A0A087X480_POEFO Loading...

RING-type E3 ubiquitin transferase

E3 ubiquitin-protein ligase component of a retrotranslocation channel required for peroxisome organization by mediating export of the PEX5 receptor from peroxisomes to the cytosol, thereby promoting PEX5 recycling. The retrotranslocation channel is composed of PEX2, PEX10 and PEX12; each subunit contributing transmembrane segments that coassemble into an open channel that specifically allows the passage of PEX5 through the peroxisomal membrane. PEX10 also regulates PEX5 recycling by acting as a E3 ubiquitin-protein ligase. When PEX5 recycling is compromised, PEX10 catalyzes polyubiquitination of PEX5 during its passage through the retrotranslocation channel, leading to its degradation.

AlphaFold DB , UniProt , Accession A0A087X480, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 323 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	55.3	Low	82.9	Confident	221 Å²	221	54 Å²	54	100%	1.089	31%	0.309	S	S	*	.				0	140.7	0	-66.1	-163.9	168.4	0	0	108.8	L3	M1-L3 PolarHBondContact O-N 3.1Å
2	P	66.7	Low	83.8	Confident	121 Å²	121	50.8 Å²	50.8	79%	0.786	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-66.1	120.5	177	27.1	-32	0	0	0	109.7	A4	P2-A4 PolarHBondContact O-N 3.11Å
3	L	75.8	Confident	84.5	Confident	107 Å²	107	56.5 Å²	56.5	56%	0.56	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-72	124.3	175.7	-65.7	170.5	0	0	0	109.3	M1 L199	M1-L3 PolarHBondContact O-N 3.1Å; L3-L199 HydrophobicContact CB-CD1 4.18Å; L3-L199 HydrophobicContact CD1-CD1 4.22Å
4	A	84.8	Confident	85.2	Confident	28 Å²	28	52.9 Å²	52.9	23%	0.231	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-84.2	151.1	176.9	0	0	0	0	0	111	P2 C200	P2-A4 PolarHBondContact O-N 3.11Å; A4-C200 PolarHBondContact O-N 3.43Å
5	P	87.8	Confident	85.8	Confident	56 Å²	56	50.2 Å²	50.2	36%	0.364	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-63.5	146.5	169.8	28.9	-34.5	0	0	0	110.5
6	A	88.8	Confident	86.4	Confident	6 Å²	6	54.6 Å²	54.6	5%	0.05	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-63.9	137.8	178	0	0	0	0	0	111.8	L11 I76 Y198	A6-L11 HydrophobicContact CB-CD2 4.05Å; A6-L11 HydrophobicContact CB-CG 4.24Å; A6-I76 HydrophobicContact CB-CG2 3.92Å; A6-Y198 PolarHBondContact N-O 3.36Å; A6-Y198 VanDerWaalsContact N-O 3.09Å
7	N	88.9	Confident	87	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.032	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-80.7	162.1	179.1	-67.4	-39.6	0	0	0	112.1	A9 Q10 L11 D208 R212	N7-A9 VanDerWaalsContact C-N 3.31Å; N7-A9 PolarHBondContact O-N 3.37Å; N7-Q10 WeakPolarHBondContact O-CB 3.46Å; N7-Q10 PolarHBondContact O-N 2.86Å; N7-L11 PolarHBondContact O-N 3.1Å; N7-L11 VanDerWaalsContact O-N 3.09Å; N7-D208 VanDerWaalsContact ND2-CB 3.35Å; N7-D208 WeakPolarHBondContact ND2-CB 3.1Å; N7-D208 PolarHBondContact ND2-OD1 2.76Å; N7-D208 PolarHBondContact ND2-OD2 3.22Å; N7-R212 PolarHBondContact OD1-NH2 3.14Å
8	Q	90.7	Very high	87.5	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-55.2	-44.6	-178.6	-62.9	94.2	-34.9	0	0	112.3	Q10 L11 I12 F180 Y181 Y215	Q8-Q10 VanDerWaalsContact C-N 3.28Å; Q8-Q10 PolarHBondContact O-N 3.42Å; Q8-L11 PolarHBondContact O-N 3Å; Q8-I12 WeakPolarHBondContact O-CD1 3.32Å; Q8-I12 VanDerWaalsContact O-CG1 3.23Å; Q8-I12 WeakPolarHBondContact O-CG1 3.5Å; Q8-I12 PolarHBondContact O-N 3.39Å; Q8-F180 HydrophobicContact CB-CE1 4.49Å; Q8-F180 HydrophobicContact CB-CZ 4.13Å; Q8-F180 HydrophobicContact CG-CZ 4.34Å; Q8-Y181 PolarHBondContact NE2-O 3.39Å; Q8-Y215 HydrophobicContact CB-CD1 4.44Å; Q8-Y215 HydrophobicContact CB-CD2 4.12Å; Q8-Y215 HydrophobicContact CB-CG 4Å
9	A	90.1	Very high	87.9	Confident	16 Å²	16	52.9 Å²	52.9	13%	0.132	28%	0.276	C	S	.	.	H	α-helix	trans	-59.9	-37.4	178.4	0	0	0	0	0	112.8	N7 R13 I211 Y215	N7-A9 VanDerWaalsContact C-N 3.31Å; N7-A9 PolarHBondContact O-N 3.37Å; A9-R13 WeakPolarHBondContact O-CB 3.46Å; A9-R13 VanDerWaalsContact O-CG 3.28Å; A9-R13 WeakPolarHBondContact O-CG 3.29Å; A9-R13 PolarHBondContact O-N 3.17Å; A9-I211 HydrophobicContact CB-CG2 4.11Å; A9-Y215 HydrophobicContact CB-CE2 3.8Å
10	Q	91.2	Very high	88.3	Confident	21 Å²	21	56 Å²	56	10%	0.098	29%	0.287	C	S	.	.	H	α-helix	trans	-69.7	-42.6	178.4	-70.3	174.1	-29.9	0	0	111.2	N7 Q8 I12 R13 S14 V74 I76 C200	N7-Q10 WeakPolarHBondContact O-CB 3.46Å; N7-Q10 PolarHBondContact O-N 2.86Å; Q8-Q10 VanDerWaalsContact C-N 3.28Å; Q8-Q10 PolarHBondContact O-N 3.42Å; Q10-I12 VanDerWaalsContact C-N 3.34Å; Q10-I12 PolarHBondContact O-N 3.39Å; Q10-R13 PolarHBondContact O-N 3.33Å; Q10-S14 WeakPolarHBondContact O-CB 3.07Å; Q10-S14 PolarHBondContact O-N 3.3Å; Q10-S14 PolarHBondContact O-OG 2.94Å; Q10-V74 HydrophobicContact CB-CG1 3.49Å; Q10-V74 VanDerWaalsContact CB-CG1 3.49Å; Q10-V74 HydrophobicContact CG-CG1 3.6Å; Q10-I76 HydrophobicContact CB-CG2 4.26Å; Q10-C200 PolarHBondContact NE2-SG 2.99Å
11	L	92.3	Very high	88.7	Confident	11 Å²	11	56.9 Å²	56.9	6%	0.058	29%	0.288	C	S	.	.	H	α-helix	trans	-64	-38.5	175.6	-65.6	176.7	0	0	0	112.2	A6 N7 Q8 S14 S15 I76 F180 Y198	A6-L11 HydrophobicContact CB-CD2 4.05Å; A6-L11 HydrophobicContact CB-CG 4.24Å; N7-L11 PolarHBondContact O-N 3.1Å; N7-L11 VanDerWaalsContact O-N 3.09Å; Q8-L11 PolarHBondContact O-N 3Å; L11-S14 WeakPolarHBondContact CA-OG 3.37Å; L11-S14 PolarHBondContact O-OG 3.01Å; L11-S15 WeakPolarHBondContact O-CB 3Å; L11-S15 PolarHBondContact O-N 3.38Å; L11-S15 VanDerWaalsContact O-N 3.09Å; L11-I76 HydrophobicContact CD2-CD1 4.13Å; L11-F180 HydrophobicContact CB-CE2 4.22Å; L11-F180 HydrophobicContact CB-CZ 4.14Å; L11-F180 HydrophobicContact CD1-CE2 3.8Å; L11-F180 HydrophobicContact CD1-CZ 4.44Å; L11-Y198 HydrophobicContact CD2-CD2 3.44Å; L11-Y198 VanDerWaalsContact CD2-CD2 3.44Å; L11-Y198 HydrophobicContact CD2-CE2 4.19Å; L11-Y198 HydrophobicContact CD2-CG 3.74Å
12	I	93.1	Very high	90.6	Very high	15 Å²	15	46.9 Å²	46.9	8%	0.077	24%	0.238	C	C	.	.	H	α-helix	trans	-68.6	-49.7	176.9	-66	162.1	0	0	0	110.3	Q8 Q10 S14 S15 Q16 F180 Y181 Y187 Y215	Q8-I12 WeakPolarHBondContact O-CD1 3.32Å; Q8-I12 VanDerWaalsContact O-CG1 3.23Å; Q8-I12 WeakPolarHBondContact O-CG1 3.5Å; Q8-I12 PolarHBondContact O-N 3.39Å; Q10-I12 VanDerWaalsContact C-N 3.34Å; Q10-I12 PolarHBondContact O-N 3.39Å; I12-S14 PolarHBondContact O-N 3.04Å; I12-S15 PolarHBondContact O-N 2.7Å; I12-Q16 HydrophobicContact CG2-CG 4.26Å; I12-Q16 WeakPolarHBondContact O-CB 3.23Å; I12-Q16 VanDerWaalsContact O-CG 3.3Å; I12-Q16 WeakPolarHBondContact O-CG 3.22Å; I12-Q16 PolarHBondContact O-N 3.46Å; I12-F180 HydrophobicContact CD1-CE1 4.05Å; I12-F180 HydrophobicContact CD1-CZ 4.44Å; I12-F180 HydrophobicContact CG1-CE1 3.92Å; I12-F180 HydrophobicContact CG1-CZ 4.05Å; I12-Y181 HydrophobicContact CD1-CE1 3.77Å; I12-Y187 HydrophobicContact CG1-CE2 4.39Å; I12-Y215 HydrophobicContact CD1-CD1 4.28Å; I12-Y215 HydrophobicContact CD1-CE1 3.65Å
13	R	93.3	Very high	92	Very high	126 Å²	126	43.2 Å²	43.2	48%	0.475	22%	0.215	S	C	.	.	H	α-helix	trans	-61.8	-42.9	-179.2	-75.2	-173.3	-63.5	176.1	1.7	112.5	A9 Q10 Q16 K17 V74	A9-R13 WeakPolarHBondContact O-CB 3.46Å; A9-R13 VanDerWaalsContact O-CG 3.28Å; A9-R13 WeakPolarHBondContact O-CG 3.29Å; A9-R13 PolarHBondContact O-N 3.17Å; Q10-R13 PolarHBondContact O-N 3.33Å; R13-Q16 PolarHBondContact O-N 3.43Å; R13-K17 WeakPolarHBondContact O-CB 3.38Å; R13-K17 PolarHBondContact O-N 3.41Å; R13-V74 HydrophobicContact CB-CG2 3.91Å
14	S	94.5	Very high	93.1	Very high	6 Å²	6	42.4 Å²	42.4	4%	0.042	21%	0.211	C	C	.	.	H	α-helix	trans	-62.5	-47.1	176.1	50.8	0	0	0	0	110.8	Q10 L11 I12 Q16 K17 D18 G70 I76	Q10-S14 WeakPolarHBondContact O-CB 3.07Å; Q10-S14 PolarHBondContact O-N 3.3Å; Q10-S14 PolarHBondContact O-OG 2.94Å; L11-S14 WeakPolarHBondContact CA-OG 3.37Å; L11-S14 PolarHBondContact O-OG 3.01Å; I12-S14 PolarHBondContact O-N 3.04Å; S14-Q16 PolarHBondContact O-N 3.11Å; S14-K17 PolarHBondContact O-N 3.43Å; S14-D18 PolarHBondContact O-N 3.44Å; S14-G70 WeakPolarHBondContact CA-O 3.35Å; S14-G70 WeakPolarHBondContact CB-O 3.12Å; S14-G70 WeakPolarHBondContact O-CA 3.37Å; S14-I76 VanDerWaalsContact OG-CD1 3.31Å; S14-I76 WeakPolarHBondContact OG-CD1 3.46Å
15	S	93.7	Very high	93.6	Very high	12 Å²	12	44.2 Å²	44.2	8%	0.084	22%	0.216	C	C	.	.	H	α-helix	trans	-64.8	-36.8	178.1	-169	0	0	0	0	113.4	L11 I12 K17 D18 E19 Y187 H188	L11-S15 WeakPolarHBondContact O-CB 3Å; L11-S15 PolarHBondContact O-N 3.38Å; L11-S15 VanDerWaalsContact O-N 3.09Å; I12-S15 PolarHBondContact O-N 2.7Å; S15-K17 VanDerWaalsContact C-N 3.35Å; S15-D18 PolarHBondContact O-N 3.31Å; S15-E19 PolarHBondContact O-N 2.91Å; S15-Y187 VanDerWaalsContact OG-CE1 3.27Å; S15-Y187 WeakPolarHBondContact OG-CE1 3.4Å; S15-H188 PolarHBondContact OG-NE2 2.74Å
16	Q	95.7	Very high	94	Very high	120 Å²	120	44 Å²	44	56%	0.561	21%	0.208	S	C	*	.	H	α-helix	trans	-65	-41.4	176	-77	174.7	-16.8	0	0	111.2	I12 R13 S14 E19 F20	I12-Q16 HydrophobicContact CG2-CG 4.26Å; I12-Q16 WeakPolarHBondContact O-CB 3.23Å; I12-Q16 VanDerWaalsContact O-CG 3.3Å; I12-Q16 WeakPolarHBondContact O-CG 3.22Å; I12-Q16 PolarHBondContact O-N 3.46Å; R13-Q16 PolarHBondContact O-N 3.43Å; S14-Q16 PolarHBondContact O-N 3.11Å; Q16-E19 PolarHBondContact O-N 3.41Å; Q16-F20 PolarHBondContact O-N 3.17Å
17	K	96.6	Very high	94.4	Very high	53 Å²	53	48 Å²	48	23%	0.23	23%	0.229	C	C	.	.	H	α-helix	trans	-66.6	-40	177	-169.7	59.5	158.8	163.5	0	111.7	R13 S14 S15 F20 Y21 Y73	R13-K17 WeakPolarHBondContact O-CB 3.38Å; R13-K17 PolarHBondContact O-N 3.41Å; S14-K17 PolarHBondContact O-N 3.43Å; S15-K17 VanDerWaalsContact C-N 3.35Å; K17-F20 WeakPolarHBondContact O-CB 3.44Å; K17-F20 PolarHBondContact O-N 3.39Å; K17-Y21 HydrophobicContact CD-CD2 4.32Å; K17-Y21 HydrophobicContact CD-CE2 3.73Å; K17-Y21 HydrophobicContact CG-CD2 4.3Å; K17-Y21 HydrophobicContact CG-CE2 3.95Å; K17-Y21 PolarHBondContact NZ-OH 3.49Å; K17-Y21 VanDerWaalsContact O-CD2 3.25Å; K17-Y21 WeakPolarHBondContact O-CD2 3.34Å; K17-Y21 PolarHBondContact O-N 3.15Å; K17-Y73 HydrophobicContact CB-CD1 4.36Å; K17-Y73 HydrophobicContact CG-CD1 4.19Å; K17-Y73 HydrophobicContact CG-CG 4.04Å
18	D	95.8	Very high	94.8	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.016	25%	0.247	C	C	.	.	H	α-helix	trans	-62.1	-44.4	173.1	-80	-24.1	0	0	0	112.1	S14 S15 F20 Y21 R22 Y57 T68 G70	S14-D18 PolarHBondContact O-N 3.44Å; S15-D18 PolarHBondContact O-N 3.31Å; D18-F20 VanDerWaalsContact C-N 3.3Å; D18-F20 PolarHBondContact O-N 3.47Å; D18-Y21 PolarHBondContact O-N 2.84Å; D18-R22 WeakPolarHBondContact O-CB 3.28Å; D18-R22 VanDerWaalsContact O-CG 3.31Å; D18-R22 WeakPolarHBondContact O-CG 3.19Å; D18-R22 PolarHBondContact O-N 3.36Å; D18-Y57 HydrophobicContact CB-CE1 4.42Å; D18-Y57 PolarHBondContact OD1-OH 3.4Å; D18-T68 VanDerWaalsContact OD1-CB 3.23Å; D18-T68 WeakPolarHBondContact OD1-CB 3.3Å; D18-T68 PolarHBondContact OD1-OG1 3.24Å; D18-T68 VanDerWaalsContact OD1-OG1 3.04Å; D18-T68 PolarHBondContact OD2-OG1 3.47Å; D18-G70 WeakPolarHBondContact OD1-CA 3.3Å; D18-G70 PolarHBondContact OD1-N 2.82Å
19	E	95.3	Very high	95	Very high	77 Å²	77	51.8 Å²	51.8	36%	0.36	26%	0.258	S	S	.	.	H	α-helix	trans	-65.5	-34.7	178	-167.3	62	-148.9	0	0	111.8	S15 Q16 R22 S23 R26	S15-E19 PolarHBondContact O-N 2.91Å; Q16-E19 PolarHBondContact O-N 3.41Å; E19-R22 PolarHBondContact O-N 3.34Å; E19-R22 IonicContact OE2-CZ 3.92Å; E19-R22 IonicContact OE2-NH1 2.65Å; E19-R22 PolarHBondContact OE2-NH1 3Å; E19-S23 WeakPolarHBondContact O-CB 3.47Å; E19-S23 PolarHBondContact O-N 2.84Å; E19-S23 PolarHBondContact O-OG 3.02Å; E19-S23 VanDerWaalsContact O-OG 3.1Å; E19-R26 IonicContact OE1-CZ 3.07Å; E19-R26 IonicContact OE1-NH1 3.85Å; E19-R26 PolarHBondContact OE1-NH1 3.06Å
20	F	96.8	Very high	95.3	Very high	113 Å²	113	51.6 Å²	51.6	50%	0.496	25%	0.254	S	S	.	.	H	α-helix	trans	-58.8	-52	173.8	175.3	-95.3	0	0	0	111.6	Q16 K17 D18 R22 S23 L24	Q16-F20 PolarHBondContact O-N 3.17Å; K17-F20 WeakPolarHBondContact O-CB 3.44Å; K17-F20 PolarHBondContact O-N 3.39Å; D18-F20 VanDerWaalsContact C-N 3.3Å; D18-F20 PolarHBondContact O-N 3.47Å; F20-R22 PolarHBondContact O-N 3.22Å; F20-S23 PolarHBondContact O-N 3.39Å; F20-S23 PolarHBondContact O-OG 2.85Å; F20-L24 PolarHBondContact O-N 3.2Å
21	Y	96	Very high	95.5	Very high	76 Å²	76	56.5 Å²	56.5	30%	0.298	28%	0.277	S	S	.	.	H	α-helix	trans	-69.1	-34.4	179.3	-73.2	-70.1	0	0	0	113.2	K17 D18 L24 L25 L69	K17-Y21 HydrophobicContact CD-CD2 4.32Å; K17-Y21 HydrophobicContact CD-CE2 3.73Å; K17-Y21 HydrophobicContact CG-CD2 4.3Å; K17-Y21 HydrophobicContact CG-CE2 3.95Å; K17-Y21 PolarHBondContact NZ-OH 3.49Å; K17-Y21 VanDerWaalsContact O-CD2 3.25Å; K17-Y21 WeakPolarHBondContact O-CD2 3.34Å; K17-Y21 PolarHBondContact O-N 3.15Å; D18-Y21 PolarHBondContact O-N 2.84Å; Y21-L24 PolarHBondContact O-N 2.93Å; Y21-L25 WeakPolarHBondContact O-CB 3.2Å; Y21-L25 PolarHBondContact O-N 3.38Å; Y21-L69 HydrophobicContact CD1-CD1 3.94Å; Y21-L69 HydrophobicContact CD2-CB 3.85Å; Y21-L69 HydrophobicContact CD2-CD1 3.62Å; Y21-L69 HydrophobicContact CD2-CG 4.41Å; Y21-L69 HydrophobicContact CE1-CD1 4.22Å; Y21-L69 HydrophobicContact CE2-CB 3.97Å; Y21-L69 HydrophobicContact CE2-CD1 3.91Å; Y21-L69 HydrophobicContact CG-CD1 3.64Å
22	R	95.3	Very high	95.7	Very high	10 Å²	10	58.4 Å²	58.4	4%	0.038	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-43	173.9	-75.4	173.2	60.7	-144.5	-1.7	112	D18 E19 F20 L24 L25 R26 D54 Y57 Y58 H99	D18-R22 WeakPolarHBondContact O-CB 3.28Å; D18-R22 VanDerWaalsContact O-CG 3.31Å; D18-R22 WeakPolarHBondContact O-CG 3.19Å; D18-R22 PolarHBondContact O-N 3.36Å; E19-R22 PolarHBondContact O-N 3.34Å; E19-R22 IonicContact OE2-CZ 3.92Å; E19-R22 IonicContact OE2-NH1 2.65Å; E19-R22 PolarHBondContact OE2-NH1 3Å; F20-R22 PolarHBondContact O-N 3.22Å; R22-L24 VanDerWaalsContact C-N 3.34Å; R22-L25 PolarHBondContact O-N 3.33Å; R22-R26 WeakPolarHBondContact O-CB 3.48Å; R22-R26 VanDerWaalsContact O-CG 3.24Å; R22-R26 WeakPolarHBondContact O-CG 3.34Å; R22-R26 PolarHBondContact O-N 2.9Å; R22-D54 IonicContact CZ-OD1 3.45Å; R22-D54 VanDerWaalsContact CZ-OD1 3.29Å; R22-D54 IonicContact CZ-OD2 3.03Å; R22-D54 IonicContact NE-OD1 3.76Å; R22-D54 PolarHBondContact NE-OD1 2.91Å; R22-D54 IonicContact NH2-OD1 3.15Å; R22-D54 PolarHBondContact NH2-OD1 3.45Å; R22-D54 IonicContact NH2-OD2 3.98Å; R22-D54 PolarHBondContact NH2-OD2 2.83Å; R22-Y57 HydrophobicContact CG-CD1 3.56Å; R22-Y57 HydrophobicContact CG-CD2 4.34Å; R22-Y57 HydrophobicContact CG-CE1 3.98Å; R22-Y57 HydrophobicContact CG-CG 3.76Å; R22-Y58 PolarHBondContact NH1-OH 3.47Å; R22-H99 PolarHBondContact NH1-CE1 3.28Å
23	S	96.6	Very high	95.8	Very high	44 Å²	44	59 Å²	59	31%	0.308	30%	0.3	S	S	.	.	H	α-helix	trans	-64.1	-40	176.3	63.5	0	0	0	0	111.8	E19 F20 R26 N27	E19-S23 WeakPolarHBondContact O-CB 3.47Å; E19-S23 PolarHBondContact O-N 2.84Å; E19-S23 PolarHBondContact O-OG 3.02Å; E19-S23 VanDerWaalsContact O-OG 3.1Å; F20-S23 PolarHBondContact O-N 3.39Å; F20-S23 PolarHBondContact O-OG 2.85Å; S23-R26 PolarHBondContact O-N 3.45Å; S23-N27 WeakPolarHBondContact O-CB 3.41Å; S23-N27 PolarHBondContact O-N 3.3Å; S23-N27 PolarHBondContact O-ND2 2.96Å; S23-N27 PolarHBondContact O-OD1 2.82Å
24	L	97.1	Very high	95.8	Very high	90 Å²	90	57 Å²	57	47%	0.471	30%	0.296	S	S	.	.	H	α-helix	trans	-58.9	-50	172.2	-176.6	63.6	0	0	0	111.7	F20 Y21 R22 R26 N27 S28	F20-L24 PolarHBondContact O-N 3.2Å; Y21-L24 PolarHBondContact O-N 2.93Å; R22-L24 VanDerWaalsContact C-N 3.34Å; L24-R26 PolarHBondContact O-N 3.35Å; L24-N27 PolarHBondContact O-N 3.2Å; L24-S28 PolarHBondContact O-N 2.71Å; L24-S28 PolarHBondContact O-OG 3.4Å
25	L	96.6	Very high	95.8	Very high	67 Å²	67	61.3 Å²	61.3	35%	0.351	33%	0.326	S	S	.	.	H	α-helix	trans	-61.2	-44.1	179.7	-175.5	65.4	0	0	0	111.9	Y21 R22 N27 S28 A29 S53	Y21-L25 WeakPolarHBondContact O-CB 3.2Å; Y21-L25 PolarHBondContact O-N 3.38Å; R22-L25 PolarHBondContact O-N 3.33Å; L25-N27 VanDerWaalsContact C-N 3.35Å; L25-N27 PolarHBondContact O-N 3.2Å; L25-S28 PolarHBondContact O-N 2.93Å; L25-A29 WeakPolarHBondContact O-CB 3.09Å; L25-A29 PolarHBondContact O-N 2.99Å; L25-S53 VanDerWaalsContact CD2-O 3.26Å; L25-S53 WeakPolarHBondContact CD2-O 3.42Å
26	R	96.1	Very high	95.9	Very high	50 Å²	50	66.9 Å²	66.9	19%	0.189	36%	0.359	C	S	.	.	H	α-helix	trans	-60.8	-43.1	175.6	-72.8	170.7	178.9	162.9	-13.6	111.7	E19 R22 S23 L24 N30 E50 D54	E19-R26 IonicContact OE1-CZ 3.07Å; E19-R26 IonicContact OE1-NH1 3.85Å; E19-R26 PolarHBondContact OE1-NH1 3.06Å; R22-R26 WeakPolarHBondContact O-CB 3.48Å; R22-R26 VanDerWaalsContact O-CG 3.24Å; R22-R26 WeakPolarHBondContact O-CG 3.34Å; R22-R26 PolarHBondContact O-N 2.9Å; S23-R26 PolarHBondContact O-N 3.45Å; L24-R26 PolarHBondContact O-N 3.35Å; R26-N30 VanDerWaalsContact O-CB 3.24Å; R26-N30 WeakPolarHBondContact O-CB 3.3Å; R26-N30 PolarHBondContact O-N 3.49Å; R26-N30 PolarHBondContact O-ND2 2.8Å; R26-E50 HydrophobicContact CB-CG 4.42Å; R26-E50 HydrophobicContact CG-CB 4.41Å; R26-E50 HydrophobicContact CG-CG 4.33Å; R26-D54 IonicContact CZ-OD1 3.3Å; R26-D54 VanDerWaalsContact CZ-OD1 3.3Å; R26-D54 IonicContact CZ-OD2 2.95Å; R26-D54 IonicContact NE-OD1 2.64Å; R26-D54 PolarHBondContact NE-OD1 2.84Å; R26-D54 IonicContact NE-OD2 3.51Å; R26-D54 PolarHBondContact NE-OD2 3.43Å; R26-D54 VanDerWaalsContact NH2-CG 3.31Å; R26-D54 IonicContact NH2-OD1 2.74Å; R26-D54 PolarHBondContact NH2-OD1 3.36Å; R26-D54 VanDerWaalsContact NH2-OD1 3.16Å; R26-D54 IonicContact NH2-OD2 3.3Å; R26-D54 PolarHBondContact NH2-OD2 2.9Å
27	N	96.6	Very high	95.7	Very high	90 Å²	90	63.2 Å²	63.2	48%	0.481	35%	0.349	S	S	.	.	H	α-helix	trans	-65.3	-49.4	179.7	-69.7	-15.3	0	0	0	110.7	S23 L24 L25 A29 N30 E31	S23-N27 WeakPolarHBondContact O-CB 3.41Å; S23-N27 PolarHBondContact O-N 3.3Å; S23-N27 PolarHBondContact O-ND2 2.96Å; S23-N27 PolarHBondContact O-OD1 2.82Å; L24-N27 PolarHBondContact O-N 3.2Å; L25-N27 VanDerWaalsContact C-N 3.35Å; L25-N27 PolarHBondContact O-N 3.2Å; N27-A29 VanDerWaalsContact C-N 3.34Å; N27-A29 PolarHBondContact O-N 3.27Å; N27-N30 PolarHBondContact O-N 2.83Å; N27-E31 WeakPolarHBondContact O-CG 3.38Å; N27-E31 PolarHBondContact O-N 3.46Å
28	S	97.1	Very high	95.5	Very high	59 Å²	59	62.1 Å²	62.1	41%	0.413	35%	0.353	S	S	.	.	H	α-helix	trans	-61.9	-40.2	177.2	-58.3	0	0	0	0	112.6	L24 L25 E31 A32	L24-S28 PolarHBondContact O-N 2.71Å; L24-S28 PolarHBondContact O-OG 3.4Å; L25-S28 PolarHBondContact O-N 2.93Å; S28-E31 PolarHBondContact O-N 2.97Å; S28-A32 VanDerWaalsContact O-CB 3.31Å; S28-A32 WeakPolarHBondContact O-CB 3.5Å; S28-A32 PolarHBondContact O-N 2.94Å
29	A	96.4	Very high	95.2	Very high	28 Å²	28	65.5 Å²	65.5	23%	0.231	38%	0.377	C	S	.	.	H	α-helix	trans	-66.3	-39.1	176.2	0	0	0	0	0	112	L25 N27 C33 V49 S53	L25-A29 WeakPolarHBondContact O-CB 3.09Å; L25-A29 PolarHBondContact O-N 2.99Å; N27-A29 VanDerWaalsContact C-N 3.34Å; N27-A29 PolarHBondContact O-N 3.27Å; A29-C33 VanDerWaalsContact O-CB 3.26Å; A29-C33 WeakPolarHBondContact O-CB 3.36Å; A29-C33 PolarHBondContact O-N 3.49Å; A29-V49 HydrophobicContact CB-CG1 3.65Å; A29-S53 VanDerWaalsContact CB-OG 3.26Å; A29-S53 WeakPolarHBondContact CB-OG 3.48Å
30	N	95.8	Very high	94.8	Very high	12 Å²	12	69.3 Å²	69.3	6%	0.064	39%	0.393	C	S	.	.	H	α-helix	trans	-65.7	-45	175.1	-85.8	-48	0	0	0	111.9	R26 N27 C33 Q34 W42	R26-N30 VanDerWaalsContact O-CB 3.24Å; R26-N30 WeakPolarHBondContact O-CB 3.3Å; R26-N30 PolarHBondContact O-N 3.49Å; R26-N30 PolarHBondContact O-ND2 2.8Å; N27-N30 PolarHBondContact O-N 2.83Å; N30-C33 PolarHBondContact O-N 3.12Å; N30-Q34 VanDerWaalsContact O-CB 3.27Å; N30-Q34 WeakPolarHBondContact O-CB 3.5Å; N30-Q34 PolarHBondContact O-N 3.38Å; N30-W42 PolarHBondContact OD1-NE1 2.96Å; N30-W42 VanDerWaalsContact OD1-NE1 3.13Å
31	E	95.7	Very high	94.2	Very high	125 Å²	125	68.8 Å²	68.8	58%	0.584	39%	0.391	S	S	*	.	H	α-helix	trans	-61.9	-43.5	176.2	-73.9	171.3	-172.5	0	0	111.7	N27 S28 Q34 S35	N27-E31 WeakPolarHBondContact O-CG 3.38Å; N27-E31 PolarHBondContact O-N 3.46Å; S28-E31 PolarHBondContact O-N 2.97Å; E31-Q34 PolarHBondContact O-N 2.92Å; E31-S35 WeakPolarHBondContact O-CB 3.35Å; E31-S35 PolarHBondContact O-N 3.37Å; E31-S35 PolarHBondContact O-OG 2.84Å
32	A	95.8	Very high	93.9	Very high	50 Å²	50	67 Å²	67	41%	0.413	38%	0.384	S	S	.	.	H	α-helix	trans	-63.6	-42.3	174.9	0	0	0	0	0	111.9	S28 Q34 S35 V36	S28-A32 VanDerWaalsContact O-CB 3.31Å; S28-A32 WeakPolarHBondContact O-CB 3.5Å; S28-A32 PolarHBondContact O-N 2.94Å; A32-Q34 VanDerWaalsContact C-N 3.35Å; A32-S35 PolarHBondContact O-N 3.48Å; A32-S35 PolarHBondContact O-OG 3.41Å; A32-V36 WeakPolarHBondContact O-CB 3.44Å; A32-V36 VanDerWaalsContact O-CG2 3.25Å; A32-V36 WeakPolarHBondContact O-CG2 3.44Å; A32-V36 PolarHBondContact O-N 2.87Å
33	C	94.5	Very high	93.5	Very high	28 Å²	28	72 Å²	72	19%	0.189	41%	0.411	C	S	.	.	H	α-helix	trans	-66.3	-39.7	176.5	-173.9	0	0	0	0	111.5	A29 N30 A37 V49	A29-C33 VanDerWaalsContact O-CB 3.26Å; A29-C33 WeakPolarHBondContact O-CB 3.36Å; A29-C33 PolarHBondContact O-N 3.49Å; N30-C33 PolarHBondContact O-N 3.12Å; C33-A37 VanDerWaalsContact O-CB 3.3Å; C33-A37 WeakPolarHBondContact O-CB 3.35Å; C33-A37 PolarHBondContact O-N 3.25Å; C33-V49 HydrophobicContact CB-CG2 4.15Å
34	Q	94.6	Very high	92.8	Very high	84 Å²	84	74.8 Å²	74.8	39%	0.393	42%	0.422	S	S	.	.	H	α-helix	trans	-65.3	-41.2	177.9	-173.8	179	5.4	0	0	112.1	N30 E31 A32 G38 W42	N30-Q34 VanDerWaalsContact O-CB 3.27Å; N30-Q34 WeakPolarHBondContact O-CB 3.5Å; N30-Q34 PolarHBondContact O-N 3.38Å; E31-Q34 PolarHBondContact O-N 2.92Å; A32-Q34 VanDerWaalsContact C-N 3.35Å; Q34-G38 CarbonylContact O-C 3.51Å; Q34-G38 VanDerWaalsContact O-CA 3.25Å; Q34-G38 WeakPolarHBondContact O-CA 3.16Å; Q34-G38 PolarHBondContact O-N 2.92Å; Q34-G38 VanDerWaalsContact O-N 3.14Å; Q34-W42 HydrophobicContact CB-CB 4.17Å; Q34-W42 HydrophobicContact CB-CD2 4.34Å; Q34-W42 HydrophobicContact CB-CG 3.88Å; Q34-W42 HydrophobicContact CG-CB 4.45Å; Q34-W42 HydrophobicContact CG-CD2 4.4Å; Q34-W42 HydrophobicContact CG-CG 4.28Å
35	S	94.9	Very high	92.2	Very high	97 Å²	97	74.9 Å²	74.9	68%	0.678	42%	0.416	S	S	*	.	H	α-helix	trans	-71.1	-36.9	178.9	65.2	0	0	0	0	112.5	E31 A32	E31-S35 WeakPolarHBondContact O-CB 3.35Å; E31-S35 PolarHBondContact O-N 3.37Å; E31-S35 PolarHBondContact O-OG 2.84Å; A32-S35 PolarHBondContact O-N 3.48Å; A32-S35 PolarHBondContact O-OG 3.41Å
36	V	95.3	Very high	91.9	Very high	128 Å²	128	77.1 Å²	77.1	78%	0.776	42%	0.42	S	S	*	.	H	α-helix	trans	-84.6	-46.9	-177	176.1	0	0	0	0	112.8	A32	A32-V36 WeakPolarHBondContact O-CB 3.44Å; A32-V36 VanDerWaalsContact O-CG2 3.25Å; A32-V36 WeakPolarHBondContact O-CG2 3.44Å; A32-V36 PolarHBondContact O-N 2.87Å
37	A	91.6	Very high	91.5	Very high	43 Å²	43	80.2 Å²	80.2	36%	0.355	43%	0.432	S	S	.	.	H	α-helix	trans	-96.5	-9.3	-172.8	0	0	0	0	0	113.6	C33 H41	C33-A37 VanDerWaalsContact O-CB 3.3Å; C33-A37 WeakPolarHBondContact O-CB 3.35Å; C33-A37 PolarHBondContact O-N 3.25Å; A37-H41 HydrophobicContact CB-CB 3.95Å; A37-H41 PolarHBondContact O-ND1 3.06Å
38	G	91.9	Very high	91.2	Very high	30 Å²	30	77.4 Å²	77.4	31%	0.309	42%	0.416	S	S	.	.	H	α-helix	trans	78.8	162.6	-175	0	0	0	0	0	113.5	Q34 K40 H41 W42	Q34-G38 CarbonylContact O-C 3.51Å; Q34-G38 VanDerWaalsContact O-CA 3.25Å; Q34-G38 WeakPolarHBondContact O-CA 3.16Å; Q34-G38 PolarHBondContact O-N 2.92Å; Q34-G38 VanDerWaalsContact O-N 3.14Å; G38-K40 VanDerWaalsContact C-N 3.33Å; G38-K40 PolarHBondContact O-N 3.39Å; G38-H41 PolarHBondContact O-N 3.21Å; G38-W42 WeakPolarHBondContact O-CB 3.27Å; G38-W42 PolarHBondContact O-N 2.81Å
39	S	90.4	Very high	90.9	Very high	75 Å²	75	75.5 Å²	75.5	52%	0.524	40%	0.402	S	S	.	.	H	α-helix	trans	-60.1	-36.2	-172.9	55.4	0	0	0	0	114.2	L43	S39-L43 WeakPolarHBondContact O-CG 3.25Å; S39-L43 PolarHBondContact O-N 3.27Å
40	K	86.7	Confident	90.8	Very high	157 Å²	157	76.7 Å²	76.7	68%	0.683	40%	0.402	S	S	*	.	H	α-helix	trans	-65.5	-48.3	-179.2	-174	176.7	177	176.9	0	112.1	G38 D44	G38-K40 VanDerWaalsContact C-N 3.33Å; G38-K40 PolarHBondContact O-N 3.39Å; K40-D44 PolarHBondContact O-N 3.03Å
41	H	84	Confident	90.7	Very high	101 Å²	101	76.9 Å²	76.9	47%	0.468	40%	0.403	S	S	.	.	H	α-helix	trans	-72.3	-35.4	178.3	-61.8	103.5	0	0	0	111.5	A37 G38 L43 D44 W45	A37-H41 HydrophobicContact CB-CB 3.95Å; A37-H41 PolarHBondContact O-ND1 3.06Å; G38-H41 PolarHBondContact O-N 3.21Å; H41-L43 PolarHBondContact O-N 2.83Å; H41-D44 PolarHBondContact O-N 2.94Å; H41-W45 WeakPolarHBondContact O-CB 3.46Å; H41-W45 VanDerWaalsContact O-CD1 3.31Å; H41-W45 PolarHBondContact O-N 3.06Å
42	W	89.4	Confident	90.6	Very high	40 Å²	40	75.9 Å²	75.9	15%	0.152	40%	0.402	C	S	.	.	H	α-helix	trans	-58.3	-45.4	173.8	168.3	74.9	0	0	0	112.1	N30 Q34 G38 D44 W45 R46	N30-W42 PolarHBondContact OD1-NE1 2.96Å; N30-W42 VanDerWaalsContact OD1-NE1 3.13Å; Q34-W42 HydrophobicContact CB-CB 4.17Å; Q34-W42 HydrophobicContact CB-CD2 4.34Å; Q34-W42 HydrophobicContact CB-CG 3.88Å; Q34-W42 HydrophobicContact CG-CB 4.45Å; Q34-W42 HydrophobicContact CG-CD2 4.4Å; Q34-W42 HydrophobicContact CG-CG 4.28Å; G38-W42 WeakPolarHBondContact O-CB 3.27Å; G38-W42 PolarHBondContact O-N 2.81Å; W42-D44 VanDerWaalsContact C-N 3.27Å; W42-D44 PolarHBondContact O-N 2.91Å; W42-W45 CarbonylContact O-C 3.29Å; W42-W45 PolarHBondContact O-N 2.85Å; W42-W45 VanDerWaalsContact O-N 3.15Å; W42-R46 HydrophobicContact CZ2-CG 4.32Å; W42-R46 WeakPolarHBondContact O-CA 3.38Å; W42-R46 VanDerWaalsContact O-CB 3.3Å; W42-R46 WeakPolarHBondContact O-CB 3.43Å; W42-R46 PolarHBondContact O-N 3.14Å
43	L	86.2	Confident	90.6	Very high	114 Å²	114	74 Å²	74	60%	0.597	39%	0.385	S	S	*	.	H	α-helix	trans	-58.2	-40.8	177.4	-78.8	168.7	0	0	0	112.3	S39 H41	S39-L43 WeakPolarHBondContact O-CG 3.25Å; S39-L43 PolarHBondContact O-N 3.27Å; H41-L43 PolarHBondContact O-N 2.83Å
44	D	83.3	Confident	90.6	Very high	103 Å²	103	73.1 Å²	73.1	55%	0.551	38%	0.379	S	S	*	.	H	α-helix	trans	-69.8	-35.3	178.3	-70	-22.3	0	0	0	112.1	K40 H41 W42	K40-D44 PolarHBondContact O-N 3.03Å; H41-D44 PolarHBondContact O-N 2.94Å; W42-D44 VanDerWaalsContact C-N 3.27Å; W42-D44 PolarHBondContact O-N 2.91Å
45	W	84.4	Confident	90.6	Very high	91 Å²	91	71 Å²	71	35%	0.345	37%	0.37	S	S	.	.	H	α-helix	trans	-99.9	-7.7	-172.8	-78.1	64.8	0	0	0	115.1	H41 W42 R47 E48 V49 W133	H41-W45 WeakPolarHBondContact O-CB 3.46Å; H41-W45 VanDerWaalsContact O-CD1 3.31Å; H41-W45 PolarHBondContact O-N 3.06Å; W42-W45 CarbonylContact O-C 3.29Å; W42-W45 PolarHBondContact O-N 2.85Å; W42-W45 VanDerWaalsContact O-N 3.15Å; W45-R47 VanDerWaalsContact C-N 3.28Å; W45-R47 PolarHBondContact O-N 2.98Å; W45-R47 VanDerWaalsContact O-N 3.14Å; W45-E48 WeakPolarHBondContact O-CA 3.3Å; W45-E48 WeakPolarHBondContact O-CB 3.37Å; W45-E48 PolarHBondContact O-N 2.82Å; W45-V49 HydrophobicContact CB-CG2 4.35Å; W45-V49 WeakPolarHBondContact O-CG2 3.37Å; W45-V49 PolarHBondContact O-N 2.8Å; W45-W133 AromaticContact CH2-CE2 3.77Å; W45-W133 AromaticContact CH2-CH2 3.39Å; W45-W133 HydrophobicContact CH2-CH2 3.39Å; W45-W133 AromaticContact CH2-CZ2 2.98Å; W45-W133 HydrophobicContact CH2-CZ2 2.98Å; W45-W133 HydrophobicContact CH2-CZ3 4.45Å; W45-W133 AromaticContact CZ2-CE2 3.51Å; W45-W133 HydrophobicContact CZ2-CH2 4.04Å; W45-W133 AromaticContact CZ2-CZ2 3.17Å; W45-W133 HydrophobicContact CZ2-CZ2 3.17Å; W45-W133 AromaticContact CZ2-NE1 3.58Å; W45-W133 AromaticContact CZ3-CH2 3.88Å; W45-W133 HydrophobicContact CZ3-CH2 3.88Å; W45-W133 AromaticContact CZ3-CZ2 3.87Å; W45-W133 HydrophobicContact CZ3-CZ2 3.87Å
46	R	89.5	Confident	90.6	Very high	114 Å²	114	68.6 Å²	68.6	43%	0.43	36%	0.356	S	S	.	.	H	α-helix	trans	-48.3	-48.3	-173.5	177.8	179.5	173.5	172.4	3.4	113	W42 E48 V49 E50	W42-R46 HydrophobicContact CZ2-CG 4.32Å; W42-R46 WeakPolarHBondContact O-CA 3.38Å; W42-R46 VanDerWaalsContact O-CB 3.3Å; W42-R46 WeakPolarHBondContact O-CB 3.43Å; W42-R46 PolarHBondContact O-N 3.14Å; R46-E48 VanDerWaalsContact C-N 3.3Å; R46-E48 PolarHBondContact O-N 3.31Å; R46-V49 PolarHBondContact O-N 3.36Å; R46-E50 WeakPolarHBondContact CG-OE1 3.37Å; R46-E50 IonicContact CZ-OE1 2.82Å; R46-E50 IonicContact NE-OE1 2.89Å; R46-E50 PolarHBondContact NE-OE1 3.15Å; R46-E50 IonicContact NH2-OE1 2.97Å; R46-E50 WeakPolarHBondContact O-CG 3.35Å; R46-E50 PolarHBondContact O-N 2.91Å
47	R	87.5	Confident	90.7	Very high	115 Å²	115	63.3 Å²	63.3	43%	0.434	32%	0.322	S	S	.	.	H	α-helix	trans	-65	-33.8	179.9	-68.9	-175.5	173.8	-152.3	-9.8	112.7	W45 L51 Y104 E107	W45-R47 VanDerWaalsContact C-N 3.28Å; W45-R47 PolarHBondContact O-N 2.98Å; W45-R47 VanDerWaalsContact O-N 3.14Å; R47-L51 WeakPolarHBondContact O-CB 3.38Å; R47-L51 PolarHBondContact O-N 3.04Å; R47-Y104 HydrophobicContact CB-CE2 4.37Å; R47-E107 IonicContact CZ-OE1 2.65Å; R47-E107 IonicContact NH1-OE1 3.96Å; R47-E107 PolarHBondContact NH1-OE1 3.38Å; R47-E107 IonicContact NH1-OE2 2.69Å; R47-E107 IonicContact NH2-OE1 3.15Å; R47-E107 PolarHBondContact NH2-OE1 3.1Å
48	E	89.9	Confident	90.8	Very high	32 Å²	32	61.4 Å²	61.4	15%	0.15	31%	0.306	C	S	.	.	H	α-helix	trans	-74.4	-38.9	177.8	-47.7	-49.1	152	0	0	111.2	W45 R46 E50 L51 L52 Y104 K108	W45-E48 WeakPolarHBondContact O-CA 3.3Å; W45-E48 WeakPolarHBondContact O-CB 3.37Å; W45-E48 PolarHBondContact O-N 2.82Å; R46-E48 VanDerWaalsContact C-N 3.3Å; R46-E48 PolarHBondContact O-N 3.31Å; E48-E50 VanDerWaalsContact C-N 3.33Å; E48-L51 PolarHBondContact O-N 3.47Å; E48-L52 WeakPolarHBondContact O-CB 3.39Å; E48-L52 VanDerWaalsContact O-CG 3.27Å; E48-L52 WeakPolarHBondContact O-CG 3.48Å; E48-L52 PolarHBondContact O-N 3.37Å; E48-Y104 WeakPolarHBondContact OE1-CE2 3.27Å; E48-Y104 PolarHBondContact OE1-OH 3.24Å; E48-Y104 WeakPolarHBondContact OE2-CE2 3.38Å; E48-Y104 VanDerWaalsContact OE2-CZ 3.26Å; E48-Y104 PolarHBondContact OE2-OH 2.81Å; E48-K108 IonicContact OE1-NZ 3.29Å; E48-K108 PolarHBondContact OE1-NZ 2.88Å
49	V	92.1	Very high	91	Very high	18 Å²	18	60.9 Å²	60.9	11%	0.109	30%	0.3	C	S	.	.	H	α-helix	trans	-62.9	-42	174.4	175.7	0	0	0	0	110.4	A29 C33 W45 R46 L52 S53	A29-V49 HydrophobicContact CB-CG1 3.65Å; C33-V49 HydrophobicContact CB-CG2 4.15Å; W45-V49 HydrophobicContact CB-CG2 4.35Å; W45-V49 WeakPolarHBondContact O-CG2 3.37Å; W45-V49 PolarHBondContact O-N 2.8Å; R46-V49 PolarHBondContact O-N 3.36Å; V49-L52 PolarHBondContact O-N 3.27Å; V49-S53 WeakPolarHBondContact O-CB 3.42Å; V49-S53 PolarHBondContact O-N 3.25Å; V49-S53 PolarHBondContact O-OG 2.81Å
50	E	93.3	Very high	91.2	Very high	53 Å²	53	63.5 Å²	63.5	25%	0.248	31%	0.307	C	S	.	.	H	α-helix	trans	-62.2	-44	174.4	-73.4	170.2	-169.2	0	0	111.9	R26 R46 E48 S53 D54	R26-E50 HydrophobicContact CB-CG 4.42Å; R26-E50 HydrophobicContact CG-CB 4.41Å; R26-E50 HydrophobicContact CG-CG 4.33Å; R46-E50 WeakPolarHBondContact CG-OE1 3.37Å; R46-E50 IonicContact CZ-OE1 2.82Å; R46-E50 IonicContact NE-OE1 2.89Å; R46-E50 PolarHBondContact NE-OE1 3.15Å; R46-E50 IonicContact NH2-OE1 2.97Å; R46-E50 WeakPolarHBondContact O-CG 3.35Å; R46-E50 PolarHBondContact O-N 2.91Å; E48-E50 VanDerWaalsContact C-N 3.33Å; E50-S53 PolarHBondContact O-N 2.85Å; E50-D54 PolarHBondContact O-N 2.8Å; E50-D54 VanDerWaalsContact O-N 3.07Å
51	L	92.9	Very high	91.5	Very high	16 Å²	16	56.9 Å²	56.9	8%	0.084	28%	0.28	C	S	.	.	H	α-helix	trans	-63.6	-46.4	175.9	179.4	67.4	0	0	0	112	R47 E48 S53 D54 L55 A100 F101 Y104	R47-L51 WeakPolarHBondContact O-CB 3.38Å; R47-L51 PolarHBondContact O-N 3.04Å; E48-L51 PolarHBondContact O-N 3.47Å; L51-S53 VanDerWaalsContact C-N 3.29Å; L51-S53 PolarHBondContact O-N 3.41Å; L51-D54 PolarHBondContact O-N 3.28Å; L51-L55 HydrophobicContact CD1-CD1 4.4Å; L51-L55 HydrophobicContact CD1-CG 4.49Å; L51-L55 HydrophobicContact CG-CD1 4.08Å; L51-L55 VanDerWaalsContact O-CG 3.3Å; L51-L55 WeakPolarHBondContact O-CG 3.5Å; L51-L55 PolarHBondContact O-N 2.83Å; L51-A100 HydrophobicContact CD1-CB 3.96Å; L51-A100 WeakPolarHBondContact CD1-O 3.48Å; L51-F101 HydrophobicContact CD2-CD1 4.28Å; L51-F101 HydrophobicContact CD2-CE1 4.1Å; L51-Y104 HydrophobicContact CD2-CD1 4.24Å; L51-Y104 HydrophobicContact CD2-CD2 4.27Å; L51-Y104 HydrophobicContact CD2-CE1 4.37Å; L51-Y104 HydrophobicContact CD2-CE2 4.34Å; L51-Y104 HydrophobicContact CD2-CG 4.2Å
52	L	94.2	Very high	92	Very high	105 Å²	105	52.1 Å²	52.1	55%	0.55	26%	0.258	S	S	.	.	H	α-helix	trans	-62.5	-38.3	177.9	-74.7	173.3	0	0	0	111.5	E48 V49 L55 A56	E48-L52 WeakPolarHBondContact O-CB 3.39Å; E48-L52 VanDerWaalsContact O-CG 3.27Å; E48-L52 WeakPolarHBondContact O-CG 3.48Å; E48-L52 PolarHBondContact O-N 3.37Å; V49-L52 PolarHBondContact O-N 3.27Å; L52-L55 PolarHBondContact O-N 3.29Å; L52-A56 VanDerWaalsContact O-CB 3.29Å; L52-A56 WeakPolarHBondContact O-CB 3.46Å; L52-A56 PolarHBondContact O-N 3.15Å
53	S	95.4	Very high	92.1	Very high	9 Å²	9	53.4 Å²	53.4	6%	0.063	27%	0.268	C	S	.	.	H	α-helix	trans	-62.3	-45	175.1	-59	0	0	0	0	111.4	L25 A29 V49 E50 L51 A56 Y57	L25-S53 VanDerWaalsContact CD2-O 3.26Å; L25-S53 WeakPolarHBondContact CD2-O 3.42Å; A29-S53 VanDerWaalsContact CB-OG 3.26Å; A29-S53 WeakPolarHBondContact CB-OG 3.48Å; V49-S53 WeakPolarHBondContact O-CB 3.42Å; V49-S53 PolarHBondContact O-N 3.25Å; V49-S53 PolarHBondContact O-OG 2.81Å; E50-S53 PolarHBondContact O-N 2.85Å; L51-S53 VanDerWaalsContact C-N 3.29Å; L51-S53 PolarHBondContact O-N 3.41Å; S53-A56 PolarHBondContact O-N 3.26Å; S53-Y57 PolarHBondContact O-N 3.23Å
54	D	94.4	Very high	92.4	Very high	11 Å²	11	51.4 Å²	51.4	6%	0.059	26%	0.263	C	S	.	.	H	α-helix	trans	-63.1	-42.9	175.9	-78.1	-23	0	0	0	112.7	R22 R26 E50 L51 A56 Y57 Y58	R22-D54 IonicContact CZ-OD1 3.45Å; R22-D54 VanDerWaalsContact CZ-OD1 3.29Å; R22-D54 IonicContact CZ-OD2 3.03Å; R22-D54 IonicContact NE-OD1 3.76Å; R22-D54 PolarHBondContact NE-OD1 2.91Å; R22-D54 IonicContact NH2-OD1 3.15Å; R22-D54 PolarHBondContact NH2-OD1 3.45Å; R22-D54 IonicContact NH2-OD2 3.98Å; R22-D54 PolarHBondContact NH2-OD2 2.83Å; R26-D54 IonicContact CZ-OD1 3.3Å; R26-D54 VanDerWaalsContact CZ-OD1 3.3Å; R26-D54 IonicContact CZ-OD2 2.95Å; R26-D54 IonicContact NE-OD1 2.64Å; R26-D54 PolarHBondContact NE-OD1 2.84Å; R26-D54 IonicContact NE-OD2 3.51Å; R26-D54 PolarHBondContact NE-OD2 3.43Å; R26-D54 VanDerWaalsContact NH2-CG 3.31Å; R26-D54 IonicContact NH2-OD1 2.74Å; R26-D54 PolarHBondContact NH2-OD1 3.36Å; R26-D54 VanDerWaalsContact NH2-OD1 3.16Å; R26-D54 IonicContact NH2-OD2 3.3Å; R26-D54 PolarHBondContact NH2-OD2 2.9Å; E50-D54 PolarHBondContact O-N 2.8Å; E50-D54 VanDerWaalsContact O-N 3.07Å; L51-D54 PolarHBondContact O-N 3.28Å; D54-A56 VanDerWaalsContact C-N 3.34Å; D54-Y57 PolarHBondContact O-N 3.44Å; D54-Y58 WeakPolarHBondContact O-CD2 3.31Å; D54-Y58 PolarHBondContact O-N 3.47Å
55	L	95.1	Very high	92.7	Very high	40 Å²	40	48.1 Å²	48.1	21%	0.209	25%	0.254	C	S	.	.	H	α-helix	trans	-66.2	-37.2	177	-69.4	173.4	0	0	0	111.8	L51 L52 G59 V96 A100 F101	L51-L55 HydrophobicContact CD1-CD1 4.4Å; L51-L55 HydrophobicContact CD1-CG 4.49Å; L51-L55 HydrophobicContact CG-CD1 4.08Å; L51-L55 VanDerWaalsContact O-CG 3.3Å; L51-L55 WeakPolarHBondContact O-CG 3.5Å; L51-L55 PolarHBondContact O-N 2.83Å; L52-L55 PolarHBondContact O-N 3.29Å; L55-G59 VanDerWaalsContact O-CA 3.24Å; L55-G59 WeakPolarHBondContact O-CA 3Å; L55-G59 PolarHBondContact O-N 2.92Å; L55-V96 HydrophobicContact CD2-CG1 3.96Å; L55-A100 HydrophobicContact CD2-CB 3.64Å; L55-A100 HydrophobicContact CG-CB 4.2Å; L55-F101 HydrophobicContact CD1-CE1 4.44Å; L55-F101 HydrophobicContact CD1-CE2 3.62Å; L55-F101 HydrophobicContact CD1-CZ 3.53Å; L55-F101 HydrophobicContact CD2-CD2 4.06Å; L55-F101 HydrophobicContact CD2-CE2 3.48Å; L55-F101 VanDerWaalsContact CD2-CE2 3.48Å; L55-F101 HydrophobicContact CD2-CZ 4.28Å; L55-F101 HydrophobicContact CG-CE2 4.16Å
56	A	95.6	Very high	93.1	Very high	45 Å²	45	52 Å²	52	37%	0.372	27%	0.269	S	S	.	.	H	α-helix	trans	-64.1	-46.6	174.1	0	0	0	0	0	110.9	L52 S53 D54 G59 L60	L52-A56 VanDerWaalsContact O-CB 3.29Å; L52-A56 WeakPolarHBondContact O-CB 3.46Å; L52-A56 PolarHBondContact O-N 3.15Å; S53-A56 PolarHBondContact O-N 3.26Å; D54-A56 VanDerWaalsContact C-N 3.34Å; A56-G59 PolarHBondContact O-N 3.46Å; A56-L60 WeakPolarHBondContact O-CB 3.39Å; A56-L60 VanDerWaalsContact O-CG 3.29Å; A56-L60 WeakPolarHBondContact O-CG 3.23Å; A56-L60 PolarHBondContact O-N 3.19Å
57	Y	96.3	Very high	93.3	Very high	17 Å²	17	50.4 Å²	50.4	7%	0.067	27%	0.267	C	S	.	.	H	α-helix	trans	-58.6	-55	178.3	-178.2	-101.8	0	0	0	112	D18 R22 S53 D54 G59 T61 T68 L69	D18-Y57 HydrophobicContact CB-CE1 4.42Å; D18-Y57 PolarHBondContact OD1-OH 3.4Å; R22-Y57 HydrophobicContact CG-CD1 3.56Å; R22-Y57 HydrophobicContact CG-CD2 4.34Å; R22-Y57 HydrophobicContact CG-CE1 3.98Å; R22-Y57 HydrophobicContact CG-CG 3.76Å; S53-Y57 PolarHBondContact O-N 3.23Å; D54-Y57 PolarHBondContact O-N 3.44Å; Y57-G59 VanDerWaalsContact C-N 3.32Å; Y57-G59 PolarHBondContact O-N 2.97Å; Y57-T61 WeakPolarHBondContact O-CB 3.11Å; Y57-T61 WeakPolarHBondContact O-CG2 3.43Å; Y57-T61 PolarHBondContact O-N 2.81Å; Y57-T61 VanDerWaalsContact O-N 3.14Å; Y57-T61 PolarHBondContact O-OG1 3.35Å; Y57-T68 HydrophobicContact CE1-CG2 4.32Å; Y57-L69 HydrophobicContact CE2-CD1 4.2Å; Y57-L69 HydrophobicContact CE2-CG 4.46Å; Y57-L69 PolarHBondContact OH-N 2.76Å
58	Y	94.8	Very high	93.7	Very high	4 Å²	4	45 Å²	45	2%	0.016	25%	0.247	C	C	.	.	H	α-helix	trans	-74.3	-23.8	-179.2	-71.9	-59.8	0	0	0	113.5	R22 D54 T61 T62 L63 T68 F95 V96 H99	R22-Y58 PolarHBondContact NH1-OH 3.47Å; D54-Y58 WeakPolarHBondContact O-CD2 3.31Å; D54-Y58 PolarHBondContact O-N 3.47Å; Y58-T61 WeakPolarHBondContact CA-OG1 3.15Å; Y58-T62 PolarHBondContact O-N 3.17Å; Y58-L63 PolarHBondContact O-N 2.92Å; Y58-T68 HydrophobicContact CD1-CG2 4.36Å; Y58-T68 HydrophobicContact CE1-CG2 4.29Å; Y58-F95 HydrophobicContact CD1-CE1 4.07Å; Y58-F95 HydrophobicContact CD1-CZ 4.38Å; Y58-F95 HydrophobicContact CE1-CE1 4.2Å; Y58-F95 HydrophobicContact CE1-CZ 4.09Å; Y58-V96 HydrophobicContact CG-CG2 4.43Å; Y58-H99 AromaticContact CE2-CE1 3.89Å; Y58-H99 AromaticContact CE2-ND1 3.57Å
59	G	95	Very high	94	Very high	18 Å²	18	46.8 Å²	46.8	19%	0.186	26%	0.257	C	S	.	.	I	π-helix	trans	-67	-51.3	173.5	0	0	0	0	0	111.6	L55 A56 Y57 T61 L63 S64	L55-G59 VanDerWaalsContact O-CA 3.24Å; L55-G59 WeakPolarHBondContact O-CA 3Å; L55-G59 PolarHBondContact O-N 2.92Å; A56-G59 PolarHBondContact O-N 3.46Å; Y57-G59 VanDerWaalsContact C-N 3.32Å; Y57-G59 PolarHBondContact O-N 2.97Å; G59-T61 VanDerWaalsContact C-N 3.32Å; G59-T61 PolarHBondContact O-N 3.08Å; G59-L63 WeakPolarHBondContact O-CB 3.4Å; G59-S64 PolarHBondContact O-N 2.84Å; G59-S64 PolarHBondContact O-OG 3.07Å; G59-S64 VanDerWaalsContact O-OG 3.06Å
60	L	94.8	Very high	94.2	Very high	130 Å²	130	45.9 Å²	45.9	68%	0.681	25%	0.251	S	S	*	.	I	π-helix	trans	-68.1	-32	179.6	-68	172.6	0	0	0	112.7	A56 S64	A56-L60 WeakPolarHBondContact O-CB 3.39Å; A56-L60 VanDerWaalsContact O-CG 3.29Å; A56-L60 WeakPolarHBondContact O-CG 3.23Å; A56-L60 PolarHBondContact O-N 3.19Å; L60-S64 VanDerWaalsContact O-CB 3.26Å; L60-S64 WeakPolarHBondContact O-CB 3.26Å; L60-S64 PolarHBondContact O-OG 3.15Å
61	T	94.6	Very high	94.2	Very high	18 Å²	18	43.5 Å²	43.5	11%	0.11	24%	0.24	C	C	.	.	I	π-helix	trans	-90.9	-84.5	179	56.3	0	0	0	0	111.5	Y57 Y58 G59 L63 S64 G65 Y66	Y57-T61 WeakPolarHBondContact O-CB 3.11Å; Y57-T61 WeakPolarHBondContact O-CG2 3.43Å; Y57-T61 PolarHBondContact O-N 2.81Å; Y57-T61 VanDerWaalsContact O-N 3.14Å; Y57-T61 PolarHBondContact O-OG1 3.35Å; Y58-T61 WeakPolarHBondContact CA-OG1 3.15Å; G59-T61 VanDerWaalsContact C-N 3.32Å; G59-T61 PolarHBondContact O-N 3.08Å; T61-L63 PolarHBondContact O-N 2.7Å; T61-S64 PolarHBondContact O-N 3.18Å; T61-G65 PolarHBondContact O-N 2.97Å; T61-Y66 CarbonylContact C-O 3.49Å; T61-Y66 VanDerWaalsContact C-O 3.29Å; T61-Y66 PolarHBondContact O-N 3.21Å
62	T	92.6	Very high	94.3	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.006	27%	0.265	C	S	.	.	I	π-helix	trans	-65.9	-42.4	-168.5	-55.5	0	0	0	0	113.2	Y58 G65 T68 R92 F95 V96	Y58-T62 PolarHBondContact O-N 3.17Å; T62-G65 PolarHBondContact O-N 3.49Å; T62-T68 WeakPolarHBondContact OG1-CG2 3.41Å; T62-R92 HydrophobicContact CG2-CB 4.11Å; T62-R92 HydrophobicContact CG2-CG 4.18Å; T62-R92 WeakPolarHBondContact O-CD 3.26Å; T62-F95 HydrophobicContact CG2-CD1 3.92Å; T62-F95 HydrophobicContact CG2-CE1 4.11Å; T62-V96 HydrophobicContact CG2-CG2 4.46Å
63	L	93	Very high	94.3	Very high	68 Å²	68	51.2 Å²	51.2	36%	0.356	27%	0.267	S	S	.	.	I	π-helix	trans	-69.4	-41.6	-180	-61.8	-176.9	0	0	0	112.2	Y58 G59 T61 G65 R92 C93 V96	Y58-L63 PolarHBondContact O-N 2.92Å; G59-L63 WeakPolarHBondContact O-CB 3.4Å; T61-L63 PolarHBondContact O-N 2.7Å; L63-G65 PolarHBondContact O-N 2.94Å; L63-R92 HydrophobicContact CD2-CB 4.2Å; L63-C93 HydrophobicContact CD2-CB 4.28Å; L63-V96 HydrophobicContact CD1-CG1 4.32Å; L63-V96 HydrophobicContact CD2-CB 4.11Å; L63-V96 HydrophobicContact CD2-CG2 3.74Å; L63-V96 HydrophobicContact CG-CB 4.4Å; L63-V96 HydrophobicContact CG-CG2 3.94Å
64	S	93	Very high	94.1	Very high	72 Å²	72	51.6 Å²	51.6	50%	0.503	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-22.5	172.2	-59.8	0	0	0	0	113	G59 L60 T61	G59-S64 PolarHBondContact O-N 2.84Å; G59-S64 PolarHBondContact O-OG 3.07Å; G59-S64 VanDerWaalsContact O-OG 3.06Å; L60-S64 VanDerWaalsContact O-CB 3.26Å; L60-S64 WeakPolarHBondContact O-CB 3.26Å; L60-S64 PolarHBondContact O-OG 3.15Å; T61-S64 PolarHBondContact O-N 3.18Å
65	G	89.3	Confident	94	Very high	34 Å²	34	51.9 Å²	51.9	35%	0.351	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.1	16.2	179.1	0	0	0	0	0	115.7	T61 T62 L63	T61-G65 PolarHBondContact O-N 2.97Å; T62-G65 PolarHBondContact O-N 3.49Å; L63-G65 PolarHBondContact O-N 2.94Å
66	Y	92.4	Very high	93.9	Very high	172 Å²	172	50 Å²	50	68%	0.675	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-84.2	157.4	164.5	-61.7	-69.8	0	0	0	110.2	T61	T61-Y66 CarbonylContact C-O 3.49Å; T61-Y66 VanDerWaalsContact C-O 3.29Å; T61-Y66 PolarHBondContact O-N 3.21Å
67	Q	94.3	Very high	93.8	Very high	81 Å²	81	50 Å²	50	38%	0.379	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-66.5	150.7	169.6	-70	171.9	-73.8	0	0	109.7	E71 I76	Q67-E71 WeakPolarHBondContact CA-OE2 3.39Å; Q67-E71 HydrophobicContact CB-CB 3.98Å; Q67-E71 HydrophobicContact CG-CB 4.47Å; Q67-I76 PolarHBondContact NE2-O 2.85Å
68	T	95.8	Very high	93.6	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-71.9	161.2	167.3	67.8	0	0	0	0	110.2	D18 Y57 Y58 T62 G70 E71 E72	D18-T68 VanDerWaalsContact OD1-CB 3.23Å; D18-T68 WeakPolarHBondContact OD1-CB 3.3Å; D18-T68 PolarHBondContact OD1-OG1 3.24Å; D18-T68 VanDerWaalsContact OD1-OG1 3.04Å; D18-T68 PolarHBondContact OD2-OG1 3.47Å; Y57-T68 HydrophobicContact CE1-CG2 4.32Å; Y58-T68 HydrophobicContact CD1-CG2 4.36Å; Y58-T68 HydrophobicContact CE1-CG2 4.29Å; T62-T68 WeakPolarHBondContact OG1-CG2 3.41Å; T68-G70 PolarHBondContact O-N 3.32Å; T68-E71 PolarHBondContact N-OE2 3.11Å; T68-E71 WeakPolarHBondContact O-CB 3.15Å; T68-E71 PolarHBondContact O-N 3.43Å; T68-E71 WeakPolarHBondContact OG1-CB 3.3Å; T68-E71 VanDerWaalsContact OG1-CD 3.22Å; T68-E71 WeakPolarHBondContact OG1-CG 3.41Å; T68-E71 PolarHBondContact OG1-N 3Å; T68-E72 PolarHBondContact O-N 2.93Å
69	L	95.8	Very high	93.5	Very high	69 Å²	69	50 Å²	50	36%	0.361	26%	0.262	S	S	.	.	H	α-helix	trans	-61.6	-33.1	179.1	-63.7	175.3	0	0	0	111.9	Y21 Y57 Y73	Y21-L69 HydrophobicContact CD1-CD1 3.94Å; Y21-L69 HydrophobicContact CD2-CB 3.85Å; Y21-L69 HydrophobicContact CD2-CD1 3.62Å; Y21-L69 HydrophobicContact CD2-CG 4.41Å; Y21-L69 HydrophobicContact CE1-CD1 4.22Å; Y21-L69 HydrophobicContact CE2-CB 3.97Å; Y21-L69 HydrophobicContact CE2-CD1 3.91Å; Y21-L69 HydrophobicContact CG-CD1 3.64Å; Y57-L69 HydrophobicContact CE2-CD1 4.2Å; Y57-L69 HydrophobicContact CE2-CG 4.46Å; Y57-L69 PolarHBondContact OH-N 2.76Å; L69-Y73 WeakPolarHBondContact O-CB 3.5Å; L69-Y73 PolarHBondContact O-N 3.03Å
70	G	95.6	Very high	93.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-70.5	-35.1	173.2	0	0	0	0	0	113.5	S14 D18 T68 V74	S14-G70 WeakPolarHBondContact CA-O 3.35Å; S14-G70 WeakPolarHBondContact CB-O 3.12Å; S14-G70 WeakPolarHBondContact O-CA 3.37Å; D18-G70 WeakPolarHBondContact OD1-CA 3.3Å; D18-G70 PolarHBondContact OD1-N 2.82Å; T68-G70 PolarHBondContact O-N 3.32Å; G70-V74 PolarHBondContact O-N 3Å
71	E	94.4	Very high	93	Very high	3 Å²	3	47.3 Å²	47.3	1%	0.014	25%	0.248	C	C	.	.	H	α-helix	trans	-66.4	-44.7	175.1	-74.6	166.8	-179.8	0	0	111.6	Q67 T68 V74 G75 I76 Q78 Y198	Q67-E71 WeakPolarHBondContact CA-OE2 3.39Å; Q67-E71 HydrophobicContact CB-CB 3.98Å; Q67-E71 HydrophobicContact CG-CB 4.47Å; T68-E71 PolarHBondContact N-OE2 3.11Å; T68-E71 WeakPolarHBondContact O-CB 3.15Å; T68-E71 PolarHBondContact O-N 3.43Å; T68-E71 WeakPolarHBondContact OG1-CB 3.3Å; T68-E71 VanDerWaalsContact OG1-CD 3.22Å; T68-E71 WeakPolarHBondContact OG1-CG 3.41Å; T68-E71 PolarHBondContact OG1-N 3Å; E71-V74 PolarHBondContact O-N 3.41Å; E71-G75 PolarHBondContact O-N 3.19Å; E71-I76 HydrophobicContact CB-CG1 4.13Å; E71-I76 HydrophobicContact CG-CD1 4.35Å; E71-I76 HydrophobicContact CG-CG1 4.09Å; E71-I76 PolarHBondContact O-N 3.06Å; E71-Q78 WeakPolarHBondContact OE1-CG 3.25Å; E71-Q78 PolarHBondContact OE1-NE2 3.34Å; E71-Q78 PolarHBondContact OE2-NE2 2.81Å; E71-Y198 HydrophobicContact CG-CE1 3.77Å; E71-Y198 VanDerWaalsContact OE1-CE1 3.22Å; E71-Y198 WeakPolarHBondContact OE1-CE1 3.22Å; E71-Y198 VanDerWaalsContact OE1-CZ 3.3Å; E71-Y198 PolarHBondContact OE1-OH 3.34Å
72	E	93.9	Very high	92.6	Very high	128 Å²	128	50.4 Å²	50.4	60%	0.598	27%	0.27	S	S	*	.	H	α-helix	trans	-63.3	-45.7	175	-172.8	-178.5	178.5	0	0	111.4	T68 V74 G75	T68-E72 PolarHBondContact O-N 2.93Å; E72-V74 PolarHBondContact O-N 3.39Å; E72-V74 VanDerWaalsContact O-N 3.16Å; E72-G75 PolarHBondContact O-N 3.3Å; E72-G75 VanDerWaalsContact O-N 3.14Å
73	Y	94.1	Very high	92.3	Very high	154 Å²	154	57.3 Å²	57.3	60%	0.604	30%	0.296	S	S	*	.	H	α-helix	trans	-56.2	-34.3	179.8	178.7	-102.7	0	0	0	113.6	K17 L69	K17-Y73 HydrophobicContact CB-CD1 4.36Å; K17-Y73 HydrophobicContact CG-CD1 4.19Å; K17-Y73 HydrophobicContact CG-CG 4.04Å; L69-Y73 WeakPolarHBondContact O-CB 3.5Å; L69-Y73 PolarHBondContact O-N 3.03Å
74	V	91.8	Very high	91.9	Very high	17 Å²	17	64.9 Å²	64.9	10%	0.103	32%	0.32	C	S	.	.	H	α-helix	trans	-98.8	-16.2	-179.1	-174.3	0	0	0	0	112.6	Q10 R13 G70 E71 E72 I76	Q10-V74 HydrophobicContact CB-CG1 3.49Å; Q10-V74 VanDerWaalsContact CB-CG1 3.49Å; Q10-V74 HydrophobicContact CG-CG1 3.6Å; R13-V74 HydrophobicContact CB-CG2 3.91Å; G70-V74 PolarHBondContact O-N 3Å; E71-V74 PolarHBondContact O-N 3.41Å; E72-V74 PolarHBondContact O-N 3.39Å; E72-V74 VanDerWaalsContact O-N 3.16Å; V74-I76 HydrophobicContact CG1-CG2 4.09Å
75	G	92	Very high	91.7	Very high	18 Å²	18	68.5 Å²	68.5	19%	0.186	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	43.7	-174.9	0	0	0	0	0	113.2	E71 E72 V201	E71-G75 PolarHBondContact O-N 3.19Å; E72-G75 PolarHBondContact O-N 3.3Å; E72-G75 VanDerWaalsContact O-N 3.14Å; G75-V201 WeakPolarHBondContact O-CB 3.38Å; G75-V201 PolarHBondContact O-N 3.1Å
76	I	92.4	Very high	91.7	Very high	0 Å²	0	72 Å²	72	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	144.6	176.9	61.9	172.2	0	0	0	111.6	A6 Q10 L11 S14 Q67 E71 V74 Y198 L199	A6-I76 HydrophobicContact CB-CG2 3.92Å; Q10-I76 HydrophobicContact CB-CG2 4.26Å; L11-I76 HydrophobicContact CD2-CD1 4.13Å; S14-I76 VanDerWaalsContact OG-CD1 3.31Å; S14-I76 WeakPolarHBondContact OG-CD1 3.46Å; Q67-I76 PolarHBondContact NE2-O 2.85Å; E71-I76 HydrophobicContact CB-CG1 4.13Å; E71-I76 HydrophobicContact CG-CD1 4.35Å; E71-I76 HydrophobicContact CG-CG1 4.09Å; E71-I76 PolarHBondContact O-N 3.06Å; V74-I76 HydrophobicContact CG1-CG2 4.09Å; I76-Y198 HydrophobicContact CB-CD1 4.12Å; I76-Y198 HydrophobicContact CD1-CD1 3.7Å; I76-Y198 HydrophobicContact CD1-CE1 4.04Å; I76-Y198 HydrophobicContact CD1-CG 4.12Å; I76-Y198 HydrophobicContact CG1-CD1 3.95Å; I76-Y198 HydrophobicContact CG1-CE1 4.34Å; I76-L199 WeakPolarHBondContact CA-O 3.42Å
77	V	93.3	Very high	91.7	Very high	45 Å²	45	63.9 Å²	63.9	27%	0.273	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	138.2	-177.8	174.8	0	0	0	0	110.5	Y198 L199 V201	V77-Y198 WeakPolarHBondContact O-CA 3.11Å; V77-L199 PolarHBondContact N-O 3.49Å; V77-L199 PolarHBondContact O-N 2.92Å; V77-V201 HydrophobicContact CB-CG2 4.3Å; V77-V201 HydrophobicContact CG2-CG2 3.43Å; V77-V201 VanDerWaalsContact CG2-CG2 3.43Å
78	Q	93.2	Very high	91.7	Very high	10 Å²	10	62.8 Å²	62.8	5%	0.047	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	132.1	173.4	-64.8	-176.2	15.5	0	0	111.1	E71 P87 I196 Y198	E71-Q78 WeakPolarHBondContact OE1-CG 3.25Å; E71-Q78 PolarHBondContact OE1-NE2 3.34Å; E71-Q78 PolarHBondContact OE2-NE2 2.81Å; Q78-P87 HydrophobicContact CB-CG 4.06Å; Q78-P87 VanDerWaalsContact O-CD 3.28Å; Q78-P87 WeakPolarHBondContact O-CD 3.37Å; Q78-I196 HydrophobicContact CB-CG2 3.9Å; Q78-I196 HydrophobicContact CG-CG2 4.03Å; Q78-Y198 HydrophobicContact CB-CE1 4.34Å; Q78-Y198 HydrophobicContact CG-CD1 4.3Å; Q78-Y198 HydrophobicContact CG-CE1 3.43Å; Q78-Y198 VanDerWaalsContact CG-CE1 3.43Å
79	V	92.5	Very high	91.5	Very high	10 Å²	10	72.7 Å²	72.7	6%	0.061	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	152.7	176	-63.5	0	0	0	0	111.9	R83 S197 L199	V79-R83 HydrophobicContact CG2-CB 4.49Å; V79-R83 HydrophobicContact CG2-CG 4.38Å; V79-S197 WeakPolarHBondContact CG2-O 3.25Å; V79-S197 PolarHBondContact N-O 3.47Å; V79-S197 PolarHBondContact O-N 2.85Å; V79-L199 HydrophobicContact CB-CD1 4.5Å; V79-L199 HydrophobicContact CB-CG 4.43Å; V79-L199 HydrophobicContact CG1-CB 4.41Å; V79-L199 HydrophobicContact CG1-CD1 3.67Å; V79-L199 HydrophobicContact CG1-CG 3.79Å; V79-L199 HydrophobicContact CG2-CD1 4.28Å; V79-L199 HydrophobicContact CG2-CD2 4.41Å; V79-L199 HydrophobicContact CG2-CG 3.8Å
80	D	91	Very high	91.4	Very high	24 Å²	24	72.8 Å²	72.8	13%	0.128	36%	0.356	C	S	.	.			trans	-68.1	166.1	170.6	-148.2	39.2	0	0	0	111.3	S82 R83 Q85 R91	D80-S82 PolarHBondContact O-N 3.47Å; D80-S82 VanDerWaalsContact O-N 3.11Å; D80-R83 WeakPolarHBondContact O-CA 3.47Å; D80-R83 PolarHBondContact O-N 2.86Å; D80-Q85 PolarHBondContact N-O 3.41Å; D80-R91 WeakPolarHBondContact OD1-CD 3.43Å; D80-R91 IonicContact OD1-CZ 2.95Å; D80-R91 IonicContact OD1-NE 3.49Å; D80-R91 PolarHBondContact OD1-NE 2.61Å; D80-R91 IonicContact OD1-NH1 3.16Å; D80-R91 PolarHBondContact OD1-NH1 2.78Å; D80-R91 IonicContact OD2-CZ 3.97Å; D80-R91 IonicContact OD2-NH1 3.21Å; D80-R91 PolarHBondContact OD2-NH1 3.27Å; D80-R91 IonicContact OD2-NH2 3.45Å
81	P	87.9	Confident	91.3	Very high	69 Å²	69	76.9 Å²	76.9	45%	0.448	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-29.6	174.8	-28.5	36.6	0	0	0	113.9	R83 G195	P81-R83 PolarHBondContact O-N 2.9Å; P81-G195 VanDerWaalsContact CD-O 3.29Å; P81-G195 WeakPolarHBondContact CD-O 3.29Å; P81-G195 VanDerWaalsContact CG-O 3.31Å; P81-G195 WeakPolarHBondContact CG-O 3.37Å
82	S	87.1	Confident	91.3	Very high	83 Å²	83	78.1 Å²	78.1	58%	0.58	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-11	173.9	-54.1	0	0	0	0	113.3	D80 R84	D80-S82 PolarHBondContact O-N 3.47Å; D80-S82 VanDerWaalsContact O-N 3.11Å; S82-R84 WeakPolarHBondContact O-CG 3.27Å; S82-R84 PolarHBondContact O-N 2.99Å
83	R	85.6	Confident	91.3	Very high	145 Å²	145	74.5 Å²	74.5	55%	0.547	37%	0.365	S	S	.	.	S	Bend	trans	56.4	13	179.7	-56.4	-176.3	-176.8	-177.1	0.5	115.9	V79 D80 P81	V79-R83 HydrophobicContact CG2-CB 4.49Å; V79-R83 HydrophobicContact CG2-CG 4.38Å; D80-R83 WeakPolarHBondContact O-CA 3.47Å; D80-R83 PolarHBondContact O-N 2.86Å; P81-R83 PolarHBondContact O-N 2.9Å
84	R	84.7	Confident	91.3	Very high	227 Å²	227	70.9 Å²	70.9	86%	0.857	36%	0.355	S	S	*	.	S	Bend	trans	-111.6	-15.7	-174.9	-71.4	175	-175.1	-168.6	0.9	113.7	S82	S82-R84 WeakPolarHBondContact O-CG 3.27Å; S82-R84 PolarHBondContact O-N 2.99Å
85	Q	88.1	Confident	91.5	Very high	148 Å²	148	70.1 Å²	70.1	69%	0.692	35%	0.35	S	S	*	.	S	Bend	trans	-139.3	156.4	-174.4	-64.6	-176.9	3.5	0	0	110.4	D80	D80-Q85 PolarHBondContact N-O 3.41Å
86	I	90.1	Very high	91.5	Very high	109 Å²	109	69.4 Å²	69.4	56%	0.559	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-69.1	141.8	173.7	-45.1	175.2	0	0	0	108
87	P	92.6	Very high	91.5	Very high	1 Å²	1	73.2 Å²	73.2	1%	0.006	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-55	143.3	-178	-27.1	32.8	0	0	0	112.4	Q78 R91 R92 I196	Q78-P87 HydrophobicContact CB-CG 4.06Å; Q78-P87 VanDerWaalsContact O-CD 3.28Å; Q78-P87 WeakPolarHBondContact O-CD 3.37Å; P87-R91 HydrophobicContact CB-CB 4.4Å; P87-R92 HydrophobicContact CB-CG 4Å; P87-R92 PolarHBondContact O-NE 3.13Å; P87-R92 PolarHBondContact O-NH2 2.97Å; P87-I196 HydrophobicContact CB-CD1 4.39Å; P87-I196 HydrophobicContact CB-CG1 4.24Å; P87-I196 HydrophobicContact CG-CD1 4.48Å; P87-I196 HydrophobicContact CG-CG1 4.13Å; P87-I196 HydrophobicContact CG-CG2 3.91Å
88	S	93.4	Very high	91.5	Very high	57 Å²	57	72.7 Å²	72.7	40%	0.399	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-62.6	155.2	174.4	62.2	0	0	0	0	111.7	A90 R91 R92	S88-A90 PolarHBondContact O-N 2.77Å; S88-A90 VanDerWaalsContact O-N 3.17Å; S88-R91 PolarHBondContact O-N 2.74Å; S88-R91 WeakPolarHBondContact OG-CG 3.49Å; S88-R92 PolarHBondContact O-N 3.46Å; S88-R92 VanDerWaalsContact O-N 3.1Å
89	R	92.4	Very high	91.4	Very high	210 Å²	210	73.6 Å²	73.6	79%	0.792	37%	0.365	S	S	*	.	H	α-helix	trans	-54.3	-36.3	177.3	-68.9	-174.5	178	177.5	-0.7	112.5	R92 C93	R89-R92 PolarHBondContact O-N 3.42Å; R89-C93 VanDerWaalsContact O-CB 3.26Å; R89-C93 WeakPolarHBondContact O-CB 3.43Å; R89-C93 PolarHBondContact O-N 2.87Å
90	A	93.6	Very high	91.3	Very high	71 Å²	71	73.3 Å²	73.3	59%	0.587	36%	0.363	S	S	*	.	H	α-helix	trans	-62.1	-43.6	177.3	0	0	0	0	0	112.6	S88 C93 L94	S88-A90 PolarHBondContact O-N 2.77Å; S88-A90 VanDerWaalsContact O-N 3.17Å; A90-C93 PolarHBondContact O-N 3.36Å; A90-L94 WeakPolarHBondContact O-CB 3.28Å; A90-L94 PolarHBondContact O-N 2.93Å
91	R	93.6	Very high	91.2	Very high	85 Å²	85	75.2 Å²	75.2	32%	0.321	37%	0.37	S	S	.	.	H	α-helix	trans	-70.1	-38.4	178.9	-67.8	176.1	-172.4	-146	3.1	111.9	D80 P87 S88 L94 F95	D80-R91 WeakPolarHBondContact OD1-CD 3.43Å; D80-R91 IonicContact OD1-CZ 2.95Å; D80-R91 IonicContact OD1-NE 3.49Å; D80-R91 PolarHBondContact OD1-NE 2.61Å; D80-R91 IonicContact OD1-NH1 3.16Å; D80-R91 PolarHBondContact OD1-NH1 2.78Å; D80-R91 IonicContact OD2-CZ 3.97Å; D80-R91 IonicContact OD2-NH1 3.21Å; D80-R91 PolarHBondContact OD2-NH1 3.27Å; D80-R91 IonicContact OD2-NH2 3.45Å; P87-R91 HydrophobicContact CB-CB 4.4Å; S88-R91 PolarHBondContact O-N 2.74Å; S88-R91 WeakPolarHBondContact OG-CG 3.49Å; R91-L94 PolarHBondContact O-N 3.34Å; R91-F95 WeakPolarHBondContact O-CB 3.37Å; R91-F95 PolarHBondContact O-N 2.65Å
92	R	94.3	Very high	91.3	Very high	29 Å²	29	75.5 Å²	75.5	11%	0.109	37%	0.371	C	S	.	.	H	α-helix	trans	-64	-44.1	173.6	-62.2	-168.5	-149.8	154.8	-0.7	111.3	T62 L63 P87 S88 R89 F95 V96	T62-R92 HydrophobicContact CG2-CB 4.11Å; T62-R92 HydrophobicContact CG2-CG 4.18Å; T62-R92 WeakPolarHBondContact O-CD 3.26Å; L63-R92 HydrophobicContact CD2-CB 4.2Å; P87-R92 HydrophobicContact CB-CG 4Å; P87-R92 PolarHBondContact O-NE 3.13Å; P87-R92 PolarHBondContact O-NH2 2.97Å; S88-R92 PolarHBondContact O-N 3.46Å; S88-R92 VanDerWaalsContact O-N 3.1Å; R89-R92 PolarHBondContact O-N 3.42Å; R92-F95 WeakPolarHBondContact O-CB 3.35Å; R92-F95 PolarHBondContact O-N 3.08Å; R92-V96 WeakPolarHBondContact O-CG2 3.33Å; R92-V96 PolarHBondContact O-N 2.99Å
93	C	94.2	Very high	91.3	Very high	53 Å²	53	74.9 Å²	74.9	36%	0.358	37%	0.365	S	S	.	.	H	α-helix	trans	-59.6	-48.6	174.1	-172.3	0	0	0	0	111.3	L63 R89 A90 F95 V96 L97	L63-C93 HydrophobicContact CD2-CB 4.28Å; R89-C93 VanDerWaalsContact O-CB 3.26Å; R89-C93 WeakPolarHBondContact O-CB 3.43Å; R89-C93 PolarHBondContact O-N 2.87Å; A90-C93 PolarHBondContact O-N 3.36Å; C93-F95 VanDerWaalsContact C-N 3.31Å; C93-F95 PolarHBondContact O-N 3.02Å; C93-V96 PolarHBondContact O-N 3.04Å; C93-L97 WeakPolarHBondContact O-CB 3.26Å; C93-L97 VanDerWaalsContact O-CG 3.26Å; C93-L97 WeakPolarHBondContact O-CG 3.37Å; C93-L97 PolarHBondContact O-N 3.26Å
94	L	94.8	Very high	91.3	Very high	77 Å²	77	69.4 Å²	69.4	40%	0.403	34%	0.344	S	S	.	.	H	α-helix	trans	-56.2	-45.3	175.1	179.5	63.3	0	0	0	111.8	A90 R91 C98 A194	A90-L94 WeakPolarHBondContact O-CB 3.28Å; A90-L94 PolarHBondContact O-N 2.93Å; R91-L94 PolarHBondContact O-N 3.34Å; L94-C98 WeakPolarHBondContact O-CB 3.12Å; L94-C98 PolarHBondContact O-N 2.99Å; L94-C98 PolarHBondContact O-SG 3.28Å; L94-A194 HydrophobicContact CD2-CB 4.33Å; L94-A194 HydrophobicContact CG-CB 4.44Å
95	F	94.1	Very high	91.5	Very high	1 Å²	1	61.5 Å²	61.5	0%	0.004	32%	0.319	C	S	.	.	H	α-helix	trans	-58.5	-52.1	175.9	159.2	-110.4	0	0	0	111.9	Y58 T62 R91 R92 C93 C98 H99 S190 K191 A194 I196	Y58-F95 HydrophobicContact CD1-CE1 4.07Å; Y58-F95 HydrophobicContact CD1-CZ 4.38Å; Y58-F95 HydrophobicContact CE1-CE1 4.2Å; Y58-F95 HydrophobicContact CE1-CZ 4.09Å; T62-F95 HydrophobicContact CG2-CD1 3.92Å; T62-F95 HydrophobicContact CG2-CE1 4.11Å; R91-F95 WeakPolarHBondContact O-CB 3.37Å; R91-F95 PolarHBondContact O-N 2.65Å; R92-F95 WeakPolarHBondContact O-CB 3.35Å; R92-F95 PolarHBondContact O-N 3.08Å; C93-F95 VanDerWaalsContact C-N 3.31Å; C93-F95 PolarHBondContact O-N 3.02Å; F95-C98 PolarHBondContact O-N 3.43Å; F95-H99 HydrophobicContact CD2-CB 4.35Å; F95-H99 HydrophobicContact CE2-CB 3.96Å; F95-H99 AromaticContact CE2-CD2 3.98Å; F95-H99 HydrophobicContact CZ-CB 4.4Å; F95-H99 WeakPolarHBondContact O-CB 3.23Å; F95-H99 PolarHBondContact O-N 3.12Å; F95-S190 VanDerWaalsContact CD2-OG 3.27Å; F95-S190 WeakPolarHBondContact CD2-OG 3.25Å; F95-S190 VanDerWaalsContact CE2-OG 3.25Å; F95-S190 WeakPolarHBondContact CE2-OG 3.42Å; F95-K191 HydrophobicContact CD2-CB 4.47Å; F95-K191 HydrophobicContact CD2-CD 4.46Å; F95-K191 HydrophobicContact CD2-CG 3.43Å; F95-K191 VanDerWaalsContact CD2-CG 3.43Å; F95-K191 HydrophobicContact CE2-CD 4.04Å; F95-K191 VanDerWaalsContact CE2-CE 3.4Å; F95-K191 HydrophobicContact CE2-CG 3.39Å; F95-K191 HydrophobicContact CG-CG 4.35Å; F95-K191 VanDerWaalsContact CZ-CE 3.45Å; F95-K191 HydrophobicContact CZ-CG 4.27Å; F95-A194 HydrophobicContact CB-CB 3.94Å; F95-I196 HydrophobicContact CB-CD1 3.74Å; F95-I196 HydrophobicContact CG-CD1 4.27Å
96	V	93.8	Very high	91.4	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.018	30%	0.302	C	S	.	.	H	α-helix	trans	-64.3	-43.5	-177.4	175.4	0	0	0	0	111	L55 Y58 T62 L63 R92 C93 H99 A100	L55-V96 HydrophobicContact CD2-CG1 3.96Å; Y58-V96 HydrophobicContact CG-CG2 4.43Å; T62-V96 HydrophobicContact CG2-CG2 4.46Å; L63-V96 HydrophobicContact CD1-CG1 4.32Å; L63-V96 HydrophobicContact CD2-CB 4.11Å; L63-V96 HydrophobicContact CD2-CG2 3.74Å; L63-V96 HydrophobicContact CG-CB 4.4Å; L63-V96 HydrophobicContact CG-CG2 3.94Å; R92-V96 WeakPolarHBondContact O-CG2 3.33Å; R92-V96 PolarHBondContact O-N 2.99Å; C93-V96 PolarHBondContact O-N 3.04Å; V96-H99 PolarHBondContact O-N 3.5Å; V96-A100 WeakPolarHBondContact O-CB 3.3Å; V96-A100 PolarHBondContact O-N 3.43Å
97	L	92.1	Very high	91.2	Very high	80 Å²	80	56.8 Å²	56.8	42%	0.419	30%	0.296	S	S	.	.	H	α-helix	trans	-62.3	-48.7	176.8	-69.2	178	0	0	0	111.3	C93 H99 F101	C93-L97 WeakPolarHBondContact O-CB 3.26Å; C93-L97 VanDerWaalsContact O-CG 3.26Å; C93-L97 WeakPolarHBondContact O-CG 3.37Å; C93-L97 PolarHBondContact O-N 3.26Å; L97-H99 VanDerWaalsContact C-N 3.32Å; L97-H99 PolarHBondContact O-N 2.98Å; L97-F101 HydrophobicContact CD2-CD2 3.61Å; L97-F101 HydrophobicContact CD2-CE2 3.5Å; L97-F101 VanDerWaalsContact CD2-CE2 3.5Å; L97-F101 HydrophobicContact CD2-CZ 4.5Å; L97-F101 WeakPolarHBondContact O-CA 3.23Å; L97-F101 VanDerWaalsContact O-CB 3.28Å; L97-F101 WeakPolarHBondContact O-CB 3.32Å; L97-F101 PolarHBondContact O-N 3.05Å
98	C	92.6	Very high	90.7	Very high	35 Å²	35	58.1 Å²	58.1	24%	0.236	30%	0.302	C	S	.	.	H	α-helix	trans	-64.9	-36	178	-72.8	0	0	0	0	112.7	L94 F95 V102	L94-C98 WeakPolarHBondContact O-CB 3.12Å; L94-C98 PolarHBondContact O-N 2.99Å; L94-C98 PolarHBondContact O-SG 3.28Å; F95-C98 PolarHBondContact O-N 3.43Å; C98-V102 HydrophobicContact CB-CG2 4.33Å; C98-V102 VanDerWaalsContact O-CB 3.26Å; C98-V102 WeakPolarHBondContact O-CB 3.39Å; C98-V102 WeakPolarHBondContact O-CG2 3.45Å
99	H	91	Very high	90.4	Very high	29 Å²	29	57.2 Å²	57.2	13%	0.134	30%	0.298	C	S	.	.	H	α-helix	trans	-75.7	-39.9	-176.9	-168.7	-86.7	0	0	0	112.5	R22 Y58 F95 V96 L97 P103 H188 S190	R22-H99 PolarHBondContact NH1-CE1 3.28Å; Y58-H99 AromaticContact CE2-CE1 3.89Å; Y58-H99 AromaticContact CE2-ND1 3.57Å; F95-H99 HydrophobicContact CD2-CB 4.35Å; F95-H99 HydrophobicContact CE2-CB 3.96Å; F95-H99 AromaticContact CE2-CD2 3.98Å; F95-H99 HydrophobicContact CZ-CB 4.4Å; F95-H99 WeakPolarHBondContact O-CB 3.23Å; F95-H99 PolarHBondContact O-N 3.12Å; V96-H99 PolarHBondContact O-N 3.5Å; L97-H99 VanDerWaalsContact C-N 3.32Å; L97-H99 PolarHBondContact O-N 2.98Å; H99-P103 WeakPolarHBondContact O-CD 3.41Å; H99-P103 VanDerWaalsContact O-CG 3.29Å; H99-P103 WeakPolarHBondContact O-CG 3.46Å; H99-H188 AromaticContact NE2-CE1 3.68Å; H99-H188 AromaticContact NE2-CG 3.97Å; H99-H188 AromaticContact NE2-ND1 3.59Å; H99-S190 WeakPolarHBondContact CB-OG 3.48Å; H99-S190 PolarHBondContact CD2-OG 3Å; H99-S190 VanDerWaalsContact CD2-OG 3.3Å
100	A	90.1	Very high	90	Very high	3 Å²	3	48.3 Å²	48.3	3%	0.025	27%	0.266	C	S	.	.	H	α-helix	trans	-90.8	-47.6	-177.1	0	0	0	0	0	112.8	L51 L55 V96	L51-A100 HydrophobicContact CD1-CB 3.96Å; L51-A100 WeakPolarHBondContact CD1-O 3.48Å; L55-A100 HydrophobicContact CD2-CB 3.64Å; L55-A100 HydrophobicContact CG-CB 4.2Å; V96-A100 WeakPolarHBondContact O-CB 3.3Å; V96-A100 PolarHBondContact O-N 3.43Å
101	F	89.1	Confident	89.5	Confident	64 Å²	64	48 Å²	48	28%	0.281	26%	0.256	S	S	.	.	H	α-helix	trans	-83.6	-38.7	-171.4	-74	-91.9	0	0	0	114	L51 L55 L97 Y104 L105	L51-F101 HydrophobicContact CD2-CD1 4.28Å; L51-F101 HydrophobicContact CD2-CE1 4.1Å; L55-F101 HydrophobicContact CD1-CE1 4.44Å; L55-F101 HydrophobicContact CD1-CE2 3.62Å; L55-F101 HydrophobicContact CD1-CZ 3.53Å; L55-F101 HydrophobicContact CD2-CD2 4.06Å; L55-F101 HydrophobicContact CD2-CE2 3.48Å; L55-F101 VanDerWaalsContact CD2-CE2 3.48Å; L55-F101 HydrophobicContact CD2-CZ 4.28Å; L55-F101 HydrophobicContact CG-CE2 4.16Å; L97-F101 HydrophobicContact CD2-CD2 3.61Å; L97-F101 HydrophobicContact CD2-CE2 3.5Å; L97-F101 VanDerWaalsContact CD2-CE2 3.5Å; L97-F101 HydrophobicContact CD2-CZ 4.5Å; L97-F101 WeakPolarHBondContact O-CA 3.23Å; L97-F101 VanDerWaalsContact O-CB 3.28Å; L97-F101 WeakPolarHBondContact O-CB 3.32Å; L97-F101 PolarHBondContact O-N 3.05Å; F101-Y104 PolarHBondContact O-N 2.91Å; F101-L105 HydrophobicContact CB-CD1 4.26Å; F101-L105 VanDerWaalsContact O-CB 3.31Å; F101-L105 WeakPolarHBondContact O-CB 3.32Å; F101-L105 VanDerWaalsContact O-CG 3.23Å; F101-L105 WeakPolarHBondContact O-CG 3.46Å; F101-L105 PolarHBondContact O-N 3.33Å
102	V	89.4	Confident	88.9	Confident	76 Å²	76	44.8 Å²	44.8	46%	0.461	25%	0.247	S	C	.	.	H	α-helix	trans	-58.7	-49.4	-177	175	0	0	0	0	113.1	C98 Y104 L105 L106	C98-V102 HydrophobicContact CB-CG2 4.33Å; C98-V102 VanDerWaalsContact O-CB 3.26Å; C98-V102 WeakPolarHBondContact O-CB 3.39Å; C98-V102 WeakPolarHBondContact O-CG2 3.45Å; V102-Y104 VanDerWaalsContact C-N 3.33Å; V102-Y104 PolarHBondContact O-N 3.3Å; V102-L105 PolarHBondContact O-N 2.82Å; V102-L106 WeakPolarHBondContact O-CB 3.36Å; V102-L106 PolarHBondContact O-N 3.14Å
103	P	87.1	Confident	88.3	Confident	69 Å²	69	45.7 Å²	45.7	45%	0.448	25%	0.254	S	S	.	.	H	α-helix	trans	-62.5	-42	179.7	23.1	-32.5	0	0	0	111.9	H99 L106 E107	H99-P103 WeakPolarHBondContact O-CD 3.41Å; H99-P103 VanDerWaalsContact O-CG 3.29Å; H99-P103 WeakPolarHBondContact O-CG 3.46Å; P103-L106 PolarHBondContact O-N 2.69Å; P103-E107 WeakPolarHBondContact O-CB 3.42Å; P103-E107 PolarHBondContact O-N 2.89Å
104	Y	87.4	Confident	87.8	Confident	31 Å²	31	46.4 Å²	46.4	12%	0.122	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-47.8	176.8	167.8	-86.6	0	0	0	112.2	R47 E48 L51 F101 V102 K108 L135	R47-Y104 HydrophobicContact CB-CE2 4.37Å; E48-Y104 WeakPolarHBondContact OE1-CE2 3.27Å; E48-Y104 PolarHBondContact OE1-OH 3.24Å; E48-Y104 WeakPolarHBondContact OE2-CE2 3.38Å; E48-Y104 VanDerWaalsContact OE2-CZ 3.26Å; E48-Y104 PolarHBondContact OE2-OH 2.81Å; L51-Y104 HydrophobicContact CD2-CD1 4.24Å; L51-Y104 HydrophobicContact CD2-CD2 4.27Å; L51-Y104 HydrophobicContact CD2-CE1 4.37Å; L51-Y104 HydrophobicContact CD2-CE2 4.34Å; L51-Y104 HydrophobicContact CD2-CG 4.2Å; F101-Y104 PolarHBondContact O-N 2.91Å; V102-Y104 VanDerWaalsContact C-N 3.33Å; V102-Y104 PolarHBondContact O-N 3.3Å; Y104-K108 HydrophobicContact CE1-CD 3.98Å; Y104-K108 HydrophobicContact CE2-CD 4.04Å; Y104-K108 VanDerWaalsContact CE2-CE 3.47Å; Y104-K108 PolarHBondContact O-N 3.25Å; Y104-K108 VanDerWaalsContact O-N 3.08Å; Y104-K108 VanDerWaalsContact OH-CE 3.23Å; Y104-K108 WeakPolarHBondContact OH-CE 3.41Å; Y104-K108 PolarHBondContact OH-NZ 3.29Å; Y104-L135 HydrophobicContact CE1-CD2 4.5Å
105	L	87.2	Confident	87	Confident	61 Å²	61	45 Å²	45	32%	0.319	24%	0.244	S	C	.	.	H	α-helix	trans	-67.1	-42.6	-179.6	-72.3	175.1	0	0	0	111.4	F101 V102 K108 A109 L135 L139	F101-L105 HydrophobicContact CB-CD1 4.26Å; F101-L105 VanDerWaalsContact O-CB 3.31Å; F101-L105 WeakPolarHBondContact O-CB 3.32Å; F101-L105 VanDerWaalsContact O-CG 3.23Å; F101-L105 WeakPolarHBondContact O-CG 3.46Å; F101-L105 PolarHBondContact O-N 3.33Å; V102-L105 PolarHBondContact O-N 2.82Å; L105-K108 PolarHBondContact O-N 2.87Å; L105-A109 WeakPolarHBondContact O-CB 3.26Å; L105-A109 PolarHBondContact O-N 3.4Å; L105-L135 HydrophobicContact CD2-CD2 3.57Å; L105-L139 HydrophobicContact CD2-CD1 4.45Å
106	L	87.1	Confident	86.3	Confident	66 Å²	66	46.1 Å²	46.1	35%	0.346	25%	0.25	S	C	.	.	H	α-helix	trans	-62.4	-46.6	-179.8	-178	62.7	0	0	0	110.9	V102 P103 A109 L110 V169	V102-L106 WeakPolarHBondContact O-CB 3.36Å; V102-L106 PolarHBondContact O-N 3.14Å; P103-L106 PolarHBondContact O-N 2.69Å; L106-A109 PolarHBondContact O-N 2.9Å; L106-L110 HydrophobicContact CD1-CD1 3.93Å; L106-L110 HydrophobicContact CD1-CG 4.24Å; L106-L110 HydrophobicContact CG-CD1 3.88Å; L106-L110 WeakPolarHBondContact O-CB 3.36Å; L106-L110 WeakPolarHBondContact O-CD1 3.23Å; L106-L110 WeakPolarHBondContact O-CG 3.38Å; L106-L110 PolarHBondContact O-N 3Å; L106-V169 HydrophobicContact CD2-CG1 3.98Å; L106-V169 HydrophobicContact CD2-CG2 4.05Å
107	E	84.5	Confident	85.4	Confident	92 Å²	92	46.8 Å²	46.8	43%	0.43	25%	0.253	S	S	.	.	H	α-helix	trans	-64.1	-48.4	178.3	-165.6	-168.3	150.6	0	0	111.5	R47 P103 A109 L110 V111	R47-E107 IonicContact CZ-OE1 2.65Å; R47-E107 IonicContact NH1-OE1 3.96Å; R47-E107 PolarHBondContact NH1-OE1 3.38Å; R47-E107 IonicContact NH1-OE2 2.69Å; R47-E107 IonicContact NH2-OE1 3.15Å; R47-E107 PolarHBondContact NH2-OE1 3.1Å; P103-E107 WeakPolarHBondContact O-CB 3.42Å; P103-E107 PolarHBondContact O-N 2.89Å; E107-A109 VanDerWaalsContact C-N 3.34Å; E107-A109 PolarHBondContact O-N 3.13Å; E107-L110 PolarHBondContact O-N 3.23Å; E107-V111 WeakPolarHBondContact O-CG2 3.43Å; E107-V111 PolarHBondContact O-N 2.87Å
108	K	84.1	Confident	84.5	Confident	29 Å²	29	48.2 Å²	48.2	13%	0.126	26%	0.257	C	S	.	.	H	α-helix	trans	-62	-41	177.7	-78.1	-158.5	174.4	-170.9	0	112.5	E48 Y104 L105 C112 L139	E48-K108 IonicContact OE1-NZ 3.29Å; E48-K108 PolarHBondContact OE1-NZ 2.88Å; Y104-K108 HydrophobicContact CE1-CD 3.98Å; Y104-K108 HydrophobicContact CE2-CD 4.04Å; Y104-K108 VanDerWaalsContact CE2-CE 3.47Å; Y104-K108 PolarHBondContact O-N 3.25Å; Y104-K108 VanDerWaalsContact O-N 3.08Å; Y104-K108 VanDerWaalsContact OH-CE 3.23Å; Y104-K108 WeakPolarHBondContact OH-CE 3.41Å; Y104-K108 PolarHBondContact OH-NZ 3.29Å; L105-K108 PolarHBondContact O-N 2.87Å; K108-C112 VanDerWaalsContact O-CB 3.23Å; K108-C112 WeakPolarHBondContact O-CB 3.31Å; K108-C112 PolarHBondContact O-N 3.25Å; K108-L139 HydrophobicContact CB-CD1 4.14Å
109	A	85.6	Confident	83	Confident	38 Å²	38	47.6 Å²	47.6	31%	0.314	26%	0.257	S	S	.	.	H	α-helix	trans	-66.2	-43.7	178.6	0	0	0	0	0	111.7	L105 L106 E107 C112 L113 L139	L105-A109 WeakPolarHBondContact O-CB 3.26Å; L105-A109 PolarHBondContact O-N 3.4Å; L106-A109 PolarHBondContact O-N 2.9Å; E107-A109 VanDerWaalsContact C-N 3.34Å; E107-A109 PolarHBondContact O-N 3.13Å; A109-C112 PolarHBondContact O-N 3.07Å; A109-L113 VanDerWaalsContact O-CB 3.23Å; A109-L113 WeakPolarHBondContact O-CB 3.47Å; A109-L113 PolarHBondContact O-N 3.35Å; A109-L139 HydrophobicContact CB-CD2 4.44Å
110	L	84.4	Confident	81.5	Confident	23 Å²	23	48 Å²	48	12%	0.12	27%	0.269	C	S	.	.	H	α-helix	trans	-63.4	-47	178.1	-74.9	168.1	0	0	0	111.7	L106 E107 C112 L113 E114 V162 I165 Q166	L106-L110 HydrophobicContact CD1-CD1 3.93Å; L106-L110 HydrophobicContact CD1-CG 4.24Å; L106-L110 HydrophobicContact CG-CD1 3.88Å; L106-L110 WeakPolarHBondContact O-CB 3.36Å; L106-L110 WeakPolarHBondContact O-CD1 3.23Å; L106-L110 WeakPolarHBondContact O-CG 3.38Å; L106-L110 PolarHBondContact O-N 3Å; E107-L110 PolarHBondContact O-N 3.23Å; L110-C112 VanDerWaalsContact C-N 3.34Å; L110-C112 PolarHBondContact O-N 3.25Å; L110-L113 PolarHBondContact O-N 2.84Å; L110-E114 WeakPolarHBondContact O-CB 3.31Å; L110-E114 PolarHBondContact O-N 2.94Å; L110-V162 HydrophobicContact CD2-CG1 4.41Å; L110-I165 HydrophobicContact CD2-CG2 3.91Å; L110-Q166 HydrophobicContact CD1-CG 4.14Å; L110-Q166 HydrophobicContact CD2-CG 4.3Å
111	V	83.1	Confident	79.7	Confident	63 Å²	63	53.5 Å²	53.5	38%	0.382	31%	0.305	S	S	.	.	H	α-helix	trans	-63.3	-41.6	177.5	171.7	0	0	0	0	111.1	E107 L113 N115	E107-V111 WeakPolarHBondContact O-CG2 3.43Å; E107-V111 PolarHBondContact O-N 2.87Å; V111-L113 VanDerWaalsContact C-N 3.35Å; V111-N115 WeakPolarHBondContact CG1-ND2 3.44Å; V111-N115 WeakPolarHBondContact O-CB 3.49Å; V111-N115 VanDerWaalsContact O-CG 3.25Å; V111-N115 PolarHBondContact O-N 3.47Å; V111-N115 VanDerWaalsContact O-N 3.08Å; V111-N115 PolarHBondContact O-ND2 3.03Å
112	C	80.4	Confident	78	Confident	18 Å²	18	58.6 Å²	58.6	12%	0.122	33%	0.329	C	S	.	.	H	α-helix	trans	-65.1	-41.1	177.6	-169.8	0	0	0	0	111.9	K108 A109 L110 E116 R140	K108-C112 VanDerWaalsContact O-CB 3.23Å; K108-C112 WeakPolarHBondContact O-CB 3.31Å; K108-C112 PolarHBondContact O-N 3.25Å; A109-C112 PolarHBondContact O-N 3.07Å; L110-C112 VanDerWaalsContact C-N 3.34Å; L110-C112 PolarHBondContact O-N 3.25Å; C112-E116 WeakPolarHBondContact O-CG 3.27Å; C112-E116 PolarHBondContact O-N 2.83Å; C112-E116 VanDerWaalsContact O-N 3.17Å; C112-R140 VanDerWaalsContact SG-CA 3.6Å
113	L	82.8	Confident	76.2	Confident	49 Å²	49	57.7 Å²	57.7	26%	0.257	32%	0.324	S	S	.	.	H	α-helix	trans	-66.5	-47.5	178.9	-174.7	64.3	0	0	0	110.9	A109 L110 V111 N115 E116 L117 V147 V162	A109-L113 VanDerWaalsContact O-CB 3.23Å; A109-L113 WeakPolarHBondContact O-CB 3.47Å; A109-L113 PolarHBondContact O-N 3.35Å; L110-L113 PolarHBondContact O-N 2.84Å; V111-L113 VanDerWaalsContact C-N 3.35Å; L113-N115 PolarHBondContact O-N 3.48Å; L113-E116 PolarHBondContact O-N 3.37Å; L113-L117 HydrophobicContact CD1-CD1 3.47Å; L113-L117 VanDerWaalsContact CD1-CD1 3.47Å; L113-L117 HydrophobicContact CG-CD1 3.68Å; L113-L117 WeakPolarHBondContact O-CD1 3.35Å; L113-L117 PolarHBondContact O-N 2.94Å; L113-V147 HydrophobicContact CD1-CG2 4.21Å; L113-V162 HydrophobicContact CD2-CG2 3.87Å; L113-V162 HydrophobicContact CG-CG2 4.08Å
114	E	83.4	Confident	74.6	Confident	67 Å²	67	62.7 Å²	62.7	31%	0.313	33%	0.334	S	S	.	.	H	α-helix	trans	-56.9	-49.3	177.3	-173.3	167.2	-163.9	0	0	111.7	L110 E116 L117 E118 V162 Q166	L110-E114 WeakPolarHBondContact O-CB 3.31Å; L110-E114 PolarHBondContact O-N 2.94Å; E114-E116 VanDerWaalsContact C-N 3.34Å; E114-E116 PolarHBondContact O-N 3.49Å; E114-L117 PolarHBondContact O-N 3.25Å; E114-L117 VanDerWaalsContact O-N 3.15Å; E114-E118 WeakPolarHBondContact O-CG 3.26Å; E114-E118 PolarHBondContact O-N 2.88Å; E114-V162 HydrophobicContact CB-CG1 4.35Å; E114-Q166 PolarHBondContact OE2-NE2 3.25Å
115	N	78.6	Confident	72.8	Confident	47 Å²	47	71.4 Å²	71.4	25%	0.251	37%	0.367	S	S	.	.	H	α-helix	trans	-60.4	-39.6	177.9	-75.5	-48.7	0	0	0	113.5	V111 L113 G119 Q127	V111-N115 WeakPolarHBondContact CG1-ND2 3.44Å; V111-N115 WeakPolarHBondContact O-CB 3.49Å; V111-N115 VanDerWaalsContact O-CG 3.25Å; V111-N115 PolarHBondContact O-N 3.47Å; V111-N115 VanDerWaalsContact O-N 3.08Å; V111-N115 PolarHBondContact O-ND2 3.03Å; L113-N115 PolarHBondContact O-N 3.48Å; N115-G119 WeakPolarHBondContact O-CA 3.3Å; N115-G119 PolarHBondContact O-N 3.44Å; N115-Q127 PolarHBondContact ND2-NE2 2.96Å
116	E	78	Confident	71.1	Confident	25 Å²	25	78.9 Å²	78.9	12%	0.117	39%	0.391	C	S	.	.	H	α-helix	trans	-74.7	-29.6	177.7	-71.6	-72.8	178	0	0	111.7	C112 L113 E114 Q144 V147 R155	C112-E116 WeakPolarHBondContact O-CG 3.27Å; C112-E116 PolarHBondContact O-N 2.83Å; C112-E116 VanDerWaalsContact O-N 3.17Å; L113-E116 PolarHBondContact O-N 3.37Å; E114-E116 VanDerWaalsContact C-N 3.34Å; E114-E116 PolarHBondContact O-N 3.49Å; E116-Q144 HydrophobicContact CG-CG 4.39Å; E116-Q144 VanDerWaalsContact OE1-CG 3.3Å; E116-Q144 WeakPolarHBondContact OE1-CG 3.24Å; E116-Q144 PolarHBondContact OE1-NE2 2.92Å; E116-V147 HydrophobicContact CB-CG2 4.41Å; E116-R155 PolarHBondContact O-NH2 3.3Å
117	L	75.4	Confident	69.5	Low	17 Å²	17	77.9 Å²	77.9	9%	0.089	38%	0.384	C	S	.	.	H	α-helix	trans	-72.4	-40.4	173.9	-90.1	87.1	0	0	0	112.5	L113 E114 V147 R155 C158 Q159 V162	L113-L117 HydrophobicContact CD1-CD1 3.47Å; L113-L117 VanDerWaalsContact CD1-CD1 3.47Å; L113-L117 HydrophobicContact CG-CD1 3.68Å; L113-L117 WeakPolarHBondContact O-CD1 3.35Å; L113-L117 PolarHBondContact O-N 2.94Å; E114-L117 PolarHBondContact O-N 3.25Å; E114-L117 VanDerWaalsContact O-N 3.15Å; L117-V147 HydrophobicContact CD1-CG2 3.99Å; L117-R155 HydrophobicContact CG-CG 4.5Å; L117-R155 PolarHBondContact O-NE 3.32Å; L117-R155 PolarHBondContact O-NH2 3.4Å; L117-C158 VanDerWaalsContact CD2-C 3.42Å; L117-C158 HydrophobicContact CD2-CB 3.6Å; L117-Q159 HydrophobicContact CD2-CB 4.22Å; L117-Q159 VanDerWaalsContact CD2-N 3.34Å; L117-V162 HydrophobicContact CD2-CG2 4.16Å
118	E	74.1	Confident	67.8	Low	110 Å²	110	78.8 Å²	78.8	51%	0.514	40%	0.396	S	S	.	.	H	α-helix	trans	-81.3	-15.9	179.3	-64.7	-172.1	158.3	0	0	113.5	E114 G120	E114-E118 WeakPolarHBondContact O-CG 3.26Å; E114-E118 PolarHBondContact O-N 2.88Å; E118-G120 PolarHBondContact O-N 3.38Å
119	G	60.4	Low	66.1	Low	23 Å²	23	83.2 Å²	83.2	24%	0.237	43%	0.426	C	S	.	.			trans	-62.5	99	-171.9	0	0	0	0	0	114.4	N115 R155	N115-G119 WeakPolarHBondContact O-CA 3.3Å; N115-G119 PolarHBondContact O-N 3.44Å; G119-R155 PolarHBondContact O-NH2 3.21Å
120	G	59.5	Low	64.5	Low	37 Å²	37	84.1 Å²	84.1	38%	0.381	43%	0.43	S	S	.	.			trans	-72	170.9	146.6	0	0	0	0	0	111.6	E118 E122 T123	E118-G120 PolarHBondContact O-N 3.38Å; G120-E122 PolarHBondContact O-N 3.44Å; G120-T123 PolarHBondContact O-N 3.04Å
121	P	52.9	Low	63.1	Low	119 Å²	119	94.2 Å²	94.2	77%	0.773	47%	0.466	S	S	*	.	H	α-helix	trans	-58.8	-22.5	-171.5	20.1	-31.4	0	0	0	115.2
122	E	52	Low	61.7	Low	170 Å²	170	91.8 Å²	91.8	79%	0.794	45%	0.453	S	S	*	.	H	α-helix	trans	-76.6	-38.1	-179.3	-64.7	-158.3	149.6	0	0	114.1	G120 R124 R125 R126	G120-E122 PolarHBondContact O-N 3.44Å; E122-R124 PolarHBondContact O-N 3.5Å; E122-R125 PolarHBondContact O-N 2.86Å; E122-R125 VanDerWaalsContact O-N 3.17Å; E122-R126 PolarHBondContact O-N 3.35Å
123	T	53.2	Low	60.9	Low	58 Å²	58	97.5 Å²	97.5	36%	0.356	47%	0.472	S	S	.	.	H	α-helix	trans	-63.6	-33.8	177.7	-31.9	0	0	0	0	111	G120 R125 R126 Q127	G120-T123 PolarHBondContact O-N 3.04Å; T123-R125 VanDerWaalsContact C-N 3.3Å; T123-R125 PolarHBondContact O-N 2.98Å; T123-R126 PolarHBondContact O-N 3.18Å; T123-Q127 PolarHBondContact O-N 3.46Å
124	R	53.1	Low	60.1	Low	174 Å²	174	99 Å²	99	66%	0.657	49%	0.486	S	S	*	.	H	α-helix	trans	-65.5	-29.5	177.8	-155.1	171.6	-165.8	178.7	3.7	113.3	E122 T128	E122-R124 PolarHBondContact O-N 3.5Å; R124-T128 PolarHBondContact O-OG1 3.47Å
125	R	50.1	Low	59.6	Low	213 Å²	213	99.1 Å²	99.1	80%	0.804	49%	0.489	S	S	*	.	H	α-helix	trans	-84.1	-26	-178.1	-146.2	175	-170.6	179	1.9	112.9	E122 T123 T128	E122-R125 PolarHBondContact O-N 2.86Å; E122-R125 VanDerWaalsContact O-N 3.17Å; T123-R125 VanDerWaalsContact C-N 3.3Å; T123-R125 PolarHBondContact O-N 2.98Å; R125-T128 PolarHBondContact O-OG1 3.08Å; R125-T128 VanDerWaalsContact O-OG1 3.1Å
126	R	51.1	Low	59.4	Low	218 Å²	218	99.4 Å²	99.4	82%	0.823	49%	0.489	S	S	*	.	H	α-helix	trans	-83.7	-22.1	178	-140.7	162.4	-173.8	165.3	-0.6	113.1	E122 T123 T129	E122-R126 PolarHBondContact O-N 3.35Å; T123-R126 PolarHBondContact O-N 3.18Å; R126-T129 PolarHBondContact O-OG1 3.33Å; R126-T129 VanDerWaalsContact O-OG1 3.11Å
127	Q	53.3	Low	59.4	Low	46 Å²	46	104.5 Å²	104.5	22%	0.215	51%	0.507	C	S	.	.	S	Bend	trans	-89	-11.9	178.2	-78.9	180	-13.8	0	0	114.9	N115 T123 T129 R140	N115-Q127 PolarHBondContact ND2-NE2 2.96Å; T123-Q127 PolarHBondContact O-N 3.46Å; Q127-T129 PolarHBondContact O-N 3.46Å; Q127-R140 PolarHBondContact O-NH1 3.07Å
128	T	48.2	Very low	59.7	Low	111 Å²	111	111.7 Å²	111.7	68%	0.681	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-14.6	179	2.6	0	0	0	0	112.7	R124 R125	R124-T128 PolarHBondContact O-OG1 3.47Å; R125-T128 PolarHBondContact O-OG1 3.08Å; R125-T128 VanDerWaalsContact O-OG1 3.1Å
129	T	48.5	Very low	60	Low	121 Å²	121	107.6 Å²	107.6	74%	0.742	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-13.2	179.5	52.2	0	0	0	0	113.9	R126 Q127 R131	R126-T129 PolarHBondContact O-OG1 3.33Å; R126-T129 VanDerWaalsContact O-OG1 3.11Å; Q127-T129 PolarHBondContact O-N 3.46Å; T129-R131 PolarHBondContact O-N 2.97Å
130	S	52	Low	60.9	Low	58 Å²	58	108.5 Å²	108.5	41%	0.406	51%	0.511	S	S	.	.	S	Bend	trans	-76.4	118	171.4	150.2	0	0	0	0	108.9	A132	S130-A132 PolarHBondContact O-N 3.03Å
131	R	54.3	Low	62	Low	234 Å²	234	114 Å²	114	88%	0.883	52%	0.52	S	S	*	.			trans	-76	67.5	-178.8	-135.3	178.2	-172.2	-178.7	1.2	109.5	T129 W133	T129-R131 PolarHBondContact O-N 2.97Å; R131-W133 PolarHBondContact O-N 3.24Å
132	A	55.4	Low	63.4	Low	12 Å²	12	110.2 Å²	110.2	10%	0.099	50%	0.498	C	S	.	.			trans	-63.7	132.9	-175.6	0	0	0	0	0	111.9	S130 E136 R137	S130-A132 PolarHBondContact O-N 3.03Å; A132-E136 HydrophobicContact CB-CB 4.16Å; A132-E136 HydrophobicContact CB-CG 4.09Å; A132-R137 HydrophobicContact CB-CG 4.18Å; A132-R137 WeakPolarHBondContact O-CD 3.34Å; A132-R137 WeakPolarHBondContact O-CG 3.48Å; A132-R137 PolarHBondContact O-NE 3.41Å
133	W	62.6	Low	64.8	Low	139 Å²	139	102.8 Å²	102.8	53%	0.527	47%	0.466	S	S	.	.			trans	-68.2	174.5	177.4	-100.7	44	0	0	0	113.5	W45 R131 L135 E136 R137	W45-W133 AromaticContact CH2-CE2 3.77Å; W45-W133 AromaticContact CH2-CH2 3.39Å; W45-W133 HydrophobicContact CH2-CH2 3.39Å; W45-W133 AromaticContact CH2-CZ2 2.98Å; W45-W133 HydrophobicContact CH2-CZ2 2.98Å; W45-W133 HydrophobicContact CH2-CZ3 4.45Å; W45-W133 AromaticContact CZ2-CE2 3.51Å; W45-W133 HydrophobicContact CZ2-CH2 4.04Å; W45-W133 AromaticContact CZ2-CZ2 3.17Å; W45-W133 HydrophobicContact CZ2-CZ2 3.17Å; W45-W133 AromaticContact CZ2-NE1 3.58Å; W45-W133 AromaticContact CZ3-CH2 3.88Å; W45-W133 HydrophobicContact CZ3-CH2 3.88Å; W45-W133 AromaticContact CZ3-CZ2 3.87Å; W45-W133 HydrophobicContact CZ3-CZ2 3.87Å; R131-W133 PolarHBondContact O-N 3.24Å; W133-L135 PolarHBondContact O-N 3.38Å; W133-E136 PolarHBondContact O-N 2.89Å; W133-R137 WeakPolarHBondContact O-CB 3.16Å; W133-R137 VanDerWaalsContact O-CG 3.28Å; W133-R137 WeakPolarHBondContact O-CG 3.21Å; W133-R137 PolarHBondContact O-N 3.32Å; W133-R137 PolarHBondContact O-NE 3.45Å
134	S	67	Low	66.1	Low	79 Å²	79	103.4 Å²	103.4	55%	0.552	47%	0.465	S	S	*	.	H	α-helix	trans	-57.7	-41.2	-174.1	55.5	0	0	0	0	113.8	R137 W138	S134-R137 PolarHBondContact O-N 2.91Å; S134-W138 WeakPolarHBondContact O-CB 3.47Å; S134-W138 PolarHBondContact O-N 2.71Å
135	L	72.7	Confident	67.5	Low	71 Å²	71	103.9 Å²	103.9	37%	0.372	47%	0.467	S	S	.	.	H	α-helix	trans	-73.3	-39.8	-177	-159.1	145.8	0	0	0	112	Y104 L105 W133 W138 L139	Y104-L135 HydrophobicContact CE1-CD2 4.5Å; L105-L135 HydrophobicContact CD2-CD2 3.57Å; W133-L135 PolarHBondContact O-N 3.38Å; L135-W138 PolarHBondContact O-N 3.07Å; L135-L139 HydrophobicContact CD2-CD1 3.67Å; L135-L139 HydrophobicContact CD2-CG 4.15Å; L135-L139 WeakPolarHBondContact O-CB 3.49Å; L135-L139 WeakPolarHBondContact O-CG 3.44Å; L135-L139 PolarHBondContact O-N 2.88Å
136	E	74.4	Confident	69	Low	53 Å²	53	96.1 Å²	96.1	25%	0.248	45%	0.448	C	S	.	.	H	α-helix	trans	-68.3	-38.9	173.2	-169	-174.8	152.4	0	0	111.5	A132 W133 W138 L139 R140	A132-E136 HydrophobicContact CB-CB 4.16Å; A132-E136 HydrophobicContact CB-CG 4.09Å; W133-E136 PolarHBondContact O-N 2.89Å; E136-W138 VanDerWaalsContact C-N 3.29Å; E136-W138 PolarHBondContact O-N 3.07Å; E136-L139 PolarHBondContact O-N 3.05Å; E136-R140 WeakPolarHBondContact O-CB 3.28Å; E136-R140 PolarHBondContact O-N 2.9Å; E136-R140 IonicContact OE1-NH2 2.96Å; E136-R140 PolarHBondContact OE1-NH2 3.19Å
137	R	76.7	Confident	70.4	Confident	132 Å²	132	86.6 Å²	86.6	50%	0.498	41%	0.414	S	S	.	.	H	α-helix	trans	-60.8	-39.5	170.7	-76.9	-179.9	-74	-169.9	-4.3	111.7	A132 W133 S134 R141	A132-R137 HydrophobicContact CB-CG 4.18Å; A132-R137 WeakPolarHBondContact O-CD 3.34Å; A132-R137 WeakPolarHBondContact O-CG 3.48Å; A132-R137 PolarHBondContact O-NE 3.41Å; W133-R137 WeakPolarHBondContact O-CB 3.16Å; W133-R137 VanDerWaalsContact O-CG 3.28Å; W133-R137 WeakPolarHBondContact O-CG 3.21Å; W133-R137 PolarHBondContact O-N 3.32Å; W133-R137 PolarHBondContact O-NE 3.45Å; S134-R137 PolarHBondContact O-N 2.91Å; R137-R141 WeakPolarHBondContact O-CB 3.49Å; R137-R141 VanDerWaalsContact O-CG 3.22Å; R137-R141 WeakPolarHBondContact O-CG 3.47Å; R137-R141 PolarHBondContact O-N 2.88Å
138	W	81.9	Confident	71.6	Confident	167 Å²	167	87.5 Å²	87.5	63%	0.633	44%	0.436	S	S	*	.	H	α-helix	trans	-67.2	-49.7	176.8	-178.5	89.4	0	0	0	111.5	S134 L135 E136 R140 R141 A142	S134-W138 WeakPolarHBondContact O-CB 3.47Å; S134-W138 PolarHBondContact O-N 2.71Å; L135-W138 PolarHBondContact O-N 3.07Å; E136-W138 VanDerWaalsContact C-N 3.29Å; E136-W138 PolarHBondContact O-N 3.07Å; W138-R140 VanDerWaalsContact C-N 3.29Å; W138-R140 PolarHBondContact O-N 2.95Å; W138-R141 PolarHBondContact O-N 3.4Å; W138-A142 WeakPolarHBondContact O-CB 3.08Å; W138-A142 PolarHBondContact O-N 3Å
139	L	81.4	Confident	73.2	Confident	24 Å²	24	89.3 Å²	89.3	13%	0.126	44%	0.441	C	S	.	.	H	α-helix	trans	-57.6	-43.2	175.8	-76.7	171.9	0	0	0	111.3	L105 K108 A109 L135 E136 A142 A143	L105-L139 HydrophobicContact CD2-CD1 4.45Å; K108-L139 HydrophobicContact CB-CD1 4.14Å; A109-L139 HydrophobicContact CB-CD2 4.44Å; L135-L139 HydrophobicContact CD2-CD1 3.67Å; L135-L139 HydrophobicContact CD2-CG 4.15Å; L135-L139 WeakPolarHBondContact O-CB 3.49Å; L135-L139 WeakPolarHBondContact O-CG 3.44Å; L135-L139 PolarHBondContact O-N 2.88Å; E136-L139 PolarHBondContact O-N 3.05Å; L139-A142 PolarHBondContact O-N 2.93Å; L139-A143 VanDerWaalsContact O-CB 3.31Å; L139-A143 WeakPolarHBondContact O-CB 3.3Å; L139-A143 PolarHBondContact O-N 2.93Å
140	R	79.4	Confident	74.8	Confident	42 Å²	42	86.6 Å²	86.6	16%	0.158	42%	0.421	C	S	.	.	H	α-helix	trans	-64.4	-45.1	177.1	-165.4	-178.4	-60.9	-175.4	2.7	111.8	C112 Q127 E136 W138 A142 A143 Q144	C112-R140 VanDerWaalsContact SG-CA 3.6Å; Q127-R140 PolarHBondContact O-NH1 3.07Å; E136-R140 WeakPolarHBondContact O-CB 3.28Å; E136-R140 PolarHBondContact O-N 2.9Å; E136-R140 IonicContact OE1-NH2 2.96Å; E136-R140 PolarHBondContact OE1-NH2 3.19Å; W138-R140 VanDerWaalsContact C-N 3.29Å; W138-R140 PolarHBondContact O-N 2.95Å; R140-A142 VanDerWaalsContact C-N 3.33Å; R140-A142 PolarHBondContact O-N 3.22Å; R140-A143 PolarHBondContact O-N 3.47Å; R140-Q144 VanDerWaalsContact O-CB 3.3Å; R140-Q144 WeakPolarHBondContact O-CB 3.26Å; R140-Q144 WeakPolarHBondContact O-CG 3.37Å; R140-Q144 PolarHBondContact O-N 2.89Å
141	R	81.3	Confident	76.2	Confident	154 Å²	154	88.2 Å²	88.2	58%	0.581	43%	0.429	S	S	*	.	H	α-helix	trans	-62.7	-39.9	174.6	-75.5	173.5	-175.6	176	0.9	112	R137 W138 R145	R137-R141 WeakPolarHBondContact O-CB 3.49Å; R137-R141 VanDerWaalsContact O-CG 3.22Å; R137-R141 WeakPolarHBondContact O-CG 3.47Å; R137-R141 PolarHBondContact O-N 2.88Å; W138-R141 PolarHBondContact O-N 3.4Å; R141-R145 WeakPolarHBondContact O-CB 3.38Å; R141-R145 VanDerWaalsContact O-CG 3.23Å; R141-R145 WeakPolarHBondContact O-CG 3.26Å; R141-R145 PolarHBondContact O-N 3.38Å
142	A	83.1	Confident	77.3	Confident	38 Å²	38	82.9 Å²	82.9	31%	0.314	41%	0.414	S	S	.	.	H	α-helix	trans	-65.4	-45.2	176.6	0	0	0	0	0	111.1	W138 L139 R140 R145 A146	W138-A142 WeakPolarHBondContact O-CB 3.08Å; W138-A142 PolarHBondContact O-N 3Å; L139-A142 PolarHBondContact O-N 2.93Å; R140-A142 VanDerWaalsContact C-N 3.33Å; R140-A142 PolarHBondContact O-N 3.22Å; A142-R145 PolarHBondContact O-N 3.34Å; A142-A146 WeakPolarHBondContact O-CB 3.34Å; A142-A146 PolarHBondContact O-N 3.38Å
143	A	81.5	Confident	78.1	Confident	14 Å²	14	92.8 Å²	92.8	12%	0.116	45%	0.449	C	S	.	.	H	α-helix	trans	-62	-45.4	174.9	0	0	0	0	0	111.6	L139 R140 R145 A146 V147	L139-A143 VanDerWaalsContact O-CB 3.31Å; L139-A143 WeakPolarHBondContact O-CB 3.3Å; L139-A143 PolarHBondContact O-N 2.93Å; R140-A143 PolarHBondContact O-N 3.47Å; A143-R145 PolarHBondContact O-N 2.82Å; A143-A146 PolarHBondContact O-N 3.02Å; A143-V147 WeakPolarHBondContact O-CB 3.29Å; A143-V147 VanDerWaalsContact O-CG2 3.27Å; A143-V147 WeakPolarHBondContact O-CG2 3.42Å; A143-V147 PolarHBondContact O-N 3.42Å
144	Q	81.4	Confident	78.8	Confident	71 Å²	71	90.8 Å²	90.8	33%	0.332	45%	0.445	S	S	.	.	H	α-helix	trans	-63	-39.7	176.4	-75.6	173.7	-8.8	0	0	112.6	E116 R140 G148	E116-Q144 HydrophobicContact CG-CG 4.39Å; E116-Q144 VanDerWaalsContact OE1-CG 3.3Å; E116-Q144 WeakPolarHBondContact OE1-CG 3.24Å; E116-Q144 PolarHBondContact OE1-NE2 2.92Å; R140-Q144 VanDerWaalsContact O-CB 3.3Å; R140-Q144 WeakPolarHBondContact O-CB 3.26Å; R140-Q144 WeakPolarHBondContact O-CG 3.37Å; R140-Q144 PolarHBondContact O-N 2.89Å; Q144-G148 WeakPolarHBondContact O-CA 3.21Å; Q144-G148 PolarHBondContact O-N 2.66Å
145	R	82.3	Confident	79.3	Confident	184 Å²	184	89.9 Å²	89.9	69%	0.694	43%	0.43	S	S	*	.	H	α-helix	trans	-64.8	-45.7	173.4	-76.1	173.7	-177.2	174.8	-1.1	111.1	R141 A142 A143 G148 L149	R141-R145 WeakPolarHBondContact O-CB 3.38Å; R141-R145 VanDerWaalsContact O-CG 3.23Å; R141-R145 WeakPolarHBondContact O-CG 3.26Å; R141-R145 PolarHBondContact O-N 3.38Å; A142-R145 PolarHBondContact O-N 3.34Å; A143-R145 PolarHBondContact O-N 2.82Å; R145-G148 PolarHBondContact O-N 2.75Å; R145-L149 VanDerWaalsContact O-CG 3.3Å; R145-L149 WeakPolarHBondContact O-CG 3.28Å; R145-L149 PolarHBondContact O-N 3.38Å
146	A	81.6	Confident	79.4	Confident	50 Å²	50	93.9 Å²	93.9	41%	0.413	44%	0.444	S	S	.	.	H	α-helix	trans	-62.3	-46.8	178.6	0	0	0	0	0	111.7	A142 A143 L149 L150	A142-A146 WeakPolarHBondContact O-CB 3.34Å; A142-A146 PolarHBondContact O-N 3.38Å; A143-A146 PolarHBondContact O-N 3.02Å; A146-L149 PolarHBondContact O-N 3.39Å; A146-L150 WeakPolarHBondContact O-CD1 3.34Å
147	V	80.3	Confident	79.6	Confident	18 Å²	18	94.4 Å²	94.4	11%	0.109	46%	0.457	C	S	.	.	H	α-helix	trans	-68.4	-35.6	177.3	177	0	0	0	0	111.8	L113 E116 L117 A143 L149 L150	L113-V147 HydrophobicContact CD1-CG2 4.21Å; E116-V147 HydrophobicContact CB-CG2 4.41Å; L117-V147 HydrophobicContact CD1-CG2 3.99Å; A143-V147 WeakPolarHBondContact O-CB 3.29Å; A143-V147 VanDerWaalsContact O-CG2 3.27Å; A143-V147 WeakPolarHBondContact O-CG2 3.42Å; A143-V147 PolarHBondContact O-N 3.42Å; V147-L149 PolarHBondContact O-N 3Å; V147-L150 WeakPolarHBondContact O-CB 3.47Å; V147-L150 PolarHBondContact O-N 3.5Å; V147-L150 VanDerWaalsContact O-N 3.1Å
148	G	77.1	Confident	79.7	Confident	65 Å²	65	90 Å²	90	67%	0.67	45%	0.447	S	S	*	.	H	α-helix	trans	-67.8	-20.7	177.2	0	0	0	0	0	114.3	Q144 R145	Q144-G148 WeakPolarHBondContact O-CA 3.21Å; Q144-G148 PolarHBondContact O-N 2.66Å; R145-G148 PolarHBondContact O-N 2.75Å
149	L	82.5	Confident	79.4	Confident	150 Å²	150	86.5 Å²	86.5	79%	0.785	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-14.2	173	-67.9	169.6	0	0	0	113	R145 A146 V147	R145-L149 VanDerWaalsContact O-CG 3.3Å; R145-L149 WeakPolarHBondContact O-CG 3.28Å; R145-L149 PolarHBondContact O-N 3.38Å; A146-L149 PolarHBondContact O-N 3.39Å; V147-L149 PolarHBondContact O-N 3Å
150	L	81.6	Confident	79.3	Confident	63 Å²	63	89 Å²	89	33%	0.33	46%	0.455	S	S	.	.	S	Bend	trans	-90.4	136.1	-176.2	-73.7	152.6	0	0	0	110.7	A146 V147 Q154	A146-L150 WeakPolarHBondContact O-CD1 3.34Å; V147-L150 WeakPolarHBondContact O-CB 3.47Å; V147-L150 PolarHBondContact O-N 3.5Å; V147-L150 VanDerWaalsContact O-N 3.1Å; L150-Q154 HydrophobicContact CB-CB 4.29Å; L150-Q154 HydrophobicContact CD2-CB 3.66Å; L150-Q154 HydrophobicContact CD2-CG 4.46Å
151	T	81.2	Confident	79.5	Confident	92 Å²	92	89 Å²	89	56%	0.564	46%	0.464	S	S	*	.			trans	-71.7	156.7	174	-25.3	0	0	0	0	110.9	R153 Q154 R155	T151-R153 PolarHBondContact O-N 3.08Å; T151-Q154 CarbonylContact O-C 3.58Å; T151-Q154 WeakPolarHBondContact O-CA 3.5Å; T151-Q154 WeakPolarHBondContact O-CB 3.26Å; T151-Q154 PolarHBondContact O-N 3.37Å; T151-R155 PolarHBondContact O-N 3.47Å
152	E	78.1	Confident	79.6	Confident	122 Å²	122	82.1 Å²	82.1	57%	0.57	44%	0.439	S	S	*	.	H	α-helix	trans	-50.1	-35.5	175.9	-84.7	-66.2	149.9	0	0	113.9	R155 K156	E152-R155 IonicContact OE1-NH1 3.88Å; E152-K156 PolarHBondContact O-N 3.46Å
153	R	72.4	Confident	79.5	Confident	221 Å²	221	85.8 Å²	85.8	83%	0.834	45%	0.448	S	S	*	.	H	α-helix	trans	-67	-39.7	174.1	-66.7	-175	-179	179.5	0.9	112.7	T151 A157	T151-R153 PolarHBondContact O-N 3.08Å; R153-A157 PolarHBondContact O-N 2.82Å
154	Q	78.2	Confident	79.7	Confident	96 Å²	96	89.2 Å²	89.2	45%	0.449	47%	0.467	S	S	.	.	H	α-helix	trans	-74.2	-36.1	178.9	-65.4	-176.4	-38.4	0	0	111.4	L150 T151 K156 A157 C158	L150-Q154 HydrophobicContact CB-CB 4.29Å; L150-Q154 HydrophobicContact CD2-CB 3.66Å; L150-Q154 HydrophobicContact CD2-CG 4.46Å; T151-Q154 CarbonylContact O-C 3.58Å; T151-Q154 WeakPolarHBondContact O-CA 3.5Å; T151-Q154 WeakPolarHBondContact O-CB 3.26Å; T151-Q154 PolarHBondContact O-N 3.37Å; Q154-K156 VanDerWaalsContact C-N 3.33Å; Q154-K156 PolarHBondContact O-N 3.39Å; Q154-A157 CarbonylContact O-C 3.59Å; Q154-A157 WeakPolarHBondContact O-CA 3.48Å; Q154-A157 WeakPolarHBondContact O-CB 3.29Å; Q154-A157 PolarHBondContact O-N 3.22Å; Q154-C158 WeakPolarHBondContact O-CB 3.39Å; Q154-C158 PolarHBondContact O-N 3.24Å; Q154-C158 PolarHBondContact O-SG 2.87Å
155	R	76.6	Confident	80	Confident	61 Å²	61	89.3 Å²	89.3	23%	0.23	47%	0.469	C	S	.	.	H	α-helix	trans	-57.8	-45.3	174	-169	176.8	179.3	-167.5	0.6	111.8	E116 L117 G119 T151 E152 A157 C158 Q159	E116-R155 PolarHBondContact O-NH2 3.3Å; L117-R155 HydrophobicContact CG-CG 4.5Å; L117-R155 PolarHBondContact O-NE 3.32Å; L117-R155 PolarHBondContact O-NH2 3.4Å; G119-R155 PolarHBondContact O-NH2 3.21Å; T151-R155 PolarHBondContact O-N 3.47Å; E152-R155 IonicContact OE1-NH1 3.88Å; R155-A157 VanDerWaalsContact C-N 3.3Å; R155-A157 PolarHBondContact O-N 2.87Å; R155-C158 PolarHBondContact O-N 3.29Å; R155-Q159 PolarHBondContact O-N 3.48Å
156	K	74.3	Confident	80.2	Confident	154 Å²	154	83.7 Å²	83.7	67%	0.67	45%	0.451	S	S	*	.	H	α-helix	trans	-64.5	-30.5	174.2	-70	-176.3	-178.3	-175.8	0	113.4	E152 Q154 P160	E152-K156 PolarHBondContact O-N 3.46Å; Q154-K156 VanDerWaalsContact C-N 3.33Å; Q154-K156 PolarHBondContact O-N 3.39Å; K156-P160 WeakPolarHBondContact O-CD 3.42Å
157	A	78.6	Confident	80.4	Confident	64 Å²	64	85.3 Å²	85.3	53%	0.529	45%	0.45	S	S	.	.	H	α-helix	trans	-79.2	-28.4	174.6	0	0	0	0	0	113.2	R153 Q154 R155 P160	R153-A157 PolarHBondContact O-N 2.82Å; Q154-A157 CarbonylContact O-C 3.59Å; Q154-A157 WeakPolarHBondContact O-CA 3.48Å; Q154-A157 WeakPolarHBondContact O-CB 3.29Å; Q154-A157 PolarHBondContact O-N 3.22Å; R155-A157 VanDerWaalsContact C-N 3.3Å; R155-A157 PolarHBondContact O-N 2.87Å; A157-P160 VanDerWaalsContact O-CD 3.3Å; A157-P160 WeakPolarHBondContact O-CD 3.5Å; A157-P160 VanDerWaalsContact O-CG 3.26Å; A157-P160 WeakPolarHBondContact O-CG 3.29Å
158	C	79.1	Confident	80.8	Confident	40 Å²	40	86.7 Å²	86.7	27%	0.27	46%	0.46	S	S	.	.	H	α-helix	trans	-77.8	-24.6	178.4	-72	0	0	0	0	113	L117 Q154 R155 A161 V162	L117-C158 VanDerWaalsContact CD2-C 3.42Å; L117-C158 HydrophobicContact CD2-CB 3.6Å; Q154-C158 WeakPolarHBondContact O-CB 3.39Å; Q154-C158 PolarHBondContact O-N 3.24Å; Q154-C158 PolarHBondContact O-SG 2.87Å; R155-C158 PolarHBondContact O-N 3.29Å; C158-A161 WeakPolarHBondContact O-CA 3.24Å; C158-A161 VanDerWaalsContact O-CB 3.25Å; C158-A161 WeakPolarHBondContact O-CB 3.33Å; C158-A161 PolarHBondContact O-N 2.96Å; C158-V162 PolarHBondContact O-N 2.65Å; C158-V162 VanDerWaalsContact O-N 3.13Å
159	Q	75.2	Confident	81.4	Confident	94 Å²	94	86.2 Å²	86.2	44%	0.439	44%	0.444	S	S	.	.	H	α-helix	trans	-56.6	-50.6	177.6	-167.3	-179.5	-1.7	0	0	112.9	L117 R155 A161 V162	L117-Q159 HydrophobicContact CD2-CB 4.22Å; L117-Q159 VanDerWaalsContact CD2-N 3.34Å; R155-Q159 PolarHBondContact O-N 3.48Å; Q159-A161 PolarHBondContact O-N 2.95Å; Q159-V162 PolarHBondContact O-N 2.82Å
160	P	79.6	Confident	81.7	Confident	77 Å²	77	81.2 Å²	81.2	50%	0.5	43%	0.425	S	S	.	.	H	α-helix	trans	-66.5	-22.9	173.1	26.7	-35.1	0	0	0	113	K156 A157 F163 V164	K156-P160 WeakPolarHBondContact O-CD 3.42Å; A157-P160 VanDerWaalsContact O-CD 3.3Å; A157-P160 WeakPolarHBondContact O-CD 3.5Å; A157-P160 VanDerWaalsContact O-CG 3.26Å; A157-P160 WeakPolarHBondContact O-CG 3.29Å; P160-F163 PolarHBondContact O-N 3.42Å; P160-V164 VanDerWaalsContact O-CG2 3.3Å; P160-V164 WeakPolarHBondContact O-CG2 3.43Å; P160-V164 PolarHBondContact O-N 3.41Å
161	A	83.1	Confident	82.2	Confident	41 Å²	41	81.2 Å²	81.2	34%	0.339	43%	0.425	S	S	.	.	H	α-helix	trans	-68.7	-35.9	178	0	0	0	0	0	112.3	C158 Q159 F163 V164 I165	C158-A161 WeakPolarHBondContact O-CA 3.24Å; C158-A161 VanDerWaalsContact O-CB 3.25Å; C158-A161 WeakPolarHBondContact O-CB 3.33Å; C158-A161 PolarHBondContact O-N 2.96Å; Q159-A161 PolarHBondContact O-N 2.95Å; A161-F163 PolarHBondContact O-N 3.49Å; A161-V164 PolarHBondContact O-N 3.16Å; A161-I165 VanDerWaalsContact O-CG1 3.26Å; A161-I165 WeakPolarHBondContact O-CG1 3.34Å; A161-I165 PolarHBondContact O-N 2.97Å
162	V	83	Confident	82.7	Confident	9 Å²	9	81.8 Å²	81.8	6%	0.055	42%	0.424	C	S	.	.	H	α-helix	trans	-61.2	-45.7	175.4	179.1	0	0	0	0	110.8	L110 L113 E114 L117 C158 Q159 V164 I165 Q166	L110-V162 HydrophobicContact CD2-CG1 4.41Å; L113-V162 HydrophobicContact CD2-CG2 3.87Å; L113-V162 HydrophobicContact CG-CG2 4.08Å; E114-V162 HydrophobicContact CB-CG1 4.35Å; L117-V162 HydrophobicContact CD2-CG2 4.16Å; C158-V162 PolarHBondContact O-N 2.65Å; C158-V162 VanDerWaalsContact O-N 3.13Å; Q159-V162 PolarHBondContact O-N 2.82Å; V162-V164 VanDerWaalsContact C-N 3.34Å; V162-V164 PolarHBondContact O-N 3.03Å; V162-I165 WeakPolarHBondContact O-CB 3.48Å; V162-I165 PolarHBondContact O-N 2.82Å; V162-Q166 PolarHBondContact O-N 2.94Å
163	F	81.5	Confident	83.3	Confident	115 Å²	115	81.5 Å²	81.5	50%	0.504	42%	0.422	S	S	.	.	H	α-helix	trans	-61.6	-41.6	175.6	-179.5	-100	0	0	0	112.1	P160 A161 I165 Q166 Q167	P160-F163 PolarHBondContact O-N 3.42Å; A161-F163 PolarHBondContact O-N 3.49Å; F163-I165 VanDerWaalsContact C-N 3.33Å; F163-I165 PolarHBondContact O-N 2.91Å; F163-Q166 PolarHBondContact O-N 3.42Å; F163-Q167 HydrophobicContact CD1-CG 4.35Å; F163-Q167 HydrophobicContact CE1-CG 3.97Å; F163-Q167 HydrophobicContact CZ-CG 4.06Å; F163-Q167 WeakPolarHBondContact O-CG 3.34Å; F163-Q167 PolarHBondContact O-N 2.93Å
164	V	86.2	Confident	84.3	Confident	86 Å²	86	77.5 Å²	77.5	52%	0.521	41%	0.407	S	S	.	.	H	α-helix	trans	-61.6	-40.9	174.5	170.4	0	0	0	0	111.3	P160 A161 V162 Q167 S168	P160-V164 VanDerWaalsContact O-CG2 3.3Å; P160-V164 WeakPolarHBondContact O-CG2 3.43Å; P160-V164 PolarHBondContact O-N 3.41Å; A161-V164 PolarHBondContact O-N 3.16Å; V162-V164 VanDerWaalsContact C-N 3.34Å; V162-V164 PolarHBondContact O-N 3.03Å; V164-Q167 PolarHBondContact O-N 2.88Å; V164-S168 WeakPolarHBondContact O-CB 3.38Å; V164-S168 PolarHBondContact O-N 3.44Å
165	I	86.8	Confident	85	Confident	73 Å²	73	76 Å²	76	37%	0.374	40%	0.402	S	S	.	.	H	α-helix	trans	-62.4	-49.2	176.6	-68.1	162.8	0	0	0	110.2	L110 A161 V162 F163 Q167 S168 V169	L110-I165 HydrophobicContact CD2-CG2 3.91Å; A161-I165 VanDerWaalsContact O-CG1 3.26Å; A161-I165 WeakPolarHBondContact O-CG1 3.34Å; A161-I165 PolarHBondContact O-N 2.97Å; V162-I165 WeakPolarHBondContact O-CB 3.48Å; V162-I165 PolarHBondContact O-N 2.82Å; F163-I165 VanDerWaalsContact C-N 3.33Å; F163-I165 PolarHBondContact O-N 2.91Å; I165-Q167 VanDerWaalsContact C-N 3.32Å; I165-Q167 PolarHBondContact O-N 3.45Å; I165-S168 WeakPolarHBondContact CA-OG 3.26Å; I165-S168 WeakPolarHBondContact O-CB 3.46Å; I165-S168 PolarHBondContact O-N 3.49Å; I165-S168 VanDerWaalsContact O-N 3.08Å; I165-S168 PolarHBondContact O-OG 3.32Å; I165-V169 WeakPolarHBondContact O-CG2 3.28Å; I165-V169 PolarHBondContact O-N 2.92Å
166	Q	86.3	Confident	85.7	Confident	66 Å²	66	73.4 Å²	73.4	31%	0.308	39%	0.392	S	S	.	.	H	α-helix	trans	-56.6	-46	176.9	-72.8	176.1	-7.8	0	0	111.6	L110 E114 V162 F163 S168 V169 A170	L110-Q166 HydrophobicContact CD1-CG 4.14Å; L110-Q166 HydrophobicContact CD2-CG 4.3Å; E114-Q166 PolarHBondContact OE2-NE2 3.25Å; V162-Q166 PolarHBondContact O-N 2.94Å; F163-Q166 PolarHBondContact O-N 3.42Å; Q166-S168 VanDerWaalsContact C-N 3.34Å; Q166-S168 PolarHBondContact O-N 3.49Å; Q166-V169 PolarHBondContact O-N 2.95Å; Q166-A170 PolarHBondContact O-N 2.79Å
167	Q	87.6	Confident	86.6	Confident	84 Å²	84	68 Å²	68	39%	0.393	37%	0.372	S	S	.	.	H	α-helix	trans	-63.3	-38.8	175.5	-74.6	-167.6	-30.9	0	0	112.7	F163 V164 I165 V169 A170 L171	F163-Q167 HydrophobicContact CD1-CG 4.35Å; F163-Q167 HydrophobicContact CE1-CG 3.97Å; F163-Q167 HydrophobicContact CZ-CG 4.06Å; F163-Q167 WeakPolarHBondContact O-CG 3.34Å; F163-Q167 PolarHBondContact O-N 2.93Å; V164-Q167 PolarHBondContact O-N 2.88Å; I165-Q167 VanDerWaalsContact C-N 3.32Å; I165-Q167 PolarHBondContact O-N 3.45Å; Q167-V169 PolarHBondContact O-N 3.18Å; Q167-A170 PolarHBondContact O-N 2.85Å; Q167-L171 WeakPolarHBondContact O-CB 3.46Å; Q167-L171 PolarHBondContact O-N 2.87Å
168	S	88.3	Confident	87.2	Confident	47 Å²	47	65 Å²	65	33%	0.329	35%	0.347	S	S	.	.	H	α-helix	trans	-64.1	-40.1	178.8	77.4	0	0	0	0	111.9	V164 I165 Q166 L171 L172	V164-S168 WeakPolarHBondContact O-CB 3.38Å; V164-S168 PolarHBondContact O-N 3.44Å; I165-S168 WeakPolarHBondContact CA-OG 3.26Å; I165-S168 WeakPolarHBondContact O-CB 3.46Å; I165-S168 PolarHBondContact O-N 3.49Å; I165-S168 VanDerWaalsContact O-N 3.08Å; I165-S168 PolarHBondContact O-OG 3.32Å; Q166-S168 VanDerWaalsContact C-N 3.34Å; Q166-S168 PolarHBondContact O-N 3.49Å; S168-L171 PolarHBondContact O-N 3.4Å; S168-L172 WeakPolarHBondContact O-CB 3.3Å; S168-L172 VanDerWaalsContact O-CG 3.23Å; S168-L172 WeakPolarHBondContact O-CG 3.46Å; S168-L172 PolarHBondContact O-N 3.18Å
169	V	89.6	Confident	87.8	Confident	55 Å²	55	66.3 Å²	66.3	33%	0.333	35%	0.351	S	S	.	.	H	α-helix	trans	-63.1	-46.1	176.8	173.2	0	0	0	0	110.3	L106 I165 Q166 Q167 L171 L172 H173	L106-V169 HydrophobicContact CD2-CG1 3.98Å; L106-V169 HydrophobicContact CD2-CG2 4.05Å; I165-V169 WeakPolarHBondContact O-CG2 3.28Å; I165-V169 PolarHBondContact O-N 2.92Å; Q166-V169 PolarHBondContact O-N 2.95Å; Q167-V169 PolarHBondContact O-N 3.18Å; V169-L171 VanDerWaalsContact C-N 3.3Å; V169-L171 PolarHBondContact O-N 3.06Å; V169-L172 PolarHBondContact O-N 3.3Å; V169-H173 PolarHBondContact O-N 2.96Å
170	A	89.6	Confident	88.6	Confident	46 Å²	46	61.9 Å²	61.9	38%	0.38	33%	0.33	S	S	.	.	H	α-helix	trans	-61.9	-39.8	176.5	0	0	0	0	0	111.9	Q166 Q167 H173 R174	Q166-A170 PolarHBondContact O-N 2.79Å; Q167-A170 PolarHBondContact O-N 2.85Å; A170-H173 PolarHBondContact O-N 2.94Å; A170-R174 WeakPolarHBondContact O-CG 3.24Å; A170-R174 PolarHBondContact O-N 3.41Å; A170-R174 VanDerWaalsContact O-N 3.11Å
171	L	91.5	Very high	89.2	Confident	62 Å²	62	60.1 Å²	60.1	33%	0.325	31%	0.314	S	S	.	.	H	α-helix	trans	-65.7	-47.3	177.6	-175.6	70.8	0	0	0	112	Q167 S168 V169 H173 R174 L175 L226 L230	Q167-L171 WeakPolarHBondContact O-CB 3.46Å; Q167-L171 PolarHBondContact O-N 2.87Å; S168-L171 PolarHBondContact O-N 3.4Å; V169-L171 VanDerWaalsContact C-N 3.3Å; V169-L171 PolarHBondContact O-N 3.06Å; L171-H173 VanDerWaalsContact C-N 3.27Å; L171-H173 PolarHBondContact O-N 3.26Å; L171-R174 PolarHBondContact O-N 3.45Å; L171-L175 WeakPolarHBondContact O-CB 3.43Å; L171-L175 PolarHBondContact O-N 3.22Å; L171-L226 HydrophobicContact CD1-CD1 3.55Å; L171-L226 HydrophobicContact CD1-CD2 4.42Å; L171-L226 HydrophobicContact CD1-CG 4.16Å; L171-L230 HydrophobicContact CD1-CD1 3.9Å; L171-L230 HydrophobicContact CD1-CD2 3.6Å; L171-L230 HydrophobicContact CD1-CG 3.85Å; L171-L230 HydrophobicContact CD2-CD1 4.45Å; L171-L230 HydrophobicContact CD2-CD2 3.97Å; L171-L230 HydrophobicContact CG-CD2 4.45Å
172	L	91.7	Very high	89.5	Confident	105 Å²	105	60.6 Å²	60.6	55%	0.55	31%	0.313	S	S	.	.	H	α-helix	trans	-58.8	-41.2	177.4	-74.7	169.9	0	0	0	111.2	S168 V169 L175 H176	S168-L172 WeakPolarHBondContact O-CB 3.3Å; S168-L172 VanDerWaalsContact O-CG 3.23Å; S168-L172 WeakPolarHBondContact O-CG 3.46Å; S168-L172 PolarHBondContact O-N 3.18Å; V169-L172 PolarHBondContact O-N 3.3Å; L172-L175 PolarHBondContact O-N 3.47Å; L172-H176 WeakPolarHBondContact O-CB 3.26Å; L172-H176 PolarHBondContact O-N 3.36Å
173	H	91.3	Very high	89.4	Confident	115 Å²	115	62.8 Å²	62.8	53%	0.532	33%	0.329	S	S	.	.	H	α-helix	trans	-61.6	-49.3	175.4	-178	73.6	0	0	0	112	V169 A170 L171 L175 H176 V177	V169-H173 PolarHBondContact O-N 2.96Å; A170-H173 PolarHBondContact O-N 2.94Å; L171-H173 VanDerWaalsContact C-N 3.27Å; L171-H173 PolarHBondContact O-N 3.26Å; H173-L175 VanDerWaalsContact C-N 3.33Å; H173-L175 PolarHBondContact O-N 2.82Å; H173-H176 PolarHBondContact O-N 3.29Å; H173-V177 WeakPolarHBondContact O-CG2 3.48Å; H173-V177 PolarHBondContact O-N 2.84Å
174	R	92.3	Very high	89	Confident	138 Å²	138	58.9 Å²	58.9	52%	0.521	32%	0.315	S	S	.	.	H	α-helix	trans	-60.1	-42.6	177.4	-70	174.6	-174.6	-172.8	1.3	112.1	A170 L171 V177 A178 L226	A170-R174 WeakPolarHBondContact O-CG 3.24Å; A170-R174 PolarHBondContact O-N 3.41Å; A170-R174 VanDerWaalsContact O-N 3.11Å; L171-R174 PolarHBondContact O-N 3.45Å; R174-V177 PolarHBondContact O-N 2.95Å; R174-A178 WeakPolarHBondContact O-CB 3.24Å; R174-A178 PolarHBondContact O-N 3.35Å; R174-L226 HydrophobicContact CB-CD1 3.76Å; R174-L226 HydrophobicContact CB-CD2 4.49Å; R174-L226 HydrophobicContact CG-CD1 4.5Å
175	L	92.3	Very high	88.5	Confident	63 Å²	63	57 Å²	57	33%	0.33	31%	0.306	S	S	.	.	H	α-helix	trans	-61.1	-45.6	176.2	179	65	0	0	0	111.3	L171 L172 H173 A178 L179 F223 L226	L171-L175 WeakPolarHBondContact O-CB 3.43Å; L171-L175 PolarHBondContact O-N 3.22Å; L172-L175 PolarHBondContact O-N 3.47Å; H173-L175 VanDerWaalsContact C-N 3.33Å; H173-L175 PolarHBondContact O-N 2.82Å; L175-A178 PolarHBondContact O-N 3.38Å; L175-L179 HydrophobicContact CG-CD1 4.14Å; L175-L179 WeakPolarHBondContact O-CB 3.49Å; L175-L179 WeakPolarHBondContact O-CG 3.18Å; L175-L179 PolarHBondContact O-N 3.45Å; L175-F223 HydrophobicContact CD1-CD1 4.43Å; L175-F223 HydrophobicContact CD1-CE1 3.48Å; L175-F223 VanDerWaalsContact CD1-CE1 3.48Å; L175-F223 HydrophobicContact CD1-CZ 4.06Å; L175-L226 HydrophobicContact CB-CD2 4.08Å; L175-L226 HydrophobicContact CD1-CD2 4.2Å
176	H	92.8	Very high	88.5	Confident	8 Å²	8	55 Å²	55	4%	0.037	30%	0.295	C	S	.	.	H	α-helix	trans	-63.6	-43.2	178.4	169.4	64	0	0	0	112.6	L172 H173 A178 L179 F180 F186 Y187 M189 R192	L172-H176 WeakPolarHBondContact O-CB 3.26Å; L172-H176 PolarHBondContact O-N 3.36Å; H173-H176 PolarHBondContact O-N 3.29Å; H176-A178 VanDerWaalsContact C-N 3.32Å; H176-A178 PolarHBondContact O-N 2.86Å; H176-L179 WeakPolarHBondContact O-CB 3.37Å; H176-L179 PolarHBondContact O-N 3.14Å; H176-F180 WeakPolarHBondContact O-CB 3.4Å; H176-F180 PolarHBondContact O-N 2.98Å; H176-F186 PolarHBondContact CE1-O 2.84Å; H176-F186 PolarHBondContact NE2-O 3.19Å; H176-Y187 PolarHBondContact NE2-O 3.32Å; H176-M189 HydrophobicContact CB-CE 3.87Å; H176-M189 HydrophobicContact CB-CG 4.42Å; H176-M189 HydrophobicContact CB-SD 3.42Å; H176-M189 WeakPolarHBondContact CB-SD 3.33Å; H176-M189 WeakPolarHBondContact CE1-CE 3.34Å; H176-M189 WeakPolarHBondContact ND1-CE 3.25Å; H176-R192 PolarHBondContact ND1-NE 3.48Å; H176-R192 PolarHBondContact ND1-NH2 3.37Å
177	V	91.4	Very high	88.5	Confident	39 Å²	39	55.5 Å²	55.5	24%	0.236	29%	0.294	C	S	.	.	H	α-helix	trans	-61.3	-42.8	176.2	172.8	0	0	0	0	110.8	H173 R174 F180 Y181	H173-V177 WeakPolarHBondContact O-CG2 3.48Å; H173-V177 PolarHBondContact O-N 2.84Å; R174-V177 PolarHBondContact O-N 2.95Å; V177-F180 WeakPolarHBondContact O-CB 3.21Å; V177-F180 PolarHBondContact O-N 3.3Å; V177-Y181 HydrophobicContact CG1-CD2 4Å; V177-Y181 HydrophobicContact CG1-CE2 3.62Å; V177-Y181 WeakPolarHBondContact O-CD2 3.26Å; V177-Y181 PolarHBondContact O-N 3.06Å
178	A	91.9	Very high	88.6	Confident	1 Å²	1	53 Å²	53	1%	0.008	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-44.5	175.3	0	0	0	0	0	111.8	R174 L175 H176 F180 Y181 V182 F223	R174-A178 WeakPolarHBondContact O-CB 3.24Å; R174-A178 PolarHBondContact O-N 3.35Å; L175-A178 PolarHBondContact O-N 3.38Å; H176-A178 VanDerWaalsContact C-N 3.32Å; H176-A178 PolarHBondContact O-N 2.86Å; A178-F180 VanDerWaalsContact C-N 3.31Å; A178-F180 PolarHBondContact O-N 3Å; A178-Y181 PolarHBondContact O-N 3.48Å; A178-V182 WeakPolarHBondContact O-CG2 3.36Å; A178-V182 PolarHBondContact O-N 3.42Å; A178-F223 VanDerWaalsContact C-CE2 3.46Å; A178-F223 HydrophobicContact CB-CD1 4.26Å; A178-F223 HydrophobicContact CB-CD2 3.61Å; A178-F223 HydrophobicContact CB-CE1 4.27Å; A178-F223 HydrophobicContact CB-CE2 3.58Å; A178-F223 HydrophobicContact CB-CG 3.95Å; A178-F223 HydrophobicContact CB-CZ 3.93Å
179	L	91.7	Very high	88.7	Confident	69 Å²	69	54.6 Å²	54.6	36%	0.361	29%	0.286	S	S	.	.	H	α-helix	trans	-61	-37.5	174.3	-76.1	170.9	0	0	0	112.6	L175 H176 V182 S183 F223	L175-L179 HydrophobicContact CG-CD1 4.14Å; L175-L179 WeakPolarHBondContact O-CB 3.49Å; L175-L179 WeakPolarHBondContact O-CG 3.18Å; L175-L179 PolarHBondContact O-N 3.45Å; H176-L179 WeakPolarHBondContact O-CB 3.37Å; H176-L179 PolarHBondContact O-N 3.14Å; L179-V182 PolarHBondContact O-N 3.48Å; L179-S183 WeakPolarHBondContact O-CB 3.45Å; L179-S183 PolarHBondContact O-N 2.85Å; L179-S183 PolarHBondContact O-OG 2.91Å; L179-F223 HydrophobicContact CD2-CE2 4.26Å; L179-F223 HydrophobicContact CD2-CZ 3.63Å; L179-F223 HydrophobicContact CG-CE2 4.43Å; L179-F223 HydrophobicContact CG-CZ 3.74Å
180	F	93.3	Very high	88.7	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.5	-48.3	177.2	161.3	-102.3	0	0	0	111.2	Q8 L11 I12 H176 V177 A178 V182 S183 S184 F186 Y187	Q8-F180 HydrophobicContact CB-CE1 4.49Å; Q8-F180 HydrophobicContact CB-CZ 4.13Å; Q8-F180 HydrophobicContact CG-CZ 4.34Å; L11-F180 HydrophobicContact CB-CE2 4.22Å; L11-F180 HydrophobicContact CB-CZ 4.14Å; L11-F180 HydrophobicContact CD1-CE2 3.8Å; L11-F180 HydrophobicContact CD1-CZ 4.44Å; I12-F180 HydrophobicContact CD1-CE1 4.05Å; I12-F180 HydrophobicContact CD1-CZ 4.44Å; I12-F180 HydrophobicContact CG1-CE1 3.92Å; I12-F180 HydrophobicContact CG1-CZ 4.05Å; H176-F180 WeakPolarHBondContact O-CB 3.4Å; H176-F180 PolarHBondContact O-N 2.98Å; V177-F180 WeakPolarHBondContact O-CB 3.21Å; V177-F180 PolarHBondContact O-N 3.3Å; A178-F180 VanDerWaalsContact C-N 3.31Å; A178-F180 PolarHBondContact O-N 3Å; F180-V182 VanDerWaalsContact C-N 3.28Å; F180-V182 PolarHBondContact O-N 3.39Å; F180-S183 PolarHBondContact O-N 3.25Å; F180-S184 WeakPolarHBondContact O-CA 3.5Å; F180-S184 PolarHBondContact O-N 3.35Å; F180-F186 VanDerWaalsContact CD2-C 3.45Å; F180-F186 VanDerWaalsContact CD2-O 3.28Å; F180-F186 WeakPolarHBondContact CD2-O 3.39Å; F180-Y187 AromaticContact CD1-CD2 3.74Å; F180-Y187 HydrophobicContact CD1-CD2 3.74Å; F180-Y187 HydrophobicContact CD1-CE2 4.36Å; F180-Y187 HydrophobicContact CD2-CD2 4.28Å; F180-Y187 AromaticContact CE1-CD2 3.5Å; F180-Y187 HydrophobicContact CE1-CD2 3.5Å; F180-Y187 VanDerWaalsContact CE1-CD2 3.5Å; F180-Y187 HydrophobicContact CE1-CE2 4.12Å; F180-Y187 HydrophobicContact CE2-CD2 4.05Å; F180-Y187 HydrophobicContact CE2-CG 4.38Å; F180-Y187 HydrophobicContact CG-CD2 4.12Å; F180-Y187 AromaticContact CZ-CD2 3.65Å; F180-Y187 HydrophobicContact CZ-CD2 3.65Å; F180-Y187 HydrophobicContact CZ-CG 4.29Å
181	Y	91.2	Very high	88.7	Confident	40 Å²	40	51 Å²	51	16%	0.157	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-36.5	179.1	-78.3	-59.4	0	0	0	112.8	Q8 I12 V177 A178 Y215 L218 G219	Q8-Y181 PolarHBondContact NE2-O 3.39Å; I12-Y181 HydrophobicContact CD1-CE1 3.77Å; V177-Y181 HydrophobicContact CG1-CD2 4Å; V177-Y181 HydrophobicContact CG1-CE2 3.62Å; V177-Y181 WeakPolarHBondContact O-CD2 3.26Å; V177-Y181 PolarHBondContact O-N 3.06Å; A178-Y181 PolarHBondContact O-N 3.48Å; Y181-Y215 WeakPolarHBondContact CB-O 3.23Å; Y181-Y215 AromaticContact CD1-CD1 3.62Å; Y181-Y215 HydrophobicContact CD1-CD1 3.62Å; Y181-Y215 HydrophobicContact CD1-CE1 4.47Å; Y181-Y215 HydrophobicContact CD1-CG 4.38Å; Y181-Y215 AromaticContact CE1-CD1 3.53Å; Y181-Y215 HydrophobicContact CE1-CD1 3.53Å; Y181-Y215 AromaticContact CE1-CE1 3.94Å; Y181-Y215 HydrophobicContact CE1-CE1 3.94Å; Y181-L218 HydrophobicContact CD1-CD2 4.23Å; Y181-L218 HydrophobicContact CE1-CD2 3.83Å; Y181-L218 HydrophobicContact CE2-CD2 4.32Å; Y181-G219 VanDerWaalsContact CB-CA 3.45Å
182	V	88.8	Confident	88.7	Confident	52 Å²	52	52.2 Å²	52.2	32%	0.315	26%	0.259	S	S	.	.	H	α-helix	trans	-76	-47.2	178.8	177.6	0	0	0	0	112.8	A178 L179 F180 F223	A178-V182 WeakPolarHBondContact O-CG2 3.36Å; A178-V182 PolarHBondContact O-N 3.42Å; L179-V182 PolarHBondContact O-N 3.48Å; F180-V182 VanDerWaalsContact C-N 3.28Å; F180-V182 PolarHBondContact O-N 3.39Å; V182-F223 HydrophobicContact CG2-CD2 4.05Å; V182-F223 HydrophobicContact CG2-CE2 3.89Å
183	S	81.9	Confident	88.6	Confident	55 Å²	55	50.5 Å²	50.5	39%	0.385	26%	0.26	S	S	.	.	H	α-helix	trans	-99.9	-7.2	-169	64.9	0	0	0	0	114.8	L179 F180 S185	L179-S183 WeakPolarHBondContact O-CB 3.45Å; L179-S183 PolarHBondContact O-N 2.85Å; L179-S183 PolarHBondContact O-OG 2.91Å; F180-S183 PolarHBondContact O-N 3.25Å; S183-S185 PolarHBondContact O-N 3.27Å
184	S	73.4	Confident	88.6	Confident	32 Å²	32	45.4 Å²	45.4	22%	0.224	24%	0.237	C	C	.	.			trans	54.3	11.9	-179.2	66.7	0	0	0	0	116.4	F180	F180-S184 WeakPolarHBondContact O-CA 3.5Å; F180-S184 PolarHBondContact O-N 3.35Å
185	S	75.6	Confident	88.5	Confident	48 Å²	48	39.6 Å²	39.6	34%	0.336	22%	0.22	S	C	.	.	S	Bend	trans	-85.1	-48.1	-162.4	-165.4	0	0	0	0	114.2	S183	S183-S185 PolarHBondContact O-N 3.27Å
186	F	86.6	Confident	88.4	Confident	29 Å²	29	36.6 Å²	36.6	13%	0.127	21%	0.205	C	C	.	.			trans	-149	122.6	-174.3	-57.9	-81.3	0	0	0	110.3	H176 F180 K191 R192 I196	H176-F186 PolarHBondContact CE1-O 2.84Å; H176-F186 PolarHBondContact NE2-O 3.19Å; F180-F186 VanDerWaalsContact CD2-C 3.45Å; F180-F186 VanDerWaalsContact CD2-O 3.28Å; F180-F186 WeakPolarHBondContact CD2-O 3.39Å; F186-K191 HydrophobicContact CD1-CB 4.34Å; F186-R192 HydrophobicContact CB-CB 3.98Å; F186-R192 HydrophobicContact CD1-CB 4.5Å; F186-R192 HydrophobicContact CD2-CB 4.06Å; F186-R192 HydrophobicContact CD2-CG 4.02Å; F186-R192 HydrophobicContact CE2-CG 4.46Å; F186-R192 HydrophobicContact CG-CB 3.94Å; F186-R192 HydrophobicContact CG-CG 4.41Å; F186-I196 WeakPolarHBondContact CD1-O 3.44Å; F186-I196 WeakPolarHBondContact CE1-O 3.39Å
187	Y	86.1	Confident	88.3	Confident	77 Å²	77	37.1 Å²	37.1	30%	0.302	21%	0.209	S	C	.	.	S	Bend	trans	-78.1	-42.4	176.3	-176.8	-110.5	0	0	0	112.1	I12 S15 H176 F180	I12-Y187 HydrophobicContact CG1-CE2 4.39Å; S15-Y187 VanDerWaalsContact OG-CE1 3.27Å; S15-Y187 WeakPolarHBondContact OG-CE1 3.4Å; H176-Y187 PolarHBondContact NE2-O 3.32Å; F180-Y187 AromaticContact CD1-CD2 3.74Å; F180-Y187 HydrophobicContact CD1-CD2 3.74Å; F180-Y187 HydrophobicContact CD1-CE2 4.36Å; F180-Y187 HydrophobicContact CD2-CD2 4.28Å; F180-Y187 AromaticContact CE1-CD2 3.5Å; F180-Y187 HydrophobicContact CE1-CD2 3.5Å; F180-Y187 VanDerWaalsContact CE1-CD2 3.5Å; F180-Y187 HydrophobicContact CE1-CE2 4.12Å; F180-Y187 HydrophobicContact CE2-CD2 4.05Å; F180-Y187 HydrophobicContact CE2-CG 4.38Å; F180-Y187 HydrophobicContact CG-CD2 4.12Å; F180-Y187 AromaticContact CZ-CD2 3.65Å; F180-Y187 HydrophobicContact CZ-CD2 3.65Å; F180-Y187 HydrophobicContact CZ-CG 4.29Å
188	H	90	Very high	88.4	Confident	31 Å²	31	36.2 Å²	36.2	14%	0.144	20%	0.202	C	C	.	.	S	Bend	trans	-97.6	142.1	179.5	-70.7	-62.5	0	0	0	112.2	S15 H99 S190 K191 R192	S15-H188 PolarHBondContact OG-NE2 2.74Å; H99-H188 AromaticContact NE2-CE1 3.68Å; H99-H188 AromaticContact NE2-CG 3.97Å; H99-H188 AromaticContact NE2-ND1 3.59Å; H188-S190 VanDerWaalsContact C-N 3.34Å; H188-S190 PolarHBondContact O-N 3.42Å; H188-K191 HydrophobicContact CB-CB 4.33Å; H188-K191 HydrophobicContact CB-CD 4.26Å; H188-K191 HydrophobicContact CB-CG 4.02Å; H188-K191 PolarHBondContact O-N 3.11Å; H188-R192 PolarHBondContact O-N 3.35Å
189	M	88.9	Confident	88.3	Confident	81 Å²	81	37 Å²	37	40%	0.399	21%	0.206	S	C	.	.	H	α-helix	trans	-65.6	-37.2	177.8	-65.6	-89.7	56.5	0	0	113	H176 K191 R192 A193	H176-M189 HydrophobicContact CB-CE 3.87Å; H176-M189 HydrophobicContact CB-CG 4.42Å; H176-M189 HydrophobicContact CB-SD 3.42Å; H176-M189 WeakPolarHBondContact CB-SD 3.33Å; H176-M189 WeakPolarHBondContact CE1-CE 3.34Å; H176-M189 WeakPolarHBondContact ND1-CE 3.25Å; M189-K191 VanDerWaalsContact C-N 3.3Å; M189-K191 PolarHBondContact O-N 3.35Å; M189-R192 HydrophobicContact CE-CB 4.15Å; M189-R192 HydrophobicContact CE-CG 4.48Å; M189-R192 WeakPolarHBondContact O-CB 3.23Å; M189-R192 PolarHBondContact O-N 2.9Å; M189-A193 PolarHBondContact O-N 2.83Å
190	S	90.6	Very high	88.2	Confident	10 Å²	10	34 Å²	34	7%	0.07	19%	0.19	C	C	.	.	H	α-helix	trans	-61.5	-37.1	174.6	54.5	0	0	0	0	112.4	F95 H99 H188 A193 A194	F95-S190 VanDerWaalsContact CD2-OG 3.27Å; F95-S190 WeakPolarHBondContact CD2-OG 3.25Å; F95-S190 VanDerWaalsContact CE2-OG 3.25Å; F95-S190 WeakPolarHBondContact CE2-OG 3.42Å; H99-S190 WeakPolarHBondContact CB-OG 3.48Å; H99-S190 PolarHBondContact CD2-OG 3Å; H99-S190 VanDerWaalsContact CD2-OG 3.3Å; H188-S190 VanDerWaalsContact C-N 3.34Å; H188-S190 PolarHBondContact O-N 3.42Å; S190-A193 PolarHBondContact O-N 3.47Å; S190-A194 WeakPolarHBondContact O-CB 3.31Å; S190-A194 PolarHBondContact O-N 2.85Å
191	K	90.4	Very high	87.9	Confident	17 Å²	17	38.2 Å²	38.2	7%	0.074	22%	0.216	C	C	.	.	H	α-helix	trans	-71.1	-34.3	176.8	-64.9	-173.7	-175.5	172.1	0	112.1	F95 F186 H188 M189 A194 G195 I196 Y198	F95-K191 HydrophobicContact CD2-CB 4.47Å; F95-K191 HydrophobicContact CD2-CD 4.46Å; F95-K191 HydrophobicContact CD2-CG 3.43Å; F95-K191 VanDerWaalsContact CD2-CG 3.43Å; F95-K191 HydrophobicContact CE2-CD 4.04Å; F95-K191 VanDerWaalsContact CE2-CE 3.4Å; F95-K191 HydrophobicContact CE2-CG 3.39Å; F95-K191 HydrophobicContact CG-CG 4.35Å; F95-K191 VanDerWaalsContact CZ-CE 3.45Å; F95-K191 HydrophobicContact CZ-CG 4.27Å; F186-K191 HydrophobicContact CD1-CB 4.34Å; H188-K191 HydrophobicContact CB-CB 4.33Å; H188-K191 HydrophobicContact CB-CD 4.26Å; H188-K191 HydrophobicContact CB-CG 4.02Å; H188-K191 PolarHBondContact O-N 3.11Å; M189-K191 VanDerWaalsContact C-N 3.3Å; M189-K191 PolarHBondContact O-N 3.35Å; K191-A194 PolarHBondContact O-N 3.48Å; K191-G195 PolarHBondContact O-N 3.38Å; K191-I196 PolarHBondContact O-N 3.36Å; K191-Y198 HydrophobicContact CD-CE2 3.79Å; K191-Y198 VanDerWaalsContact CE-OH 3.3Å; K191-Y198 WeakPolarHBondContact CE-OH 3.45Å; K191-Y198 PolarHBondContact NZ-OH 2.97Å
192	R	90.6	Very high	87.2	Confident	87 Å²	87	40.1 Å²	40.1	33%	0.328	23%	0.232	S	C	.	.	H	α-helix	trans	-62.8	-45.6	170.5	-176	-174.7	-68.6	-84.1	3.5	111.1	H176 F186 H188 M189 A194 G195	H176-R192 PolarHBondContact ND1-NE 3.48Å; H176-R192 PolarHBondContact ND1-NH2 3.37Å; F186-R192 HydrophobicContact CB-CB 3.98Å; F186-R192 HydrophobicContact CD1-CB 4.5Å; F186-R192 HydrophobicContact CD2-CB 4.06Å; F186-R192 HydrophobicContact CD2-CG 4.02Å; F186-R192 HydrophobicContact CE2-CG 4.46Å; F186-R192 HydrophobicContact CG-CB 3.94Å; F186-R192 HydrophobicContact CG-CG 4.41Å; H188-R192 PolarHBondContact O-N 3.35Å; M189-R192 HydrophobicContact CE-CB 4.15Å; M189-R192 HydrophobicContact CE-CG 4.48Å; M189-R192 WeakPolarHBondContact O-CB 3.23Å; M189-R192 PolarHBondContact O-N 2.9Å; R192-A194 VanDerWaalsContact C-N 3.34Å; R192-A194 PolarHBondContact O-N 3.43Å; R192-G195 PolarHBondContact O-N 3.22Å
193	A	89.9	Confident	86.2	Confident	69 Å²	69	39.7 Å²	39.7	57%	0.57	24%	0.238	S	C	*	.	H	α-helix	trans	-64.2	-37.7	177.9	0	0	0	0	0	112.6	M189 S190	M189-A193 PolarHBondContact O-N 2.83Å; S190-A193 PolarHBondContact O-N 3.47Å
194	A	90.5	Very high	85.5	Confident	7 Å²	7	41.5 Å²	41.5	6%	0.058	25%	0.248	C	C	.	.	H	α-helix	trans	-82.8	-9.6	177.4	0	0	0	0	0	114.4	L94 F95 S190 K191 R192 I196	L94-A194 HydrophobicContact CD2-CB 4.33Å; L94-A194 HydrophobicContact CG-CB 4.44Å; F95-A194 HydrophobicContact CB-CB 3.94Å; S190-A194 WeakPolarHBondContact O-CB 3.31Å; S190-A194 PolarHBondContact O-N 2.85Å; K191-A194 PolarHBondContact O-N 3.48Å; R192-A194 VanDerWaalsContact C-N 3.34Å; R192-A194 PolarHBondContact O-N 3.43Å; A194-I196 VanDerWaalsContact C-N 3.3Å; A194-I196 HydrophobicContact CB-CD1 3.91Å; A194-I196 HydrophobicContact CB-CG1 3.9Å; A194-I196 PolarHBondContact O-N 2.95Å
195	G	89.9	Confident	85.3	Confident	16 Å²	16	45.1 Å²	45.1	17%	0.165	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	26.5	-176.7	0	0	0	0	0	114.3	P81 K191 R192	P81-G195 VanDerWaalsContact CD-O 3.29Å; P81-G195 WeakPolarHBondContact CD-O 3.29Å; P81-G195 VanDerWaalsContact CG-O 3.31Å; P81-G195 WeakPolarHBondContact CG-O 3.37Å; K191-G195 PolarHBondContact O-N 3.38Å; R192-G195 PolarHBondContact O-N 3.22Å
196	I	91.7	Very high	84.8	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	29%	0.287	C	S	.	.			trans	-88.7	113.1	-177.4	-59.2	174.8	0	0	0	109.5	Q78 P87 F95 F186 K191 A194	Q78-I196 HydrophobicContact CB-CG2 3.9Å; Q78-I196 HydrophobicContact CG-CG2 4.03Å; P87-I196 HydrophobicContact CB-CD1 4.39Å; P87-I196 HydrophobicContact CB-CG1 4.24Å; P87-I196 HydrophobicContact CG-CD1 4.48Å; P87-I196 HydrophobicContact CG-CG1 4.13Å; P87-I196 HydrophobicContact CG-CG2 3.91Å; F95-I196 HydrophobicContact CB-CD1 3.74Å; F95-I196 HydrophobicContact CG-CD1 4.27Å; F186-I196 WeakPolarHBondContact CD1-O 3.44Å; F186-I196 WeakPolarHBondContact CE1-O 3.39Å; K191-I196 PolarHBondContact O-N 3.36Å; A194-I196 VanDerWaalsContact C-N 3.3Å; A194-I196 HydrophobicContact CB-CD1 3.91Å; A194-I196 HydrophobicContact CB-CG1 3.9Å; A194-I196 PolarHBondContact O-N 2.95Å
197	S	90.7	Very high	84.3	Confident	19 Å²	19	51.5 Å²	51.5	13%	0.133	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	170.4	176.7	-67.4	0	0	0	0	111.2	V79	V79-S197 WeakPolarHBondContact CG2-O 3.25Å; V79-S197 PolarHBondContact N-O 3.47Å; V79-S197 PolarHBondContact O-N 2.85Å
198	Y	91.6	Very high	84.1	Confident	20 Å²	20	49.2 Å²	49.2	8%	0.078	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	139.3	179.4	-74.9	-82.8	0	0	0	112	A6 L11 E71 I76 V77 Q78 K191	A6-Y198 PolarHBondContact N-O 3.36Å; A6-Y198 VanDerWaalsContact N-O 3.09Å; L11-Y198 HydrophobicContact CD2-CD2 3.44Å; L11-Y198 VanDerWaalsContact CD2-CD2 3.44Å; L11-Y198 HydrophobicContact CD2-CE2 4.19Å; L11-Y198 HydrophobicContact CD2-CG 3.74Å; E71-Y198 HydrophobicContact CG-CE1 3.77Å; E71-Y198 VanDerWaalsContact OE1-CE1 3.22Å; E71-Y198 WeakPolarHBondContact OE1-CE1 3.22Å; E71-Y198 VanDerWaalsContact OE1-CZ 3.3Å; E71-Y198 PolarHBondContact OE1-OH 3.34Å; I76-Y198 HydrophobicContact CB-CD1 4.12Å; I76-Y198 HydrophobicContact CD1-CD1 3.7Å; I76-Y198 HydrophobicContact CD1-CE1 4.04Å; I76-Y198 HydrophobicContact CD1-CG 4.12Å; I76-Y198 HydrophobicContact CG1-CD1 3.95Å; I76-Y198 HydrophobicContact CG1-CE1 4.34Å; V77-Y198 WeakPolarHBondContact O-CA 3.11Å; Q78-Y198 HydrophobicContact CB-CE1 4.34Å; Q78-Y198 HydrophobicContact CG-CD1 4.3Å; Q78-Y198 HydrophobicContact CG-CE1 3.43Å; Q78-Y198 VanDerWaalsContact CG-CE1 3.43Å; K191-Y198 HydrophobicContact CD-CE2 3.79Å; K191-Y198 VanDerWaalsContact CE-OH 3.3Å; K191-Y198 WeakPolarHBondContact CE-OH 3.45Å; K191-Y198 PolarHBondContact NZ-OH 2.97Å
199	L	91.3	Very high	83.8	Confident	17 Å²	17	51.9 Å²	51.9	9%	0.089	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143.9	165.7	-61.2	-177.7	0	0	0	109.6	L3 I76 V77 V79	L3-L199 HydrophobicContact CB-CD1 4.18Å; L3-L199 HydrophobicContact CD1-CD1 4.22Å; I76-L199 WeakPolarHBondContact CA-O 3.42Å; V77-L199 PolarHBondContact N-O 3.49Å; V77-L199 PolarHBondContact O-N 2.92Å; V79-L199 HydrophobicContact CB-CD1 4.5Å; V79-L199 HydrophobicContact CB-CG 4.43Å; V79-L199 HydrophobicContact CG1-CB 4.41Å; V79-L199 HydrophobicContact CG1-CD1 3.67Å; V79-L199 HydrophobicContact CG1-CG 3.79Å; V79-L199 HydrophobicContact CG2-CD1 4.28Å; V79-L199 HydrophobicContact CG2-CD2 4.41Å; V79-L199 HydrophobicContact CG2-CG 3.8Å
200	C	89.1	Confident	83.7	Confident	6 Å²	6	51 Å²	51	4%	0.041	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	130.1	171.3	-170.8	0	0	0	0	109.1	A4 Q10 T202	A4-C200 PolarHBondContact O-N 3.43Å; Q10-C200 PolarHBondContact NE2-SG 2.99Å; C200-T202 PolarHBondContact SG-O 3.35Å
201	V	86.3	Confident	83.5	Confident	88 Å²	88	53.1 Å²	53.1	53%	0.533	34%	0.337	S	S	.	.	S	Bend	trans	-84.2	-33.3	175.5	-177	0	0	0	0	110.2	G75 V77	G75-V201 WeakPolarHBondContact O-CB 3.38Å; G75-V201 PolarHBondContact O-N 3.1Å; V77-V201 HydrophobicContact CB-CG2 4.3Å; V77-V201 HydrophobicContact CG2-CG2 3.43Å; V77-V201 VanDerWaalsContact CG2-CG2 3.43Å
202	T	76.8	Confident	83.3	Confident	81 Å²	81	56.8 Å²	56.8	50%	0.497	35%	0.35	S	S	.	.	S	Bend	trans	-70.4	137.2	173	-30.5	0	0	0	0	109.5	C200	C200-T202 PolarHBondContact SG-O 3.35Å
203	G	69.2	Low	83.3	Confident	42 Å²	42	56 Å²	56	43%	0.433	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-56.8	158.8	-177.3	0	0	0	0	0	113.6	N205	G203-N205 PolarHBondContact O-N 2.76Å
204	P	66.8	Low	83.4	Confident	94 Å²	94	56.7 Å²	56.7	61%	0.61	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-64.2	126.9	178.7	26.3	-32.5	0	0	0	110.5
205	N	69.3	Low	83.4	Confident	108 Å²	108	59.4 Å²	59.4	58%	0.578	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-88.2	143.7	174.6	-76.6	-15.3	0	0	0	109.7	G203 D207 D208	G203-N205 PolarHBondContact O-N 2.76Å; N205-D207 PolarHBondContact O-N 3.1Å; N205-D207 VanDerWaalsContact O-N 3.12Å; N205-D208 PolarHBondContact N-OD2 3.29Å; N205-D208 VanDerWaalsContact O-CB 3.26Å; N205-D208 WeakPolarHBondContact O-CB 3.48Å; N205-D208 VanDerWaalsContact O-CG 3.25Å; N205-D208 PolarHBondContact O-N 3.49Å
206	A	64.6	Low	83.5	Confident	96 Å²	96	65.3 Å²	65.3	79%	0.793	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-30.8	178.3	0	0	0	0	0	112.9	D208 S209	A206-D208 VanDerWaalsContact C-N 3.27Å; A206-D208 PolarHBondContact O-N 3.47Å; A206-S209 PolarHBondContact O-OG 3.43Å
207	D	76.8	Confident	83.6	Confident	114 Å²	114	70.7 Å²	70.7	61%	0.61	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-6.7	179	-68.5	-22.1	0	0	0	114.6	N205 S209 S210 I211	N205-D207 PolarHBondContact O-N 3.1Å; N205-D207 VanDerWaalsContact O-N 3.12Å; D207-S209 PolarHBondContact O-N 3.22Å; D207-S209 VanDerWaalsContact O-N 3.15Å; D207-S210 PolarHBondContact O-N 3.06Å; D207-S210 PolarHBondContact O-OG 3.17Å; D207-I211 HydrophobicContact CB-CD1 4.25Å; D207-I211 WeakPolarHBondContact O-CD1 3.41Å; D207-I211 VanDerWaalsContact O-CG1 3.24Å; D207-I211 WeakPolarHBondContact O-CG1 2.99Å; D207-I211 PolarHBondContact O-N 2.89Å; D207-I211 VanDerWaalsContact O-N 3.13Å
208	D	80.4	Confident	83.7	Confident	30 Å²	30	73.4 Å²	73.4	16%	0.16	43%	0.426	C	S	.	.	H	α-helix	trans	-61.3	-29.1	-177.9	-76.5	-16.3	0	0	0	112.9	N7 N205 A206 R212	N7-D208 VanDerWaalsContact ND2-CB 3.35Å; N7-D208 WeakPolarHBondContact ND2-CB 3.1Å; N7-D208 PolarHBondContact ND2-OD1 2.76Å; N7-D208 PolarHBondContact ND2-OD2 3.22Å; N205-D208 PolarHBondContact N-OD2 3.29Å; N205-D208 VanDerWaalsContact O-CB 3.26Å; N205-D208 WeakPolarHBondContact O-CB 3.48Å; N205-D208 VanDerWaalsContact O-CG 3.25Å; N205-D208 PolarHBondContact O-N 3.49Å; A206-D208 VanDerWaalsContact C-N 3.27Å; A206-D208 PolarHBondContact O-N 3.47Å; D208-R212 VanDerWaalsContact O-CB 3.29Å; D208-R212 WeakPolarHBondContact O-CB 3.27Å; D208-R212 PolarHBondContact O-N 2.95Å
209	S	83.7	Confident	83.8	Confident	87 Å²	87	72.4 Å²	72.4	61%	0.608	42%	0.422	S	S	*	.	H	α-helix	trans	-71	-45.5	179.7	64.5	0	0	0	0	112.8	A206 D207 R212 S213	A206-S209 PolarHBondContact O-OG 3.43Å; D207-S209 PolarHBondContact O-N 3.22Å; D207-S209 VanDerWaalsContact O-N 3.15Å; S209-R212 PolarHBondContact O-N 3.23Å; S209-S213 PolarHBondContact O-N 3.41Å; S209-S213 VanDerWaalsContact O-N 3.1Å
210	S	87.6	Confident	84	Confident	61 Å²	61	75.3 Å²	75.3	43%	0.427	44%	0.443	S	S	.	.	H	α-helix	trans	-67.7	-43.4	178.6	65.2	0	0	0	0	110.5	D207 R212 S213 S214	D207-S210 PolarHBondContact O-N 3.06Å; D207-S210 PolarHBondContact O-OG 3.17Å; S210-R212 VanDerWaalsContact C-N 3.33Å; S210-R212 PolarHBondContact O-N 3.24Å; S210-S213 WeakPolarHBondContact O-CB 3.48Å; S210-S213 PolarHBondContact O-N 3.48Å; S210-S213 VanDerWaalsContact O-N 3.16Å; S210-S214 PolarHBondContact O-N 2.97Å; S210-S214 PolarHBondContact O-OG 3.02Å
211	I	86.8	Confident	84.3	Confident	56 Å²	56	78.6 Å²	78.6	29%	0.287	46%	0.463	S	S	.	.	H	α-helix	trans	-56	-48.8	174.3	-67.6	169.5	0	0	0	110.2	A9 D207 S213 S214 Y215	A9-I211 HydrophobicContact CB-CG2 4.11Å; D207-I211 HydrophobicContact CB-CD1 4.25Å; D207-I211 WeakPolarHBondContact O-CD1 3.41Å; D207-I211 VanDerWaalsContact O-CG1 3.24Å; D207-I211 WeakPolarHBondContact O-CG1 2.99Å; D207-I211 PolarHBondContact O-N 2.89Å; D207-I211 VanDerWaalsContact O-N 3.13Å; I211-S213 VanDerWaalsContact C-N 3.32Å; I211-S213 PolarHBondContact O-N 3.36Å; I211-S214 PolarHBondContact O-N 2.98Å; I211-Y215 HydrophobicContact CG2-CD2 3.72Å; I211-Y215 HydrophobicContact CG2-CE2 3.65Å; I211-Y215 WeakPolarHBondContact O-CD2 2.93Å; I211-Y215 PolarHBondContact O-N 3.21Å; I211-Y215 VanDerWaalsContact O-N 3.09Å
212	R	86.2	Confident	84.7	Confident	93 Å²	93	75.8 Å²	75.8	35%	0.351	45%	0.447	S	S	.	.	H	α-helix	trans	-60.3	-40.3	178.8	-174.3	177.2	-61.3	-162.6	0.3	112.5	N7 D208 S209 S210 R216	N7-R212 PolarHBondContact OD1-NH2 3.14Å; D208-R212 VanDerWaalsContact O-CB 3.29Å; D208-R212 WeakPolarHBondContact O-CB 3.27Å; D208-R212 PolarHBondContact O-N 2.95Å; S209-R212 PolarHBondContact O-N 3.23Å; S210-R212 VanDerWaalsContact C-N 3.33Å; S210-R212 PolarHBondContact O-N 3.24Å; R212-R216 VanDerWaalsContact O-CG 3.3Å; R212-R216 WeakPolarHBondContact O-CG 3.48Å; R212-R216 PolarHBondContact O-N 2.78Å
213	S	89.3	Confident	85.5	Confident	72 Å²	72	74.5 Å²	74.5	50%	0.503	44%	0.435	S	S	.	.	H	α-helix	trans	-62.9	-47.5	177.5	-168.9	0	0	0	0	111.7	S209 S210 I211 Y215 R216 L217	S209-S213 PolarHBondContact O-N 3.41Å; S209-S213 VanDerWaalsContact O-N 3.1Å; S210-S213 WeakPolarHBondContact O-CB 3.48Å; S210-S213 PolarHBondContact O-N 3.48Å; S210-S213 VanDerWaalsContact O-N 3.16Å; I211-S213 VanDerWaalsContact C-N 3.32Å; I211-S213 PolarHBondContact O-N 3.36Å; S213-Y215 PolarHBondContact O-N 2.69Å; S213-R216 WeakPolarHBondContact O-CB 3.43Å; S213-R216 PolarHBondContact O-N 3.47Å; S213-R216 VanDerWaalsContact O-N 3.14Å; S213-L217 PolarHBondContact O-N 3.22Å
214	S	92.1	Very high	86.8	Confident	82 Å²	82	78 Å²	78	57%	0.573	44%	0.443	S	S	*	.	H	α-helix	trans	-58.6	-44.1	177.9	-59.4	0	0	0	0	112.4	S210 I211 L217 L218	S210-S214 PolarHBondContact O-N 2.97Å; S210-S214 PolarHBondContact O-OG 3.02Å; I211-S214 PolarHBondContact O-N 2.98Å; S214-L217 WeakPolarHBondContact O-CB 3.32Å; S214-L217 PolarHBondContact O-N 3.44Å; S214-L218 PolarHBondContact O-N 2.88Å
215	Y	91.7	Very high	88.2	Confident	65 Å²	65	79.5 Å²	79.5	26%	0.255	44%	0.442	S	S	.	.	H	α-helix	trans	-69.3	-35	176.1	-78.7	-70.5	0	0	0	113.1	Q8 A9 I12 Y181 I211 S213 L217 L218 G219	Q8-Y215 HydrophobicContact CB-CD1 4.44Å; Q8-Y215 HydrophobicContact CB-CD2 4.12Å; Q8-Y215 HydrophobicContact CB-CG 4Å; A9-Y215 HydrophobicContact CB-CE2 3.8Å; I12-Y215 HydrophobicContact CD1-CD1 4.28Å; I12-Y215 HydrophobicContact CD1-CE1 3.65Å; Y181-Y215 WeakPolarHBondContact CB-O 3.23Å; Y181-Y215 AromaticContact CD1-CD1 3.62Å; Y181-Y215 HydrophobicContact CD1-CD1 3.62Å; Y181-Y215 HydrophobicContact CD1-CE1 4.47Å; Y181-Y215 HydrophobicContact CD1-CG 4.38Å; Y181-Y215 AromaticContact CE1-CD1 3.53Å; Y181-Y215 HydrophobicContact CE1-CD1 3.53Å; Y181-Y215 AromaticContact CE1-CE1 3.94Å; Y181-Y215 HydrophobicContact CE1-CE1 3.94Å; I211-Y215 HydrophobicContact CG2-CD2 3.72Å; I211-Y215 HydrophobicContact CG2-CE2 3.65Å; I211-Y215 WeakPolarHBondContact O-CD2 2.93Å; I211-Y215 PolarHBondContact O-N 3.21Å; I211-Y215 VanDerWaalsContact O-N 3.09Å; S213-Y215 PolarHBondContact O-N 2.69Å; Y215-L217 VanDerWaalsContact C-N 3.29Å; Y215-L217 PolarHBondContact O-N 2.68Å; Y215-L218 HydrophobicContact CD1-CD2 4.3Å; Y215-L218 WeakPolarHBondContact O-CB 3.49Å; Y215-L218 PolarHBondContact O-N 3.42Å; Y215-G219 PolarHBondContact O-N 3.22Å
216	R	92.2	Very high	89.4	Confident	139 Å²	139	75 Å²	75	53%	0.525	42%	0.418	S	S	.	.	H	α-helix	trans	-61.9	-39.8	172.3	-77	176.9	68.7	-168.9	1.4	111.4	R212 S213 G219 C220	R212-R216 VanDerWaalsContact O-CG 3.3Å; R212-R216 WeakPolarHBondContact O-CG 3.48Å; R212-R216 PolarHBondContact O-N 2.78Å; S213-R216 WeakPolarHBondContact O-CB 3.43Å; S213-R216 PolarHBondContact O-N 3.47Å; S213-R216 VanDerWaalsContact O-N 3.14Å; R216-G219 WeakPolarHBondContact O-CA 3.3Å; R216-G219 PolarHBondContact O-N 2.9Å; R216-C220 PolarHBondContact O-N 2.85Å; R216-C220 PolarHBondContact O-SG 2.93Å; R216-C220 VanDerWaalsContact O-SG 3.39Å
217	L	93.9	Very high	90.8	Very high	115 Å²	115	75.9 Å²	75.9	60%	0.602	41%	0.408	S	S	*	.	H	α-helix	trans	-63.2	-45.1	176.2	-156.8	153.4	0	0	0	110.8	S213 S214 Y215 G219 C220 V221	S213-L217 PolarHBondContact O-N 3.22Å; S214-L217 WeakPolarHBondContact O-CB 3.32Å; S214-L217 PolarHBondContact O-N 3.44Å; Y215-L217 VanDerWaalsContact C-N 3.29Å; Y215-L217 PolarHBondContact O-N 2.68Å; L217-G219 VanDerWaalsContact C-N 3.26Å; L217-G219 PolarHBondContact O-N 3.25Å; L217-C220 PolarHBondContact O-N 2.61Å; L217-C220 VanDerWaalsContact O-N 3.16Å; L217-V221 HydrophobicContact CD2-CG2 4.04Å; L217-V221 WeakPolarHBondContact O-CG2 3.42Å; L217-V221 PolarHBondContact O-N 2.98Å
218	L	93.1	Very high	91.7	Very high	75 Å²	75	73.8 Å²	73.8	39%	0.393	40%	0.4	S	S	.	.	H	α-helix	trans	-58.2	-38.2	172.5	-174.7	63.3	0	0	0	112.3	Y181 S214 Y215 V221 S222	Y181-L218 HydrophobicContact CD1-CD2 4.23Å; Y181-L218 HydrophobicContact CE1-CD2 3.83Å; Y181-L218 HydrophobicContact CE2-CD2 4.32Å; S214-L218 PolarHBondContact O-N 2.88Å; Y215-L218 HydrophobicContact CD1-CD2 4.3Å; Y215-L218 WeakPolarHBondContact O-CB 3.49Å; Y215-L218 PolarHBondContact O-N 3.42Å; L218-V221 PolarHBondContact O-N 3.02Å; L218-S222 WeakPolarHBondContact O-CB 3.41Å; L218-S222 PolarHBondContact O-N 3.43Å; L218-S222 PolarHBondContact O-OG 2.9Å
219	G	93.4	Very high	92.3	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-61.8	-47.8	173.5	0	0	0	0	0	112.7	Y181 Y215 R216 L217 V221 S222 F223	Y181-G219 VanDerWaalsContact CB-CA 3.45Å; Y215-G219 PolarHBondContact O-N 3.22Å; R216-G219 WeakPolarHBondContact O-CA 3.3Å; R216-G219 PolarHBondContact O-N 2.9Å; L217-G219 VanDerWaalsContact C-N 3.26Å; L217-G219 PolarHBondContact O-N 3.25Å; G219-V221 PolarHBondContact O-N 3.04Å; G219-S222 WeakPolarHBondContact O-CB 3.25Å; G219-S222 PolarHBondContact O-N 3.26Å; G219-F223 VanDerWaalsContact O-CD2 3.31Å; G219-F223 WeakPolarHBondContact O-CD2 3.47Å; G219-F223 PolarHBondContact O-N 2.84Å
220	C	94.4	Very high	92.7	Very high	77 Å²	77	72.6 Å²	72.6	52%	0.52	39%	0.388	S	S	.	.	H	α-helix	trans	-60.8	-43	176.2	-67.2	0	0	0	0	112.3	R216 L217 S222 F223 L224	R216-C220 PolarHBondContact O-N 2.85Å; R216-C220 PolarHBondContact O-SG 2.93Å; R216-C220 VanDerWaalsContact O-SG 3.39Å; L217-C220 PolarHBondContact O-N 2.61Å; L217-C220 VanDerWaalsContact O-N 3.16Å; C220-S222 VanDerWaalsContact C-N 3.34Å; C220-S222 PolarHBondContact O-N 2.85Å; C220-F223 WeakPolarHBondContact O-CB 3.13Å; C220-F223 PolarHBondContact O-N 3.39Å; C220-L224 PolarHBondContact O-N 3.48Å
221	V	95.9	Very high	93	Very high	75 Å²	75	72.7 Å²	72.7	46%	0.455	39%	0.389	S	S	.	.	H	α-helix	trans	-62	-43.8	175.8	173.1	0	0	0	0	110.7	L217 L218 G219 F223 L224 Q225	L217-V221 HydrophobicContact CD2-CG2 4.04Å; L217-V221 WeakPolarHBondContact O-CG2 3.42Å; L217-V221 PolarHBondContact O-N 2.98Å; L218-V221 PolarHBondContact O-N 3.02Å; G219-V221 PolarHBondContact O-N 3.04Å; V221-F223 VanDerWaalsContact C-N 3.32Å; V221-F223 PolarHBondContact O-N 3.42Å; V221-L224 PolarHBondContact O-N 3.24Å; V221-Q225 WeakPolarHBondContact O-CB 3.4Å; V221-Q225 PolarHBondContact O-N 2.99Å
222	S	93.8	Very high	93.3	Very high	30 Å²	30	75.4 Å²	75.4	21%	0.21	40%	0.403	C	S	.	.	H	α-helix	trans	-62.6	-38.8	177	-57.5	0	0	0	0	112.1	L218 G219 C220 L226	L218-S222 WeakPolarHBondContact O-CB 3.41Å; L218-S222 PolarHBondContact O-N 3.43Å; L218-S222 PolarHBondContact O-OG 2.9Å; G219-S222 WeakPolarHBondContact O-CB 3.25Å; G219-S222 PolarHBondContact O-N 3.26Å; C220-S222 VanDerWaalsContact C-N 3.34Å; C220-S222 PolarHBondContact O-N 2.85Å; S222-L226 WeakPolarHBondContact O-CB 3.39Å; S222-L226 PolarHBondContact O-N 3.34Å
223	F	94.9	Very high	93.4	Very high	54 Å²	54	75 Å²	75	24%	0.237	41%	0.405	C	S	.	.	H	α-helix	trans	-63.6	-46.4	173.4	-95	-70.6	0	0	0	112.4	L175 A178 L179 V182 G219 C220 V221 Q225 L226 L227	L175-F223 HydrophobicContact CD1-CD1 4.43Å; L175-F223 HydrophobicContact CD1-CE1 3.48Å; L175-F223 VanDerWaalsContact CD1-CE1 3.48Å; L175-F223 HydrophobicContact CD1-CZ 4.06Å; A178-F223 VanDerWaalsContact C-CE2 3.46Å; A178-F223 HydrophobicContact CB-CD1 4.26Å; A178-F223 HydrophobicContact CB-CD2 3.61Å; A178-F223 HydrophobicContact CB-CE1 4.27Å; A178-F223 HydrophobicContact CB-CE2 3.58Å; A178-F223 HydrophobicContact CB-CG 3.95Å; A178-F223 HydrophobicContact CB-CZ 3.93Å; L179-F223 HydrophobicContact CD2-CE2 4.26Å; L179-F223 HydrophobicContact CD2-CZ 3.63Å; L179-F223 HydrophobicContact CG-CE2 4.43Å; L179-F223 HydrophobicContact CG-CZ 3.74Å; V182-F223 HydrophobicContact CG2-CD2 4.05Å; V182-F223 HydrophobicContact CG2-CE2 3.89Å; G219-F223 VanDerWaalsContact O-CD2 3.31Å; G219-F223 WeakPolarHBondContact O-CD2 3.47Å; G219-F223 PolarHBondContact O-N 2.84Å; C220-F223 WeakPolarHBondContact O-CB 3.13Å; C220-F223 PolarHBondContact O-N 3.39Å; V221-F223 VanDerWaalsContact C-N 3.32Å; V221-F223 PolarHBondContact O-N 3.42Å; F223-Q225 VanDerWaalsContact C-N 3.34Å; F223-Q225 PolarHBondContact O-N 3.48Å; F223-L226 WeakPolarHBondContact O-CB 3.27Å; F223-L226 PolarHBondContact O-N 3.38Å; F223-L227 WeakPolarHBondContact O-CG 3.48Å; F223-L227 PolarHBondContact O-N 3.26Å
224	L	95.6	Very high	93.4	Very high	115 Å²	115	75.9 Å²	75.9	60%	0.602	40%	0.404	S	S	*	.	H	α-helix	trans	-61.8	-43.8	177.7	-175.6	135.7	0	0	0	110.9	C220 V221 L226 L227 V228	C220-L224 PolarHBondContact O-N 3.48Å; V221-L224 PolarHBondContact O-N 3.24Å; L224-L226 VanDerWaalsContact C-N 3.31Å; L224-L226 PolarHBondContact O-N 2.98Å; L224-L227 PolarHBondContact O-N 3.01Å; L224-V228 HydrophobicContact CD2-CG2 4.33Å; L224-V228 WeakPolarHBondContact O-CG2 3.23Å; L224-V228 PolarHBondContact O-N 3.41Å
225	Q	95.7	Very high	93.4	Very high	125 Å²	125	76.7 Å²	76.7	58%	0.584	40%	0.402	S	S	*	.	H	α-helix	trans	-58.8	-42.2	173.9	-176.5	-175.7	-2.1	0	0	112.1	V221 F223 T229	V221-Q225 WeakPolarHBondContact O-CB 3.4Å; V221-Q225 PolarHBondContact O-N 2.99Å; F223-Q225 VanDerWaalsContact C-N 3.34Å; F223-Q225 PolarHBondContact O-N 3.48Å; Q225-T229 WeakPolarHBondContact O-CB 3.33Å; Q225-T229 PolarHBondContact O-N 2.93Å; Q225-T229 PolarHBondContact O-OG1 2.81Å
226	L	94.5	Very high	93.3	Very high	14 Å²	14	77.1 Å²	77.1	7%	0.073	41%	0.408	C	S	.	.	H	α-helix	trans	-63.4	-45.2	176.9	-170.5	63.3	0	0	0	111.6	L171 R174 L175 S222 F223 L224 T229 L230	L171-L226 HydrophobicContact CD1-CD1 3.55Å; L171-L226 HydrophobicContact CD1-CD2 4.42Å; L171-L226 HydrophobicContact CD1-CG 4.16Å; R174-L226 HydrophobicContact CB-CD1 3.76Å; R174-L226 HydrophobicContact CB-CD2 4.49Å; R174-L226 HydrophobicContact CG-CD1 4.5Å; L175-L226 HydrophobicContact CB-CD2 4.08Å; L175-L226 HydrophobicContact CD1-CD2 4.2Å; S222-L226 WeakPolarHBondContact O-CB 3.39Å; S222-L226 PolarHBondContact O-N 3.34Å; F223-L226 WeakPolarHBondContact O-CB 3.27Å; F223-L226 PolarHBondContact O-N 3.38Å; L224-L226 VanDerWaalsContact C-N 3.31Å; L224-L226 PolarHBondContact O-N 2.98Å; L226-T229 PolarHBondContact O-N 3.47Å; L226-L230 HydrophobicContact CG-CD1 4.38Å; L226-L230 WeakPolarHBondContact O-CB 3.34Å; L226-L230 WeakPolarHBondContact O-CG 3.49Å; L226-L230 PolarHBondContact O-N 2.92Å
227	L	95	Very high	92.9	Very high	115 Å²	115	74.7 Å²	74.7	60%	0.602	41%	0.405	S	S	*	.	H	α-helix	trans	-63.3	-43.6	178.1	-71.8	173.4	0	0	0	112	F223 L224 L230 S231	F223-L227 WeakPolarHBondContact O-CG 3.48Å; F223-L227 PolarHBondContact O-N 3.26Å; L224-L227 PolarHBondContact O-N 3.01Å; L227-L230 PolarHBondContact O-N 2.96Å; L227-S231 WeakPolarHBondContact O-CB 3.41Å; L227-S231 PolarHBondContact O-N 3.3Å; L227-S231 PolarHBondContact O-OG 3.42Å
228	V	95.8	Very high	92.7	Very high	70 Å²	70	76.6 Å²	76.6	42%	0.424	40%	0.404	S	S	.	.	H	α-helix	trans	-63.1	-44	175.5	172.1	0	0	0	0	110.9	L224 L230 S231 L232	L224-V228 HydrophobicContact CD2-CG2 4.33Å; L224-V228 WeakPolarHBondContact O-CG2 3.23Å; L224-V228 PolarHBondContact O-N 3.41Å; V228-L230 PolarHBondContact O-N 3.21Å; V228-S231 WeakPolarHBondContact CA-OG 3.25Å; V228-S231 PolarHBondContact O-N 2.88Å; V228-S231 PolarHBondContact O-OG 2.9Å; V228-L232 HydrophobicContact CG1-CD1 4.04Å; V228-L232 HydrophobicContact CG1-CG 4.45Å; V228-L232 WeakPolarHBondContact O-CB 3.38Å; V228-L232 VanDerWaalsContact O-CG 3.27Å; V228-L232 WeakPolarHBondContact O-CG 3.37Å; V228-L232 PolarHBondContact O-N 3.43Å
229	T	92.6	Very high	92.4	Very high	43 Å²	43	79 Å²	79	26%	0.264	41%	0.414	S	S	.	.	H	α-helix	trans	-62.9	-45.4	178.2	-56.5	0	0	0	0	111.1	Q225 L226 L232 Q233	Q225-T229 WeakPolarHBondContact O-CB 3.33Å; Q225-T229 PolarHBondContact O-N 2.93Å; Q225-T229 PolarHBondContact O-OG1 2.81Å; L226-T229 PolarHBondContact O-N 3.47Å; T229-L232 PolarHBondContact O-N 2.85Å; T229-Q233 WeakPolarHBondContact O-CB 3.45Å; T229-Q233 VanDerWaalsContact O-CG 3.29Å; T229-Q233 WeakPolarHBondContact O-CG 3.42Å; T229-Q233 PolarHBondContact O-N 2.64Å
230	L	92.9	Very high	91.8	Very high	48 Å²	48	86.1 Å²	86.1	25%	0.251	44%	0.441	S	S	.	.	H	α-helix	trans	-63	-43.6	177.1	-81	177.6	0	0	0	112.2	L171 L226 L227 V228 Q233 L234	L171-L230 HydrophobicContact CD1-CD1 3.9Å; L171-L230 HydrophobicContact CD1-CD2 3.6Å; L171-L230 HydrophobicContact CD1-CG 3.85Å; L171-L230 HydrophobicContact CD2-CD1 4.45Å; L171-L230 HydrophobicContact CD2-CD2 3.97Å; L171-L230 HydrophobicContact CG-CD2 4.45Å; L226-L230 HydrophobicContact CG-CD1 4.38Å; L226-L230 WeakPolarHBondContact O-CB 3.34Å; L226-L230 WeakPolarHBondContact O-CG 3.49Å; L226-L230 PolarHBondContact O-N 2.92Å; L227-L230 PolarHBondContact O-N 2.96Å; V228-L230 PolarHBondContact O-N 3.21Å; L230-Q233 PolarHBondContact O-N 3.28Å; L230-L234 WeakPolarHBondContact O-CB 3.27Å; L230-L234 VanDerWaalsContact O-CG 3.23Å; L230-L234 WeakPolarHBondContact O-CG 3.45Å; L230-L234 PolarHBondContact O-N 2.92Å
231	S	93.1	Very high	91.2	Very high	64 Å²	64	88 Å²	88	45%	0.448	44%	0.442	S	S	.	.	H	α-helix	trans	-65.5	-41	-179.8	69.3	0	0	0	0	111.4	L227 V228 L234 N235	L227-S231 WeakPolarHBondContact O-CB 3.41Å; L227-S231 PolarHBondContact O-N 3.3Å; L227-S231 PolarHBondContact O-OG 3.42Å; V228-S231 WeakPolarHBondContact CA-OG 3.25Å; V228-S231 PolarHBondContact O-N 2.88Å; V228-S231 PolarHBondContact O-OG 2.9Å; S231-L234 PolarHBondContact O-N 3.02Å; S231-N235 VanDerWaalsContact O-CB 3.25Å; S231-N235 WeakPolarHBondContact O-CB 3.29Å; S231-N235 PolarHBondContact O-N 3.47Å
232	L	93.1	Very high	90.7	Very high	112 Å²	112	92.5 Å²	92.5	59%	0.586	45%	0.45	S	S	*	.	H	α-helix	trans	-64.1	-43.9	174.1	-70.2	175.6	0	0	0	112	V228 T229 N235 N236	V228-L232 HydrophobicContact CG1-CD1 4.04Å; V228-L232 HydrophobicContact CG1-CG 4.45Å; V228-L232 WeakPolarHBondContact O-CB 3.38Å; V228-L232 VanDerWaalsContact O-CG 3.27Å; V228-L232 WeakPolarHBondContact O-CG 3.37Å; V228-L232 PolarHBondContact O-N 3.43Å; T229-L232 PolarHBondContact O-N 2.85Å; L232-N235 PolarHBondContact O-N 3.49Å; L232-N236 WeakPolarHBondContact O-CB 3.31Å; L232-N236 PolarHBondContact O-N 2.71Å
233	Q	89.1	Confident	89.9	Confident	84 Å²	84	92.7 Å²	92.7	39%	0.393	45%	0.454	S	S	.	.	H	α-helix	trans	-62.6	-46.4	176.4	-76	-179.9	-26.1	0	0	111.7	T229 L230 N235 N236 L237	T229-Q233 WeakPolarHBondContact O-CB 3.45Å; T229-Q233 VanDerWaalsContact O-CG 3.29Å; T229-Q233 WeakPolarHBondContact O-CG 3.42Å; T229-Q233 PolarHBondContact O-N 2.64Å; L230-Q233 PolarHBondContact O-N 3.28Å; Q233-N235 VanDerWaalsContact C-N 3.34Å; Q233-N235 PolarHBondContact O-N 3.49Å; Q233-N236 PolarHBondContact O-N 2.93Å; Q233-L237 WeakPolarHBondContact O-CB 3.01Å; Q233-L237 VanDerWaalsContact O-CG 3.28Å; Q233-L237 WeakPolarHBondContact O-CG 3.28Å; Q233-L237 PolarHBondContact O-N 2.54Å
234	L	89.4	Confident	89.1	Confident	92 Å²	92	98.5 Å²	98.5	48%	0.482	47%	0.474	S	S	.	.	H	α-helix	trans	-63.9	-39.3	176.7	-72.5	171.2	0	0	0	111.8	L230 S231 L237 R238	L230-L234 WeakPolarHBondContact O-CB 3.27Å; L230-L234 VanDerWaalsContact O-CG 3.23Å; L230-L234 WeakPolarHBondContact O-CG 3.45Å; L230-L234 PolarHBondContact O-N 2.92Å; S231-L234 PolarHBondContact O-N 3.02Å; L234-L237 PolarHBondContact O-N 3.07Å; L234-R238 WeakPolarHBondContact O-CB 3.21Å; L234-R238 VanDerWaalsContact O-CG 3.25Å; L234-R238 WeakPolarHBondContact O-CG 3.35Å; L234-R238 PolarHBondContact O-N 3.25Å
235	N	91.3	Very high	88.3	Confident	99 Å²	99	98.7 Å²	98.7	53%	0.529	47%	0.472	S	S	.	.	H	α-helix	trans	-65.3	-44.7	176.4	-167.6	22.9	0	0	0	111.2	S231 L232 Q233 L237 R238 Q239	S231-N235 VanDerWaalsContact O-CB 3.25Å; S231-N235 WeakPolarHBondContact O-CB 3.29Å; S231-N235 PolarHBondContact O-N 3.47Å; L232-N235 PolarHBondContact O-N 3.49Å; Q233-N235 VanDerWaalsContact C-N 3.34Å; Q233-N235 PolarHBondContact O-N 3.49Å; N235-L237 VanDerWaalsContact C-N 3.33Å; N235-L237 PolarHBondContact O-N 2.81Å; N235-R238 PolarHBondContact O-N 2.88Å; N235-Q239 VanDerWaalsContact O-CB 3.3Å; N235-Q239 WeakPolarHBondContact O-CB 3.38Å; N235-Q239 PolarHBondContact O-N 3.34Å
236	N	88.6	Confident	87.5	Confident	74 Å²	74	98.2 Å²	98.2	40%	0.396	47%	0.47	S	S	.	.	H	α-helix	trans	-61.7	-41.4	176.5	-159.6	-57	0	0	0	111.4	L232 Q233 Q239 R240	L232-N236 WeakPolarHBondContact O-CB 3.31Å; L232-N236 PolarHBondContact O-N 2.71Å; Q233-N236 PolarHBondContact O-N 2.93Å; N236-Q239 PolarHBondContact O-N 2.94Å; N236-R240 WeakPolarHBondContact O-CB 3.22Å; N236-R240 VanDerWaalsContact O-CG 3.24Å; N236-R240 WeakPolarHBondContact O-CG 3.28Å; N236-R240 PolarHBondContact O-N 3.27Å; N236-R240 PolarHBondContact OD1-NE 2.97Å
237	L	85.6	Confident	86.2	Confident	88 Å²	88	103.9 Å²	103.9	46%	0.461	49%	0.491	S	S	.	.	H	α-helix	trans	-65.1	-44.9	174.9	-70.8	175.1	0	0	0	112.3	Q233 L234 N235 Q239 R240 Q241	Q233-L237 WeakPolarHBondContact O-CB 3.01Å; Q233-L237 VanDerWaalsContact O-CG 3.28Å; Q233-L237 WeakPolarHBondContact O-CG 3.28Å; Q233-L237 PolarHBondContact O-N 2.54Å; L234-L237 PolarHBondContact O-N 3.07Å; N235-L237 VanDerWaalsContact C-N 3.33Å; N235-L237 PolarHBondContact O-N 2.81Å; L237-Q239 VanDerWaalsContact C-N 3.33Å; L237-Q239 PolarHBondContact O-N 3.4Å; L237-R240 PolarHBondContact O-N 3.26Å; L237-Q241 WeakPolarHBondContact O-CG 3.34Å; L237-Q241 PolarHBondContact O-N 3.09Å
238	R	87.9	Confident	85.2	Confident	155 Å²	155	105 Å²	105	59%	0.585	49%	0.493	S	S	*	.	H	α-helix	trans	-60.8	-42.7	174.9	-77.1	176.4	178.3	-172.2	0	111.3	L234 N235 Q241 R242	L234-R238 WeakPolarHBondContact O-CB 3.21Å; L234-R238 VanDerWaalsContact O-CG 3.25Å; L234-R238 WeakPolarHBondContact O-CG 3.35Å; L234-R238 PolarHBondContact O-N 3.25Å; N235-R238 PolarHBondContact O-N 2.88Å; R238-Q241 PolarHBondContact O-N 3.19Å; R238-R242 WeakPolarHBondContact O-CG 3.35Å; R238-R242 PolarHBondContact O-N 3.46Å
239	Q	86.9	Confident	84	Confident	126 Å²	126	106.3 Å²	106.3	59%	0.589	50%	0.496	S	S	*	.	H	α-helix	trans	-62.7	-43.8	176.6	-172	179.6	5.5	0	0	111.2	N235 N236 L237 Q241 R242 A243	N235-Q239 VanDerWaalsContact O-CB 3.3Å; N235-Q239 WeakPolarHBondContact O-CB 3.38Å; N235-Q239 PolarHBondContact O-N 3.34Å; N236-Q239 PolarHBondContact O-N 2.94Å; L237-Q239 VanDerWaalsContact C-N 3.33Å; L237-Q239 PolarHBondContact O-N 3.4Å; Q239-Q241 VanDerWaalsContact C-N 3.33Å; Q239-Q241 PolarHBondContact O-N 2.91Å; Q239-R242 PolarHBondContact O-N 3.43Å; Q239-A243 WeakPolarHBondContact O-CB 3.46Å; Q239-A243 PolarHBondContact O-N 3.03Å
240	R	82.1	Confident	82.8	Confident	149 Å²	149	111.9 Å²	111.9	56%	0.562	51%	0.514	S	S	*	.	H	α-helix	trans	-62.2	-39.6	173.9	-72.8	173.5	-172.8	-157.8	-3	112.2	N236 L237 R244	N236-R240 WeakPolarHBondContact O-CB 3.22Å; N236-R240 VanDerWaalsContact O-CG 3.24Å; N236-R240 WeakPolarHBondContact O-CG 3.28Å; N236-R240 PolarHBondContact O-N 3.27Å; N236-R240 PolarHBondContact OD1-NE 2.97Å; L237-R240 PolarHBondContact O-N 3.26Å; R240-R244 VanDerWaalsContact O-CG 3.28Å; R240-R244 WeakPolarHBondContact O-CG 3.38Å; R240-R244 PolarHBondContact O-N 2.77Å
241	Q	81.8	Confident	81.4	Confident	117 Å²	117	116.5 Å²	116.5	55%	0.547	53%	0.528	S	S	.	.	H	α-helix	trans	-66.7	-45.2	176.9	-75.2	176.4	-7.5	0	0	111.9	L237 R238 Q239 R244 Q245	L237-Q241 WeakPolarHBondContact O-CG 3.34Å; L237-Q241 PolarHBondContact O-N 3.09Å; R238-Q241 PolarHBondContact O-N 3.19Å; Q239-Q241 VanDerWaalsContact C-N 3.33Å; Q239-Q241 PolarHBondContact O-N 2.91Å; Q241-R244 WeakPolarHBondContact O-CB 3.44Å; Q241-R244 PolarHBondContact O-N 3.28Å; Q241-Q245 WeakPolarHBondContact O-CG 3.31Å; Q241-Q245 PolarHBondContact O-N 2.9Å
242	R	84.9	Confident	80.1	Confident	168 Å²	168	117.9 Å²	117.9	63%	0.634	54%	0.537	S	S	*	.	H	α-helix	trans	-59.4	-49	175.6	-74.1	179.4	-177.1	-170	-0.4	111.6	R238 Q239 R244 Q245 E246	R238-R242 WeakPolarHBondContact O-CG 3.35Å; R238-R242 PolarHBondContact O-N 3.46Å; Q239-R242 PolarHBondContact O-N 3.43Å; R242-R244 VanDerWaalsContact C-N 3.29Å; R242-R244 PolarHBondContact O-N 2.97Å; R242-Q245 PolarHBondContact O-N 3.25Å; R242-Q245 VanDerWaalsContact O-N 3.08Å; R242-E246 WeakPolarHBondContact O-CG 3.49Å; R242-E246 PolarHBondContact O-N 3.4Å
243	A	77.8	Confident	78.7	Confident	35 Å²	35	118.5 Å²	118.5	29%	0.289	54%	0.541	S	S	.	.	H	α-helix	trans	-53.9	-49.1	174.8	0	0	0	0	0	110.4	Q239 Q245 E246 W247	Q239-A243 WeakPolarHBondContact O-CB 3.46Å; Q239-A243 PolarHBondContact O-N 3.03Å; A243-Q245 VanDerWaalsContact C-N 3.33Å; A243-Q245 PolarHBondContact O-N 3.19Å; A243-E246 PolarHBondContact O-N 2.93Å; A243-W247 VanDerWaalsContact C-CD1 3.46Å; A243-W247 WeakPolarHBondContact O-CB 3.37Å; A243-W247 PolarHBondContact O-N 3.25Å
244	R	78.4	Confident	77.2	Confident	175 Å²	175	115.6 Å²	115.6	66%	0.66	53%	0.53	S	S	*	.	H	α-helix	trans	-58.4	-39.7	177.7	-74.4	174.2	-176.8	-176.9	0.4	113.4	R240 Q241 R242 Q248	R240-R244 VanDerWaalsContact O-CG 3.28Å; R240-R244 WeakPolarHBondContact O-CG 3.38Å; R240-R244 PolarHBondContact O-N 2.77Å; Q241-R244 WeakPolarHBondContact O-CB 3.44Å; Q241-R244 PolarHBondContact O-N 3.28Å; R242-R244 VanDerWaalsContact C-N 3.29Å; R242-R244 PolarHBondContact O-N 2.97Å; R244-Q248 WeakPolarHBondContact O-CG 3.11Å; R244-Q248 PolarHBondContact O-N 3.34Å
245	Q	77.3	Confident	75.5	Confident	120 Å²	120	116 Å²	116	56%	0.561	54%	0.538	S	S	*	.	H	α-helix	trans	-68.6	-47.1	177.6	-73.3	176.9	-17.5	0	0	111.9	Q241 R242 A243 W247 Q248 I249	Q241-Q245 WeakPolarHBondContact O-CG 3.31Å; Q241-Q245 PolarHBondContact O-N 2.9Å; R242-Q245 PolarHBondContact O-N 3.25Å; R242-Q245 VanDerWaalsContact O-N 3.08Å; A243-Q245 VanDerWaalsContact C-N 3.33Å; A243-Q245 PolarHBondContact O-N 3.19Å; Q245-W247 VanDerWaalsContact C-N 3.28Å; Q245-W247 PolarHBondContact O-N 3.48Å; Q245-Q248 PolarHBondContact O-N 3.26Å; Q245-Q248 VanDerWaalsContact O-N 3.12Å; Q245-I249 WeakPolarHBondContact O-CG1 3.41Å; Q245-I249 PolarHBondContact O-N 2.96Å
246	E	80.3	Confident	73.6	Confident	115 Å²	115	121.3 Å²	121.3	54%	0.537	55%	0.55	S	S	.	*	H	α-helix	trans	-56.4	-44.9	174.3	-71.7	171.4	-177.5	0	0	110.5	R242 A243 Q248 I249 Y250	R242-E246 WeakPolarHBondContact O-CG 3.49Å; R242-E246 PolarHBondContact O-N 3.4Å; A243-E246 PolarHBondContact O-N 2.93Å; E246-Q248 PolarHBondContact O-N 2.95Å; E246-I249 PolarHBondContact O-N 3.47Å; E246-Y250 HydrophobicContact CB-CE2 4.48Å; E246-Y250 WeakPolarHBondContact O-CD2 3.39Å; E246-Y250 PolarHBondContact O-N 2.91Å
247	W	67.3	Low	71.9	Confident	133 Å²	133	125.8 Å²	125.8	50%	0.504	57%	0.568	S	S	.	*	H	α-helix	trans	-59.3	-42.4	174.7	-76.5	116.8	0	0	0	113	A243 Q245 I249 Y250 R251 W291	A243-W247 VanDerWaalsContact C-CD1 3.46Å; A243-W247 WeakPolarHBondContact O-CB 3.37Å; A243-W247 PolarHBondContact O-N 3.25Å; Q245-W247 VanDerWaalsContact C-N 3.28Å; Q245-W247 PolarHBondContact O-N 3.48Å; W247-I249 VanDerWaalsContact C-N 3.34Å; W247-I249 PolarHBondContact O-N 2.91Å; W247-Y250 PolarHBondContact O-N 2.97Å; W247-R251 WeakPolarHBondContact O-CB 3.21Å; W247-R251 PolarHBondContact O-N 3.49Å; W247-W291 AromaticContact CE3-NE1 3.98Å; W247-W291 AromaticContact CH2-CE2 3.6Å; W247-W291 AromaticContact CH2-CZ2 3.7Å; W247-W291 HydrophobicContact CH2-CZ2 3.7Å; W247-W291 AromaticContact CH2-NE1 3.14Å; W247-W291 HydrophobicContact CZ2-CZ2 4.24Å; W247-W291 AromaticContact CZ3-CD1 3.66Å; W247-W291 AromaticContact CZ3-CE2 3.97Å; W247-W291 AromaticContact CZ3-NE1 3.07Å
248	Q	72.6	Confident	69.9	Low	138 Å²	138	126.4 Å²	126.4	65%	0.645	58%	0.578	S	S	*	*	H	α-helix	trans	-64	-39.3	177.1	-77.1	179.1	-16	0	0	112.2	R244 Q245 E246 R251 S252	R244-Q248 WeakPolarHBondContact O-CG 3.11Å; R244-Q248 PolarHBondContact O-N 3.34Å; Q245-Q248 PolarHBondContact O-N 3.26Å; Q245-Q248 VanDerWaalsContact O-N 3.12Å; E246-Q248 PolarHBondContact O-N 2.95Å; Q248-R251 WeakPolarHBondContact O-CB 3.42Å; Q248-R251 PolarHBondContact O-N 2.77Å; Q248-S252 PolarHBondContact O-N 3.45Å
249	I	71.7	Confident	68	Low	98 Å²	98	124.3 Å²	124.3	50%	0.503	59%	0.594	S	S	.	*	H	α-helix	trans	-64.4	-49	176.7	-66.5	167.2	0	0	0	110	Q245 E246 W247 R251 S252 L253	Q245-I249 WeakPolarHBondContact O-CG1 3.41Å; Q245-I249 PolarHBondContact O-N 2.96Å; E246-I249 PolarHBondContact O-N 3.47Å; W247-I249 VanDerWaalsContact C-N 3.34Å; W247-I249 PolarHBondContact O-N 2.91Å; I249-R251 VanDerWaalsContact C-N 3.25Å; I249-R251 PolarHBondContact O-N 2.89Å; I249-S252 PolarHBondContact O-N 3.28Å; I249-S252 PolarHBondContact O-OG 2.77Å; I249-L253 HydrophobicContact CG2-CD1 3.6Å; I249-L253 HydrophobicContact CG2-CG 4.33Å; I249-L253 PolarHBondContact O-N 2.81Å
250	Y	66.3	Low	65.9	Low	160 Å²	160	122.5 Å²	122.5	63%	0.627	60%	0.595	S	S	*	*	H	α-helix	trans	-57.9	-36.7	175.6	-76.5	-63.2	0	0	0	112.8	E246 W247 S254	E246-Y250 HydrophobicContact CB-CE2 4.48Å; E246-Y250 WeakPolarHBondContact O-CD2 3.39Å; E246-Y250 PolarHBondContact O-N 2.91Å; W247-Y250 PolarHBondContact O-N 2.97Å; Y250-S254 PolarHBondContact O-N 3.01Å
251	R	64.5	Low	64.3	Low	145 Å²	145	121.2 Å²	121.2	55%	0.547	61%	0.608	S	S	.	*	H	α-helix	trans	-63.9	-42.6	174	-174.4	172.7	-152.4	167.1	10.6	112.4	W247 Q248 I249 E292	W247-R251 WeakPolarHBondContact O-CB 3.21Å; W247-R251 PolarHBondContact O-N 3.49Å; Q248-R251 WeakPolarHBondContact O-CB 3.42Å; Q248-R251 PolarHBondContact O-N 2.77Å; I249-R251 VanDerWaalsContact C-N 3.25Å; I249-R251 PolarHBondContact O-N 2.89Å; R251-E292 WeakPolarHBondContact CB-OE1 3.34Å; R251-E292 WeakPolarHBondContact CD-OE1 3.2Å; R251-E292 WeakPolarHBondContact CG-OE1 3.42Å; R251-E292 IonicContact CZ-OE1 3.77Å; R251-E292 IonicContact CZ-OE2 2.96Å; R251-E292 VanDerWaalsContact NE-CD 3.31Å; R251-E292 IonicContact NE-OE1 3.18Å; R251-E292 PolarHBondContact NE-OE1 3.21Å; R251-E292 IonicContact NE-OE2 2.84Å; R251-E292 PolarHBondContact NE-OE2 2.97Å; R251-E292 IonicContact NH1-OE2 3.96Å; R251-E292 IonicContact NH2-OE2 2.7Å; R251-E292 PolarHBondContact NH2-OE2 3.11Å
252	S	65.8	Low	62.5	Low	92 Å²	92	119.4 Å²	119.4	64%	0.643	61%	0.609	S	S	*	*	H	α-helix	trans	-73.5	-32.6	-178.1	70.1	0	0	0	0	114	Q248 I249 S254	Q248-S252 PolarHBondContact O-N 3.45Å; I249-S252 PolarHBondContact O-N 3.28Å; I249-S252 PolarHBondContact O-OG 2.77Å; S252-S254 VanDerWaalsContact C-N 3.35Å
253	L	63	Low	60.6	Low	126 Å²	126	117.8 Å²	117.8	66%	0.66	62%	0.623	S	S	*	*	H	α-helix	trans	-83.5	-10.1	178.8	-69.5	169.8	0	0	0	113.3	I249 P255	I249-L253 HydrophobicContact CG2-CD1 3.6Å; I249-L253 HydrophobicContact CG2-CG 4.33Å; I249-L253 PolarHBondContact O-N 2.81Å; L253-P255 VanDerWaalsContact O-CD 3.26Å; L253-P255 WeakPolarHBondContact O-CD 3.36Å; L253-P255 VanDerWaalsContact O-N 3.14Å
254	S	56.8	Low	59.3	Low	23 Å²	23	121.6 Å²	121.6	16%	0.161	64%	0.643	C	S	.	*	S	Bend	trans	-63.3	115.3	176.7	-164.9	0	0	0	0	109	Y250 S252 R256	Y250-S254 PolarHBondContact O-N 3.01Å; S252-S254 VanDerWaalsContact C-N 3.35Å; S254-R256 PolarHBondContact O-N 3.02Å
255	P	54.9	Low	58.1	Low	100 Å²	100	119.1 Å²	119.1	65%	0.649	65%	0.65	S	S	*	*			trans	-54.9	120.7	-173.6	-23.5	31.9	0	0	0	109.9	L253 H257	L253-P255 VanDerWaalsContact O-CD 3.26Å; L253-P255 WeakPolarHBondContact O-CD 3.36Å; L253-P255 VanDerWaalsContact O-N 3.14Å; P255-H257 VanDerWaalsContact C-N 3.26Å; P255-H257 PolarHBondContact O-N 2.92Å
256	R	51	Low	57	Low	211 Å²	211	124.9 Å²	124.9	80%	0.796	67%	0.666	S	S	*	*			trans	-62.7	100.2	156.2	-96.7	179.9	171.3	173.4	-2.7	104.6	S254 P258	S254-R256 PolarHBondContact O-N 3.02Å; R256-P258 WeakPolarHBondContact O-CD 3.4Å
257	H	53.8	Low	56.1	Low	168 Å²	168	123.4 Å²	123.4	78%	0.778	67%	0.667	S	S	*	*			trans	-57.8	112.6	163.8	-107.2	-76.7	0	0	0	106	P255 A259	P255-H257 VanDerWaalsContact C-N 3.26Å; P255-H257 PolarHBondContact O-N 2.92Å; H257-A259 PolarHBondContact O-N 3.09Å
258	P	43.1	Very low	56.6	Low	101 Å²	101	119 Å²	119	66%	0.656	66%	0.658	S	S	*	*			trans	-60.4	141.3	167	22.7	-21.1	0	0	0	106.2	R256 S260	R256-P258 WeakPolarHBondContact O-CD 3.4Å; P258-S260 PolarHBondContact O-N 2.87Å
259	A	48.5	Very low	57.2	Low	111 Å²	111	121.3 Å²	121.3	92%	0.917	66%	0.661	S	S	*	*			trans	-63.3	81.3	173.5	0	0	0	0	0	108.7	H257 S261	H257-A259 PolarHBondContact O-N 3.09Å; A259-S261 PolarHBondContact O-N 2.95Å
260	S	43	Very low	58	Low	88 Å²	88	116.7 Å²	116.7	62%	0.615	64%	0.638	S	S	*	*			trans	-82.4	111	171.7	56.6	0	0	0	0	107.7	P258 S262	P258-S260 PolarHBondContact O-N 2.87Å; S260-S262 PolarHBondContact O-N 2.67Å; S260-S262 VanDerWaalsContact O-N 3.11Å
261	S	48.1	Very low	59	Low	121 Å²	121	113.1 Å²	113.1	85%	0.846	63%	0.628	S	S	*	*			trans	-53.1	100.4	167.6	49.1	0	0	0	0	112.1	A259	A259-S261 PolarHBondContact O-N 2.95Å
262	S	42.8	Very low	60.1	Low	80 Å²	80	109 Å²	109	56%	0.559	62%	0.617	S	S	*	*	S	Bend	trans	-166.2	116	151.3	49.7	0	0	0	0	111.4	S260 T264	S260-S262 PolarHBondContact O-N 2.67Å; S260-S262 VanDerWaalsContact O-N 3.11Å; S262-T264 VanDerWaalsContact C-N 3.32Å; S262-T264 PolarHBondContact O-N 2.88Å; S262-T264 PolarHBondContact O-OG1 3.38Å
263	S	45.6	Very low	61.1	Low	134 Å²	134	106.8 Å²	106.8	94%	0.937	60%	0.601	S	S	*	*	S	Bend	trans	15.6	53.8	153.9	62.5	0	0	0	0	119.7
264	T	50.1	Low	62.1	Low	114 Å²	114	107 Å²	107	70%	0.699	60%	0.602	S	S	*	*			trans	-123.9	149.9	170.9	30.6	0	0	0	0	109.7	S262 R266	S262-T264 VanDerWaalsContact C-N 3.32Å; S262-T264 PolarHBondContact O-N 2.88Å; S262-T264 PolarHBondContact O-OG1 3.38Å; T264-R266 PolarHBondContact O-N 3.49Å
265	P	53	Low	63.3	Low	123 Å²	123	111 Å²	111	80%	0.799	62%	0.618	S	S	*	*			trans	-54.9	135.6	-176.3	21.8	-31.8	0	0	0	110
266	R	55.6	Low	64.7	Low	242 Å²	242	108.6 Å²	108.6	91%	0.913	61%	0.606	S	S	*	*			trans	-45.5	126.2	-175.6	-71.2	177	165.9	179.2	-3.6	110.1	T264 A268	T264-R266 PolarHBondContact O-N 3.49Å; R266-A268 PolarHBondContact O-N 2.82Å
267	P	61	Low	66.3	Low	84 Å²	84	101 Å²	101	55%	0.545	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-59.1	128	179.7	23.5	-32.8	0	0	0	109.1	R269 A276	P267-R269 PolarHBondContact O-N 2.98Å; P267-R269 VanDerWaalsContact O-N 3.1Å; P267-A276 HydrophobicContact CB-CB 4.31Å; P267-A276 HydrophobicContact CG-CB 4.42Å
268	A	76.8	Confident	67.6	Low	39 Å²	39	97.1 Å²	97.1	32%	0.322	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-58.7	119	-178	0	0	0	0	0	109.3	R266 R277	R266-A268 PolarHBondContact O-N 2.82Å; A268-R277 WeakPolarHBondContact O-CB 3.4Å; A268-R277 PolarHBondContact O-N 3.26Å
269	R	85.6	Confident	69.5	Low	188 Å²	188	95.5 Å²	95.5	71%	0.709	54%	0.542	S	S	*	.	B	Isolated β-bridge	trans	-76.7	150.8	179.6	-73.1	-178.2	164.2	178.8	-7.3	111	P267 E275	P267-R269 PolarHBondContact O-N 2.98Å; P267-R269 VanDerWaalsContact O-N 3.1Å; R269-E275 CarbonylContact C-O 3.59Å; R269-E275 VanDerWaalsContact CA-O 3.32Å; R269-E275 WeakPolarHBondContact CA-O 3.41Å
270	C	88.2	Confident	71.4	Confident	1 Å²	1	90.6 Å²	90.6	1%	0.007	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-87.9	130.9	169	-179.4	0	0	0	0	109.7	L272 L274 E275 R277 C290	C270-L272 PolarHBondContact O-N 3.47Å; C270-L274 WeakPolarHBondContact O-CA 3.23Å; C270-L274 PolarHBondContact O-N 3.24Å; C270-E275 PolarHBondContact N-O 2.95Å; C270-R277 HydrophobicContact CB-CB 4.49Å; C270-C290 WeakPolarHBondContact CB-SG 3.3Å; C270-C290 PolarHBondContact SG-N 3.14Å; C270-C290 VanDerWaalsContact SG-N 3.39Å
271	I	87.9	Confident	73.7	Confident	84 Å²	84	86.4 Å²	86.4	43%	0.431	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-16.2	-179	69.5	168.6	0	0	0	114	F289 L306	I271-F289 HydrophobicContact CD1-CE1 3.67Å; I271-F289 HydrophobicContact CG1-CD1 4Å; I271-F289 HydrophobicContact CG1-CE1 3.61Å; I271-L306 HydrophobicContact CD1-CD1 3.9Å; I271-L306 HydrophobicContact CD1-CD2 3.45Å; I271-L306 VanDerWaalsContact CD1-CD2 3.45Å; I271-L306 HydrophobicContact CD1-CG 3.43Å; I271-L306 VanDerWaalsContact CD1-CG 3.43Å
272	L	88	Confident	75.9	Confident	59 Å²	59	81.9 Å²	81.9	31%	0.309	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-43.5	-176.6	-68.2	172.7	0	0	0	111.5	C270 F289 C293 W297 P305	C270-L272 PolarHBondContact O-N 3.47Å; L272-F289 HydrophobicContact CD1-CB 4.48Å; L272-F289 HydrophobicContact CD1-CD1 3.8Å; L272-F289 HydrophobicContact CD1-CE1 4.4Å; L272-F289 HydrophobicContact CD1-CG 4.33Å; L272-F289 HydrophobicContact CG-CD1 4.02Å; L272-F289 HydrophobicContact CG-CE1 4.43Å; L272-C293 HydrophobicContact CB-CB 3.57Å; L272-C293 HydrophobicContact CD1-CB 3.48Å; L272-C293 VanDerWaalsContact CD1-CB 3.48Å; L272-C293 WeakPolarHBondContact CD1-O 3.44Å; L272-C293 HydrophobicContact CG-CB 4.17Å; L272-W297 HydrophobicContact CD2-CE3 4.31Å; L272-P305 HydrophobicContact CD1-CG 4.18Å; L272-P305 HydrophobicContact CD2-CB 4.14Å; L272-P305 HydrophobicContact CD2-CG 4.09Å
273	C	86.2	Confident	78.3	Confident	46 Å²	46	78.1 Å²	78.1	31%	0.311	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-8.9	176.7	63.6	0	0	0	0	114.2	E275	C273-E275 PolarHBondContact O-N 3.09Å
274	L	84.2	Confident	80.5	Confident	129 Å²	129	74.7 Å²	74.7	68%	0.675	39%	0.388	S	S	*	.			trans	60.8	5.7	-177.1	-52.7	177	0	0	0	115.3	C270	C270-L274 WeakPolarHBondContact O-CA 3.23Å; C270-L274 PolarHBondContact O-N 3.24Å
275	E	82.5	Confident	82.5	Confident	109 Å²	109	71 Å²	71	51%	0.509	37%	0.366	S	S	.	.	S	Bend	trans	-88.5	171.2	174.3	-62.2	-174.2	-177	0	0	111.9	R269 C270 C273 R277	R269-E275 CarbonylContact C-O 3.59Å; R269-E275 VanDerWaalsContact CA-O 3.32Å; R269-E275 WeakPolarHBondContact CA-O 3.41Å; C270-E275 PolarHBondContact N-O 2.95Å; C273-E275 PolarHBondContact O-N 3.09Å; E275-R277 PolarHBondContact O-N 3.34Å
276	A	82.7	Confident	84.3	Confident	48 Å²	48	67.2 Å²	67.2	40%	0.397	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-57.1	132.6	167.3	0	0	0	0	0	109.6	P267 R278	P267-A276 HydrophobicContact CB-CB 4.31Å; P267-A276 HydrophobicContact CG-CB 4.42Å; A276-R278 PolarHBondContact O-N 3.04Å; A276-R278 VanDerWaalsContact O-N 3.17Å
277	R	86.5	Confident	86.1	Confident	52 Å²	52	58.7 Å²	58.7	20%	0.196	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-63.9	119.4	-174.3	-169.5	-175.4	-57.9	148.6	0.7	110	A268 C270 E275 S280 L288	A268-R277 WeakPolarHBondContact O-CB 3.4Å; A268-R277 PolarHBondContact O-N 3.26Å; C270-R277 HydrophobicContact CB-CB 4.49Å; E275-R277 PolarHBondContact O-N 3.34Å; R277-S280 WeakPolarHBondContact CD-OG 3.32Å; R277-L288 PolarHBondContact NE-O 3.28Å
278	R	80.6	Confident	87.5	Confident	87 Å²	87	56.4 Å²	56.4	33%	0.328	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-102.4	138.7	172.3	-56	-176.3	-170.7	-137.2	3.3	108.4	A276 C290	A276-R278 PolarHBondContact O-N 3.04Å; A276-R278 VanDerWaalsContact O-N 3.17Å; R278-C290 PolarHBondContact N-SG 3.46Å; R278-C290 VanDerWaalsContact N-SG 3.38Å; R278-C290 WeakPolarHBondContact O-CA 3.46Å; R278-C290 WeakPolarHBondContact O-CB 3.42Å
279	N	83	Confident	88.3	Confident	67 Å²	67	54.6 Å²	54.6	36%	0.358	29%	0.288	S	S	.	.	S	Bend	trans	52.2	61.7	175.7	-64.4	-22.8	0	0	0	111.6	T281 W291 F318	N279-T281 PolarHBondContact O-N 3.24Å; N279-T281 PolarHBondContact O-OG1 3.33Å; N279-W291 HydrophobicContact CB-CB 4.2Å; N279-W291 WeakPolarHBondContact O-CB 3.49Å; N279-W291 PolarHBondContact O-N 2.94Å; N279-F318 HydrophobicContact CB-CE2 3.62Å; N279-F318 HydrophobicContact CB-CZ 3.69Å
280	S	88.9	Confident	88.4	Confident	7 Å²	7	46 Å²	46	5%	0.049	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.7	125	-175	-65.6	0	0	0	0	111.8	R277 L319	R277-S280 WeakPolarHBondContact CD-OG 3.32Å; S280-L319 WeakPolarHBondContact O-CB 3.47Å; S280-L319 PolarHBondContact O-N 3.12Å
281	T	91.4	Very high	88.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.2	179.5	-59.3	0	0	0	0	109.5	N279 L288 F289 W291 I294 L316 V317	N279-T281 PolarHBondContact O-N 3.24Å; N279-T281 PolarHBondContact O-OG1 3.33Å; T281-L288 WeakPolarHBondContact O-CA 3.43Å; T281-F289 PolarHBondContact N-O 3.04Å; T281-F289 PolarHBondContact O-N 3.31Å; T281-W291 HydrophobicContact CG2-CE3 3.71Å; T281-W291 HydrophobicContact CG2-CZ3 4.21Å; T281-W291 WeakPolarHBondContact OG1-CA 3.48Å; T281-W291 WeakPolarHBondContact OG1-CB 3.31Å; T281-W291 PolarHBondContact OG1-N 3.48Å; T281-I294 HydrophobicContact CG2-CG2 3.83Å; T281-L316 HydrophobicContact CG2-CB 4.02Å; T281-L316 HydrophobicContact CG2-CD2 4.2Å; T281-V317 WeakPolarHBondContact CA-O 3.36Å
282	C	92.6	Very high	88.4	Confident	26 Å²	26	47.3 Å²	47.3	18%	0.176	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	129	179.3	-165.1	0	0	0	0	110.1	G286 H287 L288 V317 L319	C282-G286 VanDerWaalsContact SG-C 3.58Å; C282-G286 VanDerWaalsContact SG-CA 3.54Å; C282-H287 WeakPolarHBondContact CA-O 3.35Å; C282-L288 HydrophobicContact CB-CD2 4.03Å; C282-V317 PolarHBondContact N-O 2.94Å; C282-V317 PolarHBondContact O-N 3.4Å; C282-L319 HydrophobicContact CB-CD1 4.2Å; C282-L319 HydrophobicContact CB-CD2 4.44Å; C282-L319 HydrophobicContact CB-CG 4.29Å
283	T	93.3	Very high	88.4	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.012	25%	0.251	C	S	.	.			trans	-74.6	157.3	163.4	51.4	0	0	0	0	110.4	C285 G286 H287 F289 I294 F311 L316	T283-C285 PolarHBondContact O-N 3.16Å; T283-C285 PolarHBondContact OG1-SG 3.24Å; T283-G286 PolarHBondContact O-N 3.48Å; T283-H287 PolarHBondContact N-O 3.33Å; T283-H287 WeakPolarHBondContact OG1-CB 3.37Å; T283-H287 PolarHBondContact OG1-N 3.16Å; T283-H287 PolarHBondContact OG1-O 2.92Å; T283-H287 VanDerWaalsContact OG1-O 3.06Å; T283-F289 HydrophobicContact CG2-CD2 4.03Å; T283-F289 HydrophobicContact CG2-CE2 3.8Å; T283-I294 HydrophobicContact CG2-CD1 3.9Å; T283-I294 HydrophobicContact CG2-CG1 3.88Å; T283-F311 HydrophobicContact CG2-CE1 3.69Å; T283-F311 HydrophobicContact CG2-CE2 4.35Å; T283-F311 HydrophobicContact CG2-CZ 3.47Å; T283-F311 VanDerWaalsContact CG2-CZ 3.47Å; T283-L316 HydrophobicContact CG2-CD2 3.92Å
284	P	92.1	Very high	88.7	Confident	62 Å²	62	43.4 Å²	43.4	40%	0.403	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-27.1	179	-29.2	37.4	0	0	0	114.8	G286 F311 R315	P284-G286 VanDerWaalsContact C-N 3.26Å; P284-G286 PolarHBondContact O-N 3.5Å; P284-F311 HydrophobicContact CG-CB 3.91Å; P284-F311 HydrophobicContact CG-CD2 4.31Å; P284-F311 HydrophobicContact CG-CG 4.02Å; P284-R315 HydrophobicContact CG-CB 3.71Å
285	C	93.1	Very high	88.9	Confident	35 Å²	35	38.4 Å²	38.4	24%	0.236	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	3	176.7	66	0	0	0	0	114.9	T283 H287 C304 C307 E309	T283-C285 PolarHBondContact O-N 3.16Å; T283-C285 PolarHBondContact OG1-SG 3.24Å; C285-H287 PolarHBondContact SG-ND1 3.33Å; C285-C304 PolarHBondContact SG-SG 3.06Å; C285-C307 PolarHBondContact SG-SG 3.01Å; C285-E309 HydrophobicContact CB-CB 4.26Å; C285-E309 WeakPolarHBondContact CB-OE2 3.41Å
286	G	91.2	Very high	89.2	Confident	44 Å²	44	39.5 Å²	39.5	45%	0.454	22%	0.219	S	C	.	.	S	Bend	trans	91.5	-7.9	176.6	0	0	0	0	0	115.8	C282 T283 P284	C282-G286 VanDerWaalsContact SG-C 3.58Å; C282-G286 VanDerWaalsContact SG-CA 3.54Å; T283-G286 PolarHBondContact O-N 3.48Å; P284-G286 VanDerWaalsContact C-N 3.26Å; P284-G286 PolarHBondContact O-N 3.5Å
287	H	92.1	Very high	89.5	Confident	64 Å²	64	41.4 Å²	41.4	30%	0.296	22%	0.216	S	C	.	.			trans	-75.1	143.4	179.8	-67	108.5	0	0	0	113.2	C282 T283 C285 F289 L306	C282-H287 WeakPolarHBondContact CA-O 3.35Å; T283-H287 PolarHBondContact N-O 3.33Å; T283-H287 WeakPolarHBondContact OG1-CB 3.37Å; T283-H287 PolarHBondContact OG1-N 3.16Å; T283-H287 PolarHBondContact OG1-O 2.92Å; T283-H287 VanDerWaalsContact OG1-O 3.06Å; C285-H287 PolarHBondContact SG-ND1 3.33Å; H287-F289 HydrophobicContact CB-CE2 3.55Å; H287-F289 HydrophobicContact CB-CZ 3.89Å; H287-L306 HydrophobicContact CB-CD1 3.93Å; H287-L306 WeakPolarHBondContact CD2-CD1 3.47Å
288	L	91.6	Very high	89.7	Confident	36 Å²	36	39.2 Å²	39.2	19%	0.188	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	129.1	-170.3	-66.1	153.5	0	0	0	112.4	R277 T281 C282 L319 Y322	R277-L288 PolarHBondContact NE-O 3.28Å; T281-L288 WeakPolarHBondContact O-CA 3.43Å; C282-L288 HydrophobicContact CB-CD2 4.03Å; L288-L319 HydrophobicContact CD2-CD1 3.34Å; L288-Y322 HydrophobicContact CD1-CE1 3.99Å; L288-Y322 HydrophobicContact CD2-CE1 4.43Å
289	F	91.8	Very high	89.9	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	171.5	-179.3	-54.1	-87.4	0	0	0	110.7	I271 L272 T281 T283 H287 I294 P305 L306	I271-F289 HydrophobicContact CD1-CE1 3.67Å; I271-F289 HydrophobicContact CG1-CD1 4Å; I271-F289 HydrophobicContact CG1-CE1 3.61Å; L272-F289 HydrophobicContact CD1-CB 4.48Å; L272-F289 HydrophobicContact CD1-CD1 3.8Å; L272-F289 HydrophobicContact CD1-CE1 4.4Å; L272-F289 HydrophobicContact CD1-CG 4.33Å; L272-F289 HydrophobicContact CG-CD1 4.02Å; L272-F289 HydrophobicContact CG-CE1 4.43Å; T281-F289 PolarHBondContact N-O 3.04Å; T281-F289 PolarHBondContact O-N 3.31Å; T283-F289 HydrophobicContact CG2-CD2 4.03Å; T283-F289 HydrophobicContact CG2-CE2 3.8Å; H287-F289 HydrophobicContact CB-CE2 3.55Å; H287-F289 HydrophobicContact CB-CZ 3.89Å; F289-I294 HydrophobicContact CB-CB 3.8Å; F289-I294 HydrophobicContact CB-CG2 4.23Å; F289-I294 HydrophobicContact CD2-CB 4.21Å; F289-I294 HydrophobicContact CD2-CD1 3.82Å; F289-I294 HydrophobicContact CD2-CG1 4.01Å; F289-I294 HydrophobicContact CE2-CD1 4.03Å; F289-I294 HydrophobicContact CG-CB 4.16Å; F289-I294 HydrophobicContact CG-CD1 4.23Å; F289-I294 HydrophobicContact CG-CG1 4.42Å; F289-P305 HydrophobicContact CE1-CB 4.13Å; F289-P305 HydrophobicContact CE1-CG 3.96Å; F289-P305 HydrophobicContact CZ-CB 4.23Å; F289-P305 HydrophobicContact CZ-CG 3.97Å; F289-L306 HydrophobicContact CE1-CD1 4.08Å; F289-L306 HydrophobicContact CE1-CG 4.31Å; F289-L306 HydrophobicContact CZ-CB 4.47Å; F289-L306 HydrophobicContact CZ-CD1 3.75Å; F289-L306 HydrophobicContact CZ-CG 4.03Å
290	C	89	Confident	89.9	Confident	7 Å²	7	44.1 Å²	44.1	5%	0.047	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	138.2	162	-61.1	0	0	0	0	108.7	C270 R278 E292 C293 I294	C270-C290 WeakPolarHBondContact CB-SG 3.3Å; C270-C290 PolarHBondContact SG-N 3.14Å; C270-C290 VanDerWaalsContact SG-N 3.39Å; R278-C290 PolarHBondContact N-SG 3.46Å; R278-C290 VanDerWaalsContact N-SG 3.38Å; R278-C290 WeakPolarHBondContact O-CA 3.46Å; R278-C290 WeakPolarHBondContact O-CB 3.42Å; C290-E292 PolarHBondContact O-N 2.95Å; C290-C293 HydrophobicContact CB-CB 4.15Å; C290-C293 PolarHBondContact O-N 2.94Å; C290-C293 VanDerWaalsContact O-N 3.12Å; C290-I294 WeakPolarHBondContact O-CG2 3.48Å; C290-I294 PolarHBondContact O-N 3.15Å
291	W	88.4	Confident	89.9	Confident	58 Å²	58	49 Å²	49	22%	0.22	27%	0.266	C	S	.	.	H	α-helix	trans	-45.7	-49	174.6	171	-101.6	0	0	0	112.5	W247 N279 T281 C293 I294 A295 L316 F318	W247-W291 AromaticContact CE3-NE1 3.98Å; W247-W291 AromaticContact CH2-CE2 3.6Å; W247-W291 AromaticContact CH2-CZ2 3.7Å; W247-W291 HydrophobicContact CH2-CZ2 3.7Å; W247-W291 AromaticContact CH2-NE1 3.14Å; W247-W291 HydrophobicContact CZ2-CZ2 4.24Å; W247-W291 AromaticContact CZ3-CD1 3.66Å; W247-W291 AromaticContact CZ3-CE2 3.97Å; W247-W291 AromaticContact CZ3-NE1 3.07Å; N279-W291 HydrophobicContact CB-CB 4.2Å; N279-W291 WeakPolarHBondContact O-CB 3.49Å; N279-W291 PolarHBondContact O-N 2.94Å; T281-W291 HydrophobicContact CG2-CE3 3.71Å; T281-W291 HydrophobicContact CG2-CZ3 4.21Å; T281-W291 WeakPolarHBondContact OG1-CA 3.48Å; T281-W291 WeakPolarHBondContact OG1-CB 3.31Å; T281-W291 PolarHBondContact OG1-N 3.48Å; W291-C293 PolarHBondContact O-N 3.07Å; W291-I294 WeakPolarHBondContact O-CG2 3.45Å; W291-A295 WeakPolarHBondContact O-CB 3.37Å; W291-A295 PolarHBondContact O-N 2.93Å; W291-L316 HydrophobicContact CZ3-CB 4.14Å; W291-F318 HydrophobicContact CB-CD2 4.08Å; W291-F318 HydrophobicContact CB-CE2 3.95Å; W291-F318 AromaticContact CD2-CD2 3.97Å; W291-F318 HydrophobicContact CD2-CD2 3.97Å; W291-F318 HydrophobicContact CD2-CE2 4.47Å; W291-F318 HydrophobicContact CE3-CB 4.42Å; W291-F318 AromaticContact CE3-CD2 3.79Å; W291-F318 HydrophobicContact CE3-CD2 3.79Å; W291-F318 HydrophobicContact CG-CD2 4.1Å; W291-F318 HydrophobicContact CG-CE2 4.15Å
292	E	86.4	Confident	89.8	Confident	55 Å²	55	51.3 Å²	51.3	26%	0.257	29%	0.285	S	S	.	.	H	α-helix	trans	-63.2	-46.4	-177.3	-60.1	-179.3	158.6	0	0	111.9	R251 C290 A295 E296	R251-E292 WeakPolarHBondContact CB-OE1 3.34Å; R251-E292 WeakPolarHBondContact CD-OE1 3.2Å; R251-E292 WeakPolarHBondContact CG-OE1 3.42Å; R251-E292 IonicContact CZ-OE1 3.77Å; R251-E292 IonicContact CZ-OE2 2.96Å; R251-E292 VanDerWaalsContact NE-CD 3.31Å; R251-E292 IonicContact NE-OE1 3.18Å; R251-E292 PolarHBondContact NE-OE1 3.21Å; R251-E292 IonicContact NE-OE2 2.84Å; R251-E292 PolarHBondContact NE-OE2 2.97Å; R251-E292 IonicContact NH1-OE2 3.96Å; R251-E292 IonicContact NH2-OE2 2.7Å; R251-E292 PolarHBondContact NH2-OE2 3.11Å; C290-E292 PolarHBondContact O-N 2.95Å; E292-A295 PolarHBondContact O-N 3Å; E292-E296 VanDerWaalsContact O-CB 3.26Å; E292-E296 WeakPolarHBondContact O-CB 3.28Å; E292-E296 PolarHBondContact O-N 2.91Å
293	C	89.3	Confident	89.9	Confident	23 Å²	23	52.3 Å²	52.3	16%	0.155	29%	0.287	C	S	.	.	H	α-helix	trans	-66.3	-42.7	-176.2	-59.6	0	0	0	0	111.8	L272 C290 W291 W297	L272-C293 HydrophobicContact CB-CB 3.57Å; L272-C293 HydrophobicContact CD1-CB 3.48Å; L272-C293 VanDerWaalsContact CD1-CB 3.48Å; L272-C293 WeakPolarHBondContact CD1-O 3.44Å; L272-C293 HydrophobicContact CG-CB 4.17Å; C290-C293 HydrophobicContact CB-CB 4.15Å; C290-C293 PolarHBondContact O-N 2.94Å; C290-C293 VanDerWaalsContact O-N 3.12Å; W291-C293 PolarHBondContact O-N 3.07Å; C293-W297 WeakPolarHBondContact O-CB 3.46Å; C293-W297 PolarHBondContact O-N 2.96Å
294	I	92.2	Very high	89.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-74.5	-37.2	179.5	-167.9	60.9	0	0	0	112	T281 T283 F289 C290 W291 W297 C298 P305 F311 L316	T281-I294 HydrophobicContact CG2-CG2 3.83Å; T283-I294 HydrophobicContact CG2-CD1 3.9Å; T283-I294 HydrophobicContact CG2-CG1 3.88Å; F289-I294 HydrophobicContact CB-CB 3.8Å; F289-I294 HydrophobicContact CB-CG2 4.23Å; F289-I294 HydrophobicContact CD2-CB 4.21Å; F289-I294 HydrophobicContact CD2-CD1 3.82Å; F289-I294 HydrophobicContact CD2-CG1 4.01Å; F289-I294 HydrophobicContact CE2-CD1 4.03Å; F289-I294 HydrophobicContact CG-CB 4.16Å; F289-I294 HydrophobicContact CG-CD1 4.23Å; F289-I294 HydrophobicContact CG-CG1 4.42Å; C290-I294 WeakPolarHBondContact O-CG2 3.48Å; C290-I294 PolarHBondContact O-N 3.15Å; W291-I294 WeakPolarHBondContact O-CG2 3.45Å; I294-W297 PolarHBondContact O-N 2.98Å; I294-C298 WeakPolarHBondContact O-CB 3.48Å; I294-C298 PolarHBondContact O-N 3.37Å; I294-C298 PolarHBondContact O-SG 2.91Å; I294-P305 VanDerWaalsContact CD1-CD 3.48Å; I294-P305 HydrophobicContact CD1-CG 3.83Å; I294-F311 HydrophobicContact CD1-CZ 4.47Å; I294-L316 HydrophobicContact CG1-CD2 3.78Å; I294-L316 HydrophobicContact CG2-CD1 4.26Å; I294-L316 HydrophobicContact CG2-CD2 4.2Å
295	A	89.3	Confident	89.9	Confident	25 Å²	25	50.7 Å²	50.7	21%	0.207	28%	0.276	C	S	.	.	H	α-helix	trans	-64.7	-41	175.9	0	0	0	0	0	111.8	W291 E292 C298 N299	W291-A295 WeakPolarHBondContact O-CB 3.37Å; W291-A295 PolarHBondContact O-N 2.93Å; E292-A295 PolarHBondContact O-N 3Å; A295-C298 PolarHBondContact O-N 3.09Å; A295-N299 PolarHBondContact O-N 3.3Å; A295-N299 VanDerWaalsContact O-N 3.11Å; A295-N299 PolarHBondContact O-ND2 2.96Å
296	E	87.6	Confident	89.8	Confident	131 Å²	131	53.2 Å²	53.2	61%	0.612	29%	0.287	S	S	*	.	H	α-helix	trans	-66.2	-42	175.6	-172.4	169.6	-164.7	0	0	111.9	E292 N299	E292-E296 VanDerWaalsContact O-CB 3.26Å; E292-E296 WeakPolarHBondContact O-CB 3.28Å; E292-E296 PolarHBondContact O-N 2.91Å; E296-N299 PolarHBondContact O-N 3.31Å
297	W	90.2	Very high	89.9	Confident	88 Å²	88	53.9 Å²	53.9	33%	0.333	28%	0.284	S	S	.	.	H	α-helix	trans	-58.5	-48.9	172.4	180	-90.5	0	0	0	111.7	L272 C293 I294 N299 T300 K301 E303 P305	L272-W297 HydrophobicContact CD2-CE3 4.31Å; C293-W297 WeakPolarHBondContact O-CB 3.46Å; C293-W297 PolarHBondContact O-N 2.96Å; I294-W297 PolarHBondContact O-N 2.98Å; W297-N299 PolarHBondContact O-N 3.14Å; W297-T300 WeakPolarHBondContact O-CA 3.4Å; W297-T300 PolarHBondContact O-N 3.39Å; W297-K301 HydrophobicContact CZ2-CD 4.38Å; W297-K301 PolarHBondContact O-N 3.04Å; W297-E303 PolarHBondContact NE1-O 3.17Å; W297-P305 HydrophobicContact CD2-CG 3.97Å; W297-P305 HydrophobicContact CG-CG 3.87Å; W297-P305 HydrophobicContact CZ2-CB 4.44Å
298	C	88.7	Confident	90	Very high	7 Å²	7	59.8 Å²	59.8	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-63.9	-25.3	-179.1	-72	0	0	0	0	114.2	I294 A295 T300 K301 F311 P313	I294-C298 WeakPolarHBondContact O-CB 3.48Å; I294-C298 PolarHBondContact O-N 3.37Å; I294-C298 PolarHBondContact O-SG 2.91Å; A295-C298 PolarHBondContact O-N 3.09Å; C298-T300 PolarHBondContact O-N 3.39Å; C298-K301 WeakPolarHBondContact CA-O 3.49Å; C298-F311 VanDerWaalsContact SG-CE2 3.54Å; C298-F311 VanDerWaalsContact SG-CZ 3.54Å; C298-P313 HydrophobicContact CB-CG 4.28Å
299	N	85	Confident	90.1	Very high	139 Å²	139	62.7 Å²	62.7	74%	0.743	32%	0.317	S	S	*	.	H	α-helix	trans	-67.9	-24.3	171.7	-76.2	-28.9	0	0	0	112.7	A295 E296 W297	A295-N299 PolarHBondContact O-N 3.3Å; A295-N299 VanDerWaalsContact O-N 3.11Å; A295-N299 PolarHBondContact O-ND2 2.96Å; E296-N299 PolarHBondContact O-N 3.31Å; W297-N299 PolarHBondContact O-N 3.14Å
300	T	84.5	Confident	90.2	Very high	118 Å²	118	70.9 Å²	70.9	72%	0.724	35%	0.352	S	S	*	.	H	α-helix	trans	-97.6	-46	178.6	-45.8	0	0	0	0	111.1	W297 C298	W297-T300 WeakPolarHBondContact O-CA 3.4Å; W297-T300 PolarHBondContact O-N 3.39Å; C298-T300 PolarHBondContact O-N 3.39Å
301	K	87.4	Confident	90.3	Very high	110 Å²	110	71.1 Å²	71.1	48%	0.478	35%	0.352	S	S	.	.			trans	-139.9	116.2	179.2	-63.8	-175.2	-180	-178.3	0	110.1	W297 C298 E303	W297-K301 HydrophobicContact CZ2-CD 4.38Å; W297-K301 PolarHBondContact O-N 3.04Å; C298-K301 WeakPolarHBondContact CA-O 3.49Å; K301-E303 HydrophobicContact CB-CG 4.09Å; K301-E303 WeakPolarHBondContact CD-OE1 3.38Å; K301-E303 PolarHBondContact O-N 3.27Å
302	A	90.7	Very high	90.3	Very high	48 Å²	48	73 Å²	73	40%	0.397	37%	0.367	S	S	.	.	S	Bend	trans	-76.3	56.7	179.4	0	0	0	0	0	112.6	K310 F311	A302-K310 WeakPolarHBondContact O-CA 3.45Å; A302-F311 WeakPolarHBondContact CB-O 3.34Å; A302-F311 PolarHBondContact O-N 3.46Å; A302-F311 VanDerWaalsContact O-N 3.15Å
303	E	93.7	Very high	90.4	Very high	46 Å²	46	73.1 Å²	73.1	22%	0.215	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-144.6	156	-179.5	69.7	-171.9	179.5	0	0	111.9	W297 K301 E309 K310	W297-E303 PolarHBondContact NE1-O 3.17Å; K301-E303 HydrophobicContact CB-CG 4.09Å; K301-E303 WeakPolarHBondContact CD-OE1 3.38Å; K301-E303 PolarHBondContact O-N 3.27Å; E303-E309 CarbonylContact C-O 3.6Å; E303-E309 VanDerWaalsContact CA-O 3.27Å; E303-E309 WeakPolarHBondContact CA-O 3.35Å; E303-K310 HydrophobicContact CB-CG 4.4Å
304	C	93.2	Very high	90.3	Very high	0 Å²	0	78.8 Å²	78.8	0%	0	40%	0.396	C	S	.	.			trans	-70.3	129	176.6	-175.7	0	0	0	0	111	C285 L306 C307 R308 E309 F311	C285-C304 PolarHBondContact SG-SG 3.06Å; C304-L306 PolarHBondContact O-N 3.23Å; C304-L306 VanDerWaalsContact O-N 3.15Å; C304-C307 VanDerWaalsContact CB-SG 3.56Å; C304-R308 WeakPolarHBondContact O-CA 3.3Å; C304-R308 PolarHBondContact O-N 3.15Å; C304-E309 PolarHBondContact N-O 3.36Å; C304-F311 HydrophobicContact CB-CE1 3.91Å
305	P	92.4	Very high	90.3	Very high	30 Å²	30	86 Å²	86	20%	0.195	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-25.9	177.4	-22.7	29.3	0	0	0	114.9	L272 F289 I294 W297	L272-P305 HydrophobicContact CD1-CG 4.18Å; L272-P305 HydrophobicContact CD2-CB 4.14Å; L272-P305 HydrophobicContact CD2-CG 4.09Å; F289-P305 HydrophobicContact CE1-CB 4.13Å; F289-P305 HydrophobicContact CE1-CG 3.96Å; F289-P305 HydrophobicContact CZ-CB 4.23Å; F289-P305 HydrophobicContact CZ-CG 3.97Å; I294-P305 VanDerWaalsContact CD1-CD 3.48Å; I294-P305 HydrophobicContact CD1-CG 3.83Å; W297-P305 HydrophobicContact CD2-CG 3.97Å; W297-P305 HydrophobicContact CG-CG 3.87Å; W297-P305 HydrophobicContact CZ2-CB 4.44Å
306	L	91.3	Very high	90.4	Very high	89 Å²	89	85.7 Å²	85.7	47%	0.466	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-56.9	-176.2	-80.3	166.9	0	0	0	112.7	I271 H287 F289 C304	I271-L306 HydrophobicContact CD1-CD1 3.9Å; I271-L306 HydrophobicContact CD1-CD2 3.45Å; I271-L306 VanDerWaalsContact CD1-CD2 3.45Å; I271-L306 HydrophobicContact CD1-CG 3.43Å; I271-L306 VanDerWaalsContact CD1-CG 3.43Å; H287-L306 HydrophobicContact CB-CD1 3.93Å; H287-L306 WeakPolarHBondContact CD2-CD1 3.47Å; F289-L306 HydrophobicContact CE1-CD1 4.08Å; F289-L306 HydrophobicContact CE1-CG 4.31Å; F289-L306 HydrophobicContact CZ-CB 4.47Å; F289-L306 HydrophobicContact CZ-CD1 3.75Å; F289-L306 HydrophobicContact CZ-CG 4.03Å; C304-L306 PolarHBondContact O-N 3.23Å; C304-L306 VanDerWaalsContact O-N 3.15Å
307	C	93.3	Very high	90.6	Very high	58 Å²	58	83.4 Å²	83.4	39%	0.392	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-3.6	-174.9	64	0	0	0	0	114.4	C285 C304 E309	C285-C307 PolarHBondContact SG-SG 3.01Å; C304-C307 VanDerWaalsContact CB-SG 3.56Å; C307-E309 PolarHBondContact O-N 3.34Å; C307-E309 VanDerWaalsContact O-N 3.14Å
308	R	93.3	Very high	90.5	Very high	188 Å²	188	83 Å²	83	71%	0.709	41%	0.414	S	S	*	.			trans	59.9	18.1	-178.3	-52.5	-180	-177.8	-179	0.2	115	C304 K310	C304-R308 WeakPolarHBondContact O-CA 3.3Å; C304-R308 PolarHBondContact O-N 3.15Å; R308-K310 PolarHBondContact O-N 2.94Å
309	E	93.9	Very high	90.5	Very high	96 Å²	96	85.1 Å²	85.1	45%	0.449	42%	0.424	S	S	.	.			trans	-64	128.5	172.1	-171.6	175.5	145.9	0	0	110	C285 E303 C304 C307 F311	C285-E309 HydrophobicContact CB-CB 4.26Å; C285-E309 WeakPolarHBondContact CB-OE2 3.41Å; E303-E309 CarbonylContact C-O 3.6Å; E303-E309 VanDerWaalsContact CA-O 3.27Å; E303-E309 WeakPolarHBondContact CA-O 3.35Å; C304-E309 PolarHBondContact N-O 3.36Å; C307-E309 PolarHBondContact O-N 3.34Å; C307-E309 VanDerWaalsContact O-N 3.14Å; E309-F311 WeakPolarHBondContact O-CD1 3.21Å
310	K	93.6	Very high	90.2	Very high	172 Å²	172	88.8 Å²	88.8	75%	0.748	43%	0.427	S	S	*	.	B	Isolated β-bridge	trans	-81.6	128.9	-178.8	-65.9	-178.8	-179	177.9	0	110.3	A302 E303 R308	A302-K310 WeakPolarHBondContact O-CA 3.45Å; E303-K310 HydrophobicContact CB-CG 4.4Å; R308-K310 PolarHBondContact O-N 2.94Å
311	F	91.3	Very high	89.3	Confident	12 Å²	12	91.3 Å²	91.3	5%	0.053	44%	0.437	C	S	.	.			trans	-148.9	157	176.8	63	-93.5	0	0	0	111.3	T283 P284 I294 C298 A302 C304 E309 L316	T283-F311 HydrophobicContact CG2-CE1 3.69Å; T283-F311 HydrophobicContact CG2-CE2 4.35Å; T283-F311 HydrophobicContact CG2-CZ 3.47Å; T283-F311 VanDerWaalsContact CG2-CZ 3.47Å; P284-F311 HydrophobicContact CG-CB 3.91Å; P284-F311 HydrophobicContact CG-CD2 4.31Å; P284-F311 HydrophobicContact CG-CG 4.02Å; I294-F311 HydrophobicContact CD1-CZ 4.47Å; C298-F311 VanDerWaalsContact SG-CE2 3.54Å; C298-F311 VanDerWaalsContact SG-CZ 3.54Å; A302-F311 WeakPolarHBondContact CB-O 3.34Å; A302-F311 PolarHBondContact O-N 3.46Å; A302-F311 VanDerWaalsContact O-N 3.15Å; C304-F311 HydrophobicContact CB-CE1 3.91Å; E309-F311 WeakPolarHBondContact O-CD1 3.21Å; F311-L316 HydrophobicContact CE2-CD2 3.52Å; F311-L316 HydrophobicContact CE2-CG 3.92Å; F311-L316 HydrophobicContact CZ-CD2 3.91Å
312	L	89.2	Confident	88.4	Confident	99 Å²	99	92.2 Å²	92.2	52%	0.518	44%	0.438	S	S	.	.			trans	-82.4	141.4	177.4	-66	167.2	0	0	0	110.5	H314 R315	L312-H314 WeakPolarHBondContact CB-CE1 3.46Å; L312-H314 WeakPolarHBondContact CD1-CE1 3.29Å; L312-H314 PolarHBondContact O-N 3.1Å; L312-R315 WeakPolarHBondContact O-CB 3.26Å; L312-R315 PolarHBondContact O-N 3.13Å
313	P	87.6	Confident	86.8	Confident	57 Å²	57	97.1 Å²	97.1	37%	0.37	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-55	-28.8	-175.1	-27.4	33.4	0	0	0	115.2	C298 R315 L316	C298-P313 HydrophobicContact CB-CG 4.28Å; P313-R315 PolarHBondContact O-N 3.3Å; P313-L316 WeakPolarHBondContact O-CB 3.47Å; P313-L316 WeakPolarHBondContact O-CG 3.24Å; P313-L316 PolarHBondContact O-N 3.16Å
314	H	88.7	Confident	86.4	Confident	141 Å²	141	99.7 Å²	99.7	65%	0.653	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-69.8	-12.1	177.7	65.1	-105.3	0	0	0	114	L312 L316	L312-H314 WeakPolarHBondContact CB-CE1 3.46Å; L312-H314 WeakPolarHBondContact CD1-CE1 3.29Å; L312-H314 PolarHBondContact O-N 3.1Å; H314-L316 VanDerWaalsContact C-N 3.31Å
315	R	91.6	Very high	86.1	Confident	151 Å²	151	104.9 Å²	104.9	57%	0.57	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-87.4	1.8	175.6	-63.1	-167.9	169	-170.5	-4.8	113.2	P284 L312 P313 V317	P284-R315 HydrophobicContact CG-CB 3.71Å; L312-R315 WeakPolarHBondContact O-CB 3.26Å; L312-R315 PolarHBondContact O-N 3.13Å; P313-R315 PolarHBondContact O-N 3.3Å; R315-V317 PolarHBondContact O-N 3.4Å
316	L	91.4	Very high	85.7	Confident	19 Å²	19	109.1 Å²	109.1	10%	0.099	52%	0.524	C	S	.	.			trans	-68.9	127.3	172.6	-70.6	172.2	0	0	0	109.9	T281 T283 W291 I294 F311 P313 H314	T281-L316 HydrophobicContact CG2-CB 4.02Å; T281-L316 HydrophobicContact CG2-CD2 4.2Å; T283-L316 HydrophobicContact CG2-CD2 3.92Å; W291-L316 HydrophobicContact CZ3-CB 4.14Å; I294-L316 HydrophobicContact CG1-CD2 3.78Å; I294-L316 HydrophobicContact CG2-CD1 4.26Å; I294-L316 HydrophobicContact CG2-CD2 4.2Å; F311-L316 HydrophobicContact CE2-CD2 3.52Å; F311-L316 HydrophobicContact CE2-CG 3.92Å; F311-L316 HydrophobicContact CZ-CD2 3.91Å; P313-L316 WeakPolarHBondContact O-CB 3.47Å; P313-L316 WeakPolarHBondContact O-CG 3.24Å; P313-L316 PolarHBondContact O-N 3.16Å; H314-L316 VanDerWaalsContact C-N 3.31Å
317	V	91.2	Very high	85.4	Confident	83 Å²	83	110.2 Å²	110.2	50%	0.503	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	114.3	-179.5	-176.9	0	0	0	0	109.1	T281 C282 R315 L319	T281-V317 WeakPolarHBondContact CA-O 3.36Å; C282-V317 PolarHBondContact N-O 2.94Å; C282-V317 PolarHBondContact O-N 3.4Å; R315-V317 PolarHBondContact O-N 3.4Å; V317-L319 HydrophobicContact CG1-CD2 4.21Å; V317-L319 PolarHBondContact O-N 3.2Å
318	F	89.1	Confident	84.9	Confident	81 Å²	81	113.5 Å²	113.5	36%	0.355	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	118.7	174.3	-171.1	-85.8	0	0	0	110.1	N279 W291 R320	N279-F318 HydrophobicContact CB-CE2 3.62Å; N279-F318 HydrophobicContact CB-CZ 3.69Å; W291-F318 HydrophobicContact CB-CD2 4.08Å; W291-F318 HydrophobicContact CB-CE2 3.95Å; W291-F318 AromaticContact CD2-CD2 3.97Å; W291-F318 HydrophobicContact CD2-CD2 3.97Å; W291-F318 HydrophobicContact CD2-CE2 4.47Å; W291-F318 HydrophobicContact CE3-CB 4.42Å; W291-F318 AromaticContact CE3-CD2 3.79Å; W291-F318 HydrophobicContact CE3-CD2 3.79Å; W291-F318 HydrophobicContact CG-CD2 4.1Å; W291-F318 HydrophobicContact CG-CE2 4.15Å; F318-R320 HydrophobicContact CD1-CG 4Å; F318-R320 HydrophobicContact CE1-CG 4.12Å
319	L	87.3	Confident	84.4	Confident	50 Å²	50	108.5 Å²	108.5	26%	0.262	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-89	120	179.1	-56.9	-179.7	0	0	0	109.8	S280 C282 L288 V317 Y322	S280-L319 WeakPolarHBondContact O-CB 3.47Å; S280-L319 PolarHBondContact O-N 3.12Å; C282-L319 HydrophobicContact CB-CD1 4.2Å; C282-L319 HydrophobicContact CB-CD2 4.44Å; C282-L319 HydrophobicContact CB-CG 4.29Å; L288-L319 HydrophobicContact CD2-CD1 3.34Å; V317-L319 HydrophobicContact CG1-CD2 4.21Å; V317-L319 PolarHBondContact O-N 3.2Å; L319-Y322 HydrophobicContact CD1-CD1 4.2Å; L319-Y322 HydrophobicContact CD1-CD2 4.36Å; L319-Y322 HydrophobicContact CD1-CG 4.03Å
320	R	79.3	Confident	83.7	Confident	216 Å²	216	109.4 Å²	109.4	82%	0.815	53%	0.53	S	S	*	.	S	Bend	trans	-88.8	138.6	172.5	-65.2	-176	174.9	-176.7	-1.7	109.4	F318 Y322	F318-R320 HydrophobicContact CD1-CG 4Å; F318-R320 HydrophobicContact CE1-CG 4.12Å; R320-Y322 VanDerWaalsContact C-N 3.27Å; R320-Y322 PolarHBondContact O-N 3.48Å
321	N	66.7	Low	82.9	Confident	172 Å²	172	104.6 Å²	104.6	92%	0.92	51%	0.514	S	S	*	.	S	Bend	trans	59.3	27.2	176.1	-54.7	-21.3	0	0	0	115.8
322	Y	68.1	Low	82.2	Confident	128 Å²	128	112.3 Å²	112.3	50%	0.502	55%	0.552	S	S	.	*			trans	-97	100.5	175	-171.4	-92.3	0	0	0	109.5	L288 L319 R320	L288-Y322 HydrophobicContact CD1-CE1 3.99Å; L288-Y322 HydrophobicContact CD2-CE1 4.43Å; L319-Y322 HydrophobicContact CD1-CD1 4.2Å; L319-Y322 HydrophobicContact CD1-CD2 4.36Å; L319-Y322 HydrophobicContact CD1-CG 4.03Å; R320-Y322 VanDerWaalsContact C-N 3.27Å; R320-Y322 PolarHBondContact O-N 3.48Å
323	S	56.6	Low	81.6	Confident	151 Å²	151	113.5 Å²	113.5	100%	1.056	56%	0.555	S	S	*	*			trans	-91.3	0	178.8	60.8	0	0	0	0	112.7

Retrieved 323 of 323 residues in 163.6 ms (Link to these results)

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