A0A087XWF4_POEFO Loading...

Proteasome activator complex subunit 1

Implicated in immunoproteasome assembly and required for efficient antigen processing. The PA28 activator complex enhances the generation of class I binding peptides by altering the cleavage pattern of the proteasome.

AlphaFold DB (A0A3B3W2C9), UniProt , Accession A0A087XWF4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 250 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	41.4	Very low	70.8	Confident	243 Å²	243	121.5 Å²	121.5	100%	1.197	70%	0.701	S	S	*	*				0	127	0	-62.2	-172.4	-168.6	0	0	107.3	S3	M1-S3 PolarHBondContact O-N 3.32Å
2	A	47.5	Very low	72.6	Confident	100 Å²	100	122.7 Å²	122.7	83%	0.826	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-65.6	132.6	175.9	0	0	0	0	0	108.7
3	S	59.8	Low	74.2	Confident	98 Å²	98	122.3 Å²	122.3	69%	0.685	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-52.9	131.9	171.6	-178.2	0	0	0	0	108.2	M1 G5	M1-S3 PolarHBondContact O-N 3.32Å; S3-G5 PolarHBondContact O-N 2.98Å
4	P	63	Low	75.6	Confident	111 Å²	111	119.6 Å²	119.6	72%	0.721	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-53.8	120.9	165.9	20.5	-26.6	0	0	0	106.5	I6	P4-I6 PolarHBondContact O-N 3.15Å
5	G	63.4	Low	76.8	Confident	70 Å²	70	116.4 Å²	116.4	72%	0.722	65%	0.649	S	S	*	*			trans	-61.5	109.7	-178.9	0	0	0	0	0	108	S3 Q7	S3-G5 PolarHBondContact O-N 2.98Å; G5-Q7 PolarHBondContact O-N 3.37Å; G5-Q7 VanDerWaalsContact O-N 3.15Å
6	I	74.5	Confident	77.9	Confident	128 Å²	128	113.5 Å²	113.5	66%	0.656	63%	0.632	S	S	*	*			trans	-59.6	121.3	175	-62.2	171.7	0	0	0	106.6	P4 L8 K11	P4-I6 PolarHBondContact O-N 3.15Å; I6-L8 PolarHBondContact O-N 2.69Å; I6-K11 HydrophobicContact CG2-CB 4.03Å
7	Q	81.4	Confident	79	Confident	138 Å²	138	113.4 Å²	113.4	65%	0.645	62%	0.623	S	S	*	*			trans	-60.5	136.6	176.6	-68.1	178.3	-5.8	0	0	109.2	G5 E9 S10 K11	G5-Q7 PolarHBondContact O-N 3.37Å; G5-Q7 VanDerWaalsContact O-N 3.15Å; Q7-E9 PolarHBondContact O-N 2.71Å; Q7-E9 VanDerWaalsContact O-N 3.15Å; Q7-S10 WeakPolarHBondContact O-CB 3.16Å; Q7-S10 PolarHBondContact O-N 2.81Å; Q7-K11 PolarHBondContact O-N 3.01Å
8	L	82.4	Confident	79.9	Confident	148 Å²	148	108.8 Å²	108.8	78%	0.775	60%	0.601	S	S	*	*	H	α-helix	trans	-55.7	-35.9	-175.9	-176.4	65.8	0	0	0	112.1	I6 K11 K12	I6-L8 PolarHBondContact O-N 2.69Å; L8-K11 PolarHBondContact O-N 2.78Å; L8-K12 PolarHBondContact O-N 3.49Å
9	E	86.3	Confident	80.7	Confident	139 Å²	139	108.8 Å²	108.8	65%	0.65	60%	0.596	S	S	*	*	H	α-helix	trans	-65.1	-46.6	176.2	-173.4	170.7	-172	0	0	112.3	Q7 K11 K12 Q13	Q7-E9 PolarHBondContact O-N 2.71Å; Q7-E9 VanDerWaalsContact O-N 3.15Å; E9-K11 VanDerWaalsContact C-N 3.29Å; E9-K11 PolarHBondContact O-N 3.27Å; E9-K12 PolarHBondContact O-N 3.23Å; E9-Q13 WeakPolarHBondContact O-CG 3.26Å; E9-Q13 PolarHBondContact O-N 3.2Å
10	S	89.4	Confident	81.6	Confident	47 Å²	47	108.3 Å²	108.3	33%	0.329	59%	0.592	S	S	.	*	H	α-helix	trans	-61.6	-38.8	176.2	-49.7	0	0	0	0	111.8	Q7 Q13 V14	Q7-S10 WeakPolarHBondContact O-CB 3.16Å; Q7-S10 PolarHBondContact O-N 2.81Å; S10-Q13 PolarHBondContact O-N 2.94Å; S10-V14 WeakPolarHBondContact O-CG2 3.31Å; S10-V14 PolarHBondContact O-N 2.88Å
11	K	89.2	Confident	82.3	Confident	115 Å²	115	103.8 Å²	103.8	50%	0.5	57%	0.567	S	S	.	*	H	α-helix	trans	-62	-47.3	175.1	-173.7	178	178.1	-177.9	0	111.2	I6 Q7 L8 E9 Q13 V14 D15	I6-K11 HydrophobicContact CG2-CB 4.03Å; Q7-K11 PolarHBondContact O-N 3.01Å; L8-K11 PolarHBondContact O-N 2.78Å; E9-K11 VanDerWaalsContact C-N 3.29Å; E9-K11 PolarHBondContact O-N 3.27Å; K11-Q13 VanDerWaalsContact C-N 3.34Å; K11-Q13 PolarHBondContact O-N 2.96Å; K11-V14 PolarHBondContact O-N 3.47Å; K11-D15 VanDerWaalsContact O-CG 3.28Å; K11-D15 PolarHBondContact O-N 2.85Å
12	K	92.8	Very high	84.9	Confident	135 Å²	135	92.9 Å²	92.9	59%	0.587	52%	0.515	S	S	*	.	H	α-helix	trans	-59.7	-43.6	178.7	-173.2	-177.6	176.2	-173.1	0	112.1	L8 E9 V14 D15 D16	L8-K12 PolarHBondContact O-N 3.49Å; E9-K12 PolarHBondContact O-N 3.23Å; K12-V14 VanDerWaalsContact C-N 3.32Å; K12-V14 PolarHBondContact O-N 3.04Å; K12-D15 PolarHBondContact O-N 2.93Å; K12-D16 WeakPolarHBondContact O-CB 3.42Å; K12-D16 VanDerWaalsContact O-CG 3.3Å; K12-D16 PolarHBondContact O-N 2.83Å
13	Q	93.8	Very high	87.3	Confident	118 Å²	118	93.6 Å²	93.6	55%	0.551	50%	0.5	S	S	*	.	H	α-helix	trans	-58.6	-43.2	178	-73.2	173.3	-15.9	0	0	112.4	E9 S10 K11 F17	E9-Q13 WeakPolarHBondContact O-CG 3.26Å; E9-Q13 PolarHBondContact O-N 3.2Å; S10-Q13 PolarHBondContact O-N 2.94Å; K11-Q13 VanDerWaalsContact C-N 3.34Å; K11-Q13 PolarHBondContact O-N 2.96Å; Q13-F17 PolarHBondContact O-N 2.9Å; Q13-F17 VanDerWaalsContact O-N 3.1Å
14	V	93.4	Very high	89.1	Confident	84 Å²	84	92.7 Å²	92.7	51%	0.509	49%	0.485	S	S	.	.	H	α-helix	trans	-70.1	-41.6	178	176.3	0	0	0	0	111.1	S10 K11 K12 D16 F17 C18	S10-V14 WeakPolarHBondContact O-CG2 3.31Å; S10-V14 PolarHBondContact O-N 2.88Å; K11-V14 PolarHBondContact O-N 3.47Å; K12-V14 VanDerWaalsContact C-N 3.32Å; K12-V14 PolarHBondContact O-N 3.04Å; V14-D16 VanDerWaalsContact C-N 3.34Å; V14-D16 PolarHBondContact O-N 3.24Å; V14-F17 WeakPolarHBondContact O-CB 3.01Å; V14-F17 PolarHBondContact O-N 3.14Å; V14-C18 PolarHBondContact O-N 3.33Å; V14-C18 PolarHBondContact O-SG 2.97Å
15	D	93.1	Very high	90.7	Very high	72 Å²	72	87.4 Å²	87.4	39%	0.385	45%	0.45	S	S	.	.	H	α-helix	trans	-60.9	-43.1	177.1	-70.4	-20.9	0	0	0	111.3	K11 K12 C18 Q19	K11-D15 VanDerWaalsContact O-CG 3.28Å; K11-D15 PolarHBondContact O-N 2.85Å; K12-D15 PolarHBondContact O-N 2.93Å; D15-C18 PolarHBondContact O-N 3.01Å; D15-Q19 WeakPolarHBondContact O-CG 3.35Å; D15-Q19 PolarHBondContact O-N 3.08Å
16	D	95.6	Very high	92.2	Very high	70 Å²	70	86.9 Å²	86.9	37%	0.374	43%	0.429	S	S	.	.	H	α-helix	trans	-62.8	-42	176.1	-72	-20.3	0	0	0	111.4	K12 V14 Q19 N20	K12-D16 WeakPolarHBondContact O-CB 3.42Å; K12-D16 VanDerWaalsContact O-CG 3.3Å; K12-D16 PolarHBondContact O-N 2.83Å; V14-D16 VanDerWaalsContact C-N 3.34Å; V14-D16 PolarHBondContact O-N 3.24Å; D16-Q19 PolarHBondContact O-N 2.94Å; D16-N20 VanDerWaalsContact O-CG 3.3Å; D16-N20 PolarHBondContact O-N 3.43Å; D16-N20 PolarHBondContact O-ND2 3.33Å
17	F	95.8	Very high	93.3	Very high	111 Å²	111	87.1 Å²	87.1	49%	0.487	43%	0.428	S	S	.	.	H	α-helix	trans	-59.8	-48.9	173.8	171.2	-99.2	0	0	0	111.9	Q13 V14 Q19 N20 L21 L138	Q13-F17 PolarHBondContact O-N 2.9Å; Q13-F17 VanDerWaalsContact O-N 3.1Å; V14-F17 WeakPolarHBondContact O-CB 3.01Å; V14-F17 PolarHBondContact O-N 3.14Å; F17-Q19 VanDerWaalsContact C-N 3.3Å; F17-Q19 PolarHBondContact O-N 3.21Å; F17-N20 PolarHBondContact O-N 3.45Å; F17-L21 HydrophobicContact CE1-CD2 4.36Å; F17-L21 HydrophobicContact CZ-CD2 4.46Å; F17-L21 WeakPolarHBondContact O-CB 3.31Å; F17-L21 PolarHBondContact O-N 3.32Å; F17-L138 HydrophobicContact CE1-CD1 4.02Å
18	C	95.3	Very high	94.1	Very high	32 Å²	32	81 Å²	81	22%	0.216	40%	0.399	C	S	.	.	H	α-helix	trans	-59.2	-39.9	178.4	-70.5	0	0	0	0	112.3	V14 D15 S22	V14-C18 PolarHBondContact O-N 3.33Å; V14-C18 PolarHBondContact O-SG 2.97Å; D15-C18 PolarHBondContact O-N 3.01Å; C18-S22 WeakPolarHBondContact O-CB 3.39Å; C18-S22 PolarHBondContact O-N 3.21Å; C18-S22 PolarHBondContact O-OG 3.42Å
19	Q	95.7	Very high	94.8	Very high	109 Å²	109	74.2 Å²	74.2	51%	0.509	36%	0.364	S	S	.	.	H	α-helix	trans	-66.5	-44.4	176.9	-72.8	179.5	24.3	0	0	112.1	D15 D16 F17 S22 K23	D15-Q19 WeakPolarHBondContact O-CG 3.35Å; D15-Q19 PolarHBondContact O-N 3.08Å; D16-Q19 PolarHBondContact O-N 2.94Å; F17-Q19 VanDerWaalsContact C-N 3.3Å; F17-Q19 PolarHBondContact O-N 3.21Å; Q19-S22 PolarHBondContact O-N 2.93Å; Q19-K23 WeakPolarHBondContact O-CG 3.43Å; Q19-K23 PolarHBondContact O-N 3.18Å; Q19-K23 VanDerWaalsContact O-N 3.08Å
20	N	97.4	Very high	95.2	Very high	98 Å²	98	71.7 Å²	71.7	52%	0.524	36%	0.362	S	S	.	.	H	α-helix	trans	-64.9	-44.5	178.1	-71	-24.6	0	0	0	111.5	D16 F17 S22 K23 E24	D16-N20 VanDerWaalsContact O-CG 3.3Å; D16-N20 PolarHBondContact O-N 3.43Å; D16-N20 PolarHBondContact O-ND2 3.33Å; F17-N20 PolarHBondContact O-N 3.45Å; N20-S22 VanDerWaalsContact C-N 3.3Å; N20-S22 PolarHBondContact O-N 2.99Å; N20-K23 PolarHBondContact O-N 3.33Å; N20-E24 PolarHBondContact O-N 3.1Å
21	L	97.4	Very high	95.5	Very high	13 Å²	13	75.6 Å²	75.6	7%	0.068	37%	0.372	C	S	.	.	H	α-helix	trans	-60.7	-40.5	175.9	-174.8	73.7	0	0	0	111.8	F17 E24 A25 T131 M134 W135 L138	F17-L21 HydrophobicContact CE1-CD2 4.36Å; F17-L21 HydrophobicContact CZ-CD2 4.46Å; F17-L21 WeakPolarHBondContact O-CB 3.31Å; F17-L21 PolarHBondContact O-N 3.32Å; L21-E24 PolarHBondContact O-N 3.37Å; L21-A25 WeakPolarHBondContact O-CB 3.5Å; L21-A25 PolarHBondContact O-N 2.84Å; L21-T131 HydrophobicContact CD1-CG2 3.71Å; L21-M134 HydrophobicContact CD2-CB 3.98Å; L21-M134 HydrophobicContact CD2-CG 3.62Å; L21-W135 HydrophobicContact CD2-CB 4.18Å; L21-W135 HydrophobicContact CG-CB 4.25Å; L21-L138 HydrophobicContact CD2-CD1 3.68Å
22	S	95.9	Very high	96	Very high	15 Å²	15	72.4 Å²	72.4	11%	0.105	36%	0.359	C	S	.	.	H	α-helix	trans	-62.1	-44.3	176.7	-61.4	0	0	0	0	111.7	C18 Q19 N20 E24 A25 E26	C18-S22 WeakPolarHBondContact O-CB 3.39Å; C18-S22 PolarHBondContact O-N 3.21Å; C18-S22 PolarHBondContact O-OG 3.42Å; Q19-S22 PolarHBondContact O-N 2.93Å; N20-S22 VanDerWaalsContact C-N 3.3Å; N20-S22 PolarHBondContact O-N 2.99Å; S22-E24 VanDerWaalsContact C-N 3.35Å; S22-E24 PolarHBondContact O-N 3.18Å; S22-A25 PolarHBondContact O-N 3.45Å; S22-E26 WeakPolarHBondContact O-CB 3.28Å; S22-E26 VanDerWaalsContact O-CG 3.25Å; S22-E26 WeakPolarHBondContact O-CG 3.44Å; S22-E26 PolarHBondContact O-N 2.69Å
23	K	96.8	Very high	96.2	Very high	115 Å²	115	66 Å²	66	50%	0.5	33%	0.331	S	S	.	.	H	α-helix	trans	-61.9	-43.4	175.7	-69.3	171	-173	169.2	0	111.4	Q19 N20 E26 Q27	Q19-K23 WeakPolarHBondContact O-CG 3.43Å; Q19-K23 PolarHBondContact O-N 3.18Å; Q19-K23 VanDerWaalsContact O-N 3.08Å; N20-K23 PolarHBondContact O-N 3.33Å; K23-E26 PolarHBondContact O-N 2.94Å; K23-Q27 WeakPolarHBondContact O-CB 3.43Å; K23-Q27 VanDerWaalsContact O-CG 3.31Å; K23-Q27 WeakPolarHBondContact O-CG 3.24Å; K23-Q27 PolarHBondContact O-N 3.47Å
24	E	98	Very high	96.4	Very high	78 Å²	78	62.5 Å²	62.5	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-62.3	-48.7	177.8	-170.2	-174	161.9	0	0	111.1	N20 L21 S22 E26 Q27 L28 T131	N20-E24 PolarHBondContact O-N 3.1Å; L21-E24 PolarHBondContact O-N 3.37Å; S22-E24 VanDerWaalsContact C-N 3.35Å; S22-E24 PolarHBondContact O-N 3.18Å; E24-E26 PolarHBondContact O-N 3.47Å; E24-Q27 WeakPolarHBondContact O-CB 3.36Å; E24-Q27 PolarHBondContact O-N 3.2Å; E24-L28 WeakPolarHBondContact O-CG 3.12Å; E24-L28 PolarHBondContact O-N 3.43Å; E24-T131 HydrophobicContact CB-CG2 4.4Å; E24-T131 HydrophobicContact CG-CG2 4.02Å
25	A	97.6	Very high	96.7	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-60.7	-43.3	178.6	0	0	0	0	0	112.1	L21 S22 Q27 L28 L29 W135	L21-A25 WeakPolarHBondContact O-CB 3.5Å; L21-A25 PolarHBondContact O-N 2.84Å; S22-A25 PolarHBondContact O-N 3.45Å; A25-Q27 VanDerWaalsContact C-N 3.34Å; A25-Q27 PolarHBondContact O-N 2.98Å; A25-L28 WeakPolarHBondContact O-CB 3.12Å; A25-L28 PolarHBondContact O-N 3.48Å; A25-L29 VanDerWaalsContact O-CG 3.26Å; A25-L29 WeakPolarHBondContact O-CG 3.28Å; A25-L29 PolarHBondContact O-N 3.17Å; A25-W135 HydrophobicContact CB-CB 3.7Å; A25-W135 HydrophobicContact CB-CD2 3.62Å; A25-W135 HydrophobicContact CB-CE3 3.92Å; A25-W135 HydrophobicContact CB-CG 3.52Å
26	E	95.2	Very high	96.9	Very high	60 Å²	60	59.7 Å²	59.7	28%	0.28	30%	0.297	S	S	.	.	H	α-helix	trans	-63.8	-38.3	176.4	-72.4	169.2	-168.8	0	0	111.9	S22 K23 E24 L29 S30 Y235 K239	S22-E26 WeakPolarHBondContact O-CB 3.28Å; S22-E26 VanDerWaalsContact O-CG 3.25Å; S22-E26 WeakPolarHBondContact O-CG 3.44Å; S22-E26 PolarHBondContact O-N 2.69Å; K23-E26 PolarHBondContact O-N 2.94Å; E24-E26 PolarHBondContact O-N 3.47Å; E26-L29 PolarHBondContact O-N 3.42Å; E26-S30 VanDerWaalsContact O-CB 3.31Å; E26-S30 WeakPolarHBondContact O-CB 3.44Å; E26-S30 PolarHBondContact O-N 3.49Å; E26-S30 PolarHBondContact O-OG 3.23Å; E26-Y235 HydrophobicContact CG-CE2 4.46Å; E26-Y235 PolarHBondContact OE1-OH 2.94Å; E26-K239 WeakPolarHBondContact OE1-CE 3.37Å; E26-K239 IonicContact OE1-NZ 2.9Å; E26-K239 PolarHBondContact OE1-NZ 3Å
27	Q	97.8	Very high	97.1	Very high	133 Å²	133	58.5 Å²	58.5	62%	0.621	29%	0.29	S	S	*	.	H	α-helix	trans	-66.2	-38.7	173	-75.7	-179.6	-5.5	0	0	112.4	K23 E24 A25 K31 F32	K23-Q27 WeakPolarHBondContact O-CB 3.43Å; K23-Q27 VanDerWaalsContact O-CG 3.31Å; K23-Q27 WeakPolarHBondContact O-CG 3.24Å; K23-Q27 PolarHBondContact O-N 3.47Å; E24-Q27 WeakPolarHBondContact O-CB 3.36Å; E24-Q27 PolarHBondContact O-N 3.2Å; A25-Q27 VanDerWaalsContact C-N 3.34Å; A25-Q27 PolarHBondContact O-N 2.98Å; Q27-K31 PolarHBondContact O-N 3.08Å; Q27-K31 VanDerWaalsContact O-N 3.1Å; Q27-F32 PolarHBondContact O-N 3.22Å
28	L	98.1	Very high	97.2	Very high	10 Å²	10	60 Å²	60	5%	0.052	30%	0.299	C	S	.	.	I	π-helix	trans	-61.2	-47.3	175.9	-70.9	175.7	0	0	0	111	E24 A25 F32 F33 K128 T131 V132	E24-L28 WeakPolarHBondContact O-CG 3.12Å; E24-L28 PolarHBondContact O-N 3.43Å; A25-L28 WeakPolarHBondContact O-CB 3.12Å; A25-L28 PolarHBondContact O-N 3.48Å; L28-F32 HydrophobicContact CD2-CB 3.85Å; L28-F32 HydrophobicContact CD2-CD1 3.84Å; L28-F32 HydrophobicContact CD2-CD2 4.49Å; L28-F32 HydrophobicContact CD2-CG 3.81Å; L28-F32 WeakPolarHBondContact O-CB 3.27Å; L28-F32 PolarHBondContact O-N 3.38Å; L28-F33 HydrophobicContact CB-CD1 4.25Å; L28-F33 HydrophobicContact CB-CE1 3.96Å; L28-F33 WeakPolarHBondContact O-CD1 3.26Å; L28-F33 PolarHBondContact O-N 2.96Å; L28-K128 HydrophobicContact CD1-CB 4.18Å; L28-K128 HydrophobicContact CD1-CD 4.03Å; L28-K128 HydrophobicContact CD1-CG 4.41Å; L28-K128 HydrophobicContact CD2-CB 4.49Å; L28-K128 HydrophobicContact CD2-CD 3.67Å; L28-K128 HydrophobicContact CD2-CG 3.96Å; L28-T131 HydrophobicContact CD1-CG2 3.83Å; L28-V132 HydrophobicContact CD1-CG2 4.26Å
29	L	95.3	Very high	97.3	Very high	4 Å²	4	63.1 Å²	63.1	2%	0.021	31%	0.31	C	S	.	.	I	π-helix	trans	-69.2	-46.5	-177.8	-65.1	164.9	0	0	0	112.2	A25 E26 F33 P34 W135 F228 I231	A25-L29 VanDerWaalsContact O-CG 3.26Å; A25-L29 WeakPolarHBondContact O-CG 3.28Å; A25-L29 PolarHBondContact O-N 3.17Å; E26-L29 PolarHBondContact O-N 3.42Å; L29-F33 HydrophobicContact CD2-CD2 4.12Å; L29-F33 HydrophobicContact CD2-CE2 3.95Å; L29-P34 WeakPolarHBondContact O-CD 3.37Å; L29-W135 HydrophobicContact CD1-CH2 4.03Å; L29-W135 HydrophobicContact CD1-CZ3 3.75Å; L29-F228 WeakPolarHBondContact O-CD2 3.5Å; L29-F228 WeakPolarHBondContact O-CE2 3.28Å; L29-I231 HydrophobicContact CD1-CG2 3.57Å; L29-I231 HydrophobicContact CD2-CB 4.14Å; L29-I231 HydrophobicContact CD2-CD1 3.64Å; L29-I231 HydrophobicContact CD2-CG1 4.49Å; L29-I231 HydrophobicContact CD2-CG2 3.99Å; L29-I231 HydrophobicContact CG-CG2 4.42Å
30	S	94.9	Very high	97.4	Very high	87 Å²	87	58 Å²	58	61%	0.608	29%	0.286	S	S	*	.	I	π-helix	trans	-76	-27.9	-173.3	57	0	0	0	0	114	E26	E26-S30 VanDerWaalsContact O-CB 3.31Å; E26-S30 WeakPolarHBondContact O-CB 3.44Å; E26-S30 PolarHBondContact O-N 3.49Å; E26-S30 PolarHBondContact O-OG 3.23Å
31	K	97.3	Very high	97.4	Very high	128 Å²	128	56.5 Å²	56.5	56%	0.557	28%	0.276	S	S	*	.	I	π-helix	trans	-127.1	-57.3	-172.3	-173.8	176.8	178.3	-178.4	0	113.1	Q27 F33 P34 E35	Q27-K31 PolarHBondContact O-N 3.08Å; Q27-K31 VanDerWaalsContact O-N 3.1Å; K31-F33 PolarHBondContact O-N 3.06Å; K31-P34 WeakPolarHBondContact O-CD 3.43Å; K31-E35 WeakPolarHBondContact CE-OE1 3.41Å; K31-E35 VanDerWaalsContact CG-OE1 3.22Å; K31-E35 WeakPolarHBondContact CG-OE1 3.38Å; K31-E35 VanDerWaalsContact O-CG 3.31Å; K31-E35 WeakPolarHBondContact O-CG 3.45Å; K31-E35 PolarHBondContact O-N 3.37Å
32	F	98.4	Very high	97.4	Very high	48 Å²	48	60.9 Å²	60.9	21%	0.211	30%	0.297	C	S	.	.	I	π-helix	trans	-64.1	-42.4	-170.9	-174	-97.2	0	0	0	113	Q27 L28 E35 K36 T124 K128 Y224	Q27-F32 PolarHBondContact O-N 3.22Å; L28-F32 HydrophobicContact CD2-CB 3.85Å; L28-F32 HydrophobicContact CD2-CD1 3.84Å; L28-F32 HydrophobicContact CD2-CD2 4.49Å; L28-F32 HydrophobicContact CD2-CG 3.81Å; L28-F32 WeakPolarHBondContact O-CB 3.27Å; L28-F32 PolarHBondContact O-N 3.38Å; F32-E35 PolarHBondContact O-N 3.28Å; F32-K36 HydrophobicContact CD1-CG 3.91Å; F32-K36 HydrophobicContact CE1-CD 4.33Å; F32-K36 HydrophobicContact CE1-CG 3.5Å; F32-K36 VanDerWaalsContact CE1-CG 3.5Å; F32-K36 HydrophobicContact CE2-CG 4.19Å; F32-K36 HydrophobicContact CG-CG 4.42Å; F32-K36 HydrophobicContact CZ-CD 4.12Å; F32-K36 VanDerWaalsContact CZ-CE 3.48Å; F32-K36 HydrophobicContact CZ-CG 3.66Å; F32-K36 VanDerWaalsContact O-CB 3.32Å; F32-K36 WeakPolarHBondContact O-CB 3.5Å; F32-K36 WeakPolarHBondContact O-CG 3.45Å; F32-K36 PolarHBondContact O-N 3.09Å; F32-T124 HydrophobicContact CE1-CG2 4.17Å; F32-T124 HydrophobicContact CZ-CG2 3.65Å; F32-K128 HydrophobicContact CD1-CG 4.18Å; F32-K128 HydrophobicContact CE1-CG 3.62Å; F32-K128 HydrophobicContact CZ-CG 4.19Å; F32-Y224 HydrophobicContact CD1-CE1 4.46Å; F32-Y224 HydrophobicContact CE1-CE1 4.2Å
33	F	98.3	Very high	97.4	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.7	-51.7	-176.7	-81	30.7	0	0	0	111.3	L28 L29 K31 E35 K36 I37 K128 V132 Y224 L227 F228	L28-F33 HydrophobicContact CB-CD1 4.25Å; L28-F33 HydrophobicContact CB-CE1 3.96Å; L28-F33 WeakPolarHBondContact O-CD1 3.26Å; L28-F33 PolarHBondContact O-N 2.96Å; L29-F33 HydrophobicContact CD2-CD2 4.12Å; L29-F33 HydrophobicContact CD2-CE2 3.95Å; K31-F33 PolarHBondContact O-N 3.06Å; F33-E35 PolarHBondContact O-N 3.12Å; F33-K36 PolarHBondContact O-N 3.42Å; F33-I37 VanDerWaalsContact O-CG1 3.31Å; F33-I37 WeakPolarHBondContact O-CG1 3.39Å; F33-I37 PolarHBondContact O-N 3.01Å; F33-K128 HydrophobicContact CE1-CB 4.35Å; F33-V132 HydrophobicContact CZ-CG2 4.12Å; F33-Y224 HydrophobicContact CB-CD1 4.34Å; F33-Y224 AromaticContact CD1-CD1 3.64Å; F33-Y224 HydrophobicContact CD1-CD1 3.64Å; F33-Y224 AromaticContact CD1-CE1 3.85Å; F33-Y224 HydrophobicContact CD1-CE1 3.85Å; F33-Y224 AromaticContact CD2-CD1 3.93Å; F33-Y224 HydrophobicContact CD2-CD1 3.93Å; F33-Y224 AromaticContact CE1-CD1 3.81Å; F33-Y224 HydrophobicContact CE1-CD1 3.81Å; F33-Y224 AromaticContact CE1-CE1 3.75Å; F33-Y224 HydrophobicContact CE1-CE1 3.75Å; F33-Y224 HydrophobicContact CE2-CD1 4.11Å; F33-Y224 AromaticContact CG-CD1 3.68Å; F33-Y224 HydrophobicContact CG-CD1 3.68Å; F33-Y224 HydrophobicContact CG-CE1 4.36Å; F33-Y224 HydrophobicContact CZ-CD1 4.04Å; F33-Y224 HydrophobicContact CZ-CE1 4.22Å; F33-L227 HydrophobicContact CD2-CB 4.31Å; F33-L227 HydrophobicContact CE2-CB 3.73Å; F33-L227 HydrophobicContact CE2-CD1 4.19Å; F33-F228 HydrophobicContact CB-CD2 4.38Å; F33-F228 HydrophobicContact CD2-CB 4.29Å
34	P	98.2	Very high	97.4	Very high	45 Å²	45	56.3 Å²	56.3	29%	0.292	28%	0.277	S	S	.	.	H	α-helix	trans	-53.8	-49	172.2	-28.1	34.5	0	0	0	113.6	L29 K31 K36 I37 E38 F228	L29-P34 WeakPolarHBondContact O-CD 3.37Å; K31-P34 WeakPolarHBondContact O-CD 3.43Å; P34-K36 VanDerWaalsContact C-N 3.31Å; P34-K36 PolarHBondContact O-N 2.9Å; P34-I37 PolarHBondContact O-N 3.43Å; P34-E38 PolarHBondContact O-N 3.3Å; P34-F228 HydrophobicContact CG-CD2 4.11Å; P34-F228 HydrophobicContact CG-CE2 3.76Å; P34-F228 HydrophobicContact CG-CZ 4.42Å
35	E	98.4	Very high	97.2	Very high	79 Å²	79	59 Å²	59	37%	0.369	29%	0.288	S	S	.	.	H	α-helix	trans	-60.3	-41.3	179.3	-72	174.2	177	0	0	111.6	K31 F32 F33 I37 E38 Q39	K31-E35 WeakPolarHBondContact CE-OE1 3.41Å; K31-E35 VanDerWaalsContact CG-OE1 3.22Å; K31-E35 WeakPolarHBondContact CG-OE1 3.38Å; K31-E35 VanDerWaalsContact O-CG 3.31Å; K31-E35 WeakPolarHBondContact O-CG 3.45Å; K31-E35 PolarHBondContact O-N 3.37Å; F32-E35 PolarHBondContact O-N 3.28Å; F33-E35 PolarHBondContact O-N 3.12Å; E35-I37 PolarHBondContact O-N 3.06Å; E35-E38 PolarHBondContact O-N 3.32Å; E35-Q39 VanDerWaalsContact O-CG 3.29Å; E35-Q39 WeakPolarHBondContact O-CG 3.17Å; E35-Q39 PolarHBondContact O-N 3.36Å
36	K	98.3	Very high	97	Very high	19 Å²	19	62.9 Å²	62.9	8%	0.083	31%	0.312	C	S	.	.	H	α-helix	trans	-65.8	-36.4	177.8	-86.2	-71.2	175.6	-174.3	0	113.1	F32 F33 P34 E38 Q39 L40 E121 Y224	F32-K36 HydrophobicContact CD1-CG 3.91Å; F32-K36 HydrophobicContact CE1-CD 4.33Å; F32-K36 HydrophobicContact CE1-CG 3.5Å; F32-K36 VanDerWaalsContact CE1-CG 3.5Å; F32-K36 HydrophobicContact CE2-CG 4.19Å; F32-K36 HydrophobicContact CG-CG 4.42Å; F32-K36 HydrophobicContact CZ-CD 4.12Å; F32-K36 VanDerWaalsContact CZ-CE 3.48Å; F32-K36 HydrophobicContact CZ-CG 3.66Å; F32-K36 VanDerWaalsContact O-CB 3.32Å; F32-K36 WeakPolarHBondContact O-CB 3.5Å; F32-K36 WeakPolarHBondContact O-CG 3.45Å; F32-K36 PolarHBondContact O-N 3.09Å; F33-K36 PolarHBondContact O-N 3.42Å; P34-K36 VanDerWaalsContact C-N 3.31Å; P34-K36 PolarHBondContact O-N 2.9Å; K36-E38 VanDerWaalsContact C-N 3.3Å; K36-E38 PolarHBondContact O-N 3.2Å; K36-Q39 PolarHBondContact O-N 3.29Å; K36-L40 WeakPolarHBondContact O-CB 3.31Å; K36-L40 WeakPolarHBondContact O-CD1 3.17Å; K36-L40 WeakPolarHBondContact O-CG 3.16Å; K36-L40 PolarHBondContact O-N 3.11Å; K36-E121 VanDerWaalsContact NZ-CD 3.28Å; K36-E121 IonicContact NZ-OE1 3.32Å; K36-E121 PolarHBondContact NZ-OE1 3.38Å; K36-E121 IonicContact NZ-OE2 3.01Å; K36-E121 PolarHBondContact NZ-OE2 3.35Å; K36-Y224 HydrophobicContact CB-CD2 4.05Å; K36-Y224 HydrophobicContact CB-CE2 3.97Å; K36-Y224 HydrophobicContact CB-CG 4.39Å; K36-Y224 HydrophobicContact CG-CE2 4.29Å
37	I	98.5	Very high	96.9	Very high	44 Å²	44	60.7 Å²	60.7	23%	0.226	30%	0.303	C	S	.	.	H	α-helix	trans	-59.8	-44.9	176.2	-68.2	161.7	0	0	0	110.2	F33 P34 E35 Q41 R221 A225	F33-I37 VanDerWaalsContact O-CG1 3.31Å; F33-I37 WeakPolarHBondContact O-CG1 3.39Å; F33-I37 PolarHBondContact O-N 3.01Å; P34-I37 PolarHBondContact O-N 3.43Å; E35-I37 PolarHBondContact O-N 3.06Å; I37-Q41 WeakPolarHBondContact O-CB 3.42Å; I37-Q41 PolarHBondContact O-N 3.19Å; I37-R221 HydrophobicContact CG2-CG 4.06Å; I37-A225 HydrophobicContact CD1-CB 3.91Å; I37-A225 HydrophobicContact CG1-CB 4.49Å
38	E	98.2	Very high	96.5	Very high	144 Å²	144	55 Å²	55	67%	0.673	28%	0.276	S	S	*	.	H	α-helix	trans	-66.9	-44.7	177.7	-67	-175	173.5	0	0	112.3	P34 E35 K36 L40 Q41 M42	P34-E38 PolarHBondContact O-N 3.3Å; E35-E38 PolarHBondContact O-N 3.32Å; K36-E38 VanDerWaalsContact C-N 3.3Å; K36-E38 PolarHBondContact O-N 3.2Å; E38-L40 PolarHBondContact O-N 2.73Å; E38-Q41 WeakPolarHBondContact O-CB 3.13Å; E38-Q41 PolarHBondContact O-N 3.48Å; E38-M42 WeakPolarHBondContact O-CG 3.29Å; E38-M42 PolarHBondContact O-N 3.45Å
39	Q	98.1	Very high	95.8	Very high	97 Å²	97	57.6 Å²	57.6	45%	0.453	30%	0.295	S	S	.	.	H	α-helix	trans	-57.5	-47.3	176.7	-72.7	171.5	11.5	0	0	111.8	E35 K36 Q41 M42 L43	E35-Q39 VanDerWaalsContact O-CG 3.29Å; E35-Q39 WeakPolarHBondContact O-CG 3.17Å; E35-Q39 PolarHBondContact O-N 3.36Å; K36-Q39 PolarHBondContact O-N 3.29Å; Q39-Q41 VanDerWaalsContact C-N 3.33Å; Q39-Q41 PolarHBondContact O-N 3.33Å; Q39-M42 WeakPolarHBondContact O-CB 3.25Å; Q39-M42 PolarHBondContact O-N 3.33Å; Q39-L43 PolarHBondContact O-N 3.45Å
40	L	98.3	Very high	95	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-69.2	-32.9	179.4	-65.9	166.2	0	0	0	111.8	K36 E38 M42 L43 L44 E121 V217 I220 R221 Y224	K36-L40 WeakPolarHBondContact O-CB 3.31Å; K36-L40 WeakPolarHBondContact O-CD1 3.17Å; K36-L40 WeakPolarHBondContact O-CG 3.16Å; K36-L40 PolarHBondContact O-N 3.11Å; E38-L40 PolarHBondContact O-N 2.73Å; L40-M42 VanDerWaalsContact C-N 3.3Å; L40-M42 PolarHBondContact O-N 3.09Å; L40-L43 HydrophobicContact CD2-CD2 4.24Å; L40-L43 PolarHBondContact O-N 2.94Å; L40-L44 WeakPolarHBondContact O-CG 2.88Å; L40-L44 PolarHBondContact O-N 3.27Å; L40-E121 HydrophobicContact CD2-CB 4.28Å; L40-E121 HydrophobicContact CD2-CG 3.89Å; L40-V217 HydrophobicContact CB-CG1 4.43Å; L40-V217 HydrophobicContact CD2-CG1 4.15Å; L40-I220 HydrophobicContact CD1-CB 4.35Å; L40-I220 HydrophobicContact CD1-CG2 3.56Å; L40-I220 HydrophobicContact CD2-CG2 4.34Å; L40-R221 HydrophobicContact CB-CB 3.94Å; L40-R221 HydrophobicContact CB-CG 4.16Å; L40-R221 HydrophobicContact CD1-CB 4.01Å; L40-Y224 HydrophobicContact CD1-CD2 3.8Å; L40-Y224 HydrophobicContact CD1-CE2 3.93Å
41	Q	97.5	Very high	93.9	Very high	66 Å²	66	62.7 Å²	62.7	31%	0.308	32%	0.318	S	S	.	.	H	α-helix	trans	-63.1	-38.2	171.6	-176.8	62	53.6	0	0	111.8	I37 E38 Q39 K45	I37-Q41 WeakPolarHBondContact O-CB 3.42Å; I37-Q41 PolarHBondContact O-N 3.19Å; E38-Q41 WeakPolarHBondContact O-CB 3.13Å; E38-Q41 PolarHBondContact O-N 3.48Å; Q39-Q41 VanDerWaalsContact C-N 3.33Å; Q39-Q41 PolarHBondContact O-N 3.33Å; Q41-K45 WeakPolarHBondContact O-CG 3.48Å; Q41-K45 PolarHBondContact O-N 3.3Å
42	M	97.1	Very high	93.3	Very high	105 Å²	105	61.2 Å²	61.2	52%	0.517	32%	0.316	S	S	.	.	H	α-helix	trans	-68.7	-45.7	174.6	-72.6	-56	-61.4	0	0	111.5	E38 Q39 L40 L44 K45 T46	E38-M42 WeakPolarHBondContact O-CG 3.29Å; E38-M42 PolarHBondContact O-N 3.45Å; Q39-M42 WeakPolarHBondContact O-CB 3.25Å; Q39-M42 PolarHBondContact O-N 3.33Å; L40-M42 VanDerWaalsContact C-N 3.3Å; L40-M42 PolarHBondContact O-N 3.09Å; M42-L44 VanDerWaalsContact C-N 3.27Å; M42-L44 PolarHBondContact O-N 2.87Å; M42-K45 WeakPolarHBondContact O-CA 3.22Å; M42-K45 WeakPolarHBondContact O-CB 3.31Å; M42-K45 PolarHBondContact O-N 3.07Å; M42-K45 HydrophobicContact SD-CD 4.37Å; M42-T46 HydrophobicContact CE-CG2 4.45Å; M42-T46 PolarHBondContact O-N 2.89Å; M42-T46 PolarHBondContact O-OG1 3.41Å; M42-T46 VanDerWaalsContact O-OG1 3.07Å
43	L	96.3	Very high	92.6	Very high	21 Å²	21	60.9 Å²	60.9	11%	0.11	32%	0.316	C	S	.	.	H	α-helix	trans	-52.9	-44.7	174.8	176.9	62.3	0	0	0	112.2	Q39 L40 K45 T46 S47 F48 E117 V217	Q39-L43 PolarHBondContact O-N 3.45Å; L40-L43 HydrophobicContact CD2-CD2 4.24Å; L40-L43 PolarHBondContact O-N 2.94Å; L43-K45 VanDerWaalsContact C-N 3.29Å; L43-K45 PolarHBondContact O-N 2.8Å; L43-T46 PolarHBondContact O-N 2.79Å; L43-T46 PolarHBondContact O-OG1 2.91Å; L43-S47 WeakPolarHBondContact CD1-OG 3.41Å; L43-S47 WeakPolarHBondContact O-CB 3.39Å; L43-S47 PolarHBondContact O-N 2.88Å; L43-F48 HydrophobicContact CG-CE2 4.38Å; L43-E117 HydrophobicContact CD1-CB 4.24Å; L43-E117 WeakPolarHBondContact CD1-OE2 3.4Å; L43-V217 HydrophobicContact CD2-CG1 3.94Å; L43-V217 HydrophobicContact CD2-CG2 4.11Å; L43-V217 HydrophobicContact CG-CG1 4.39Å
44	L	95.9	Very high	92	Very high	14 Å²	14	63.3 Å²	63.3	7%	0.073	34%	0.336	C	S	.	.	H	α-helix	trans	-62.1	-34.6	176	-75.6	164.8	0	0	0	113.2	L40 M42 F48 R214 V217 L218	L40-L44 WeakPolarHBondContact O-CG 2.88Å; L40-L44 PolarHBondContact O-N 3.27Å; M42-L44 VanDerWaalsContact C-N 3.27Å; M42-L44 PolarHBondContact O-N 2.87Å; L44-F48 HydrophobicContact CD2-CD2 4.24Å; L44-F48 WeakPolarHBondContact O-CB 3.48Å; L44-R214 HydrophobicContact CD2-CG 3.99Å; L44-V217 HydrophobicContact CD1-CG1 4.13Å; L44-V217 HydrophobicContact CD2-CB 3.96Å; L44-V217 HydrophobicContact CD2-CG1 3.76Å; L44-V217 HydrophobicContact CG-CB 4.38Å; L44-V217 HydrophobicContact CG-CG1 3.62Å; L44-L218 HydrophobicContact CD1-CD2 3.53Å; L44-L218 HydrophobicContact CD1-CG 3.99Å; L44-L218 HydrophobicContact CD2-CD2 4.32Å; L44-L218 HydrophobicContact CD2-CG 3.98Å
45	K	94.4	Very high	91.5	Very high	134 Å²	134	65.1 Å²	65.1	58%	0.583	35%	0.35	S	S	*	.	H	α-helix	trans	-78	-36.2	178.7	-71.3	176.1	178.8	179.9	0	112.2	Q41 M42 L43	Q41-K45 WeakPolarHBondContact O-CG 3.48Å; Q41-K45 PolarHBondContact O-N 3.3Å; M42-K45 WeakPolarHBondContact O-CA 3.22Å; M42-K45 WeakPolarHBondContact O-CB 3.31Å; M42-K45 PolarHBondContact O-N 3.07Å; M42-K45 HydrophobicContact SD-CD 4.37Å; L43-K45 VanDerWaalsContact C-N 3.29Å; L43-K45 PolarHBondContact O-N 2.8Å
46	T	93.4	Very high	91.1	Very high	82 Å²	82	61.5 Å²	61.5	50%	0.503	33%	0.333	S	S	.	.	H	α-helix	trans	-89.4	-48.4	-172.9	54.8	0	0	0	0	112.6	M42 L43 S49	M42-T46 HydrophobicContact CE-CG2 4.45Å; M42-T46 PolarHBondContact O-N 2.89Å; M42-T46 PolarHBondContact O-OG1 3.41Å; M42-T46 VanDerWaalsContact O-OG1 3.07Å; L43-T46 PolarHBondContact O-N 2.79Å; L43-T46 PolarHBondContact O-OG1 2.91Å; T46-S49 PolarHBondContact O-OG 2.94Å; T46-S49 VanDerWaalsContact O-OG 3.1Å
47	S	91.4	Very high	90.8	Very high	14 Å²	14	65.6 Å²	65.6	10%	0.098	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-24	-170.1	-53.4	0	0	0	0	112.1	L43 R110 E117	L43-S47 WeakPolarHBondContact CD1-OG 3.41Å; L43-S47 WeakPolarHBondContact O-CB 3.39Å; L43-S47 PolarHBondContact O-N 2.88Å; S47-R110 PolarHBondContact O-NH2 2.91Å; S47-E117 PolarHBondContact OG-OE2 3.49Å
48	F	90.6	Very high	90.5	Very high	12 Å²	12	64.2 Å²	64.2	5%	0.053	35%	0.346	C	S	.	.	S	Bend	trans	-107.9	37.5	-179.9	-64.8	-87.9	0	0	0	114.3	L43 L44 L114 V118 Y210 L213 R214 V217	L43-F48 HydrophobicContact CG-CE2 4.38Å; L44-F48 HydrophobicContact CD2-CD2 4.24Å; L44-F48 WeakPolarHBondContact O-CB 3.48Å; F48-L114 HydrophobicContact CD1-CD1 4.44Å; F48-L114 HydrophobicContact CD1-CD2 4.43Å; F48-L114 HydrophobicContact CD2-CD2 4.48Å; F48-L114 HydrophobicContact CE1-CD1 4Å; F48-L114 HydrophobicContact CE1-CD2 4.06Å; F48-L114 HydrophobicContact CE1-CG 4.49Å; F48-L114 HydrophobicContact CE2-CD2 4.1Å; F48-L114 HydrophobicContact CZ-CD2 3.9Å; F48-V118 HydrophobicContact CE2-CG2 4.45Å; F48-V118 HydrophobicContact CZ-CG2 4.03Å; F48-Y210 WeakPolarHBondContact CA-OH 3.47Å; F48-Y210 HydrophobicContact CD1-CE2 4.04Å; F48-Y210 PolarHBondContact O-OH 3.38Å; F48-L213 HydrophobicContact CE1-CB 3.94Å; F48-L213 HydrophobicContact CZ-CB 4.08Å; F48-R214 HydrophobicContact CB-CG 4.03Å; F48-R214 HydrophobicContact CD1-CB 3.47Å; F48-R214 VanDerWaalsContact CD1-CB 3.47Å; F48-R214 HydrophobicContact CD1-CG 3.76Å; F48-R214 VanDerWaalsContact CE1-CA 3.48Å; F48-R214 HydrophobicContact CE1-CB 3.72Å; F48-R214 HydrophobicContact CE1-CG 4.4Å; F48-R214 VanDerWaalsContact CE1-N 3.32Å; F48-R214 HydrophobicContact CG-CB 4.17Å; F48-R214 HydrophobicContact CG-CG 3.96Å; F48-V217 HydrophobicContact CE2-CB 4.45Å; F48-V217 HydrophobicContact CE2-CG2 3.83Å; F48-V217 HydrophobicContact CZ-CG2 4.03Å
49	S	82.5	Confident	90.2	Very high	65 Å²	65	62.2 Å²	62.2	46%	0.455	35%	0.345	S	S	.	.			trans	-94	24.8	-179.8	50.6	0	0	0	0	114.4	T46 D51	T46-S49 PolarHBondContact O-OG 2.94Å; T46-S49 VanDerWaalsContact O-OG 3.1Å; S49-D51 PolarHBondContact O-N 3.33Å
50	C	77.9	Confident	90	Very high	29 Å²	29	58.6 Å²	58.6	20%	0.196	33%	0.329	C	S	.	.			trans	-80.1	104.5	-176.9	-154.5	0	0	0	0	110.1	D52 S55 Y210	C50-D52 PolarHBondContact SG-O 3.07Å; C50-S55 PolarHBondContact SG-OG 2.94Å; C50-Y210 HydrophobicContact CB-CE1 4.2Å; C50-Y210 HydrophobicContact CB-CE2 4.09Å; C50-Y210 WeakPolarHBondContact CB-OH 3.32Å; C50-Y210 PolarHBondContact N-OH 3.39Å
51	D	72.8	Confident	89.6	Confident	170 Å²	170	64.5 Å²	64.5	91%	0.909	36%	0.361	S	S	*	.	S	Bend	trans	-76.6	-28.7	179.4	-65.5	-35.7	0	0	0	112.7	S49	S49-D51 PolarHBondContact O-N 3.33Å
52	D	84.8	Confident	89.3	Confident	96 Å²	96	61.7 Å²	61.7	51%	0.513	35%	0.348	S	S	.	.			trans	-117.9	120.5	177.7	-177.8	12.5	0	0	0	110.9	C50 A54 S55	C50-D52 PolarHBondContact SG-O 3.07Å; D52-A54 VanDerWaalsContact C-N 3.26Å; D52-A54 PolarHBondContact O-N 3.28Å; D52-A54 VanDerWaalsContact OD1-CB 3.3Å; D52-A54 WeakPolarHBondContact OD1-CB 3.49Å; D52-A54 PolarHBondContact OD1-N 3.5Å; D52-S55 PolarHBondContact O-N 3.42Å; D52-S55 PolarHBondContact O-OG 2.92Å
53	L	84.2	Confident	88.9	Confident	42 Å²	42	60.2 Å²	60.2	22%	0.22	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-75.3	-16.4	177.6	-62.7	174.1	0	0	0	112.8	S55 L56 Q207 Y210	L53-S55 PolarHBondContact O-N 3.01Å; L53-L56 HydrophobicContact CB-CD1 4.42Å; L53-L56 HydrophobicContact CD2-CD1 3.56Å; L53-L56 WeakPolarHBondContact O-CB 3.43Å; L53-L56 PolarHBondContact O-N 3.17Å; L53-L56 VanDerWaalsContact O-N 3.11Å; L53-Q207 HydrophobicContact CB-CG 4.29Å; L53-Y210 HydrophobicContact CD2-CD1 3.87Å; L53-Y210 HydrophobicContact CD2-CE1 4.06Å
54	A	85.2	Confident	88.5	Confident	51 Å²	51	65.8 Å²	65.8	42%	0.421	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-64.3	-28	175	0	0	0	0	0	111.8	D52 L56 K57	D52-A54 VanDerWaalsContact C-N 3.26Å; D52-A54 PolarHBondContact O-N 3.28Å; D52-A54 VanDerWaalsContact OD1-CB 3.3Å; D52-A54 WeakPolarHBondContact OD1-CB 3.49Å; D52-A54 PolarHBondContact OD1-N 3.5Å; A54-L56 PolarHBondContact O-N 3.48Å; A54-K57 WeakPolarHBondContact O-CB 3.31Å; A54-K57 WeakPolarHBondContact O-CG 3.24Å; A54-K57 PolarHBondContact O-N 2.99Å
55	S	87.2	Confident	88	Confident	83 Å²	83	67.1 Å²	67.1	58%	0.58	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-70.4	-9.6	175.9	75.6	0	0	0	0	113.6	C50 D52 L53 K57	C50-S55 PolarHBondContact SG-OG 2.94Å; D52-S55 PolarHBondContact O-N 3.42Å; D52-S55 PolarHBondContact O-OG 2.92Å; L53-S55 PolarHBondContact O-N 3.01Å; S55-K57 VanDerWaalsContact C-N 3.33Å
56	L	90.3	Very high	87.6	Confident	3 Å²	3	63.8 Å²	63.8	2%	0.016	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-83	-8.1	174	-62.9	171.1	0	0	0	112.8	L53 A54 A58 N108 R110 Q207 Y210	L53-L56 HydrophobicContact CB-CD1 4.42Å; L53-L56 HydrophobicContact CD2-CD1 3.56Å; L53-L56 WeakPolarHBondContact O-CB 3.43Å; L53-L56 PolarHBondContact O-N 3.17Å; L53-L56 VanDerWaalsContact O-N 3.11Å; A54-L56 PolarHBondContact O-N 3.48Å; L56-A58 PolarHBondContact O-N 3.05Å; L56-N108 PolarHBondContact O-ND2 3.49Å; L56-R110 HydrophobicContact CD2-CB 4.23Å; L56-R110 HydrophobicContact CD2-CG 3.6Å; L56-Q207 HydrophobicContact CB-CG 4.49Å; L56-Q207 HydrophobicContact CD1-CG 4.39Å; L56-Y210 HydrophobicContact CD1-CD1 3.74Å; L56-Y210 HydrophobicContact CD1-CD2 3.97Å; L56-Y210 HydrophobicContact CD1-CE1 4.44Å; L56-Y210 HydrophobicContact CD1-CG 3.48Å; L56-Y210 VanDerWaalsContact CD1-CG 3.48Å; L56-Y210 HydrophobicContact CD2-CD2 3.87Å; L56-Y210 HydrophobicContact CD2-CE2 4.36Å; L56-Y210 HydrophobicContact CD2-CG 4.24Å
57	K	91.1	Very high	87.2	Confident	104 Å²	104	64.9 Å²	64.9	45%	0.452	38%	0.381	S	S	.	.			trans	-68.5	107.9	-178.8	-70.4	-174.2	177.5	-174.6	0	110.7	A54 S55 H203	A54-K57 WeakPolarHBondContact O-CB 3.31Å; A54-K57 WeakPolarHBondContact O-CG 3.24Å; A54-K57 PolarHBondContact O-N 2.99Å; S55-K57 VanDerWaalsContact C-N 3.33Å; K57-H203 HydrophobicContact CG-CB 4.35Å
58	A	92.3	Very high	86.9	Confident	16 Å²	16	67.3 Å²	67.3	13%	0.132	40%	0.402	C	S	.	.			trans	-70.1	149.8	171.2	0	0	0	0	0	111.4	L56 L60 N108 H203	L56-A58 PolarHBondContact O-N 3.05Å; A58-L60 PolarHBondContact O-N 3.38Å; A58-N108 HydrophobicContact CB-CB 4.15Å; A58-H203 PolarHBondContact O-CE1 3.42Å; A58-H203 VanDerWaalsContact O-CE1 3.25Å
59	P	93.1	Very high	86.5	Confident	101 Å²	101	73.8 Å²	73.8	66%	0.656	43%	0.43	S	S	*	.			trans	-56.1	136.9	171.5	-24	34.2	0	0	0	111.9
60	L	93	Very high	86.5	Confident	21 Å²	21	74.4 Å²	74.4	11%	0.11	43%	0.426	C	S	.	.			trans	-132.1	75.9	178.9	-169.7	64.2	0	0	0	109.7	A58 I62 I105 V186 R199 V202	A58-L60 PolarHBondContact O-N 3.38Å; L60-I62 HydrophobicContact CD1-CD1 3.75Å; L60-I62 HydrophobicContact CD1-CG1 4.18Å; L60-I62 HydrophobicContact CD2-CD1 4.2Å; L60-I62 HydrophobicContact CG-CD1 3.8Å; L60-I62 HydrophobicContact CG-CG1 4.12Å; L60-I62 PolarHBondContact O-N 3.26Å; L60-I105 HydrophobicContact CD1-CD1 4.35Å; L60-I105 HydrophobicContact CD1-CG1 4.45Å; L60-I105 HydrophobicContact CD1-CG2 3.64Å; L60-V186 HydrophobicContact CD1-CG2 4.43Å; L60-R199 HydrophobicContact CD2-CB 3.82Å; L60-R199 HydrophobicContact CD2-CG 3.93Å; L60-V202 HydrophobicContact CD1-CG1 4.47Å; L60-V202 HydrophobicContact CD2-CB 4.2Å; L60-V202 HydrophobicContact CD2-CG1 4.44Å; L60-V202 HydrophobicContact CD2-CG2 4.28Å
61	D	91.2	Very high	86.7	Confident	126 Å²	126	78 Å²	78	67%	0.674	44%	0.44	S	S	*	.			trans	-76.8	53.4	-171.6	-61.7	-34.9	0	0	0	113.1
62	I	90.9	Very high	87.2	Confident	6 Å²	6	72.1 Å²	72.1	3%	0.031	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-92	125.5	173	-56.4	172.4	0	0	0	107.5	L60 I64 C102 I105 A189 P193 R199	L60-I62 HydrophobicContact CD1-CD1 3.75Å; L60-I62 HydrophobicContact CD1-CG1 4.18Å; L60-I62 HydrophobicContact CD2-CD1 4.2Å; L60-I62 HydrophobicContact CG-CD1 3.8Å; L60-I62 HydrophobicContact CG-CG1 4.12Å; L60-I62 PolarHBondContact O-N 3.26Å; I62-I64 PolarHBondContact O-N 3.45Å; I62-C102 HydrophobicContact CG1-CB 4.35Å; I62-I105 HydrophobicContact CG1-CD1 4.06Å; I62-I105 HydrophobicContact CG1-CG1 4.43Å; I62-A189 HydrophobicContact CD1-CB 3.48Å; I62-A189 VanDerWaalsContact CD1-CB 3.48Å; I62-P193 HydrophobicContact CG2-CB 4.09Å; I62-R199 VanDerWaalsContact O-CZ 3.23Å; I62-R199 PolarHBondContact O-NH1 3.45Å; I62-R199 PolarHBondContact O-NH2 3.42Å
63	P	89.3	Confident	87.1	Confident	74 Å²	74	74.2 Å²	74.2	48%	0.481	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-57.1	134.5	178.5	-26.4	35.6	0	0	0	112.3	P101 R199	P63-P101 WeakPolarHBondContact CG-O 3.46Å; P63-R199 PolarHBondContact O-NH2 2.81Å
64	I	87.2	Confident	87.1	Confident	139 Å²	139	80.4 Å²	80.4	71%	0.713	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-84.5	124.6	174.8	-61	172.8	0	0	0	107.8	I62 D66	I62-I64 PolarHBondContact O-N 3.45Å; I64-D66 PolarHBondContact O-N 2.87Å
65	P	85	Confident	87.1	Confident	41 Å²	41	83 Å²	83	27%	0.266	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-64.9	132.5	180	-20.1	34.1	0	0	0	110.5	E70 P193 H194	P65-E70 HydrophobicContact CB-CG 4.35Å; P65-P193 WeakPolarHBondContact CD-O 3.44Å; P65-P193 HydrophobicContact CG-CB 3.78Å; P65-P193 HydrophobicContact CG-CG 3.69Å; P65-H194 HydrophobicContact CG-CB 4.26Å
66	D	85.7	Confident	86.9	Confident	64 Å²	64	85.9 Å²	85.9	34%	0.342	44%	0.444	S	S	.	.			trans	-96.3	114.2	172.2	177.3	-17.6	0	0	0	108	I64 A68 K69 E70	I64-D66 PolarHBondContact O-N 2.87Å; D66-A68 PolarHBondContact O-N 3.4Å; D66-A68 PolarHBondContact OD1-N 3.36Å; D66-K69 HydrophobicContact CB-CB 4.02Å; D66-K69 HydrophobicContact CB-CD 3.9Å; D66-K69 HydrophobicContact CB-CG 4Å; D66-K69 PolarHBondContact O-N 3.21Å; D66-K69 VanDerWaalsContact O-N 3.08Å; D66-K69 WeakPolarHBondContact OD2-CD 3.47Å; D66-K69 WeakPolarHBondContact OD2-CE 3.47Å; D66-K69 WeakPolarHBondContact OD2-CG 3.45Å; D66-K69 IonicContact OD2-NZ 2.88Å; D66-E70 PolarHBondContact O-N 2.88Å
67	P	85	Confident	86.6	Confident	105 Å²	105	90.4 Å²	90.4	68%	0.682	46%	0.463	S	S	*	.	H	α-helix	trans	-53.4	-38.4	-176.7	-26.8	34.5	0	0	0	113.4	E71	P67-E71 WeakPolarHBondContact O-CB 3.24Å; P67-E71 PolarHBondContact O-N 2.87Å
68	A	85.4	Confident	86.3	Confident	66 Å²	66	91.4 Å²	91.4	55%	0.545	47%	0.47	S	S	.	.	H	α-helix	trans	-70.8	-38.2	-178.7	0	0	0	0	0	111.8	D66 A72	D66-A68 PolarHBondContact O-N 3.4Å; D66-A68 PolarHBondContact OD1-N 3.36Å; A68-A72 WeakPolarHBondContact O-CB 3.4Å; A68-A72 PolarHBondContact O-N 2.99Å
69	K	82.3	Confident	85.8	Confident	147 Å²	147	96.2 Å²	96.2	64%	0.639	49%	0.49	S	S	*	.	H	α-helix	trans	-70.9	-39.2	176.2	-67.1	179.7	-171.9	167.1	0	111.8	D66 A72 K73	D66-K69 HydrophobicContact CB-CB 4.02Å; D66-K69 HydrophobicContact CB-CD 3.9Å; D66-K69 HydrophobicContact CB-CG 4Å; D66-K69 PolarHBondContact O-N 3.21Å; D66-K69 VanDerWaalsContact O-N 3.08Å; D66-K69 WeakPolarHBondContact OD2-CD 3.47Å; D66-K69 WeakPolarHBondContact OD2-CE 3.47Å; D66-K69 WeakPolarHBondContact OD2-CG 3.45Å; D66-K69 IonicContact OD2-NZ 2.88Å; K69-A72 PolarHBondContact O-N 3.39Å; K69-K73 WeakPolarHBondContact O-CB 3.49Å; K69-K73 PolarHBondContact O-N 3.31Å
70	E	82	Confident	85.3	Confident	79 Å²	79	98.1 Å²	98.1	37%	0.369	49%	0.487	S	S	.	.	H	α-helix	trans	-66.9	-41.9	176.4	-74.4	-58.3	134.2	0	0	111.6	P65 D66 K73 R74	P65-E70 HydrophobicContact CB-CG 4.35Å; D66-E70 PolarHBondContact O-N 2.88Å; E70-K73 PolarHBondContact O-N 2.79Å; E70-R74 WeakPolarHBondContact O-CG 3.41Å; E70-R74 PolarHBondContact O-N 2.95Å
71	E	82.6	Confident	84.7	Confident	103 Å²	103	102.7 Å²	102.7	48%	0.481	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-42.5	174.3	-167.1	-175.4	159	0	0	111.7	P67 K73 R74 K75	P67-E71 WeakPolarHBondContact O-CB 3.24Å; P67-E71 PolarHBondContact O-N 2.87Å; E71-K73 VanDerWaalsContact C-N 3.32Å; E71-K73 PolarHBondContact O-N 2.89Å; E71-R74 PolarHBondContact O-N 3.23Å; E71-K75 WeakPolarHBondContact O-CG 3.4Å; E71-K75 PolarHBondContact O-N 3.02Å; E71-K75 VanDerWaalsContact OE1-CE 3.24Å; E71-K75 WeakPolarHBondContact OE1-CE 3.19Å; E71-K75 IonicContact OE1-NZ 2.71Å; E71-K75 PolarHBondContact OE1-NZ 3.36Å
72	A	84.3	Confident	84.1	Confident	47 Å²	47	100.8 Å²	100.8	39%	0.388	51%	0.51	S	S	.	.	H	α-helix	trans	-63.5	-36.9	174.7	0	0	0	0	0	112.5	A68 K69 K76	A68-A72 WeakPolarHBondContact O-CB 3.4Å; A68-A72 PolarHBondContact O-N 2.99Å; K69-A72 PolarHBondContact O-N 3.39Å; A72-K76 WeakPolarHBondContact O-CB 3.45Å; A72-K76 WeakPolarHBondContact O-CG 3.47Å; A72-K76 PolarHBondContact O-N 3.01Å; A72-K76 VanDerWaalsContact O-N 3.07Å
73	K	82.1	Confident	83.3	Confident	141 Å²	141	108.6 Å²	108.6	61%	0.613	54%	0.543	S	S	*	.	H	α-helix	trans	-67.3	-41.6	175.9	-169.2	-178.8	178.2	-172.2	0	111.4	K69 E70 E71 K76 K77	K69-K73 WeakPolarHBondContact O-CB 3.49Å; K69-K73 PolarHBondContact O-N 3.31Å; E70-K73 PolarHBondContact O-N 2.79Å; E71-K73 VanDerWaalsContact C-N 3.32Å; E71-K73 PolarHBondContact O-N 2.89Å; K73-K76 PolarHBondContact O-N 3.33Å; K73-K77 PolarHBondContact O-N 3.28Å
74	R	83.1	Confident	82.3	Confident	171 Å²	171	112.2 Å²	112.2	65%	0.645	55%	0.554	S	S	*	*	H	α-helix	trans	-60.9	-51.4	174	-73.6	178	-176.9	-168.4	0	111.8	E70 E71 K76 K77 E78	E70-R74 WeakPolarHBondContact O-CG 3.41Å; E70-R74 PolarHBondContact O-N 2.95Å; E71-R74 PolarHBondContact O-N 3.23Å; R74-K76 VanDerWaalsContact C-N 3.28Å; R74-K76 PolarHBondContact O-N 2.71Å; R74-K77 WeakPolarHBondContact O-CB 3.48Å; R74-K77 PolarHBondContact O-N 3.34Å; R74-E78 WeakPolarHBondContact O-CG 3.44Å; R74-E78 PolarHBondContact O-N 3.28Å
75	K	85.6	Confident	80.8	Confident	107 Å²	107	108.6 Å²	108.6	47%	0.465	55%	0.551	S	S	.	*	H	α-helix	trans	-57.2	-40.4	177	-71.8	177.1	-176.3	167.7	0	112.3	E71 E79	E71-K75 WeakPolarHBondContact O-CG 3.4Å; E71-K75 PolarHBondContact O-N 3.02Å; E71-K75 VanDerWaalsContact OE1-CE 3.24Å; E71-K75 WeakPolarHBondContact OE1-CE 3.19Å; E71-K75 IonicContact OE1-NZ 2.71Å; E71-K75 PolarHBondContact OE1-NZ 3.36Å; K75-E79 WeakPolarHBondContact O-CB 3.24Å; K75-E79 WeakPolarHBondContact O-CG 3.25Å; K75-E79 PolarHBondContact O-N 2.9Å
76	K	83.9	Confident	79.4	Confident	143 Å²	143	116.9 Å²	116.9	62%	0.622	58%	0.583	S	S	*	*	H	α-helix	trans	-66.6	-34.8	174.6	-78.8	-179.5	179.5	179.6	0	113.6	A72 K73 R74 K80	A72-K76 WeakPolarHBondContact O-CB 3.45Å; A72-K76 WeakPolarHBondContact O-CG 3.47Å; A72-K76 PolarHBondContact O-N 3.01Å; A72-K76 VanDerWaalsContact O-N 3.07Å; K73-K76 PolarHBondContact O-N 3.33Å; R74-K76 VanDerWaalsContact C-N 3.28Å; R74-K76 PolarHBondContact O-N 2.71Å; K76-K80 WeakPolarHBondContact O-CG 3.42Å; K76-K80 PolarHBondContact O-N 2.79Å; K76-K80 VanDerWaalsContact O-N 3.17Å
77	K	82.7	Confident	77.6	Confident	97 Å²	97	122.9 Å²	122.9	42%	0.422	61%	0.606	S	S	.	*	H	α-helix	trans	-69	-47	176.2	-166.1	177.9	176	-179.5	0	109.8	K73 R74 E79 K80 E81 E95	K73-K77 PolarHBondContact O-N 3.28Å; R74-K77 WeakPolarHBondContact O-CB 3.48Å; R74-K77 PolarHBondContact O-N 3.34Å; K77-E79 PolarHBondContact O-N 3.49Å; K77-K80 PolarHBondContact O-N 3.29Å; K77-K80 VanDerWaalsContact O-N 3.14Å; K77-E81 VanDerWaalsContact CE-OE1 3.25Å; K77-E81 WeakPolarHBondContact CE-OE1 3.31Å; K77-E81 WeakPolarHBondContact O-CG 3.34Å; K77-E81 PolarHBondContact O-N 3.31Å; K77-E95 IonicContact NZ-OE1 2.71Å; K77-E95 PolarHBondContact NZ-OE1 3.49Å
78	E	84.9	Confident	75.7	Confident	125 Å²	125	124.3 Å²	124.3	58%	0.584	61%	0.608	S	S	*	*	H	α-helix	trans	-59.2	-43.3	175.5	-69.5	170.8	-175.9	0	0	112.4	R74 K80 E81 A82	R74-E78 WeakPolarHBondContact O-CG 3.44Å; R74-E78 PolarHBondContact O-N 3.28Å; E78-K80 VanDerWaalsContact C-N 3.35Å; E78-K80 PolarHBondContact O-N 3.38Å; E78-E81 PolarHBondContact O-N 3Å; E78-A82 VanDerWaalsContact O-CB 3.31Å; E78-A82 WeakPolarHBondContact O-CB 3.4Å; E78-A82 PolarHBondContact O-N 2.86Å
79	E	83.1	Confident	74	Confident	118 Å²	118	130.9 Å²	130.9	55%	0.551	62%	0.624	S	S	*	*	H	α-helix	trans	-65.1	-34.1	175.4	-80.6	-176.5	-175.3	0	0	113.5	K75 K77 K83	K75-E79 WeakPolarHBondContact O-CB 3.24Å; K75-E79 WeakPolarHBondContact O-CG 3.25Å; K75-E79 PolarHBondContact O-N 2.9Å; K77-E79 PolarHBondContact O-N 3.49Å; E79-K83 WeakPolarHBondContact O-CG 3.21Å; E79-K83 PolarHBondContact O-N 2.84Å
80	K	81.2	Confident	72.1	Confident	141 Å²	141	129.9 Å²	129.9	61%	0.613	63%	0.625	S	S	*	*	H	α-helix	trans	-71.3	-46.3	176.2	-80.8	-176.8	175.3	-168	0	111.3	K76 K77 E78 A82 K83 E84	K76-K80 WeakPolarHBondContact O-CG 3.42Å; K76-K80 PolarHBondContact O-N 2.79Å; K76-K80 VanDerWaalsContact O-N 3.17Å; K77-K80 PolarHBondContact O-N 3.29Å; K77-K80 VanDerWaalsContact O-N 3.14Å; E78-K80 VanDerWaalsContact C-N 3.35Å; E78-K80 PolarHBondContact O-N 3.38Å; K80-A82 VanDerWaalsContact C-N 3.27Å; K80-A82 PolarHBondContact O-N 3.44Å; K80-K83 PolarHBondContact O-N 3.28Å; K80-E84 PolarHBondContact O-N 2.86Å
81	E	81.1	Confident	70.5	Confident	117 Å²	117	129.6 Å²	129.6	55%	0.547	63%	0.632	S	S	.	*	H	α-helix	trans	-63.9	-31.8	177.2	-71	174.3	-173	0	0	112.2	K77 E78	K77-E81 VanDerWaalsContact CE-OE1 3.25Å; K77-E81 WeakPolarHBondContact CE-OE1 3.31Å; K77-E81 WeakPolarHBondContact O-CG 3.34Å; K77-E81 PolarHBondContact O-N 3.31Å; E78-E81 PolarHBondContact O-N 3Å
82	A	78.2	Confident	68.8	Low	85 Å²	85	131 Å²	131	70%	0.702	64%	0.643	S	S	*	*	H	α-helix	trans	-71.8	-27.4	173.1	0	0	0	0	0	113.4	E78 K80	E78-A82 VanDerWaalsContact O-CB 3.31Å; E78-A82 WeakPolarHBondContact O-CB 3.4Å; E78-A82 PolarHBondContact O-N 2.86Å; K80-A82 VanDerWaalsContact C-N 3.27Å; K80-A82 PolarHBondContact O-N 3.44Å
83	K	74.9	Confident	66.8	Low	170 Å²	170	136.3 Å²	136.3	74%	0.739	66%	0.657	S	S	*	*	H	α-helix	trans	-88.7	-33.8	179.2	-75.5	176.4	-176.5	172.5	0	113.2	E79 K80 G85	E79-K83 WeakPolarHBondContact O-CG 3.21Å; E79-K83 PolarHBondContact O-N 2.84Å; K80-K83 PolarHBondContact O-N 3.28Å; K83-G85 PolarHBondContact O-N 3.2Å
84	E	66.9	Low	64.9	Low	151 Å²	151	137 Å²	137	71%	0.706	66%	0.663	S	S	*	*	S	Bend	trans	-94.6	83	175.1	-70.2	178.2	176.8	0	0	109	K80 K86	K80-E84 PolarHBondContact O-N 2.86Å; E84-K86 PolarHBondContact O-N 3.32Å
85	G	56.1	Low	63.2	Low	63 Å²	63	134.6 Å²	134.6	65%	0.649	66%	0.659	S	S	*	*			trans	-49	114.7	-176.2	0	0	0	0	0	113.2	K83 K87	K83-G85 PolarHBondContact O-N 3.2Å; G85-K87 PolarHBondContact O-N 3.41Å
86	K	56	Low	61.4	Low	214 Å²	214	138 Å²	138	93%	0.93	68%	0.677	S	S	*	*			trans	18.4	70.2	162.7	-123.7	-177.2	-171.2	176.2	0	114.9	E84	E84-K86 PolarHBondContact O-N 3.32Å
87	K	48.3	Very low	59.7	Low	191 Å²	191	138 Å²	138	83%	0.83	68%	0.684	S	S	*	*			trans	-106.8	115.7	164.6	-104.9	-175.7	175.6	-177.3	0	110.2	G85	G85-K87 PolarHBondContact O-N 3.41Å
88	D	45.2	Very low	58.6	Low	134 Å²	134	137.6 Å²	137.6	72%	0.717	69%	0.693	S	S	*	*			trans	50.3	116.3	163.4	-59.4	-37.9	0	0	0	120.3	D90	D88-D90 PolarHBondContact O-N 2.88Å
89	K	50.2	Low	57.4	Low	205 Å²	205	134.3 Å²	134.3	89%	0.891	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	34.1	179.1	-114.1	-175.7	178.6	-171.2	0	113.5
90	D	42.4	Very low	56.5	Low	125 Å²	125	132.7 Å²	132.7	67%	0.668	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.5	1.2	-177.7	-133.8	2.2	0	0	0	113.2	D88	D88-D90 PolarHBondContact O-N 2.88Å
91	S	48	Very low	56.1	Low	73 Å²	73	130 Å²	130	51%	0.51	69%	0.689	S	S	.	*	G	3₁₀ helix	trans	-83.8	-8.6	-179.8	56.4	0	0	0	0	115.3	K93 E94	S91-K93 PolarHBondContact O-N 3.47Å; S91-E94 PolarHBondContact O-N 3.43Å; S91-E94 VanDerWaalsContact O-N 3.12Å
92	D	45.9	Very low	56.1	Low	134 Å²	134	125.5 Å²	125.5	72%	0.717	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-67.3	-15.8	177.5	-88	-20.4	0	0	0	112.8
93	K	42.8	Very low	56.5	Low	157 Å²	157	123.8 Å²	123.8	68%	0.683	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-84.1	-15.7	173.8	-77.5	-179.1	-179.6	168.8	0	114.1	S91	S91-K93 PolarHBondContact O-N 3.47Å
94	E	42.1	Very low	57.2	Low	155 Å²	155	121.9 Å²	121.9	72%	0.724	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-22.8	-178.9	-67.6	-173.3	168.1	0	0	112.7	S91 E96 D97	S91-E94 PolarHBondContact O-N 3.43Å; S91-E94 VanDerWaalsContact O-N 3.12Å; E94-E96 VanDerWaalsContact C-N 3.31Å; E94-E96 PolarHBondContact O-N 3.39Å; E94-D97 PolarHBondContact O-N 3Å
95	E	47.5	Very low	58.5	Low	121 Å²	121	116.6 Å²	116.6	57%	0.565	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-70.8	-25.2	173.3	-87.3	-168.9	175.5	0	0	112.6	K77 D97 S98	K77-E95 IonicContact NZ-OE1 2.71Å; K77-E95 PolarHBondContact NZ-OE1 3.49Å; E95-D97 VanDerWaalsContact C-N 3.29Å; E95-D97 PolarHBondContact O-N 3.42Å; E95-S98 PolarHBondContact O-OG 2.88Å
96	E	48	Very low	60.3	Low	179 Å²	179	117.8 Å²	117.8	84%	0.836	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-70.8	-20	175.7	-104.5	-170.6	163.1	0	0	113.8	E94	E94-E96 VanDerWaalsContact C-N 3.31Å; E94-E96 PolarHBondContact O-N 3.39Å
97	D	48.4	Very low	62.2	Low	144 Å²	144	110.4 Å²	110.4	77%	0.77	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-100.2	-3.9	-178.2	-162.2	35.5	0	0	0	113.4	E94 E95 G99	E94-D97 PolarHBondContact O-N 3Å; E95-D97 VanDerWaalsContact C-N 3.29Å; E95-D97 PolarHBondContact O-N 3.42Å; D97-G99 PolarHBondContact O-N 3.46Å
98	S	58.4	Low	64.5	Low	88 Å²	88	101.5 Å²	101.5	62%	0.615	58%	0.576	S	S	*	*	S	Bend	trans	-70.2	104	166.4	69.4	0	0	0	0	108.1	E95	E95-S98 PolarHBondContact O-OG 2.88Å
99	G	59.8	Low	66.9	Low	55 Å²	55	102.9 Å²	102.9	57%	0.567	58%	0.578	S	S	*	*			trans	-49	164	178	0	0	0	0	0	112.7	D97	D97-G99 PolarHBondContact O-N 3.46Å
100	P	65.6	Low	69	Low	85 Å²	85	97.6 Å²	97.6	55%	0.552	55%	0.553	S	S	*	*			trans	-52.2	146.5	-172	20.2	-31.3	0	0	0	111.8	C102	P100-C102 PolarHBondContact O-N 3.2Å
101	P	71.4	Confident	71.6	Confident	83 Å²	83	91.6 Å²	91.6	54%	0.539	52%	0.521	S	S	.	.	S	Bend	trans	-70.8	13.9	-174.2	31	-37.2	0	0	0	113.7	P63 S190	P63-P101 WeakPolarHBondContact CG-O 3.46Å; P101-S190 WeakPolarHBondContact CD-O 3.24Å; P101-S190 WeakPolarHBondContact CG-O 3.34Å
102	C	82.1	Confident	73.9	Confident	23 Å²	23	90 Å²	90	16%	0.155	51%	0.505	C	S	.	.	S	Bend	trans	-131.6	159.4	-176	66.2	0	0	0	0	111.3	I62 P100	I62-C102 HydrophobicContact CG1-CB 4.35Å; P100-C102 PolarHBondContact O-N 3.2Å
103	G	86.8	Confident	76.3	Confident	49 Å²	49	86 Å²	86	51%	0.505	49%	0.488	S	S	.	.			trans	-67.5	-179.2	168.9	0	0	0	0	0	112.6	I105	G103-I105 PolarHBondContact O-N 2.85Å
104	P	90.1	Very high	78.9	Confident	130 Å²	130	78.5 Å²	78.5	84%	0.844	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-60.9	130.8	176.4	26.4	-33.8	0	0	0	110.9
105	I	93.5	Very high	81.6	Confident	41 Å²	41	71.1 Å²	71.1	21%	0.21	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-100.6	116.5	174.6	-56.4	-58.5	0	0	0	108.6	L60 I62 G103 V186	L60-I105 HydrophobicContact CD1-CD1 4.35Å; L60-I105 HydrophobicContact CD1-CG1 4.45Å; L60-I105 HydrophobicContact CD1-CG2 3.64Å; I62-I105 HydrophobicContact CG1-CD1 4.06Å; I62-I105 HydrophobicContact CG1-CG1 4.43Å; G103-I105 PolarHBondContact O-N 2.85Å; I105-V186 HydrophobicContact CB-CG1 3.89Å; I105-V186 HydrophobicContact CG1-CG1 4.06Å; I105-V186 HydrophobicContact CG2-CG1 3.89Å; I105-V186 HydrophobicContact CG2-CG2 4.22Å
106	C	94.1	Very high	83.9	Confident	87 Å²	87	70.4 Å²	70.4	59%	0.588	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-75.9	162.9	-177.8	-62.4	0	0	0	0	113.1	R182	C106-R182 PolarHBondContact O-NH1 2.87Å; C106-R182 PolarHBondContact O-NH2 2.95Å
107	S	95.9	Very high	86.3	Confident	60 Å²	60	65 Å²	65	42%	0.42	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-65.5	158.4	166	-63.4	0	0	0	0	111.1	E109	S107-E109 PolarHBondContact O-N 3.1Å; S107-E109 VanDerWaalsContact O-N 3.16Å
108	N	97.3	Very high	88.6	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.021	36%	0.359	C	S	.	.			trans	-73.3	105.7	174.4	-174.1	-52.2	0	0	0	110.3	L56 A58 R110 V111 E112 D206	L56-N108 PolarHBondContact O-ND2 3.49Å; A58-N108 HydrophobicContact CB-CB 4.15Å; N108-R110 PolarHBondContact O-N 2.83Å; N108-R110 PolarHBondContact OD1-N 3.47Å; N108-R110 VanDerWaalsContact OD1-N 3.12Å; N108-V111 HydrophobicContact CB-CB 4.08Å; N108-V111 HydrophobicContact CB-CG2 4.09Å; N108-V111 PolarHBondContact O-N 3.3Å; N108-V111 VanDerWaalsContact O-N 3.13Å; N108-V111 PolarHBondContact OD1-N 3.25Å; N108-V111 VanDerWaalsContact OD1-N 3.1Å; N108-E112 WeakPolarHBondContact O-CG 3.17Å; N108-E112 PolarHBondContact O-N 3.4Å; N108-D206 VanDerWaalsContact ND2-CG 3.26Å; N108-D206 PolarHBondContact ND2-OD2 3.43Å
109	E	95.5	Very high	90.5	Very high	163 Å²	163	57.5 Å²	57.5	76%	0.762	35%	0.345	S	S	*	.	H	α-helix	trans	-57.1	-35.9	-174.8	-63.6	-176.5	170.1	0	0	113.6	S107 E112 S113	S107-E109 PolarHBondContact O-N 3.1Å; S107-E109 VanDerWaalsContact O-N 3.16Å; E109-E112 PolarHBondContact O-N 2.68Å; E109-S113 WeakPolarHBondContact O-CB 3.43Å; E109-S113 PolarHBondContact O-N 3.22Å
110	R	93.9	Very high	92.3	Very high	93 Å²	93	58 Å²	58	35%	0.351	34%	0.338	S	S	.	.	H	α-helix	trans	-69.3	-43.1	179.7	-173.6	56.6	173.6	163.4	2.1	111.1	S47 L56 N108 L114	S47-R110 PolarHBondContact O-NH2 2.91Å; L56-R110 HydrophobicContact CD2-CB 4.23Å; L56-R110 HydrophobicContact CD2-CG 3.6Å; N108-R110 PolarHBondContact O-N 2.83Å; N108-R110 PolarHBondContact OD1-N 3.47Å; N108-R110 VanDerWaalsContact OD1-N 3.12Å; R110-L114 WeakPolarHBondContact O-CG 3.47Å; R110-L114 PolarHBondContact O-N 3.49Å
111	V	96.4	Very high	93.9	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66	-41	174.3	177.6	0	0	0	0	110.8	N108 S113 L114 L115 Y178 Q209 L213	N108-V111 HydrophobicContact CB-CB 4.08Å; N108-V111 HydrophobicContact CB-CG2 4.09Å; N108-V111 PolarHBondContact O-N 3.3Å; N108-V111 VanDerWaalsContact O-N 3.13Å; N108-V111 PolarHBondContact OD1-N 3.25Å; N108-V111 VanDerWaalsContact OD1-N 3.1Å; V111-S113 PolarHBondContact O-N 3.45Å; V111-L114 PolarHBondContact O-N 2.85Å; V111-L115 HydrophobicContact CG1-CD1 3.9Å; V111-L115 HydrophobicContact CG1-CG 4.28Å; V111-L115 WeakPolarHBondContact O-CB 3.26Å; V111-L115 WeakPolarHBondContact O-CG 3.45Å; V111-L115 PolarHBondContact O-N 3.07Å; V111-Y178 HydrophobicContact CG1-CE1 3.72Å; V111-Q209 HydrophobicContact CG1-CB 4.21Å; V111-Q209 HydrophobicContact CG1-CG 3.56Å; V111-L213 HydrophobicContact CG1-CD1 4.19Å
112	E	97.3	Very high	95.1	Very high	39 Å²	39	51.8 Å²	51.8	18%	0.182	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-44.4	176	-72.8	-53.8	129.4	0	0	112.4	N108 E109 L114 L115 N116 Y179	N108-E112 WeakPolarHBondContact O-CG 3.17Å; N108-E112 PolarHBondContact O-N 3.4Å; E109-E112 PolarHBondContact O-N 2.68Å; E112-L114 VanDerWaalsContact C-N 3.31Å; E112-L114 PolarHBondContact O-N 3.41Å; E112-L115 WeakPolarHBondContact O-CB 3.37Å; E112-L115 PolarHBondContact O-N 3.1Å; E112-N116 VanDerWaalsContact O-CG 3.29Å; E112-N116 PolarHBondContact O-N 3.04Å; E112-N116 PolarHBondContact O-ND2 2.89Å; E112-Y179 VanDerWaalsContact CD-OH 3.27Å; E112-Y179 WeakPolarHBondContact OE1-CE1 3.47Å; E112-Y179 PolarHBondContact OE1-OH 3.46Å; E112-Y179 PolarHBondContact OE2-OH 2.84Å
113	S	96	Very high	95.9	Very high	50 Å²	50	54.3 Å²	54.3	35%	0.35	30%	0.304	S	S	.	.	H	α-helix	trans	-56.7	-46.5	175.8	-174.2	0	0	0	0	111.4	E109 V111 N116 E117	E109-S113 WeakPolarHBondContact O-CB 3.43Å; E109-S113 PolarHBondContact O-N 3.22Å; V111-S113 PolarHBondContact O-N 3.45Å; S113-N116 PolarHBondContact O-N 2.97Å; S113-E117 PolarHBondContact O-N 3.34Å
114	L	97.1	Very high	96.4	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.1	-39.2	178.4	-65.8	170	0	0	0	111.8	F48 R110 V111 E112 N116 E117 V118 Y210 L213	F48-L114 HydrophobicContact CD1-CD1 4.44Å; F48-L114 HydrophobicContact CD1-CD2 4.43Å; F48-L114 HydrophobicContact CD2-CD2 4.48Å; F48-L114 HydrophobicContact CE1-CD1 4Å; F48-L114 HydrophobicContact CE1-CD2 4.06Å; F48-L114 HydrophobicContact CE1-CG 4.49Å; F48-L114 HydrophobicContact CE2-CD2 4.1Å; F48-L114 HydrophobicContact CZ-CD2 3.9Å; R110-L114 WeakPolarHBondContact O-CG 3.47Å; R110-L114 PolarHBondContact O-N 3.49Å; V111-L114 PolarHBondContact O-N 2.85Å; E112-L114 VanDerWaalsContact C-N 3.31Å; E112-L114 PolarHBondContact O-N 3.41Å; L114-N116 VanDerWaalsContact C-N 3.25Å; L114-N116 PolarHBondContact O-N 2.97Å; L114-E117 PolarHBondContact O-N 2.99Å; L114-E117 VanDerWaalsContact O-N 3.12Å; L114-V118 WeakPolarHBondContact O-CB 3.4Å; L114-V118 VanDerWaalsContact O-CG2 3.27Å; L114-V118 WeakPolarHBondContact O-CG2 3.35Å; L114-V118 PolarHBondContact O-N 2.97Å; L114-Y210 HydrophobicContact CD1-CD2 3.36Å; L114-Y210 HydrophobicContact CD1-CE2 3.58Å; L114-L213 HydrophobicContact CB-CD1 3.94Å
115	L	97.6	Very high	96.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-59.5	-38.4	174.8	-77.4	168.7	0	0	0	111.7	V111 E112 E117 V118 K119 I175 Y178 Y179 L213	V111-L115 HydrophobicContact CG1-CD1 3.9Å; V111-L115 HydrophobicContact CG1-CG 4.28Å; V111-L115 WeakPolarHBondContact O-CB 3.26Å; V111-L115 WeakPolarHBondContact O-CG 3.45Å; V111-L115 PolarHBondContact O-N 3.07Å; E112-L115 WeakPolarHBondContact O-CB 3.37Å; E112-L115 PolarHBondContact O-N 3.1Å; L115-E117 VanDerWaalsContact C-N 3.28Å; L115-E117 PolarHBondContact O-N 3.42Å; L115-V118 PolarHBondContact O-N 3.47Å; L115-K119 VanDerWaalsContact O-CB 3.3Å; L115-K119 WeakPolarHBondContact O-CB 3.45Å; L115-K119 WeakPolarHBondContact O-CD 3.34Å; L115-K119 WeakPolarHBondContact O-CG 3.32Å; L115-K119 PolarHBondContact O-N 3.5Å; L115-I175 HydrophobicContact CD2-CB 4.41Å; L115-I175 HydrophobicContact CD2-CD1 4.06Å; L115-I175 HydrophobicContact CD2-CG1 3.85Å; L115-I175 HydrophobicContact CD2-CG2 3.81Å; L115-Y178 HydrophobicContact CD1-CD1 4.29Å; L115-Y178 HydrophobicContact CD1-CE1 4.2Å; L115-Y179 HydrophobicContact CD1-CE2 4.2Å; L115-Y179 WeakPolarHBondContact CD1-OH 3.27Å; L115-L213 HydrophobicContact CD2-CD1 3.93Å; L115-L213 HydrophobicContact CD2-CD2 3.63Å; L115-L213 HydrophobicContact CD2-CG 4.37Å; L115-L213 HydrophobicContact CG-CD1 3.87Å; L115-L213 HydrophobicContact CG-CD2 4.44Å
116	N	97.4	Very high	96.9	Very high	106 Å²	106	48 Å²	48	57%	0.567	25%	0.251	S	S	*	.	H	α-helix	trans	-67.1	-28.8	176.8	-68.7	-27.5	0	0	0	112.9	E112 S113 L114 P120	E112-N116 VanDerWaalsContact O-CG 3.29Å; E112-N116 PolarHBondContact O-N 3.04Å; E112-N116 PolarHBondContact O-ND2 2.89Å; S113-N116 PolarHBondContact O-N 2.97Å; L114-N116 VanDerWaalsContact C-N 3.25Å; L114-N116 PolarHBondContact O-N 2.97Å; N116-P120 WeakPolarHBondContact O-CD 3.5Å; N116-P120 WeakPolarHBondContact O-CG 3.47Å
117	E	97.1	Very high	97	Very high	65 Å²	65	48.4 Å²	48.4	30%	0.304	24%	0.244	S	C	.	.	H	α-helix	trans	-81.2	-38.3	173.6	-68	176	-105.2	0	0	112.2	L43 S47 S113 L114 L115 P120	L43-E117 HydrophobicContact CD1-CB 4.24Å; L43-E117 WeakPolarHBondContact CD1-OE2 3.4Å; S47-E117 PolarHBondContact OG-OE2 3.49Å; S113-E117 PolarHBondContact O-N 3.34Å; L114-E117 PolarHBondContact O-N 2.99Å; L114-E117 VanDerWaalsContact O-N 3.12Å; L115-E117 VanDerWaalsContact C-N 3.28Å; L115-E117 PolarHBondContact O-N 3.42Å; E117-P120 WeakPolarHBondContact O-CD 3.48Å
118	V	98	Very high	97.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-82.9	-38	-172.9	176.5	0	0	0	0	113.1	F48 L114 L115 E121 I122 L213 V216 V217	F48-V118 HydrophobicContact CE2-CG2 4.45Å; F48-V118 HydrophobicContact CZ-CG2 4.03Å; L114-V118 WeakPolarHBondContact O-CB 3.4Å; L114-V118 VanDerWaalsContact O-CG2 3.27Å; L114-V118 WeakPolarHBondContact O-CG2 3.35Å; L114-V118 PolarHBondContact O-N 2.97Å; L115-V118 PolarHBondContact O-N 3.47Å; V118-E121 PolarHBondContact O-N 3.06Å; V118-E121 VanDerWaalsContact O-N 3.11Å; V118-I122 HydrophobicContact CG1-CD1 4Å; V118-I122 HydrophobicContact CG1-CG1 4.23Å; V118-I122 PolarHBondContact O-N 3.26Å; V118-I122 VanDerWaalsContact O-N 3.1Å; V118-L213 HydrophobicContact CB-CD2 4.21Å; V118-L213 HydrophobicContact CG1-CD2 4.04Å; V118-L213 HydrophobicContact CG2-CD2 4.41Å; V118-V216 HydrophobicContact CG1-CB 4.47Å; V118-V216 HydrophobicContact CG1-CG1 3.78Å; V118-V217 HydrophobicContact CB-CG2 4.5Å; V118-V217 HydrophobicContact CG1-CG2 4.28Å; V118-V217 HydrophobicContact CG2-CG2 3.51Å
119	K	97.9	Very high	97.1	Very high	74 Å²	74	47.7 Å²	47.7	32%	0.322	23%	0.233	S	C	.	.	H	α-helix	trans	-55	-46	-179.6	-75.6	167.5	-177.2	165.4	0	112.6	L115 E121 I122 Q123 I175 Y179	L115-K119 VanDerWaalsContact O-CB 3.3Å; L115-K119 WeakPolarHBondContact O-CB 3.45Å; L115-K119 WeakPolarHBondContact O-CD 3.34Å; L115-K119 WeakPolarHBondContact O-CG 3.32Å; L115-K119 PolarHBondContact O-N 3.5Å; K119-E121 VanDerWaalsContact C-N 3.32Å; K119-E121 PolarHBondContact O-N 3.3Å; K119-I122 PolarHBondContact O-N 3Å; K119-Q123 PolarHBondContact O-N 3.47Å; K119-Q123 VanDerWaalsContact O-N 3.15Å; K119-I175 HydrophobicContact CG-CD1 3.82Å; K119-Y179 PolarHBondContact NZ-OH 3.26Å
120	P	98	Very high	97.1	Very high	66 Å²	66	43.6 Å²	43.6	43%	0.429	22%	0.217	S	C	.	.	H	α-helix	trans	-62.3	-35.6	176.4	-24.2	35.4	0	0	0	113.8	N116 E117 Q123 T124	N116-P120 WeakPolarHBondContact O-CD 3.5Å; N116-P120 WeakPolarHBondContact O-CG 3.47Å; E117-P120 WeakPolarHBondContact O-CD 3.48Å; P120-Q123 PolarHBondContact O-N 3.32Å; P120-T124 VanDerWaalsContact O-CB 3.29Å; P120-T124 WeakPolarHBondContact O-CB 3.37Å; P120-T124 PolarHBondContact O-N 2.71Å; P120-T124 PolarHBondContact O-OG1 3.39Å
121	E	98.1	Very high	97.3	Very high	32 Å²	32	40.1 Å²	40.1	15%	0.15	21%	0.206	C	C	.	.	H	α-helix	trans	-69.5	-38.7	179.5	-64.6	-58.6	151.3	0	0	111.9	K36 L40 V118 K119 T124 L125 I220	K36-E121 VanDerWaalsContact NZ-CD 3.28Å; K36-E121 IonicContact NZ-OE1 3.32Å; K36-E121 PolarHBondContact NZ-OE1 3.38Å; K36-E121 IonicContact NZ-OE2 3.01Å; K36-E121 PolarHBondContact NZ-OE2 3.35Å; L40-E121 HydrophobicContact CD2-CB 4.28Å; L40-E121 HydrophobicContact CD2-CG 3.89Å; V118-E121 PolarHBondContact O-N 3.06Å; V118-E121 VanDerWaalsContact O-N 3.11Å; K119-E121 VanDerWaalsContact C-N 3.32Å; K119-E121 PolarHBondContact O-N 3.3Å; E121-T124 PolarHBondContact O-N 2.81Å; E121-L125 WeakPolarHBondContact O-CB 3.5Å; E121-L125 PolarHBondContact O-N 3.3Å; E121-I220 HydrophobicContact CB-CD1 4.15Å
122	I	97.8	Very high	97.4	Very high	6 Å²	6	40.1 Å²	40.1	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-58.8	-50.4	171.5	-65.2	170.3	0	0	0	110.2	V118 K119 L125 K126 I168 F171 I175 V216 I220	V118-I122 HydrophobicContact CG1-CD1 4Å; V118-I122 HydrophobicContact CG1-CG1 4.23Å; V118-I122 PolarHBondContact O-N 3.26Å; V118-I122 VanDerWaalsContact O-N 3.1Å; K119-I122 PolarHBondContact O-N 3Å; I122-L125 PolarHBondContact O-N 3.39Å; I122-K126 WeakPolarHBondContact O-CB 3.47Å; I122-K126 PolarHBondContact O-N 3.24Å; I122-I168 HydrophobicContact CG2-CG2 3.8Å; I122-F171 HydrophobicContact CD1-CB 3.97Å; I122-F171 HydrophobicContact CG1-CB 4.47Å; I122-I175 HydrophobicContact CD1-CD1 3.71Å; I122-V216 HydrophobicContact CD1-CG1 4.04Å; I122-V216 HydrophobicContact CG1-CG1 4.06Å; I122-I220 HydrophobicContact CG1-CD1 3.83Å
123	Q	97.6	Very high	97.4	Very high	75 Å²	75	39 Å²	39	35%	0.35	20%	0.202	S	C	.	.	H	α-helix	trans	-63.5	-44.2	-178.2	-178.8	58.9	28.3	0	0	111.5	K119 P120 L125 K126 E127	K119-Q123 PolarHBondContact O-N 3.47Å; K119-Q123 VanDerWaalsContact O-N 3.15Å; P120-Q123 PolarHBondContact O-N 3.32Å; Q123-L125 PolarHBondContact O-N 3.06Å; Q123-K126 WeakPolarHBondContact O-CB 3.33Å; Q123-K126 PolarHBondContact O-N 3.06Å; Q123-E127 PolarHBondContact NE2-OE1 3.27Å; Q123-E127 PolarHBondContact O-N 2.98Å
124	T	97.9	Very high	97.4	Very high	34 Å²	34	39.6 Å²	39.6	21%	0.209	20%	0.2	C	C	.	.	H	α-helix	trans	-60.3	-48.4	178.2	-61.3	0	0	0	0	110.9	F32 P120 E121 K126 E127 K128	F32-T124 HydrophobicContact CE1-CG2 4.17Å; F32-T124 HydrophobicContact CZ-CG2 3.65Å; P120-T124 VanDerWaalsContact O-CB 3.29Å; P120-T124 WeakPolarHBondContact O-CB 3.37Å; P120-T124 PolarHBondContact O-N 2.71Å; P120-T124 PolarHBondContact O-OG1 3.39Å; E121-T124 PolarHBondContact O-N 2.81Å; T124-K126 VanDerWaalsContact C-N 3.3Å; T124-K126 PolarHBondContact O-N 2.9Å; T124-E127 PolarHBondContact O-N 2.98Å; T124-K128 HydrophobicContact CG2-CG 4.37Å; T124-K128 WeakPolarHBondContact O-CG 3.44Å; T124-K128 PolarHBondContact O-N 2.92Å
125	L	97.5	Very high	97.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.9	-42.1	177.3	176.7	61.8	0	0	0	111.2	E121 I122 Q123 E127 K128 L129 I168 I220 T223 Y224	E121-L125 WeakPolarHBondContact O-CB 3.5Å; E121-L125 PolarHBondContact O-N 3.3Å; I122-L125 PolarHBondContact O-N 3.39Å; Q123-L125 PolarHBondContact O-N 3.06Å; L125-E127 PolarHBondContact O-N 3.33Å; L125-K128 PolarHBondContact O-N 3.34Å; L125-L129 WeakPolarHBondContact O-CB 3.32Å; L125-L129 PolarHBondContact O-N 3.1Å; L125-I168 HydrophobicContact CD2-CD1 3.52Å; L125-I168 HydrophobicContact CD2-CG1 3.79Å; L125-I168 HydrophobicContact CG-CD1 3.59Å; L125-I168 HydrophobicContact CG-CG1 4.33Å; L125-I220 HydrophobicContact CB-CG2 4.37Å; L125-I220 HydrophobicContact CD2-CB 4.18Å; L125-I220 HydrophobicContact CD2-CG1 3.98Å; L125-I220 HydrophobicContact CD2-CG2 3.92Å; L125-T223 HydrophobicContact CD1-CG2 4.05Å; L125-T223 HydrophobicContact CD2-CG2 4.03Å; L125-Y224 WeakPolarHBondContact CA-OH 3.37Å; L125-Y224 HydrophobicContact CB-CE2 4.43Å; L125-Y224 HydrophobicContact CD1-CD1 4.1Å; L125-Y224 HydrophobicContact CD1-CD2 4.44Å; L125-Y224 HydrophobicContact CD1-CE1 3.63Å; L125-Y224 HydrophobicContact CD1-CE2 4.01Å; L125-Y224 HydrophobicContact CD1-CG 4.49Å
126	K	96.1	Very high	97.4	Very high	55 Å²	55	39.6 Å²	39.6	24%	0.239	20%	0.2	C	C	.	.	H	α-helix	trans	-58.7	-45.8	178	-170.1	177	-175.3	175.3	0	112.2	I122 Q123 T124 N130 I168	I122-K126 WeakPolarHBondContact O-CB 3.47Å; I122-K126 PolarHBondContact O-N 3.24Å; Q123-K126 WeakPolarHBondContact O-CB 3.33Å; Q123-K126 PolarHBondContact O-N 3.06Å; T124-K126 VanDerWaalsContact C-N 3.3Å; T124-K126 PolarHBondContact O-N 2.9Å; K126-N130 PolarHBondContact O-N 3.27Å; K126-N130 VanDerWaalsContact O-N 3.07Å; K126-I168 HydrophobicContact CB-CG2 4.2Å
127	E	97.1	Very high	97.4	Very high	95 Å²	95	39 Å²	39	44%	0.444	19%	0.194	S	C	.	.	H	α-helix	trans	-65.5	-47.1	177.8	-71.6	174.2	-165.2	0	0	111.9	Q123 T124 L125 L129 N130 T131	Q123-E127 PolarHBondContact NE2-OE1 3.27Å; Q123-E127 PolarHBondContact O-N 2.98Å; T124-E127 PolarHBondContact O-N 2.98Å; L125-E127 PolarHBondContact O-N 3.33Å; E127-L129 VanDerWaalsContact C-N 3.33Å; E127-L129 PolarHBondContact O-N 3.24Å; E127-N130 WeakPolarHBondContact O-CB 3.36Å; E127-N130 PolarHBondContact O-N 3.4Å; E127-N130 VanDerWaalsContact O-N 3.14Å; E127-T131 PolarHBondContact O-N 3.46Å; E127-T131 PolarHBondContact O-OG1 3.19Å
128	K	97.6	Very high	97.3	Very high	45 Å²	45	39.5 Å²	39.5	20%	0.196	20%	0.199	C	C	.	.	H	α-helix	trans	-67.2	-37.3	-178.5	-62.3	-30.3	-176	-175.5	0	112	L28 F32 F33 T124 L125 N130 T131 V132	L28-K128 HydrophobicContact CD1-CB 4.18Å; L28-K128 HydrophobicContact CD1-CD 4.03Å; L28-K128 HydrophobicContact CD1-CG 4.41Å; L28-K128 HydrophobicContact CD2-CB 4.49Å; L28-K128 HydrophobicContact CD2-CD 3.67Å; L28-K128 HydrophobicContact CD2-CG 3.96Å; F32-K128 HydrophobicContact CD1-CG 4.18Å; F32-K128 HydrophobicContact CE1-CG 3.62Å; F32-K128 HydrophobicContact CZ-CG 4.19Å; F33-K128 HydrophobicContact CE1-CB 4.35Å; T124-K128 HydrophobicContact CG2-CG 4.37Å; T124-K128 WeakPolarHBondContact O-CG 3.44Å; T124-K128 PolarHBondContact O-N 2.92Å; L125-K128 PolarHBondContact O-N 3.34Å; K128-N130 VanDerWaalsContact C-N 3.32Å; K128-N130 PolarHBondContact O-N 3.23Å; K128-T131 PolarHBondContact O-N 2.98Å; K128-V132 WeakPolarHBondContact O-CG2 3.45Å; K128-V132 PolarHBondContact O-N 3.04Å
129	L	96.7	Very high	97.1	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-61.3	-42.3	172.6	-171.1	70.9	0	0	0	111.1	L125 E127 T131 V132 S133 L161 T164 R165 I168 L227	L125-L129 WeakPolarHBondContact O-CB 3.32Å; L125-L129 PolarHBondContact O-N 3.1Å; E127-L129 VanDerWaalsContact C-N 3.33Å; E127-L129 PolarHBondContact O-N 3.24Å; L129-T131 PolarHBondContact O-N 3.27Å; L129-V132 PolarHBondContact O-N 2.94Å; L129-S133 WeakPolarHBondContact O-CB 3.41Å; L129-S133 PolarHBondContact O-N 3.45Å; L129-S133 PolarHBondContact O-OG 3.43Å; L129-L161 HydrophobicContact CD1-CB 4.4Å; L129-L161 HydrophobicContact CD1-CD2 3.38Å; L129-L161 HydrophobicContact CG-CD2 4.49Å; L129-T164 HydrophobicContact CD1-CG2 4.22Å; L129-T164 HydrophobicContact CD2-CG2 3.86Å; L129-R165 HydrophobicContact CD2-CB 3.74Å; L129-I168 HydrophobicContact CD2-CD1 3.62Å; L129-L227 HydrophobicContact CD1-CD1 3.55Å
130	N	96.9	Very high	97	Very high	78 Å²	78	41.2 Å²	41.2	42%	0.417	21%	0.209	S	C	.	.	H	α-helix	trans	-61.9	-42.8	176.7	-173.5	76.1	0	0	0	112.3	K126 E127 K128 S133 M134	K126-N130 PolarHBondContact O-N 3.27Å; K126-N130 VanDerWaalsContact O-N 3.07Å; E127-N130 WeakPolarHBondContact O-CB 3.36Å; E127-N130 PolarHBondContact O-N 3.4Å; E127-N130 VanDerWaalsContact O-N 3.14Å; K128-N130 VanDerWaalsContact C-N 3.32Å; K128-N130 PolarHBondContact O-N 3.23Å; N130-S133 PolarHBondContact O-N 3.45Å; N130-M134 WeakPolarHBondContact O-CB 3.38Å; N130-M134 PolarHBondContact O-N 3.15Å
131	T	97.8	Very high	96.9	Very high	19 Å²	19	39.8 Å²	39.8	12%	0.117	20%	0.2	C	C	.	.	H	α-helix	trans	-58	-50.1	174.4	-59.2	0	0	0	0	111.4	L21 E24 L28 E127 K128 L129 M134 W135	L21-T131 HydrophobicContact CD1-CG2 3.71Å; E24-T131 HydrophobicContact CB-CG2 4.4Å; E24-T131 HydrophobicContact CG-CG2 4.02Å; L28-T131 HydrophobicContact CD1-CG2 3.83Å; E127-T131 PolarHBondContact O-N 3.46Å; E127-T131 PolarHBondContact O-OG1 3.19Å; K128-T131 PolarHBondContact O-N 2.98Å; L129-T131 PolarHBondContact O-N 3.27Å; T131-M134 PolarHBondContact O-N 2.72Å; T131-W135 WeakPolarHBondContact O-CB 3.3Å; T131-W135 PolarHBondContact O-N 3.17Å
132	V	97.6	Very high	96.7	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.5	-41.3	-179.3	174.8	0	0	0	0	111.8	L28 F33 K128 L129 M134 W135 V136 L161 I231	L28-V132 HydrophobicContact CD1-CG2 4.26Å; F33-V132 HydrophobicContact CZ-CG2 4.12Å; K128-V132 WeakPolarHBondContact O-CG2 3.45Å; K128-V132 PolarHBondContact O-N 3.04Å; L129-V132 PolarHBondContact O-N 2.94Å; V132-M134 PolarHBondContact O-N 3.01Å; V132-W135 HydrophobicContact CG1-CE3 4.31Å; V132-W135 WeakPolarHBondContact O-CB 3.47Å; V132-W135 PolarHBondContact O-N 3.38Å; V132-V136 WeakPolarHBondContact O-CG2 3.38Å; V132-V136 PolarHBondContact O-N 3.39Å; V132-L161 HydrophobicContact CG1-CD1 4.2Å; V132-L161 HydrophobicContact CG1-CD2 4.01Å; V132-I231 HydrophobicContact CG1-CD1 3.57Å
133	S	96.9	Very high	96.5	Very high	15 Å²	15	55.3 Å²	55.3	11%	0.105	27%	0.267	C	S	.	.	H	α-helix	trans	-59.6	-46.2	175.6	-66.5	0	0	0	0	112.2	L129 N130 W135 V136 Q137 L161	L129-S133 WeakPolarHBondContact O-CB 3.41Å; L129-S133 PolarHBondContact O-N 3.45Å; L129-S133 PolarHBondContact O-OG 3.43Å; N130-S133 PolarHBondContact O-N 3.45Å; S133-W135 VanDerWaalsContact C-N 3.32Å; S133-W135 PolarHBondContact O-N 3.04Å; S133-V136 PolarHBondContact O-N 3.49Å; S133-Q137 WeakPolarHBondContact O-CB 3.35Å; S133-Q137 PolarHBondContact O-N 3.03Å; S133-L161 WeakPolarHBondContact OG-CB 3.3Å
134	M	97.6	Very high	96.3	Very high	64 Å²	64	56 Å²	56	32%	0.315	27%	0.271	S	S	.	.	H	α-helix	trans	-64	-41	177.2	-173.4	57.5	60.3	0	0	111	L21 N130 T131 V132 Q137 L138	L21-M134 HydrophobicContact CD2-CB 3.98Å; L21-M134 HydrophobicContact CD2-CG 3.62Å; N130-M134 WeakPolarHBondContact O-CB 3.38Å; N130-M134 PolarHBondContact O-N 3.15Å; T131-M134 PolarHBondContact O-N 2.72Å; V132-M134 PolarHBondContact O-N 3.01Å; M134-Q137 PolarHBondContact O-N 3.42Å; M134-L138 HydrophobicContact CG-CD1 4.05Å; M134-L138 HydrophobicContact CG-CG 4.47Å; M134-L138 WeakPolarHBondContact O-CG 3.27Å; M134-L138 PolarHBondContact O-N 3.45Å; M134-L138 HydrophobicContact SD-CD1 4.23Å; M134-L138 HydrophobicContact SD-CG 4.19Å
135	W	97.7	Very high	95.9	Very high	0 Å²	0	63 Å²	63	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58.9	-49.8	176.5	168.7	63.3	0	0	0	111.9	L21 A25 L29 T131 V132 S133 Q137 L138 Q139 I231 Y235 I238 K239	L21-W135 HydrophobicContact CD2-CB 4.18Å; L21-W135 HydrophobicContact CG-CB 4.25Å; A25-W135 HydrophobicContact CB-CB 3.7Å; A25-W135 HydrophobicContact CB-CD2 3.62Å; A25-W135 HydrophobicContact CB-CE3 3.92Å; A25-W135 HydrophobicContact CB-CG 3.52Å; L29-W135 HydrophobicContact CD1-CH2 4.03Å; L29-W135 HydrophobicContact CD1-CZ3 3.75Å; T131-W135 WeakPolarHBondContact O-CB 3.3Å; T131-W135 PolarHBondContact O-N 3.17Å; V132-W135 HydrophobicContact CG1-CE3 4.31Å; V132-W135 WeakPolarHBondContact O-CB 3.47Å; V132-W135 PolarHBondContact O-N 3.38Å; S133-W135 VanDerWaalsContact C-N 3.32Å; S133-W135 PolarHBondContact O-N 3.04Å; W135-Q137 PolarHBondContact O-N 3.42Å; W135-L138 PolarHBondContact O-N 2.71Å; W135-Q139 WeakPolarHBondContact O-CG 3.4Å; W135-Q139 PolarHBondContact O-N 3.25Å; W135-Q139 PolarHBondContact O-NE2 3.46Å; W135-I231 HydrophobicContact CH2-CG2 4.24Å; W135-I231 HydrophobicContact CZ3-CG2 3.96Å; W135-Y235 HydrophobicContact CH2-CD2 4.14Å; W135-Y235 AromaticContact CH2-CE2 3.85Å; W135-Y235 HydrophobicContact CH2-CE2 3.85Å; W135-Y235 HydrophobicContact CZ2-CE2 4.03Å; W135-I238 HydrophobicContact CH2-CG2 3.94Å; W135-I238 HydrophobicContact CZ2-CG2 4.36Å; W135-I238 HydrophobicContact CZ3-CG2 4.19Å; W135-K239 HydrophobicContact CZ2-CG 4.44Å
136	V	96.8	Very high	95.6	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.5	-44.1	176.9	173.1	0	0	0	0	111.1	V132 S133 L138 Q139 F158 L161 I238	V132-V136 WeakPolarHBondContact O-CG2 3.38Å; V132-V136 PolarHBondContact O-N 3.39Å; S133-V136 PolarHBondContact O-N 3.49Å; V136-L138 VanDerWaalsContact C-N 3.31Å; V136-L138 PolarHBondContact O-N 2.94Å; V136-Q139 WeakPolarHBondContact O-CB 3.46Å; V136-Q139 PolarHBondContact O-N 3.48Å; V136-F158 HydrophobicContact CG1-CB 4.28Å; V136-F158 HydrophobicContact CG1-CD2 4.41Å; V136-L161 HydrophobicContact CB-CD1 4.39Å; V136-L161 HydrophobicContact CG2-CD1 4Å; V136-I238 HydrophobicContact CG2-CG2 4.18Å
137	Q	96	Very high	95.5	Very high	93 Å²	93	67 Å²	67	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-61.7	-39	-179.2	-169.3	170.4	23.2	0	0	112.3	S133 M134 W135 Q139 I140 F158	S133-Q137 WeakPolarHBondContact O-CB 3.35Å; S133-Q137 PolarHBondContact O-N 3.03Å; M134-Q137 PolarHBondContact O-N 3.42Å; W135-Q137 PolarHBondContact O-N 3.42Å; Q137-Q139 PolarHBondContact O-N 2.88Å; Q137-I140 HydrophobicContact CG-CD1 4.46Å; Q137-I140 WeakPolarHBondContact O-CB 3.41Å; Q137-I140 WeakPolarHBondContact O-CG1 3.45Å; Q137-I140 PolarHBondContact O-N 2.91Å; Q137-F158 HydrophobicContact CB-CE2 4.03Å; Q137-F158 HydrophobicContact CG-CE2 4.48Å
138	L	95.4	Very high	95.4	Very high	76 Å²	76	65.2 Å²	65.2	40%	0.398	33%	0.334	S	S	.	.	H	α-helix	trans	-74.7	-11.5	177.1	-66.8	174.7	0	0	0	113.6	F17 L21 M134 W135 V136 I140	F17-L138 HydrophobicContact CE1-CD1 4.02Å; L21-L138 HydrophobicContact CD2-CD1 3.68Å; M134-L138 HydrophobicContact CG-CD1 4.05Å; M134-L138 HydrophobicContact CG-CG 4.47Å; M134-L138 WeakPolarHBondContact O-CG 3.27Å; M134-L138 PolarHBondContact O-N 3.45Å; M134-L138 HydrophobicContact SD-CD1 4.23Å; M134-L138 HydrophobicContact SD-CG 4.19Å; W135-L138 PolarHBondContact O-N 2.71Å; V136-L138 VanDerWaalsContact C-N 3.31Å; V136-L138 PolarHBondContact O-N 2.94Å; L138-I140 VanDerWaalsContact C-N 3.33Å
139	Q	94.4	Very high	95.4	Very high	37 Å²	37	69.9 Å²	69.9	17%	0.173	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-8.6	170.6	-57.9	-44.9	-71.8	0	0	113.2	W135 V136 Q137 P141 Q154 I238	W135-Q139 WeakPolarHBondContact O-CG 3.4Å; W135-Q139 PolarHBondContact O-N 3.25Å; W135-Q139 PolarHBondContact O-NE2 3.46Å; V136-Q139 WeakPolarHBondContact O-CB 3.46Å; V136-Q139 PolarHBondContact O-N 3.48Å; Q137-Q139 PolarHBondContact O-N 2.88Å; Q139-P141 WeakPolarHBondContact O-CD 3.49Å; Q139-Q154 VanDerWaalsContact C-NE2 3.3Å; Q139-Q154 VanDerWaalsContact CB-NE2 3.33Å; Q139-Q154 PolarHBondContact O-NE2 2.92Å; Q139-I238 VanDerWaalsContact CB-O 3.25Å; Q139-I238 WeakPolarHBondContact CB-O 3.49Å; Q139-I238 HydrophobicContact CG-CG2 4.46Å
140	I	95.2	Very high	95.4	Very high	72 Å²	72	69.8 Å²	69.8	37%	0.369	35%	0.354	S	S	.	.			trans	-66.8	121	-179.1	-62.6	174.8	0	0	0	108.8	Q137 L138	Q137-I140 HydrophobicContact CG-CD1 4.46Å; Q137-I140 WeakPolarHBondContact O-CB 3.41Å; Q137-I140 WeakPolarHBondContact O-CG1 3.45Å; Q137-I140 PolarHBondContact O-N 2.91Å; L138-I140 VanDerWaalsContact C-N 3.33Å
141	P	95.3	Very high	95.4	Very high	37 Å²	37	66.8 Å²	66.8	24%	0.24	34%	0.338	C	S	.	.			trans	-78.4	174.2	-176.9	35.4	-36.1	0	0	0	110.6	Q139 I143 V151 P241	Q139-P141 WeakPolarHBondContact O-CD 3.49Å; P141-I143 PolarHBondContact O-N 3.45Å; P141-V151 HydrophobicContact CG-CG2 3.65Å; P141-P241 HydrophobicContact CB-CG 4.45Å; P141-P241 HydrophobicContact CG-CG 3.78Å
142	R	94.9	Very high	95.5	Very high	205 Å²	205	68.1 Å²	68.1	77%	0.774	35%	0.351	S	S	*	.			trans	-53	136.2	171.2	-178.2	-175.5	177.8	-179.5	-0.5	110.8	E144 R242	R142-E144 PolarHBondContact O-N 2.94Å; R142-R242 PolarHBondContact O-NH1 3.37Å; R142-R242 PolarHBondContact O-NH2 3.46Å
143	I	94.2	Very high	95.5	Very high	158 Å²	158	69 Å²	69	81%	0.81	36%	0.356	S	S	*	.			trans	-62	131.4	174.5	-58.9	172.5	0	0	0	110.3	P141	P141-I143 PolarHBondContact O-N 3.45Å
144	E	91.8	Very high	95.5	Very high	91 Å²	91	68.3 Å²	68.3	43%	0.425	35%	0.351	S	S	.	.			trans	-139.7	159.9	177.4	-69	173.7	-167.2	0	0	109.5	R142 G146 N148 R242	R142-E144 PolarHBondContact O-N 2.94Å; E144-G146 VanDerWaalsContact C-N 3.29Å; E144-G146 PolarHBondContact O-N 3.05Å; E144-N148 PolarHBondContact O-ND2 3.18Å; E144-R242 VanDerWaalsContact CD-CZ 3.41Å; E144-R242 IonicContact OE1-CZ 2.71Å; E144-R242 IonicContact OE1-NH1 3.24Å; E144-R242 PolarHBondContact OE1-NH1 3.49Å; E144-R242 IonicContact OE2-CZ 2.81Å; E144-R242 VanDerWaalsContact OE2-CZ 3.24Å; E144-R242 IonicContact OE2-NE 3.79Å; E144-R242 PolarHBondContact OE2-NE 2.96Å; E144-R242 IonicContact OE2-NH1 2.72Å; E144-R242 PolarHBondContact OE2-NH1 3.16Å; E144-R242 VanDerWaalsContact OE2-NH1 3.11Å; E144-R242 IonicContact OE2-NH2 3.17Å
145	D	90.1	Very high	95.5	Very high	179 Å²	179	70.9 Å²	70.9	96%	0.957	36%	0.363	S	S	*	.	S	Bend	trans	-71.6	-20.7	-176.2	-64.6	-25.1	0	0	0	113.6
146	G	92.3	Very high	95.5	Very high	40 Å²	40	76.9 Å²	76.9	41%	0.412	39%	0.389	S	S	.	.	S	Bend	trans	-139.1	176.3	-176.4	0	0	0	0	0	113.2	E144 N148	E144-G146 VanDerWaalsContact C-N 3.29Å; E144-G146 PolarHBondContact O-N 3.05Å; G146-N148 VanDerWaalsContact C-N 3.34Å; G146-N148 PolarHBondContact O-N 3.07Å; G146-N148 PolarHBondContact O-OD1 3.44Å
147	N	93.2	Very high	95.6	Very high	99 Å²	99	77 Å²	77	53%	0.529	39%	0.39	S	S	.	.			trans	57.9	41.6	-178.5	-164.8	20.5	0	0	0	113.8	R242	N147-R242 WeakPolarHBondContact ND2-CB 3.34Å
148	N	95.6	Very high	95.6	Very high	59 Å²	59	75.2 Å²	75.2	32%	0.316	38%	0.381	S	S	.	.			trans	-100.9	8	-176	-65.4	-43.6	0	0	0	114.2	E144 G146 G150 V151 A152 R242	E144-N148 PolarHBondContact O-ND2 3.18Å; G146-N148 VanDerWaalsContact C-N 3.34Å; G146-N148 PolarHBondContact O-N 3.07Å; G146-N148 PolarHBondContact O-OD1 3.44Å; N148-G150 PolarHBondContact O-N 3.42Å; N148-V151 HydrophobicContact CB-CB 4.41Å; N148-V151 WeakPolarHBondContact O-CB 3.37Å; N148-V151 PolarHBondContact O-N 3.22Å; N148-V151 VanDerWaalsContact O-N 3.12Å; N148-A152 PolarHBondContact O-N 3.29Å; N148-R242 PolarHBondContact OD1-NH2 2.9Å
149	F	97	Very high	95.7	Very high	142 Å²	142	75.8 Å²	75.8	62%	0.623	38%	0.381	S	S	*	.	H	α-helix	trans	-58.5	-47.1	178.6	174.4	-96.7	0	0	0	112.2	V151 A152 V153	F149-V151 VanDerWaalsContact C-N 3.25Å; F149-V151 PolarHBondContact O-N 3.09Å; F149-A152 WeakPolarHBondContact O-CB 3.4Å; F149-A152 PolarHBondContact O-N 2.86Å; F149-V153 HydrophobicContact CD1-CG2 4.4Å; F149-V153 HydrophobicContact CE1-CG2 3.89Å; F149-V153 HydrophobicContact CZ-CG2 3.99Å; F149-V153 WeakPolarHBondContact O-CG2 3.48Å; F149-V153 PolarHBondContact O-N 3.37Å
150	G	97.3	Very high	95.8	Very high	1 Å²	1	76.3 Å²	76.3	1%	0.01	39%	0.385	C	S	.	.	H	α-helix	trans	-65.9	-29.9	177	0	0	0	0	0	113.1	N148 V153 Q154 P241	N148-G150 PolarHBondContact O-N 3.42Å; G150-V153 WeakPolarHBondContact O-CB 3.39Å; G150-V153 PolarHBondContact O-N 3.1Å; G150-Q154 WeakPolarHBondContact O-CG 3.34Å; G150-Q154 PolarHBondContact O-N 3.05Å; G150-P241 VanDerWaalsContact C-CB 3.49Å; G150-P241 WeakPolarHBondContact CA-O 3.25Å
151	V	97.6	Very high	95.8	Very high	15 Å²	15	72.9 Å²	72.9	9%	0.091	37%	0.367	C	S	.	.	H	α-helix	trans	-66.7	-43.2	173.6	-174.6	0	0	0	0	110.2	P141 N148 F149 V153 Q154 E155 P241	P141-V151 HydrophobicContact CG-CG2 3.65Å; N148-V151 HydrophobicContact CB-CB 4.41Å; N148-V151 WeakPolarHBondContact O-CB 3.37Å; N148-V151 PolarHBondContact O-N 3.22Å; N148-V151 VanDerWaalsContact O-N 3.12Å; F149-V151 VanDerWaalsContact C-N 3.25Å; F149-V151 PolarHBondContact O-N 3.09Å; V151-V153 VanDerWaalsContact C-N 3.26Å; V151-V153 PolarHBondContact O-N 3.05Å; V151-Q154 WeakPolarHBondContact O-CA 3.29Å; V151-Q154 WeakPolarHBondContact O-CB 2.97Å; V151-Q154 PolarHBondContact O-N 3.34Å; V151-E155 WeakPolarHBondContact O-CG 3.45Å; V151-E155 PolarHBondContact O-N 2.92Å; V151-P241 HydrophobicContact CG2-CB 4.26Å
152	A	98	Very high	95.7	Very high	47 Å²	47	73.9 Å²	73.9	39%	0.388	37%	0.373	S	S	.	.	H	α-helix	trans	-61.4	-34.1	174.1	0	0	0	0	0	112.5	N148 F149 K156	N148-A152 PolarHBondContact O-N 3.29Å; F149-A152 WeakPolarHBondContact O-CB 3.4Å; F149-A152 PolarHBondContact O-N 2.86Å; A152-K156 WeakPolarHBondContact O-CB 3.39Å; A152-K156 PolarHBondContact O-N 3.37Å
153	V	98.2	Very high	95.7	Very high	19 Å²	19	68.5 Å²	68.5	12%	0.115	36%	0.359	C	S	.	.	H	α-helix	trans	-64.4	-45.3	171.7	174.3	0	0	0	0	111	F149 G150 V151 K156 V157 N234 K237	F149-V153 HydrophobicContact CD1-CG2 4.4Å; F149-V153 HydrophobicContact CE1-CG2 3.89Å; F149-V153 HydrophobicContact CZ-CG2 3.99Å; F149-V153 WeakPolarHBondContact O-CG2 3.48Å; F149-V153 PolarHBondContact O-N 3.37Å; G150-V153 WeakPolarHBondContact O-CB 3.39Å; G150-V153 PolarHBondContact O-N 3.1Å; V151-V153 VanDerWaalsContact C-N 3.26Å; V151-V153 PolarHBondContact O-N 3.05Å; V153-K156 PolarHBondContact O-N 3.21Å; V153-V157 WeakPolarHBondContact O-CG2 3.49Å; V153-V157 PolarHBondContact O-N 3.45Å; V153-V157 VanDerWaalsContact O-N 3.09Å; V153-N234 HydrophobicContact CG1-CB 3.79Å; V153-K237 HydrophobicContact CB-CB 4.18Å; V153-K237 HydrophobicContact CG1-CB 3.9Å; V153-K237 HydrophobicContact CG2-CB 4.47Å
154	Q	98.1	Very high	95.7	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-59.2	-47	175.2	-70.7	172.3	-37.9	0	0	111.4	Q139 G150 V151 K156 V157 F158 I238	Q139-Q154 VanDerWaalsContact C-NE2 3.3Å; Q139-Q154 VanDerWaalsContact CB-NE2 3.33Å; Q139-Q154 PolarHBondContact O-NE2 2.92Å; G150-Q154 WeakPolarHBondContact O-CG 3.34Å; G150-Q154 PolarHBondContact O-N 3.05Å; V151-Q154 WeakPolarHBondContact O-CA 3.29Å; V151-Q154 WeakPolarHBondContact O-CB 2.97Å; V151-Q154 PolarHBondContact O-N 3.34Å; Q154-K156 VanDerWaalsContact C-N 3.3Å; Q154-K156 PolarHBondContact O-N 3.14Å; Q154-V157 PolarHBondContact O-N 3.07Å; Q154-F158 VanDerWaalsContact O-CB 3.32Å; Q154-F158 WeakPolarHBondContact O-CB 3.34Å; Q154-F158 PolarHBondContact O-N 3.45Å; Q154-I238 PolarHBondContact NE2-O 2.71Å
155	E	97.6	Very high	95.8	Very high	119 Å²	119	62.5 Å²	62.5	56%	0.556	33%	0.325	S	S	*	.	H	α-helix	trans	-57.2	-43.7	177	-72.5	173.4	171.8	0	0	111.4	V151 V157 F158 E159	V151-E155 WeakPolarHBondContact O-CG 3.45Å; V151-E155 PolarHBondContact O-N 2.92Å; E155-V157 PolarHBondContact O-N 3.27Å; E155-F158 PolarHBondContact O-N 3.25Å; E155-E159 WeakPolarHBondContact O-CB 3.4Å; E155-E159 PolarHBondContact O-N 3.45Å
156	K	97.8	Very high	95.9	Very high	126 Å²	126	58.1 Å²	58.1	55%	0.548	30%	0.304	S	S	.	.	H	α-helix	trans	-66.6	-39.6	-179.7	-169.7	63.3	-173.3	169.3	0	113	A152 V153 Q154 E159 L160	A152-K156 WeakPolarHBondContact O-CB 3.39Å; A152-K156 PolarHBondContact O-N 3.37Å; V153-K156 PolarHBondContact O-N 3.21Å; Q154-K156 VanDerWaalsContact C-N 3.3Å; Q154-K156 PolarHBondContact O-N 3.14Å; K156-E159 WeakPolarHBondContact CD-OE2 3.49Å; K156-E159 IonicContact NZ-OE1 3.48Å; K156-E159 IonicContact NZ-OE2 3.89Å; K156-E159 PolarHBondContact NZ-OE2 3.5Å; K156-L160 PolarHBondContact O-N 3.41Å
157	V	97.6	Very high	96	Very high	3 Å²	3	60.5 Å²	60.5	2%	0.018	30%	0.304	C	S	.	.	H	α-helix	trans	-67.1	-41.6	174.8	174	0	0	0	0	110.4	V153 Q154 E155 L160 L161 I230 I231 I238	V153-V157 WeakPolarHBondContact O-CG2 3.49Å; V153-V157 PolarHBondContact O-N 3.45Å; V153-V157 VanDerWaalsContact O-N 3.09Å; Q154-V157 PolarHBondContact O-N 3.07Å; E155-V157 PolarHBondContact O-N 3.27Å; V157-L160 PolarHBondContact O-N 3.12Å; V157-L161 HydrophobicContact CG1-CD1 4.2Å; V157-L161 WeakPolarHBondContact O-CG 3.3Å; V157-L161 PolarHBondContact O-N 3.1Å; V157-I230 HydrophobicContact CG2-CD1 4.26Å; V157-I230 HydrophobicContact CG2-CG1 4.25Å; V157-I231 HydrophobicContact CG1-CG1 4.09Å; V157-I238 HydrophobicContact CG1-CD1 4.21Å; V157-I238 HydrophobicContact CG2-CD1 4.16Å
158	F	96.6	Very high	95.9	Very high	55 Å²	55	55.9 Å²	55.9	24%	0.241	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-37.1	177.9	-171.5	-97	0	0	0	112.9	V136 Q137 Q154 E155 L160 L161 T162	V136-F158 HydrophobicContact CG1-CB 4.28Å; V136-F158 HydrophobicContact CG1-CD2 4.41Å; Q137-F158 HydrophobicContact CB-CE2 4.03Å; Q137-F158 HydrophobicContact CG-CE2 4.48Å; Q154-F158 VanDerWaalsContact O-CB 3.32Å; Q154-F158 WeakPolarHBondContact O-CB 3.34Å; Q154-F158 PolarHBondContact O-N 3.45Å; E155-F158 PolarHBondContact O-N 3.25Å; F158-L160 VanDerWaalsContact C-N 3.35Å; F158-L160 PolarHBondContact O-N 3.45Å; F158-L161 PolarHBondContact O-N 3.42Å; F158-T162 WeakPolarHBondContact O-CB 3.17Å; F158-T162 PolarHBondContact O-N 2.97Å; F158-T162 PolarHBondContact O-OG1 3.5Å
159	E	96.7	Very high	95.8	Very high	87 Å²	87	56.5 Å²	56.5	41%	0.407	28%	0.28	S	S	.	.	H	α-helix	trans	-58.1	-47	172.8	-171.4	-165.7	167.3	0	0	111	E155 K156 L161 T162 N163	E155-E159 WeakPolarHBondContact O-CB 3.4Å; E155-E159 PolarHBondContact O-N 3.45Å; K156-E159 WeakPolarHBondContact CD-OE2 3.49Å; K156-E159 IonicContact NZ-OE1 3.48Å; K156-E159 IonicContact NZ-OE2 3.89Å; K156-E159 PolarHBondContact NZ-OE2 3.5Å; E159-L161 PolarHBondContact O-N 3.27Å; E159-T162 PolarHBondContact O-N 2.86Å; E159-N163 VanDerWaalsContact O-CG 3.27Å; E159-N163 PolarHBondContact O-N 3.5Å; E159-N163 PolarHBondContact O-ND2 3.39Å
160	L	96.2	Very high	95.7	Very high	48 Å²	48	52.2 Å²	52.2	25%	0.251	27%	0.27	S	S	.	.	H	α-helix	trans	-61.8	-43.8	176.9	177	65.3	0	0	0	112.1	K156 V157 F158 T162 N163 T164 V226 L227 I230	K156-L160 PolarHBondContact O-N 3.41Å; V157-L160 PolarHBondContact O-N 3.12Å; F158-L160 VanDerWaalsContact C-N 3.35Å; F158-L160 PolarHBondContact O-N 3.45Å; L160-T162 VanDerWaalsContact C-N 3.3Å; L160-T162 PolarHBondContact O-N 3.36Å; L160-N163 PolarHBondContact O-N 2.86Å; L160-T164 VanDerWaalsContact O-CB 3.3Å; L160-T164 WeakPolarHBondContact O-CB 3.09Å; L160-T164 PolarHBondContact O-N 3.11Å; L160-T164 PolarHBondContact O-OG1 3.42Å; L160-V226 HydrophobicContact CD2-CG1 3.98Å; L160-L227 HydrophobicContact CD2-CD2 4.36Å; L160-L227 HydrophobicContact CG-CD2 4.49Å; L160-I230 HydrophobicContact CD2-CB 4.49Å; L160-I230 HydrophobicContact CD2-CD1 3.59Å; L160-I230 HydrophobicContact CD2-CG2 3.83Å
161	L	95.8	Very high	95.5	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.9	-41.8	176.3	-69.6	166.6	0	0	0	111.3	L129 V132 S133 V136 V157 F158 E159 T164 R165 L227	L129-L161 HydrophobicContact CD1-CB 4.4Å; L129-L161 HydrophobicContact CD1-CD2 3.38Å; L129-L161 HydrophobicContact CG-CD2 4.49Å; V132-L161 HydrophobicContact CG1-CD1 4.2Å; V132-L161 HydrophobicContact CG1-CD2 4.01Å; S133-L161 WeakPolarHBondContact OG-CB 3.3Å; V136-L161 HydrophobicContact CB-CD1 4.39Å; V136-L161 HydrophobicContact CG2-CD1 4Å; V157-L161 HydrophobicContact CG1-CD1 4.2Å; V157-L161 WeakPolarHBondContact O-CG 3.3Å; V157-L161 PolarHBondContact O-N 3.1Å; F158-L161 PolarHBondContact O-N 3.42Å; E159-L161 PolarHBondContact O-N 3.27Å; L161-T164 PolarHBondContact O-N 2.76Å; L161-R165 PolarHBondContact O-N 3.45Å; L161-L227 HydrophobicContact CD2-CD1 4.26Å; L161-L227 HydrophobicContact CD2-CD2 3.54Å; L161-L227 HydrophobicContact CG-CD2 4.36Å
162	T	93.9	Very high	95.1	Very high	58 Å²	58	56.8 Å²	56.8	36%	0.356	29%	0.29	S	S	.	.	H	α-helix	trans	-65.8	-48.3	178	-57.5	0	0	0	0	111.7	F158 E159 L160 T164 R165 T166	F158-T162 WeakPolarHBondContact O-CB 3.17Å; F158-T162 PolarHBondContact O-N 2.97Å; F158-T162 PolarHBondContact O-OG1 3.5Å; E159-T162 PolarHBondContact O-N 2.86Å; L160-T162 VanDerWaalsContact C-N 3.3Å; L160-T162 PolarHBondContact O-N 3.36Å; T162-T164 VanDerWaalsContact C-N 3.26Å; T162-T164 PolarHBondContact O-N 3.03Å; T162-R165 WeakPolarHBondContact O-CB 3.27Å; T162-R165 PolarHBondContact O-N 2.98Å; T162-R165 VanDerWaalsContact O-N 3.1Å; T162-T166 PolarHBondContact O-N 3.33Å; T162-T166 PolarHBondContact O-OG1 3.11Å
163	N	94.5	Very high	94.9	Very high	92 Å²	92	59.1 Å²	59.1	49%	0.492	30%	0.299	S	S	.	.	H	α-helix	trans	-60.7	-39.2	177.8	-69	-19.5	0	0	0	111.7	E159 L160 R165 T166 K167	E159-N163 VanDerWaalsContact O-CG 3.27Å; E159-N163 PolarHBondContact O-N 3.5Å; E159-N163 PolarHBondContact O-ND2 3.39Å; L160-N163 PolarHBondContact O-N 2.86Å; N163-R165 VanDerWaalsContact C-N 3.34Å; N163-R165 PolarHBondContact O-N 3.39Å; N163-T166 PolarHBondContact O-N 3.15Å; N163-K167 PolarHBondContact O-N 3.01Å; N163-K167 VanDerWaalsContact O-N 3.17Å
164	T	94.7	Very high	94.8	Very high	17 Å²	17	60.2 Å²	60.2	10%	0.104	30%	0.304	C	S	.	.	H	α-helix	trans	-62.2	-41.7	175.9	-59.9	0	0	0	0	111.4	L129 L160 L161 T162 T166 K167 I168 T223	L129-T164 HydrophobicContact CD1-CG2 4.22Å; L129-T164 HydrophobicContact CD2-CG2 3.86Å; L160-T164 VanDerWaalsContact O-CB 3.3Å; L160-T164 WeakPolarHBondContact O-CB 3.09Å; L160-T164 PolarHBondContact O-N 3.11Å; L160-T164 PolarHBondContact O-OG1 3.42Å; L161-T164 PolarHBondContact O-N 2.76Å; T162-T164 VanDerWaalsContact C-N 3.26Å; T162-T164 PolarHBondContact O-N 3.03Å; T164-T166 PolarHBondContact O-N 3.22Å; T164-K167 WeakPolarHBondContact O-CB 3.42Å; T164-K167 PolarHBondContact O-N 3.02Å; T164-I168 HydrophobicContact CG2-CD1 3.89Å; T164-I168 WeakPolarHBondContact O-CD1 3.4Å; T164-I168 WeakPolarHBondContact O-CG1 3.37Å; T164-I168 PolarHBondContact O-N 2.8Å; T164-T223 HydrophobicContact CG2-CG2 3.29Å
165	R	92.8	Very high	94.7	Very high	106 Å²	106	61 Å²	61	40%	0.4	31%	0.307	S	S	.	.	H	α-helix	trans	-59.5	-46.4	177.7	-178.6	179.9	174.1	153.2	-0.2	111.6	L129 L161 T162 N163 K167 I168 E169	L129-R165 HydrophobicContact CD2-CB 3.74Å; L161-R165 PolarHBondContact O-N 3.45Å; T162-R165 WeakPolarHBondContact O-CB 3.27Å; T162-R165 PolarHBondContact O-N 2.98Å; T162-R165 VanDerWaalsContact O-N 3.1Å; N163-R165 VanDerWaalsContact C-N 3.34Å; N163-R165 PolarHBondContact O-N 3.39Å; R165-K167 VanDerWaalsContact C-N 3.29Å; R165-K167 PolarHBondContact O-N 3.48Å; R165-I168 PolarHBondContact O-N 3.44Å; R165-E169 IonicContact NE-OE1 3.74Å; R165-E169 PolarHBondContact NE-OE1 3.44Å; R165-E169 PolarHBondContact O-N 3.15Å
166	T	93.7	Very high	94.6	Very high	87 Å²	87	59.2 Å²	59.2	53%	0.534	31%	0.308	S	S	.	.	H	α-helix	trans	-59.9	-40.7	177.3	-54.3	0	0	0	0	111.6	T162 N163 T164 I168 E169 A170	T162-T166 PolarHBondContact O-N 3.33Å; T162-T166 PolarHBondContact O-OG1 3.11Å; N163-T166 PolarHBondContact O-N 3.15Å; T164-T166 PolarHBondContact O-N 3.22Å; T166-I168 PolarHBondContact O-N 3.32Å; T166-E169 PolarHBondContact O-N 3.19Å; T166-A170 PolarHBondContact O-N 3.22Å
167	K	92.9	Very high	94.6	Very high	91 Å²	91	57.9 Å²	57.9	40%	0.396	30%	0.302	S	S	.	.	H	α-helix	trans	-61.9	-43.2	176.3	-169.4	-179.7	-178.6	-172.8	0	112.1	N163 T164 R165 E169 A170 F171 D219	N163-K167 PolarHBondContact O-N 3.01Å; N163-K167 VanDerWaalsContact O-N 3.17Å; T164-K167 WeakPolarHBondContact O-CB 3.42Å; T164-K167 PolarHBondContact O-N 3.02Å; R165-K167 VanDerWaalsContact C-N 3.29Å; R165-K167 PolarHBondContact O-N 3.48Å; K167-E169 PolarHBondContact O-N 3.09Å; K167-A170 WeakPolarHBondContact O-CB 3.44Å; K167-A170 PolarHBondContact O-N 3.18Å; K167-F171 HydrophobicContact CD-CZ 4.24Å; K167-F171 HydrophobicContact CG-CE1 4.22Å; K167-F171 HydrophobicContact CG-CZ 3.95Å; K167-F171 PolarHBondContact O-N 2.89Å; K167-D219 WeakPolarHBondContact CE-OD2 2.75Å; K167-D219 IonicContact NZ-OD1 3.75Å; K167-D219 PolarHBondContact NZ-OD1 3.42Å; K167-D219 IonicContact NZ-OD2 3.51Å; K167-D219 PolarHBondContact NZ-OD2 2.97Å
168	I	92.4	Very high	94.6	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-65.9	-38.6	179.4	-63.6	157.3	0	0	0	111.4	I122 L125 K126 L129 T164 R165 T166 A170 F171 Q172	I122-I168 HydrophobicContact CG2-CG2 3.8Å; L125-I168 HydrophobicContact CD2-CD1 3.52Å; L125-I168 HydrophobicContact CD2-CG1 3.79Å; L125-I168 HydrophobicContact CG-CD1 3.59Å; L125-I168 HydrophobicContact CG-CG1 4.33Å; K126-I168 HydrophobicContact CB-CG2 4.2Å; L129-I168 HydrophobicContact CD2-CD1 3.62Å; T164-I168 HydrophobicContact CG2-CD1 3.89Å; T164-I168 WeakPolarHBondContact O-CD1 3.4Å; T164-I168 WeakPolarHBondContact O-CG1 3.37Å; T164-I168 PolarHBondContact O-N 2.8Å; R165-I168 PolarHBondContact O-N 3.44Å; T166-I168 PolarHBondContact O-N 3.32Å; I168-A170 VanDerWaalsContact C-N 3.26Å; I168-A170 PolarHBondContact O-N 3.05Å; I168-F171 WeakPolarHBondContact O-CB 3.47Å; I168-F171 PolarHBondContact O-N 3.34Å; I168-F171 VanDerWaalsContact O-N 3.16Å; I168-Q172 PolarHBondContact O-N 3.16Å
169	E	91.8	Very high	94.7	Very high	72 Å²	72	59.1 Å²	59.1	34%	0.336	31%	0.306	S	S	.	.	H	α-helix	trans	-62.3	-35.1	175.9	-72.7	173.6	178.4	0	0	111.8	R165 T166 K167 F171 Q172 T173	R165-E169 IonicContact NE-OE1 3.74Å; R165-E169 PolarHBondContact NE-OE1 3.44Å; R165-E169 PolarHBondContact O-N 3.15Å; T166-E169 PolarHBondContact O-N 3.19Å; K167-E169 PolarHBondContact O-N 3.09Å; E169-F171 VanDerWaalsContact C-N 3.34Å; E169-F171 PolarHBondContact O-N 3.47Å; E169-Q172 PolarHBondContact O-N 3.49Å; E169-T173 PolarHBondContact O-N 3.21Å
170	A	95	Very high	94.8	Very high	51 Å²	51	58.3 Å²	58.3	42%	0.421	31%	0.31	S	S	.	.	H	α-helix	trans	-66	-32.3	174.4	0	0	0	0	0	113.4	T166 K167 I168 Q172 T173 Q174	T166-A170 PolarHBondContact O-N 3.22Å; K167-A170 WeakPolarHBondContact O-CB 3.44Å; K167-A170 PolarHBondContact O-N 3.18Å; I168-A170 VanDerWaalsContact C-N 3.26Å; I168-A170 PolarHBondContact O-N 3.05Å; A170-Q172 VanDerWaalsContact C-N 3.3Å; A170-Q172 PolarHBondContact O-N 2.91Å; A170-T173 PolarHBondContact O-N 3.4Å; A170-T173 PolarHBondContact O-OG1 3.24Å; A170-Q174 WeakPolarHBondContact O-CB 3.33Å; A170-Q174 PolarHBondContact O-N 3.5Å; A170-Q174 VanDerWaalsContact O-N 3.08Å
171	F	93.4	Very high	94.9	Very high	26 Å²	26	59.2 Å²	59.2	11%	0.114	31%	0.313	C	S	.	.	H	α-helix	trans	-63.6	-39.1	173.9	-59	-27.5	0	0	0	111.7	I122 K167 I168 E169 Q174 I175 V216 D219	I122-F171 HydrophobicContact CD1-CB 3.97Å; I122-F171 HydrophobicContact CG1-CB 4.47Å; K167-F171 HydrophobicContact CD-CZ 4.24Å; K167-F171 HydrophobicContact CG-CE1 4.22Å; K167-F171 HydrophobicContact CG-CZ 3.95Å; K167-F171 PolarHBondContact O-N 2.89Å; I168-F171 WeakPolarHBondContact O-CB 3.47Å; I168-F171 PolarHBondContact O-N 3.34Å; I168-F171 VanDerWaalsContact O-N 3.16Å; E169-F171 VanDerWaalsContact C-N 3.34Å; E169-F171 PolarHBondContact O-N 3.47Å; F171-Q174 PolarHBondContact O-N 3.4Å; F171-I175 PolarHBondContact O-N 3.21Å; F171-V216 HydrophobicContact CB-CG1 4.3Å; F171-V216 HydrophobicContact CB-CG2 4.3Å; F171-V216 HydrophobicContact CD1-CG2 3.77Å; F171-V216 HydrophobicContact CD2-CG1 3.85Å; F171-V216 HydrophobicContact CD2-CG2 4.43Å; F171-V216 HydrophobicContact CE1-CG2 4.09Å; F171-V216 HydrophobicContact CE2-CG1 4.25Å; F171-V216 HydrophobicContact CG-CG1 4.05Å; F171-V216 HydrophobicContact CG-CG2 3.94Å; F171-D219 HydrophobicContact CE2-CB 4.11Å; F171-D219 HydrophobicContact CZ-CB 3.68Å
172	Q	89.6	Confident	95	Very high	87 Å²	87	60 Å²	60	41%	0.407	32%	0.316	S	S	.	.	H	α-helix	trans	-67	-40.1	179.7	-168.7	171.3	7.9	0	0	111.8	I168 E169 A170 I175	I168-Q172 PolarHBondContact O-N 3.16Å; E169-Q172 PolarHBondContact O-N 3.49Å; A170-Q172 VanDerWaalsContact C-N 3.3Å; A170-Q172 PolarHBondContact O-N 2.91Å; Q172-I175 PolarHBondContact O-N 3.05Å
173	T	94.1	Very high	95.2	Very high	95 Å²	95	59 Å²	59	58%	0.583	32%	0.317	S	S	*	.	H	α-helix	trans	-69.6	-36	177.5	57.8	0	0	0	0	112.3	E169 A170 I175 S176 K177	E169-T173 PolarHBondContact O-N 3.21Å; A170-T173 PolarHBondContact O-N 3.4Å; A170-T173 PolarHBondContact O-OG1 3.24Å; T173-I175 VanDerWaalsContact C-N 3.28Å; T173-I175 PolarHBondContact O-N 3.43Å; T173-S176 PolarHBondContact O-N 3.32Å; T173-K177 PolarHBondContact O-N 3.49Å
174	Q	95.6	Very high	95.4	Very high	43 Å²	43	59 Å²	59	20%	0.201	32%	0.317	C	S	.	.	H	α-helix	trans	-61.9	-33.9	177.1	-176.9	55.7	42	0	0	112.6	A170 F171 K177 Y178	A170-Q174 WeakPolarHBondContact O-CB 3.33Å; A170-Q174 PolarHBondContact O-N 3.5Å; A170-Q174 VanDerWaalsContact O-N 3.08Å; F171-Q174 PolarHBondContact O-N 3.4Å; Q174-K177 WeakPolarHBondContact O-CB 3.42Å; Q174-K177 PolarHBondContact O-N 3.37Å; Q174-Y178 PolarHBondContact O-N 3.21Å
175	I	95.9	Very high	95.5	Very high	15 Å²	15	58.2 Å²	58.2	8%	0.077	31%	0.312	C	S	.	.	H	α-helix	trans	-63.4	-47.5	175.7	-69.1	171.6	0	0	0	111.2	L115 K119 I122 F171 Q172 T173 K177 Y178 Y179	L115-I175 HydrophobicContact CD2-CB 4.41Å; L115-I175 HydrophobicContact CD2-CD1 4.06Å; L115-I175 HydrophobicContact CD2-CG1 3.85Å; L115-I175 HydrophobicContact CD2-CG2 3.81Å; K119-I175 HydrophobicContact CG-CD1 3.82Å; I122-I175 HydrophobicContact CD1-CD1 3.71Å; F171-I175 PolarHBondContact O-N 3.21Å; Q172-I175 PolarHBondContact O-N 3.05Å; T173-I175 VanDerWaalsContact C-N 3.28Å; T173-I175 PolarHBondContact O-N 3.43Å; I175-K177 VanDerWaalsContact C-N 3.26Å; I175-K177 PolarHBondContact O-N 3.41Å; I175-Y178 PolarHBondContact O-N 3.25Å; I175-Y179 HydrophobicContact CG2-CD2 4.39Å; I175-Y179 HydrophobicContact CG2-CE2 3.93Å; I175-Y179 VanDerWaalsContact O-CD2 3.26Å; I175-Y179 WeakPolarHBondContact O-CD2 3.5Å
176	S	95.8	Very high	95.8	Very high	82 Å²	82	54.3 Å²	54.3	57%	0.573	30%	0.3	S	S	*	.	H	α-helix	trans	-62.8	-37.4	177.1	-59.3	0	0	0	0	111.7	T173 Y178 Y179 S180	T173-S176 PolarHBondContact O-N 3.32Å; S176-Y178 PolarHBondContact O-N 3.2Å; S176-Y179 PolarHBondContact O-N 3.42Å; S176-S180 PolarHBondContact O-N 3.27Å
177	K	97.8	Very high	95.8	Very high	99 Å²	99	52 Å²	52	43%	0.43	29%	0.289	S	S	.	.	H	α-helix	trans	-61.4	-41.7	177.3	-175.5	176.5	170.4	-174.8	0	112.1	T173 Q174 I175 Y179 S180 E181	T173-K177 PolarHBondContact O-N 3.49Å; Q174-K177 WeakPolarHBondContact O-CB 3.42Å; Q174-K177 PolarHBondContact O-N 3.37Å; I175-K177 VanDerWaalsContact C-N 3.26Å; I175-K177 PolarHBondContact O-N 3.41Å; K177-Y179 PolarHBondContact O-N 3.39Å; K177-S180 PolarHBondContact O-N 3.48Å; K177-E181 WeakPolarHBondContact CE-OE1 3.14Å; K177-E181 WeakPolarHBondContact CE-OE2 3.49Å; K177-E181 HydrophobicContact CG-CG 4.08Å; K177-E181 IonicContact NZ-OE1 3.11Å; K177-E181 WeakPolarHBondContact O-CB 3.45Å; K177-E181 WeakPolarHBondContact O-CG 3.43Å; K177-E181 PolarHBondContact O-N 3.13Å
178	Y	98.4	Very high	95.9	Very high	3 Å²	3	52.4 Å²	52.4	1%	0.012	29%	0.292	C	S	.	.	H	α-helix	trans	-56.3	-48	175.3	164	-107.6	0	0	0	112.6	V111 L115 Q174 I175 S176 S180 E181 R182 D206 Q209	V111-Y178 HydrophobicContact CG1-CE1 3.72Å; L115-Y178 HydrophobicContact CD1-CD1 4.29Å; L115-Y178 HydrophobicContact CD1-CE1 4.2Å; Q174-Y178 PolarHBondContact O-N 3.21Å; I175-Y178 PolarHBondContact O-N 3.25Å; S176-Y178 PolarHBondContact O-N 3.2Å; Y178-S180 VanDerWaalsContact C-N 3.32Å; Y178-S180 PolarHBondContact O-N 3.28Å; Y178-E181 PolarHBondContact O-N 2.91Å; Y178-R182 HydrophobicContact CE2-CB 4.3Å; Y178-R182 WeakPolarHBondContact O-CB 3.48Å; Y178-R182 PolarHBondContact O-N 3.21Å; Y178-R182 WeakPolarHBondContact OH-CD 3.42Å; Y178-D206 PolarHBondContact OH-OD1 3.21Å; Y178-D206 VanDerWaalsContact OH-OD1 3.07Å; Y178-Q209 HydrophobicContact CD1-CG 3.89Å; Y178-Q209 HydrophobicContact CD2-CB 3.47Å; Y178-Q209 VanDerWaalsContact CD2-CB 3.47Å; Y178-Q209 HydrophobicContact CD2-CG 3.6Å; Y178-Q209 HydrophobicContact CE1-CG 4.12Å; Y178-Q209 HydrophobicContact CE2-CB 3.56Å; Y178-Q209 HydrophobicContact CE2-CG 3.84Å; Y178-Q209 HydrophobicContact CG-CB 4.04Å; Y178-Q209 HydrophobicContact CG-CG 3.61Å
179	Y	98.2	Very high	96	Very high	80 Å²	80	52.3 Å²	52.3	31%	0.314	29%	0.291	S	S	.	.	H	α-helix	trans	-61.2	-42	178.1	-71.6	-73.9	0	0	0	112.1	E112 L115 K119 I175 S176 K177 G183	E112-Y179 VanDerWaalsContact CD-OH 3.27Å; E112-Y179 WeakPolarHBondContact OE1-CE1 3.47Å; E112-Y179 PolarHBondContact OE1-OH 3.46Å; E112-Y179 PolarHBondContact OE2-OH 2.84Å; L115-Y179 HydrophobicContact CD1-CE2 4.2Å; L115-Y179 WeakPolarHBondContact CD1-OH 3.27Å; K119-Y179 PolarHBondContact NZ-OH 3.26Å; I175-Y179 HydrophobicContact CG2-CD2 4.39Å; I175-Y179 HydrophobicContact CG2-CE2 3.93Å; I175-Y179 VanDerWaalsContact O-CD2 3.26Å; I175-Y179 WeakPolarHBondContact O-CD2 3.5Å; S176-Y179 PolarHBondContact O-N 3.42Å; K177-Y179 PolarHBondContact O-N 3.39Å; Y179-G183 PolarHBondContact O-N 2.79Å
180	S	98.3	Very high	96.1	Very high	70 Å²	70	49.4 Å²	49.4	49%	0.49	28%	0.278	S	S	.	.	H	α-helix	trans	-63.4	-53.7	177.8	-167.9	0	0	0	0	111.5	S176 K177 Y178 R182 G183 D184	S176-S180 PolarHBondContact O-N 3.27Å; K177-S180 PolarHBondContact O-N 3.48Å; Y178-S180 VanDerWaalsContact C-N 3.32Å; Y178-S180 PolarHBondContact O-N 3.28Å; S180-R182 PolarHBondContact O-N 2.86Å; S180-G183 PolarHBondContact O-N 3.37Å; S180-D184 PolarHBondContact O-N 3.49Å
181	E	98.6	Very high	95.9	Very high	67 Å²	67	55 Å²	55	31%	0.313	29%	0.293	S	S	.	.	H	α-helix	trans	-65.7	-40.2	-176.3	-70.3	-178.4	151.6	0	0	111.9	K177 Y178 D184 A185 L205	K177-E181 WeakPolarHBondContact CE-OE1 3.14Å; K177-E181 WeakPolarHBondContact CE-OE2 3.49Å; K177-E181 HydrophobicContact CG-CG 4.08Å; K177-E181 IonicContact NZ-OE1 3.11Å; K177-E181 WeakPolarHBondContact O-CB 3.45Å; K177-E181 WeakPolarHBondContact O-CG 3.43Å; K177-E181 PolarHBondContact O-N 3.13Å; Y178-E181 PolarHBondContact O-N 2.91Å; E181-D184 PolarHBondContact O-N 2.96Å; E181-A185 WeakPolarHBondContact O-CB 3.42Å; E181-A185 PolarHBondContact O-N 3.12Å; E181-L205 HydrophobicContact CB-CD1 4.26Å; E181-L205 HydrophobicContact CB-CD2 4.23Å
182	R	98.4	Very high	95.8	Very high	17 Å²	17	57.7 Å²	57.7	6%	0.064	31%	0.306	C	S	.	.	H	α-helix	trans	-65.2	-43.8	174.6	-171.3	-177.2	-171.7	-85.1	-0.3	111.2	C106 Y178 S180 D184 A185 V186 V202 D206	C106-R182 PolarHBondContact O-NH1 2.87Å; C106-R182 PolarHBondContact O-NH2 2.95Å; Y178-R182 HydrophobicContact CE2-CB 4.3Å; Y178-R182 WeakPolarHBondContact O-CB 3.48Å; Y178-R182 PolarHBondContact O-N 3.21Å; Y178-R182 WeakPolarHBondContact OH-CD 3.42Å; S180-R182 PolarHBondContact O-N 2.86Å; R182-D184 VanDerWaalsContact C-N 3.35Å; R182-D184 PolarHBondContact O-N 3.44Å; R182-A185 PolarHBondContact O-N 2.82Å; R182-V186 WeakPolarHBondContact O-CG2 3.14Å; R182-V186 PolarHBondContact O-N 3.45Å; R182-V202 HydrophobicContact CG-CG1 4.48Å; R182-D206 WeakPolarHBondContact CD-OD1 3.49Å; R182-D206 IonicContact CZ-OD1 3.63Å; R182-D206 IonicContact NE-OD1 2.68Å; R182-D206 PolarHBondContact NE-OD1 3.18Å; R182-D206 IonicContact NE-OD2 2.74Å; R182-D206 IonicContact NH2-OD1 3.76Å; R182-D206 IonicContact NH2-OD2 3.86Å
183	G	97.9	Very high	95.8	Very high	37 Å²	37	54.9 Å²	54.9	38%	0.381	30%	0.295	S	S	.	.	H	α-helix	trans	-58	-46.7	175.9	0	0	0	0	0	112	Y179 S180 A185 V186 A187	Y179-G183 PolarHBondContact O-N 2.79Å; S180-G183 PolarHBondContact O-N 3.37Å; G183-A185 PolarHBondContact O-N 3.44Å; G183-V186 PolarHBondContact O-N 3.08Å; G183-A187 WeakPolarHBondContact O-CB 3.42Å; G183-A187 PolarHBondContact O-N 3.09Å
184	D	97.9	Very high	95.6	Very high	91 Å²	91	57 Å²	57	49%	0.487	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-41.5	176.3	-73	-21.2	0	0	0	112.3	S180 E181 R182 A187 K188	S180-D184 PolarHBondContact O-N 3.49Å; E181-D184 PolarHBondContact O-N 2.96Å; R182-D184 VanDerWaalsContact C-N 3.35Å; R182-D184 PolarHBondContact O-N 3.44Å; D184-A187 PolarHBondContact O-N 2.94Å; D184-K188 WeakPolarHBondContact O-CB 3.4Å; D184-K188 VanDerWaalsContact O-CG 3.31Å; D184-K188 WeakPolarHBondContact O-CG 3.47Å; D184-K188 PolarHBondContact O-N 3.45Å
185	A	97.9	Very high	95.5	Very high	2 Å²	2	56.6 Å²	56.6	2%	0.017	30%	0.299	C	S	.	.	H	α-helix	trans	-64	-44.1	176.8	0	0	0	0	0	111.8	E181 R182 G183 K188 A189 L201 V202 L205	E181-A185 WeakPolarHBondContact O-CB 3.42Å; E181-A185 PolarHBondContact O-N 3.12Å; R182-A185 PolarHBondContact O-N 2.82Å; G183-A185 PolarHBondContact O-N 3.44Å; A185-K188 PolarHBondContact O-N 2.88Å; A185-A189 WeakPolarHBondContact O-CB 3.43Å; A185-A189 PolarHBondContact O-N 3.47Å; A185-L201 HydrophobicContact CB-CD2 3.87Å; A185-L201 HydrophobicContact CB-CG 3.95Å; A185-V202 HydrophobicContact CB-CG2 3.72Å; A185-L205 HydrophobicContact CB-CD1 3.85Å
186	V	97.1	Very high	95.5	Very high	23 Å²	23	58.1 Å²	58.1	14%	0.139	32%	0.318	C	S	.	.	H	α-helix	trans	-62.6	-44.3	174.9	170.7	0	0	0	0	111	L60 I105 R182 G183 K188 A189 S190 V202	L60-V186 HydrophobicContact CD1-CG2 4.43Å; I105-V186 HydrophobicContact CB-CG1 3.89Å; I105-V186 HydrophobicContact CG1-CG1 4.06Å; I105-V186 HydrophobicContact CG2-CG1 3.89Å; I105-V186 HydrophobicContact CG2-CG2 4.22Å; R182-V186 WeakPolarHBondContact O-CG2 3.14Å; R182-V186 PolarHBondContact O-N 3.45Å; G183-V186 PolarHBondContact O-N 3.08Å; V186-K188 VanDerWaalsContact C-N 3.34Å; V186-K188 PolarHBondContact O-N 3.39Å; V186-A189 PolarHBondContact O-N 2.74Å; V186-S190 PolarHBondContact O-N 3.07Å; V186-S190 PolarHBondContact O-OG 3.1Å; V186-V202 HydrophobicContact CB-CG2 4.5Å; V186-V202 HydrophobicContact CG2-CG1 4.07Å; V186-V202 HydrophobicContact CG2-CG2 3.68Å
187	A	95.3	Very high	95.6	Very high	38 Å²	38	60.3 Å²	60.3	31%	0.314	32%	0.323	S	S	.	.	H	α-helix	trans	-63	-38.8	178.4	0	0	0	0	0	112.4	G183 D184 S190 K191	G183-A187 WeakPolarHBondContact O-CB 3.42Å; G183-A187 PolarHBondContact O-N 3.09Å; D184-A187 PolarHBondContact O-N 2.94Å; A187-S190 PolarHBondContact O-OG 3.12Å; A187-K191 WeakPolarHBondContact O-CB 3.34Å; A187-K191 VanDerWaalsContact O-CG 3.28Å; A187-K191 WeakPolarHBondContact O-CG 3.44Å; A187-K191 PolarHBondContact O-N 3.43Å
188	K	95.1	Very high	95.6	Very high	101 Å²	101	58.3 Å²	58.3	44%	0.439	31%	0.314	S	S	.	.	H	α-helix	trans	-68.5	-42.7	174	-71.7	175.5	-174.1	175.1	0	111.6	D184 A185 V186 S190 K191 Q192 Y198	D184-K188 WeakPolarHBondContact O-CB 3.4Å; D184-K188 VanDerWaalsContact O-CG 3.31Å; D184-K188 WeakPolarHBondContact O-CG 3.47Å; D184-K188 PolarHBondContact O-N 3.45Å; A185-K188 PolarHBondContact O-N 2.88Å; V186-K188 VanDerWaalsContact C-N 3.34Å; V186-K188 PolarHBondContact O-N 3.39Å; K188-S190 VanDerWaalsContact C-N 3.29Å; K188-S190 PolarHBondContact O-N 3.07Å; K188-K191 PolarHBondContact O-N 2.74Å; K188-Q192 WeakPolarHBondContact O-CB 3.48Å; K188-Q192 PolarHBondContact O-N 2.82Å; K188-Y198 HydrophobicContact CB-CD1 3.78Å; K188-Y198 HydrophobicContact CB-CD2 3.86Å; K188-Y198 HydrophobicContact CB-CE1 3.9Å; K188-Y198 HydrophobicContact CB-CE2 3.99Å; K188-Y198 HydrophobicContact CB-CG 3.76Å; K188-Y198 HydrophobicContact CD-CD1 4.07Å; K188-Y198 HydrophobicContact CD-CE1 3.59Å; K188-Y198 HydrophobicContact CG-CE1 4.3Å
189	A	94.9	Very high	95.5	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.5	-37.1	177.2	0	0	0	0	0	112.2	I62 A185 V186 P193 R199	I62-A189 HydrophobicContact CD1-CB 3.48Å; I62-A189 VanDerWaalsContact CD1-CB 3.48Å; A185-A189 WeakPolarHBondContact O-CB 3.43Å; A185-A189 PolarHBondContact O-N 3.47Å; V186-A189 PolarHBondContact O-N 2.74Å; A189-P193 WeakPolarHBondContact O-CA 3.47Å; A189-R199 HydrophobicContact CB-CG 4.34Å
190	S	92.8	Very high	95.5	Very high	10 Å²	10	60 Å²	60	7%	0.07	32%	0.323	C	S	.	.	H	α-helix	trans	-76.5	-39	178.9	65.7	0	0	0	0	112.9	P101 V186 A187 K188	P101-S190 WeakPolarHBondContact CD-O 3.24Å; P101-S190 WeakPolarHBondContact CG-O 3.34Å; V186-S190 PolarHBondContact O-N 3.07Å; V186-S190 PolarHBondContact O-OG 3.1Å; A187-S190 PolarHBondContact O-OG 3.12Å; K188-S190 VanDerWaalsContact C-N 3.29Å; K188-S190 PolarHBondContact O-N 3.07Å
191	K	90.9	Very high	95.5	Very high	169 Å²	169	60.1 Å²	60.1	74%	0.735	32%	0.317	S	S	*	.	H	α-helix	trans	-74.4	-30.9	177.1	-70.4	178	-179.9	-173.5	0	113.3	A187 K188 P193	A187-K191 WeakPolarHBondContact O-CB 3.34Å; A187-K191 VanDerWaalsContact O-CG 3.28Å; A187-K191 WeakPolarHBondContact O-CG 3.44Å; A187-K191 PolarHBondContact O-N 3.43Å; K188-K191 PolarHBondContact O-N 2.74Å; K191-P193 WeakPolarHBondContact O-CD 3.37Å
192	Q	90.6	Very high	95.5	Very high	82 Å²	82	57 Å²	57	38%	0.383	30%	0.303	S	S	.	.			trans	-126	63.7	-177.1	-61.6	-178.9	-11.1	0	0	110.8	K188 H194 V195 Y198	K188-Q192 WeakPolarHBondContact O-CB 3.48Å; K188-Q192 PolarHBondContact O-N 2.82Å; Q192-H194 PolarHBondContact O-N 3.31Å; Q192-V195 HydrophobicContact CB-CG2 4.09Å; Q192-V195 PolarHBondContact O-N 3.26Å; Q192-Y198 HydrophobicContact CB-CD2 4.35Å; Q192-Y198 HydrophobicContact CB-CE2 4.13Å; Q192-Y198 PolarHBondContact OE1-OH 2.77Å
193	P	90.8	Very high	95.4	Very high	28 Å²	28	57.4 Å²	57.4	18%	0.182	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-12.9	-170.9	27.7	-36.7	0	0	0	114.3	I62 P65 A189 K191 V195	I62-P193 HydrophobicContact CG2-CB 4.09Å; P65-P193 WeakPolarHBondContact CD-O 3.44Å; P65-P193 HydrophobicContact CG-CB 3.78Å; P65-P193 HydrophobicContact CG-CG 3.69Å; A189-P193 WeakPolarHBondContact O-CA 3.47Å; K191-P193 WeakPolarHBondContact O-CD 3.37Å; P193-V195 VanDerWaalsContact C-N 3.35Å
194	H	89.3	Confident	95.4	Very high	139 Å²	139	59.6 Å²	59.6	64%	0.644	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-17.6	174.1	61.1	-85	0	0	0	113.1	P65 Q192 G196	P65-H194 HydrophobicContact CG-CB 4.26Å; Q192-H194 PolarHBondContact O-N 3.31Å; H194-G196 PolarHBondContact O-N 3.41Å
195	V	94.3	Very high	95.4	Very high	36 Å²	36	56.3 Å²	56.3	22%	0.218	29%	0.288	C	S	.	.			trans	-90.5	97.9	177.7	-176.1	0	0	0	0	108.9	Q192 P193 D197 Y198	Q192-V195 HydrophobicContact CB-CG2 4.09Å; Q192-V195 PolarHBondContact O-N 3.26Å; P193-V195 VanDerWaalsContact C-N 3.35Å; V195-D197 HydrophobicContact CG1-CB 4.33Å; V195-D197 PolarHBondContact O-N 3.36Å; V195-Y198 HydrophobicContact CB-CD2 3.63Å; V195-Y198 HydrophobicContact CB-CE2 3.75Å; V195-Y198 HydrophobicContact CG1-CD2 3.63Å; V195-Y198 HydrophobicContact CG1-CE2 3.63Å; V195-Y198 HydrophobicContact CG1-CG 4.3Å; V195-Y198 HydrophobicContact CG2-CD2 4.42Å; V195-Y198 HydrophobicContact CG2-CE2 4.1Å; V195-Y198 PolarHBondContact O-N 3.24Å
196	G	94.7	Very high	95.4	Very high	46 Å²	46	56.3 Å²	56.3	47%	0.474	29%	0.288	S	S	.	.	H	α-helix	trans	-60.6	-30.2	-178.4	0	0	0	0	0	114.1	H194 Y198 R199 Q200	H194-G196 PolarHBondContact O-N 3.41Å; G196-Y198 VanDerWaalsContact C-N 3.28Å; G196-Y198 PolarHBondContact O-N 3.16Å; G196-R199 WeakPolarHBondContact O-CB 3.41Å; G196-R199 PolarHBondContact O-N 3.47Å; G196-R199 VanDerWaalsContact O-N 3.08Å; G196-Q200 PolarHBondContact O-N 3.34Å
197	D	98.2	Very high	95.4	Very high	128 Å²	128	56.2 Å²	56.2	68%	0.684	29%	0.286	S	S	*	.	H	α-helix	trans	-62.9	-30.1	-176.9	-63.5	-50.2	0	0	0	113.4	V195 R199 Q200 L201	V195-D197 HydrophobicContact CG1-CB 4.33Å; V195-D197 PolarHBondContact O-N 3.36Å; D197-R199 VanDerWaalsContact C-N 3.31Å; D197-R199 PolarHBondContact O-N 3.34Å; D197-Q200 PolarHBondContact O-N 3.06Å; D197-L201 WeakPolarHBondContact O-CB 3.36Å; D197-L201 PolarHBondContact O-N 3.47Å
198	Y	97.7	Very high	95.4	Very high	58 Å²	58	59 Å²	59	23%	0.227	29%	0.289	C	S	.	.	H	α-helix	trans	-68.4	-32	176.2	-64.7	-49.6	0	0	0	112.6	K188 Q192 V195 G196 L201 V202	K188-Y198 HydrophobicContact CB-CD1 3.78Å; K188-Y198 HydrophobicContact CB-CD2 3.86Å; K188-Y198 HydrophobicContact CB-CE1 3.9Å; K188-Y198 HydrophobicContact CB-CE2 3.99Å; K188-Y198 HydrophobicContact CB-CG 3.76Å; K188-Y198 HydrophobicContact CD-CD1 4.07Å; K188-Y198 HydrophobicContact CD-CE1 3.59Å; K188-Y198 HydrophobicContact CG-CE1 4.3Å; Q192-Y198 HydrophobicContact CB-CD2 4.35Å; Q192-Y198 HydrophobicContact CB-CE2 4.13Å; Q192-Y198 PolarHBondContact OE1-OH 2.77Å; V195-Y198 HydrophobicContact CB-CD2 3.63Å; V195-Y198 HydrophobicContact CB-CE2 3.75Å; V195-Y198 HydrophobicContact CG1-CD2 3.63Å; V195-Y198 HydrophobicContact CG1-CE2 3.63Å; V195-Y198 HydrophobicContact CG1-CG 4.3Å; V195-Y198 HydrophobicContact CG2-CD2 4.42Å; V195-Y198 HydrophobicContact CG2-CE2 4.1Å; V195-Y198 PolarHBondContact O-N 3.24Å; G196-Y198 VanDerWaalsContact C-N 3.28Å; G196-Y198 PolarHBondContact O-N 3.16Å; Y198-L201 PolarHBondContact O-N 3.23Å; Y198-V202 WeakPolarHBondContact O-CG2 3.43Å; Y198-V202 PolarHBondContact O-N 3.35Å
199	R	96.7	Very high	95.5	Very high	39 Å²	39	54.3 Å²	54.3	15%	0.147	27%	0.269	C	S	.	.	H	α-helix	trans	-67.7	-44	173.5	-61.9	172.9	-179.8	-103.9	2.7	110.4	L60 I62 P63 A189 G196 D197 L201 V202 H203	L60-R199 HydrophobicContact CD2-CB 3.82Å; L60-R199 HydrophobicContact CD2-CG 3.93Å; I62-R199 VanDerWaalsContact O-CZ 3.23Å; I62-R199 PolarHBondContact O-NH1 3.45Å; I62-R199 PolarHBondContact O-NH2 3.42Å; P63-R199 PolarHBondContact O-NH2 2.81Å; A189-R199 HydrophobicContact CB-CG 4.34Å; G196-R199 WeakPolarHBondContact O-CB 3.41Å; G196-R199 PolarHBondContact O-N 3.47Å; G196-R199 VanDerWaalsContact O-N 3.08Å; D197-R199 VanDerWaalsContact C-N 3.31Å; D197-R199 PolarHBondContact O-N 3.34Å; R199-L201 VanDerWaalsContact C-N 3.31Å; R199-L201 PolarHBondContact O-N 3.44Å; R199-V202 PolarHBondContact O-N 3Å; R199-H203 PolarHBondContact O-CD2 2.85Å; R199-H203 VanDerWaalsContact O-CD2 3.23Å; R199-H203 PolarHBondContact O-N 3.18Å
200	Q	97.4	Very high	95.6	Very high	78 Å²	78	54.7 Å²	54.7	36%	0.364	27%	0.27	S	S	.	.	H	α-helix	trans	-62.1	-42	175.7	-173.6	59.5	28	0	0	111	G196 D197 V202 H203 E204	G196-Q200 PolarHBondContact O-N 3.34Å; D197-Q200 PolarHBondContact O-N 3.06Å; Q200-V202 VanDerWaalsContact C-N 3.31Å; Q200-V202 PolarHBondContact O-N 3.43Å; Q200-H203 PolarHBondContact O-N 2.93Å; Q200-E204 HydrophobicContact CG-CG 4.17Å; Q200-E204 PolarHBondContact NE2-OE1 3.25Å; Q200-E204 WeakPolarHBondContact O-CG 3.34Å; Q200-E204 PolarHBondContact O-N 3.04Å
201	L	98.4	Very high	95.7	Very high	73 Å²	73	59.6 Å²	59.6	38%	0.382	29%	0.287	S	S	.	.	H	α-helix	trans	-57.3	-41.4	178.3	179	61.2	0	0	0	112.4	A185 D197 Y198 R199 H203 E204 L205	A185-L201 HydrophobicContact CB-CD2 3.87Å; A185-L201 HydrophobicContact CB-CG 3.95Å; D197-L201 WeakPolarHBondContact O-CB 3.36Å; D197-L201 PolarHBondContact O-N 3.47Å; Y198-L201 PolarHBondContact O-N 3.23Å; R199-L201 VanDerWaalsContact C-N 3.31Å; R199-L201 PolarHBondContact O-N 3.44Å; L201-H203 VanDerWaalsContact C-N 3.31Å; L201-H203 PolarHBondContact O-N 3.33Å; L201-E204 PolarHBondContact O-N 3.33Å; L201-L205 HydrophobicContact CD1-CD1 4.17Å; L201-L205 HydrophobicContact CD1-CG 4.13Å; L201-L205 HydrophobicContact CG-CD1 4.02Å; L201-L205 HydrophobicContact CG-CG 4.44Å; L201-L205 WeakPolarHBondContact O-CB 3.49Å; L201-L205 VanDerWaalsContact O-CG 3.26Å; L201-L205 WeakPolarHBondContact O-CG 3.49Å; L201-L205 PolarHBondContact O-N 3.49Å
202	V	98.3	Very high	96	Very high	1 Å²	1	54 Å²	54	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-57.3	-46.7	174.4	174.5	0	0	0	0	110.7	L60 R182 A185 V186 Y198 R199 Q200 L205 D206	L60-V202 HydrophobicContact CD1-CG1 4.47Å; L60-V202 HydrophobicContact CD2-CB 4.2Å; L60-V202 HydrophobicContact CD2-CG1 4.44Å; L60-V202 HydrophobicContact CD2-CG2 4.28Å; R182-V202 HydrophobicContact CG-CG1 4.48Å; A185-V202 HydrophobicContact CB-CG2 3.72Å; V186-V202 HydrophobicContact CB-CG2 4.5Å; V186-V202 HydrophobicContact CG2-CG1 4.07Å; V186-V202 HydrophobicContact CG2-CG2 3.68Å; Y198-V202 WeakPolarHBondContact O-CG2 3.43Å; Y198-V202 PolarHBondContact O-N 3.35Å; R199-V202 PolarHBondContact O-N 3Å; Q200-V202 VanDerWaalsContact C-N 3.31Å; Q200-V202 PolarHBondContact O-N 3.43Å; V202-L205 PolarHBondContact O-N 3.43Å; V202-D206 PolarHBondContact O-N 3.47Å; V202-D206 VanDerWaalsContact O-N 3.12Å
203	H	97.6	Very high	96.3	Very high	27 Å²	27	50.2 Å²	50.2	13%	0.125	25%	0.246	C	C	.	.	H	α-helix	trans	-70.3	-35	179.8	-59.8	-45.8	0	0	0	113.5	K57 A58 R199 Q200 L201 D206 Q207	K57-H203 HydrophobicContact CG-CB 4.35Å; A58-H203 PolarHBondContact O-CE1 3.42Å; A58-H203 VanDerWaalsContact O-CE1 3.25Å; R199-H203 PolarHBondContact O-CD2 2.85Å; R199-H203 VanDerWaalsContact O-CD2 3.23Å; R199-H203 PolarHBondContact O-N 3.18Å; Q200-H203 PolarHBondContact O-N 2.93Å; L201-H203 VanDerWaalsContact C-N 3.31Å; L201-H203 PolarHBondContact O-N 3.33Å; H203-D206 PolarHBondContact O-N 2.89Å; H203-Q207 WeakPolarHBondContact O-CG 3.46Å; H203-Q207 PolarHBondContact O-N 3.33Å; H203-Q207 VanDerWaalsContact O-N 3.09Å
204	E	97.6	Very high	96.6	Very high	82 Å²	82	53.8 Å²	53.8	38%	0.383	26%	0.256	S	S	.	.	H	α-helix	trans	-65.4	-41.2	174.2	-70.5	-61.5	155.6	0	0	111.3	Q200 L201 D206 Q207 Y208	Q200-E204 HydrophobicContact CG-CG 4.17Å; Q200-E204 PolarHBondContact NE2-OE1 3.25Å; Q200-E204 WeakPolarHBondContact O-CG 3.34Å; Q200-E204 PolarHBondContact O-N 3.04Å; L201-E204 PolarHBondContact O-N 3.33Å; E204-D206 VanDerWaalsContact C-N 3.34Å; E204-D206 PolarHBondContact O-N 3.41Å; E204-Q207 PolarHBondContact O-N 3.46Å; E204-Y208 WeakPolarHBondContact O-CB 3.19Å; E204-Y208 PolarHBondContact O-N 3.22Å
205	L	98.3	Very high	97	Very high	23 Å²	23	51.1 Å²	51.1	12%	0.12	25%	0.246	C	C	.	.	H	α-helix	trans	-62.9	-40.6	175.6	-72.5	167.1	0	0	0	111.6	E181 A185 L201 V202 Y208 Q209	E181-L205 HydrophobicContact CB-CD1 4.26Å; E181-L205 HydrophobicContact CB-CD2 4.23Å; A185-L205 HydrophobicContact CB-CD1 3.85Å; L201-L205 HydrophobicContact CD1-CD1 4.17Å; L201-L205 HydrophobicContact CD1-CG 4.13Å; L201-L205 HydrophobicContact CG-CD1 4.02Å; L201-L205 HydrophobicContact CG-CG 4.44Å; L201-L205 WeakPolarHBondContact O-CB 3.49Å; L201-L205 VanDerWaalsContact O-CG 3.26Å; L201-L205 WeakPolarHBondContact O-CG 3.49Å; L201-L205 PolarHBondContact O-N 3.49Å; V202-L205 PolarHBondContact O-N 3.43Å; L205-Y208 PolarHBondContact O-N 3.48Å; L205-Q209 VanDerWaalsContact O-CB 3.31Å; L205-Q209 WeakPolarHBondContact O-CB 3.21Å; L205-Q209 PolarHBondContact O-N 3.04Å
206	D	97.8	Very high	97.1	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-62.1	-46.5	176	-71.2	-8.4	0	0	0	111.6	N108 Y178 R182 V202 H203 E204 Q209 Y210	N108-D206 VanDerWaalsContact ND2-CG 3.26Å; N108-D206 PolarHBondContact ND2-OD2 3.43Å; Y178-D206 PolarHBondContact OH-OD1 3.21Å; Y178-D206 VanDerWaalsContact OH-OD1 3.07Å; R182-D206 WeakPolarHBondContact CD-OD1 3.49Å; R182-D206 IonicContact CZ-OD1 3.63Å; R182-D206 IonicContact NE-OD1 2.68Å; R182-D206 PolarHBondContact NE-OD1 3.18Å; R182-D206 IonicContact NE-OD2 2.74Å; R182-D206 IonicContact NH2-OD1 3.76Å; R182-D206 IonicContact NH2-OD2 3.86Å; V202-D206 PolarHBondContact O-N 3.47Å; V202-D206 VanDerWaalsContact O-N 3.12Å; H203-D206 PolarHBondContact O-N 2.89Å; E204-D206 VanDerWaalsContact C-N 3.34Å; E204-D206 PolarHBondContact O-N 3.41Å; D206-Q209 PolarHBondContact O-N 3.03Å; D206-Y210 PolarHBondContact O-N 3.3Å
207	Q	96.2	Very high	97.3	Very high	22 Å²	22	47.9 Å²	47.9	10%	0.103	22%	0.217	C	C	.	.	H	α-helix	trans	-67.9	-40.2	177.9	-71.1	-179.3	43	0	0	112.5	L53 L56 H203 E204 Y210 R211	L53-Q207 HydrophobicContact CB-CG 4.29Å; L56-Q207 HydrophobicContact CB-CG 4.49Å; L56-Q207 HydrophobicContact CD1-CG 4.39Å; H203-Q207 WeakPolarHBondContact O-CG 3.46Å; H203-Q207 PolarHBondContact O-N 3.33Å; H203-Q207 VanDerWaalsContact O-N 3.09Å; E204-Q207 PolarHBondContact O-N 3.46Å; Q207-Y210 PolarHBondContact O-N 3.44Å; Q207-R211 WeakPolarHBondContact O-CG 3.4Å; Q207-R211 PolarHBondContact O-N 3.08Å
208	Y	96.4	Very high	97.3	Very high	96 Å²	96	43.4 Å²	43.4	38%	0.376	19%	0.193	S	C	.	.	H	α-helix	trans	-58.4	-50.8	173.9	173.8	-99.8	0	0	0	110.1	E204 L205 Y210 R211 E212	E204-Y208 WeakPolarHBondContact O-CB 3.19Å; E204-Y208 PolarHBondContact O-N 3.22Å; L205-Y208 PolarHBondContact O-N 3.48Å; Y208-Y210 VanDerWaalsContact C-N 3.31Å; Y208-Y210 PolarHBondContact O-N 3.27Å; Y208-R211 PolarHBondContact O-N 2.91Å; Y208-R211 VanDerWaalsContact O-N 3.09Å; Y208-E212 HydrophobicContact CD1-CG 3.99Å; Y208-E212 HydrophobicContact CD2-CG 4.2Å; Y208-E212 HydrophobicContact CE1-CG 3.5Å; Y208-E212 VanDerWaalsContact CE1-CG 3.5Å; Y208-E212 HydrophobicContact CE2-CG 3.74Å; Y208-E212 HydrophobicContact CG-CG 4.31Å; Y208-E212 WeakPolarHBondContact O-CG 3.3Å; Y208-E212 PolarHBondContact O-N 2.86Å
209	Q	97.4	Very high	97.3	Very high	3 Å²	3	42.7 Å²	42.7	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-38.9	-179.2	-174.7	59.7	22.6	0	0	112.5	V111 Y178 L205 D206 R211 E212 L213	V111-Q209 HydrophobicContact CG1-CB 4.21Å; V111-Q209 HydrophobicContact CG1-CG 3.56Å; Y178-Q209 HydrophobicContact CD1-CG 3.89Å; Y178-Q209 HydrophobicContact CD2-CB 3.47Å; Y178-Q209 VanDerWaalsContact CD2-CB 3.47Å; Y178-Q209 HydrophobicContact CD2-CG 3.6Å; Y178-Q209 HydrophobicContact CE1-CG 4.12Å; Y178-Q209 HydrophobicContact CE2-CB 3.56Å; Y178-Q209 HydrophobicContact CE2-CG 3.84Å; Y178-Q209 HydrophobicContact CG-CB 4.04Å; Y178-Q209 HydrophobicContact CG-CG 3.61Å; L205-Q209 VanDerWaalsContact O-CB 3.31Å; L205-Q209 WeakPolarHBondContact O-CB 3.21Å; L205-Q209 PolarHBondContact O-N 3.04Å; D206-Q209 PolarHBondContact O-N 3.03Å; Q209-R211 PolarHBondContact O-N 3.38Å; Q209-E212 PolarHBondContact O-N 3.27Å; Q209-L213 HydrophobicContact CG-CD1 4.14Å; Q209-L213 HydrophobicContact CG-CG 4.38Å; Q209-L213 WeakPolarHBondContact O-CB 3.44Å; Q209-L213 VanDerWaalsContact O-CG 3.24Å; Q209-L213 WeakPolarHBondContact O-CG 3.31Å; Q209-L213 PolarHBondContact O-N 3.42Å
210	Y	96.7	Very high	97.3	Very high	8 Å²	8	40.9 Å²	40.9	3%	0.031	19%	0.186	C	C	.	.	H	α-helix	trans	-56.9	-48.5	173	172.9	-93	0	0	0	112.3	F48 C50 L53 L56 L114 D206 Q207 Y208 L213 R214	F48-Y210 WeakPolarHBondContact CA-OH 3.47Å; F48-Y210 HydrophobicContact CD1-CE2 4.04Å; F48-Y210 PolarHBondContact O-OH 3.38Å; C50-Y210 HydrophobicContact CB-CE1 4.2Å; C50-Y210 HydrophobicContact CB-CE2 4.09Å; C50-Y210 WeakPolarHBondContact CB-OH 3.32Å; C50-Y210 PolarHBondContact N-OH 3.39Å; L53-Y210 HydrophobicContact CD2-CD1 3.87Å; L53-Y210 HydrophobicContact CD2-CE1 4.06Å; L56-Y210 HydrophobicContact CD1-CD1 3.74Å; L56-Y210 HydrophobicContact CD1-CD2 3.97Å; L56-Y210 HydrophobicContact CD1-CE1 4.44Å; L56-Y210 HydrophobicContact CD1-CG 3.48Å; L56-Y210 VanDerWaalsContact CD1-CG 3.48Å; L56-Y210 HydrophobicContact CD2-CD2 3.87Å; L56-Y210 HydrophobicContact CD2-CE2 4.36Å; L56-Y210 HydrophobicContact CD2-CG 4.24Å; L114-Y210 HydrophobicContact CD1-CD2 3.36Å; L114-Y210 HydrophobicContact CD1-CE2 3.58Å; D206-Y210 PolarHBondContact O-N 3.3Å; Q207-Y210 PolarHBondContact O-N 3.44Å; Y208-Y210 VanDerWaalsContact C-N 3.31Å; Y208-Y210 PolarHBondContact O-N 3.27Å; Y210-L213 PolarHBondContact O-N 3.26Å; Y210-R214 PolarHBondContact O-N 2.93Å
211	R	95.3	Very high	97.4	Very high	112 Å²	112	39.4 Å²	39.4	42%	0.423	18%	0.177	S	C	.	.	H	α-helix	trans	-64.7	-42.8	179.6	-66.7	171.2	-173.6	147.4	-3.5	111.2	Q207 Y208 Q209 R214 L215	Q207-R211 WeakPolarHBondContact O-CG 3.4Å; Q207-R211 PolarHBondContact O-N 3.08Å; Y208-R211 PolarHBondContact O-N 2.91Å; Y208-R211 VanDerWaalsContact O-N 3.09Å; Q209-R211 PolarHBondContact O-N 3.38Å; R211-R214 WeakPolarHBondContact O-CB 3.42Å; R211-R214 PolarHBondContact O-N 3.49Å; R211-L215 PolarHBondContact O-N 2.79Å
212	E	96.6	Very high	97.4	Very high	51 Å²	51	39 Å²	39	24%	0.238	18%	0.176	C	C	.	.	H	α-helix	trans	-62.2	-44.8	177.6	-73	-54.4	113.3	0	0	111.8	Y208 Q209 R214 L215 V216	Y208-E212 HydrophobicContact CD1-CG 3.99Å; Y208-E212 HydrophobicContact CD2-CG 4.2Å; Y208-E212 HydrophobicContact CE1-CG 3.5Å; Y208-E212 VanDerWaalsContact CE1-CG 3.5Å; Y208-E212 HydrophobicContact CE2-CG 3.74Å; Y208-E212 HydrophobicContact CG-CG 4.31Å; Y208-E212 WeakPolarHBondContact O-CG 3.3Å; Y208-E212 PolarHBondContact O-N 2.86Å; Q209-E212 PolarHBondContact O-N 3.27Å; E212-R214 PolarHBondContact O-N 3.28Å; E212-L215 WeakPolarHBondContact O-CB 3.02Å; E212-L215 PolarHBondContact O-N 2.79Å; E212-V216 WeakPolarHBondContact O-CG2 3.26Å; E212-V216 PolarHBondContact O-N 3.4Å
213	L	97.5	Very high	97.3	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-59.9	-37.4	176.2	-70.7	171.5	0	0	0	112.2	F48 V111 L114 L115 V118 Q209 Y210 V216 V217	F48-L213 HydrophobicContact CE1-CB 3.94Å; F48-L213 HydrophobicContact CZ-CB 4.08Å; V111-L213 HydrophobicContact CG1-CD1 4.19Å; L114-L213 HydrophobicContact CB-CD1 3.94Å; L115-L213 HydrophobicContact CD2-CD1 3.93Å; L115-L213 HydrophobicContact CD2-CD2 3.63Å; L115-L213 HydrophobicContact CD2-CG 4.37Å; L115-L213 HydrophobicContact CG-CD1 3.87Å; L115-L213 HydrophobicContact CG-CD2 4.44Å; V118-L213 HydrophobicContact CB-CD2 4.21Å; V118-L213 HydrophobicContact CG1-CD2 4.04Å; V118-L213 HydrophobicContact CG2-CD2 4.41Å; Q209-L213 HydrophobicContact CG-CD1 4.14Å; Q209-L213 HydrophobicContact CG-CG 4.38Å; Q209-L213 WeakPolarHBondContact O-CB 3.44Å; Q209-L213 VanDerWaalsContact O-CG 3.24Å; Q209-L213 WeakPolarHBondContact O-CG 3.31Å; Q209-L213 PolarHBondContact O-N 3.42Å; Y210-L213 PolarHBondContact O-N 3.26Å; L213-V216 PolarHBondContact O-N 2.81Å; L213-V217 WeakPolarHBondContact O-CG2 3.45Å; L213-V217 PolarHBondContact O-N 3.36Å; L213-V217 VanDerWaalsContact O-N 3.09Å
214	R	96.9	Very high	97.4	Very high	103 Å²	103	38.4 Å²	38.4	39%	0.389	17%	0.174	S	C	.	.	H	α-helix	trans	-63.4	-42.8	174.7	-168.9	178.2	172.7	-79.1	0.7	111.7	L44 F48 Y210 R211 E212 V217 L218	L44-R214 HydrophobicContact CD2-CG 3.99Å; F48-R214 HydrophobicContact CB-CG 4.03Å; F48-R214 HydrophobicContact CD1-CB 3.47Å; F48-R214 VanDerWaalsContact CD1-CB 3.47Å; F48-R214 HydrophobicContact CD1-CG 3.76Å; F48-R214 VanDerWaalsContact CE1-CA 3.48Å; F48-R214 HydrophobicContact CE1-CB 3.72Å; F48-R214 HydrophobicContact CE1-CG 4.4Å; F48-R214 VanDerWaalsContact CE1-N 3.32Å; F48-R214 HydrophobicContact CG-CB 4.17Å; F48-R214 HydrophobicContact CG-CG 3.96Å; Y210-R214 PolarHBondContact O-N 2.93Å; R211-R214 WeakPolarHBondContact O-CB 3.42Å; R211-R214 PolarHBondContact O-N 3.49Å; E212-R214 PolarHBondContact O-N 3.28Å; R214-V217 PolarHBondContact O-N 3.47Å; R214-L218 WeakPolarHBondContact O-CG 3.45Å; R214-L218 PolarHBondContact O-N 3.49Å; R214-L218 VanDerWaalsContact O-N 3.1Å
215	L	96.6	Very high	97.4	Very high	84 Å²	84	36.4 Å²	36.4	44%	0.44	17%	0.172	S	C	.	.	H	α-helix	trans	-65.3	-40.1	176.6	-69.7	177.7	0	0	0	111.7	R211 E212 V217 L218 D219	R211-L215 PolarHBondContact O-N 2.79Å; E212-L215 WeakPolarHBondContact O-CB 3.02Å; E212-L215 PolarHBondContact O-N 2.79Å; L215-V217 PolarHBondContact O-N 2.91Å; L215-L218 HydrophobicContact CD2-CD1 4.27Å; L215-L218 WeakPolarHBondContact O-CB 3.26Å; L215-L218 PolarHBondContact O-N 2.91Å; L215-D219 WeakPolarHBondContact O-CB 3.49Å; L215-D219 PolarHBondContact O-N 3.26Å
216	V	97.8	Very high	97.3	Very high	14 Å²	14	38.9 Å²	38.9	9%	0.085	19%	0.187	C	C	.	.	H	α-helix	trans	-57.6	-47	174.4	170	0	0	0	0	111	V118 I122 F171 E212 L213 L218 D219 I220	V118-V216 HydrophobicContact CG1-CB 4.47Å; V118-V216 HydrophobicContact CG1-CG1 3.78Å; I122-V216 HydrophobicContact CD1-CG1 4.04Å; I122-V216 HydrophobicContact CG1-CG1 4.06Å; F171-V216 HydrophobicContact CB-CG1 4.3Å; F171-V216 HydrophobicContact CB-CG2 4.3Å; F171-V216 HydrophobicContact CD1-CG2 3.77Å; F171-V216 HydrophobicContact CD2-CG1 3.85Å; F171-V216 HydrophobicContact CD2-CG2 4.43Å; F171-V216 HydrophobicContact CE1-CG2 4.09Å; F171-V216 HydrophobicContact CE2-CG1 4.25Å; F171-V216 HydrophobicContact CG-CG1 4.05Å; F171-V216 HydrophobicContact CG-CG2 3.94Å; E212-V216 WeakPolarHBondContact O-CG2 3.26Å; E212-V216 PolarHBondContact O-N 3.4Å; L213-V216 PolarHBondContact O-N 2.81Å; V216-L218 PolarHBondContact O-N 2.89Å; V216-D219 PolarHBondContact O-N 2.94Å; V216-I220 HydrophobicContact CG1-CD1 3.81Å; V216-I220 HydrophobicContact CG1-CG1 4.37Å; V216-I220 VanDerWaalsContact O-CG1 3.27Å; V216-I220 WeakPolarHBondContact O-CG1 3.4Å; V216-I220 PolarHBondContact O-N 3.42Å
217	V	98.2	Very high	97.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.1	-41.5	178.6	177.3	0	0	0	0	111.8	L40 L43 L44 F48 V118 L213 R214 L215 D219 I220 R221	L40-V217 HydrophobicContact CB-CG1 4.43Å; L40-V217 HydrophobicContact CD2-CG1 4.15Å; L43-V217 HydrophobicContact CD2-CG1 3.94Å; L43-V217 HydrophobicContact CD2-CG2 4.11Å; L43-V217 HydrophobicContact CG-CG1 4.39Å; L44-V217 HydrophobicContact CD1-CG1 4.13Å; L44-V217 HydrophobicContact CD2-CB 3.96Å; L44-V217 HydrophobicContact CD2-CG1 3.76Å; L44-V217 HydrophobicContact CG-CB 4.38Å; L44-V217 HydrophobicContact CG-CG1 3.62Å; F48-V217 HydrophobicContact CE2-CB 4.45Å; F48-V217 HydrophobicContact CE2-CG2 3.83Å; F48-V217 HydrophobicContact CZ-CG2 4.03Å; V118-V217 HydrophobicContact CB-CG2 4.5Å; V118-V217 HydrophobicContact CG1-CG2 4.28Å; V118-V217 HydrophobicContact CG2-CG2 3.51Å; L213-V217 WeakPolarHBondContact O-CG2 3.45Å; L213-V217 PolarHBondContact O-N 3.36Å; L213-V217 VanDerWaalsContact O-N 3.09Å; R214-V217 PolarHBondContact O-N 3.47Å; L215-V217 PolarHBondContact O-N 2.91Å; V217-D219 VanDerWaalsContact C-N 3.31Å; V217-D219 PolarHBondContact O-N 3.37Å; V217-I220 PolarHBondContact O-N 3.03Å; V217-R221 WeakPolarHBondContact O-CB 3.46Å; V217-R221 PolarHBondContact O-N 3.26Å
218	L	97.8	Very high	97.3	Very high	33 Å²	33	41.1 Å²	41.1	17%	0.173	20%	0.197	C	C	.	.	H	α-helix	trans	-59	-44	173.4	-77.2	165.9	0	0	0	111.6	L44 R214 L215 V216 R221 N222	L44-L218 HydrophobicContact CD1-CD2 3.53Å; L44-L218 HydrophobicContact CD1-CG 3.99Å; L44-L218 HydrophobicContact CD2-CD2 4.32Å; L44-L218 HydrophobicContact CD2-CG 3.98Å; R214-L218 WeakPolarHBondContact O-CG 3.45Å; R214-L218 PolarHBondContact O-N 3.49Å; R214-L218 VanDerWaalsContact O-N 3.1Å; L215-L218 HydrophobicContact CD2-CD1 4.27Å; L215-L218 WeakPolarHBondContact O-CB 3.26Å; L215-L218 PolarHBondContact O-N 2.91Å; V216-L218 PolarHBondContact O-N 2.89Å; L218-R221 PolarHBondContact O-N 3.42Å; L218-N222 WeakPolarHBondContact O-CB 3.16Å; L218-N222 PolarHBondContact O-N 3.39Å; L218-N222 PolarHBondContact O-ND2 3.31Å; L218-N222 PolarHBondContact O-OD1 3.45Å
219	D	97.3	Very high	97.4	Very high	44 Å²	44	40 Å²	40	24%	0.235	20%	0.198	C	C	.	.	H	α-helix	trans	-67.1	-40.6	179.5	-88	-22.7	0	0	0	112.8	K167 F171 L215 V216 V217 N222 T223	K167-D219 WeakPolarHBondContact CE-OD2 2.75Å; K167-D219 IonicContact NZ-OD1 3.75Å; K167-D219 PolarHBondContact NZ-OD1 3.42Å; K167-D219 IonicContact NZ-OD2 3.51Å; K167-D219 PolarHBondContact NZ-OD2 2.97Å; F171-D219 HydrophobicContact CE2-CB 4.11Å; F171-D219 HydrophobicContact CZ-CB 3.68Å; L215-D219 WeakPolarHBondContact O-CB 3.49Å; L215-D219 PolarHBondContact O-N 3.26Å; V216-D219 PolarHBondContact O-N 2.94Å; V217-D219 VanDerWaalsContact C-N 3.31Å; V217-D219 PolarHBondContact O-N 3.37Å; D219-N222 PolarHBondContact O-N 2.98Å; D219-T223 VanDerWaalsContact O-CB 3.27Å; D219-T223 WeakPolarHBondContact O-CB 3.34Å; D219-T223 PolarHBondContact O-N 2.94Å; D219-T223 PolarHBondContact O-OG1 3.4Å
220	I	98.1	Very high	97.4	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-60.6	-48.4	173.8	-67.8	168.8	0	0	0	109.6	L40 E121 I122 L125 V216 V217 N222 T223 Y224	L40-I220 HydrophobicContact CD1-CB 4.35Å; L40-I220 HydrophobicContact CD1-CG2 3.56Å; L40-I220 HydrophobicContact CD2-CG2 4.34Å; E121-I220 HydrophobicContact CB-CD1 4.15Å; I122-I220 HydrophobicContact CG1-CD1 3.83Å; L125-I220 HydrophobicContact CB-CG2 4.37Å; L125-I220 HydrophobicContact CD2-CB 4.18Å; L125-I220 HydrophobicContact CD2-CG1 3.98Å; L125-I220 HydrophobicContact CD2-CG2 3.92Å; V216-I220 HydrophobicContact CG1-CD1 3.81Å; V216-I220 HydrophobicContact CG1-CG1 4.37Å; V216-I220 VanDerWaalsContact O-CG1 3.27Å; V216-I220 WeakPolarHBondContact O-CG1 3.4Å; V216-I220 PolarHBondContact O-N 3.42Å; V217-I220 PolarHBondContact O-N 3.03Å; I220-N222 PolarHBondContact O-N 2.92Å; I220-T223 WeakPolarHBondContact O-CB 3.41Å; I220-T223 PolarHBondContact O-N 3.07Å; I220-Y224 HydrophobicContact CG2-CD2 4.07Å; I220-Y224 HydrophobicContact CG2-CE2 3.7Å; I220-Y224 VanDerWaalsContact O-CD2 3.3Å; I220-Y224 WeakPolarHBondContact O-CD2 3.48Å; I220-Y224 PolarHBondContact O-N 2.82Å; I220-Y224 VanDerWaalsContact O-N 3.09Å
221	R	98.4	Very high	97.4	Very high	46 Å²	46	41.3 Å²	41.3	17%	0.174	20%	0.204	C	C	.	.	H	α-helix	trans	-59.5	-48.3	178	-175.3	-159.1	66.3	-167	-6.2	111.4	I37 L40 V217 L218 T223 Y224 A225	I37-R221 HydrophobicContact CG2-CG 4.06Å; L40-R221 HydrophobicContact CB-CB 3.94Å; L40-R221 HydrophobicContact CB-CG 4.16Å; L40-R221 HydrophobicContact CD1-CB 4.01Å; V217-R221 WeakPolarHBondContact O-CB 3.46Å; V217-R221 PolarHBondContact O-N 3.26Å; L218-R221 PolarHBondContact O-N 3.42Å; R221-T223 VanDerWaalsContact C-N 3.27Å; R221-T223 PolarHBondContact O-N 2.85Å; R221-Y224 PolarHBondContact O-N 3.04Å; R221-A225 PolarHBondContact O-N 3.17Å
222	N	98	Very high	97.4	Very high	65 Å²	65	39.2 Å²	39.2	35%	0.348	20%	0.202	S	C	.	.	H	α-helix	trans	-63.5	-36.5	179.3	-67.2	-9.9	0	0	0	111.2	L218 D219 I220 A225 V226	L218-N222 WeakPolarHBondContact O-CB 3.16Å; L218-N222 PolarHBondContact O-N 3.39Å; L218-N222 PolarHBondContact O-ND2 3.31Å; L218-N222 PolarHBondContact O-OD1 3.45Å; D219-N222 PolarHBondContact O-N 2.98Å; I220-N222 PolarHBondContact O-N 2.92Å; N222-A225 PolarHBondContact O-N 2.92Å; N222-V226 WeakPolarHBondContact O-CB 3.37Å; N222-V226 VanDerWaalsContact O-CG2 3.31Å; N222-V226 WeakPolarHBondContact O-CG2 3.34Å; N222-V226 PolarHBondContact O-N 3.02Å
223	T	97.3	Very high	97.5	Very high	16 Å²	16	43.9 Å²	43.9	10%	0.098	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-49.6	175.8	-62.8	0	0	0	0	111.1	L125 T164 D219 I220 R221 A225 V226 L227	L125-T223 HydrophobicContact CD1-CG2 4.05Å; L125-T223 HydrophobicContact CD2-CG2 4.03Å; T164-T223 HydrophobicContact CG2-CG2 3.29Å; D219-T223 VanDerWaalsContact O-CB 3.27Å; D219-T223 WeakPolarHBondContact O-CB 3.34Å; D219-T223 PolarHBondContact O-N 2.94Å; D219-T223 PolarHBondContact O-OG1 3.4Å; I220-T223 WeakPolarHBondContact O-CB 3.41Å; I220-T223 PolarHBondContact O-N 3.07Å; R221-T223 VanDerWaalsContact C-N 3.27Å; R221-T223 PolarHBondContact O-N 2.85Å; T223-A225 VanDerWaalsContact C-N 3.29Å; T223-A225 PolarHBondContact O-N 3.08Å; T223-V226 PolarHBondContact O-N 3.42Å; T223-L227 HydrophobicContact CG2-CD1 3.75Å; T223-L227 HydrophobicContact CG2-CG 4.16Å; T223-L227 WeakPolarHBondContact O-CB 3.37Å; T223-L227 VanDerWaalsContact O-CG 3.24Å; T223-L227 WeakPolarHBondContact O-CG 3.45Å; T223-L227 PolarHBondContact O-N 2.92Å
224	Y	98.3	Very high	97.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-57.1	-42.7	175.9	-76.5	-63.3	0	0	0	112.2	F32 F33 K36 L40 L125 I220 R221 F228	F32-Y224 HydrophobicContact CD1-CE1 4.46Å; F32-Y224 HydrophobicContact CE1-CE1 4.2Å; F33-Y224 HydrophobicContact CB-CD1 4.34Å; F33-Y224 AromaticContact CD1-CD1 3.64Å; F33-Y224 HydrophobicContact CD1-CD1 3.64Å; F33-Y224 AromaticContact CD1-CE1 3.85Å; F33-Y224 HydrophobicContact CD1-CE1 3.85Å; F33-Y224 AromaticContact CD2-CD1 3.93Å; F33-Y224 HydrophobicContact CD2-CD1 3.93Å; F33-Y224 AromaticContact CE1-CD1 3.81Å; F33-Y224 HydrophobicContact CE1-CD1 3.81Å; F33-Y224 AromaticContact CE1-CE1 3.75Å; F33-Y224 HydrophobicContact CE1-CE1 3.75Å; F33-Y224 HydrophobicContact CE2-CD1 4.11Å; F33-Y224 AromaticContact CG-CD1 3.68Å; F33-Y224 HydrophobicContact CG-CD1 3.68Å; F33-Y224 HydrophobicContact CG-CE1 4.36Å; F33-Y224 HydrophobicContact CZ-CD1 4.04Å; F33-Y224 HydrophobicContact CZ-CE1 4.22Å; K36-Y224 HydrophobicContact CB-CD2 4.05Å; K36-Y224 HydrophobicContact CB-CE2 3.97Å; K36-Y224 HydrophobicContact CB-CG 4.39Å; K36-Y224 HydrophobicContact CG-CE2 4.29Å; L40-Y224 HydrophobicContact CD1-CD2 3.8Å; L40-Y224 HydrophobicContact CD1-CE2 3.93Å; L125-Y224 WeakPolarHBondContact CA-OH 3.37Å; L125-Y224 HydrophobicContact CB-CE2 4.43Å; L125-Y224 HydrophobicContact CD1-CD1 4.1Å; L125-Y224 HydrophobicContact CD1-CD2 4.44Å; L125-Y224 HydrophobicContact CD1-CE1 3.63Å; L125-Y224 HydrophobicContact CD1-CE2 4.01Å; L125-Y224 HydrophobicContact CD1-CG 4.49Å; I220-Y224 HydrophobicContact CG2-CD2 4.07Å; I220-Y224 HydrophobicContact CG2-CE2 3.7Å; I220-Y224 VanDerWaalsContact O-CD2 3.3Å; I220-Y224 WeakPolarHBondContact O-CD2 3.48Å; I220-Y224 PolarHBondContact O-N 2.82Å; I220-Y224 VanDerWaalsContact O-N 3.09Å; R221-Y224 PolarHBondContact O-N 3.04Å; Y224-F228 VanDerWaalsContact O-CB 3.24Å; Y224-F228 WeakPolarHBondContact O-CB 3.33Å; Y224-F228 PolarHBondContact O-N 2.89Å
225	A	98.1	Very high	97.5	Very high	40 Å²	40	44.3 Å²	44.3	33%	0.331	23%	0.227	S	C	.	.	H	α-helix	trans	-64.9	-45.9	178.7	0	0	0	0	0	112.6	I37 R221 N222 T223 F228 D229	I37-A225 HydrophobicContact CD1-CB 3.91Å; I37-A225 HydrophobicContact CG1-CB 4.49Å; R221-A225 PolarHBondContact O-N 3.17Å; N222-A225 PolarHBondContact O-N 2.92Å; T223-A225 VanDerWaalsContact C-N 3.29Å; T223-A225 PolarHBondContact O-N 3.08Å; A225-F228 PolarHBondContact O-N 3.24Å; A225-D229 WeakPolarHBondContact O-CB 3.38Å; A225-D229 PolarHBondContact O-N 2.91Å
226	V	97.6	Very high	97.5	Very high	74 Å²	74	46.3 Å²	46.3	45%	0.448	24%	0.238	S	C	.	.	H	α-helix	trans	-63.9	-44.7	178.7	168.3	0	0	0	0	111	L160 N222 T223 D229 I230	L160-V226 HydrophobicContact CD2-CG1 3.98Å; N222-V226 WeakPolarHBondContact O-CB 3.37Å; N222-V226 VanDerWaalsContact O-CG2 3.31Å; N222-V226 WeakPolarHBondContact O-CG2 3.34Å; N222-V226 PolarHBondContact O-N 3.02Å; T223-V226 PolarHBondContact O-N 3.42Å; V226-D229 PolarHBondContact O-N 3.04Å; V226-I230 VanDerWaalsContact O-CG2 3.24Å; V226-I230 WeakPolarHBondContact O-CG2 3.42Å; V226-I230 PolarHBondContact O-N 2.68Å
227	L	96.1	Very high	97.4	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-65.6	-42.7	178.7	-67.4	178.7	0	0	0	111.7	F33 L129 L160 L161 T223 I231	F33-L227 HydrophobicContact CD2-CB 4.31Å; F33-L227 HydrophobicContact CE2-CB 3.73Å; F33-L227 HydrophobicContact CE2-CD1 4.19Å; L129-L227 HydrophobicContact CD1-CD1 3.55Å; L160-L227 HydrophobicContact CD2-CD2 4.36Å; L160-L227 HydrophobicContact CG-CD2 4.49Å; L161-L227 HydrophobicContact CD2-CD1 4.26Å; L161-L227 HydrophobicContact CD2-CD2 3.54Å; L161-L227 HydrophobicContact CG-CD2 4.36Å; T223-L227 HydrophobicContact CG2-CD1 3.75Å; T223-L227 HydrophobicContact CG2-CG 4.16Å; T223-L227 WeakPolarHBondContact O-CB 3.37Å; T223-L227 VanDerWaalsContact O-CG 3.24Å; T223-L227 WeakPolarHBondContact O-CG 3.45Å; T223-L227 PolarHBondContact O-N 2.92Å; L227-I231 HydrophobicContact CB-CD1 4.48Å; L227-I231 VanDerWaalsContact O-CB 3.24Å; L227-I231 WeakPolarHBondContact O-CB 3.2Å; L227-I231 WeakPolarHBondContact O-CD1 3.44Å; L227-I231 WeakPolarHBondContact O-CG1 3.42Å; L227-I231 PolarHBondContact O-N 3.33Å; L227-I231 VanDerWaalsContact O-N 3.07Å
228	F	97	Very high	97.3	Very high	70 Å²	70	49.8 Å²	49.8	31%	0.307	25%	0.252	S	S	.	.	H	α-helix	trans	-57.5	-49.5	173.4	178	-89.9	0	0	0	111.3	L29 F33 P34 Y224 A225 N232	L29-F228 WeakPolarHBondContact O-CD2 3.5Å; L29-F228 WeakPolarHBondContact O-CE2 3.28Å; F33-F228 HydrophobicContact CB-CD2 4.38Å; F33-F228 HydrophobicContact CD2-CB 4.29Å; P34-F228 HydrophobicContact CG-CD2 4.11Å; P34-F228 HydrophobicContact CG-CE2 3.76Å; P34-F228 HydrophobicContact CG-CZ 4.42Å; Y224-F228 VanDerWaalsContact O-CB 3.24Å; Y224-F228 WeakPolarHBondContact O-CB 3.33Å; Y224-F228 PolarHBondContact O-N 2.89Å; A225-F228 PolarHBondContact O-N 3.24Å; F228-N232 WeakPolarHBondContact CD1-ND2 3.45Å; F228-N232 VanDerWaalsContact CD2-ND2 3.27Å; F228-N232 WeakPolarHBondContact CD2-ND2 3.38Å; F228-N232 VanDerWaalsContact CE1-ND2 3.28Å; F228-N232 WeakPolarHBondContact CE1-ND2 3.31Å; F228-N232 WeakPolarHBondContact CE2-ND2 3.18Å; F228-N232 WeakPolarHBondContact CG-ND2 3.33Å; F228-N232 WeakPolarHBondContact CZ-ND2 3.33Å; F228-N232 VanDerWaalsContact O-CB 3.28Å; F228-N232 WeakPolarHBondContact O-CB 3.42Å; F228-N232 PolarHBondContact O-N 2.97Å; F228-N232 PolarHBondContact O-ND2 3Å
229	D	98.1	Very high	97.2	Very high	73 Å²	73	51.7 Å²	51.7	39%	0.39	26%	0.259	S	S	.	.	H	α-helix	trans	-63.3	-52.2	-176.9	-179.4	73.4	0	0	0	112.4	A225 V226 I231 N232 K233	A225-D229 WeakPolarHBondContact O-CB 3.38Å; A225-D229 PolarHBondContact O-N 2.91Å; V226-D229 PolarHBondContact O-N 3.04Å; D229-I231 PolarHBondContact O-N 3.03Å; D229-N232 PolarHBondContact O-N 3.01Å; D229-K233 WeakPolarHBondContact O-CB 3.36Å; D229-K233 VanDerWaalsContact O-CG 3.31Å; D229-K233 WeakPolarHBondContact O-CG 3.37Å; D229-K233 PolarHBondContact O-N 3.4Å; D229-K233 WeakPolarHBondContact OD1-CE 3.34Å; D229-K233 IonicContact OD1-NZ 2.69Å; D229-K233 PolarHBondContact OD1-NZ 3.43Å; D229-K233 WeakPolarHBondContact OD2-CE 3.24Å; D229-K233 IonicContact OD2-NZ 2.98Å; D229-K233 PolarHBondContact OD2-NZ 3.42Å
230	I	97.6	Very high	97.1	Very high	37 Å²	37	54.1 Å²	54.1	19%	0.19	27%	0.268	C	S	.	.	H	α-helix	trans	-67.3	-38.7	-176.3	-164.2	175.8	0	0	0	111.9	V157 L160 V226 N234	V157-I230 HydrophobicContact CG2-CD1 4.26Å; V157-I230 HydrophobicContact CG2-CG1 4.25Å; L160-I230 HydrophobicContact CD2-CB 4.49Å; L160-I230 HydrophobicContact CD2-CD1 3.59Å; L160-I230 HydrophobicContact CD2-CG2 3.83Å; V226-I230 VanDerWaalsContact O-CG2 3.24Å; V226-I230 WeakPolarHBondContact O-CG2 3.42Å; V226-I230 PolarHBondContact O-N 2.68Å; I230-N234 WeakPolarHBondContact O-CB 3.41Å; I230-N234 PolarHBondContact O-N 3.43Å; I230-N234 PolarHBondContact O-ND2 3.44Å
231	I	96.6	Very high	96.9	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-70.5	-44.4	-179.6	-67.4	169	0	0	0	110	L29 V132 W135 V157 L227 D229 N234 Y235 I238	L29-I231 HydrophobicContact CD1-CG2 3.57Å; L29-I231 HydrophobicContact CD2-CB 4.14Å; L29-I231 HydrophobicContact CD2-CD1 3.64Å; L29-I231 HydrophobicContact CD2-CG1 4.49Å; L29-I231 HydrophobicContact CD2-CG2 3.99Å; L29-I231 HydrophobicContact CG-CG2 4.42Å; V132-I231 HydrophobicContact CG1-CD1 3.57Å; W135-I231 HydrophobicContact CH2-CG2 4.24Å; W135-I231 HydrophobicContact CZ3-CG2 3.96Å; V157-I231 HydrophobicContact CG1-CG1 4.09Å; L227-I231 HydrophobicContact CB-CD1 4.48Å; L227-I231 VanDerWaalsContact O-CB 3.24Å; L227-I231 WeakPolarHBondContact O-CB 3.2Å; L227-I231 WeakPolarHBondContact O-CD1 3.44Å; L227-I231 WeakPolarHBondContact O-CG1 3.42Å; L227-I231 PolarHBondContact O-N 3.33Å; L227-I231 VanDerWaalsContact O-N 3.07Å; D229-I231 PolarHBondContact O-N 3.03Å; I231-N234 CarbonylContact O-C 3.48Å; I231-N234 PolarHBondContact O-N 3.49Å; I231-Y235 VanDerWaalsContact O-CA 3.26Å; I231-Y235 WeakPolarHBondContact O-CA 3.39Å; I231-Y235 WeakPolarHBondContact O-CB 3.48Å; I231-Y235 PolarHBondContact O-N 3.43Å; I231-I238 HydrophobicContact CB-CD1 4.39Å; I231-I238 HydrophobicContact CG1-CD1 4.46Å; I231-I238 HydrophobicContact CG2-CD1 4.03Å
232	N	96.6	Very high	96.7	Very high	69 Å²	69	54.8 Å²	54.8	37%	0.369	27%	0.271	S	S	.	.	H	α-helix	trans	-64	-43.8	179	-78.8	-48.8	0	0	0	112.3	F228 D229 N234 Y235	F228-N232 WeakPolarHBondContact CD1-ND2 3.45Å; F228-N232 VanDerWaalsContact CD2-ND2 3.27Å; F228-N232 WeakPolarHBondContact CD2-ND2 3.38Å; F228-N232 VanDerWaalsContact CE1-ND2 3.28Å; F228-N232 WeakPolarHBondContact CE1-ND2 3.31Å; F228-N232 WeakPolarHBondContact CE2-ND2 3.18Å; F228-N232 WeakPolarHBondContact CG-ND2 3.33Å; F228-N232 WeakPolarHBondContact CZ-ND2 3.33Å; F228-N232 VanDerWaalsContact O-CB 3.28Å; F228-N232 WeakPolarHBondContact O-CB 3.42Å; F228-N232 PolarHBondContact O-N 2.97Å; F228-N232 PolarHBondContact O-ND2 3Å; D229-N232 PolarHBondContact O-N 3.01Å; N232-N234 PolarHBondContact O-N 3.28Å; N232-Y235 PolarHBondContact O-N 3.07Å
233	K	98.1	Very high	96.2	Very high	148 Å²	148	53.6 Å²	53.6	64%	0.643	28%	0.275	S	S	*	.	H	α-helix	trans	-60.4	-28.7	177.4	-77.1	172.4	176.3	164.5	0	113.3	D229	D229-K233 WeakPolarHBondContact O-CB 3.36Å; D229-K233 VanDerWaalsContact O-CG 3.31Å; D229-K233 WeakPolarHBondContact O-CG 3.37Å; D229-K233 PolarHBondContact O-N 3.4Å; D229-K233 WeakPolarHBondContact OD1-CE 3.34Å; D229-K233 IonicContact OD1-NZ 2.69Å; D229-K233 PolarHBondContact OD1-NZ 3.43Å; D229-K233 WeakPolarHBondContact OD2-CE 3.24Å; D229-K233 IonicContact OD2-NZ 2.98Å; D229-K233 PolarHBondContact OD2-NZ 3.42Å
234	N	97.8	Very high	95	Very high	50 Å²	50	59 Å²	59	27%	0.267	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	10.6	-175.2	-63.4	-76.4	0	0	0	113	V153 I230 I231 N232 D236 K237 I238	V153-N234 HydrophobicContact CG1-CB 3.79Å; I230-N234 WeakPolarHBondContact O-CB 3.41Å; I230-N234 PolarHBondContact O-N 3.43Å; I230-N234 PolarHBondContact O-ND2 3.44Å; I231-N234 CarbonylContact O-C 3.48Å; I231-N234 PolarHBondContact O-N 3.49Å; N232-N234 PolarHBondContact O-N 3.28Å; N234-D236 VanDerWaalsContact C-N 3.34Å; N234-D236 PolarHBondContact O-N 3.14Å; N234-K237 PolarHBondContact O-N 2.94Å; N234-I238 HydrophobicContact CB-CD1 4.08Å; N234-I238 HydrophobicContact CB-CG1 4.35Å; N234-I238 WeakPolarHBondContact O-CG1 3.44Å; N234-I238 PolarHBondContact O-N 2.92Å
235	Y	96.6	Very high	93	Very high	65 Å²	65	62.3 Å²	62.3	26%	0.255	34%	0.337	S	S	.	.	H	α-helix	trans	-56	-46	-167.7	-176.1	-92.4	0	0	0	112.5	E26 W135 I231 N232 K237 I238 K239	E26-Y235 HydrophobicContact CG-CE2 4.46Å; E26-Y235 PolarHBondContact OE1-OH 2.94Å; W135-Y235 HydrophobicContact CH2-CD2 4.14Å; W135-Y235 AromaticContact CH2-CE2 3.85Å; W135-Y235 HydrophobicContact CH2-CE2 3.85Å; W135-Y235 HydrophobicContact CZ2-CE2 4.03Å; I231-Y235 VanDerWaalsContact O-CA 3.26Å; I231-Y235 WeakPolarHBondContact O-CA 3.39Å; I231-Y235 WeakPolarHBondContact O-CB 3.48Å; I231-Y235 PolarHBondContact O-N 3.43Å; N232-Y235 PolarHBondContact O-N 3.07Å; Y235-K237 VanDerWaalsContact C-N 3.31Å; Y235-K237 PolarHBondContact O-N 3Å; Y235-I238 PolarHBondContact O-N 3.17Å; Y235-I238 VanDerWaalsContact O-N 3.14Å; Y235-K239 HydrophobicContact CE1-CG 4.04Å; Y235-K239 PolarHBondContact O-N 3.12Å
236	D	95.7	Very high	90.7	Very high	127 Å²	127	70.2 Å²	70.2	68%	0.679	36%	0.364	S	S	*	.	H	α-helix	trans	-59.8	-40	179	-69.7	-25.6	0	0	0	112.5	N234 K240	N234-D236 VanDerWaalsContact C-N 3.34Å; N234-D236 PolarHBondContact O-N 3.14Å; D236-K240 CarbonylContact O-C 3.44Å; D236-K240 WeakPolarHBondContact O-CA 3.45Å; D236-K240 WeakPolarHBondContact O-CB 3.41Å; D236-K240 PolarHBondContact O-N 3.2Å
237	K	96.9	Very high	88.2	Confident	86 Å²	86	70.9 Å²	70.9	37%	0.374	38%	0.377	S	S	.	.	H	α-helix	trans	-76.3	-28.9	178.3	-66.3	-59.5	-176.6	-174.4	0	112.4	V153 N234 Y235 P241	V153-K237 HydrophobicContact CB-CB 4.18Å; V153-K237 HydrophobicContact CG1-CB 3.9Å; V153-K237 HydrophobicContact CG2-CB 4.47Å; N234-K237 PolarHBondContact O-N 2.94Å; Y235-K237 VanDerWaalsContact C-N 3.31Å; Y235-K237 PolarHBondContact O-N 3Å; K237-P241 WeakPolarHBondContact O-CA 3.44Å; K237-P241 WeakPolarHBondContact O-CB 3.43Å
238	I	96.1	Very high	85.9	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-68.7	-47.2	173.1	-66.5	165.2	0	0	0	110.4	W135 V136 Q139 Q154 V157 I231 N234 Y235	W135-I238 HydrophobicContact CH2-CG2 3.94Å; W135-I238 HydrophobicContact CZ2-CG2 4.36Å; W135-I238 HydrophobicContact CZ3-CG2 4.19Å; V136-I238 HydrophobicContact CG2-CG2 4.18Å; Q139-I238 VanDerWaalsContact CB-O 3.25Å; Q139-I238 WeakPolarHBondContact CB-O 3.49Å; Q139-I238 HydrophobicContact CG-CG2 4.46Å; Q154-I238 PolarHBondContact NE2-O 2.71Å; V157-I238 HydrophobicContact CG1-CD1 4.21Å; V157-I238 HydrophobicContact CG2-CD1 4.16Å; I231-I238 HydrophobicContact CB-CD1 4.39Å; I231-I238 HydrophobicContact CG1-CD1 4.46Å; I231-I238 HydrophobicContact CG2-CD1 4.03Å; N234-I238 HydrophobicContact CB-CD1 4.08Å; N234-I238 HydrophobicContact CB-CG1 4.35Å; N234-I238 WeakPolarHBondContact O-CG1 3.44Å; N234-I238 PolarHBondContact O-N 2.92Å; Y235-I238 PolarHBondContact O-N 3.17Å; Y235-I238 VanDerWaalsContact O-N 3.14Å
239	K	94.6	Very high	83.4	Confident	74 Å²	74	83.2 Å²	83.2	32%	0.322	44%	0.444	S	S	.	.	H	α-helix	trans	-75.3	-37.7	-179.6	-103.4	-88.4	-172	164.3	0	113.5	E26 W135 Y235	E26-K239 WeakPolarHBondContact OE1-CE 3.37Å; E26-K239 IonicContact OE1-NZ 2.9Å; E26-K239 PolarHBondContact OE1-NZ 3Å; W135-K239 HydrophobicContact CZ2-CG 4.44Å; Y235-K239 HydrophobicContact CE1-CG 4.04Å; Y235-K239 PolarHBondContact O-N 3.12Å
240	K	95	Very high	80.7	Confident	95 Å²	95	93.7 Å²	93.7	41%	0.413	48%	0.48	S	S	.	.			trans	-134.7	69	-173.1	-59.7	179.4	-176.9	-176.5	0	110.2	D236 R242 G243 D244	D236-K240 CarbonylContact O-C 3.44Å; D236-K240 WeakPolarHBondContact O-CA 3.45Å; D236-K240 WeakPolarHBondContact O-CB 3.41Å; D236-K240 PolarHBondContact O-N 3.2Å; K240-R242 PolarHBondContact O-N 3.28Å; K240-R242 VanDerWaalsContact O-N 3.08Å; K240-G243 PolarHBondContact O-N 3.06Å; K240-D244 VanDerWaalsContact CD-OD1 3.26Å; K240-D244 WeakPolarHBondContact CD-OD1 3.33Å; K240-D244 WeakPolarHBondContact CE-OD1 3.31Å; K240-D244 IonicContact NZ-OD1 2.81Å; K240-D244 PolarHBondContact NZ-OD1 2.98Å; K240-D244 IonicContact NZ-OD2 3.72Å; K240-D244 PolarHBondContact NZ-OD2 3.44Å
241	P	94.9	Very high	79.9	Confident	10 Å²	10	96.5 Å²	96.5	7%	0.065	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.5	-175	23	-34.3	0	0	0	113.5	P141 G150 V151 K237	P141-P241 HydrophobicContact CB-CG 4.45Å; P141-P241 HydrophobicContact CG-CG 3.78Å; G150-P241 VanDerWaalsContact C-CB 3.49Å; G150-P241 WeakPolarHBondContact CA-O 3.25Å; V151-P241 HydrophobicContact CG2-CB 4.26Å; K237-P241 WeakPolarHBondContact O-CA 3.44Å; K237-P241 WeakPolarHBondContact O-CB 3.43Å
242	R	93.8	Very high	79	Confident	50 Å²	50	101.6 Å²	101.6	19%	0.189	52%	0.52	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	9.4	176.5	-65.1	-170.7	177.6	137.5	9.6	114.3	R142 E144 N147 N148 K240	R142-R242 PolarHBondContact O-NH1 3.37Å; R142-R242 PolarHBondContact O-NH2 3.46Å; E144-R242 VanDerWaalsContact CD-CZ 3.41Å; E144-R242 IonicContact OE1-CZ 2.71Å; E144-R242 IonicContact OE1-NH1 3.24Å; E144-R242 PolarHBondContact OE1-NH1 3.49Å; E144-R242 IonicContact OE2-CZ 2.81Å; E144-R242 VanDerWaalsContact OE2-CZ 3.24Å; E144-R242 IonicContact OE2-NE 3.79Å; E144-R242 PolarHBondContact OE2-NE 2.96Å; E144-R242 IonicContact OE2-NH1 2.72Å; E144-R242 PolarHBondContact OE2-NH1 3.16Å; E144-R242 VanDerWaalsContact OE2-NH1 3.11Å; E144-R242 IonicContact OE2-NH2 3.17Å; N147-R242 WeakPolarHBondContact ND2-CB 3.34Å; N148-R242 PolarHBondContact OD1-NH2 2.9Å; K240-R242 PolarHBondContact O-N 3.28Å; K240-R242 VanDerWaalsContact O-N 3.08Å
243	G	87.8	Confident	78	Confident	41 Å²	41	103.4 Å²	103.4	42%	0.423	53%	0.529	S	S	.	.			trans	72.3	-170.3	-174.8	0	0	0	0	0	114	K240 G245	K240-G243 PolarHBondContact O-N 3.06Å; G243-G245 PolarHBondContact O-N 3Å; G243-G245 VanDerWaalsContact O-N 3.15Å
244	D	72.7	Confident	76.8	Confident	128 Å²	128	100.8 Å²	100.8	68%	0.684	52%	0.522	S	S	*	.	S	Bend	trans	-80.6	23.2	-177.7	-77	-45.6	0	0	0	114.4	K240 K246	K240-D244 VanDerWaalsContact CD-OD1 3.26Å; K240-D244 WeakPolarHBondContact CD-OD1 3.33Å; K240-D244 WeakPolarHBondContact CE-OD1 3.31Å; K240-D244 IonicContact NZ-OD1 2.81Å; K240-D244 PolarHBondContact NZ-OD1 2.98Å; K240-D244 IonicContact NZ-OD2 3.72Å; K240-D244 PolarHBondContact NZ-OD2 3.44Å; D244-K246 VanDerWaalsContact C-N 3.34Å; D244-K246 PolarHBondContact O-N 3.01Å
245	G	56.3	Low	75.5	Confident	71 Å²	71	103.9 Å²	103.9	73%	0.732	54%	0.538	S	S	*	.	S	Bend	trans	71.3	20.2	176.5	0	0	0	0	0	115.6	G243	G243-G245 PolarHBondContact O-N 3Å; G243-G245 VanDerWaalsContact O-N 3.15Å
246	K	48.3	Very low	74.1	Confident	206 Å²	206	106.5 Å²	106.5	90%	0.896	56%	0.557	S	S	*	*			trans	-110.3	78.3	167.6	-71.5	-171	-179.8	-179.2	0	111.3	D244	D244-K246 VanDerWaalsContact C-N 3.34Å; D244-K246 PolarHBondContact O-N 3.01Å
247	A	45.6	Very low	72.6	Confident	87 Å²	87	105.1 Å²	105.1	72%	0.719	55%	0.548	S	S	*	.			trans	-137.5	66.1	160.9	0	0	0	0	0	109.4
248	L	48.2	Very low	70.7	Confident	162 Å²	162	106.5 Å²	106.5	85%	0.848	56%	0.562	S	S	*	*			trans	-137.5	84.1	151.4	-81.9	169.4	0	0	0	105.5
249	I	44.3	Very low	68.6	Low	168 Å²	168	115.4 Å²	115.4	86%	0.862	61%	0.608	S	S	*	*			trans	-106.4	116	153.6	-51.2	-179.5	0	0	0	103.7
250	Y	41.9	Very low	66.2	Low	293 Å²	293	119.2 Å²	119.2	100%	1.149	63%	0.634	S	S	*	*			trans	-46.2	0	179.9	-92.5	-99	0	0	0	113.2

Retrieved 250 of 250 residues in 277.4 ms (Link to these results)

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