicContact CE1-CD2 3.65Å; Y56-F72 HydrophobicContact CE1-CZ 4.26Å; Y56-F72 HydrophobicContact CE2-CE1 4.29Å; Y56-F72 AromaticContact CE2-CZ 3.97Å; Y56-F72 HydrophobicContact CE2-CZ 3.97Å; Y56-F72 AromaticContact CZ-CE1 3.98Å; Y56-F72 AromaticContact CZ-CZ 3.82Å; Y56-L108 WeakPolarHBondContact CB-O 3.36Å; Y56-L108 HydrophobicContact CD1-CD2 3.48Å; Y56-L108 VanDerWaalsContact CD1-CD2 3.48Å; Y56-L108 HydrophobicContact CE1-CD2 4.04Å; Y56-L108 HydrophobicContact CG-CD2 3.94Å; Y56-L108 PolarHBondContact N-O 3.03Å
57	F	92.7	Very high	87.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-65.3	-36.5	177.2	-79.9	-58.1	0	0	0	112.1	V36 L50 S54 Q59 L60 F61 V68 L70 F78 L108	V36-F57 HydrophobicContact CG1-CZ 4.3Å; V36-F57 HydrophobicContact CG2-CE1 3.98Å; V36-F57 HydrophobicContact CG2-CZ 4.04Å; L50-F57 HydrophobicContact CB-CB 4.06Å; L50-F57 HydrophobicContact CB-CD2 4.1Å; L50-F57 HydrophobicContact CB-CG 4.02Å; L50-F57 HydrophobicContact CD1-CD1 4.28Å; L50-F57 HydrophobicContact CD1-CD2 4.45Å; L50-F57 HydrophobicContact CD1-CE1 4.23Å; L50-F57 HydrophobicContact CD1-CE2 4.4Å; L50-F57 HydrophobicContact CD1-CG 4.4Å; L50-F57 HydrophobicContact CD1-CZ 4.29Å; L50-F57 HydrophobicContact CD2-CD2 3.97Å; L50-F57 HydrophobicContact CD2-CE2 3.9Å; L50-F57 HydrophobicContact CD2-CZ 4.49Å; L50-F57 HydrophobicContact CG-CD2 4.41Å; S54-F57 PolarHBondContact O-N 3.48Å; S54-F57 WeakPolarHBondContact OG-CD2 3.37Å; S54-F57 PolarHBondContact OG-N 2.94Å; F57-Q59 PolarHBondContact O-N 2.78Å; F57-L60 HydrophobicContact CD1-CD2 4.31Å; F57-L60 PolarHBondContact O-N 3.23Å; F57-F61 HydrophobicContact CB-CD2 3.95Å; F57-F61 HydrophobicContact CB-CE2 3.66Å; F57-F61 HydrophobicContact CD1-CD2 4.44Å; F57-F61 HydrophobicContact CD1-CE1 4.45Å; F57-F61 AromaticContact CD1-CE2 3.57Å; F57-F61 HydrophobicContact CD1-CE2 3.57Å; F57-F61 AromaticContact CD1-CZ 3.55Å; F57-F61 HydrophobicContact CD1-CZ 3.55Å; F57-F61 HydrophobicContact CE1-CZ 4.14Å; F57-F61 AromaticContact CG-CE2 3.89Å; F57-F61 HydrophobicContact CG-CE2 3.89Å; F57-F61 HydrophobicContact CG-CZ 4.33Å; F57-F61 VanDerWaalsContact O-CB 3.22Å; F57-F61 WeakPolarHBondContact O-CB 3.34Å; F57-F61 WeakPolarHBondContact O-CD2 3.3Å; F57-F61 VanDerWaalsContact O-CG 3.24Å; F57-F61 WeakPolarHBondContact O-CG 3.38Å; F57-F61 PolarHBondContact O-N 3.38Å; F57-V68 HydrophobicContact CE1-CG1 4.37Å; F57-L70 HydrophobicContact CZ-CD1 4.05Å; F57-F78 AromaticContact CE2-CE2 3.9Å; F57-F78 HydrophobicContact CE2-CE2 3.9Å; F57-F78 HydrophobicContact CE2-CZ 4.23Å; F57-F78 AromaticContact CZ-CE2 3.76Å; F57-F78 HydrophobicContact CZ-CE2 3.76Å; F57-F78 AromaticContact CZ-CZ 3.88Å; F57-F78 HydrophobicContact CZ-CZ 3.88Å; F57-L108 HydrophobicContact CE2-CD1 4.3Å; F57-L108 HydrophobicContact CE2-CD2 4.09Å; F57-L108 HydrophobicContact CZ-CD2 4.42Å
58	H	92.1	Very high	87.4	Confident	105 Å²	105	56.8 Å²	56.8	49%	0.486	33%	0.33	S	S	.	.	H	α-helix	trans	-57.2	-46.6	173.2	-169.3	82.1	0	0	0	112.6	S51 S54 T55 Y56 S62	S51-H58 PolarHBondContact O-ND1 3.38Å; S51-H58 PolarHBondContact OG-ND1 3.49Å; S54-H58 WeakPolarHBondContact O-CB 3.37Å; S54-H58 PolarHBondContact O-N 3.46Å; T55-H58 WeakPolarHBondContact O-CB 3.17Å; T55-H58 PolarHBondContact O-N 3.13Å; Y56-H58 VanDerWaalsContact C-N 3.33Å; Y56-H58 PolarHBondContact O-N 3.34Å; H58-S62 PolarHBondContact O-N 3.07Å; H58-S62 PolarHBondContact O-OG 2.88Å
59	Q	89.3	Confident	87.3	Confident	151 Å²	151	52.8 Å²	52.8	71%	0.706	31%	0.307	S	S	*	.	H	α-helix	trans	-69.8	-42.6	177.6	-171.5	173.2	3	0	0	111.8	T55 Y56 F57 S62	T55-Q59 PolarHBondContact O-N 2.67Å; Y56-Q59 PolarHBondContact O-N 3.42Å; F57-Q59 PolarHBondContact O-N 2.78Å; Q59-S62 VanDerWaalsContact O-CB 3.23Å; Q59-S62 WeakPolarHBondContact O-CB 3.25Å; Q59-S62 PolarHBondContact O-N 3.49Å; Q59-S62 VanDerWaalsContact O-N 3.12Å
60	L	87.2	Confident	87.1	Confident	38 Å²	38	51 Å²	51	20%	0.199	30%	0.298	C	S	.	.	H	α-helix	trans	-63.8	-43.9	179.2	-174.4	66.3	0	0	0	112.2	Y56 F57 S62 V63 V68	Y56-L60 HydrophobicContact CE1-CD2 3.86Å; Y56-L60 WeakPolarHBondContact O-CB 3.3Å; Y56-L60 PolarHBondContact O-N 2.97Å; F57-L60 HydrophobicContact CD1-CD2 4.31Å; F57-L60 PolarHBondContact O-N 3.23Å; L60-S62 PolarHBondContact O-N 3.36Å; L60-V63 WeakPolarHBondContact O-CB 3.4Å; L60-V63 PolarHBondContact O-N 3.2Å; L60-V68 HydrophobicContact CD2-CB 4.23Å; L60-V68 HydrophobicContact CD2-CG1 3.47Å; L60-V68 VanDerWaalsContact CD2-CG1 3.47Å; L60-V68 HydrophobicContact CD2-CG2 3.66Å; L60-V68 HydrophobicContact CG-CG2 4.47Å
61	F	88.5	Confident	86.7	Confident	14 Å²	14	54.1 Å²	54.1	6%	0.061	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-5	176	-65.1	-36.7	0	0	0	114	V34 K47 L50 F57 V63 V68 K501	V34-F61 HydrophobicContact CB-CE1 4.38Å; V34-F61 HydrophobicContact CB-CZ 4.3Å; V34-F61 HydrophobicContact CG1-CE1 3.86Å; V34-F61 HydrophobicContact CG1-CZ 3.81Å; V34-F61 HydrophobicContact CG2-CD1 4.37Å; V34-F61 HydrophobicContact CG2-CE1 3.69Å; V34-F61 HydrophobicContact CG2-CZ 3.93Å; K47-F61 HydrophobicContact CD-CB 4.47Å; K47-F61 HydrophobicContact CD-CD1 4.44Å; K47-F61 HydrophobicContact CD-CG 4.31Å; K47-F61 VanDerWaalsContact CE-CB 3.48Å; K47-F61 HydrophobicContact CG-CB 4.14Å; K47-F61 HydrophobicContact CG-CD1 4.09Å; K47-F61 HydrophobicContact CG-CD2 3.69Å; K47-F61 HydrophobicContact CG-CE1 4.49Å; K47-F61 HydrophobicContact CG-CE2 4.12Å; K47-F61 HydrophobicContact CG-CG 3.7Å; L50-F61 HydrophobicContact CB-CE2 3.72Å; L50-F61 HydrophobicContact CD1-CE2 3.91Å; L50-F61 HydrophobicContact CD1-CZ 3.91Å; L50-F61 HydrophobicContact CG-CE2 4.49Å; F57-F61 HydrophobicContact CB-CD2 3.95Å; F57-F61 HydrophobicContact CB-CE2 3.66Å; F57-F61 HydrophobicContact CD1-CD2 4.44Å; F57-F61 HydrophobicContact CD1-CE1 4.45Å; F57-F61 AromaticContact CD1-CE2 3.57Å; F57-F61 HydrophobicContact CD1-CE2 3.57Å; F57-F61 AromaticContact CD1-CZ 3.55Å; F57-F61 HydrophobicContact CD1-CZ 3.55Å; F57-F61 HydrophobicContact CE1-CZ 4.14Å; F57-F61 AromaticContact CG-CE2 3.89Å; F57-F61 HydrophobicContact CG-CE2 3.89Å; F57-F61 HydrophobicContact CG-CZ 4.33Å; F57-F61 VanDerWaalsContact O-CB 3.22Å; F57-F61 WeakPolarHBondContact O-CB 3.34Å; F57-F61 WeakPolarHBondContact O-CD2 3.3Å; F57-F61 VanDerWaalsContact O-CG 3.24Å; F57-F61 WeakPolarHBondContact O-CG 3.38Å; F57-F61 PolarHBondContact O-N 3.38Å; F61-V63 CarbonylContact C-O 3.47Å; F61-V63 VanDerWaalsContact O-O 3.05Å; F61-V68 HydrophobicContact CE1-CG2 3.83Å; F61-V68 HydrophobicContact CZ-CG2 4.44Å; F61-K501 PolarHBondContact O-NZ 2.86Å
62	S	82.3	Confident	86.4	Confident	71 Å²	71	56 Å²	56	50%	0.497	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-7.5	162.5	-60.2	0	0	0	0	112.6	H58 Q59 L60 K501	H58-S62 PolarHBondContact O-N 3.07Å; H58-S62 PolarHBondContact O-OG 2.88Å; Q59-S62 VanDerWaalsContact O-CB 3.23Å; Q59-S62 WeakPolarHBondContact O-CB 3.25Å; Q59-S62 PolarHBondContact O-N 3.49Å; Q59-S62 VanDerWaalsContact O-N 3.12Å; L60-S62 PolarHBondContact O-N 3.36Å; S62-K501 PolarHBondContact O-NZ 3.48Å
63	V	78.5	Confident	86.3	Confident	100 Å²	100	52.2 Å²	52.2	61%	0.606	29%	0.292	S	S	*	.	S	Bend	trans	-98.1	164	158.9	-172.1	0	0	0	0	109.8	L60 F61	L60-V63 WeakPolarHBondContact O-CB 3.4Å; L60-V63 PolarHBondContact O-N 3.2Å; F61-V63 CarbonylContact C-O 3.47Å; F61-V63 VanDerWaalsContact O-O 3.05Å
64	A	54.5	Low	86.1	Confident	52 Å²	52	54.1 Å²	54.1	43%	0.43	29%	0.293	S	S	.	.			trans	-84.1	125.9	176.3	0	0	0	0	0	111.2	K501	A64-K501 HydrophobicContact CB-CB 4.36Å; A64-K501 HydrophobicContact CB-CD 4.32Å
65	G	71.6	Confident	85.9	Confident	27 Å²	27	54 Å²	54	28%	0.278	29%	0.292	S	S	.	.			trans	-175.9	147.4	176.4	0	0	0	0	0	112.1
66	Q	77.4	Confident	85.7	Confident	142 Å²	142	53.2 Å²	53.2	66%	0.664	28%	0.282	S	S	*	.	S	Bend	trans	-111.7	-14.9	171	-69.8	-179.9	-8.1	0	0	112.3	V34 T35	V34-Q66 CarbonylContact C-O 3.41Å; V34-Q66 WeakPolarHBondContact CA-O 3.13Å; T35-Q66 PolarHBondContact N-O 3.01Å
67	V	87	Confident	85.8	Confident	15 Å²	15	50.8 Å²	50.8	9%	0.091	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	140.6	176.9	178.7	0	0	0	0	108.7	T35 I37 N437	T35-V67 VanDerWaalsContact O-CA 3.31Å; T35-V67 WeakPolarHBondContact O-CA 3.21Å; I37-V67 HydrophobicContact CD1-CG1 3.63Å; I37-V67 HydrophobicContact CG1-CG1 4.05Å; V67-N437 HydrophobicContact CG2-CB 3.84Å
68	V	89.4	Confident	85.9	Confident	6 Å²	6	50.8 Å²	50.8	4%	0.036	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	121.9	-178.3	169.1	0	0	0	0	110.3	V34 T35 V36 I37 F57 L60 F61 L70	V34-V68 HydrophobicContact CG1-CG2 4.37Å; T35-V68 PolarHBondContact O-N 3.44Å; V36-V68 HydrophobicContact CG1-CB 4.41Å; V36-V68 HydrophobicContact CG1-CG1 4.21Å; V36-V68 HydrophobicContact CG2-CB 4.47Å; I37-V68 PolarHBondContact N-O 3.14Å; F57-V68 HydrophobicContact CE1-CG1 4.37Å; L60-V68 HydrophobicContact CD2-CB 4.23Å; L60-V68 HydrophobicContact CD2-CG1 3.47Å; L60-V68 VanDerWaalsContact CD2-CG1 3.47Å; L60-V68 HydrophobicContact CD2-CG2 3.66Å; L60-V68 HydrophobicContact CG-CG2 4.47Å; F61-V68 HydrophobicContact CE1-CG2 3.83Å; F61-V68 HydrophobicContact CZ-CG2 4.44Å; V68-L70 HydrophobicContact CG1-CD2 3.91Å; V68-L70 HydrophobicContact CG1-CG 4.2Å
69	E	90.2	Very high	85.9	Confident	45 Å²	45	46.3 Å²	46.3	21%	0.21	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	116.2	158.9	165.6	-113.7	-87.8	0	0	114.3	I37 Y435	I37-E69 HydrophobicContact CB-CB 3.96Å; I37-E69 HydrophobicContact CG2-CB 4.45Å; E69-Y435 WeakPolarHBondContact OE2-CE2 3.48Å
70	L	90.3	Very high	86.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	114.1	157.4	-54.3	-179.9	0	0	0	110.8	V36 I37 V38 Y56 F57 V68 F72 I73 F78 L108	V36-L70 HydrophobicContact CG1-CD1 3.64Å; V36-L70 HydrophobicContact CG1-CG 3.76Å; I37-L70 PolarHBondContact O-N 3.28Å; V38-L70 HydrophobicContact CG1-CB 4.44Å; V38-L70 HydrophobicContact CG2-CB 4.1Å; V38-L70 HydrophobicContact CG2-CD1 4.1Å; V38-L70 HydrophobicContact CG2-CG 4.4Å; Y56-L70 HydrophobicContact CE1-CD2 3.65Å; F57-L70 HydrophobicContact CZ-CD1 4.05Å; V68-L70 HydrophobicContact CG1-CD2 3.91Å; V68-L70 HydrophobicContact CG1-CG 4.2Å; L70-F72 HydrophobicContact CD2-CE1 4.01Å; L70-F72 HydrophobicContact CD2-CZ 4.07Å; L70-I73 HydrophobicContact CD1-CD1 4.2Å; L70-F78 HydrophobicContact CD1-CD2 3.77Å; L70-F78 HydrophobicContact CD1-CE2 3.59Å; L70-F78 HydrophobicContact CD1-CZ 4.23Å; L70-L108 HydrophobicContact CD1-CD2 4.33Å
71	S	85.8	Confident	86.4	Confident	65 Å²	65	40.8 Å²	40.8	46%	0.455	23%	0.227	S	C	.	.			trans	-105.9	-3.1	-178.9	54.2	0	0	0	0	114.4	G431	S71-G431 PolarHBondContact OG-O 3.07Å
72	F	88.3	Confident	86.6	Confident	69 Å²	69	40.1 Å²	40.1	30%	0.303	22%	0.224	S	C	.	.	S	Bend	trans	-109.4	12.1	-174.3	61.3	-94.3	0	0	0	114.2	Y56 L70 L107 L108 C432	Y56-F72 HydrophobicContact CE1-CZ 4.26Å; Y56-F72 HydrophobicContact CE2-CE1 4.29Å; Y56-F72 AromaticContact CE2-CZ 3.97Å; Y56-F72 HydrophobicContact CE2-CZ 3.97Å; Y56-F72 AromaticContact CZ-CE1 3.98Å; Y56-F72 AromaticContact CZ-CZ 3.82Å; L70-F72 HydrophobicContact CD2-CE1 4.01Å; L70-F72 HydrophobicContact CD2-CZ 4.07Å; F72-L107 HydrophobicContact CD2-CB 4.05Å; F72-L107 HydrophobicContact CD2-CD1 3.85Å; F72-L107 HydrophobicContact CD2-CG 4.47Å; F72-L107 HydrophobicContact CE2-CB 3.7Å; F72-L107 HydrophobicContact CE2-CD1 4.38Å; F72-L108 HydrophobicContact CE2-CD2 4.41Å; F72-L108 HydrophobicContact CZ-CD2 4.26Å; F72-C432 VanDerWaalsContact CE1-SG 3.6Å
73	I	91.6	Very high	87.1	Confident	6 Å²	6	39.3 Å²	39.3	3%	0.031	21%	0.214	C	C	.	.	S	Bend	trans	-139.8	137.3	-178.9	-49.4	-178.9	0	0	0	108.1	V38 L70 I77 F78 L108	V38-I73 WeakPolarHBondContact CG1-O 3.47Å; L70-I73 HydrophobicContact CD1-CD1 4.2Å; I73-I77 HydrophobicContact CG2-CB 4Å; I73-I77 HydrophobicContact CG2-CG2 3.99Å; I73-F78 HydrophobicContact CD1-CD2 4.45Å; I73-F78 HydrophobicContact CG2-CB 4.01Å; I73-L108 HydrophobicContact CD1-CD1 3.54Å; I73-L108 HydrophobicContact CD1-CD2 3.93Å; I73-L108 HydrophobicContact CD1-CG 3.61Å
74	R	90.4	Very high	87.8	Confident	84 Å²	84	36.6 Å²	36.6	32%	0.317	19%	0.193	S	C	.	.			trans	-70.3	142.9	168.4	-69.3	-151.2	-62.5	-76.3	-7.5	111.6	E39 E76 I77 F78 E100	E39-R74 WeakPolarHBondContact OE2-CA 3.26Å; R74-E76 HydrophobicContact CB-CG 3.97Å; R74-E76 IonicContact CZ-OE1 3.51Å; R74-E76 IonicContact NE-OE1 2.65Å; R74-E76 PolarHBondContact NE-OE1 3.42Å; R74-E76 IonicContact NH2-OE1 2.8Å; R74-E76 PolarHBondContact NH2-OE1 2.87Å; R74-E76 PolarHBondContact O-N 3.38Å; R74-I77 HydrophobicContact CB-CG1 4.33Å; R74-I77 PolarHBondContact O-N 3.31Å; R74-F78 PolarHBondContact O-N 3.22Å; R74-E100 IonicContact CZ-OE1 2.67Å; R74-E100 IonicContact CZ-OE2 3.98Å; R74-E100 IonicContact NE-OE1 2.75Å; R74-E100 IonicContact NH1-OE1 2.77Å; R74-E100 PolarHBondContact NH1-OE1 3.07Å; R74-E100 IonicContact NH1-OE2 3.17Å; R74-E100 PolarHBondContact NH1-OE2 2.78Å; R74-E100 IonicContact NH2-OE1 2.78Å; R74-E100 IonicContact NH2-OE2 3.07Å; R74-E100 PolarHBondContact NH2-OE2 2.93Å
75	A	90.7	Very high	89.7	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-63.2	-24.9	-178.2	0	0	0	0	0	113.4	V38 E39 R41 F43 A79	V38-A75 HydrophobicContact CB-CB 4.18Å; V38-A75 HydrophobicContact CG1-CB 4.17Å; V38-A75 WeakPolarHBondContact O-CB 3.38Å; E39-A75 HydrophobicContact CB-CB 4.38Å; E39-A75 WeakPolarHBondContact OE2-CB 3.08Å; E39-A75 PolarHBondContact OE2-N 3.39Å; R41-A75 HydrophobicContact CB-CB 4Å; R41-A75 HydrophobicContact CG-CB 4.34Å; R41-A75 PolarHBondContact NH1-O 3.45Å; F43-A75 HydrophobicContact CE2-CB 4.15Å; F43-A75 HydrophobicContact CZ-CB 4.22Å; F43-A75 WeakPolarHBondContact CZ-O 3.38Å; A75-A79 WeakPolarHBondContact O-CB 2.98Å; A75-A79 PolarHBondContact O-N 3.37Å; A75-A79 VanDerWaalsContact O-N 3.07Å
76	E	91	Very high	90.8	Very high	71 Å²	71	33.1 Å²	33.1	33%	0.332	16%	0.161	S	C	.	.	H	α-helix	trans	-66	-47.3	168.4	47	162.5	-158.6	0	0	112.2	R74 A79 E80 L97	R74-E76 HydrophobicContact CB-CG 3.97Å; R74-E76 IonicContact CZ-OE1 3.51Å; R74-E76 IonicContact NE-OE1 2.65Å; R74-E76 PolarHBondContact NE-OE1 3.42Å; R74-E76 IonicContact NH2-OE1 2.8Å; R74-E76 PolarHBondContact NH2-OE1 2.87Å; R74-E76 PolarHBondContact O-N 3.38Å; E76-A79 WeakPolarHBondContact O-CB 3.44Å; E76-A79 PolarHBondContact O-N 2.93Å; E76-E80 PolarHBondContact O-N 3.28Å; E76-L97 WeakPolarHBondContact OE1-CD2 3.34Å
77	I	92.9	Very high	91.5	Very high	4 Å²	4	28 Å²	28	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-64.6	-43.9	177.6	-59.6	-62.6	0	0	0	110.6	I73 R74 A79 E80 I81 L97 E100 L101	I73-I77 HydrophobicContact CG2-CB 4Å; I73-I77 HydrophobicContact CG2-CG2 3.99Å; R74-I77 HydrophobicContact CB-CG1 4.33Å; R74-I77 PolarHBondContact O-N 3.31Å; I77-A79 VanDerWaalsContact C-N 3.28Å; I77-A79 PolarHBondContact O-N 2.8Å; I77-E80 PolarHBondContact O-N 3.49Å; I77-I81 HydrophobicContact CG2-CD1 4.13Å; I77-I81 WeakPolarHBondContact O-CG1 3.31Å; I77-I81 PolarHBondContact O-N 3.11Å; I77-L97 HydrophobicContact CD1-CB 3.92Å; I77-L97 HydrophobicContact CD1-CD2 4.04Å; I77-L97 HydrophobicContact CD1-CG 4.4Å; I77-E100 HydrophobicContact CD1-CB 4.13Å; I77-E100 HydrophobicContact CD1-CG 4.4Å; I77-E100 HydrophobicContact CG1-CB 4.4Å; I77-E100 HydrophobicContact CG1-CG 4.11Å; I77-L101 HydrophobicContact CD1-CB 4.49Å; I77-L101 HydrophobicContact CG2-CB 4.38Å; I77-L101 HydrophobicContact CG2-CD1 4.07Å
78	F	94.3	Very high	91.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.2	-34.8	176.9	-173.7	-102.8	0	0	0	112.6	V36 V38 F43 F57 L70 I73 R74 E80 I81 L82 L108	V36-F78 HydrophobicContact CB-CE1 4.03Å; V36-F78 HydrophobicContact CB-CZ 4.02Å; V36-F78 HydrophobicContact CG1-CE1 3.94Å; V36-F78 HydrophobicContact CG1-CE2 4.39Å; V36-F78 HydrophobicContact CG1-CZ 3.74Å; V36-F78 HydrophobicContact CG2-CZ 4.18Å; V38-F78 HydrophobicContact CG1-CB 4.18Å; V38-F78 HydrophobicContact CG2-CB 4.1Å; V38-F78 HydrophobicContact CG2-CD1 3.54Å; V38-F78 HydrophobicContact CG2-CD2 4.36Å; V38-F78 HydrophobicContact CG2-CE1 4.05Å; V38-F78 HydrophobicContact CG2-CG 3.72Å; F43-F78 HydrophobicContact CB-CD1 4.45Å; F43-F78 HydrophobicContact CB-CE1 3.92Å; F43-F78 HydrophobicContact CD1-CD1 4.23Å; F43-F78 HydrophobicContact CD1-CE1 4.41Å; F43-F78 AromaticContact CD2-CD1 3.68Å; F43-F78 HydrophobicContact CD2-CD1 3.68Å; F43-F78 AromaticContact CD2-CE1 3.95Å; F43-F78 HydrophobicContact CD2-CE1 3.95Å; F43-F78 HydrophobicContact CE1-CD1 4.4Å; F43-F78 AromaticContact CE2-CD1 3.89Å; F43-F78 HydrophobicContact CE2-CD1 3.89Å; F43-F78 AromaticContact CG-CD1 3.86Å; F43-F78 HydrophobicContact CG-CD1 3.86Å; F43-F78 AromaticContact CG-CE1 3.84Å; F43-F78 HydrophobicContact CG-CE1 3.84Å; F43-F78 HydrophobicContact CZ-CD1 4.23Å; F57-F78 AromaticContact CE2-CE2 3.9Å; F57-F78 HydrophobicContact CE2-CE2 3.9Å; F57-F78 HydrophobicContact CE2-CZ 4.23Å; F57-F78 AromaticContact CZ-CE2 3.76Å; F57-F78 HydrophobicContact CZ-CE2 3.76Å; F57-F78 AromaticContact CZ-CZ 3.88Å; F57-F78 HydrophobicContact CZ-CZ 3.88Å; L70-F78 HydrophobicContact CD1-CD2 3.77Å; L70-F78 HydrophobicContact CD1-CE2 3.59Å; L70-F78 HydrophobicContact CD1-CZ 4.23Å; I73-F78 HydrophobicContact CD1-CD2 4.45Å; I73-F78 HydrophobicContact CG2-CB 4.01Å; R74-F78 PolarHBondContact O-N 3.22Å; F78-E80 VanDerWaalsContact C-N 3.34Å; F78-E80 PolarHBondContact O-N 3.12Å; F78-I81 PolarHBondContact O-N 2.77Å; F78-L82 HydrophobicContact CE1-CB 4.46Å; F78-L82 HydrophobicContact CE1-CD2 3.98Å; F78-L82 HydrophobicContact CZ-CD2 4.49Å; F78-L82 VanDerWaalsContact O-CB 3.32Å; F78-L82 WeakPolarHBondContact O-CB 3.1Å; F78-L82 PolarHBondContact O-N 3.08Å; F78-L108 HydrophobicContact CD2-CD1 4.02Å; F78-L108 HydrophobicContact CE2-CD1 4Å
79	A	92.6	Very high	91.6	Very high	11 Å²	11	35.8 Å²	35.8	9%	0.091	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-44	174.4	0	0	0	0	0	111.4	F43 A75 E76 I77 L82 N83	F43-A79 HydrophobicContact CE1-CB 3.81Å; F43-A79 HydrophobicContact CZ-CB 4.18Å; A75-A79 WeakPolarHBondContact O-CB 2.98Å; A75-A79 PolarHBondContact O-N 3.37Å; A75-A79 VanDerWaalsContact O-N 3.07Å; E76-A79 WeakPolarHBondContact O-CB 3.44Å; E76-A79 PolarHBondContact O-N 2.93Å; I77-A79 VanDerWaalsContact C-N 3.28Å; I77-A79 PolarHBondContact O-N 2.8Å; A79-L82 PolarHBondContact O-N 3.11Å; A79-N83 WeakPolarHBondContact O-CB 3.43Å; A79-N83 PolarHBondContact O-N 3.22Å; A79-N83 PolarHBondContact O-ND2 2.93Å; A79-N83 PolarHBondContact O-OD1 3.26Å
80	E	92.8	Very high	91.5	Very high	74 Å²	74	36 Å²	36	35%	0.346	19%	0.186	S	C	.	.	H	α-helix	trans	-71.7	-35.8	178.3	-61.8	-50.9	155.1	0	0	113.6	E76 I77 F78 L82 N83 Y84 V93 L101	E76-E80 PolarHBondContact O-N 3.28Å; I77-E80 PolarHBondContact O-N 3.49Å; F78-E80 VanDerWaalsContact C-N 3.34Å; F78-E80 PolarHBondContact O-N 3.12Å; E80-L82 VanDerWaalsContact C-N 3.28Å; E80-L82 PolarHBondContact O-N 3.07Å; E80-N83 PolarHBondContact O-N 2.62Å; E80-N83 PolarHBondContact OE2-ND2 2.71Å; E80-Y84 PolarHBondContact O-N 2.84Å; E80-V93 HydrophobicContact CG-CG2 4.43Å; E80-L101 HydrophobicContact CB-CD1 4.46Å
81	I	93.6	Very high	91	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.4	-43.7	170.1	-65.5	176.4	0	0	0	110.2	I77 F78 Y84 I85 L101 L108 V110 I113	I77-I81 HydrophobicContact CG2-CD1 4.13Å; I77-I81 WeakPolarHBondContact O-CG1 3.31Å; I77-I81 PolarHBondContact O-N 3.11Å; F78-I81 PolarHBondContact O-N 2.77Å; I81-Y84 PolarHBondContact O-N 3.44Å; I81-I85 HydrophobicContact CG2-CD1 3.98Å; I81-I85 VanDerWaalsContact O-CG1 3.3Å; I81-I85 WeakPolarHBondContact O-CG1 3.45Å; I81-I85 PolarHBondContact O-N 2.75Å; I81-L101 HydrophobicContact CD1-CD1 4.14Å; I81-L101 HydrophobicContact CG1-CD1 3.42Å; I81-L101 VanDerWaalsContact CG1-CD1 3.42Å; I81-L108 HydrophobicContact CD1-CD1 3.98Å; I81-L108 HydrophobicContact CG2-CD1 4.03Å; I81-V110 HydrophobicContact CG2-CG2 4.17Å; I81-I113 HydrophobicContact CB-CD1 4.21Å; I81-I113 HydrophobicContact CG1-CD1 3.89Å; I81-I113 HydrophobicContact CG2-CD1 4.07Å
82	L	93.8	Very high	90.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-71.7	-31.8	179.7	-163.9	60.8	0	0	0	112.1	F43 A45 L50 F78 A79 E80 I85 Y86	F43-L82 HydrophobicContact CB-CD2 3.93Å; F43-L82 HydrophobicContact CD1-CD2 4.09Å; F43-L82 HydrophobicContact CG-CD2 4.35Å; A45-L82 HydrophobicContact CB-CD1 4.4Å; L50-L82 HydrophobicContact CD2-CD1 3.57Å; F78-L82 HydrophobicContact CE1-CB 4.46Å; F78-L82 HydrophobicContact CE1-CD2 3.98Å; F78-L82 HydrophobicContact CZ-CD2 4.49Å; F78-L82 VanDerWaalsContact O-CB 3.32Å; F78-L82 WeakPolarHBondContact O-CB 3.1Å; F78-L82 PolarHBondContact O-N 3.08Å; A79-L82 PolarHBondContact O-N 3.11Å; E80-L82 VanDerWaalsContact C-N 3.28Å; E80-L82 PolarHBondContact O-N 3.07Å; L82-I85 PolarHBondContact O-N 2.69Å; L82-Y86 HydrophobicContact CD1-CD2 3.92Å; L82-Y86 HydrophobicContact CD1-CE2 3.78Å; L82-Y86 HydrophobicContact CG-CD2 4.21Å; L82-Y86 HydrophobicContact CG-CE2 4.4Å; L82-Y86 WeakPolarHBondContact O-CD2 3.45Å; L82-Y86 PolarHBondContact O-N 2.99Å; L82-Y86 VanDerWaalsContact O-N 3.13Å
83	N	92.4	Very high	90.3	Very high	53 Å²	53	46.7 Å²	46.7	28%	0.283	23%	0.227	S	C	.	.	H	α-helix	trans	-66.2	-40.2	171.4	-65.6	-18.5	0	0	0	111.6	R26 A79 E80 Y86 S87	R26-N83 PolarHBondContact NH1-OD1 2.86Å; R26-N83 PolarHBondContact NH2-OD1 3.16Å; R26-N83 VanDerWaalsContact NH2-OD1 3.13Å; A79-N83 WeakPolarHBondContact O-CB 3.43Å; A79-N83 PolarHBondContact O-N 3.22Å; A79-N83 PolarHBondContact O-ND2 2.93Å; A79-N83 PolarHBondContact O-OD1 3.26Å; E80-N83 PolarHBondContact O-N 2.62Å; E80-N83 PolarHBondContact OE2-ND2 2.71Å; N83-Y86 CarbonylContact O-C 3.54Å; N83-Y86 PolarHBondContact O-N 2.93Å; N83-S87 WeakPolarHBondContact O-CB 3.41Å; N83-S87 PolarHBondContact O-N 3.43Å; N83-S87 PolarHBondContact O-OG 2.66Å
84	Y	94	Very high	89.8	Confident	43 Å²	43	52.4 Å²	52.4	17%	0.169	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-49.1	171.7	170.1	-101.7	0	0	0	111.6	E80 I81 Y86 S87 S88 K89 I90 V110 F112 I113	E80-Y84 PolarHBondContact O-N 2.84Å; I81-Y84 PolarHBondContact O-N 3.44Å; Y84-Y86 PolarHBondContact O-N 2.95Å; Y84-Y86 VanDerWaalsContact O-N 3.14Å; Y84-S87 PolarHBondContact O-N 2.95Å; Y84-S87 VanDerWaalsContact O-N 3.11Å; Y84-S88 WeakPolarHBondContact O-CA 3.34Å; Y84-S88 PolarHBondContact O-N 2.81Å; Y84-K89 WeakPolarHBondContact CA-O 3.46Å; Y84-I90 HydrophobicContact CD2-CD1 4.18Å; Y84-I90 HydrophobicContact CD2-CG1 3.72Å; Y84-I90 HydrophobicContact CG-CD1 4.47Å; Y84-I90 HydrophobicContact CG-CG1 4.16Å; Y84-V110 HydrophobicContact CD1-CG1 4Å; Y84-V110 HydrophobicContact CE1-CG1 3.82Å; Y84-F112 HydrophobicContact CD2-CD1 4.18Å; Y84-F112 HydrophobicContact CD2-CE1 4.38Å; Y84-F112 HydrophobicContact CE1-CB 4.34Å; Y84-F112 HydrophobicContact CE1-CD1 4.27Å; Y84-F112 AromaticContact CE2-CD1 3.4Å; Y84-F112 HydrophobicContact CE2-CD1 3.4Å; Y84-F112 AromaticContact CE2-CE1 3.76Å; Y84-F112 HydrophobicContact CE2-CE1 3.76Å; Y84-F112 HydrophobicContact CE2-CG 4.2Å; Y84-F112 AromaticContact CZ-CD1 3.46Å; Y84-F112 VanDerWaalsContact CZ-CD1 3.46Å; Y84-F112 AromaticContact CZ-CG 3.89Å; Y84-F112 WeakPolarHBondContact OH-CB 3.33Å; Y84-F112 WeakPolarHBondContact OH-CD1 3.46Å; Y84-F112 WeakPolarHBondContact OH-CG 3.35Å; Y84-I113 HydrophobicContact CD1-CD1 3.65Å; Y84-I113 HydrophobicContact CD1-CG1 3.88Å; Y84-I113 HydrophobicContact CE1-CD1 4.4Å; Y84-I113 HydrophobicContact CE1-CG1 4.19Å; Y84-I113 HydrophobicContact CG-CD1 4Å; Y84-I113 HydrophobicContact CG-CG1 4.27Å
85	I	94.1	Very high	89.5	Confident	7 Å²	7	53 Å²	53	4%	0.036	27%	0.266	C	S	.	.	H	α-helix	trans	-55.9	-32.9	178.5	-71.8	170.7	0	0	0	112	I49 L50 I81 L82 V110	I49-I85 HydrophobicContact CG2-CG2 3.68Å; L50-I85 HydrophobicContact CD2-CD1 4.06Å; I81-I85 HydrophobicContact CG2-CD1 3.98Å; I81-I85 VanDerWaalsContact O-CG1 3.3Å; I81-I85 WeakPolarHBondContact O-CG1 3.45Å; I81-I85 PolarHBondContact O-N 2.75Å; L82-I85 PolarHBondContact O-N 2.69Å; I85-V110 HydrophobicContact CD1-CG2 4.47Å
86	Y	94.6	Very high	89.1	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	13.7	-178.9	-79.9	-88.4	0	0	0	114.9	L22 N23 R26 H46 I49 L82 N83 Y84	L22-Y86 HydrophobicContact CB-CD1 4.15Å; L22-Y86 HydrophobicContact CB-CE1 4.08Å; L22-Y86 WeakPolarHBondContact O-CE1 3.13Å; N23-Y86 HydrophobicContact CB-CD1 4.3Å; N23-Y86 WeakPolarHBondContact CB-O 3.46Å; N23-Y86 WeakPolarHBondContact OD1-CB 3.46Å; R26-Y86 HydrophobicContact CB-CD1 4.3Å; R26-Y86 HydrophobicContact CB-CE1 4.08Å; H46-Y86 VanDerWaalsContact CB-OH 3.26Å; H46-Y86 WeakPolarHBondContact CB-OH 3.26Å; H46-Y86 PolarHBondContact N-OH 3.14Å; H46-Y86 AromaticContact ND1-CE1 3.84Å; H46-Y86 AromaticContact ND1-CZ 3.79Å; H46-Y86 PolarHBondContact ND1-OH 2.64Å; I49-Y86 HydrophobicContact CG1-CE1 4.43Å; I49-Y86 HydrophobicContact CG2-CE1 4.2Å; I49-Y86 HydrophobicContact CG2-CE2 4.15Å; L82-Y86 HydrophobicContact CD1-CD2 3.92Å; L82-Y86 HydrophobicContact CD1-CE2 3.78Å; L82-Y86 HydrophobicContact CG-CD2 4.21Å; L82-Y86 HydrophobicContact CG-CE2 4.4Å; L82-Y86 WeakPolarHBondContact O-CD2 3.45Å; L82-Y86 PolarHBondContact O-N 2.99Å; L82-Y86 VanDerWaalsContact O-N 3.13Å; N83-Y86 CarbonylContact O-C 3.54Å; N83-Y86 PolarHBondContact O-N 2.93Å; Y84-Y86 PolarHBondContact O-N 2.95Å; Y84-Y86 VanDerWaalsContact O-N 3.14Å
87	S	91.6	Very high	88.9	Confident	34 Å²	34	55.3 Å²	55.3	24%	0.238	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-148.1	-10.4	175.6	67.6	0	0	0	0	115.4	N83 Y84 K89	N83-S87 WeakPolarHBondContact O-CB 3.41Å; N83-S87 PolarHBondContact O-N 3.43Å; N83-S87 PolarHBondContact O-OG 2.66Å; Y84-S87 PolarHBondContact O-N 2.95Å; Y84-S87 VanDerWaalsContact O-N 3.11Å; S87-K89 PolarHBondContact O-N 3.31Å; S87-K89 VanDerWaalsContact O-N 3.17Å; S87-K89 PolarHBondContact OG-N 2.83Å; S87-K89 PolarHBondContact OG-O 3.4Å
88	S	90.6	Very high	88.6	Confident	81 Å²	81	58.3 Å²	58.3	57%	0.566	30%	0.296	S	S	*	.	S	Bend	trans	56.5	16.5	-167.4	-61.3	0	0	0	0	114.4	L19 Y84	L19-S88 VanDerWaalsContact CD2-OG 3.3Å; L19-S88 WeakPolarHBondContact CD2-OG 3.23Å; Y84-S88 WeakPolarHBondContact O-CA 3.34Å; Y84-S88 PolarHBondContact O-N 2.81Å
89	K	88.1	Confident	88.4	Confident	104 Å²	104	63.3 Å²	63.3	45%	0.452	32%	0.323	S	S	.	.			trans	-129.6	151.8	-175.9	-63.6	-176.3	-170.2	-160.4	0	111.6	Y84 S87 V91 S172	Y84-K89 WeakPolarHBondContact CA-O 3.46Å; S87-K89 PolarHBondContact O-N 3.31Å; S87-K89 VanDerWaalsContact O-N 3.17Å; S87-K89 PolarHBondContact OG-N 2.83Å; S87-K89 PolarHBondContact OG-O 3.4Å; K89-V91 HydrophobicContact CB-CG2 4.38Å; K89-S172 WeakPolarHBondContact CE-OG 3.37Å; K89-S172 PolarHBondContact NZ-OG 3.26Å
90	I	87.3	Confident	88.3	Confident	50 Å²	50	65.1 Å²	65.1	26%	0.256	33%	0.329	S	S	.	.			trans	-122.7	127.4	171.9	-60	178.1	0	0	0	106.3	Y84 V93 L101 F112 I113 L116	Y84-I90 HydrophobicContact CD2-CD1 4.18Å; Y84-I90 HydrophobicContact CD2-CG1 3.72Å; Y84-I90 HydrophobicContact CG-CD1 4.47Å; Y84-I90 HydrophobicContact CG-CG1 4.16Å; I90-V93 HydrophobicContact CG2-CB 4.19Å; I90-V93 HydrophobicContact CG2-CG2 3.38Å; I90-L101 HydrophobicContact CG2-CD2 4.4Å; I90-F112 HydrophobicContact CD1-CD1 4.27Å; I90-F112 HydrophobicContact CD1-CE1 3.86Å; I90-F112 HydrophobicContact CG1-CE1 4.48Å; I90-I113 HydrophobicContact CD1-CG1 4.19Å; I90-L116 HydrophobicContact CD1-CD1 3.71Å
91	V	81.2	Confident	88.2	Confident	85 Å²	85	61.7 Å²	61.7	52%	0.515	31%	0.313	S	S	.	.			trans	-133	121.9	-168.5	-179.2	0	0	0	0	109.8	K89 V93	K89-V91 HydrophobicContact CB-CG2 4.38Å; V91-V93 VanDerWaalsContact C-N 3.26Å; V91-V93 PolarHBondContact O-N 2.92Å
92	R	76.1	Confident	88.1	Confident	234 Å²	234	62.5 Å²	62.5	88%	0.883	32%	0.318	S	S	*	.	S	Bend	trans	56	29.8	173.3	-62.2	174.3	177	163.8	-1	115.6	R94	R92-R94 PolarHBondContact O-N 2.95Å
93	V	81.8	Confident	88	Confident	38 Å²	38	67.9 Å²	67.9	23%	0.23	34%	0.341	C	S	.	.			trans	-59.7	128.3	168.6	171.1	0	0	0	0	109.4	E80 I90 V91 L97 L98 L101	E80-V93 HydrophobicContact CG-CG2 4.43Å; I90-V93 HydrophobicContact CG2-CB 4.19Å; I90-V93 HydrophobicContact CG2-CG2 3.38Å; V91-V93 VanDerWaalsContact C-N 3.26Å; V91-V93 PolarHBondContact O-N 2.92Å; V93-L97 HydrophobicContact CG1-CB 4.28Å; V93-L98 HydrophobicContact CG1-CB 4.47Å; V93-L98 HydrophobicContact CG1-CD1 4.49Å; V93-L101 HydrophobicContact CB-CD2 4.43Å; V93-L101 HydrophobicContact CG1-CD2 3.91Å; V93-L101 HydrophobicContact CG2-CD2 3.85Å
94	R	82.6	Confident	88	Confident	126 Å²	126	65.6 Å²	65.6	48%	0.475	33%	0.329	S	S	.	.			trans	-70.6	140.2	179.7	-50.8	-174.1	-66.9	110.7	-5.3	109.5	R92 D96 L97 L98	R92-R94 PolarHBondContact O-N 2.95Å; R94-D96 WeakPolarHBondContact CB-OD1 3.4Å; R94-D96 IonicContact CZ-OD1 3.57Å; R94-D96 IonicContact CZ-OD2 3.65Å; R94-D96 IonicContact NH1-OD1 3.77Å; R94-D96 PolarHBondContact NH1-OD1 3.01Å; R94-D96 IonicContact NH1-OD2 2.71Å; R94-D96 PolarHBondContact NH1-OD2 3.38Å; R94-D96 IonicContact NH2-OD2 3.08Å; R94-D96 PolarHBondContact O-N 3.03Å; R94-D96 VanDerWaalsContact O-N 3.15Å; R94-L97 HydrophobicContact CB-CD1 4.37Å; R94-L97 HydrophobicContact CB-CG 4.33Å; R94-L97 HydrophobicContact CG-CD1 4.49Å; R94-L97 WeakPolarHBondContact O-CB 3.34Å; R94-L97 PolarHBondContact O-N 3.44Å; R94-L98 PolarHBondContact O-N 3.39Å
95	S	83	Confident	87.9	Confident	97 Å²	97	63.5 Å²	63.5	68%	0.678	32%	0.321	S	S	*	.	H	α-helix	trans	-59.4	-29.6	-174.1	-50.3	0	0	0	0	113.7	L97 L98	S95-L97 VanDerWaalsContact C-N 3.32Å; S95-L98 PolarHBondContact O-N 3.04Å
96	D	82.7	Confident	87.8	Confident	104 Å²	104	68.5 Å²	68.5	56%	0.556	34%	0.344	S	S	*	.	H	α-helix	trans	-73.7	-19.2	175.3	63.4	-58.9	0	0	0	113.9	R94	R94-D96 WeakPolarHBondContact CB-OD1 3.4Å; R94-D96 IonicContact CZ-OD1 3.57Å; R94-D96 IonicContact CZ-OD2 3.65Å; R94-D96 IonicContact NH1-OD1 3.77Å; R94-D96 PolarHBondContact NH1-OD1 3.01Å; R94-D96 IonicContact NH1-OD2 2.71Å; R94-D96 PolarHBondContact NH1-OD2 3.38Å; R94-D96 IonicContact NH2-OD2 3.08Å; R94-D96 PolarHBondContact O-N 3.03Å; R94-D96 VanDerWaalsContact O-N 3.15Å
97	L	86.2	Confident	87.7	Confident	17 Å²	17	73.1 Å²	73.1	9%	0.089	37%	0.368	C	S	.	.	H	α-helix	trans	-91	-16.5	173.2	-62.8	-178.3	0	0	0	113	E76 I77 V93 R94 S95 D99 E100 L101	E76-L97 WeakPolarHBondContact OE1-CD2 3.34Å; I77-L97 HydrophobicContact CD1-CB 3.92Å; I77-L97 HydrophobicContact CD1-CD2 4.04Å; I77-L97 HydrophobicContact CD1-CG 4.4Å; V93-L97 HydrophobicContact CG1-CB 4.28Å; R94-L97 HydrophobicContact CB-CD1 4.37Å; R94-L97 HydrophobicContact CB-CG 4.33Å; R94-L97 HydrophobicContact CG-CD1 4.49Å; R94-L97 WeakPolarHBondContact O-CB 3.34Å; R94-L97 PolarHBondContact O-N 3.44Å; S95-L97 VanDerWaalsContact C-N 3.32Å; L97-D99 PolarHBondContact O-N 3.23Å; L97-E100 PolarHBondContact O-N 3.28Å; L97-L101 WeakPolarHBondContact O-CB 3.34Å; L97-L101 PolarHBondContact O-N 3.45Å
98	L	87.9	Confident	87.7	Confident	66 Å²	66	71.5 Å²	71.5	35%	0.346	36%	0.357	S	S	.	.	H	α-helix	trans	-64.7	-44.6	-170.7	-177.5	60.2	0	0	0	112.8	V93 R94 S95 E100 L101 I102 L116	V93-L98 HydrophobicContact CG1-CB 4.47Å; V93-L98 HydrophobicContact CG1-CD1 4.49Å; R94-L98 PolarHBondContact O-N 3.39Å; S95-L98 PolarHBondContact O-N 3.04Å; L98-E100 PolarHBondContact O-N 3.16Å; L98-L101 PolarHBondContact O-N 2.96Å; L98-I102 HydrophobicContact CD1-CD1 4.29Å; L98-I102 HydrophobicContact CG-CD1 4.04Å; L98-I102 WeakPolarHBondContact O-CD1 3.38Å; L98-I102 VanDerWaalsContact O-CG1 3.29Å; L98-I102 WeakPolarHBondContact O-CG1 3.5Å; L98-I102 PolarHBondContact O-N 3.31Å; L98-L116 HydrophobicContact CD1-CD1 4.39Å
99	D	88.8	Confident	87.8	Confident	106 Å²	106	68.5 Å²	68.5	57%	0.567	34%	0.339	S	S	*	.	H	α-helix	trans	-59.6	-32.4	175.8	-86.3	-2.2	0	0	0	112.7	L97 K103	L97-D99 PolarHBondContact O-N 3.23Å; D99-K103 WeakPolarHBondContact O-CD 3.41Å; D99-K103 WeakPolarHBondContact O-CE 3.31Å; D99-K103 WeakPolarHBondContact O-CG 3.43Å; D99-K103 PolarHBondContact O-N 2.81Å
100	E	90.4	Very high	88.1	Confident	48 Å²	48	63.7 Å²	63.7	22%	0.224	32%	0.318	C	S	.	.	H	α-helix	trans	-82.3	-39	179.8	-162.4	174.5	154.1	0	0	111.3	R74 I77 L97 L98 I102 K103 S104	R74-E100 IonicContact CZ-OE1 2.67Å; R74-E100 IonicContact CZ-OE2 3.98Å; R74-E100 IonicContact NE-OE1 2.75Å; R74-E100 IonicContact NH1-OE1 2.77Å; R74-E100 PolarHBondContact NH1-OE1 3.07Å; R74-E100 IonicContact NH1-OE2 3.17Å; R74-E100 PolarHBondContact NH1-OE2 2.78Å; R74-E100 IonicContact NH2-OE1 2.78Å; R74-E100 IonicContact NH2-OE2 3.07Å; R74-E100 PolarHBondContact NH2-OE2 2.93Å; I77-E100 HydrophobicContact CD1-CB 4.13Å; I77-E100 HydrophobicContact CD1-CG 4.4Å; I77-E100 HydrophobicContact CG1-CB 4.4Å; I77-E100 HydrophobicContact CG1-CG 4.11Å; L97-E100 PolarHBondContact O-N 3.28Å; L98-E100 PolarHBondContact O-N 3.16Å; E100-I102 VanDerWaalsContact C-N 3.3Å; E100-I102 PolarHBondContact O-N 3.46Å; E100-K103 PolarHBondContact O-N 2.85Å; E100-S104 WeakPolarHBondContact O-CB 3.25Å; E100-S104 PolarHBondContact O-N 3.34Å; E100-S104 PolarHBondContact O-OG 3.45Å; E100-S104 VanDerWaalsContact O-OG 3.06Å
101	L	91.9	Very high	88.3	Confident	3 Å²	3	68.5 Å²	68.5	2%	0.016	34%	0.337	C	S	.	.	H	α-helix	trans	-56.7	-43.2	169.8	-179.9	61.4	0	0	0	111.6	I77 E80 I81 I90 V93 L97 L98 S104 G105 I113	I77-L101 HydrophobicContact CD1-CB 4.49Å; I77-L101 HydrophobicContact CG2-CB 4.38Å; I77-L101 HydrophobicContact CG2-CD1 4.07Å; E80-L101 HydrophobicContact CB-CD1 4.46Å; I81-L101 HydrophobicContact CD1-CD1 4.14Å; I81-L101 HydrophobicContact CG1-CD1 3.42Å; I81-L101 VanDerWaalsContact CG1-CD1 3.42Å; I90-L101 HydrophobicContact CG2-CD2 4.4Å; V93-L101 HydrophobicContact CB-CD2 4.43Å; V93-L101 HydrophobicContact CG1-CD2 3.91Å; V93-L101 HydrophobicContact CG2-CD2 3.85Å; L97-L101 WeakPolarHBondContact O-CB 3.34Å; L97-L101 PolarHBondContact O-N 3.45Å; L98-L101 PolarHBondContact O-N 2.96Å; L101-S104 PolarHBondContact O-N 3.39Å; L101-G105 PolarHBondContact O-N 2.81Å; L101-I113 HydrophobicContact CD1-CG2 4.01Å; L101-I113 HydrophobicContact CG-CG2 3.8Å; L101-I113 WeakPolarHBondContact O-CG2 3.19Å
102	I	91.1	Very high	88.8	Confident	17 Å²	17	69.3 Å²	69.3	9%	0.087	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-49.6	174.9	-69.9	161.3	0	0	0	111.1	L98 E100 S104 G105 Q106 L116	L98-I102 HydrophobicContact CD1-CD1 4.29Å; L98-I102 HydrophobicContact CG-CD1 4.04Å; L98-I102 WeakPolarHBondContact O-CD1 3.38Å; L98-I102 VanDerWaalsContact O-CG1 3.29Å; L98-I102 WeakPolarHBondContact O-CG1 3.5Å; L98-I102 PolarHBondContact O-N 3.31Å; E100-I102 VanDerWaalsContact C-N 3.3Å; E100-I102 PolarHBondContact O-N 3.46Å; I102-S104 PolarHBondContact O-N 3.48Å; I102-G105 PolarHBondContact O-N 2.83Å; I102-Q106 WeakPolarHBondContact O-CG 3.34Å; I102-Q106 PolarHBondContact O-N 2.82Å; I102-L116 HydrophobicContact CD1-CB 4.2Å; I102-L116 HydrophobicContact CG1-CB 3.97Å
103	K	91.8	Very high	89.6	Confident	113 Å²	113	58.1 Å²	58.1	49%	0.491	29%	0.292	S	S	.	.	H	α-helix	trans	-60.9	-44	178.4	-70.3	159.5	-164.2	156.8	0	111.7	D99 E100 Q106 L107	D99-K103 WeakPolarHBondContact O-CD 3.41Å; D99-K103 WeakPolarHBondContact O-CE 3.31Å; D99-K103 WeakPolarHBondContact O-CG 3.43Å; D99-K103 PolarHBondContact O-N 2.81Å; E100-K103 PolarHBondContact O-N 2.85Å; K103-Q106 WeakPolarHBondContact O-CB 3.44Å; K103-Q106 PolarHBondContact O-N 3.39Å; K103-L107 VanDerWaalsContact O-CG 3.31Å; K103-L107 WeakPolarHBondContact O-CG 3.37Å; K103-L107 PolarHBondContact O-N 3.31Å
104	S	92.7	Very high	89.9	Confident	4 Å²	4	57.1 Å²	57.1	3%	0.028	29%	0.287	C	S	.	.	H	α-helix	trans	-68.5	-34.1	176.9	-60.8	0	0	0	0	112.3	E100 L101 I102 L107 L108	E100-S104 WeakPolarHBondContact O-CB 3.25Å; E100-S104 PolarHBondContact O-N 3.34Å; E100-S104 PolarHBondContact O-OG 3.45Å; E100-S104 VanDerWaalsContact O-OG 3.06Å; L101-S104 PolarHBondContact O-N 3.39Å; I102-S104 PolarHBondContact O-N 3.48Å; S104-L107 PolarHBondContact O-N 3.19Å; S104-L108 WeakPolarHBondContact O-CB 3.5Å; S104-L108 WeakPolarHBondContact O-CG 3.41Å; S104-L108 PolarHBondContact O-N 3.02Å
105	G	92.1	Very high	90.2	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.7	-38.8	169.8	0	0	0	0	0	112.9	L101 I102 G109 V110	L101-G105 PolarHBondContact O-N 2.81Å; I102-G105 PolarHBondContact O-N 2.83Å; G105-G109 CarbonylContact O-C 3.59Å; G105-G109 WeakPolarHBondContact O-CA 3.44Å; G105-G109 PolarHBondContact O-N 3.12Å; G105-V110 PolarHBondContact O-N 3.32Å
106	Q	91.9	Very high	90.2	Very high	112 Å²	112	55 Å²	55	52%	0.523	27%	0.274	S	S	.	.	H	α-helix	trans	-65.6	-47.6	172.7	-72.7	168	4.2	0	0	111.5	I102 K103 L108 G109 A114	I102-Q106 WeakPolarHBondContact O-CG 3.34Å; I102-Q106 PolarHBondContact O-N 2.82Å; K103-Q106 WeakPolarHBondContact O-CB 3.44Å; K103-Q106 PolarHBondContact O-N 3.39Å; Q106-L108 VanDerWaalsContact C-N 3.33Å; Q106-L108 PolarHBondContact O-N 3.12Å; Q106-G109 PolarHBondContact O-N 3.39Å; Q106-A114 HydrophobicContact CB-CB 4.32Å; Q106-A114 HydrophobicContact CG-CB 3.51Å; Q106-A114 PolarHBondContact NE2-O 2.83Å
107	L	91.6	Very high	89.4	Confident	97 Å²	97	52.5 Å²	52.5	51%	0.508	27%	0.273	S	S	.	.	H	α-helix	trans	-65	-33.7	179.5	-68.2	166.3	0	0	0	113	F72 K103 S104	F72-L107 HydrophobicContact CD2-CB 4.05Å; F72-L107 HydrophobicContact CD2-CD1 3.85Å; F72-L107 HydrophobicContact CD2-CG 4.47Å; F72-L107 HydrophobicContact CE2-CB 3.7Å; F72-L107 HydrophobicContact CE2-CD1 4.38Å; K103-L107 VanDerWaalsContact O-CG 3.31Å; K103-L107 WeakPolarHBondContact O-CG 3.37Å; K103-L107 PolarHBondContact O-N 3.31Å; S104-L107 PolarHBondContact O-N 3.19Å
108	L	92.7	Very high	88.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-6.4	171.8	-67.1	178.3	0	0	0	113.8	S54 Y56 F57 L70 F72 I73 F78 I81 S104 Q106 V110	S54-L108 WeakPolarHBondContact CB-O 3.4Å; S54-L108 PolarHBondContact OG-O 3.16Å; Y56-L108 WeakPolarHBondContact CB-O 3.36Å; Y56-L108 HydrophobicContact CD1-CD2 3.48Å; Y56-L108 VanDerWaalsContact CD1-CD2 3.48Å; Y56-L108 HydrophobicContact CE1-CD2 4.04Å; Y56-L108 HydrophobicContact CG-CD2 3.94Å; Y56-L108 PolarHBondContact N-O 3.03Å; F57-L108 HydrophobicContact CE2-CD1 4.3Å; F57-L108 HydrophobicContact CE2-CD2 4.09Å; F57-L108 HydrophobicContact CZ-CD2 4.42Å; L70-L108 HydrophobicContact CD1-CD2 4.33Å; F72-L108 HydrophobicContact CE2-CD2 4.41Å; F72-L108 HydrophobicContact CZ-CD2 4.26Å; I73-L108 HydrophobicContact CD1-CD1 3.54Å; I73-L108 HydrophobicContact CD1-CD2 3.93Å; I73-L108 HydrophobicContact CD1-CG 3.61Å; F78-L108 HydrophobicContact CD2-CD1 4.02Å; F78-L108 HydrophobicContact CE2-CD1 4Å; I81-L108 HydrophobicContact CD1-CD1 3.98Å; I81-L108 HydrophobicContact CG2-CD1 4.03Å; S104-L108 WeakPolarHBondContact O-CB 3.5Å; S104-L108 WeakPolarHBondContact O-CG 3.41Å; S104-L108 PolarHBondContact O-N 3.02Å; Q106-L108 VanDerWaalsContact C-N 3.33Å; Q106-L108 PolarHBondContact O-N 3.12Å; L108-V110 VanDerWaalsContact C-N 3.31Å; L108-V110 HydrophobicContact CB-CG2 4.01Å; L108-V110 PolarHBondContact O-N 3.37Å
109	G	92.5	Very high	86.8	Confident	18 Å²	18	55.3 Å²	55.3	19%	0.186	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	33	-176.9	0	0	0	0	0	114.6	T55 G105 Q106 K111	T55-G109 WeakPolarHBondContact OG1-CA 3.48Å; G105-G109 CarbonylContact O-C 3.59Å; G105-G109 WeakPolarHBondContact O-CA 3.44Å; G105-G109 PolarHBondContact O-N 3.12Å; Q106-G109 PolarHBondContact O-N 3.39Å; G109-K111 PolarHBondContact O-N 3.46Å
110	V	94.6	Very high	85.1	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.018	31%	0.306	C	S	.	.			trans	-86.6	89.8	174.1	-176	0	0	0	0	108.3	I81 Y84 I85 G105 L108 F112 I113 A114	I81-V110 HydrophobicContact CG2-CG2 4.17Å; Y84-V110 HydrophobicContact CD1-CG1 4Å; Y84-V110 HydrophobicContact CE1-CG1 3.82Å; I85-V110 HydrophobicContact CD1-CG2 4.47Å; G105-V110 PolarHBondContact O-N 3.32Å; L108-V110 VanDerWaalsContact C-N 3.31Å; L108-V110 HydrophobicContact CB-CG2 4.01Å; L108-V110 PolarHBondContact O-N 3.37Å; V110-F112 PolarHBondContact O-N 3.12Å; V110-I113 HydrophobicContact CB-CB 4.44Å; V110-I113 HydrophobicContact CB-CD1 4.39Å; V110-I113 HydrophobicContact CB-CG1 4.46Å; V110-I113 HydrophobicContact CG1-CB 4.3Å; V110-I113 HydrophobicContact CG1-CD1 3.82Å; V110-I113 HydrophobicContact CG1-CG1 3.83Å; V110-I113 PolarHBondContact O-N 3.26Å; V110-A114 PolarHBondContact O-N 3.12Å
111	K	90.8	Very high	83.2	Confident	150 Å²	150	60.6 Å²	60.6	65%	0.652	33%	0.332	S	S	*	.	H	α-helix	trans	-42.8	-55.5	-166.9	-63.7	-176.4	-179.8	-179.6	0	114.9	G109 I113 A114 E115	G109-K111 PolarHBondContact O-N 3.46Å; K111-I113 PolarHBondContact O-N 3.34Å; K111-A114 WeakPolarHBondContact O-CB 3.12Å; K111-A114 PolarHBondContact O-N 2.89Å; K111-A114 VanDerWaalsContact O-N 3.13Å; K111-E115 WeakPolarHBondContact O-CB 3.47Å; K111-E115 WeakPolarHBondContact O-CG 3.48Å; K111-E115 PolarHBondContact O-N 3.31Å
112	F	92.9	Very high	81	Confident	102 Å²	102	67.3 Å²	67.3	45%	0.447	36%	0.364	S	S	.	.	H	α-helix	trans	-56.2	-47.3	-178.4	177.7	-102.2	0	0	0	112.5	Y84 I90 V110 A114 E115 L116	Y84-F112 HydrophobicContact CD2-CD1 4.18Å; Y84-F112 HydrophobicContact CD2-CE1 4.38Å; Y84-F112 HydrophobicContact CE1-CB 4.34Å; Y84-F112 HydrophobicContact CE1-CD1 4.27Å; Y84-F112 AromaticContact CE2-CD1 3.4Å; Y84-F112 HydrophobicContact CE2-CD1 3.4Å; Y84-F112 AromaticContact CE2-CE1 3.76Å; Y84-F112 HydrophobicContact CE2-CE1 3.76Å; Y84-F112 HydrophobicContact CE2-CG 4.2Å; Y84-F112 AromaticContact CZ-CD1 3.46Å; Y84-F112 VanDerWaalsContact CZ-CD1 3.46Å; Y84-F112 AromaticContact CZ-CG 3.89Å; Y84-F112 WeakPolarHBondContact OH-CB 3.33Å; Y84-F112 WeakPolarHBondContact OH-CD1 3.46Å; Y84-F112 WeakPolarHBondContact OH-CG 3.35Å; I90-F112 HydrophobicContact CD1-CD1 4.27Å; I90-F112 HydrophobicContact CD1-CE1 3.86Å; I90-F112 HydrophobicContact CG1-CE1 4.48Å; V110-F112 PolarHBondContact O-N 3.12Å; F112-A114 VanDerWaalsContact C-N 3.34Å; F112-A114 PolarHBondContact O-N 2.95Å; F112-E115 PolarHBondContact O-N 3.16Å; F112-L116 HydrophobicContact CD1-CD2 4.48Å; F112-L116 HydrophobicContact CE1-CD2 3.91Å; F112-L116 HydrophobicContact CE2-CD2 4.49Å; F112-L116 HydrophobicContact CZ-CD2 3.91Å; F112-L116 WeakPolarHBondContact O-CG 3.22Å; F112-L116 PolarHBondContact O-N 2.91Å
113	I	91.1	Very high	78.8	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-66.1	-40	179.2	-55.8	-175.2	0	0	0	110.8	I81 Y84 I90 L101 V110 K111 E115 L116	I81-I113 HydrophobicContact CB-CD1 4.21Å; I81-I113 HydrophobicContact CG1-CD1 3.89Å; I81-I113 HydrophobicContact CG2-CD1 4.07Å; Y84-I113 HydrophobicContact CD1-CD1 3.65Å; Y84-I113 HydrophobicContact CD1-CG1 3.88Å; Y84-I113 HydrophobicContact CE1-CD1 4.4Å; Y84-I113 HydrophobicContact CE1-CG1 4.19Å; Y84-I113 HydrophobicContact CG-CD1 4Å; Y84-I113 HydrophobicContact CG-CG1 4.27Å; I90-I113 HydrophobicContact CD1-CG1 4.19Å; L101-I113 HydrophobicContact CD1-CG2 4.01Å; L101-I113 HydrophobicContact CG-CG2 3.8Å; L101-I113 WeakPolarHBondContact O-CG2 3.19Å; V110-I113 HydrophobicContact CB-CB 4.44Å; V110-I113 HydrophobicContact CB-CD1 4.39Å; V110-I113 HydrophobicContact CB-CG1 4.46Å; V110-I113 HydrophobicContact CG1-CB 4.3Å; V110-I113 HydrophobicContact CG1-CD1 3.82Å; V110-I113 HydrophobicContact CG1-CG1 3.83Å; V110-I113 PolarHBondContact O-N 3.26Å; K111-I113 PolarHBondContact O-N 3.34Å; I113-E115 PolarHBondContact O-N 2.79Å; I113-L116 HydrophobicContact CG2-CD1 4.28Å; I113-L116 PolarHBondContact O-N 2.83Å
114	A	89.6	Confident	76.6	Confident	17 Å²	17	74.1 Å²	74.1	14%	0.14	40%	0.398	C	S	.	.	H	α-helix	trans	-63.2	-27.7	176.9	0	0	0	0	0	113.6	Q106 V110 K111 F112	Q106-A114 HydrophobicContact CB-CB 4.32Å; Q106-A114 HydrophobicContact CG-CB 3.51Å; Q106-A114 PolarHBondContact NE2-O 2.83Å; V110-A114 PolarHBondContact O-N 3.12Å; K111-A114 WeakPolarHBondContact O-CB 3.12Å; K111-A114 PolarHBondContact O-N 2.89Å; K111-A114 VanDerWaalsContact O-N 3.13Å; F112-A114 VanDerWaalsContact C-N 3.34Å; F112-A114 PolarHBondContact O-N 2.95Å
115	E	88.4	Confident	74	Confident	109 Å²	109	79.5 Å²	79.5	51%	0.509	44%	0.436	S	S	.	.	H	α-helix	trans	-94.6	-10.8	-176.6	-71.5	166.9	-151.2	0	0	113.8	K111 F112 I113 G117 V118	K111-E115 WeakPolarHBondContact O-CB 3.47Å; K111-E115 WeakPolarHBondContact O-CG 3.48Å; K111-E115 PolarHBondContact O-N 3.31Å; F112-E115 PolarHBondContact O-N 3.16Å; I113-E115 PolarHBondContact O-N 2.79Å; E115-G117 PolarHBondContact O-N 2.96Å; E115-V118 WeakPolarHBondContact O-CB 3.46Å; E115-V118 PolarHBondContact O-N 3.5Å
116	L	82.4	Confident	71.6	Confident	68 Å²	68	86.6 Å²	86.6	36%	0.356	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-25.3	178.9	-70.2	171.4	0	0	0	114.4	I90 L98 I102 F112 I113 V118	I90-L116 HydrophobicContact CD1-CD1 3.71Å; L98-L116 HydrophobicContact CD1-CD1 4.39Å; I102-L116 HydrophobicContact CD1-CB 4.2Å; I102-L116 HydrophobicContact CG1-CB 3.97Å; F112-L116 HydrophobicContact CD1-CD2 4.48Å; F112-L116 HydrophobicContact CE1-CD2 3.91Å; F112-L116 HydrophobicContact CE2-CD2 4.49Å; F112-L116 HydrophobicContact CZ-CD2 3.91Å; F112-L116 WeakPolarHBondContact O-CG 3.22Å; F112-L116 PolarHBondContact O-N 2.91Å; I113-L116 HydrophobicContact CG2-CD1 4.28Å; I113-L116 PolarHBondContact O-N 2.83Å; L116-V118 VanDerWaalsContact C-N 3.35Å
117	G	66.6	Low	68.8	Low	52 Å²	52	87.3 Å²	87.3	54%	0.536	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-4.6	176.4	0	0	0	0	0	114.9	E115	E115-G117 PolarHBondContact O-N 2.96Å
118	V	66.7	Low	65.8	Low	63 Å²	63	86.1 Å²	86.1	38%	0.382	50%	0.501	S	S	.	.	S	Bend	trans	-94.7	125.7	-178.7	-176.1	0	0	0	0	109.6	E115 L116 L120 Q122	E115-V118 WeakPolarHBondContact O-CB 3.46Å; E115-V118 PolarHBondContact O-N 3.5Å; L116-V118 VanDerWaalsContact C-N 3.35Å; V118-L120 PolarHBondContact O-N 2.88Å; V118-Q122 HydrophobicContact CG1-CB 4.23Å
119	P	53.6	Low	62.9	Low	79 Å²	79	93 Å²	93	51%	0.513	54%	0.543	S	S	.	.			trans	-57.5	129.3	174.3	-26.1	35.4	0	0	0	112	S121 Q122	P119-S121 PolarHBondContact O-N 2.98Å; P119-Q122 PolarHBondContact O-N 3Å
120	L	51.1	Low	59.9	Low	155 Å²	155	97 Å²	97	81%	0.812	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-54.2	-19	-177.1	-74	164.2	0	0	0	114.4	V118 Q122 V123	V118-L120 PolarHBondContact O-N 2.88Å; L120-Q122 PolarHBondContact O-N 2.96Å; L120-Q122 VanDerWaalsContact O-N 3.17Å; L120-V123 PolarHBondContact O-N 2.92Å
121	S	51.4	Low	57	Low	111 Å²	111	106 Å²	106	78%	0.776	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-62.7	-12.5	172.9	55	0	0	0	0	114.9	P119	P119-S121 PolarHBondContact O-N 2.98Å
122	Q	46.3	Very low	54.1	Low	143 Å²	143	106.9 Å²	106.9	67%	0.668	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-98.4	-11.6	176.3	-59.5	-168.9	8.6	0	0	113.9	V118 P119 L120 K124	V118-Q122 HydrophobicContact CG1-CB 4.23Å; P119-Q122 PolarHBondContact O-N 3Å; L120-Q122 PolarHBondContact O-N 2.96Å; L120-Q122 VanDerWaalsContact O-N 3.17Å; Q122-K124 VanDerWaalsContact C-N 3.28Å; Q122-K124 PolarHBondContact O-N 3.41Å
123	V	43.9	Very low	51	Low	71 Å²	71	105.1 Å²	105.1	43%	0.43	64%	0.638	S	S	.	*			trans	-81.9	72	-179.2	-171.4	0	0	0	0	110.4	L120 S125	L120-V123 PolarHBondContact O-N 2.92Å; V123-S125 PolarHBondContact O-N 2.82Å
124	K	45.3	Very low	48	Very low	203 Å²	203	113 Å²	113	88%	0.883	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	62.8	-173.8	-164.7	-177.8	177.3	175.1	0	113.5	Q122	Q122-K124 VanDerWaalsContact C-N 3.28Å; Q122-K124 PolarHBondContact O-N 3.41Å
125	S	38.6	Very low	45.1	Very low	117 Å²	117	118.7 Å²	118.7	82%	0.818	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.3	23.6	172.3	-97.9	0	0	0	0	115.2	V123	V123-S125 PolarHBondContact O-N 2.82Å
126	I	41.8	Very low	42.3	Very low	149 Å²	149	120.5 Å²	120.5	76%	0.764	72%	0.722	S	S	*	*			trans	-129.6	105.5	171.6	-42.3	177.2	0	0	0	109.8
127	S	32.4	Very low	40	Very low	127 Å²	127	123 Å²	123	89%	0.888	74%	0.743	S	S	*	*			trans	-118.6	75.3	173	-64.5	0	0	0	0	110.2
128	G	29.4	Very low	38.3	Very low	72 Å²	72	127.2 Å²	127.2	74%	0.742	75%	0.752	S	S	*	*			trans	-86.1	124.4	161.4	0	0	0	0	0	109
129	T	31.7	Very low	36.8	Very low	145 Å²	145	129.7 Å²	129.7	89%	0.89	77%	0.769	S	S	*	*			trans	-82.7	122.3	-175.8	47.6	0	0	0	0	112.2
130	A	29.7	Very low	36.2	Very low	101 Å²	101	131.7 Å²	131.7	84%	0.835	78%	0.782	S	S	*	*			trans	-120.7	113.5	154.6	0	0	0	0	0	108.3
131	Q	32.9	Very low	35	Very low	191 Å²	191	131.6 Å²	131.6	89%	0.893	78%	0.783	S	S	*	*			trans	-82.1	145.4	155.7	-72.8	-175.7	-34.8	0	0	107.5
132	D	29.6	Very low	34	Very low	170 Å²	170	131.5 Å²	131.5	91%	0.909	78%	0.782	S	S	*	*			trans	-157.8	161.4	144.2	-136.7	-28	0	0	0	113.2
133	G	29	Very low	33.2	Very low	64 Å²	64	128.3 Å²	128.3	66%	0.66	79%	0.788	S	S	*	*			trans	66.2	87.5	152.4	0	0	0	0	0	119.3
134	N	28	Very low	32.5	Very low	167 Å²	167	131.7 Å²	131.7	89%	0.893	80%	0.803	S	S	*	*			trans	-61.9	133.4	155	-83.4	-40.8	0	0	0	111
135	T	28.7	Very low	32	Very low	136 Å²	136	131 Å²	131	83%	0.834	80%	0.801	S	S	*	*			trans	-157.2	110	144.2	-70.7	0	0	0	0	109.2
136	E	29.9	Very low	31.4	Very low	147 Å²	147	132.2 Å²	132.2	69%	0.687	80%	0.798	S	S	*	*			trans	-78.1	149.7	162.7	-141.4	-170.7	167.5	0	0	108.7	L138	E136-L138 WeakPolarHBondContact OE1-CD2 3.47Å; E136-L138 WeakPolarHBondContact OE1-CG 3.14Å
137	P	33.5	Very low	30.8	Very low	121 Å²	121	132.2 Å²	132.2	79%	0.786	80%	0.798	S	S	*	*				-142.5	172.6	92.3	35.7	-19.4	0	0	0	115.8
138	L	29.9	Very low	30.6	Very low	140 Å²	140	131.5 Å²	131.5	73%	0.733	79%	0.789	S	S	*	*			trans	-69	168.4	-173.2	-73.9	167.6	0	0	0	115.3	E136	E136-L138 WeakPolarHBondContact OE1-CD2 3.47Å; E136-L138 WeakPolarHBondContact OE1-CG 3.14Å
139	P	36.7	Very low	30.6	Very low	114 Å²	114	135.3 Å²	135.3	74%	0.74	79%	0.79	S	S	*	*			trans	-108.5	-148.6	-149.5	44.9	-37.7	0	0	0	114.6
140	P	39.7	Very low	30.4	Very low	121 Å²	121	137.6 Å²	137.6	79%	0.786	79%	0.791	S	S	*	*				-89.2	168.9	-124.1	41.8	-30.7	0	0	0	115.2
141	D	27.3	Very low	30.3	Very low	154 Å²	154	142.3 Å²	142.3	82%	0.824	79%	0.792	S	S	*	*			trans	-124.7	161.6	154.7	-157.1	-5.5	0	0	0	111.1
142	S	30.5	Very low	30	Very low	108 Å²	108	138.9 Å²	138.9	76%	0.755	79%	0.789	S	S	*	*			trans	-78.1	165.1	-168.7	58	0	0	0	0	115.4
143	G	28.8	Very low	29.9	Very low	77 Å²	77	138.8 Å²	138.8	79%	0.794	78%	0.781	S	S	*	*			trans	170.4	78.7	174.8	0	0	0	0	0	115.1
144	D	29.3	Very low	29.9	Very low	142 Å²	142	140.7 Å²	140.7	76%	0.759	78%	0.776	S	S	*	*			trans	-62.5	166.3	179.5	-63.2	-66.5	0	0	0	115.7
145	K	35.4	Very low	29.9	Very low	189 Å²	189	141.4 Å²	141.4	82%	0.822	77%	0.774	S	S	*	*			trans	98.7	110.6	161	-56.2	137.3	-162.3	164.1	0	114
146	N	26.2	Very low	29.8	Very low	142 Å²	142	139.9 Å²	139.9	76%	0.759	78%	0.775	S	S	*	*			cis	65	92.6	34.8	-164.5	8.3	0	0	0	113.9
147	L	28.2	Very low	29.9	Very low	148 Å²	148	142.3 Å²	142.3	78%	0.775	79%	0.787	S	S	*	*				-172.4	133.3	125.1	-122.4	72.5	0	0	0	114.3
148	V	27.7	Very low	29.6	Very low	113 Å²	113	143.6 Å²	143.6	69%	0.685	79%	0.787	S	S	*	*			trans	52	98.9	134.7	174.6	0	0	0	0	120.7
149	I	29.2	Very low	29.7	Very low	152 Å²	152	144.4 Å²	144.4	78%	0.779	79%	0.792	S	S	*	*				7.7	120.4	121.3	-53.8	159.4	0	0	0	116.9
150	Q	28.6	Very low	29.3	Very low	192 Å²	192	142.3 Å²	142.3	90%	0.897	79%	0.792	S	S	*	*				-159.9	163	124	-113.5	175.2	46.7	0	0	114.9
151	K	27.1	Very low	28.9	Very low	200 Å²	200	141 Å²	141	87%	0.87	79%	0.791	S	S	*	*			trans	-107.1	143.1	-157.5	174.5	-173.6	-175.2	178.3	0	111.3
152	S	27.2	Very low	29.2	Very low	119 Å²	119	140 Å²	140	83%	0.832	79%	0.791	S	S	*	*			trans	-137.6	157.7	166	54.4	0	0	0	0	113
153	K	27.8	Very low	29.7	Very low	168 Å²	168	142.1 Å²	142.1	73%	0.73	79%	0.792	S	S	*	*			trans	-116.4	161.5	170	-106.7	178.5	143.2	-80.9	0	105.5
154	D	27.4	Very low	29.7	Very low	104 Å²	104	145.8 Å²	145.8	56%	0.556	79%	0.79	S	S	*	*			cis	-149.6	161	15.4	-109.3	-42.4	0	0	0	112
155	E	28.9	Very low	29.9	Very low	182 Å²	182	144.3 Å²	144.3	85%	0.85	79%	0.788	S	S	*	*			trans	30.2	112.6	150.2	-58.7	179.5	140.3	0	0	122.4
156	A	27.2	Very low	29.7	Very low	104 Å²	104	141.7 Å²	141.7	86%	0.86	78%	0.782	S	S	*	*			trans	-163.8	155.1	131.7	0	0	0	0	0	111.9
157	Q	30.8	Very low	30.2	Very low	198 Å²	198	141.7 Å²	141.7	93%	0.925	78%	0.78	S	S	*	*			trans	-67.3	141.4	-171.5	-61.6	147.5	-91.5	0	0	115.6
158	D	28.1	Very low	30.4	Very low	149 Å²	149	140.1 Å²	140.1	80%	0.797	78%	0.777	S	S	*	*				-162.6	177.4	109.6	-156.8	1.4	0	0	0	110.9
159	N	31.1	Very low	30.7	Very low	156 Å²	156	141.2 Å²	141.2	83%	0.834	78%	0.775	S	S	*	*			trans	-81.5	142.9	-169.7	-64.1	-92.7	0	0	0	113.6
160	G	29.4	Very low	30.7	Very low	71 Å²	71	138.6 Å²	138.6	73%	0.732	77%	0.77	S	S	*	*			trans	-159.8	102.8	171	0	0	0	0	0	111.6	T162	G160-T162 PolarHBondContact O-N 3.42Å
161	A	31.7	Very low	30.8	Very low	94 Å²	94	137.2 Å²	137.2	78%	0.777	76%	0.761	S	S	*	*			trans	-68.7	124.7	-176.8	0	0	0	0	0	111.7	I163	A161-I163 VanDerWaalsContact C-N 3.33Å; A161-I163 PolarHBondContact O-N 2.9Å
162	T	31.7	Very low	31.1	Very low	133 Å²	133	130 Å²	130	82%	0.816	74%	0.736	S	S	*	*			trans	-74.8	85.7	172.8	-46.2	0	0	0	0	109.9	G160 M164	G160-T162 PolarHBondContact O-N 3.42Å; T162-M164 VanDerWaalsContact C-N 3.33Å; T162-M164 PolarHBondContact O-N 2.96Å
163	I	41.2	Very low	31.3	Very low	151 Å²	151	133.4 Å²	133.4	77%	0.774	74%	0.744	S	S	*	*			trans	-69.8	92.6	171.7	-58.8	174.9	0	0	0	108	A161	A161-I163 VanDerWaalsContact C-N 3.33Å; A161-I163 PolarHBondContact O-N 2.9Å
164	M	29.9	Very low	31.6	Very low	154 Å²	154	130 Å²	130	76%	0.759	74%	0.741	S	S	*	*			trans	-65.9	147	162.4	-80.7	-173.4	145.2	0	0	109.8	T162 I166	T162-M164 VanDerWaalsContact C-N 3.33Å; T162-M164 PolarHBondContact O-N 2.96Å; M164-I166 PolarHBondContact O-N 3.09Å; M164-I166 VanDerWaalsContact O-N 3.1Å
165	P	33.3	Very low	32	Very low	112 Å²	112	128.9 Å²	128.9	73%	0.727	75%	0.746	S	S	*	*			trans	-66.4	113.3	-173.6	26.2	-34.2	0	0	0	111.2	I167	P165-I167 PolarHBondContact O-N 3.33Å
166	I	31.1	Very low	32.4	Very low	133 Å²	133	128.1 Å²	128.1	68%	0.682	74%	0.743	S	S	*	*			trans	-72.3	110.6	168.5	-64.1	173.5	0	0	0	107.5	M164 T168	M164-I166 PolarHBondContact O-N 3.09Å; M164-I166 VanDerWaalsContact O-N 3.1Å; I166-T168 VanDerWaalsContact C-N 3.26Å; I166-T168 HydrophobicContact CG2-CG2 3.5Å; I166-T168 PolarHBondContact O-N 2.96Å
167	I	36.8	Very low	32.6	Very low	142 Å²	142	130.9 Å²	130.9	73%	0.728	74%	0.743	S	S	*	*			trans	-80.1	78.7	173.6	-53.7	178.7	0	0	0	108.7	P165 E169	P165-I167 PolarHBondContact O-N 3.33Å; I167-E169 VanDerWaalsContact C-N 3.3Å; I167-E169 PolarHBondContact O-N 3.07Å
168	T	32.1	Very low	32.9	Very low	115 Å²	115	131.7 Å²	131.7	71%	0.706	74%	0.74	S	S	*	*			trans	-91.7	50.5	171.6	35	0	0	0	0	112.2	I166	I166-T168 VanDerWaalsContact C-N 3.26Å; I166-T168 HydrophobicContact CG2-CG2 3.5Å; I166-T168 PolarHBondContact O-N 2.96Å
169	E	33.9	Very low	33.1	Very low	137 Å²	137	133.4 Å²	133.4	64%	0.64	74%	0.743	S	S	*	*			trans	-120.8	110.3	169.2	-68	-165.2	168.8	0	0	110.3	I167 F171	I167-E169 VanDerWaalsContact C-N 3.3Å; I167-E169 PolarHBondContact O-N 3.07Å; E169-F171 HydrophobicContact CB-CE1 4.09Å; E169-F171 HydrophobicContact CB-CE2 4.07Å; E169-F171 HydrophobicContact CB-CZ 3.64Å; E169-F171 PolarHBondContact O-N 3.12Å
170	S	30.5	Very low	33.1	Very low	97 Å²	97	135 Å²	135	68%	0.678	75%	0.747	S	S	*	*			trans	-93.5	86	-179.9	54.5	0	0	0	0	110.2	S172	S170-S172 PolarHBondContact O-N 2.87Å
171	F	30.4	Very low	33.4	Very low	162 Å²	162	140.7 Å²	140.7	71%	0.711	75%	0.752	S	S	*	*			trans	-61	109.8	179.1	-54.5	-72	0	0	0	111.1	E169	E169-F171 HydrophobicContact CB-CE1 4.09Å; E169-F171 HydrophobicContact CB-CE2 4.07Å; E169-F171 HydrophobicContact CB-CZ 3.64Å; E169-F171 PolarHBondContact O-N 3.12Å
172	S	32.8	Very low	33.5	Very low	50 Å²	50	144.8 Å²	144.8	35%	0.35	75%	0.752	S	S	.	*			trans	-122.7	112.9	168.8	-68.3	0	0	0	0	107.9	K89 S170 S174	K89-S172 WeakPolarHBondContact CE-OG 3.37Å; K89-S172 PolarHBondContact NZ-OG 3.26Å; S170-S172 PolarHBondContact O-N 2.87Å; S172-S174 VanDerWaalsContact C-N 3.27Å; S172-S174 PolarHBondContact O-N 3.2Å
173	L	32.1	Very low	33.5	Very low	189 Å²	189	145.2 Å²	145.2	99%	0.99	75%	0.748	S	S	*	*			trans	-80.6	79.2	172.3	-68.1	175.2	0	0	0	109.6
174	S	33.4	Very low	33.1	Very low	96 Å²	96	144.3 Å²	144.3	67%	0.671	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-102.2	140.5	157.8	45.2	0	0	0	0	108.2	S172	S172-S174 VanDerWaalsContact C-N 3.27Å; S172-S174 PolarHBondContact O-N 3.2Å
175	A	35	Very low	33.3	Very low	81 Å²	81	143 Å²	143	67%	0.669	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-60	150.7	-179.9	0	0	0	0	0	111.9	D177	A175-D177 PolarHBondContact O-N 3.22Å
176	E	37.2	Very low	33.3	Very low	166 Å²	166	143.5 Å²	143.5	78%	0.776	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-64	121.9	-173.9	-55.5	95.5	-104.9	0	0	113.9	Y178	E176-Y178 PolarHBondContact O-N 3.35Å
177	D	32.8	Very low	33.5	Very low	163 Å²	163	144.4 Å²	144.4	87%	0.872	75%	0.751	S	S	*	*			trans	-72.2	112.9	167.8	-76.5	-51.9	0	0	0	110.6	A175 E179	A175-D177 PolarHBondContact O-N 3.22Å; D177-E179 PolarHBondContact O-N 3.07Å
178	Y	35.8	Very low	33.5	Very low	215 Å²	215	143.4 Å²	143.4	84%	0.843	76%	0.757	S	S	*	*			trans	-81.9	105.6	175.7	-103.2	-95.5	0	0	0	111.7	E176 M180	E176-Y178 PolarHBondContact O-N 3.35Å; Y178-M180 PolarHBondContact O-N 3.29Å
179	E	32.3	Very low	34	Very low	185 Å²	185	144.4 Å²	144.4	86%	0.864	76%	0.758	S	S	*	*			trans	-71.8	105.3	-178.3	-169.8	178.7	-157.3	0	0	112.4	D177 K181	D177-E179 PolarHBondContact O-N 3.07Å; E179-K181 PolarHBondContact O-N 2.67Å; E179-K181 VanDerWaalsContact O-N 3.1Å
180	M	31.6	Very low	34.6	Very low	188 Å²	188	144.8 Å²	144.8	93%	0.926	77%	0.765	S	S	*	*			trans	-71	105.1	174.9	-91.3	-165	174.3	0	0	111.9	Y178 K182	Y178-M180 PolarHBondContact O-N 3.29Å; M180-K182 PolarHBondContact O-N 3.47Å; M180-K182 VanDerWaalsContact O-N 3.07Å
181	K	35.8	Very low	35.1	Very low	191 Å²	191	146.9 Å²	146.9	83%	0.83	77%	0.768	S	S	*	*			trans	-72	99.7	-175.4	-158.2	168.5	-166.5	166	0	112.3	E179 I183	E179-K181 PolarHBondContact O-N 2.67Å; E179-K181 VanDerWaalsContact O-N 3.1Å; K181-I183 PolarHBondContact O-N 2.68Å
182	K	33.6	Very low	35.8	Very low	180 Å²	180	146.1 Å²	146.1	78%	0.783	77%	0.771	S	S	*	*			trans	-55.5	117.7	175.2	-178.4	-179.4	-179.4	-179.9	0	111.8	M180	M180-K182 PolarHBondContact O-N 3.47Å; M180-K182 VanDerWaalsContact O-N 3.07Å
183	I	32.4	Very low	36.5	Very low	142 Å²	142	151 Å²	151	73%	0.728	79%	0.794	S	S	*	*			trans	-112.4	134.9	168.4	-65.7	175.1	0	0	0	108.4	K181 V185	K181-I183 PolarHBondContact O-N 2.68Å; I183-V185 HydrophobicContact CG2-CG2 4.01Å
184	I	33.2	Very low	37.1	Very low	132 Å²	132	149.5 Å²	149.5	68%	0.677	79%	0.787	S	S	*	*			trans	-115.8	124.2	167.5	-62.6	168.9	0	0	0	106.5
185	V	32.6	Very low	37.5	Very low	127 Å²	127	152.4 Å²	152.4	77%	0.77	80%	0.795	S	S	*	*			trans	-135.8	149.5	163	-179.3	0	0	0	0	107.3	I183	I183-V185 HydrophobicContact CG2-CG2 4.01Å
186	T	33.5	Very low	37.9	Very low	122 Å²	122	153.3 Å²	153.3	75%	0.748	79%	0.791	S	S	*	*			trans	-93.2	172.6	-168.7	48.6	0	0	0	0	114
187	D	35.3	Very low	37.9	Very low	152 Å²	152	152.1 Å²	152.1	81%	0.813	79%	0.789	S	S	*	*			trans	-42	145.1	-177.3	-45.3	-51.3	0	0	0	117.1
188	S	38.3	Very low	37.7	Very low	122 Å²	122	153.1 Å²	153.1	85%	0.853	79%	0.786	S	S	*	*			trans	-148.9	135.6	137.6	-174.7	0	0	0	0	107.3
189	D	41.9	Very low	37.4	Very low	135 Å²	135	148.2 Å²	148.2	72%	0.722	78%	0.782	S	S	*	*			trans	-81.2	-179.8	-174.7	-58.3	-78.4	0	0	0	114.2
190	D	45.4	Very low	37.4	Very low	146 Å²	146	145 Å²	145	78%	0.781	78%	0.78	S	S	*	*			trans	96.1	117.3	159.7	-57.2	-21.4	0	0	0	120.2
191	D	42.5	Very low	37.2	Very low	140 Å²	140	143.8 Å²	143.8	75%	0.749	77%	0.772	S	S	*	*			trans	76.1	109.7	147	-56.7	-12.7	0	0	0	124.2
192	D	44.1	Very low	37	Very low	147 Å²	147	142.4 Å²	142.4	79%	0.786	77%	0.772	S	S	*	*			trans	66.8	116.5	138.6	-62.1	-10.8	0	0	0	124.6
193	D	47.9	Very low	36.9	Very low	153 Å²	153	140.2 Å²	140.2	82%	0.818	77%	0.768	S	S	*	*			trans	36.5	108	141.6	-66.6	-11.4	0	0	0	122.4
194	D	44.6	Very low	36.9	Very low	157 Å²	157	139.4 Å²	139.4	84%	0.84	77%	0.772	S	S	*	*				-168.7	125.5	127.6	-118	-22.9	0	0	0	113.1	V196	D194-V196 HydrophobicContact CB-CG2 4.46Å; D194-V196 PolarHBondContact O-N 3.11Å
195	D	42	Very low	36.6	Very low	157 Å²	157	140 Å²	140	84%	0.84	78%	0.782	S	S	*	*			trans	-81.6	76.5	-176.1	-107.3	-29.4	0	0	0	112.9	I197	D195-I197 PolarHBondContact O-N 2.88Å; D195-I197 VanDerWaalsContact O-N 3.11Å
196	V	42.4	Very low	36.5	Very low	99 Å²	99	142.6 Å²	142.6	60%	0.6	78%	0.783	S	S	*	*			trans	-83.7	84.8	-177.8	-170.3	0	0	0	0	113	D194 F198	D194-V196 HydrophobicContact CB-CG2 4.46Å; D194-V196 PolarHBondContact O-N 3.11Å; V196-F198 HydrophobicContact CB-CE2 4.46Å; V196-F198 HydrophobicContact CG1-CD2 3.96Å; V196-F198 HydrophobicContact CG1-CE2 3.56Å; V196-F198 HydrophobicContact CG1-CZ 3.99Å; V196-F198 PolarHBondContact O-N 3.29Å
197	I	37.6	Very low	36.2	Very low	141 Å²	141	144.1 Å²	144.1	72%	0.723	78%	0.781	S	S	*	*			trans	-78	109.8	169.7	-58.8	-179.2	0	0	0	110.6	D195 C199	D195-I197 PolarHBondContact O-N 2.88Å; D195-I197 VanDerWaalsContact O-N 3.11Å; I197-C199 PolarHBondContact O-N 2.74Å
198	F	29.7	Very low	35.7	Very low	184 Å²	184	143.5 Å²	143.5	81%	0.807	78%	0.784	S	S	*	*			trans	-75.7	90.1	176.2	-81.4	-87.3	0	0	0	113	V196	V196-F198 HydrophobicContact CB-CE2 4.46Å; V196-F198 HydrophobicContact CG1-CD2 3.96Å; V196-F198 HydrophobicContact CG1-CE2 3.56Å; V196-F198 HydrophobicContact CG1-CZ 3.99Å; V196-F198 PolarHBondContact O-N 3.29Å
199	C	29.3	Very low	35.3	Very low	113 Å²	113	145.1 Å²	145.1	76%	0.764	78%	0.782	S	S	*	*			trans	-88.7	111.5	166.1	-73.1	0	0	0	0	111.2	I197 E201	I197-C199 PolarHBondContact O-N 2.74Å; C199-E201 PolarHBondContact O-N 3.02Å
200	S	30.8	Very low	34.8	Very low	117 Å²	117	144.8 Å²	144.8	82%	0.818	79%	0.787	S	S	*	*			trans	-87.6	93.6	169.9	-63.6	0	0	0	0	111.5
201	E	27.6	Very low	33.9	Very low	162 Å²	162	142.4 Å²	142.4	76%	0.757	78%	0.781	S	S	*	*			trans	-78.9	139.4	171.4	-175.1	174.7	-172.3	0	0	111.3	C199 L203	C199-E201 PolarHBondContact O-N 3.02Å; E201-L203 HydrophobicContact CG-CD1 4.46Å
202	I	32.8	Very low	33.1	Very low	162 Å²	162	141.9 Å²	141.9	83%	0.831	78%	0.779	S	S	*	*			trans	-121.3	105.3	175.2	-56.4	177.4	0	0	0	109.2
203	L	31.6	Very low	32.3	Very low	135 Å²	135	141.5 Å²	141.5	71%	0.707	78%	0.777	S	S	*	*			trans	-108.1	151	164.8	-116.2	75.8	0	0	0	110.2	E201	E201-L203 HydrophobicContact CG-CD1 4.46Å
204	P	31.8	Very low	31.2	Very low	124 Å²	124	140.3 Å²	140.3	81%	0.805	78%	0.775	S	S	*	*			trans	-83	145.6	-167.3	33.2	-34.8	0	0	0	113.1
205	T	27.8	Very low	30.4	Very low	145 Å²	145	139.5 Å²	139.5	89%	0.89	78%	0.776	S	S	*	*			trans	-85.9	147	173	45.8	0	0	0	0	112
206	K	29.1	Very low	29.7	Very low	182 Å²	182	136 Å²	136	79%	0.791	77%	0.768	S	S	*	*			trans	-121.9	148.6	169	-176.3	172	179.3	-179.6	0	110.6
207	E	28.1	Very low	29	Very low	153 Å²	153	140.2 Å²	140.2	72%	0.715	78%	0.781	S	S	*	*			trans	-40.1	149.4	176.4	-47.8	149.3	117.2	0	0	115.6
208	T	24.3	Very low	28.4	Very low	140 Å²	140	138.9 Å²	138.9	86%	0.859	78%	0.78	S	S	*	*				-172.4	147	119.9	-73	0	0	0	0	110.8
209	L	30	Very low	28.4	Very low	156 Å²	156	138.6 Å²	138.6	82%	0.817	78%	0.781	S	S	*	*			trans	-77.9	166.7	176.6	-78	127.4	0	0	0	113.7
210	P	31	Very low	28.2	Very low	127 Å²	127	139.2 Å²	139.2	83%	0.825	79%	0.787	S	S	*	*				-136.4	174.2	116.9	37.6	-27.5	0	0	0	114.7
211	S	26.3	Very low	28.1	Very low	96 Å²	96	140.9 Å²	140.9	67%	0.671	79%	0.786	S	S	*	*			trans	-122.2	165	-167.7	58.2	0	0	0	0	114.1
212	N	25.9	Very low	29.4	Very low	129 Å²	129	139 Å²	139	69%	0.69	79%	0.788	S	S	*	*				170.5	124.5	118.9	-82.8	-15	0	0	0	115.1
213	N	27.8	Very low	29	Very low	140 Å²	140	134.2 Å²	134.2	75%	0.749	78%	0.779	S	S	*	*			trans	53.4	143.6	132.2	-54	-25.5	0	0	0	120.7
214	T	25.3	Very low	30.3	Very low	128 Å²	128	133.7 Å²	133.7	79%	0.785	78%	0.784	S	S	*	*				-164.9	142.8	60.5	-26.5	0	0	0	0	113.7
215	V	27.6	Very low	30.1	Very low	140 Å²	140	133.9 Å²	133.9	85%	0.848	78%	0.782	S	S	*	*			trans	29	144.7	140.4	169.4	0	0	0	0	121.4
216	A	27.5	Very low	30.3	Very low	83 Å²	83	131.1 Å²	131.1	69%	0.686	77%	0.774	S	S	*	*			cis	176.5	164.9	-23.1	0	0	0	0	0	109.2
217	Q	27.2	Very low	30.5	Very low	187 Å²	187	129.8 Å²	129.8	87%	0.874	77%	0.774	S	S	*	*			trans	-174.1	141.9	143.9	-107.2	-170.2	6.6	0	0	117
218	V	25.8	Very low	30.7	Very low	114 Å²	114	127 Å²	127	69%	0.691	77%	0.772	S	S	*	*			trans	59.8	106.5	148.3	-171.4	0	0	0	0	123.6
219	Q	29.1	Very low	31	Very low	178 Å²	178	126.9 Å²	126.9	83%	0.832	77%	0.766	S	S	*	*			trans	9.8	152.8	131	-75.8	169.7	-40.8	0	0	122.3
220	S	25.7	Very low	31	Very low	126 Å²	126	125.7 Å²	125.7	88%	0.881	76%	0.764	S	S	*	*				-163.1	179.8	59.2	41.6	0	0	0	0	116.1
221	N	28.4	Very low	30.9	Very low	151 Å²	151	123.6 Å²	123.6	81%	0.807	76%	0.758	S	S	*	*			trans	-116.5	-176.1	-159.5	-142.6	-3.7	0	0	0	111.5
222	P	54	Low	31.8	Very low	122 Å²	122	124.9 Å²	124.9	79%	0.792	76%	0.764	S	S	*	*			cis	-142.9	172.1	48	38.7	-16.9	0	0	0	118.3
223	G	25.7	Very low	31.9	Very low	62 Å²	62	123.4 Å²	123.4	64%	0.639	76%	0.764	S	S	*	*			trans	-100.6	-138	172	0	0	0	0	0	113.8
224	P	58.1	Low	32	Very low	125 Å²	125	121.2 Å²	121.2	81%	0.812	77%	0.765	S	S	*	*			cis	-143.6	-157.1	15.2	41.2	-18.6	0	0	0	116.1
225	V	27.1	Very low	32.2	Very low	128 Å²	128	119.6 Å²	119.6	78%	0.776	76%	0.759	S	S	*	*			trans	115.2	91.1	158.9	-173.6	0	0	0	0	117.8
226	A	31.6	Very low	32.2	Very low	87 Å²	87	119 Å²	119	72%	0.719	75%	0.751	S	S	*	*				68.1	159.8	129.2	0	0	0	0	0	121.2
227	I	33.2	Very low	32.3	Very low	153 Å²	153	121.8 Å²	121.8	79%	0.785	76%	0.755	S	S	*	*			cis	-166.9	149.8	-18.8	-114.7	173	0	0	0	110.9
228	S	33.4	Very low	32.5	Very low	96 Å²	96	118.3 Å²	118.3	67%	0.671	75%	0.751	S	S	*	*			trans	57.7	154.2	156.7	-75.2	0	0	0	0	121.8
229	D	30.4	Very low	33.5	Very low	136 Å²	136	118.6 Å²	118.6	73%	0.727	76%	0.755	S	S	*	*			cis	-166.1	167.8	-18.3	-121	-54	0	0	0	115
230	V	31	Very low	34.6	Very low	131 Å²	131	115.2 Å²	115.2	79%	0.794	75%	0.749	S	S	*	*			trans	73.2	141.8	150.2	167.6	0	0	0	0	122.8
231	A	27.2	Very low	34.7	Very low	84 Å²	84	116.2 Å²	116.2	69%	0.694	74%	0.744	S	S	*	*			trans	-132.5	-145.3	174.4	0	0	0	0	0	109.2
232	P	46.3	Very low	34.6	Very low	122 Å²	122	115.3 Å²	115.3	79%	0.792	74%	0.743	S	S	*	*			cis	-106	-142.3	-17.5	22.4	3.6	0	0	0	110.9
233	S	27.9	Very low	33.3	Very low	98 Å²	98	116.8 Å²	116.8	69%	0.685	75%	0.745	S	S	*	*			cis	-155.9	155.7	16.8	-47.7	0	0	0	0	109.3
234	A	30.2	Very low	33.5	Very low	94 Å²	94	121.8 Å²	121.8	78%	0.777	76%	0.755	S	S	*	*				69.2	137.2	59.4	0	0	0	0	0	115
235	S	29.4	Very low	31.9	Very low	95 Å²	95	122 Å²	122	66%	0.664	75%	0.754	S	S	*	*			cis	-166.2	177.9	-8.8	48.8	0	0	0	0	109.3
236	N	27.5	Very low	32.7	Very low	126 Å²	126	120.8 Å²	120.8	67%	0.674	75%	0.749	S	S	*	*				172.2	150.2	73.1	-104.4	-19.1	0	0	0	113.5
237	N	29.5	Very low	32.3	Very low	142 Å²	142	122 Å²	122	76%	0.759	75%	0.748	S	S	*	*			trans	63.3	140.6	139.5	-56.6	-14.9	0	0	0	125.7
238	S	30.7	Very low	32	Very low	114 Å²	114	122.8 Å²	122.8	80%	0.797	75%	0.748	S	S	*	*			trans	-106.6	-163.7	162.3	-36.7	0	0	0	0	109.3
239	P	46.8	Very low	31.7	Very low	120 Å²	120	126 Å²	126	78%	0.779	75%	0.75	S	S	*	*			cis	-130.4	-119.2	2	27.7	1.4	0	0	0	116
240	P	52.8	Low	31.5	Very low	107 Å²	107	125.7 Å²	125.7	70%	0.695	75%	0.748	S	S	*	*				-134.1	-173.2	-110.9	44	-25.9	0	0	0	118.7
241	L	27.1	Very low	32	Very low	148 Å²	148	125 Å²	125	78%	0.775	75%	0.745	S	S	*	*			trans	113.1	141.3	138.7	-131.8	81.3	0	0	0	121.3
242	T	27.4	Very low	32.3	Very low	131 Å²	131	125.5 Å²	125.5	80%	0.804	74%	0.74	S	S	*	*			trans	83.4	156	152.1	27	0	0	0	0	123.3
243	N	25.3	Very low	32.2	Very low	153 Å²	153	125.6 Å²	125.6	82%	0.818	74%	0.741	S	S	*	*			trans	-93	177.8	-166.8	-76.8	-26.2	0	0	0	114.8
244	I	31.1	Very low	32.4	Very low	168 Å²	168	126 Å²	126	86%	0.862	74%	0.739	S	S	*	*			trans	123.5	132.8	147.4	-60.2	157.3	0	0	0	114.3
245	T	24.6	Very low	32.3	Very low	129 Å²	129	127.6 Å²	127.6	79%	0.791	73%	0.734	S	S	*	*			trans	-77.2	177.3	176.8	13.1	0	0	0	0	112.9
246	P	43.6	Very low	32.4	Very low	103 Å²	103	131.5 Å²	131.5	67%	0.669	74%	0.742	S	S	*	*			cis	-137.6	-158.7	2.4	37.1	-14.2	0	0	0	115.2
247	T	22.8	Very low	32.5	Very low	112 Å²	112	129.7 Å²	129.7	69%	0.687	75%	0.745	S	S	*	*			trans	83.1	127.9	148.3	38.6	0	0	0	0	123.9
248	Q	27.1	Very low	32.4	Very low	169 Å²	169	129.4 Å²	129.4	79%	0.79	75%	0.748	S	S	*	*			trans	71.6	161.8	143.2	-68.8	-171.2	91.6	0	0	120.9
249	K	27	Very low	32.2	Very low	164 Å²	164	130.6 Å²	130.6	71%	0.713	75%	0.745	S	S	*	*			cis	-178.9	134.2	-32.7	-169.7	-171.4	-174.5	-178.6	0	111.9
250	L	26.2	Very low	31.3	Very low	130 Å²	130	130.3 Å²	130.3	68%	0.681	75%	0.746	S	S	*	*			trans	65	170.2	163.5	-113.3	63.4	0	0	0	117.9	T252	L250-T252 HydrophobicContact CD2-CG2 3.8Å
251	P	41	Very low	30.3	Very low	115 Å²	115	133.1 Å²	133.1	75%	0.747	75%	0.75	S	S	*	*			cis	-106.5	159.1	40.2	7.5	16.6	0	0	0	115.3
252	T	32.8	Very low	30.3	Very low	96 Å²	96	130.4 Å²	130.4	59%	0.589	74%	0.739	S	S	*	*				67	143.3	54.2	33.3	0	0	0	0	115.9	L250 V254	L250-T252 HydrophobicContact CD2-CG2 3.8Å; T252-V254 HydrophobicContact CG2-CG2 3.73Å
253	P	46.1	Very low	30.4	Very low	124 Å²	124	133.3 Å²	133.3	81%	0.805	74%	0.744	S	S	*	*			cis	-108.6	171	35.3	14.4	8.6	0	0	0	115.1
254	V	30.4	Very low	30.5	Very low	105 Å²	105	129.5 Å²	129.5	64%	0.636	74%	0.741	S	S	*	*			cis	111.9	108.6	11.8	172.9	0	0	0	0	115.1	T252	T252-V254 HydrophobicContact CG2-CG2 3.73Å
255	N	28.2	Very low	30.4	Very low	128 Å²	128	126.6 Å²	126.6	68%	0.684	74%	0.735	S	S	*	*			trans	-173	122	130.8	-93.4	-28.6	0	0	0	109.5
256	Q	32.4	Very low	30.7	Very low	177 Å²	177	128.9 Å²	128.9	83%	0.827	74%	0.737	S	S	*	*				62.9	135.7	100.7	-62.5	-176	29.5	0	0	115.3
257	A	29.5	Very low	30.1	Very low	88 Å²	88	132.1 Å²	132.1	73%	0.727	74%	0.741	S	S	*	*			cis	-162.2	162	-15.3	0	0	0	0	0	106.8
258	T	26.4	Very low	30.3	Very low	136 Å²	136	133.3 Å²	133.3	83%	0.834	74%	0.742	S	S	*	*				-175.9	165.5	59.6	-60.2	0	0	0	0	109.6
259	L	27.9	Very low	30.2	Very low	140 Å²	140	132.5 Å²	132.5	73%	0.733	74%	0.742	S	S	*	*			trans	-98.2	155.6	-176.4	-66.7	80.7	0	0	0	115.6
260	S	27.3	Very low	30.2	Very low	114 Å²	114	130.7 Å²	130.7	80%	0.797	75%	0.745	S	S	*	*				-175.1	134.8	125.2	-74.3	0	0	0	0	109.7
261	Q	32.2	Very low	30.2	Very low	165 Å²	165	129.3 Å²	129.3	77%	0.771	75%	0.746	S	S	*	*			cis	77.4	130.1	49.5	-75.6	-155.9	32.8	0	0	114.1
262	T	26.1	Very low	29.6	Very low	91 Å²	91	129 Å²	129	56%	0.558	75%	0.746	S	S	*	*			cis	-165.7	142.4	0.3	-72.6	0	0	0	0	112.4
263	Q	30.4	Very low	29.4	Very low	192 Å²	192	128.9 Å²	128.9	90%	0.897	76%	0.755	S	S	*	*			trans	49	161	159.1	-67.1	164.7	3.3	0	0	120.5
264	G	26.9	Very low	29.5	Very low	73 Å²	73	128.2 Å²	128.2	75%	0.753	75%	0.751	S	S	*	*			cis	-161.3	-167.1	-2.4	0	0	0	0	0	108.8
265	S	30.3	Very low	29.3	Very low	107 Å²	107	130.3 Å²	130.3	75%	0.748	76%	0.764	S	S	*	*			cis	-170.2	148.8	4.3	51.9	0	0	0	0	111.7
266	E	30.1	Very low	29.2	Very low	178 Å²	178	132.4 Å²	132.4	83%	0.832	77%	0.769	S	S	*	*			trans	67.2	154.6	167	-58.2	-174.2	-173.8	0	0	117.5
267	K	31.1	Very low	29	Very low	171 Å²	171	131 Å²	131	74%	0.743	77%	0.766	S	S	*	*			cis	-154.4	141	22.6	-163.9	169.3	-175.5	169.9	0	113.2
268	L	26.1	Very low	28.9	Very low	136 Å²	136	133 Å²	133	71%	0.712	77%	0.77	S	S	*	*			trans	25.7	122.8	165.5	-74.6	102.1	0	0	0	120.8
269	L	26.4	Very low	29.9	Very low	153 Å²	153	131 Å²	131	80%	0.801	76%	0.76	S	S	*	*				66.1	134.3	76.1	-71.2	166	0	0	0	113.7
270	V	27.1	Very low	29.8	Very low	126 Å²	126	131.6 Å²	131.6	76%	0.764	76%	0.763	S	S	*	*			cis	-143.9	142.6	27.5	-174.4	0	0	0	0	112.8
271	S	26.3	Very low	29.9	Very low	101 Å²	101	133.2 Å²	133.2	71%	0.706	76%	0.761	S	S	*	*			trans	-3.5	166.6	132.2	-139	0	0	0	0	120.2
272	S	28.2	Very low	29.7	Very low	108 Å²	108	133.1 Å²	133.1	76%	0.755	77%	0.765	S	S	*	*			cis	-158.3	166.2	2.1	-10.6	0	0	0	0	110.6
273	A	28.6	Very low	29.6	Very low	93 Å²	93	134.6 Å²	134.6	77%	0.769	77%	0.769	S	S	*	*			trans	-100.8	-167.6	166.2	0	0	0	0	0	110.8
274	P	48.1	Very low	29.6	Very low	110 Å²	110	133.6 Å²	133.6	71%	0.714	77%	0.769	S	S	*	*			cis	-130	-170	-16.3	41.3	-24.4	0	0	0	112.9
275	T	26.9	Very low	29.6	Very low	149 Å²	149	136 Å²	136	91%	0.914	76%	0.764	S	S	*	*			trans	167.1	-164.2	137.1	39.1	0	0	0	0	112.6
276	H	25.4	Very low	29.5	Very low	172 Å²	172	140 Å²	140	80%	0.796	77%	0.771	S	S	*	*			trans	-136.6	171.6	-150	-174.9	-115.1	0	0	0	112.7
277	L	26.9	Very low	29.4	Very low	147 Å²	147	137.4 Å²	137.4	77%	0.77	77%	0.768	S	S	*	*			trans	90.7	161.1	173.1	-56.1	174.3	0	0	0	119.2
278	T	28.7	Very low	29.8	Very low	130 Å²	130	135.2 Å²	135.2	80%	0.798	77%	0.771	S	S	*	*			trans	-111	-162.8	-167.1	60.6	0	0	0	0	110.7
279	P	46.9	Very low	29.8	Very low	96 Å²	96	135.8 Å²	135.8	62%	0.623	77%	0.774	S	S	*	*			cis	-126.6	-172.5	-25.9	27.5	-5.1	0	0	0	112.5
280	N	26.6	Very low	29.7	Very low	151 Å²	151	134.3 Å²	134.3	81%	0.807	78%	0.776	S	S	*	*				153.1	154.6	123.5	-83	-42.6	0	0	0	118.9
281	I	28.6	Very low	29.9	Very low	148 Å²	148	134.2 Å²	134.2	76%	0.759	78%	0.776	S	S	*	*			trans	-73.6	139.3	-177.8	-61.9	152.5	0	0	0	114.3
282	I	28.2	Very low	31.2	Very low	163 Å²	163	134.9 Å²	134.9	84%	0.836	78%	0.778	S	S	*	*			trans	-149.3	100.4	148.5	-59.4	-174.3	0	0	0	106.7
283	L	24.6	Very low	32	Very low	123 Å²	123	135.6 Å²	135.6	64%	0.644	78%	0.78	S	S	*	*				52.2	115.5	86.3	-173.2	66.9	0	0	0	116.4
284	L	28.7	Very low	31.8	Very low	171 Å²	171	138.3 Å²	138.3	90%	0.895	78%	0.782	S	S	*	*			trans	-144.7	128.9	155.5	-147.4	78.3	0	0	0	111.6
285	N	26.9	Very low	30.8	Very low	123 Å²	123	138.3 Å²	138.3	66%	0.658	78%	0.78	S	S	*	*			trans	-94.3	153.6	174.4	-67.5	-39.3	0	0	0	110.5
286	Q	29.9	Very low	30.8	Very low	190 Å²	190	135.9 Å²	135.9	89%	0.888	77%	0.768	S	S	*	*				177	150.6	110.3	-94.8	171.3	26.5	0	0	113.8
287	T	27.8	Very low	30.8	Very low	125 Å²	125	132.7 Å²	132.7	77%	0.767	77%	0.766	S	S	*	*			trans	-109.4	166.4	167.8	52.7	0	0	0	0	110.1
288	P	38.7	Very low	30.8	Very low	125 Å²	125	131.5 Å²	131.5	81%	0.812	77%	0.77	S	S	*	*				-135.1	137.7	104.2	34.9	-23.9	0	0	0	111.8
289	L	26	Very low	30.8	Very low	148 Å²	148	132.8 Å²	132.8	78%	0.775	77%	0.771	S	S	*	*				78.1	98.9	55.7	-171	72.5	0	0	0	114.2
290	S	25.5	Very low	30.4	Very low	121 Å²	121	133 Å²	133	85%	0.846	77%	0.772	S	S	*	*			trans	-157.8	156	147	40.8	0	0	0	0	109.2
291	T	30.2	Very low	30.4	Very low	124 Å²	124	131.9 Å²	131.9	76%	0.761	77%	0.766	S	S	*	*			trans	-126	161.2	-157.1	33.1	0	0	0	0	114.8
292	P	53.3	Low	30.4	Very low	116 Å²	116	133.2 Å²	133.2	75%	0.753	77%	0.769	S	S	*	*			trans	-93.2	173.6	-168.4	39.3	-38.7	0	0	0	114.3
293	P	45.3	Very low	30.5	Very low	123 Å²	123	132.3 Å²	132.3	80%	0.799	76%	0.764	S	S	*	*				-145.4	178.9	105.8	31.6	-13.2	0	0	0	114
294	N	25.4	Very low	31.4	Very low	149 Å²	149	131.3 Å²	131.3	80%	0.797	77%	0.765	S	S	*	*			cis	-177.3	173.5	-32.8	-171.8	13.1	0	0	0	108.7
295	V	27	Very low	31.4	Very low	111 Å²	111	128.2 Å²	128.2	67%	0.673	76%	0.757	S	S	*	*			trans	77	132.2	157.3	-138.3	0	0	0	0	122
296	S	25.8	Very low	31.4	Very low	97 Å²	97	127 Å²	127	68%	0.678	76%	0.759	S	S	*	*			trans	62.6	128.9	149.7	48.9	0	0	0	0	120.4
297	S	25.6	Very low	31.2	Very low	106 Å²	106	125 Å²	125	74%	0.741	75%	0.753	S	S	*	*			cis	85.7	112.4	30.1	82.8	0	0	0	0	116.4
298	S	27.2	Very low	31.1	Very low	122 Å²	122	125.8 Å²	125.8	85%	0.853	75%	0.752	S	S	*	*			trans	179.8	144	138.2	36	0	0	0	0	113.8
299	L	28.2	Very low	30.4	Very low	156 Å²	156	127.1 Å²	127.1	82%	0.817	75%	0.751	S	S	*	*			trans	-78.7	169	155.5	-124.8	78	0	0	0	108.5
300	P	39.6	Very low	30.4	Very low	100 Å²	100	126.9 Å²	126.9	65%	0.649	75%	0.75	S	S	*	*				-160.9	176.8	61.7	44.4	-22.8	0	0	0	119.2
301	N	26.8	Very low	30.5	Very low	128 Å²	128	126.6 Å²	126.6	68%	0.684	74%	0.743	S	S	*	*			trans	53.4	137.1	146.7	-60.2	-6.7	0	0	0	120.2
302	H	28	Very low	30.3	Very low	176 Å²	176	127.9 Å²	127.9	82%	0.815	74%	0.74	S	S	*	*				-153.9	152.5	52.4	-123.1	-82.8	0	0	0	115.2
303	I	30.9	Very low	29	Very low	145 Å²	145	128.1 Å²	128.1	74%	0.744	74%	0.736	S	S	*	*			trans	-110.8	176.8	161.6	7.4	174.7	0	0	0	107.4
304	P	42.8	Very low	28.2	Very low	102 Å²	102	129.7 Å²	129.7	66%	0.662	73%	0.732	S	S	*	*			cis	-144.5	178.9	22.2	44.1	-24.8	0	0	0	118.2
305	S	27.6	Very low	28.3	Very low	105 Å²	105	131.2 Å²	131.2	73%	0.734	74%	0.735	S	S	*	*			trans	70.6	159.1	142.1	-78.9	0	0	0	0	121.5
306	S	27.5	Very low	28.3	Very low	98 Å²	98	132.7 Å²	132.7	69%	0.685	74%	0.744	S	S	*	*			cis	-176.2	179	-24.4	-91.2	0	0	0	0	108.6
307	I	27.2	Very low	29	Very low	149 Å²	149	133.1 Å²	133.1	76%	0.764	74%	0.744	S	S	*	*			trans	83.1	94.3	158.7	-49	-171.1	0	0	0	118
308	N	25.2	Very low	29.1	Very low	141 Å²	141	135.2 Å²	135.2	75%	0.754	75%	0.747	S	S	*	*				47.4	136.9	121.9	-65.2	-22.7	0	0	0	124.3
309	L	24.5	Very low	29	Very low	152 Å²	152	134.2 Å²	134.2	80%	0.796	74%	0.74	S	S	*	*			trans	93.2	131.8	132.4	-112.9	77	0	0	0	122
310	L	24.9	Very low	28.9	Very low	144 Å²	144	131.2 Å²	131.2	75%	0.754	74%	0.738	S	S	*	*			trans	83.6	100.6	139.7	-142.5	71.8	0	0	0	119.9
311	V	27.1	Very low	28.3	Very low	114 Å²	114	133.3 Å²	133.3	69%	0.691	74%	0.742	S	S	*	*				26.2	123.9	126.9	-169.1	0	0	0	0	117.9
312	Q	27.1	Very low	28.3	Very low	151 Å²	151	133.8 Å²	133.8	71%	0.706	74%	0.744	S	S	*	*				179.9	153.4	105.4	-158.1	94.4	9.3	0	0	112.3
313	N	25.8	Very low	28.2	Very low	122 Å²	122	132 Å²	132	65%	0.652	75%	0.746	S	S	*	*			trans	72.9	122.5	161.3	-65.2	-22.8	0	0	0	117.6
314	Q	28.9	Very low	27.9	Very low	156 Å²	156	128.3 Å²	128.3	73%	0.729	74%	0.743	S	S	*	*			cis	89	94.1	47.8	-73.7	-173.6	84.6	0	0	113.9
315	Q	27.8	Very low	27.1	Very low	181 Å²	181	131.2 Å²	131.2	85%	0.846	75%	0.754	S	S	*	*				32.2	119.9	129	-64	175.9	-14.8	0	0	119.8
316	T	26.4	Very low	27.1	Very low	142 Å²	142	135.9 Å²	135.9	87%	0.871	76%	0.761	S	S	*	*			trans	-133.9	141.1	138.1	47.2	0	0	0	0	109.5
317	P	40.3	Very low	27.1	Very low	105 Å²	105	135.4 Å²	135.4	68%	0.682	76%	0.762	S	S	*	*			trans	-111.7	179.2	-168.2	42.4	-36.1	0	0	0	115
318	N	26.5	Very low	27.1	Very low	150 Å²	150	135.3 Å²	135.3	80%	0.802	76%	0.763	S	S	*	*			trans	73.7	147.6	160.8	-59.2	-22.3	0	0	0	118
319	S	27	Very low	27.4	Very low	101 Å²	101	137 Å²	137	71%	0.706	77%	0.767	S	S	*	*			cis	-168.7	141.8	-19.9	51.1	0	0	0	0	112.3
320	A	26	Very low	27.6	Very low	94 Å²	94	139.5 Å²	139.5	78%	0.777	77%	0.774	S	S	*	*			trans	67.4	171.2	161.2	0	0	0	0	0	116.3
321	I	25.9	Very low	28	Very low	143 Å²	143	141.8 Å²	141.8	73%	0.733	78%	0.781	S	S	*	*			cis	-157.1	150.8	11.6	-150.9	153.7	0	0	0	113
322	L	27.4	Very low	28.2	Very low	138 Å²	138	145.9 Å²	145.9	72%	0.723	79%	0.793	S	S	*	*			trans	61.9	138.6	155.8	-76.9	159.6	0	0	0	124.4
323	T	25.1	Very low	28.6	Very low	139 Å²	139	147.6 Å²	147.6	85%	0.853	80%	0.801	S	S	*	*			trans	65.1	140.1	148.6	51.7	0	0	0	0	121.2
324	G	25.1	Very low	28.9	Very low	67 Å²	67	150.2 Å²	150.2	69%	0.691	81%	0.809	S	S	*	*			cis	160.9	154.8	-12.5	0	0	0	0	0	116.4
325	N	26.9	Very low	29.3	Very low	164 Å²	164	150 Å²	150	88%	0.877	81%	0.811	S	S	*	*			trans	75.6	137.1	159.2	-63.9	-9.2	0	0	0	122.4
326	K	27	Very low	29.7	Very low	203 Å²	203	148.2 Å²	148.2	88%	0.883	81%	0.806	S	S	*	*			trans	68	130.9	165.7	-64.3	-172.8	172.7	-167	0	117.6
327	A	27.8	Very low	29.9	Very low	87 Å²	87	147.8 Å²	147.8	72%	0.719	80%	0.798	S	S	*	*			cis	103.5	124.5	15.5	0	0	0	0	0	115.5
328	N	26.2	Very low	29.6	Very low	147 Å²	147	149.9 Å²	149.9	79%	0.786	80%	0.804	S	S	*	*			trans	-178.1	126.2	149.4	-90.7	15.5	0	0	0	103.1
329	E	31.6	Very low	29.9	Very low	177 Å²	177	150.4 Å²	150.4	83%	0.827	81%	0.807	S	S	*	*				67.8	103.8	66.2	-71	-178.2	-168.7	0	0	113.4
330	E	28.8	Very low	30.2	Very low	204 Å²	204	152.2 Å²	152.2	95%	0.953	81%	0.809	S	S	*	*			trans	-163	163.7	133.6	-107.5	162.4	-147.6	0	0	109.2
331	E	32.9	Very low	30.4	Very low	192 Å²	192	154.7 Å²	154.7	90%	0.897	81%	0.809	S	S	*	*			trans	-117.9	143.2	-161.6	-54.4	171.7	133.5	0	0	112
332	E	32.1	Very low	30.9	Very low	201 Å²	201	153.6 Å²	153.6	94%	0.939	81%	0.809	S	S	*	*			trans	-138.6	134.9	157.2	-69.9	-167.1	144.2	0	0	110.2
333	E	34.4	Very low	31	Very low	187 Å²	187	153.3 Å²	153.3	87%	0.874	81%	0.807	S	S	*	*			trans	-94.9	136.6	168.7	-66.2	-169.9	146.4	0	0	109.4
334	E	33.1	Very low	31.2	Very low	177 Å²	177	152.2 Å²	152.2	83%	0.827	81%	0.805	S	S	*	*			trans	-120.9	140.4	160.8	-78.6	-156.9	132.8	0	0	111.4
335	I	37.8	Very low	31.4	Very low	150 Å²	150	154.2 Å²	154.2	77%	0.769	81%	0.808	S	S	*	*			trans	-106.8	121.6	178.5	-58.7	163.1	0	0	0	106.8
336	I	34.6	Very low	31.5	Very low	144 Å²	144	152.4 Å²	152.4	74%	0.738	81%	0.808	S	S	*	*			trans	-137.1	121.4	175.8	-55.8	-179.5	0	0	0	108.2
337	D	31.8	Very low	32.2	Very low	133 Å²	133	148.7 Å²	148.7	71%	0.711	81%	0.805	S	S	*	*			trans	-93.4	-166.5	172.5	-75.3	-62	0	0	0	110.8
338	D	34.1	Very low	32.1	Very low	149 Å²	149	152.3 Å²	152.3	80%	0.797	81%	0.813	S	S	*	*			trans	79.1	92.1	168.7	-57.7	-13.4	0	0	0	119.3
339	D	33.2	Very low	32.3	Very low	161 Å²	161	150.6 Å²	150.6	86%	0.861	81%	0.812	S	S	*	*				56.2	139.8	114.7	-75.2	-7	0	0	0	126.2
340	D	32.4	Very low	32.2	Very low	139 Å²	139	146.6 Å²	146.6	74%	0.743	81%	0.809	S	S	*	*			trans	67.2	74.2	147.4	-141	21.3	0	0	0	122.3	T342	D340-T342 PolarHBondContact O-N 2.88Å
341	D	29.9	Very low	32.2	Very low	146 Å²	146	144 Å²	144	78%	0.781	81%	0.807	S	S	*	*			trans	-70.9	88.4	167	-105.7	-37	0	0	0	113.1	I343	D341-I343 HydrophobicContact CB-CD1 4.41Å; D341-I343 HydrophobicContact CB-CG1 4.29Å; D341-I343 PolarHBondContact O-N 2.96Å
342	T	36.3	Very low	31.9	Very low	121 Å²	121	139.9 Å²	139.9	74%	0.742	80%	0.799	S	S	*	*			trans	-86	88.5	166.6	40.5	0	0	0	0	111.8	D340 S344	D340-T342 PolarHBondContact O-N 2.88Å; T342-S344 PolarHBondContact O-N 2.81Å
343	I	30.8	Very low	31.6	Very low	131 Å²	131	138.2 Å²	138.2	67%	0.672	80%	0.797	S	S	*	*			trans	-90.9	100.4	-175.8	-55	179.9	0	0	0	111.9	D341	D341-I343 HydrophobicContact CB-CD1 4.41Å; D341-I343 HydrophobicContact CB-CG1 4.29Å; D341-I343 PolarHBondContact O-N 2.96Å
344	S	29	Very low	31.3	Very low	116 Å²	116	135.2 Å²	135.2	81%	0.811	79%	0.792	S	S	*	*			trans	-74.8	151.3	154.4	60.1	0	0	0	0	110.2	T342	T342-S344 PolarHBondContact O-N 2.81Å
345	S	28.7	Very low	30.9	Very low	109 Å²	109	132.3 Å²	132.3	76%	0.762	79%	0.791	S	S	*	*			trans	-145.7	113.9	-177.4	58.6	0	0	0	0	113.4
346	S	29.8	Very low	30.5	Very low	126 Å²	126	132 Å²	132	88%	0.881	79%	0.79	S	S	*	*			trans	-112.4	134.5	161.7	-64.6	0	0	0	0	108.7
347	P	41.4	Very low	30.3	Very low	126 Å²	126	131.5 Å²	131.5	82%	0.818	79%	0.793	S	S	*	*			trans	-103.1	130.8	178.1	35.3	-29.5	0	0	0	113.4
348	D	26.1	Very low	30.6	Very low	163 Å²	163	130.6 Å²	130.6	87%	0.872	80%	0.795	S	S	*	*			trans	-113.7	154.1	148.1	-104.5	-46.9	0	0	0	106.1
349	S	29.9	Very low	30.2	Very low	111 Å²	111	132.8 Å²	132.8	78%	0.776	80%	0.8	S	S	*	*			cis	-156.4	176.9	23.2	40.4	0	0	0	0	111.1
350	A	29.7	Very low	29.9	Very low	93 Å²	93	128.9 Å²	128.9	77%	0.769	79%	0.79	S	S	*	*			trans	-93.8	171.2	-174.1	0	0	0	0	0	115.1
351	V	27.6	Very low	29.6	Very low	150 Å²	150	129.5 Å²	129.5	91%	0.909	79%	0.794	S	S	*	*			trans	-134.5	149.9	160.5	-138.2	0	0	0	0	110.2
352	S	27.4	Very low	29.5	Very low	105 Å²	105	129 Å²	129	73%	0.734	80%	0.796	S	S	*	*			trans	-110.7	172.8	-157.1	-41.2	0	0	0	0	115.2
353	N	25.3	Very low	29.1	Very low	165 Å²	165	127.8 Å²	127.8	88%	0.882	79%	0.792	S	S	*	*			trans	-149	167.9	148.1	-100.2	-46.1	0	0	0	111
354	T	29.1	Very low	29.2	Very low	125 Å²	125	130.6 Å²	130.6	77%	0.767	80%	0.803	S	S	*	*			trans	-121.3	148.5	-141.7	-33.8	0	0	0	0	116
355	S	25	Very low	29.1	Very low	116 Å²	116	132.2 Å²	132.2	81%	0.811	80%	0.802	S	S	*	*			trans	-160.7	166.3	141.9	-158.8	0	0	0	0	112.6
356	L	28.1	Very low	29	Very low	142 Å²	142	134.3 Å²	134.3	74%	0.743	81%	0.811	S	S	*	*			trans	-108.3	175.4	177.9	-55.7	99.3	0	0	0	110
357	V	30.8	Very low	28.7	Very low	134 Å²	134	133.2 Å²	133.2	81%	0.812	80%	0.803	S	S	*	*			cis	-150.4	-167.2	27.9	-128.8	0	0	0	0	110.4
358	P	38	Very low	28	Very low	115 Å²	115	137.7 Å²	137.7	75%	0.747	81%	0.81	S	S	*	*			trans	-127.4	169.3	-136.2	44.6	-27.3	0	0	0	118.7
359	Q	26.8	Very low	27.9	Very low	194 Å²	194	137.4 Å²	137.4	91%	0.907	81%	0.809	S	S	*	*			trans	-174.2	166.3	151.4	-104	177.2	0.4	0	0	108
360	A	27	Very low	27.8	Very low	79 Å²	79	135.6 Å²	135.6	65%	0.653	81%	0.807	S	S	*	*			cis	-172.1	142.5	-44.8	0	0	0	0	0	107.1
361	D	25.1	Very low	27.6	Very low	153 Å²	153	136.1 Å²	136.1	82%	0.818	81%	0.805	S	S	*	*			trans	32.4	126.6	165.6	-49.4	-33	0	0	0	119.8
362	T	27.9	Very low	27.5	Very low	135 Å²	135	137.2 Å²	137.2	83%	0.828	81%	0.805	S	S	*	*				-169.8	153.8	75	-62.7	0	0	0	0	111.7
363	S	28.1	Very low	27.6	Very low	95 Å²	95	139 Å²	139	66%	0.664	81%	0.805	S	S	*	*			trans	-79	162.2	-179.6	58.7	0	0	0	0	115.9
364	Q	32.2	Very low	27.7	Very low	190 Å²	190	140.6 Å²	140.6	89%	0.888	81%	0.807	S	S	*	*				-158.1	154.8	114.8	-82.1	-129.6	-4.7	0	0	111.6
365	N	26.2	Very low	27.5	Very low	150 Å²	150	143.3 Å²	143.3	80%	0.802	81%	0.808	S	S	*	*			trans	-109.3	150.3	177.4	-64.3	-35.9	0	0	0	110.6
366	T	26.7	Very low	27.5	Very low	153 Å²	153	144.6 Å²	144.6	94%	0.939	80%	0.803	S	S	*	*			trans	-150.6	138.2	133.4	31.2	0	0	0	0	110.8
367	S	25.3	Very low	27.3	Very low	103 Å²	103	145.4 Å²	145.4	72%	0.72	80%	0.803	S	S	*	*			trans	-110.3	149.6	172.5	54.8	0	0	0	0	109.9
368	F	25.3	Very low	27.2	Very low	220 Å²	220	145.8 Å²	145.8	97%	0.965	80%	0.799	S	S	*	*			trans	-148.2	159.2	145.8	-113.3	-76.4	0	0	0	111.3
369	D	25.5	Very low	26.8	Very low	158 Å²	158	146.4 Å²	146.4	85%	0.845	80%	0.803	S	S	*	*			trans	-123.8	159.9	-166.2	-179	23.3	0	0	0	110.5
370	G	26.6	Very low	26.6	Very low	72 Å²	72	143 Å²	143	74%	0.742	80%	0.796	S	S	*	*			trans	157	118.2	177.3	0	0	0	0	0	113.9
371	S	26.7	Very low	26.4	Very low	104 Å²	104	147.1 Å²	147.1	73%	0.727	81%	0.806	S	S	*	*			trans	-131.8	142.7	-177.7	177.5	0	0	0	0	111.9
372	L	25.4	Very low	26.3	Very low	173 Å²	173	146.8 Å²	146.8	91%	0.906	80%	0.804	S	S	*	*			trans	-154.3	152.6	156.9	-147.6	71.7	0	0	0	112.1
373	I	27.5	Very low	26.2	Very low	144 Å²	144	148.6 Å²	148.6	74%	0.738	80%	0.803	S	S	*	*			trans	-119.5	142.9	-176.4	-64.7	170.2	0	0	0	109.5
374	Q	27.4	Very low	26	Very low	198 Å²	198	151.9 Å²	151.9	93%	0.925	81%	0.807	S	S	*	*			trans	-145.6	169.2	149.7	-114.1	170.3	18	0	0	111.9
375	K	25.2	Very low	25.9	Very low	181 Å²	181	148.8 Å²	148.8	79%	0.787	80%	0.804	S	S	*	*			trans	-149.7	169.8	-157	-174.6	178.2	179.8	-179.1	0	109.6
376	M	25.6	Very low	25.8	Very low	144 Å²	144	149 Å²	149	71%	0.709	80%	0.804	S	S	*	*			trans	96.7	148.1	176.2	-51.5	-94	74.2	0	0	113.7
377	Q	23.6	Very low	25.9	Very low	158 Å²	158	146.8 Å²	146.8	74%	0.738	80%	0.795	S	S	*	*			cis	-161.2	158.5	-27.1	-171.4	161.7	1.6	0	0	109.2
378	I	29.8	Very low	26	Very low	142 Å²	142	148.9 Å²	148.9	73%	0.728	80%	0.798	S	S	*	*			trans	-86.8	152.9	-176.2	-51.4	159	0	0	0	111.2
379	P	28	Very low	26.1	Very low	129 Å²	129	144.1 Å²	144.1	84%	0.838	79%	0.792	S	S	*	*				-134.9	144.2	125.5	36.9	-26.9	0	0	0	114.5
380	T	23.8	Very low	26.1	Very low	123 Å²	123	144.5 Å²	144.5	76%	0.755	79%	0.793	S	S	*	*			trans	-94.6	156.2	179.8	-42.5	0	0	0	0	111.5
381	L	22.2	Very low	26.1	Very low	164 Å²	164	150.7 Å²	150.7	86%	0.859	80%	0.799	S	S	*	*			trans	-141.6	142.9	163.3	-115.1	171.9	0	0	0	111.8
382	L	23.3	Very low	26.1	Very low	147 Å²	147	153.2 Å²	153.2	77%	0.77	80%	0.803	S	S	*	*			trans	-79.9	162.4	177.9	-72.2	74.6	0	0	0	109.6
383	Q	25.9	Very low	26.2	Very low	173 Å²	173	149.8 Å²	149.8	81%	0.808	79%	0.794	S	S	*	*				-175.3	169.1	63.4	-171.9	159.4	8.6	0	0	114.2
384	E	23.8	Very low	26.1	Very low	163 Å²	163	149.9 Å²	149.9	76%	0.762	80%	0.796	S	S	*	*			trans	-40.4	164.4	-178.5	-74.7	176.7	109.1	0	0	121.3
385	P	29.6	Very low	26	Very low	125 Å²	125	147.9 Å²	147.9	81%	0.812	79%	0.79	S	S	*	*			trans	-88.5	155.9	-167.1	35.9	-37.7	0	0	0	115.3
386	L	24.4	Very low	26.1	Very low	156 Å²	156	146.5 Å²	146.5	82%	0.817	79%	0.789	S	S	*	*			trans	-114.1	114.8	168.8	-174	65.2	0	0	0	111.7
387	S	29.9	Very low	26.2	Very low	105 Å²	105	145.9 Å²	145.9	73%	0.734	79%	0.794	S	S	*	*			trans	-70.5	137.8	172	56.4	0	0	0	0	112.4
388	N	26.1	Very low	26.2	Very low	148 Å²	148	148.3 Å²	148.3	79%	0.791	80%	0.796	S	S	*	*			trans	-156.5	130	154.2	-97.3	-62.8	0	0	0	110.6
389	S	28.7	Very low	26	Very low	119 Å²	119	149.1 Å²	149.1	83%	0.832	80%	0.802	S	S	*	*			trans	-92.4	133.6	179.6	52.6	0	0	0	0	111.5
390	L	25.7	Very low	25.9	Very low	166 Å²	166	147.2 Å²	147.2	87%	0.869	79%	0.788	S	S	*	*			trans	-113.9	108.2	175	-90.2	163.5	0	0	0	110.3
391	K	25.6	Very low	26	Very low	202 Å²	202	149.6 Å²	149.6	88%	0.878	80%	0.796	S	S	*	*			trans	-78.9	127.9	163.6	-72	176.2	176.5	173.9	0	108.5
392	I	26.7	Very low	26.2	Very low	157 Å²	157	149 Å²	149	81%	0.805	79%	0.794	S	S	*	*			trans	-98.3	136.9	161.7	-62	176.2	0	0	0	107
393	S	26.8	Very low	27	Very low	102 Å²	102	147.5 Å²	147.5	71%	0.713	79%	0.793	S	S	*	*			trans	-131	118.2	179.5	56	0	0	0	0	109
394	D	26.4	Very low	26.8	Very low	145 Å²	145	142.5 Å²	142.5	78%	0.775	79%	0.788	S	S	*	*			trans	-67.9	132	-170.2	-59.2	-57.6	0	0	0	113.1
395	I	26	Very low	27	Very low	156 Å²	156	143.6 Å²	143.6	80%	0.8	80%	0.798	S	S	*	*			trans	-95.8	95.6	171.3	-61.1	178.2	0	0	0	107.8	T397	I395-T397 PolarHBondContact O-N 3.42Å
396	I	26.6	Very low	26.7	Very low	152 Å²	152	141.2 Å²	141.2	78%	0.779	80%	0.797	S	S	*	*			trans	-80.7	102.8	176.2	-59.6	177.2	0	0	0	109.3	R398	I396-R398 PolarHBondContact O-N 3.2Å
397	T	27.1	Very low	26.8	Very low	132 Å²	132	139.1 Å²	139.1	81%	0.81	80%	0.795	S	S	*	*			trans	-72.5	90.8	172.5	-50.8	0	0	0	0	110.4	I395	I395-T397 PolarHBondContact O-N 3.42Å
398	R	23.8	Very low	26.7	Very low	209 Å²	209	143.8 Å²	143.8	79%	0.789	80%	0.802	S	S	*	*			trans	-66.9	127.2	174.6	-179.5	-178.4	-172	152.9	2.3	110.7	I396 T400	I396-R398 PolarHBondContact O-N 3.2Å; R398-T400 HydrophobicContact CG-CG2 4.1Å
399	N	25.1	Very low	26.6	Very low	158 Å²	158	144.3 Å²	144.3	85%	0.845	80%	0.799	S	S	*	*			trans	-133.3	137.6	161.7	-152.1	5.6	0	0	0	109.3
400	T	27.3	Very low	26.4	Very low	89 Å²	89	145.4 Å²	145.4	55%	0.546	80%	0.795	S	S	.	*			trans	-135.2	129.6	-169.4	48.3	0	0	0	0	110.8	R398	R398-T400 HydrophobicContact CG-CG2 4.1Å
401	N	25.1	Very low	26.7	Very low	173 Å²	173	145.1 Å²	145.1	93%	0.925	79%	0.791	S	S	*	*			trans	-156.4	142.9	150.6	-88.7	-38.9	0	0	0	109.2
402	D	25.8	Very low	26.9	Very low	153 Å²	153	143.5 Å²	143.5	82%	0.818	79%	0.787	S	S	*	*			trans	-115.6	-176.8	-173.2	-129	-15.3	0	0	0	108.1
403	P	39.8	Very low	27	Very low	114 Å²	114	138.6 Å²	138.6	74%	0.74	78%	0.775	S	S	*	*			cis	-137.4	162.6	-12.4	36.5	-18	0	0	0	116.8
404	G	22.6	Very low	27.2	Very low	68 Å²	68	140.7 Å²	140.7	70%	0.701	77%	0.774	S	S	*	*				92.4	109.1	123.7	0	0	0	0	0	121.3
405	L	27.4	Very low	27.3	Very low	186 Å²	186	141.4 Å²	141.4	97%	0.974	77%	0.77	S	S	*	*				-155.2	143.1	126.6	-145.2	67.4	0	0	0	109
406	G	23.5	Very low	27.4	Very low	76 Å²	76	140.3 Å²	140.3	78%	0.784	76%	0.764	S	S	*	*			trans	-125	148	-169.4	0	0	0	0	0	114.7
407	S	27.8	Very low	27.5	Very low	112 Å²	112	138.6 Å²	138.6	78%	0.783	76%	0.755	S	S	*	*			trans	-146.3	108.4	163.8	-163.6	0	0	0	0	113.1
408	K	26.8	Very low	27.7	Very low	202 Å²	202	137.6 Å²	137.6	88%	0.878	75%	0.749	S	S	*	*			trans	21.9	109.3	144.5	-58.2	171.4	-175.5	175.3	0	118.1
409	H	24.3	Very low	28.2	Very low	160 Å²	160	135.4 Å²	135.4	74%	0.741	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-74.2	120.9	158.2	-177.2	-57.9	0	0	0	109.8
410	L	24.9	Very low	28.7	Very low	141 Å²	141	135 Å²	135	74%	0.738	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-87.5	144.5	168.4	-158.8	75.2	0	0	0	109.4
411	M	31.9	Very low	29.4	Very low	161 Å²	161	136 Å²	136	79%	0.793	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-95	124.3	175.2	-70.1	-71.7	177.1	0	0	109
412	E	28.8	Very low	30.1	Very low	167 Å²	167	132.4 Å²	132.4	78%	0.78	75%	0.75	S	S	*	*			trans	-139.6	143.2	-174.1	-165.3	66	-97.7	0	0	111.6
413	G	28.8	Very low	31	Very low	54 Å²	54	131.2 Å²	131.2	56%	0.557	75%	0.749	S	S	*	*			trans	41.9	113.3	154.8	0	0	0	0	0	121.2	K415	G413-K415 VanDerWaalsContact C-N 3.32Å; G413-K415 PolarHBondContact O-N 3.29Å
414	Q	30.4	Very low	31	Very low	147 Å²	147	135 Å²	135	69%	0.687	76%	0.757	S	S	*	*			trans	-65.7	93	150.5	177.8	177.9	-64.7	0	0	108.8	I416	Q414-I416 PolarHBondContact O-N 3.24Å
415	K	29.3	Very low	31.8	Very low	159 Å²	159	138.1 Å²	138.1	69%	0.691	76%	0.756	S	S	*	*			trans	-75.9	89.4	-170.5	-157.4	177.9	-173.8	177.6	0	112.5	G413 I417	G413-K415 VanDerWaalsContact C-N 3.32Å; G413-K415 PolarHBondContact O-N 3.29Å; K415-I417 HydrophobicContact CD-CD1 4.48Å; K415-I417 HydrophobicContact CD-CG1 4.1Å; K415-I417 HydrophobicContact CG-CG1 3.92Å; K415-I417 PolarHBondContact O-N 2.78Å
416	I	28.3	Very low	32.2	Very low	134 Å²	134	139 Å²	139	69%	0.687	76%	0.755	S	S	*	*			trans	-68.1	109.5	158.2	-62.1	171.6	0	0	0	106.2	Q414 T418	Q414-I416 PolarHBondContact O-N 3.24Å; I416-T418 VanDerWaalsContact C-N 3.34Å; I416-T418 PolarHBondContact O-N 3.41Å; I416-T418 VanDerWaalsContact O-N 3.12Å
417	I	28.6	Very low	32.8	Very low	116 Å²	116	139 Å²	139	60%	0.595	76%	0.755	S	S	*	*			trans	-85.8	80.8	179	-53.3	175.9	0	0	0	108.9	K415 L419	K415-I417 HydrophobicContact CD-CD1 4.48Å; K415-I417 HydrophobicContact CD-CG1 4.1Å; K415-I417 HydrophobicContact CG-CG1 3.92Å; K415-I417 PolarHBondContact O-N 2.78Å; I417-L419 HydrophobicContact CG2-CD1 4.15Å
418	T	31.1	Very low	33.2	Very low	111 Å²	111	140.5 Å²	140.5	68%	0.681	75%	0.753	S	S	*	*			trans	-66.2	131.6	145.3	40.8	0	0	0	0	107.7	I416 D420	I416-T418 VanDerWaalsContact C-N 3.34Å; I416-T418 PolarHBondContact O-N 3.41Å; I416-T418 VanDerWaalsContact O-N 3.12Å; T418-D420 PolarHBondContact O-N 3.17Å
419	L	33.6	Very low	33.7	Very low	163 Å²	163	136.3 Å²	136.3	85%	0.853	75%	0.749	S	S	*	*	S	Bend	trans	-73.6	91.6	179	-102.3	80.8	0	0	0	110	I417	I417-L419 HydrophobicContact CG2-CD1 4.15Å
420	D	37.2	Very low	34.6	Very low	148 Å²	148	135.6 Å²	135.6	79%	0.791	76%	0.757	S	S	*	*			trans	-141.2	52.3	171.3	-132.1	-12.7	0	0	0	111.1	T418	T418-D420 PolarHBondContact O-N 3.17Å
421	T	42.4	Very low	35.2	Very low	110 Å²	110	131.1 Å²	131.1	68%	0.675	74%	0.744	S	S	*	*			trans	-136.6	53	173.1	60.6	0	0	0	0	110.8	T423	T421-T423 VanDerWaalsContact C-N 3.27Å; T421-T423 PolarHBondContact O-N 3.32Å; T421-T423 VanDerWaalsContact O-N 3.11Å
422	A	39.8	Very low	35.5	Very low	98 Å²	98	126.1 Å²	126.1	81%	0.81	72%	0.724	S	S	*	*			trans	-81.3	71.2	171.3	0	0	0	0	0	110.2
423	T	43.4	Very low	36	Very low	128 Å²	128	122.3 Å²	122.3	79%	0.785	71%	0.705	S	S	*	*			trans	-144.6	8.2	-173.2	-20.4	0	0	0	0	115.2	T421	T421-T423 VanDerWaalsContact C-N 3.27Å; T421-T423 PolarHBondContact O-N 3.32Å; T421-T423 VanDerWaalsContact O-N 3.11Å
424	E	40.9	Very low	36.2	Very low	193 Å²	193	124.2 Å²	124.2	90%	0.902	71%	0.706	S	S	*	*	S	Bend	trans	-144.4	35.1	178.6	-144.1	168.3	-137.5	0	0	113.2
425	I	38.2	Very low	36.4	Very low	134 Å²	134	120.2 Å²	120.2	69%	0.687	69%	0.685	S	S	*	*			trans	-126.7	39.7	173.1	-37.4	-178.7	0	0	0	111.1	G427 L428	I425-G427 PolarHBondContact O-N 2.94Å; I425-L428 HydrophobicContact CG2-CB 4.4Å; I425-L428 HydrophobicContact CG2-CD1 4.33Å
426	E	35.6	Very low	36.7	Very low	205 Å²	205	116.2 Å²	116.2	96%	0.958	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	83.1	166.3	-170.2	170.6	-146	0	0	108.9
427	G	37.4	Very low	36.6	Very low	75 Å²	75	114.4 Å²	114.4	77%	0.773	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	168.9	-16.3	-179.1	0	0	0	0	0	117.4	I425	I425-G427 PolarHBondContact O-N 2.94Å
428	L	35.5	Very low	36.8	Very low	144 Å²	144	115 Å²	115	75%	0.754	68%	0.676	S	S	*	*	S	Bend	trans	-93.8	136.2	169.9	-67.6	179	0	0	0	110.3	I425 T430	I425-L428 HydrophobicContact CG2-CB 4.4Å; I425-L428 HydrophobicContact CG2-CD1 4.33Å; L428-T430 PolarHBondContact O-N 3.27Å
429	S	37.7	Very low	37.5	Very low	114 Å²	114	112.3 Å²	112.3	80%	0.797	67%	0.671	S	S	*	*			trans	-60	135	-173.8	-167.5	0	0	0	0	112.3	G431	S429-G431 PolarHBondContact O-N 2.84Å
430	T	42	Very low	37.3	Very low	146 Å²	146	114.1 Å²	114.1	90%	0.896	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	93.9	-179.4	43.3	0	0	0	0	111.1	L428	L428-T430 PolarHBondContact O-N 3.27Å
431	G	38.1	Very low	37.1	Very low	46 Å²	46	113.3 Å²	113.3	47%	0.474	67%	0.671	S	S	.	*	T	Hydrogen-bonded Turn	trans	-167.3	-31	178.5	0	0	0	0	0	118.5	S71 S429	S71-G431 PolarHBondContact OG-O 3.07Å; S429-G431 PolarHBondContact O-N 2.84Å
432	C	37.6	Very low	36.5	Very low	56 Å²	56	113.4 Å²	113.4	38%	0.378	67%	0.672	S	S	.	*			trans	-88.4	125.1	-172.6	-60.6	0	0	0	0	112.8	F72	F72-C432 VanDerWaalsContact CE1-SG 3.6Å
433	K	39.8	Very low	36.3	Very low	88 Å²	88	117.7 Å²	117.7	38%	0.383	67%	0.668	S	S	.	*			trans	-95.7	150.8	158.1	-66	177.5	174.5	-173.7	0	109.4	Y435 D444	K433-Y435 HydrophobicContact CB-CE1 4.49Å; K433-Y435 HydrophobicContact CB-CE2 4.14Å; K433-Y435 HydrophobicContact CD-CE1 4.22Å; K433-Y435 WeakPolarHBondContact CD-OH 3.43Å; K433-D444 WeakPolarHBondContact CE-OD1 3.4Å; K433-D444 IonicContact NZ-OD1 3.63Å; K433-D444 PolarHBondContact NZ-OD1 2.9Å; K433-D444 IonicContact NZ-OD2 3.42Å; K433-D444 PolarHBondContact NZ-OD2 2.78Å
434	V	33.4	Very low	35.6	Very low	94 Å²	94	116.7 Å²	116.7	57%	0.57	66%	0.658	S	S	*	*			trans	-124	99.6	175.8	-179.1	0	0	0	0	108.6
435	Y	35.4	Very low	35.2	Very low	62 Å²	62	115.2 Å²	115.2	24%	0.243	66%	0.655	C	S	.	*			trans	-83	116.5	176.3	-53.8	-74.8	0	0	0	110.5	E69 K433 N437	E69-Y435 WeakPolarHBondContact OE2-CE2 3.48Å; K433-Y435 HydrophobicContact CB-CE1 4.49Å; K433-Y435 HydrophobicContact CB-CE2 4.14Å; K433-Y435 HydrophobicContact CD-CE1 4.22Å; K433-Y435 WeakPolarHBondContact CD-OH 3.43Å; Y435-N437 PolarHBondContact O-N 3.12Å
436	A	33.7	Very low	34.9	Very low	76 Å²	76	115 Å²	115	63%	0.628	66%	0.659	S	S	*	*			trans	-78.4	102.2	165.6	0	0	0	0	0	109.1	I438	A436-I438 PolarHBondContact O-N 3.21Å; A436-I438 VanDerWaalsContact O-N 3.09Å
437	N	28.2	Very low	34.7	Very low	95 Å²	95	112 Å²	112	51%	0.508	65%	0.648	S	S	.	*			trans	-62.6	110.8	175.4	-105.2	68.6	0	0	0	111	V67 Y435	V67-N437 HydrophobicContact CG2-CB 3.84Å; Y435-N437 PolarHBondContact O-N 3.12Å
438	I	32.7	Very low	34.3	Very low	128 Å²	128	114.1 Å²	114.1	66%	0.656	65%	0.648	S	S	*	*			trans	-133.3	76.6	170.9	-51	178.4	0	0	0	107.9	A436 V489	A436-I438 PolarHBondContact O-N 3.21Å; A436-I438 VanDerWaalsContact O-N 3.09Å; I438-V489 HydrophobicContact CD1-CG1 4.37Å
439	G	45.5	Very low	34.3	Very low	56 Å²	56	113.5 Å²	113.5	58%	0.577	65%	0.65	S	S	*	*	S	Bend	trans	99.5	-156.4	-177	0	0	0	0	0	114
440	E	29.9	Very low	34	Very low	201 Å²	201	115.8 Å²	115.8	94%	0.939	65%	0.646	S	S	*	*	S	Bend	trans	-98.3	-20.6	-167.1	-63.4	-173.5	126.2	0	0	114.8
441	D	32.1	Very low	33.3	Very low	130 Å²	130	114.8 Å²	114.8	70%	0.695	64%	0.635	S	S	*	*			trans	-99.9	144.5	-176.8	-71.6	-47	0	0	0	113.4	Y443	D441-Y443 HydrophobicContact CB-CE2 3.91Å
442	T	29.4	Very low	32.9	Very low	112 Å²	112	120 Å²	120	69%	0.687	65%	0.652	S	S	*	*			trans	-114.8	141.3	178	41.9	0	0	0	0	112.4
443	Y	35.6	Very low	33.3	Very low	189 Å²	189	122.6 Å²	122.6	74%	0.741	67%	0.668	S	S	*	*			trans	-132.5	138.9	179.8	-68.1	-87.2	0	0	0	111.5	D441	D441-Y443 HydrophobicContact CB-CE2 3.91Å
444	D	28.2	Very low	32.6	Very low	107 Å²	107	125.2 Å²	125.2	57%	0.572	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-94.9	137.6	172.5	-104.7	-10.5	0	0	0	110.9	K433	K433-D444 WeakPolarHBondContact CE-OD1 3.4Å; K433-D444 IonicContact NZ-OD1 3.63Å; K433-D444 PolarHBondContact NZ-OD1 2.9Å; K433-D444 IonicContact NZ-OD2 3.42Å; K433-D444 PolarHBondContact NZ-OD2 2.78Å
445	I	33.5	Very low	32.6	Very low	162 Å²	162	129.6 Å²	129.6	83%	0.831	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-95.2	116.2	177.8	-58.1	177.2	0	0	0	109.4
446	V	31.6	Very low	32.3	Very low	128 Å²	128	130.5 Å²	130.5	78%	0.776	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-95.5	131.5	174.1	179.6	0	0	0	0	109.6	P448	V446-P448 WeakPolarHBondContact O-CD 3.44Å
447	I	31.2	Very low	32.1	Very low	144 Å²	144	135.8 Å²	135.8	74%	0.738	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-84.5	120.1	-179.6	-58.1	172.7	0	0	0	110
448	P	30.2	Very low	32	Very low	119 Å²	119	134.4 Å²	134.4	77%	0.773	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-77.5	151.6	167	-9.6	28.3	0	0	0	111.2	V446	V446-P448 WeakPolarHBondContact O-CD 3.44Å
449	V	35.4	Very low	31.9	Very low	130 Å²	130	139 Å²	139	79%	0.788	75%	0.751	S	S	*	*			trans	-120.7	159.3	175.9	178.9	0	0	0	0	108.6
450	K	31.6	Very low	31.1	Very low	163 Å²	163	142.6 Å²	142.6	71%	0.709	76%	0.756	S	S	*	*			trans	100.3	144.1	173.7	-60.6	-165.4	140.2	-65.2	0	115.2
451	D	27.2	Very low	30.8	Very low	125 Å²	125	142 Å²	142	67%	0.668	75%	0.753	S	S	*	*			cis	-156.2	159.4	-15.5	-84.1	-32.3	0	0	0	106.9
452	D	29	Very low	30.7	Very low	155 Å²	155	142.4 Å²	142.4	83%	0.829	76%	0.756	S	S	*	*			trans	-63.8	169	163.8	-70.1	-65.7	0	0	0	112.6
453	P	45.1	Very low	30.5	Very low	110 Å²	110	145.8 Å²	145.8	71%	0.714	76%	0.764	S	S	*	*			cis	-146.4	178.1	20.3	40.2	-18.2	0	0	0	119.5
454	D	26.9	Very low	30.3	Very low	143 Å²	143	143.5 Å²	143.5	77%	0.765	76%	0.763	S	S	*	*				118.6	141.6	121.5	-113.5	-7.4	0	0	0	124.3
455	E	33.4	Very low	30.6	Very low	187 Å²	187	143.7 Å²	143.7	87%	0.874	77%	0.77	S	S	*	*			trans	28.5	142.3	164.5	-67.6	-165.6	161.5	0	0	125.2
456	G	28.6	Very low	30.3	Very low	81 Å²	81	145.4 Å²	145.4	84%	0.835	77%	0.772	S	S	*	*			trans	161	88.5	154.8	0	0	0	0	0	118.3
457	E	28.1	Very low	30.1	Very low	187 Å²	187	145.8 Å²	145.8	87%	0.874	77%	0.774	S	S	*	*			trans	-79.3	177.3	166.7	-41.2	-171.1	139.5	0	0	112.2
458	A	28.1	Very low	29.9	Very low	65 Å²	65	144.7 Å²	144.7	54%	0.537	78%	0.779	S	S	.	*			cis	-165.4	160.3	2.5	0	0	0	0	0	112.2
459	R	28.7	Very low	29.8	Very low	226 Å²	226	142.8 Å²	142.8	85%	0.853	78%	0.781	S	S	*	*			trans	63.3	170.9	145.4	-68.5	177.3	177.8	122	4.8	120.6
460	L	28.7	Very low	29.4	Very low	131 Å²	131	141.3 Å²	141.3	69%	0.686	78%	0.777	S	S	*	*			cis	177	123.1	-42.4	-162.7	176.8	0	0	0	107.4
461	E	25.5	Very low	29.6	Very low	188 Å²	188	142 Å²	142	88%	0.879	78%	0.782	S	S	*	*			trans	-170.9	158	144.9	-112.6	165.5	-163.6	0	0	113.4
462	N	28.3	Very low	29.6	Very low	139 Å²	139	143.9 Å²	143.9	74%	0.743	79%	0.789	S	S	*	*			trans	-123.9	144.2	177.1	-66.8	-77.3	0	0	0	109.5
463	E	26.4	Very low	29.8	Very low	183 Å²	183	140.4 Å²	140.4	86%	0.855	78%	0.782	S	S	*	*			trans	-143	150.5	157.9	-96.6	-55	153.7	0	0	111.2
464	I	31.4	Very low	29.3	Very low	140 Å²	140	143.2 Å²	143.2	72%	0.718	79%	0.791	S	S	*	*			trans	-136.3	137.1	-175.1	-45.2	168.3	0	0	0	109
465	P	33.5	Very low	29.7	Very low	112 Å²	112	144.3 Å²	144.3	73%	0.727	79%	0.789	S	S	*	*			trans	-147.8	118.9	131.5	31.7	-13.2	0	0	0	117
466	K	26.6	Very low	30.2	Very low	198 Å²	198	143.1 Å²	143.1	86%	0.861	78%	0.777	S	S	*	*				65.7	169.6	125.3	-64	173.5	-178.4	171.2	0	119.9
467	T	29.3	Very low	30.4	Very low	135 Å²	135	146.1 Å²	146.1	83%	0.828	77%	0.771	S	S	*	*			trans	-115.5	140.6	-163.4	52	0	0	0	0	113
468	S	26.6	Very low	31	Very low	122 Å²	122	146.7 Å²	146.7	85%	0.853	77%	0.77	S	S	*	*			trans	179.6	135.6	139	55.6	0	0	0	0	114
469	G	27.9	Very low	31.6	Very low	78 Å²	78	147.7 Å²	147.7	80%	0.804	77%	0.769	S	S	*	*			trans	96.2	138.1	138.2	0	0	0	0	0	120.1
470	S	26.4	Very low	32.4	Very low	100 Å²	100	144.6 Å²	144.6	70%	0.699	76%	0.762	S	S	*	*			trans	60	130.1	165.3	-111.2	0	0	0	0	121.7	M472	S470-M472 PolarHBondContact O-N 3.03Å
471	E	35.5	Very low	33.6	Very low	176 Å²	176	143.9 Å²	143.9	82%	0.822	76%	0.755	S	S	*	*			trans	39.1	78	135.1	-63.8	168.8	127.8	0	0	117.2	A473	E471-A473 VanDerWaalsContact C-N 3.27Å; E471-A473 PolarHBondContact O-N 3.43Å
472	M	28.2	Very low	35.8	Very low	165 Å²	165	141 Å²	141	81%	0.813	75%	0.746	S	S	*	*			trans	-75.2	85.4	163.5	-161.6	168.5	73.5	0	0	110	S470	S470-M472 PolarHBondContact O-N 3.03Å
473	A	33.3	Very low	38.2	Very low	83 Å²	83	135.1 Å²	135.1	69%	0.686	71%	0.714	S	S	*	*			trans	-47.8	150.9	156.1	0	0	0	0	0	109.4	E471 K475	E471-A473 VanDerWaalsContact C-N 3.27Å; E471-A473 PolarHBondContact O-N 3.43Å; A473-K475 PolarHBondContact O-N 2.96Å
474	N	35.1	Very low	41.1	Very low	169 Å²	169	128 Å²	128	90%	0.904	68%	0.681	S	S	*	*			trans	-62.1	75.9	-172.4	-76.2	-31.5	0	0	0	113.2	R476	N474-R476 PolarHBondContact O-N 3.07Å
475	K	34.4	Very low	43.8	Very low	166 Å²	166	126 Å²	126	72%	0.722	67%	0.665	S	S	*	*			trans	-63.7	104.1	177.7	-175.7	177.1	-175.3	-179.8	0	106.5	A473 M477	A473-K475 PolarHBondContact O-N 2.96Å; K475-M477 PolarHBondContact O-N 3.02Å
476	R	43.5	Very low	46.5	Very low	161 Å²	161	126.2 Å²	126.2	61%	0.608	66%	0.656	S	S	*	*			trans	-59.6	87	-178	-85.1	-173.1	155.8	-164.4	2.7	111.1	N474 K478 E642	N474-R476 PolarHBondContact O-N 3.07Å; R476-K478 PolarHBondContact O-N 3.37Å; R476-K478 VanDerWaalsContact O-N 3.07Å; R476-E642 WeakPolarHBondContact CD-OE2 3.24Å; R476-E642 IonicContact CZ-OE1 3.85Å; R476-E642 IonicContact CZ-OE2 2.9Å; R476-E642 IonicContact NE-OE1 2.74Å; R476-E642 IonicContact NE-OE2 3.18Å; R476-E642 PolarHBondContact NE-OE2 3.1Å; R476-E642 VanDerWaalsContact NE-OE2 3.1Å; R476-E642 IonicContact NH1-OE1 2.67Å; R476-E642 PolarHBondContact NH1-OE1 3.36Å; R476-E642 IonicContact NH1-OE2 2.95Å; R476-E642 PolarHBondContact NH1-OE2 3.28Å; R476-E642 IonicContact NH2-OE1 3.63Å; R476-E642 PolarHBondContact NH2-OE1 3.19Å; R476-E642 IonicContact NH2-OE2 2.71Å
477	M	34	Very low	49.5	Very low	144 Å²	144	120.6 Å²	120.6	71%	0.709	64%	0.635	S	S	*	*			trans	-64.3	107.8	173.4	-160.8	81.7	82.1	0	0	106.5	K475 V479	K475-M477 PolarHBondContact O-N 3.02Å; M477-V479 HydrophobicContact CB-CG2 3.95Å; M477-V479 HydrophobicContact CG-CG2 3.5Å; M477-V479 VanDerWaalsContact CG-CG2 3.5Å; M477-V479 PolarHBondContact O-N 3.24Å
478	K	40	Very low	52.5	Low	199 Å²	199	119.5 Å²	119.5	87%	0.865	62%	0.623	S	S	*	*			trans	-71.1	67.7	161.5	-80.5	-174.7	172.9	-179.7	0	108.1	R476 K480	R476-K478 PolarHBondContact O-N 3.37Å; R476-K478 VanDerWaalsContact O-N 3.07Å; K478-K480 PolarHBondContact O-N 2.83Å
479	V	41	Very low	55.4	Low	86 Å²	86	115.4 Å²	115.4	52%	0.521	59%	0.593	S	S	.	*			trans	-56.1	120.7	160.3	-176.5	0	0	0	0	105.1	M477 H481	M477-V479 HydrophobicContact CB-CG2 3.95Å; M477-V479 HydrophobicContact CG-CG2 3.5Å; M477-V479 VanDerWaalsContact CG-CG2 3.5Å; M477-V479 PolarHBondContact O-N 3.24Å; V479-H481 VanDerWaalsContact C-N 3.29Å; V479-H481 PolarHBondContact O-CD2 2.78Å; V479-H481 PolarHBondContact O-N 2.93Å
480	K	43.9	Very low	58	Low	162 Å²	162	117.8 Å²	117.8	70%	0.704	59%	0.587	S	S	*	*			trans	-67.9	100.8	161.1	-67.1	-176.7	-178.3	-177.9	0	104.7	K478 D482	K478-K480 PolarHBondContact O-N 2.83Å; K480-D482 PolarHBondContact O-N 3.38Å
481	H	54.8	Low	60.9	Low	115 Å²	115	116.2 Å²	116.2	53%	0.532	59%	0.587	S	S	.	*			trans	-62.9	132.3	168.3	-73	-104.2	0	0	0	106.9	V479 D483	V479-H481 VanDerWaalsContact C-N 3.29Å; V479-H481 PolarHBondContact O-CD2 2.78Å; V479-H481 PolarHBondContact O-N 2.93Å; H481-D483 HydrophobicContact CB-CB 4.22Å; H481-D483 PolarHBondContact O-N 2.97Å
482	D	72.4	Confident	63.4	Low	129 Å²	129	114.5 Å²	114.5	69%	0.69	57%	0.573	S	S	*	*			trans	-79.9	55.1	169.6	-163.7	21	0	0	0	108.3	K480 H484 I498	K480-D482 PolarHBondContact O-N 3.38Å; D482-H484 VanDerWaalsContact C-N 3.29Å; D482-I498 WeakPolarHBondContact O-CD1 3.22Å
483	D	77.9	Confident	66.4	Low	14 Å²	14	109 Å²	109	8%	0.075	55%	0.548	C	S	.	.			trans	-83	-9.2	-178.6	63.4	-23.4	0	0	0	112.2	H481 I498 F514	H481-D483 HydrophobicContact CB-CB 4.22Å; H481-D483 PolarHBondContact O-N 2.97Å; D483-I498 PolarHBondContact O-N 2.94Å; D483-F514 HydrophobicContact CB-CD1 3.96Å; D483-F514 HydrophobicContact CB-CD2 3.72Å; D483-F514 HydrophobicContact CB-CE1 3.87Å; D483-F514 HydrophobicContact CB-CE2 3.6Å; D483-F514 HydrophobicContact CB-CG 3.9Å; D483-F514 HydrophobicContact CB-CZ 3.69Å
484	H	87.3	Confident	69.1	Low	33 Å²	33	108 Å²	108	15%	0.153	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	162	-177.4	66.6	-70.7	0	0	0	114.7	D482 Y495 I496 L507 L510	D482-H484 VanDerWaalsContact C-N 3.29Å; H484-Y495 AromaticContact CD2-CD1 3.7Å; H484-Y495 AromaticContact NE2-CD1 3.79Å; H484-I496 WeakPolarHBondContact CA-O 3.45Å; H484-I496 WeakPolarHBondContact CB-O 3.21Å; H484-L507 VanDerWaalsContact CE1-CD1 3.5Å; H484-L507 WeakPolarHBondContact CE1-CD1 3.44Å; H484-L510 HydrophobicContact CB-CD1 4.2Å; H484-L510 HydrophobicContact CB-CD2 3.22Å; H484-L510 HydrophobicContact CB-CG 4.26Å
485	Y	87.6	Confident	71.8	Confident	98 Å²	98	102.2 Å²	102.2	38%	0.384	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	159.4	161.4	54.9	-81.7	0	0	0	110.6	I496 I498	Y485-I496 HydrophobicContact CD1-CB 4.43Å; Y485-I496 HydrophobicContact CD2-CB 4.14Å; Y485-I496 HydrophobicContact CE1-CB 4.1Å; Y485-I496 HydrophobicContact CE1-CG2 3.89Å; Y485-I496 HydrophobicContact CE2-CB 3.79Å; Y485-I496 HydrophobicContact CE2-CD1 3.9Å; Y485-I496 HydrophobicContact CE2-CG1 4.25Å; Y485-I496 HydrophobicContact CE2-CG2 4Å; Y485-I496 HydrophobicContact CG-CB 4.46Å; Y485-I496 PolarHBondContact N-O 2.86Å; Y485-I496 VanDerWaalsContact N-O 3.12Å; Y485-I496 PolarHBondContact O-N 3.46Å; Y485-I496 WeakPolarHBondContact OH-CG2 3.16Å; Y485-I498 HydrophobicContact CD1-CG2 4.04Å; Y485-I498 HydrophobicContact CE1-CG2 4.48Å
486	E	91.7	Very high	74.4	Confident	117 Å²	117	94.8 Å²	94.8	55%	0.547	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	137.3	174.3	-66.4	-178.8	-179.2	0	0	110.1	V493 Y494 Y495	E486-V493 HydrophobicContact CB-CG1 4.13Å; E486-V493 HydrophobicContact CG-CG1 4.13Å; E486-Y494 CarbonylContact C-O 3.53Å; E486-Y494 WeakPolarHBondContact CA-O 3.44Å; E486-Y495 HydrophobicContact CG-CD1 3.83Å; E486-Y495 HydrophobicContact CG-CE1 3.89Å; E486-Y495 WeakPolarHBondContact OE1-CE1 3.4Å
487	L	89.6	Confident	76.7	Confident	80 Å²	80	87.1 Å²	87.1	42%	0.419	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.9	170.7	178.8	69.1	0	0	0	108.5	V489 Y494 I496	L487-V489 HydrophobicContact CD2-CG2 3.98Å; L487-V489 HydrophobicContact CG-CG2 3.99Å; L487-Y494 PolarHBondContact N-O 3.1Å; L487-Y494 PolarHBondContact O-N 3.38Å; L487-I496 HydrophobicContact CB-CD1 3.61Å; L487-I496 HydrophobicContact CB-CG1 4.2Å; L487-I496 HydrophobicContact CD2-CD1 3.65Å; L487-I496 HydrophobicContact CG-CD1 4.25Å
488	I	92.5	Very high	79.4	Confident	113 Å²	113	84 Å²	84	58%	0.579	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.7	123	179	-52.7	-178	0	0	0	108.9	R492 V493	I488-R492 WeakPolarHBondContact CA-O 3.23Å; I488-V493 HydrophobicContact CG1-CG2 4.35Å
489	V	85.8	Confident	81.6	Confident	36 Å²	36	78.4 Å²	78.4	22%	0.218	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	126.1	176.6	-171.3	0	0	0	0	108	I438 L487 G491 R492 Y494	I438-V489 HydrophobicContact CD1-CG1 4.37Å; L487-V489 HydrophobicContact CD2-CG2 3.98Å; L487-V489 HydrophobicContact CG-CG2 3.99Å; V489-G491 PolarHBondContact O-N 3.24Å; V489-G491 VanDerWaalsContact O-N 3.16Å; V489-R492 PolarHBondContact N-O 2.97Å; V489-R492 WeakPolarHBondContact O-CA 3.31Å; V489-R492 WeakPolarHBondContact O-CB 3.44Å; V489-R492 PolarHBondContact O-N 2.94Å; V489-Y494 HydrophobicContact CB-CD2 4.44Å; V489-Y494 HydrophobicContact CB-CE2 4.15Å; V489-Y494 HydrophobicContact CG2-CD2 4.42Å
490	D	84.1	Confident	83.9	Confident	127 Å²	127	76.6 Å²	76.6	68%	0.679	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	33	-174.8	-40.7	-37.2	0	0	0	114.3	R492	D490-R492 PolarHBondContact O-N 3.1Å; D490-R492 IonicContact OD2-CZ 3.1Å; D490-R492 IonicContact OD2-NH2 2.64Å; D490-R492 PolarHBondContact OD2-NH2 2.86Å
491	G	85.9	Confident	86	Confident	67 Å²	67	72.1 Å²	72.1	69%	0.691	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	3.3	-173.9	0	0	0	0	0	115.1	V489	V489-G491 PolarHBondContact O-N 3.24Å; V489-G491 VanDerWaalsContact O-N 3.16Å
492	R	89.2	Confident	87.7	Confident	140 Å²	140	72.8 Å²	72.8	53%	0.528	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	131.1	172.4	-65.4	173.6	-80.8	-143.6	0	109.9	I488 V489 D490 Y494	I488-R492 WeakPolarHBondContact CA-O 3.23Å; V489-R492 PolarHBondContact N-O 2.97Å; V489-R492 WeakPolarHBondContact O-CA 3.31Å; V489-R492 WeakPolarHBondContact O-CB 3.44Å; V489-R492 PolarHBondContact O-N 2.94Å; D490-R492 PolarHBondContact O-N 3.1Å; D490-R492 IonicContact OD2-CZ 3.1Å; D490-R492 IonicContact OD2-NH2 2.64Å; D490-R492 PolarHBondContact OD2-NH2 2.86Å; R492-Y494 HydrophobicContact CB-CE2 3.8Å; R492-Y494 WeakPolarHBondContact O-CD2 3.16Å
493	V	90.4	Very high	88.5	Confident	50 Å²	50	70 Å²	70	30%	0.303	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	129.7	177.7	-174	0	0	0	0	109.9	E486 I488 Y495	E486-V493 HydrophobicContact CB-CG1 4.13Å; E486-V493 HydrophobicContact CG-CG1 4.13Å; I488-V493 HydrophobicContact CG1-CG2 4.35Å; V493-Y495 HydrophobicContact CG1-CE1 4.33Å; V493-Y495 HydrophobicContact CG1-CE2 4.46Å
494	Y	90.3	Very high	89.1	Confident	62 Å²	62	70.7 Å²	70.7	24%	0.243	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	135.7	172	-64	-96.6	0	0	0	109.2	E486 L487 V489 R492 V505	E486-Y494 CarbonylContact C-O 3.53Å; E486-Y494 WeakPolarHBondContact CA-O 3.44Å; L487-Y494 PolarHBondContact N-O 3.1Å; L487-Y494 PolarHBondContact O-N 3.38Å; V489-Y494 HydrophobicContact CB-CD2 4.44Å; V489-Y494 HydrophobicContact CB-CE2 4.15Å; V489-Y494 HydrophobicContact CG2-CD2 4.42Å; R492-Y494 HydrophobicContact CB-CE2 3.8Å; R492-Y494 WeakPolarHBondContact O-CD2 3.16Å; Y494-V505 HydrophobicContact CD1-CG2 4.24Å; Y494-V505 HydrophobicContact CE1-CG2 3.95Å
495	Y	91.6	Very high	89.2	Confident	48 Å²	48	74 Å²	74	19%	0.188	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	121.6	178.1	-53.2	-89.6	0	0	0	109.5	H484 E486 V493 S503 Y504 L507 L510	H484-Y495 AromaticContact CD2-CD1 3.7Å; H484-Y495 AromaticContact NE2-CD1 3.79Å; E486-Y495 HydrophobicContact CG-CD1 3.83Å; E486-Y495 HydrophobicContact CG-CE1 3.89Å; E486-Y495 WeakPolarHBondContact OE1-CE1 3.4Å; V493-Y495 HydrophobicContact CG1-CE1 4.33Å; V493-Y495 HydrophobicContact CG1-CE2 4.46Å; Y495-S503 CarbonylContact O-C 3.58Å; Y495-Y504 PolarHBondContact N-O 2.98Å; Y495-Y504 PolarHBondContact O-N 2.99Å; Y495-L507 HydrophobicContact CD1-CB 4.07Å; Y495-L507 HydrophobicContact CD1-CD1 4.22Å; Y495-L507 HydrophobicContact CD2-CB 4.06Å; Y495-L507 VanDerWaalsContact CD2-N 3.3Å; Y495-L507 HydrophobicContact CE1-CB 4.04Å; Y495-L507 HydrophobicContact CE1-CD2 4.42Å; Y495-L507 HydrophobicContact CE2-CB 4.03Å; Y495-L507 HydrophobicContact CG-CB 4.1Å; Y495-L510 VanDerWaalsContact CB-CD2 3.47Å; Y495-L510 HydrophobicContact CG-CD2 4.42Å
496	I	89.9	Confident	89.3	Confident	9 Å²	9	71.2 Å²	71.2	5%	0.046	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	122.1	-172.4	-54.7	-169	0	0	0	110.9	H484 Y485 L487 I498 K501 R502	H484-I496 WeakPolarHBondContact CA-O 3.45Å; H484-I496 WeakPolarHBondContact CB-O 3.21Å; Y485-I496 HydrophobicContact CD1-CB 4.43Å; Y485-I496 HydrophobicContact CD2-CB 4.14Å; Y485-I496 HydrophobicContact CE1-CB 4.1Å; Y485-I496 HydrophobicContact CE1-CG2 3.89Å; Y485-I496 HydrophobicContact CE2-CB 3.79Å; Y485-I496 HydrophobicContact CE2-CD1 3.9Å; Y485-I496 HydrophobicContact CE2-CG1 4.25Å; Y485-I496 HydrophobicContact CE2-CG2 4Å; Y485-I496 HydrophobicContact CG-CB 4.46Å; Y485-I496 PolarHBondContact N-O 2.86Å; Y485-I496 VanDerWaalsContact N-O 3.12Å; Y485-I496 PolarHBondContact O-N 3.46Å; Y485-I496 WeakPolarHBondContact OH-CG2 3.16Å; L487-I496 HydrophobicContact CB-CD1 3.61Å; L487-I496 HydrophobicContact CB-CG1 4.2Å; L487-I496 HydrophobicContact CD2-CD1 3.65Å; L487-I496 HydrophobicContact CG-CD1 4.25Å; I496-I498 PolarHBondContact O-N 3.28Å; I496-K501 HydrophobicContact CG2-CB 4.33Å; I496-R502 WeakPolarHBondContact CA-O 3.41Å
497	C	91.2	Very high	89	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	124.4	177.9	177.2	0	0	0	0	111.3	V499 K501 R502 Y504 L510 H513	C497-V499 PolarHBondContact O-N 3.45Å; C497-K501 WeakPolarHBondContact O-CA 3.47Å; C497-K501 PolarHBondContact O-N 3.38Å; C497-R502 PolarHBondContact N-O 3.31Å; C497-Y504 HydrophobicContact CB-CE2 4.47Å; C497-L510 HydrophobicContact CB-CD1 3.64Å; C497-H513 PolarHBondContact SG-NE2 2.95Å; C497-H513 VanDerWaalsContact SG-NE2 3.37Å
498	I	89.6	Confident	88.9	Confident	78 Å²	78	68.4 Å²	68.4	40%	0.4	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-31.5	-179.4	53	149.1	0	0	0	113.4	D482 D483 Y485 I496 F514	D482-I498 WeakPolarHBondContact O-CD1 3.22Å; D483-I498 PolarHBondContact O-N 2.94Å; Y485-I498 HydrophobicContact CD1-CG2 4.04Å; Y485-I498 HydrophobicContact CE1-CG2 4.48Å; I496-I498 PolarHBondContact O-N 3.28Å; I498-F514 HydrophobicContact CG1-CE2 4.31Å
499	V	87	Confident	88.6	Confident	82 Å²	82	63.9 Å²	63.9	50%	0.497	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-47.6	-172.1	-172.3	0	0	0	0	112.4	C497 F514 H517	C497-V499 PolarHBondContact O-N 3.45Å; V499-F514 HydrophobicContact CG2-CE2 3.99Å; V499-H517 HydrophobicContact CB-CB 4.38Å; V499-H517 HydrophobicContact CG1-CB 4.36Å; V499-H517 HydrophobicContact CG2-CB 4.1Å
500	C	88.3	Confident	88.8	Confident	49 Å²	49	62.2 Å²	62.2	33%	0.331	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-2.1	-174.5	73.9	0	0	0	0	114.7	R502 H513	C500-R502 PolarHBondContact O-N 3.04Å; C500-R502 VanDerWaalsContact O-N 3.12Å; C500-H513 VanDerWaalsContact SG-CE1 3.51Å; C500-H513 PolarHBondContact SG-NE2 3.35Å
501	K	89.6	Confident	88.8	Confident	68 Å²	68	61.7 Å²	61.7	30%	0.296	33%	0.328	S	S	.	.			trans	58.6	19.5	179	-58.2	163.3	-178.4	164.6	0	115.1	F61 S62 A64 I496 C497	F61-K501 PolarHBondContact O-NZ 2.86Å; S62-K501 PolarHBondContact O-NZ 3.48Å; A64-K501 HydrophobicContact CB-CB 4.36Å; A64-K501 HydrophobicContact CB-CD 4.32Å; I496-K501 HydrophobicContact CG2-CB 4.33Å; C497-K501 WeakPolarHBondContact O-CA 3.47Å; C497-K501 PolarHBondContact O-N 3.38Å
502	R	88.9	Confident	88.7	Confident	129 Å²	129	62.5 Å²	62.5	49%	0.487	31%	0.31	S	S	.	.			trans	-69.2	130.8	167.3	-72.6	-179.2	176.1	-172.9	-2	109.8	I496 C497 C500 Y504	I496-R502 WeakPolarHBondContact CA-O 3.41Å; C497-R502 PolarHBondContact N-O 3.31Å; C500-R502 PolarHBondContact O-N 3.04Å; C500-R502 VanDerWaalsContact O-N 3.12Å; R502-Y504 HydrophobicContact CB-CE2 3.64Å; R502-Y504 WeakPolarHBondContact CD-OH 3.12Å; R502-Y504 WeakPolarHBondContact O-CD2 3.45Å; R502-Y504 WeakPolarHBondContact O-CE2 3.31Å
503	S	89.8	Confident	88.5	Confident	71 Å²	71	56.6 Å²	56.6	50%	0.497	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	147.2	173.2	53.1	0	0	0	0	111.5	Y495	Y495-S503 CarbonylContact O-C 3.58Å
504	Y	90.3	Very high	88.2	Confident	28 Å²	28	55.8 Å²	55.8	11%	0.11	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	131.6	179.4	-65.4	-82	0	0	0	109.7	Y495 C497 R502 C506 L510 H513	Y495-Y504 PolarHBondContact N-O 2.98Å; Y495-Y504 PolarHBondContact O-N 2.99Å; C497-Y504 HydrophobicContact CB-CE2 4.47Å; R502-Y504 HydrophobicContact CB-CE2 3.64Å; R502-Y504 WeakPolarHBondContact CD-OH 3.12Å; R502-Y504 WeakPolarHBondContact O-CD2 3.45Å; R502-Y504 WeakPolarHBondContact O-CE2 3.31Å; Y504-C506 PolarHBondContact O-N 3.41Å; Y504-L510 HydrophobicContact CD2-CB 3.76Å; Y504-L510 HydrophobicContact CD2-CD1 3.91Å; Y504-L510 HydrophobicContact CD2-CG 4.44Å; Y504-L510 HydrophobicContact CE2-CD1 4.26Å; Y504-L510 HydrophobicContact CG-CB 3.94Å; Y504-H513 HydrophobicContact CE1-CB 4.25Å; Y504-H513 HydrophobicContact CE2-CB 4.27Å; Y504-H513 AromaticContact CE2-CD2 3.48Å; Y504-H513 VanDerWaalsContact CE2-CD2 3.48Å; Y504-H513 WeakPolarHBondContact CE2-CD2 3.33Å; Y504-H513 AromaticContact CE2-CG 3.97Å; Y504-H513 AromaticContact CZ-CD2 3.64Å; Y504-H513 AromaticContact CZ-CG 3.64Å; Y504-H513 PolarHBondContact OH-CD2 3.49Å; Y504-H513 VanDerWaalsContact OH-CD2 3.31Å; Y504-H513 PolarHBondContact OH-ND1 3.09Å
505	V	91	Very high	87.9	Confident	103 Å²	103	53.8 Å²	53.8	62%	0.624	27%	0.274	S	S	*	.	S	Bend	trans	-63.9	-28.8	176.1	-175.4	0	0	0	0	111.6	Y494	Y494-V505 HydrophobicContact CD1-CG2 4.24Å; Y494-V505 HydrophobicContact CE1-CG2 3.95Å
506	C	88.7	Confident	87.4	Confident	39 Å²	39	54.1 Å²	54.1	26%	0.264	28%	0.278	S	S	.	.	S	Bend	trans	-126.6	129.9	-177.4	-56.2	0	0	0	0	111.6	Y504 T508 S509 L510	Y504-C506 PolarHBondContact O-N 3.41Å; C506-T508 PolarHBondContact O-N 2.97Å; C506-S509 PolarHBondContact O-N 3.28Å; C506-L510 PolarHBondContact O-N 3.25Å
507	L	86	Confident	87	Confident	42 Å²	42	56.9 Å²	56.9	22%	0.22	29%	0.291	C	S	.	.	H	α-helix	trans	-53.4	-27	174.4	178.7	55.6	0	0	0	113.6	H484 Y495 L510 R511	H484-L507 VanDerWaalsContact CE1-CD1 3.5Å; H484-L507 WeakPolarHBondContact CE1-CD1 3.44Å; Y495-L507 HydrophobicContact CD1-CB 4.07Å; Y495-L507 HydrophobicContact CD1-CD1 4.22Å; Y495-L507 HydrophobicContact CD2-CB 4.06Å; Y495-L507 VanDerWaalsContact CD2-N 3.3Å; Y495-L507 HydrophobicContact CE1-CB 4.04Å; Y495-L507 HydrophobicContact CE1-CD2 4.42Å; Y495-L507 HydrophobicContact CE2-CB 4.03Å; Y495-L507 HydrophobicContact CG-CB 4.1Å; L507-L510 HydrophobicContact CD1-CD2 3.64Å; L507-L510 HydrophobicContact CD1-CG 4.5Å; L507-R511 HydrophobicContact CD1-CG 4.17Å; L507-R511 WeakPolarHBondContact O-CB 3.28Å; L507-R511 WeakPolarHBondContact O-CG 3.08Å; L507-R511 PolarHBondContact O-N 2.94Å
508	T	86.1	Confident	86.3	Confident	96 Å²	96	59.1 Å²	59.1	59%	0.589	31%	0.307	S	S	*	.	H	α-helix	trans	-65.3	-41.7	172.8	47.7	0	0	0	0	113	C506 R512	C506-T508 PolarHBondContact O-N 2.97Å; T508-R512 WeakPolarHBondContact O-CB 3.18Å; T508-R512 PolarHBondContact O-N 3.36Å
509	S	87.6	Confident	85.6	Confident	18 Å²	18	61.4 Å²	61.4	13%	0.126	31%	0.311	C	S	.	.	H	α-helix	trans	-71.7	-39.5	178.2	-78	0	0	0	0	111.9	C506 R512 H513	C506-S509 PolarHBondContact O-N 3.28Å; S509-R512 WeakPolarHBondContact O-CB 3.44Å; S509-R512 PolarHBondContact O-N 2.96Å; S509-R512 PolarHBondContact OG-NH2 2.92Å; S509-H513 WeakPolarHBondContact O-CB 3.43Å; S509-H513 PolarHBondContact O-N 3.42Å
510	L	88.5	Confident	84.5	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-56.4	-54.5	169.8	164.1	66.4	0	0	0	111.6	H484 Y495 C497 Y504 C506 L507 R512 H513 F514	H484-L510 HydrophobicContact CB-CD1 4.2Å; H484-L510 HydrophobicContact CB-CD2 3.22Å; H484-L510 HydrophobicContact CB-CG 4.26Å; Y495-L510 VanDerWaalsContact CB-CD2 3.47Å; Y495-L510 HydrophobicContact CG-CD2 4.42Å; C497-L510 HydrophobicContact CB-CD1 3.64Å; Y504-L510 HydrophobicContact CD2-CB 3.76Å; Y504-L510 HydrophobicContact CD2-CD1 3.91Å; Y504-L510 HydrophobicContact CD2-CG 4.44Å; Y504-L510 HydrophobicContact CE2-CD1 4.26Å; Y504-L510 HydrophobicContact CG-CB 3.94Å; C506-L510 PolarHBondContact O-N 3.25Å; L507-L510 HydrophobicContact CD1-CD2 3.64Å; L507-L510 HydrophobicContact CD1-CG 4.5Å; L510-R512 VanDerWaalsContact C-N 3.27Å; L510-R512 PolarHBondContact O-N 3.46Å; L510-H513 CarbonylContact O-C 3.36Å; L510-H513 WeakPolarHBondContact O-CA 3.22Å; L510-H513 WeakPolarHBondContact O-CB 3.23Å; L510-H513 PolarHBondContact O-N 3.02Å; L510-F514 PolarHBondContact O-N 3.35Å
511	R	85.1	Confident	83.3	Confident	117 Å²	117	65.7 Å²	65.7	44%	0.442	32%	0.319	S	S	.	.	H	α-helix	trans	-62	-33.8	-179.9	-77.2	177.1	178.1	167.7	4.6	112.8	L507 N515	L507-R511 HydrophobicContact CD1-CG 4.17Å; L507-R511 WeakPolarHBondContact O-CB 3.28Å; L507-R511 WeakPolarHBondContact O-CG 3.08Å; L507-R511 PolarHBondContact O-N 2.94Å; R511-N515 PolarHBondContact O-ND2 2.93Å
512	R	83.8	Confident	82.9	Confident	84 Å²	84	69.1 Å²	69.1	32%	0.317	33%	0.333	S	S	.	.	H	α-helix	trans	-62.2	-47.3	171.4	173.1	173.1	61	156.4	-8.1	110.8	T508 S509 L510 N515 L534 E536	T508-R512 WeakPolarHBondContact O-CB 3.18Å; T508-R512 PolarHBondContact O-N 3.36Å; S509-R512 WeakPolarHBondContact O-CB 3.44Å; S509-R512 PolarHBondContact O-N 2.96Å; S509-R512 PolarHBondContact OG-NH2 2.92Å; L510-R512 VanDerWaalsContact C-N 3.27Å; L510-R512 PolarHBondContact O-N 3.46Å; R512-N515 WeakPolarHBondContact CA-ND2 3.42Å; R512-N515 PolarHBondContact O-ND2 3.06Å; R512-L534 HydrophobicContact CG-CD2 3.54Å; R512-L534 HydrophobicContact CG-CG 4.17Å; R512-E536 WeakPolarHBondContact CD-OE1 3.07Å; R512-E536 IonicContact CZ-OE1 3.86Å; R512-E536 IonicContact NE-OE1 3.16Å; R512-E536 VanDerWaalsContact NH1-CD 3.32Å; R512-E536 IonicContact NH1-OE1 3.7Å; R512-E536 PolarHBondContact NH1-OE1 2.68Å; R512-E536 IonicContact NH1-OE2 2.84Å; R512-E536 PolarHBondContact NH1-OE2 3.07Å
513	H	85.3	Confident	82.7	Confident	15 Å²	15	65.6 Å²	65.6	7%	0.069	32%	0.321	C	S	.	.	H	α-helix	trans	-64.8	-39.3	176.1	158.1	64.9	0	0	0	113.2	C497 C500 Y504 S509 L510 N515 I516 H517	C497-H513 PolarHBondContact SG-NE2 2.95Å; C497-H513 VanDerWaalsContact SG-NE2 3.37Å; C500-H513 VanDerWaalsContact SG-CE1 3.51Å; C500-H513 PolarHBondContact SG-NE2 3.35Å; Y504-H513 HydrophobicContact CE1-CB 4.25Å; Y504-H513 HydrophobicContact CE2-CB 4.27Å; Y504-H513 AromaticContact CE2-CD2 3.48Å; Y504-H513 VanDerWaalsContact CE2-CD2 3.48Å; Y504-H513 WeakPolarHBondContact CE2-CD2 3.33Å; Y504-H513 AromaticContact CE2-CG 3.97Å; Y504-H513 AromaticContact CZ-CD2 3.64Å; Y504-H513 AromaticContact CZ-CG 3.64Å; Y504-H513 PolarHBondContact OH-CD2 3.49Å; Y504-H513 VanDerWaalsContact OH-CD2 3.31Å; Y504-H513 PolarHBondContact OH-ND1 3.09Å; S509-H513 WeakPolarHBondContact O-CB 3.43Å; S509-H513 PolarHBondContact O-N 3.42Å; L510-H513 CarbonylContact O-C 3.36Å; L510-H513 WeakPolarHBondContact O-CA 3.22Å; L510-H513 WeakPolarHBondContact O-CB 3.23Å; L510-H513 PolarHBondContact O-N 3.02Å; H513-N515 PolarHBondContact O-N 3.49Å; H513-N515 VanDerWaalsContact O-N 3.12Å; H513-I516 VanDerWaalsContact O-CB 3.22Å; H513-I516 WeakPolarHBondContact O-CB 3.47Å; H513-I516 VanDerWaalsContact O-CG1 3.24Å; H513-I516 WeakPolarHBondContact O-CG1 3.46Å; H513-I516 PolarHBondContact O-N 3.05Å; H513-H517 AromaticContact CE1-CD2 3.66Å; H513-H517 AromaticContact CE1-NE2 3.22Å; H513-H517 PolarHBondContact CE1-NE2 3.39Å; H513-H517 AromaticContact NE2-CD2 3.55Å; H513-H517 AromaticContact NE2-NE2 3.32Å; H513-H517 PolarHBondContact NE2-NE2 3.05Å
514	F	83.8	Confident	82.6	Confident	34 Å²	34	65.9 Å²	65.9	15%	0.149	32%	0.321	C	S	.	.	H	α-helix	trans	-61.8	-23.7	-176.6	-167.5	-96.2	0	0	0	113.5	D483 I498 V499 L510 I516 H517 S518	D483-F514 HydrophobicContact CB-CD1 3.96Å; D483-F514 HydrophobicContact CB-CD2 3.72Å; D483-F514 HydrophobicContact CB-CE1 3.87Å; D483-F514 HydrophobicContact CB-CE2 3.6Å; D483-F514 HydrophobicContact CB-CG 3.9Å; D483-F514 HydrophobicContact CB-CZ 3.69Å; I498-F514 HydrophobicContact CG1-CE2 4.31Å; V499-F514 HydrophobicContact CG2-CE2 3.99Å; L510-F514 PolarHBondContact O-N 3.35Å; F514-I516 PolarHBondContact O-N 3.28Å; F514-I516 VanDerWaalsContact O-N 3.16Å; F514-H517 PolarHBondContact O-N 3Å; F514-S518 PolarHBondContact O-N 2.88Å
515	N	83.1	Confident	82.6	Confident	20 Å²	20	65.1 Å²	65.1	11%	0.107	32%	0.319	C	S	.	.	H	α-helix	trans	-59.6	-24.5	171.6	-52.8	-73.6	0	0	0	112.9	R511 R512 H513 H517 W519 P533	R511-N515 PolarHBondContact O-ND2 2.93Å; R512-N515 WeakPolarHBondContact CA-ND2 3.42Å; R512-N515 PolarHBondContact O-ND2 3.06Å; H513-N515 PolarHBondContact O-N 3.49Å; H513-N515 VanDerWaalsContact O-N 3.12Å; N515-H517 VanDerWaalsContact C-N 3.29Å; N515-W519 WeakPolarHBondContact O-CA 3.27Å; N515-W519 PolarHBondContact O-N 3.43Å; N515-P533 WeakPolarHBondContact CB-O 3.4Å
516	I	82.1	Confident	82.4	Confident	54 Å²	54	68.2 Å²	68.2	28%	0.277	32%	0.32	S	S	.	.	H	α-helix	trans	-68.9	-29.1	174.7	-54	172.6	0	0	0	111.2	H513 F514 W519 P533 L534	H513-I516 VanDerWaalsContact O-CB 3.22Å; H513-I516 WeakPolarHBondContact O-CB 3.47Å; H513-I516 VanDerWaalsContact O-CG1 3.24Å; H513-I516 WeakPolarHBondContact O-CG1 3.46Å; H513-I516 PolarHBondContact O-N 3.05Å; F514-I516 PolarHBondContact O-N 3.28Å; F514-I516 VanDerWaalsContact O-N 3.16Å; I516-W519 PolarHBondContact O-NE1 3.46Å; I516-W519 VanDerWaalsContact O-NE1 3.07Å; I516-P533 HydrophobicContact CB-CB 4.47Å; I516-P533 HydrophobicContact CG1-CB 4.12Å; I516-P533 HydrophobicContact CG1-CG 3.97Å; I516-L534 HydrophobicContact CD1-CD1 3.82Å; I516-L534 HydrophobicContact CG1-CD1 3.41Å; I516-L534 VanDerWaalsContact CG1-CD1 3.41Å
517	H	81.6	Confident	82.4	Confident	68 Å²	68	71.8 Å²	71.8	32%	0.315	33%	0.329	S	S	.	.	H	α-helix	trans	-90.5	-43.4	175.9	-64.7	-57	0	0	0	112	V499 H513 F514 N515	V499-H517 HydrophobicContact CB-CB 4.38Å; V499-H517 HydrophobicContact CG1-CB 4.36Å; V499-H517 HydrophobicContact CG2-CB 4.1Å; H513-H517 AromaticContact CE1-CD2 3.66Å; H513-H517 AromaticContact CE1-NE2 3.22Å; H513-H517 PolarHBondContact CE1-NE2 3.39Å; H513-H517 AromaticContact NE2-CD2 3.55Å; H513-H517 AromaticContact NE2-NE2 3.32Å; H513-H517 PolarHBondContact NE2-NE2 3.05Å; F514-H517 PolarHBondContact O-N 3Å; N515-H517 VanDerWaalsContact C-N 3.29Å
518	S	75.7	Confident	82.6	Confident	47 Å²	47	71.9 Å²	71.9	33%	0.329	33%	0.332	S	S	.	.	H	α-helix	trans	-69.4	-31.3	-179.3	-160.9	0	0	0	0	112.9	F514 E520	F514-S518 PolarHBondContact O-N 2.88Å; S518-E520 PolarHBondContact O-N 3.01Å; S518-E520 VanDerWaalsContact OG-CB 3.31Å; S518-E520 WeakPolarHBondContact OG-CB 3.45Å; S518-E520 PolarHBondContact OG-OE2 2.58Å
519	W	74.6	Confident	82.8	Confident	126 Å²	126	76.7 Å²	76.7	48%	0.477	35%	0.348	S	S	.	.			trans	52.5	10.6	-170.3	-71.4	93.7	0	0	0	115.4	N515 I516 K521 K522 P533	N515-W519 WeakPolarHBondContact O-CA 3.27Å; N515-W519 PolarHBondContact O-N 3.43Å; I516-W519 PolarHBondContact O-NE1 3.46Å; I516-W519 VanDerWaalsContact O-NE1 3.07Å; W519-K521 VanDerWaalsContact C-N 3.33Å; W519-K521 PolarHBondContact O-N 3.37Å; W519-K522 WeakPolarHBondContact O-CE 3.26Å; W519-K522 VanDerWaalsContact O-CG 3.23Å; W519-K522 WeakPolarHBondContact O-CG 3.03Å; W519-P533 HydrophobicContact CE3-CB 4.49Å; W519-P533 HydrophobicContact CZ3-CB 4.39Å
520	E	64.1	Low	82.8	Confident	122 Å²	122	82 Å²	82	57%	0.57	37%	0.369	S	S	*	.			trans	-67.9	-28.3	-175	178.7	-178.8	-179	0	0	113.1	S518	S518-E520 PolarHBondContact O-N 3.01Å; S518-E520 VanDerWaalsContact OG-CB 3.31Å; S518-E520 WeakPolarHBondContact OG-CB 3.45Å; S518-E520 PolarHBondContact OG-OE2 2.58Å
521	K	64	Low	82.8	Confident	99 Å²	99	85.3 Å²	85.3	43%	0.43	39%	0.389	S	S	.	.	S	Bend	trans	-113	86.2	177.3	-65.3	-179.9	-168.3	159.8	0	110	W519 Y523	W519-K521 VanDerWaalsContact C-N 3.33Å; W519-K521 PolarHBondContact O-N 3.37Å; K521-Y523 HydrophobicContact CB-CE2 3.7Å; K521-Y523 WeakPolarHBondContact O-CD2 3.24Å; K521-Y523 WeakPolarHBondContact O-CE2 3.09Å
522	K	81.6	Confident	82.7	Confident	139 Å²	139	81.7 Å²	81.7	60%	0.604	38%	0.376	S	S	*	.			trans	-81.8	119.6	176.1	-64.4	-174	-177.2	178.6	0	109.5	W519 P524 V531	W519-K522 WeakPolarHBondContact O-CE 3.26Å; W519-K522 VanDerWaalsContact O-CG 3.23Å; W519-K522 WeakPolarHBondContact O-CG 3.03Å; K522-P524 VanDerWaalsContact C-CD 3.5Å; K522-P524 WeakPolarHBondContact O-CD 3.32Å; K522-V531 HydrophobicContact CB-CG1 3.64Å; K522-V531 HydrophobicContact CD-CG1 4.43Å; K522-V531 HydrophobicContact CG-CG1 4.1Å
523	Y	84.6	Confident	82.6	Confident	56 Å²	56	78.5 Å²	78.5	22%	0.22	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	84.3	175.9	-61.7	-83.2	0	0	0	109.3	K521 F532 A535	K521-Y523 HydrophobicContact CB-CE2 3.7Å; K521-Y523 WeakPolarHBondContact O-CD2 3.24Å; K521-Y523 WeakPolarHBondContact O-CE2 3.09Å; Y523-F532 WeakPolarHBondContact CB-O 3.43Å; Y523-F532 PolarHBondContact N-O 2.99Å; Y523-F532 PolarHBondContact O-N 2.73Å; Y523-A535 HydrophobicContact CD1-CB 3.83Å; Y523-A535 HydrophobicContact CE1-CB 3.64Å; Y523-A535 HydrophobicContact CE2-CB 4.37Å; Y523-A535 HydrophobicContact CG-CB 4.28Å
524	P	86.4	Confident	82.5	Confident	76 Å²	76	78.1 Å²	78.1	49%	0.494	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	137.3	175.8	29.3	-35.5	0	0	0	110.9	K522 V531 R538	K522-P524 VanDerWaalsContact C-CD 3.5Å; K522-P524 WeakPolarHBondContact O-CD 3.32Å; P524-V531 HydrophobicContact CB-CG2 4.21Å; P524-R538 WeakPolarHBondContact O-CD 3.42Å
525	C	90.1	Very high	82.5	Confident	12 Å²	12	78.4 Å²	78.4	8%	0.081	37%	0.374	C	S	.	.			trans	-62	144.3	171.6	-176.2	0	0	0	0	111.1	Y527 C528 K530 F532 H541	C525-Y527 VanDerWaalsContact C-N 3.29Å; C525-Y527 PolarHBondContact O-N 3.01Å; C525-Y527 PolarHBondContact SG-N 3.44Å; C525-Y527 VanDerWaalsContact SG-N 3.39Å; C525-C528 WeakPolarHBondContact CB-O 3.34Å; C525-K530 WeakPolarHBondContact CB-O 3.48Å; C525-K530 PolarHBondContact N-O 3.26Å; C525-F532 HydrophobicContact CB-CE2 4.36Å; C525-H541 PolarHBondContact SG-CD2 2.84Å; C525-H541 PolarHBondContact SG-NE2 3.33Å; C525-H541 VanDerWaalsContact SG-NE2 3.39Å
526	R	88.6	Confident	82.5	Confident	168 Å²	168	81 Å²	81	63%	0.634	39%	0.385	S	S	*	.	S	Bend	trans	-75.2	-11.8	173.9	-77	-178.9	160.7	-178.9	-5.3	114.8	E542	R526-E542 PolarHBondContact N-OE1 3.44Å; R526-E542 VanDerWaalsContact N-OE1 3.11Å
527	Y	87.1	Confident	82.7	Confident	115 Å²	115	81.7 Å²	81.7	45%	0.451	39%	0.385	S	S	.	.	S	Bend	trans	-117.7	-12.9	-171.8	-53.9	-77.1	0	0	0	114.7	C525 E542 H545 T546 L593	C525-Y527 VanDerWaalsContact C-N 3.29Å; C525-Y527 PolarHBondContact O-N 3.01Å; C525-Y527 PolarHBondContact SG-N 3.44Å; C525-Y527 VanDerWaalsContact SG-N 3.39Å; Y527-E542 HydrophobicContact CD2-CB 4.4Å; Y527-E542 HydrophobicContact CD2-CG 4.07Å; Y527-E542 HydrophobicContact CE2-CB 4.12Å; Y527-E542 HydrophobicContact CE2-CG 4.07Å; Y527-H545 HydrophobicContact CD2-CB 3.62Å; Y527-H545 AromaticContact CD2-CG 3.99Å; Y527-H545 HydrophobicContact CE2-CB 4.24Å; Y527-H545 HydrophobicContact CG-CB 3.84Å; Y527-H545 AromaticContact CG-CG 3.98Å; Y527-T546 HydrophobicContact CE2-CG2 4.29Å; Y527-L593 HydrophobicContact CE2-CD2 3.94Å; Y527-L593 WeakPolarHBondContact OH-CD2 3.48Å
528	C	90.9	Very high	83	Confident	44 Å²	44	81.1 Å²	81.1	30%	0.297	38%	0.38	S	S	.	.	S	Bend	trans	-157	170.9	176	74.7	0	0	0	0	111.2	C525 K530 H541	C525-C528 WeakPolarHBondContact CB-O 3.34Å; C528-K530 PolarHBondContact O-N 3.16Å; C528-H541 PolarHBondContact SG-NE2 2.68Å
529	E	90.9	Very high	83.6	Confident	196 Å²	196	80.3 Å²	80.3	92%	0.916	37%	0.373	S	S	*	.	S	Bend	trans	-72.2	6	-174.9	-54.7	-170.7	161.3	0	0	115.2	V531	E529-V531 PolarHBondContact O-N 2.99Å
530	K	86.9	Confident	84.1	Confident	131 Å²	131	78.5 Å²	78.5	57%	0.57	37%	0.368	S	S	*	.			trans	-73.4	129.8	-176.9	-68.6	-175.4	-179.6	-177.8	0	110.8	C525 C528 F532	C525-K530 WeakPolarHBondContact CB-O 3.48Å; C525-K530 PolarHBondContact N-O 3.26Å; C528-K530 PolarHBondContact O-N 3.16Å; K530-F532 HydrophobicContact CB-CE2 3.75Å; K530-F532 HydrophobicContact CB-CZ 4.01Å
531	V	87.6	Confident	85.3	Confident	68 Å²	68	74.2 Å²	74.2	41%	0.412	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	126.4	-179.1	-176.5	0	0	0	0	110.3	K522 P524 E529	K522-V531 HydrophobicContact CB-CG1 3.64Å; K522-V531 HydrophobicContact CD-CG1 4.43Å; K522-V531 HydrophobicContact CG-CG1 4.1Å; P524-V531 HydrophobicContact CB-CG2 4.21Å; E529-V531 PolarHBondContact O-N 2.99Å
532	F	84.5	Confident	86.4	Confident	41 Å²	41	69.6 Å²	69.6	18%	0.18	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	146.5	-178	-60.7	-93.6	0	0	0	110.9	Y523 C525 K530 L534 R538 H541	Y523-F532 WeakPolarHBondContact CB-O 3.43Å; Y523-F532 PolarHBondContact N-O 2.99Å; Y523-F532 PolarHBondContact O-N 2.73Å; C525-F532 HydrophobicContact CB-CE2 4.36Å; K530-F532 HydrophobicContact CB-CE2 3.75Å; K530-F532 HydrophobicContact CB-CZ 4.01Å; F532-L534 VanDerWaalsContact C-N 3.29Å; F532-R538 HydrophobicContact CB-CB 4.18Å; F532-R538 HydrophobicContact CD2-CB 3.93Å; F532-R538 HydrophobicContact CD2-CG 4.01Å; F532-R538 HydrophobicContact CG-CB 4.21Å; F532-H541 HydrophobicContact CE1-CB 4.22Å; F532-H541 HydrophobicContact CE2-CB 4.16Å; F532-H541 AromaticContact CE2-CD2 3.25Å; F532-H541 WeakPolarHBondContact CE2-CD2 3.49Å; F532-H541 AromaticContact CE2-CG 3.87Å; F532-H541 HydrophobicContact CZ-CB 3.69Å; F532-H541 AromaticContact CZ-CD2 3.31Å; F532-H541 WeakPolarHBondContact CZ-CD2 3.23Å; F532-H541 AromaticContact CZ-CG 3.47Å; F532-H541 VanDerWaalsContact CZ-CG 3.47Å
533	P	80.2	Confident	86.7	Confident	17 Å²	17	63.7 Å²	63.7	11%	0.11	30%	0.303	C	S	.	.	S	Bend	trans	-78.3	-11.8	174.2	31.2	-34.9	0	0	0	113.4	N515 I516 W519	N515-P533 WeakPolarHBondContact CB-O 3.4Å; I516-P533 HydrophobicContact CB-CB 4.47Å; I516-P533 HydrophobicContact CG1-CB 4.12Å; I516-P533 HydrophobicContact CG1-CG 3.97Å; W519-P533 HydrophobicContact CE3-CB 4.49Å; W519-P533 HydrophobicContact CZ3-CB 4.39Å
534	L	83.4	Confident	86.8	Confident	8 Å²	8	67.4 Å²	67.4	4%	0.042	32%	0.322	C	S	.	.	S	Bend	trans	-130.8	141	-179.8	-79.9	76.1	0	0	0	111.3	R512 I516 F532 E536 Y537 R538	R512-L534 HydrophobicContact CG-CD2 3.54Å; R512-L534 HydrophobicContact CG-CG 4.17Å; I516-L534 HydrophobicContact CD1-CD1 3.82Å; I516-L534 HydrophobicContact CG1-CD1 3.41Å; I516-L534 VanDerWaalsContact CG1-CD1 3.41Å; F532-L534 VanDerWaalsContact C-N 3.29Å; L534-E536 HydrophobicContact CB-CG 4.23Å; L534-E536 HydrophobicContact CD2-CG 4.14Å; L534-E536 WeakPolarHBondContact CD2-OE1 3.32Å; L534-E536 PolarHBondContact O-N 3.25Å; L534-Y537 HydrophobicContact CB-CD2 3.91Å; L534-Y537 HydrophobicContact CB-CE2 4.33Å; L534-Y537 HydrophobicContact CB-CG 4.1Å; L534-Y537 HydrophobicContact CD1-CD2 4.37Å; L534-Y537 HydrophobicContact CD1-CE2 4.13Å; L534-Y537 HydrophobicContact CD2-CD2 4.41Å; L534-Y537 HydrophobicContact CD2-CE1 4.37Å; L534-Y537 HydrophobicContact CD2-CE2 4.02Å; L534-Y537 HydrophobicContact CG-CD2 4.46Å; L534-Y537 HydrophobicContact CG-CE2 4.41Å; L534-Y537 PolarHBondContact O-N 3.13Å; L534-R538 PolarHBondContact O-N 3.23Å
535	A	84.3	Confident	86.9	Confident	40 Å²	40	67.8 Å²	67.8	33%	0.331	32%	0.317	S	S	.	.	H	α-helix	trans	-61.5	-40.3	177.2	0	0	0	0	0	113	Y523 Y537 R538 T539	Y523-A535 HydrophobicContact CD1-CB 3.83Å; Y523-A535 HydrophobicContact CE1-CB 3.64Å; Y523-A535 HydrophobicContact CE2-CB 4.37Å; Y523-A535 HydrophobicContact CG-CB 4.28Å; A535-Y537 VanDerWaalsContact C-N 3.34Å; A535-Y537 PolarHBondContact O-N 3.22Å; A535-R538 PolarHBondContact O-N 3.01Å; A535-T539 PolarHBondContact O-N 3.2Å; A535-T539 PolarHBondContact O-OG1 3.28Å; A535-T539 VanDerWaalsContact O-OG1 3.12Å
536	E	83.6	Confident	86.7	Confident	75 Å²	75	69.2 Å²	69.2	35%	0.35	33%	0.326	S	S	.	.	H	α-helix	trans	-64.7	-35.7	-179.3	63.9	-161.9	-164.1	0	0	112.5	R512 L534 T539 K540	R512-E536 WeakPolarHBondContact CD-OE1 3.07Å; R512-E536 IonicContact CZ-OE1 3.86Å; R512-E536 IonicContact NE-OE1 3.16Å; R512-E536 VanDerWaalsContact NH1-CD 3.32Å; R512-E536 IonicContact NH1-OE1 3.7Å; R512-E536 PolarHBondContact NH1-OE1 2.68Å; R512-E536 IonicContact NH1-OE2 2.84Å; R512-E536 PolarHBondContact NH1-OE2 3.07Å; L534-E536 HydrophobicContact CB-CG 4.23Å; L534-E536 HydrophobicContact CD2-CG 4.14Å; L534-E536 WeakPolarHBondContact CD2-OE1 3.32Å; L534-E536 PolarHBondContact O-N 3.25Å; E536-T539 PolarHBondContact O-N 3.18Å; E536-K540 WeakPolarHBondContact O-CG 3.3Å; E536-K540 PolarHBondContact O-N 2.92Å
537	Y	85.1	Confident	86.6	Confident	68 Å²	68	63 Å²	63	27%	0.267	31%	0.314	S	S	.	.	H	α-helix	trans	-69.2	-43.3	174.1	-61.7	-14	0	0	0	111.6	L534 A535 T539 K540 H541	L534-Y537 HydrophobicContact CB-CD2 3.91Å; L534-Y537 HydrophobicContact CB-CE2 4.33Å; L534-Y537 HydrophobicContact CB-CG 4.1Å; L534-Y537 HydrophobicContact CD1-CD2 4.37Å; L534-Y537 HydrophobicContact CD1-CE2 4.13Å; L534-Y537 HydrophobicContact CD2-CD2 4.41Å; L534-Y537 HydrophobicContact CD2-CE1 4.37Å; L534-Y537 HydrophobicContact CD2-CE2 4.02Å; L534-Y537 HydrophobicContact CG-CD2 4.46Å; L534-Y537 HydrophobicContact CG-CE2 4.41Å; L534-Y537 PolarHBondContact O-N 3.13Å; A535-Y537 VanDerWaalsContact C-N 3.34Å; A535-Y537 PolarHBondContact O-N 3.22Å; Y537-T539 VanDerWaalsContact C-N 3.3Å; Y537-T539 PolarHBondContact O-N 3.38Å; Y537-K540 PolarHBondContact O-N 3.42Å; Y537-H541 WeakPolarHBondContact O-CB 3.43Å; Y537-H541 PolarHBondContact O-N 3.48Å
538	R	89.4	Confident	86.6	Confident	56 Å²	56	59.2 Å²	59.2	21%	0.211	30%	0.3	C	S	.	.	H	α-helix	trans	-57.6	-45.3	171.8	-165.9	-149.8	69.1	-167.4	16.6	110.7	P524 F532 L534 A535 H541 E542	P524-R538 WeakPolarHBondContact O-CD 3.42Å; F532-R538 HydrophobicContact CB-CB 4.18Å; F532-R538 HydrophobicContact CD2-CB 3.93Å; F532-R538 HydrophobicContact CD2-CG 4.01Å; F532-R538 HydrophobicContact CG-CB 4.21Å; L534-R538 PolarHBondContact O-N 3.23Å; A535-R538 PolarHBondContact O-N 3.01Å; R538-H541 PolarHBondContact O-N 3.28Å; R538-E542 WeakPolarHBondContact CD-OE1 3.42Å; R538-E542 HydrophobicContact CG-CG 4.33Å; R538-E542 IonicContact CZ-OE1 2.94Å; R538-E542 IonicContact CZ-OE2 3.54Å; R538-E542 IonicContact NE-OE1 2.8Å; R538-E542 PolarHBondContact NE-OE1 3.02Å; R538-E542 VanDerWaalsContact NE-OE1 3.08Å; R538-E542 IonicContact NE-OE2 2.81Å; R538-E542 PolarHBondContact NE-OE2 3.31Å; R538-E542 IonicContact NH2-OE1 3.6Å; R538-E542 IonicContact NH2-OE2 2.71Å; R538-E542 PolarHBondContact NH2-OE2 2.94Å; R538-E542 WeakPolarHBondContact O-CB 3.35Å; R538-E542 VanDerWaalsContact O-CG 3.31Å; R538-E542 WeakPolarHBondContact O-CG 3.34Å; R538-E542 PolarHBondContact O-N 2.92Å
539	T	86.7	Confident	86.6	Confident	29 Å²	29	65.5 Å²	65.5	18%	0.178	32%	0.318	C	S	.	.	H	α-helix	trans	-62.8	-45.5	178.7	-64.8	0	0	0	0	112.8	A535 E536 Y537 H541 E542 I543 I595	A535-T539 PolarHBondContact O-N 3.2Å; A535-T539 PolarHBondContact O-OG1 3.28Å; A535-T539 VanDerWaalsContact O-OG1 3.12Å; E536-T539 PolarHBondContact O-N 3.18Å; Y537-T539 VanDerWaalsContact C-N 3.3Å; Y537-T539 PolarHBondContact O-N 3.38Å; T539-H541 VanDerWaalsContact C-N 3.28Å; T539-H541 PolarHBondContact O-N 3.31Å; T539-E542 PolarHBondContact O-N 2.92Å; T539-I543 HydrophobicContact CG2-CD1 4.21Å; T539-I543 WeakPolarHBondContact O-CG1 3.45Å; T539-I543 PolarHBondContact O-N 3.43Å; T539-I595 HydrophobicContact CG2-CG2 3.74Å
540	K	86.7	Confident	86.4	Confident	88 Å²	88	57.4 Å²	57.4	38%	0.383	28%	0.279	S	S	.	.	H	α-helix	trans	-60.3	-39	176	-74.7	-177.7	178.5	-173.7	0	111.9	E536 Y537 H544 E671	E536-K540 WeakPolarHBondContact O-CG 3.3Å; E536-K540 PolarHBondContact O-N 2.92Å; Y537-K540 PolarHBondContact O-N 3.42Å; K540-H544 PolarHBondContact O-N 3.26Å; K540-E671 WeakPolarHBondContact CE-OE1 3.38Å; K540-E671 IonicContact NZ-OE1 3.19Å; K540-E671 PolarHBondContact NZ-OE1 2.94Å; K540-E671 IonicContact NZ-OE2 3.12Å
541	H	87.8	Confident	86.6	Confident	32 Å²	32	52.4 Å²	52.4	15%	0.148	26%	0.256	C	S	.	.	H	α-helix	trans	-71.5	-38.5	175.7	170.9	57.8	0	0	0	113.4	C525 C528 F532 Y537 R538 T539 I543 H544 H545	C525-H541 PolarHBondContact SG-CD2 2.84Å; C525-H541 PolarHBondContact SG-NE2 3.33Å; C525-H541 VanDerWaalsContact SG-NE2 3.39Å; C528-H541 PolarHBondContact SG-NE2 2.68Å; F532-H541 HydrophobicContact CE1-CB 4.22Å; F532-H541 HydrophobicContact CE2-CB 4.16Å; F532-H541 AromaticContact CE2-CD2 3.25Å; F532-H541 WeakPolarHBondContact CE2-CD2 3.49Å; F532-H541 AromaticContact CE2-CG 3.87Å; F532-H541 HydrophobicContact CZ-CB 3.69Å; F532-H541 AromaticContact CZ-CD2 3.31Å; F532-H541 WeakPolarHBondContact CZ-CD2 3.23Å; F532-H541 AromaticContact CZ-CG 3.47Å; F532-H541 VanDerWaalsContact CZ-CG 3.47Å; Y537-H541 WeakPolarHBondContact O-CB 3.43Å; Y537-H541 PolarHBondContact O-N 3.48Å; R538-H541 PolarHBondContact O-N 3.28Å; T539-H541 VanDerWaalsContact C-N 3.28Å; T539-H541 PolarHBondContact O-N 3.31Å; H541-I543 VanDerWaalsContact C-N 3.33Å; H541-I543 PolarHBondContact O-N 3.44Å; H541-H544 WeakPolarHBondContact O-CB 3.36Å; H541-H544 PolarHBondContact O-N 3.06Å; H541-H545 AromaticContact CE1-CD2 3.46Å; H541-H545 PolarHBondContact CE1-CD2 2.9Å; H541-H545 VanDerWaalsContact CE1-CD2 3.46Å; H541-H545 AromaticContact CE1-NE2 3.16Å; H541-H545 PolarHBondContact CE1-NE2 3.34Å; H541-H545 AromaticContact NE2-CD2 3.61Å; H541-H545 AromaticContact NE2-NE2 3.34Å; H541-H545 PolarHBondContact NE2-NE2 3.06Å; H541-H545 PolarHBondContact O-N 3.1Å
542	E	87.6	Confident	86.8	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.009	25%	0.249	C	C	.	.	H	α-helix	trans	-64.7	-36	173.1	-75.4	174.2	152.9	0	0	111.7	R526 Y527 R538 T539 H544 H545 T546 L593	R526-E542 PolarHBondContact N-OE1 3.44Å; R526-E542 VanDerWaalsContact N-OE1 3.11Å; Y527-E542 HydrophobicContact CD2-CB 4.4Å; Y527-E542 HydrophobicContact CD2-CG 4.07Å; Y527-E542 HydrophobicContact CE2-CB 4.12Å; Y527-E542 HydrophobicContact CE2-CG 4.07Å; R538-E542 WeakPolarHBondContact CD-OE1 3.42Å; R538-E542 HydrophobicContact CG-CG 4.33Å; R538-E542 IonicContact CZ-OE1 2.94Å; R538-E542 IonicContact CZ-OE2 3.54Å; R538-E542 IonicContact NE-OE1 2.8Å; R538-E542 PolarHBondContact NE-OE1 3.02Å; R538-E542 VanDerWaalsContact NE-OE1 3.08Å; R538-E542 IonicContact NE-OE2 2.81Å; R538-E542 PolarHBondContact NE-OE2 3.31Å; R538-E542 IonicContact NH2-OE1 3.6Å; R538-E542 IonicContact NH2-OE2 2.71Å; R538-E542 PolarHBondContact NH2-OE2 2.94Å; R538-E542 WeakPolarHBondContact O-CB 3.35Å; R538-E542 VanDerWaalsContact O-CG 3.31Å; R538-E542 WeakPolarHBondContact O-CG 3.34Å; R538-E542 PolarHBondContact O-N 2.92Å; T539-E542 PolarHBondContact O-N 2.92Å; E542-H544 VanDerWaalsContact C-N 3.26Å; E542-H544 PolarHBondContact O-N 3.36Å; E542-H545 PolarHBondContact O-N 3.28Å; E542-T546 PolarHBondContact O-N 3.13Å; E542-T546 VanDerWaalsContact O-N 3.11Å; E542-L593 HydrophobicContact CB-CD1 3.58Å; E542-L593 HydrophobicContact CB-CD2 4.04Å; E542-L593 HydrophobicContact CB-CG 4.48Å
543	I	88.4	Confident	87.3	Confident	16 Å²	16	49.8 Å²	49.8	8%	0.082	24%	0.24	C	C	.	.	H	α-helix	trans	-58.9	-42	173.4	-71.9	168.6	0	0	0	110	T539 H541 H545 T546 G547 I561 L593	T539-I543 HydrophobicContact CG2-CD1 4.21Å; T539-I543 WeakPolarHBondContact O-CG1 3.45Å; T539-I543 PolarHBondContact O-N 3.43Å; H541-I543 VanDerWaalsContact C-N 3.33Å; H541-I543 PolarHBondContact O-N 3.44Å; I543-H545 PolarHBondContact O-N 2.98Å; I543-T546 CarbonylContact O-C 3.15Å; I543-T546 PolarHBondContact O-N 3.14Å; I543-T546 PolarHBondContact O-OG1 2.79Å; I543-G547 PolarHBondContact O-N 3.11Å; I543-I561 HydrophobicContact CG2-CG1 3.98Å; I543-L593 HydrophobicContact CG1-CD1 3.7Å
544	H	87.4	Confident	87.9	Confident	133 Å²	133	53.5 Å²	53.5	62%	0.616	26%	0.259	S	S	*	.	H	α-helix	trans	-59.4	-45.3	176.3	-169.6	82.3	0	0	0	112.3	K540 H541 E542 T546 G547	K540-H544 PolarHBondContact O-N 3.26Å; H541-H544 WeakPolarHBondContact O-CB 3.36Å; H541-H544 PolarHBondContact O-N 3.06Å; E542-H544 VanDerWaalsContact C-N 3.26Å; E542-H544 PolarHBondContact O-N 3.36Å; H544-T546 PolarHBondContact O-N 3.38Å; H544-G547 PolarHBondContact O-N 3.41Å; H544-G547 VanDerWaalsContact O-N 3.14Å
545	H	87.1	Confident	88.1	Confident	84 Å²	84	56 Å²	56	39%	0.389	28%	0.28	S	S	.	.	H	α-helix	trans	-60.2	-30.2	173.1	-82.8	-75.5	0	0	0	114	Y527 H541 E542 I543	Y527-H545 HydrophobicContact CD2-CB 3.62Å; Y527-H545 AromaticContact CD2-CG 3.99Å; Y527-H545 HydrophobicContact CE2-CB 4.24Å; Y527-H545 HydrophobicContact CG-CB 3.84Å; Y527-H545 AromaticContact CG-CG 3.98Å; H541-H545 AromaticContact CE1-CD2 3.46Å; H541-H545 PolarHBondContact CE1-CD2 2.9Å; H541-H545 VanDerWaalsContact CE1-CD2 3.46Å; H541-H545 AromaticContact CE1-NE2 3.16Å; H541-H545 PolarHBondContact CE1-NE2 3.34Å; H541-H545 AromaticContact NE2-CD2 3.61Å; H541-H545 AromaticContact NE2-NE2 3.34Å; H541-H545 PolarHBondContact NE2-NE2 3.06Å; H541-H545 PolarHBondContact O-N 3.1Å; E542-H545 PolarHBondContact O-N 3.28Å; I543-H545 PolarHBondContact O-N 2.98Å
546	T	86.1	Confident	88.4	Confident	43 Å²	43	56.8 Å²	56.8	26%	0.264	28%	0.283	S	S	.	.	H	α-helix	trans	-88.9	-7.2	177.2	66.2	0	0	0	0	114.5	Y527 E542 I543 H544 E548 S592 L593	Y527-T546 HydrophobicContact CE2-CG2 4.29Å; E542-T546 PolarHBondContact O-N 3.13Å; E542-T546 VanDerWaalsContact O-N 3.11Å; I543-T546 CarbonylContact O-C 3.15Å; I543-T546 PolarHBondContact O-N 3.14Å; I543-T546 PolarHBondContact O-OG1 2.79Å; H544-T546 PolarHBondContact O-N 3.38Å; T546-E548 PolarHBondContact O-N 2.99Å; T546-E548 VanDerWaalsContact O-N 3.14Å; T546-S592 WeakPolarHBondContact CB-OG 3.2Å; T546-S592 PolarHBondContact OG1-OG 3.4Å; T546-L593 HydrophobicContact CG2-CD2 3.84Å; T546-L593 HydrophobicContact CG2-CG 4.16Å
547	G	86.8	Confident	88.7	Confident	37 Å²	37	54.9 Å²	54.9	38%	0.381	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	13.6	-177.2	0	0	0	0	0	115.4	I543 H544 R549	I543-G547 PolarHBondContact O-N 3.11Å; H544-G547 PolarHBondContact O-N 3.41Å; H544-G547 VanDerWaalsContact O-N 3.14Å; G547-R549 PolarHBondContact O-N 2.95Å
548	E	87.3	Confident	89.1	Confident	36 Å²	36	57.7 Å²	57.7	17%	0.168	30%	0.297	C	S	.	.			trans	-73	105.9	-166	-164.3	-175	-125.4	0	0	112.3	T546 R550 C590 R591 S592	T546-E548 PolarHBondContact O-N 2.99Å; T546-E548 VanDerWaalsContact O-N 3.14Å; E548-R550 VanDerWaalsContact C-N 3.33Å; E548-R550 HydrophobicContact CB-CG 4.36Å; E548-R550 HydrophobicContact CG-CG 3.86Å; E548-R550 PolarHBondContact O-N 3.32Å; E548-R550 WeakPolarHBondContact OE2-CD 3.43Å; E548-R550 VanDerWaalsContact OE2-CG 3.24Å; E548-R550 WeakPolarHBondContact OE2-CG 3.45Å; E548-C590 VanDerWaalsContact OE2-CA 3.23Å; E548-C590 WeakPolarHBondContact OE2-CA 3.39Å; E548-C590 PolarHBondContact OE2-SG 3.41Å; E548-R591 WeakPolarHBondContact OE1-CA 3.36Å; E548-R591 WeakPolarHBondContact OE1-CB 3.42Å; E548-R591 PolarHBondContact OE1-N 3.03Å; E548-S592 PolarHBondContact OE1-N 3.42Å; E548-S592 PolarHBondContact OE2-OG 2.86Å
549	R	90	Very high	89.2	Confident	176 Å²	176	57.1 Å²	57.1	66%	0.664	30%	0.301	S	S	*	.			trans	-77.3	75	-178.7	-71.4	172.7	170.9	113	-5.8	112.1	G547 S559 F560	G547-R549 PolarHBondContact O-N 2.95Å; R549-S559 WeakPolarHBondContact CD-O 3.47Å; R549-F560 CarbonylContact C-O 3.46Å; R549-F560 VanDerWaalsContact CA-O 3.26Å; R549-F560 WeakPolarHBondContact CA-O 3.36Å
550	R	87.8	Confident	89.5	Confident	26 Å²	26	57.6 Å²	57.6	10%	0.098	30%	0.301	C	S	.	.			trans	-76.7	-22.7	-173.5	-64.2	-177.2	62.7	-156.5	-9.3	115.9	E548 F560 L587 H588	E548-R550 VanDerWaalsContact C-N 3.33Å; E548-R550 HydrophobicContact CB-CG 4.36Å; E548-R550 HydrophobicContact CG-CG 3.86Å; E548-R550 PolarHBondContact O-N 3.32Å; E548-R550 WeakPolarHBondContact OE2-CD 3.43Å; E548-R550 VanDerWaalsContact OE2-CG 3.24Å; E548-R550 WeakPolarHBondContact OE2-CG 3.45Å; R550-F560 PolarHBondContact N-O 2.84Å; R550-L587 HydrophobicContact CB-CD1 3.83Å; R550-H588 VanDerWaalsContact CZ-O 3.31Å; R550-H588 PolarHBondContact NE-O 3.23Å; R550-H588 PolarHBondContact NH2-O 3.42Å; R550-H588 PolarHBondContact O-N 3.33Å
551	Y	91.6	Very high	89.5	Confident	26 Å²	26	55.1 Å²	55.1	10%	0.102	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	101.8	-174.4	-74.3	-90.6	0	0	0	111	S559 F560 Y563 M566 Y585 L587 E671	Y551-S559 CarbonylContact O-C 3.53Å; Y551-S559 WeakPolarHBondContact O-CA 3.39Å; Y551-F560 PolarHBondContact N-O 2.71Å; Y551-F560 WeakPolarHBondContact O-CD2 3.37Å; Y551-F560 PolarHBondContact O-N 2.81Å; Y551-Y563 HydrophobicContact CD1-CD2 4.41Å; Y551-Y563 HydrophobicContact CE1-CD2 4.13Å; Y551-M566 HydrophobicContact CD1-SD 4.05Å; Y551-Y585 HydrophobicContact CD1-CD2 4.04Å; Y551-Y585 AromaticContact CD1-CE2 3.94Å; Y551-Y585 HydrophobicContact CD1-CE2 3.94Å; Y551-Y585 HydrophobicContact CE1-CE2 4.07Å; Y551-L587 HydrophobicContact CD1-CD1 4.07Å; Y551-L587 HydrophobicContact CD2-CD1 4.08Å; Y551-L587 HydrophobicContact CE1-CD1 3.85Å; Y551-L587 HydrophobicContact CE1-CD2 4.36Å; Y551-L587 HydrophobicContact CE1-CG 4.5Å; Y551-L587 HydrophobicContact CE2-CD1 3.9Å; Y551-L587 HydrophobicContact CG-CD1 4.16Å; Y551-E671 PolarHBondContact OH-OE2 3.13Å
552	Q	92.2	Very high	89.5	Confident	53 Å²	53	55.9 Å²	55.9	25%	0.248	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	122.9	-178.7	-174.5	169.5	33.8	0	0	112.1	G557 Y585 R586 H588	Q552-G557 WeakPolarHBondContact CG-O 3.34Å; Q552-G557 PolarHBondContact NE2-O 3.18Å; Q552-Y585 CarbonylContact O-C 3.6Å; Q552-Y585 WeakPolarHBondContact O-CA 3.16Å; Q552-Y585 WeakPolarHBondContact O-CB 3.42Å; Q552-R586 PolarHBondContact N-O 3.2Å; Q552-R586 PolarHBondContact O-N 3.44Å; Q552-H588 PolarHBondContact OE1-NE2 2.93Å
553	C	93.9	Very high	89.6	Confident	1 Å²	1	58 Å²	58	1%	0.007	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	129.3	167.5	176.8	0	0	0	0	110.1	G557 K558 F560 H569 I570	C553-G557 WeakPolarHBondContact O-CA 3.44Å; C553-G557 PolarHBondContact O-N 2.77Å; C553-K558 PolarHBondContact N-O 2.74Å; C553-F560 HydrophobicContact CB-CE2 4.19Å; C553-H569 PolarHBondContact SG-NE2 2.82Å; C553-H569 VanDerWaalsContact SG-NE2 3.4Å; C553-I570 HydrophobicContact CB-CD1 4.4Å; C553-I570 HydrophobicContact CB-CG1 4.38Å
554	L	92.3	Very high	89.7	Confident	95 Å²	95	61.7 Å²	61.7	50%	0.497	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-15.9	-179	-69.4	172.2	0	0	0	113.4	K583 L584 R586	L554-K583 WeakPolarHBondContact CD1-O 3.41Å; L554-L584 PolarHBondContact N-O 3.18Å; L554-R586 HydrophobicContact CD1-CB 4.35Å; L554-R586 HydrophobicContact CD2-CB 4.06Å; L554-R586 HydrophobicContact CG-CB 4.32Å
555	A	88.7	Confident	89.9	Confident	60 Å²	60	61.4 Å²	61.4	50%	0.496	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-33.1	177.2	0	0	0	0	0	113.4
556	C	91.3	Very high	90.2	Very high	56 Å²	56	57.4 Å²	57.4	38%	0.378	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.4	2.7	179.4	69.2	0	0	0	0	115.3	K558 H569 H574	C556-K558 PolarHBondContact O-N 3.18Å; C556-K558 VanDerWaalsContact O-N 3.11Å; C556-H569 VanDerWaalsContact SG-CE1 3.54Å; C556-H569 PolarHBondContact SG-NE2 3.22Å; C556-H574 PolarHBondContact SG-NE2 3.31Å; C556-H574 VanDerWaalsContact SG-NE2 3.36Å
557	G	89.9	Confident	90.5	Very high	35 Å²	35	56.1 Å²	56.1	36%	0.361	29%	0.293	S	S	.	.			trans	74.2	-7.9	178.1	0	0	0	0	0	116.1	Q552 C553	Q552-G557 WeakPolarHBondContact CG-O 3.34Å; Q552-G557 PolarHBondContact NE2-O 3.18Å; C553-G557 WeakPolarHBondContact O-CA 3.44Å; C553-G557 PolarHBondContact O-N 2.77Å
558	K	91.8	Very high	90.7	Very high	128 Å²	128	58.1 Å²	58.1	56%	0.557	30%	0.301	S	S	*	.			trans	-61	140.4	178.9	-70.8	-175.1	176.3	-173.8	0	111.5	C553 C556 F560	C553-K558 PolarHBondContact N-O 2.74Å; C556-K558 PolarHBondContact O-N 3.18Å; C556-K558 VanDerWaalsContact O-N 3.11Å; K558-F560 HydrophobicContact CB-CE2 3.78Å; K558-F560 HydrophobicContact CB-CZ 3.78Å; K558-F560 WeakPolarHBondContact O-CE2 3.48Å
559	S	93	Very high	91	Very high	43 Å²	43	57.1 Å²	57.1	30%	0.301	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	138.5	-176.2	-62.4	0	0	0	0	112.7	R549 Y551	R549-S559 WeakPolarHBondContact CD-O 3.47Å; Y551-S559 CarbonylContact O-C 3.53Å; Y551-S559 WeakPolarHBondContact O-CA 3.39Å
560	F	91.3	Very high	91	Very high	39 Å²	39	48.8 Å²	48.8	17%	0.171	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	156	-170.5	-56.9	-86.5	0	0	0	111.6	R549 R550 Y551 C553 K558 F565 M566 H569	R549-F560 CarbonylContact C-O 3.46Å; R549-F560 VanDerWaalsContact CA-O 3.26Å; R549-F560 WeakPolarHBondContact CA-O 3.36Å; R550-F560 PolarHBondContact N-O 2.84Å; Y551-F560 PolarHBondContact N-O 2.71Å; Y551-F560 WeakPolarHBondContact O-CD2 3.37Å; Y551-F560 PolarHBondContact O-N 2.81Å; C553-F560 HydrophobicContact CB-CE2 4.19Å; K558-F560 HydrophobicContact CB-CE2 3.78Å; K558-F560 HydrophobicContact CB-CZ 3.78Å; K558-F560 WeakPolarHBondContact O-CE2 3.48Å; F560-F565 HydrophobicContact CB-CB 4.26Å; F560-F565 HydrophobicContact CD1-CB 3.98Å; F560-F565 HydrophobicContact CG-CB 4.44Å; F560-M566 HydrophobicContact CB-CB 4.01Å; F560-M566 HydrophobicContact CD2-CB 3.89Å; F560-M566 HydrophobicContact CD2-CG 4.15Å; F560-M566 HydrophobicContact CG-CB 4.07Å; F560-H569 HydrophobicContact CE1-CB 3.92Å; F560-H569 HydrophobicContact CE2-CB 4.17Å; F560-H569 AromaticContact CE2-CD2 3.27Å; F560-H569 WeakPolarHBondContact CE2-CD2 3.35Å; F560-H569 AromaticContact CE2-CG 3.79Å; F560-H569 HydrophobicContact CZ-CB 3.6Å; F560-H569 AromaticContact CZ-CD2 3.26Å; F560-H569 WeakPolarHBondContact CZ-CD2 3.47Å; F560-H569 AromaticContact CZ-CG 3.29Å; F560-H569 AromaticContact CZ-NE2 3.96Å
561	I	87.4	Confident	91.2	Very high	36 Å²	36	52.1 Å²	52.1	19%	0.185	28%	0.281	C	S	.	.	S	Bend	trans	-81.5	-25.9	-173.8	-163	163.4	0	0	0	113.7	I543 F565	I543-I561 HydrophobicContact CG2-CG1 3.98Å; I561-F565 HydrophobicContact CG2-CD2 3.84Å; I561-F565 HydrophobicContact CG2-CE2 4.06Å
562	N	88.9	Confident	91.4	Very high	49 Å²	49	54.7 Å²	54.7	26%	0.262	30%	0.302	S	S	.	.	S	Bend	trans	-140.3	173.3	176.9	67.8	23	0	0	0	111.1	Q564 F565	N562-Q564 VanDerWaalsContact C-N 3.34Å; N562-Q564 PolarHBondContact OD1-N 2.86Å; N562-Q564 VanDerWaalsContact OD1-N 3.13Å; N562-F565 WeakPolarHBondContact ND2-CD2 3.3Å; N562-F565 WeakPolarHBondContact OD1-CD2 3.44Å; N562-F565 PolarHBondContact OD1-N 3.29Å
563	Y	89.5	Confident	91.4	Very high	46 Å²	46	56.3 Å²	56.3	18%	0.18	32%	0.316	C	S	.	.	H	α-helix	trans	-68.2	-32.8	177.2	179	-101.9	0	0	0	112.4	Y551 M566 S567 Y585	Y551-Y563 HydrophobicContact CD1-CD2 4.41Å; Y551-Y563 HydrophobicContact CE1-CD2 4.13Å; Y563-M566 HydrophobicContact CD2-CE 3.5Å; Y563-M566 VanDerWaalsContact CD2-CE 3.5Å; Y563-M566 HydrophobicContact CD2-SD 4.09Å; Y563-M566 HydrophobicContact CE2-CE 3.36Å; Y563-M566 HydrophobicContact CE2-SD 4.35Å; Y563-M566 HydrophobicContact CG-CE 4.36Å; Y563-M566 PolarHBondContact O-N 2.81Å; Y563-S567 WeakPolarHBondContact O-CB 3.37Å; Y563-S567 PolarHBondContact O-N 2.83Å; Y563-Y585 HydrophobicContact CD2-CE2 4.49Å; Y563-Y585 AromaticContact CE2-CE1 3.94Å; Y563-Y585 HydrophobicContact CE2-CE1 3.94Å; Y563-Y585 AromaticContact CE2-CZ 3.88Å
564	Q	89.4	Confident	91.2	Very high	93 Å²	93	58.4 Å²	58.4	44%	0.435	33%	0.325	S	S	.	.	H	α-helix	trans	-62.8	-51.3	-175.6	-69.2	72	13.9	0	0	111.9	N562 M566 S567 S568	N562-Q564 VanDerWaalsContact C-N 3.34Å; N562-Q564 PolarHBondContact OD1-N 2.86Å; N562-Q564 VanDerWaalsContact OD1-N 3.13Å; Q564-M566 PolarHBondContact O-N 3.26Å; Q564-S567 PolarHBondContact O-N 3.47Å; Q564-S568 PolarHBondContact O-N 3.23Å
565	F	91.1	Very high	91.1	Very high	127 Å²	127	59 Å²	59	56%	0.557	34%	0.338	S	S	*	.	H	α-helix	trans	-63.8	-40.9	176.3	-68.9	-59.7	0	0	0	112	F560 I561 N562 S567 H569	F560-F565 HydrophobicContact CB-CB 4.26Å; F560-F565 HydrophobicContact CD1-CB 3.98Å; F560-F565 HydrophobicContact CG-CB 4.44Å; I561-F565 HydrophobicContact CG2-CD2 3.84Å; I561-F565 HydrophobicContact CG2-CE2 4.06Å; N562-F565 WeakPolarHBondContact ND2-CD2 3.3Å; N562-F565 WeakPolarHBondContact OD1-CD2 3.44Å; N562-F565 PolarHBondContact OD1-N 3.29Å; F565-S567 VanDerWaalsContact C-N 3.32Å; F565-S567 PolarHBondContact O-N 3.5Å; F565-H569 VanDerWaalsContact O-CB 3.26Å; F565-H569 WeakPolarHBondContact O-CB 3.3Å; F565-H569 PolarHBondContact O-N 3.27Å
566	M	93.6	Very high	91	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61.8	-39.8	174.7	-180	-129.5	69.7	0	0	111.9	Y551 F560 Y563 Q564 H569 I570 P578 Y585	Y551-M566 HydrophobicContact CD1-SD 4.05Å; F560-M566 HydrophobicContact CB-CB 4.01Å; F560-M566 HydrophobicContact CD2-CB 3.89Å; F560-M566 HydrophobicContact CD2-CG 4.15Å; F560-M566 HydrophobicContact CG-CB 4.07Å; Y563-M566 HydrophobicContact CD2-CE 3.5Å; Y563-M566 VanDerWaalsContact CD2-CE 3.5Å; Y563-M566 HydrophobicContact CD2-SD 4.09Å; Y563-M566 HydrophobicContact CE2-CE 3.36Å; Y563-M566 HydrophobicContact CE2-SD 4.35Å; Y563-M566 HydrophobicContact CG-CE 4.36Å; Y563-M566 PolarHBondContact O-N 2.81Å; Q564-M566 PolarHBondContact O-N 3.26Å; M566-H569 PolarHBondContact O-N 3.21Å; M566-I570 HydrophobicContact CE-CD1 4.07Å; M566-I570 HydrophobicContact CG-CD1 4Å; M566-I570 WeakPolarHBondContact O-CG1 3.5Å; M566-I570 PolarHBondContact O-N 3.06Å; M566-I570 HydrophobicContact SD-CD1 4.2Å; M566-P578 HydrophobicContact CE-CB 3.81Å; M566-P578 HydrophobicContact CE-CG 3.68Å; M566-Y585 HydrophobicContact CE-CD1 4.01Å; M566-Y585 HydrophobicContact CE-CE1 4.34Å; M566-Y585 HydrophobicContact CE-CG 4.18Å; M566-Y585 WeakPolarHBondContact SD-CB 3.34Å; M566-Y585 HydrophobicContact SD-CD1 3.69Å; M566-Y585 HydrophobicContact SD-CD2 3.46Å; M566-Y585 WeakPolarHBondContact SD-CD2 3.2Å; M566-Y585 HydrophobicContact SD-CE1 4.29Å; M566-Y585 HydrophobicContact SD-CE2 4.08Å; M566-Y585 HydrophobicContact SD-CG 3.23Å
567	S	92.1	Very high	90.8	Very high	16 Å²	16	61.3 Å²	61.3	11%	0.112	34%	0.335	C	S	.	.	H	α-helix	trans	-72.2	-45.3	-178.6	-170.4	0	0	0	0	111.6	Y563 Q564 F565 H569 I570 K571	Y563-S567 WeakPolarHBondContact O-CB 3.37Å; Y563-S567 PolarHBondContact O-N 2.83Å; Q564-S567 PolarHBondContact O-N 3.47Å; F565-S567 VanDerWaalsContact C-N 3.32Å; F565-S567 PolarHBondContact O-N 3.5Å; S567-H569 VanDerWaalsContact C-N 3.32Å; S567-H569 PolarHBondContact O-N 2.92Å; S567-I570 PolarHBondContact O-N 3.25Å; S567-K571 WeakPolarHBondContact O-CB 3.42Å; S567-K571 VanDerWaalsContact O-CG 3.3Å; S567-K571 WeakPolarHBondContact O-CG 3.36Å; S567-K571 PolarHBondContact O-N 3.5Å
568	S	92.6	Very high	90.5	Very high	79 Å²	79	60 Å²	60	55%	0.552	32%	0.32	S	S	*	.	H	α-helix	trans	-55.9	-46.4	170.6	-178.2	0	0	0	0	111.5	Q564 K571 S572	Q564-S568 PolarHBondContact O-N 3.23Å; S568-K571 PolarHBondContact O-N 3.13Å; S568-S572 WeakPolarHBondContact O-CB 3.42Å; S568-S572 PolarHBondContact O-N 2.88Å; S568-S572 PolarHBondContact O-OG 3.03Å
569	H	92.3	Very high	90.1	Very high	15 Å²	15	58.3 Å²	58.3	7%	0.069	32%	0.324	C	S	.	.	H	α-helix	trans	-60.3	-47.8	176.7	163.2	57.3	0	0	0	113.6	C553 C556 F560 F565 M566 S567 K571 S572 V573 H574	C553-H569 PolarHBondContact SG-NE2 2.82Å; C553-H569 VanDerWaalsContact SG-NE2 3.4Å; C556-H569 VanDerWaalsContact SG-CE1 3.54Å; C556-H569 PolarHBondContact SG-NE2 3.22Å; F560-H569 HydrophobicContact CE1-CB 3.92Å; F560-H569 HydrophobicContact CE2-CB 4.17Å; F560-H569 AromaticContact CE2-CD2 3.27Å; F560-H569 WeakPolarHBondContact CE2-CD2 3.35Å; F560-H569 AromaticContact CE2-CG 3.79Å; F560-H569 HydrophobicContact CZ-CB 3.6Å; F560-H569 AromaticContact CZ-CD2 3.26Å; F560-H569 WeakPolarHBondContact CZ-CD2 3.47Å; F560-H569 AromaticContact CZ-CG 3.29Å; F560-H569 AromaticContact CZ-NE2 3.96Å; F565-H569 VanDerWaalsContact O-CB 3.26Å; F565-H569 WeakPolarHBondContact O-CB 3.3Å; F565-H569 PolarHBondContact O-N 3.27Å; M566-H569 PolarHBondContact O-N 3.21Å; S567-H569 VanDerWaalsContact C-N 3.32Å; S567-H569 PolarHBondContact O-N 2.92Å; H569-K571 VanDerWaalsContact C-N 3.32Å; H569-K571 PolarHBondContact O-N 3.01Å; H569-S572 PolarHBondContact O-N 3.34Å; H569-S572 PolarHBondContact O-OG 3.41Å; H569-V573 WeakPolarHBondContact ND1-CG2 3.38Å; H569-V573 WeakPolarHBondContact O-CB 3.41Å; H569-V573 PolarHBondContact O-N 3.19Å; H569-H574 AromaticContact CE1-CD2 3.91Å; H569-H574 AromaticContact CE1-NE2 3.55Å; H569-H574 AromaticContact NE2-CD2 3.73Å; H569-H574 AromaticContact NE2-NE2 3.46Å; H569-H574 PolarHBondContact NE2-NE2 2.8Å
570	I	90.6	Very high	89.4	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-68.3	-35	-178.6	-66.5	171.5	0	0	0	110.8	C553 M566 S567 H574 S575 Q576 P578 L584	C553-I570 HydrophobicContact CB-CD1 4.4Å; C553-I570 HydrophobicContact CB-CG1 4.38Å; M566-I570 HydrophobicContact CE-CD1 4.07Å; M566-I570 HydrophobicContact CG-CD1 4Å; M566-I570 WeakPolarHBondContact O-CG1 3.5Å; M566-I570 PolarHBondContact O-N 3.06Å; M566-I570 HydrophobicContact SD-CD1 4.2Å; S567-I570 PolarHBondContact O-N 3.25Å; I570-H574 HydrophobicContact CG2-CB 4.46Å; I570-H574 CarbonylContact O-C 3.52Å; I570-H574 WeakPolarHBondContact O-CA 3.44Å; I570-H574 WeakPolarHBondContact O-CB 3.31Å; I570-H574 PolarHBondContact O-N 3.17Å; I570-S575 PolarHBondContact O-N 2.65Å; I570-Q576 CarbonylContact C-O 3.53Å; I570-Q576 HydrophobicContact CG2-CB 4.06Å; I570-Q576 PolarHBondContact O-N 3.15Å; I570-P578 HydrophobicContact CB-CG 4.16Å; I570-P578 HydrophobicContact CD1-CB 3.96Å; I570-P578 HydrophobicContact CD1-CG 4.29Å; I570-P578 HydrophobicContact CG2-CB 4.28Å; I570-P578 HydrophobicContact CG2-CG 4.23Å; I570-L584 HydrophobicContact CD1-CB 4.14Å; I570-L584 HydrophobicContact CG2-CB 4.26Å; I570-L584 HydrophobicContact CG2-CD1 3.76Å
571	K	92.8	Very high	88.4	Confident	97 Å²	97	64.7 Å²	64.7	42%	0.422	37%	0.367	S	S	.	.	H	α-helix	trans	-69.8	-40.6	175.6	-69.6	-179.2	-175.8	-143.7	0	112.9	S567 S568 H569 S575 Q576 D577	S567-K571 WeakPolarHBondContact O-CB 3.42Å; S567-K571 VanDerWaalsContact O-CG 3.3Å; S567-K571 WeakPolarHBondContact O-CG 3.36Å; S567-K571 PolarHBondContact O-N 3.5Å; S568-K571 PolarHBondContact O-N 3.13Å; H569-K571 VanDerWaalsContact C-N 3.32Å; H569-K571 PolarHBondContact O-N 3.01Å; K571-S575 WeakPolarHBondContact O-CA 3.4Å; K571-S575 PolarHBondContact O-N 2.9Å; K571-Q576 WeakPolarHBondContact CA-O 3.4Å; K571-Q576 VanDerWaalsContact CG-O 3.3Å; K571-Q576 WeakPolarHBondContact CG-O 3.21Å; K571-Q576 PolarHBondContact N-O 3.28Å; K571-D577 WeakPolarHBondContact CE-OD1 3.33Å; K571-D577 WeakPolarHBondContact CE-OD2 3.42Å; K571-D577 IonicContact NZ-OD1 2.81Å; K571-D577 PolarHBondContact NZ-OD1 3.27Å; K571-D577 VanDerWaalsContact NZ-OD1 3.16Å; K571-D577 IonicContact NZ-OD2 2.74Å; K571-D577 PolarHBondContact NZ-OD2 3.19Å
572	S	93.8	Very high	88	Confident	79 Å²	79	66.5 Å²	66.5	55%	0.552	38%	0.383	S	S	*	.	H	α-helix	trans	-81.8	-45.4	-178.1	53.1	0	0	0	0	114.1	S568 H569	S568-S572 WeakPolarHBondContact O-CB 3.42Å; S568-S572 PolarHBondContact O-N 2.88Å; S568-S572 PolarHBondContact O-OG 3.03Å; H569-S572 PolarHBondContact O-N 3.34Å; H569-S572 PolarHBondContact O-OG 3.41Å
573	V	93.1	Very high	87.8	Confident	87 Å²	87	73.1 Å²	73.1	53%	0.527	41%	0.409	S	S	.	.	H	α-helix	trans	-93.5	-25.5	-171.9	-176.1	0	0	0	0	112.7	H569	H569-V573 WeakPolarHBondContact ND1-CG2 3.38Å; H569-V573 WeakPolarHBondContact O-CB 3.41Å; H569-V573 PolarHBondContact O-N 3.19Å
574	H	88.9	Confident	87.7	Confident	45 Å²	45	72 Å²	72	21%	0.208	41%	0.407	C	S	.	.	S	Bend	trans	-117	-1.3	-178.5	-59.3	-49.2	0	0	0	113.8	C556 H569 I570 Q576	C556-H574 PolarHBondContact SG-NE2 3.31Å; C556-H574 VanDerWaalsContact SG-NE2 3.36Å; H569-H574 AromaticContact CE1-CD2 3.91Å; H569-H574 AromaticContact CE1-NE2 3.55Å; H569-H574 AromaticContact NE2-CD2 3.73Å; H569-H574 AromaticContact NE2-NE2 3.46Å; H569-H574 PolarHBondContact NE2-NE2 2.8Å; I570-H574 HydrophobicContact CG2-CB 4.46Å; I570-H574 CarbonylContact O-C 3.52Å; I570-H574 WeakPolarHBondContact O-CA 3.44Å; I570-H574 WeakPolarHBondContact O-CB 3.31Å; I570-H574 PolarHBondContact O-N 3.17Å; H574-Q576 VanDerWaalsContact O-CG 3.3Å; H574-Q576 WeakPolarHBondContact O-CG 3.22Å; H574-Q576 PolarHBondContact O-N 2.97Å
575	S	89.9	Confident	87.8	Confident	109 Å²	109	71.3 Å²	71.3	76%	0.762	40%	0.4	S	S	*	.			trans	51.9	36	178.6	-52.9	0	0	0	0	113.6	I570 K571	I570-S575 PolarHBondContact O-N 2.65Å; K571-S575 WeakPolarHBondContact O-CA 3.4Å; K571-S575 PolarHBondContact O-N 2.9Å
576	Q	86.9	Confident	87.8	Confident	90 Å²	90	70.8 Å²	70.8	42%	0.421	40%	0.395	S	S	.	.			trans	-130.8	153.3	-174.8	-75.1	164.8	4	0	0	111.1	I570 K571 H574 L584	I570-Q576 CarbonylContact C-O 3.53Å; I570-Q576 HydrophobicContact CG2-CB 4.06Å; I570-Q576 PolarHBondContact O-N 3.15Å; K571-Q576 WeakPolarHBondContact CA-O 3.4Å; K571-Q576 VanDerWaalsContact CG-O 3.3Å; K571-Q576 WeakPolarHBondContact CG-O 3.21Å; K571-Q576 PolarHBondContact N-O 3.28Å; H574-Q576 VanDerWaalsContact O-CG 3.3Å; H574-Q576 WeakPolarHBondContact O-CG 3.22Å; H574-Q576 PolarHBondContact O-N 2.97Å; Q576-L584 HydrophobicContact CB-CD1 3.5Å; Q576-L584 VanDerWaalsContact CB-CD1 3.5Å; Q576-L584 HydrophobicContact CG-CD1 4.25Å; Q576-L584 VanDerWaalsContact OE1-CD2 3.23Å
577	D	87.2	Confident	87.7	Confident	74 Å²	74	72.7 Å²	72.7	40%	0.396	41%	0.405	S	S	.	.			trans	-98	115.2	172.6	-158	-30.6	0	0	0	111.2	K571 S579 G580	K571-D577 WeakPolarHBondContact CE-OD1 3.33Å; K571-D577 WeakPolarHBondContact CE-OD2 3.42Å; K571-D577 IonicContact NZ-OD1 2.81Å; K571-D577 PolarHBondContact NZ-OD1 3.27Å; K571-D577 VanDerWaalsContact NZ-OD1 3.16Å; K571-D577 IonicContact NZ-OD2 2.74Å; K571-D577 PolarHBondContact NZ-OD2 3.19Å; D577-S579 PolarHBondContact O-N 3.32Å; D577-S579 VanDerWaalsContact OD1-CB 3.25Å; D577-S579 WeakPolarHBondContact OD1-CB 3.48Å; D577-S579 PolarHBondContact OD1-N 3.5Å; D577-G580 PolarHBondContact O-N 3.18Å
578	P	83.8	Confident	87.4	Confident	7 Å²	7	74.9 Å²	74.9	5%	0.045	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-0.7	174.7	30.4	-33.9	0	0	0	114	M566 I570 L584 Y585	M566-P578 HydrophobicContact CE-CB 3.81Å; M566-P578 HydrophobicContact CE-CG 3.68Å; I570-P578 HydrophobicContact CB-CG 4.16Å; I570-P578 HydrophobicContact CD1-CB 3.96Å; I570-P578 HydrophobicContact CD1-CG 4.29Å; I570-P578 HydrophobicContact CG2-CB 4.28Å; I570-P578 HydrophobicContact CG2-CG 4.23Å; P578-L584 HydrophobicContact CB-CB 4.43Å; P578-Y585 HydrophobicContact CB-CD1 4.07Å; P578-Y585 HydrophobicContact CB-CE1 4.4Å
579	S	84.4	Confident	87.1	Confident	93 Å²	93	72.2 Å²	72.2	65%	0.65	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-1.5	171.6	-164.6	0	0	0	0	114.2	D577	D577-S579 PolarHBondContact O-N 3.32Å; D577-S579 VanDerWaalsContact OD1-CB 3.25Å; D577-S579 WeakPolarHBondContact OD1-CB 3.48Å; D577-S579 PolarHBondContact OD1-N 3.5Å
580	G	78.1	Confident	86.5	Confident	44 Å²	44	71.6 Å²	71.6	45%	0.454	39%	0.391	S	S	.	.	S	Bend	trans	-90	-175.3	174.4	0	0	0	0	0	113.7	D577 S582	D577-G580 PolarHBondContact O-N 3.18Å; G580-S582 PolarHBondContact O-N 2.87Å
581	D	70.5	Confident	86.1	Confident	172 Å²	172	81.7 Å²	81.7	92%	0.92	43%	0.429	S	S	*	.	S	Bend	trans	-62.3	-17.2	-178	-55.2	-57.7	0	0	0	114.3	K583	D581-K583 PolarHBondContact O-N 3.42Å
582	S	78.1	Confident	85.4	Confident	73 Å²	73	79.3 Å²	79.3	51%	0.51	43%	0.425	S	S	.	.	S	Bend	trans	-72.5	116.1	177.2	-67.1	0	0	0	0	111.4	G580 L584	G580-S582 PolarHBondContact O-N 2.87Å; S582-L584 WeakPolarHBondContact O-CG 3.47Å; S582-L584 PolarHBondContact O-N 2.93Å
583	K	84.6	Confident	84.6	Confident	188 Å²	188	76.4 Å²	76.4	82%	0.817	40%	0.403	S	S	*	.			trans	-74.6	75.4	173.3	-66.6	178.3	-179.5	176.2	0	110.8	L554 D581 Y585	L554-K583 WeakPolarHBondContact CD1-O 3.41Å; D581-K583 PolarHBondContact O-N 3.42Å; K583-Y585 VanDerWaalsContact C-N 3.35Å
584	L	88.3	Confident	83.9	Confident	24 Å²	24	80.3 Å²	80.3	13%	0.126	42%	0.415	C	S	.	.			trans	-83.8	-7.2	-174.9	-60.3	177.4	0	0	0	114.2	L554 I570 Q576 P578 S582	L554-L584 PolarHBondContact N-O 3.18Å; I570-L584 HydrophobicContact CD1-CB 4.14Å; I570-L584 HydrophobicContact CG2-CB 4.26Å; I570-L584 HydrophobicContact CG2-CD1 3.76Å; Q576-L584 HydrophobicContact CB-CD1 3.5Å; Q576-L584 VanDerWaalsContact CB-CD1 3.5Å; Q576-L584 HydrophobicContact CG-CD1 4.25Å; Q576-L584 VanDerWaalsContact OE1-CD2 3.23Å; P578-L584 HydrophobicContact CB-CB 4.43Å; S582-L584 WeakPolarHBondContact O-CG 3.47Å; S582-L584 PolarHBondContact O-N 2.93Å
585	Y	92	Very high	83.4	Confident	77 Å²	77	80.1 Å²	80.1	30%	0.302	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	163.3	178.8	75.8	-83.4	0	0	0	112.8	Y551 Q552 Y563 M566 P578 K583	Y551-Y585 HydrophobicContact CD1-CD2 4.04Å; Y551-Y585 AromaticContact CD1-CE2 3.94Å; Y551-Y585 HydrophobicContact CD1-CE2 3.94Å; Y551-Y585 HydrophobicContact CE1-CE2 4.07Å; Q552-Y585 CarbonylContact O-C 3.6Å; Q552-Y585 WeakPolarHBondContact O-CA 3.16Å; Q552-Y585 WeakPolarHBondContact O-CB 3.42Å; Y563-Y585 HydrophobicContact CD2-CE2 4.49Å; Y563-Y585 AromaticContact CE2-CE1 3.94Å; Y563-Y585 HydrophobicContact CE2-CE1 3.94Å; Y563-Y585 AromaticContact CE2-CZ 3.88Å; M566-Y585 HydrophobicContact CE-CD1 4.01Å; M566-Y585 HydrophobicContact CE-CE1 4.34Å; M566-Y585 HydrophobicContact CE-CG 4.18Å; M566-Y585 WeakPolarHBondContact SD-CB 3.34Å; M566-Y585 HydrophobicContact SD-CD1 3.69Å; M566-Y585 HydrophobicContact SD-CD2 3.46Å; M566-Y585 WeakPolarHBondContact SD-CD2 3.2Å; M566-Y585 HydrophobicContact SD-CE1 4.29Å; M566-Y585 HydrophobicContact SD-CE2 4.08Å; M566-Y585 HydrophobicContact SD-CG 3.23Å; P578-Y585 HydrophobicContact CB-CD1 4.07Å; P578-Y585 HydrophobicContact CB-CE1 4.4Å; K583-Y585 VanDerWaalsContact C-N 3.35Å
586	R	90.4	Very high	82.7	Confident	117 Å²	117	83.8 Å²	83.8	44%	0.442	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.4	171.8	-177.7	177.2	-176.3	90.1	4.6	109.7	Q552 L554	Q552-R586 PolarHBondContact N-O 3.2Å; Q552-R586 PolarHBondContact O-N 3.44Å; L554-R586 HydrophobicContact CD1-CB 4.35Å; L554-R586 HydrophobicContact CD2-CB 4.06Å; L554-R586 HydrophobicContact CG-CB 4.32Å
587	L	90.4	Very high	81.9	Confident	40 Å²	40	84.9 Å²	84.9	21%	0.209	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	121.9	169.2	-179.9	56.8	0	0	0	109.6	R550 Y551 L601	R550-L587 HydrophobicContact CB-CD1 3.83Å; Y551-L587 HydrophobicContact CD1-CD1 4.07Å; Y551-L587 HydrophobicContact CD2-CD1 4.08Å; Y551-L587 HydrophobicContact CE1-CD1 3.85Å; Y551-L587 HydrophobicContact CE1-CD2 4.36Å; Y551-L587 HydrophobicContact CE1-CG 4.5Å; Y551-L587 HydrophobicContact CE2-CD1 3.9Å; Y551-L587 HydrophobicContact CG-CD1 4.16Å; L587-L601 HydrophobicContact CB-CD2 4.11Å; L587-L601 HydrophobicContact CD2-CD2 4.03Å; L587-L601 HydrophobicContact CG-CD2 3.87Å
588	H	86.4	Confident	80.8	Confident	62 Å²	62	87.1 Å²	87.1	29%	0.287	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-86.1	152.9	175.9	-70.1	-76.3	0	0	0	112	R550 Q552	R550-H588 VanDerWaalsContact CZ-O 3.31Å; R550-H588 PolarHBondContact NE-O 3.23Å; R550-H588 PolarHBondContact NH2-O 3.42Å; R550-H588 PolarHBondContact O-N 3.33Å; Q552-H588 PolarHBondContact OE1-NE2 2.93Å
589	P	85.6	Confident	79.6	Confident	22 Å²	22	91.1 Å²	91.1	14%	0.143	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-54.3	142.7	167.9	-23.6	32.2	0	0	0	111.6	L601	P589-L601 WeakPolarHBondContact CD-O 3.39Å; P589-L601 HydrophobicContact CG-CB 4.01Å; P589-L601 VanDerWaalsContact CG-O 3.23Å; P589-L601 WeakPolarHBondContact CG-O 3.46Å
590	C	81.4	Confident	78.7	Confident	2 Å²	2	94.8 Å²	94.8	1%	0.014	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-71.8	133.9	167.7	-175.5	0	0	0	0	109.6	E548 L593 I595 Q597	E548-C590 VanDerWaalsContact OE2-CA 3.23Å; E548-C590 WeakPolarHBondContact OE2-CA 3.39Å; E548-C590 PolarHBondContact OE2-SG 3.41Å; C590-L593 PolarHBondContact SG-N 3.04Å; C590-L593 VanDerWaalsContact SG-N 3.44Å; C590-I595 HydrophobicContact CB-CD1 3.42Å; C590-I595 VanDerWaalsContact CB-CD1 3.42Å; C590-I595 HydrophobicContact CB-CG1 3.7Å; C590-Q597 PolarHBondContact O-NE2 3.34Å
591	R	81.3	Confident	77.9	Confident	213 Å²	213	93.4 Å²	93.4	80%	0.804	44%	0.438	S	S	*	.			trans	-119.3	-26.8	177.1	-60.1	-179.2	-179.6	-177.1	0.2	111.6	E548 L593	E548-R591 WeakPolarHBondContact OE1-CA 3.36Å; E548-R591 WeakPolarHBondContact OE1-CB 3.42Å; E548-R591 PolarHBondContact OE1-N 3.03Å; R591-L593 VanDerWaalsContact C-N 3.34Å
592	S	77.8	Confident	77.1	Confident	47 Å²	47	87.9 Å²	87.9	33%	0.329	41%	0.413	S	S	.	.	S	Bend	trans	-70.9	-24.3	177.5	66	0	0	0	0	114.2	T546 E548	T546-S592 WeakPolarHBondContact CB-OG 3.2Å; T546-S592 PolarHBondContact OG1-OG 3.4Å; E548-S592 PolarHBondContact OE1-N 3.42Å; E548-S592 PolarHBondContact OE2-OG 2.86Å
593	L	78.3	Confident	75.7	Confident	19 Å²	19	90.3 Å²	90.3	10%	0.099	42%	0.42	C	S	.	.	S	Bend	trans	-128.3	145.8	-177	-58.2	170.1	0	0	0	112.9	Y527 E542 I543 T546 C590 R591 I595	Y527-L593 HydrophobicContact CE2-CD2 3.94Å; Y527-L593 WeakPolarHBondContact OH-CD2 3.48Å; E542-L593 HydrophobicContact CB-CD1 3.58Å; E542-L593 HydrophobicContact CB-CD2 4.04Å; E542-L593 HydrophobicContact CB-CG 4.48Å; I543-L593 HydrophobicContact CG1-CD1 3.7Å; T546-L593 HydrophobicContact CG2-CD2 3.84Å; T546-L593 HydrophobicContact CG2-CG 4.16Å; C590-L593 PolarHBondContact SG-N 3.04Å; C590-L593 VanDerWaalsContact SG-N 3.44Å; R591-L593 VanDerWaalsContact C-N 3.34Å; L593-I595 HydrophobicContact CB-CG2 4.02Å; L593-I595 PolarHBondContact O-N 3.03Å
594	Q	77	Confident	73.3	Confident	168 Å²	168	91 Å²	91	79%	0.785	42%	0.418	S	S	*	.			trans	-74.4	72	171.5	-66.3	168.8	-31	0	0	110.8
595	I	80.1	Confident	71.2	Confident	42 Å²	42	96 Å²	96	22%	0.215	45%	0.454	C	S	.	.			trans	-105.2	156.3	172.4	68.3	168.2	0	0	0	111	T539 C590 L593 Q597	T539-I595 HydrophobicContact CG2-CG2 3.74Å; C590-I595 HydrophobicContact CB-CD1 3.42Å; C590-I595 VanDerWaalsContact CB-CD1 3.42Å; C590-I595 HydrophobicContact CB-CG1 3.7Å; L593-I595 HydrophobicContact CB-CG2 4.02Å; L593-I595 PolarHBondContact O-N 3.03Å; I595-Q597 PolarHBondContact O-N 3.35Å
596	R	74.5	Confident	68.4	Low	185 Å²	185	96.4 Å²	96.4	70%	0.698	47%	0.468	S	S	*	.			trans	-60.4	112.2	174	-175.5	174.3	-177	148.4	0.1	109.5
597	Q	70.8	Confident	65.7	Low	113 Å²	113	97.1 Å²	97.1	53%	0.528	49%	0.486	S	S	.	.			trans	-74.9	129.8	173.7	-66.3	-173.1	-4.6	0	0	109.6	C590 I595	C590-Q597 PolarHBondContact O-NE2 3.34Å; I595-Q597 PolarHBondContact O-N 3.35Å
598	Y	62.1	Low	62.5	Low	122 Å²	122	103.5 Å²	103.5	48%	0.478	52%	0.517	S	S	.	.			trans	-91.8	138.6	175.2	-60.3	-80.5	0	0	0	109.9	Y600 L601	Y598-Y600 VanDerWaalsContact C-N 3.25Å; Y598-Y600 HydrophobicContact CD1-CE1 4.38Å; Y598-Y600 AromaticContact CG-CE1 3.9Å; Y598-Y600 HydrophobicContact CG-CE1 3.9Å; Y598-Y600 PolarHBondContact O-N 3.3Å; Y598-Y600 VanDerWaalsContact O-N 3.16Å; Y598-L601 HydrophobicContact CD2-CD1 4.35Å; Y598-L601 WeakPolarHBondContact O-CB 3.29Å; Y598-L601 PolarHBondContact O-N 2.9Å
599	A	59.7	Low	59.7	Low	91 Å²	91	106.1 Å²	106.1	75%	0.752	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-55.7	-37.6	-172	0	0	0	0	0	113.4	L601 S602	A599-L601 PolarHBondContact O-N 3.05Å; A599-S602 CarbonylContact O-C 3.57Å; A599-S602 PolarHBondContact O-N 2.92Å
600	Y	66.4	Low	56.9	Low	170 Å²	170	109.6 Å²	109.6	67%	0.667	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-66.2	-16	179	66.9	-99.3	0	0	0	114.6	Y598	Y598-Y600 VanDerWaalsContact C-N 3.25Å; Y598-Y600 HydrophobicContact CD1-CE1 4.38Å; Y598-Y600 AromaticContact CG-CE1 3.9Å; Y598-Y600 HydrophobicContact CG-CE1 3.9Å; Y598-Y600 PolarHBondContact O-N 3.3Å; Y598-Y600 VanDerWaalsContact O-N 3.16Å
601	L	59.8	Low	54.3	Low	15 Å²	15	119.2 Å²	119.2	8%	0.079	62%	0.617	C	S	.	*	G	3₁₀ helix	trans	-85.4	-26.2	172.1	-60	176.1	0	0	0	112	L587 P589 Y598 A599	L587-L601 HydrophobicContact CB-CD2 4.11Å; L587-L601 HydrophobicContact CD2-CD2 4.03Å; L587-L601 HydrophobicContact CG-CD2 3.87Å; P589-L601 WeakPolarHBondContact CD-O 3.39Å; P589-L601 HydrophobicContact CG-CB 4.01Å; P589-L601 VanDerWaalsContact CG-O 3.23Å; P589-L601 WeakPolarHBondContact CG-O 3.46Å; Y598-L601 HydrophobicContact CD2-CD1 4.35Å; Y598-L601 WeakPolarHBondContact O-CB 3.29Å; Y598-L601 PolarHBondContact O-N 2.9Å; A599-L601 PolarHBondContact O-N 3.05Å
602	S	54.5	Low	51.9	Low	55 Å²	55	118.9 Å²	118.9	39%	0.385	62%	0.622	S	S	.	*			trans	-109.6	39.5	-169.9	-63.2	0	0	0	0	112.5	A599	A599-S602 CarbonylContact O-C 3.57Å; A599-S602 PolarHBondContact O-N 2.92Å
603	D	47.9	Very low	49.6	Very low	125 Å²	125	119.6 Å²	119.6	67%	0.668	64%	0.637	S	S	*	*			trans	-70.9	152.5	167.4	-160.9	6.8	0	0	0	111.2
604	R	34.7	Very low	47.4	Very low	203 Å²	203	127.2 Å²	127.2	77%	0.766	68%	0.677	S	S	*	*			trans	-70.7	147.4	-158.1	-61.8	162.1	71.8	-170.2	3.7	111.8	S606	R604-S606 VanDerWaalsContact C-N 3.33Å; R604-S606 PolarHBondContact O-N 2.84Å
605	S	44.8	Very low	45	Very low	127 Å²	127	122.6 Å²	122.6	89%	0.888	68%	0.675	S	S	*	*			trans	-64.9	94.9	162.9	54.6	0	0	0	0	109.1
606	S	33	Very low	42.6	Very low	86 Å²	86	129.1 Å²	129.1	60%	0.601	71%	0.708	S	S	*	*			trans	-145.7	98.9	178.7	-71.7	0	0	0	0	109.5	R604 M608	R604-S606 VanDerWaalsContact C-N 3.33Å; R604-S606 PolarHBondContact O-N 2.84Å; S606-M608 PolarHBondContact O-N 3.06Å
607	T	32.7	Very low	40.3	Very low	133 Å²	133	123.7 Å²	123.7	82%	0.816	71%	0.71	S	S	*	*			trans	-11.8	118.5	161.4	-47.1	0	0	0	0	114.8	P609	T607-P609 VanDerWaalsContact O-CD 3.28Å; T607-P609 WeakPolarHBondContact O-CD 3.42Å
608	M	23.8	Very low	38.4	Very low	174 Å²	174	129.7 Å²	129.7	86%	0.857	73%	0.73	S	S	*	*			trans	-54.2	120.2	161.6	-82.5	-70.2	-175.4	0	0	109.2	S606 A610	S606-M608 PolarHBondContact O-N 3.06Å; M608-A610 PolarHBondContact O-N 3.37Å; M608-A610 VanDerWaalsContact O-N 3.08Å
609	P	28.4	Very low	36.6	Very low	117 Å²	117	133.8 Å²	133.8	76%	0.76	75%	0.75	S	S	*	*			trans	-64.9	113.6	176.2	-21.3	34.1	0	0	0	109.1	T607 M611	T607-P609 VanDerWaalsContact O-CD 3.28Å; T607-P609 WeakPolarHBondContact O-CD 3.42Å; P609-M611 PolarHBondContact O-N 3.28Å
610	A	25.7	Very low	35.1	Very low	95 Å²	95	135.5 Å²	135.5	79%	0.785	75%	0.751	S	S	*	*			trans	-62	127.7	173.2	0	0	0	0	0	109.3	M608 K612	M608-A610 PolarHBondContact O-N 3.37Å; M608-A610 VanDerWaalsContact O-N 3.08Å; A610-K612 PolarHBondContact O-N 3.1Å
611	M	27.1	Very low	33.1	Very low	204 Å²	204	133.9 Å²	133.9	100%	1.005	75%	0.754	S	S	*	*			trans	-59.3	110.8	176.8	-87.4	-173.3	163.2	0	0	110.5	P609	P609-M611 PolarHBondContact O-N 3.28Å
612	K	30.2	Very low	31.4	Very low	206 Å²	206	139.1 Å²	139.1	90%	0.896	79%	0.787	S	S	*	*			trans	-133.9	140.5	156.1	-152	174	-174.3	-179.2	0	107.4	A610	A610-K612 PolarHBondContact O-N 3.1Å
613	G	31	Very low	29.9	Very low	62 Å²	62	139.7 Å²	139.7	64%	0.639	80%	0.802	S	S	*	*			trans	-79.8	-175.1	-160.5	0	0	0	0	0	116.6
614	D	30.2	Very low	28.9	Very low	178 Å²	178	144.2 Å²	144.2	95%	0.952	82%	0.815	S	S	*	*			trans	76	138	164.2	-49.3	-36	0	0	0	118.7
615	G	27.5	Very low	28.3	Very low	72 Å²	72	143 Å²	143	74%	0.742	82%	0.818	S	S	*	*			trans	117.9	64.2	148.2	0	0	0	0	0	120.1
616	I	30.3	Very low	28.1	Very low	178 Å²	178	141.8 Å²	141.8	91%	0.913	81%	0.807	S	S	*	*			trans	14.4	129.2	137.3	-57	155.5	0	0	0	118.2
617	G	25.4	Very low	28.1	Very low	72 Å²	72	143.8 Å²	143.8	74%	0.742	82%	0.818	S	S	*	*			trans	169.3	103.1	154.6	0	0	0	0	0	117.4
618	Y	31	Very low	27.8	Very low	238 Å²	238	144.6 Å²	144.6	93%	0.933	82%	0.822	S	S	*	*			trans	-92.8	146.5	166.6	-62.7	-90.5	0	0	0	111.3
619	K	25.3	Very low	27.7	Very low	208 Å²	208	139.3 Å²	139.3	90%	0.904	81%	0.813	S	S	*	*			trans	-155.2	139	143.7	-128.2	-177.2	-179.5	-170.8	0	114.6
620	V	27.8	Very low	27.5	Very low	127 Å²	127	140.5 Å²	140.5	77%	0.77	82%	0.818	S	S	*	*			trans	-110.6	147.2	167.8	166	0	0	0	0	106.7
621	D	24.4	Very low	27.5	Very low	136 Å²	136	143.1 Å²	143.1	73%	0.727	83%	0.825	S	S	*	*				178.1	157.8	120	-127.9	-34	0	0	0	116.1
622	T	23.8	Very low	27.3	Very low	125 Å²	125	139.7 Å²	139.7	77%	0.767	82%	0.815	S	S	*	*			trans	41.6	138.8	158.1	58.3	0	0	0	0	121.4
623	G	23.4	Very low	27.1	Very low	68 Å²	68	135.4 Å²	135.4	70%	0.701	81%	0.811	S	S	*	*			cis	119.3	122.7	-2	0	0	0	0	0	114.5
624	K	26.9	Very low	26.9	Very low	219 Å²	219	138.9 Å²	138.9	95%	0.952	82%	0.82	S	S	*	*			trans	-177.2	144.4	154.5	-108.7	167.5	-175.5	178.4	0	114.3
625	E	21.5	Very low	26.8	Very low	179 Å²	179	138.9 Å²	138.9	84%	0.836	81%	0.814	S	S	*	*			trans	-104.1	-173	171.2	-81.7	-157.7	144.4	0	0	111.3
626	P	41.3	Very low	26.9	Very low	101 Å²	101	143.5 Å²	143.5	66%	0.656	82%	0.822	S	S	*	*			cis	-123.8	-154.4	-49.6	35.7	-17.1	0	0	0	109.4
627	P	31.9	Very low	26.8	Very low	127 Å²	127	144.2 Å²	144.2	83%	0.825	82%	0.819	S	S	*	*				-145.8	-177.2	69.8	37	-14.7	0	0	0	116.1
628	V	26.3	Very low	27.2	Very low	150 Å²	150	146 Å²	146	91%	0.909	82%	0.817	S	S	*	*			trans	-90.2	149	-170.8	174.7	0	0	0	0	113.7
629	G	23.5	Very low	27.1	Very low	63 Å²	63	142.2 Å²	142.2	65%	0.649	81%	0.81	S	S	*	*			trans	-179.1	92.7	164.6	0	0	0	0	0	117.7
630	T	23.6	Very low	27.3	Very low	143 Å²	143	136.7 Å²	136.7	88%	0.877	79%	0.794	S	S	*	*			trans	47	110.9	158.9	38.3	0	0	0	0	120.1
631	T	25.1	Very low	27.5	Very low	150 Å²	150	138.9 Å²	138.9	92%	0.92	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-103	128	163.9	44.2	0	0	0	0	111.9
632	T	24	Very low	28	Very low	132 Å²	132	136.6 Å²	136.6	81%	0.81	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-96.3	136	165.5	48.4	0	0	0	0	110.4	T634	T632-T634 PolarHBondContact O-N 2.98Å
633	S	25.5	Very low	28.7	Very low	115 Å²	115	134.2 Å²	134.2	80%	0.804	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-62.4	129	-178.3	152.7	0	0	0	0	113.5
634	T	27.3	Very low	29.5	Very low	136 Å²	136	135.3 Å²	135.3	83%	0.834	75%	0.745	S	S	*	*			trans	-129.1	137.6	157.8	-51.7	0	0	0	0	108.5	T632	T632-T634 PolarHBondContact O-N 2.98Å
635	Q	26.8	Very low	30	Very low	177 Å²	177	132.3 Å²	132.3	83%	0.827	73%	0.732	S	S	*	*			trans	-80.7	143.9	-165.8	-67.1	178.4	-20.8	0	0	114
636	N	29.3	Very low	30.5	Very low	169 Å²	169	130 Å²	130	90%	0.904	72%	0.724	S	S	*	*			trans	-63	131.6	164.7	-75.2	-33.5	0	0	0	110.5
637	K	29.6	Very low	30.1	Very low	194 Å²	194	134 Å²	134	84%	0.843	73%	0.734	S	S	*	*			trans	-114	119.6	168.5	-168.9	176.9	-176.8	-178.1	0	108.3
638	P	32.9	Very low	30	Very low	110 Å²	110	135.6 Å²	135.6	71%	0.714	73%	0.73	S	S	*	*			trans	-69.3	145.3	-176.6	27.8	-34.3	0	0	0	111.7
639	M	29	Very low	29.9	Very low	158 Å²	158	136.9 Å²	136.9	78%	0.778	73%	0.726	S	S	*	*			trans	-59	147.5	176.6	-149.6	76.5	177	0	0	111.2	D643	M639-D643 HydrophobicContact CE-CB 3.91Å
640	T	29.9	Very low	30.5	Very low	91 Å²	91	141.6 Å²	141.6	56%	0.558	74%	0.736	S	S	*	*			trans	-115.2	159.1	-172	-0.1	0	0	0	0	112.7	E642 D643	T640-E642 PolarHBondContact O-N 3.07Å; T640-D643 PolarHBondContact O-N 2.89Å; T640-D643 VanDerWaalsContact O-OD2 3.06Å
641	W	32.6	Very low	30.7	Very low	173 Å²	173	141.7 Å²	141.7	66%	0.655	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	17.2	-178.2	-78.3	63.7	0	0	0	114.9
642	E	34.3	Very low	31	Very low	89 Å²	89	138.9 Å²	138.9	42%	0.416	72%	0.718	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.6	-49.4	164.2	-61.4	-64.3	0.3	0	0	110.5	R476 T640 I644 F645	R476-E642 WeakPolarHBondContact CD-OE2 3.24Å; R476-E642 IonicContact CZ-OE1 3.85Å; R476-E642 IonicContact CZ-OE2 2.9Å; R476-E642 IonicContact NE-OE1 2.74Å; R476-E642 IonicContact NE-OE2 3.18Å; R476-E642 PolarHBondContact NE-OE2 3.1Å; R476-E642 VanDerWaalsContact NE-OE2 3.1Å; R476-E642 IonicContact NH1-OE1 2.67Å; R476-E642 PolarHBondContact NH1-OE1 3.36Å; R476-E642 IonicContact NH1-OE2 2.95Å; R476-E642 PolarHBondContact NH1-OE2 3.28Å; R476-E642 IonicContact NH2-OE1 3.63Å; R476-E642 PolarHBondContact NH2-OE1 3.19Å; R476-E642 IonicContact NH2-OE2 2.71Å; T640-E642 PolarHBondContact O-N 3.07Å; E642-I644 PolarHBondContact O-N 3.17Å; E642-F645 PolarHBondContact O-N 3.22Å; E642-F645 VanDerWaalsContact O-N 3.12Å
643	D	38.9	Very low	31.2	Very low	74 Å²	74	139.5 Å²	139.5	40%	0.396	72%	0.715	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.6	-1.6	-156.9	-50.7	-62.6	0	0	0	113.9	M639 T640	M639-D643 HydrophobicContact CE-CB 3.91Å; T640-D643 PolarHBondContact O-N 2.89Å; T640-D643 VanDerWaalsContact O-OD2 3.06Å
644	I	39.2	Very low	31.2	Very low	92 Å²	92	143.1 Å²	143.1	47%	0.472	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.2	-21.7	178.8	-61.4	175	0	0	0	111.4	E642	E642-I644 PolarHBondContact O-N 3.17Å
645	F	36.9	Very low	31.2	Very low	156 Å²	156	144.8 Å²	144.8	68%	0.684	71%	0.712	S	S	*	*			trans	-127.8	55.9	-175.9	-64.6	-73.3	0	0	0	112.5	E642 Q647	E642-F645 PolarHBondContact O-N 3.22Å; E642-F645 VanDerWaalsContact O-N 3.12Å; F645-Q647 PolarHBondContact O-N 2.99Å; F645-Q647 VanDerWaalsContact O-N 3.14Å
646	I	32.8	Very low	31.2	Very low	129 Å²	129	144 Å²	144	66%	0.662	71%	0.708	S	S	*	*			trans	-66.2	112.6	170.7	-60.4	176.9	0	0	0	109.3	Q648	I646-Q648 HydrophobicContact CG2-CB 4.11Å; I646-Q648 PolarHBondContact O-N 3.37Å
647	Q	32.4	Very low	31	Very low	187 Å²	187	143.2 Å²	143.2	87%	0.874	70%	0.704	S	S	*	*			trans	-82	89.6	165.6	-175.2	169.5	-9.5	0	0	107.6	F645 E649	F645-Q647 PolarHBondContact O-N 2.99Å; F645-Q647 VanDerWaalsContact O-N 3.14Å; Q647-E649 PolarHBondContact O-N 3.06Å; Q647-E649 VanDerWaalsContact O-N 3.17Å
648	Q	30.7	Very low	31	Very low	159 Å²	159	140.2 Å²	140.2	74%	0.743	70%	0.702	S	S	*	*			trans	-78.2	103.2	-169.6	-169.5	167.9	11.1	0	0	111.9	I646	I646-Q648 HydrophobicContact CG2-CB 4.11Å; I646-Q648 PolarHBondContact O-N 3.37Å
649	E	24.5	Very low	30.8	Very low	177 Å²	177	141.5 Å²	141.5	83%	0.827	71%	0.708	S	S	*	*			trans	-69.9	159.3	155.5	-63.6	-169.8	138.4	0	0	110.1	Q647 D651	Q647-E649 PolarHBondContact O-N 3.06Å; Q647-E649 VanDerWaalsContact O-N 3.17Å; E649-D651 PolarHBondContact O-N 3.11Å
650	N	34.8	Very low	30.8	Very low	162 Å²	162	142 Å²	142	87%	0.866	71%	0.714	S	S	*	*			trans	-65.9	127.6	-175.4	-65.3	-40	0	0	0	111.6
651	D	28	Very low	30.6	Very low	146 Å²	146	141.1 Å²	141.1	78%	0.781	72%	0.724	S	S	*	*				-159.4	175.8	122.9	-127.2	-36.9	0	0	0	113.4	E649	E649-D651 PolarHBondContact O-N 3.11Å
652	S	31.7	Very low	30.4	Very low	91 Å²	91	138 Å²	138	64%	0.636	73%	0.728	S	S	*	*			trans	-113.3	162.8	-156.7	-51.2	0	0	0	0	116.2
653	I	28.5	Very low	30	Very low	145 Å²	145	139.7 Å²	139.7	74%	0.744	75%	0.745	S	S	*	*			trans	72.5	104.3	154.6	-61.6	151.3	0	0	0	118.3
654	F	25.7	Very low	29.5	Very low	191 Å²	191	143.7 Å²	143.7	84%	0.838	76%	0.761	S	S	*	*				-172	-166.3	105.7	-117.7	-63.8	0	0	0	113.1
655	K	27	Very low	28.8	Very low	170 Å²	170	148.3 Å²	148.3	74%	0.739	78%	0.778	S	S	*	*			trans	-114.4	141.3	-158.2	-69.7	-179	176.6	-178.7	0	115.1
656	Q	27.1	Very low	28.3	Very low	160 Å²	160	148.4 Å²	148.4	75%	0.748	78%	0.781	S	S	*	*				47.9	112.2	127.8	-169.4	-176.5	-0.1	0	0	120.2
657	N	25.3	Very low	28	Very low	153 Å²	153	149.5 Å²	149.5	82%	0.818	78%	0.781	S	S	*	*				-166.4	169.9	115.7	-102.2	-30.6	0	0	0	112.5
658	V	30.1	Very low	27.6	Very low	131 Å²	131	147 Å²	147	79%	0.794	77%	0.772	S	S	*	*			trans	-132.1	142.4	-171.9	173.7	0	0	0	0	110.3
659	T	28.2	Very low	27.7	Very low	138 Å²	138	143.7 Å²	143.7	85%	0.847	76%	0.758	S	S	*	*			trans	-154.6	156.6	157.2	25.2	0	0	0	0	110.1
660	D	28.2	Very low	27.9	Very low	167 Å²	167	139.7 Å²	139.7	89%	0.893	75%	0.748	S	S	*	*			trans	-70.9	166.2	-167.3	-59.4	-80.2	0	0	0	116.9
661	G	25.7	Very low	28	Very low	74 Å²	74	135.8 Å²	135.8	76%	0.763	72%	0.724	S	S	*	*			trans	174.4	62.3	175.4	0	0	0	0	0	113.1	T663	G661-T663 PolarHBondContact O-N 2.94Å
662	S	27.7	Very low	28.1	Very low	106 Å²	106	133.5 Å²	133.5	74%	0.741	72%	0.72	S	S	*	*			trans	-76	116.5	-177.2	55.3	0	0	0	0	113.4
663	T	26.6	Very low	27.9	Very low	126 Å²	126	138.9 Å²	138.9	77%	0.773	73%	0.728	S	S	*	*			trans	-138.3	100.8	149.5	56.1	0	0	0	0	107.9	G661	G661-T663 PolarHBondContact O-N 2.94Å
664	E	28.5	Very low	27.9	Very low	158 Å²	158	138.6 Å²	138.6	74%	0.738	73%	0.727	S	S	*	*			trans	-70.2	135.9	179	51.3	-92.7	85.1	0	0	112.7
665	F	24.2	Very low	28	Very low	189 Å²	189	135.8 Å²	135.8	83%	0.829	72%	0.721	S	S	*	*			trans	-136	89.7	156.9	-96.3	-78.2	0	0	0	108.1
666	E	27.3	Very low	28	Very low	158 Å²	158	133.9 Å²	133.9	74%	0.738	72%	0.72	S	S	*	*			trans	-76.2	123	178.5	-175.7	165.8	-145	0	0	110.2	I668	E666-I668 HydrophobicContact CG-CD1 4.35Å; E666-I668 HydrophobicContact CG-CG1 4.17Å; E666-I668 WeakPolarHBondContact OE1-CD1 3.45Å
667	F	25.4	Very low	28.1	Very low	151 Å²	151	132.4 Å²	132.4	66%	0.662	72%	0.718	S	S	*	*			trans	-130.8	83.6	172.1	-95.3	-81.6	0	0	0	109.6
668	I	25.4	Very low	28.3	Very low	134 Å²	134	131.1 Å²	131.1	69%	0.687	71%	0.712	S	S	*	*			trans	-80.9	122.9	164.4	-62.2	173.1	0	0	0	107.4	E666	E666-I668 HydrophobicContact CG-CD1 4.35Å; E666-I668 HydrophobicContact CG-CG1 4.17Å; E666-I668 WeakPolarHBondContact OE1-CD1 3.45Å
669	I	31.3	Very low	28.2	Very low	90 Å²	90	131.1 Å²	131.1	46%	0.462	71%	0.707	S	S	.	*			trans	-109.2	126	166.9	-60.3	177.9	0	0	0	106.5
670	P	30.2	Very low	28.2	Very low	93 Å²	93	130.6 Å²	130.6	60%	0.604	70%	0.697	S	S	*	*			trans	-55.9	143	-178.1	-27.9	35.7	0	0	0	113.7	S672	P670-S672 PolarHBondContact O-N 3.24Å
671	E	35	Very low	28.2	Very low	80 Å²	80	127.8 Å²	127.8	37%	0.374	68%	0.682	S	S	.	*	S	Bend	trans	-77.3	32	-178.6	-61.5	-144.7	98.5	0	0	114.3	K540 Y551 Y673	K540-E671 WeakPolarHBondContact CE-OE1 3.38Å; K540-E671 IonicContact NZ-OE1 3.19Å; K540-E671 PolarHBondContact NZ-OE1 2.94Å; K540-E671 IonicContact NZ-OE2 3.12Å; Y551-E671 PolarHBondContact OH-OE2 3.13Å; E671-Y673 PolarHBondContact O-N 3.39Å
672	S	31.2	Very low	28.4	Very low	98 Å²	98	132.3 Å²	132.3	69%	0.685	68%	0.675	S	S	*	*			trans	-96.5	73.5	176	59.5	0	0	0	0	111	P670	P670-S672 PolarHBondContact O-N 3.24Å
673	Y	27.4	Very low	28.4	Very low	205 Å²	205	134.7 Å²	134.7	80%	0.804	67%	0.669	S	S	*	*			trans	-153.8	0	171.4	-111.2	-56.8	0	0	0	111	E671	E671-Y673 PolarHBondContact O-N 3.39Å

Retrieved 673 of 673 residues in 867.3 ms (Link to these results)

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