G4VSK8_SCHMA Loading...

Putative paraxis

AlphaFold DB , UniProt , Accession G4VSK8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 221 aa.

Structure Viewer

Loading PAE data...

(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	44	Very low	46.9	Very low	190 Å²	190	126.7 Å²	126.7	94%	0.936	66%	0.658	S	S	*	*				0	108.3	0	-167.1	173.8	-80.9	0	0	106.2	M3 Y18	M1-M3 PolarHBondContact O-N 3.41Å; M1-Y18 HydrophobicContact CE-CE1 4.12Å
2	E	40.9	Very low	47.3	Very low	184 Å²	184	123.3 Å²	123.3	86%	0.86	64%	0.641	S	S	*	*			trans	-80.3	107.6	-170.7	-162.2	173.2	-170.5	0	0	108.6	S4	E2-S4 PolarHBondContact O-N 2.95Å
3	M	49.4	Very low	47.6	Very low	120 Å²	120	126.5 Å²	126.5	59%	0.591	64%	0.64	S	S	*	*			trans	-72.8	99.1	-176.2	-69.1	170.9	65.6	0	0	109	M1 I5 I116	M1-M3 PolarHBondContact O-N 3.41Å; M3-I5 PolarHBondContact O-N 3.46Å; M3-I116 HydrophobicContact CE-CD1 4.47Å
4	S	43.6	Very low	48.4	Very low	96 Å²	96	124.3 Å²	124.3	67%	0.671	64%	0.636	S	S	*	*			trans	-68.6	112.8	177.2	-71.4	0	0	0	0	110.1	E2	E2-S4 PolarHBondContact O-N 2.95Å
5	I	45.3	Very low	49.2	Very low	126 Å²	126	120.8 Å²	120.8	65%	0.646	62%	0.619	S	S	*	*	B	Isolated β-bridge	trans	-80.8	123.5	172.7	-57.6	173.4	0	0	0	106.5	M3 G9	M3-I5 PolarHBondContact O-N 3.46Å; I5-G9 VanDerWaalsContact CG2-CA 3.47Å
6	N	43.5	Very low	49.9	Very low	53 Å²	53	116.3 Å²	116.3	28%	0.283	60%	0.595	S	S	.	*			trans	-68.6	162.8	173	65.5	26.9	0	0	0	110.4	Y8 G9 K10	N6-Y8 PolarHBondContact O-N 3.37Å; N6-Y8 PolarHBondContact OD1-N 3.05Å; N6-G9 PolarHBondContact O-N 3.3Å; N6-K10 PolarHBondContact N-O 2.93Å; N6-K10 PolarHBondContact ND2-O 3.01Å; N6-K10 VanDerWaalsContact ND2-O 3.14Å; N6-K10 WeakPolarHBondContact OD1-CA 3.42Å; N6-K10 WeakPolarHBondContact OD1-CB 3.43Å; N6-K10 PolarHBondContact OD1-N 2.97Å; N6-K10 PolarHBondContact OD1-O 3.39Å
7	S	54.4	Low	51	Low	122 Å²	122	116.2 Å²	116.2	85%	0.853	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-14	-172.1	-169.3	0	0	0	0	115.4
8	Y	48.3	Very low	52.3	Low	201 Å²	201	116.3 Å²	116.3	79%	0.788	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	12.6	178.6	-57.3	-75.2	0	0	0	113.6	N6 K10	N6-Y8 PolarHBondContact O-N 3.37Å; N6-Y8 PolarHBondContact OD1-N 3.05Å; Y8-K10 PolarHBondContact O-N 3.29Å
9	G	44.6	Very low	53.2	Low	59 Å²	59	113.9 Å²	113.9	61%	0.608	58%	0.577	S	S	*	*	S	Bend	trans	70.9	9.4	-177.5	0	0	0	0	0	113.6	I5 N6	I5-G9 VanDerWaalsContact CG2-CA 3.47Å; N6-G9 PolarHBondContact O-N 3.3Å
10	K	47.9	Very low	54.3	Low	146 Å²	146	113.1 Å²	113.1	64%	0.635	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-96.2	137.3	-175.7	-61.6	-158.9	178.9	-175.5	0	110.3	N6 Y8	N6-K10 PolarHBondContact N-O 2.93Å; N6-K10 PolarHBondContact ND2-O 3.01Å; N6-K10 VanDerWaalsContact ND2-O 3.14Å; N6-K10 WeakPolarHBondContact OD1-CA 3.42Å; N6-K10 WeakPolarHBondContact OD1-CB 3.43Å; N6-K10 PolarHBondContact OD1-N 2.97Å; N6-K10 PolarHBondContact OD1-O 3.39Å; Y8-K10 PolarHBondContact O-N 3.29Å
11	R	54.4	Low	55.4	Low	97 Å²	97	110.9 Å²	110.9	37%	0.366	57%	0.569	S	S	.	*	B	Isolated β-bridge	trans	-66.6	135.5	176.2	-74.3	177.2	-81.5	-165	-1	109.5
12	N	51.4	Low	56.9	Low	85 Å²	85	104.8 Å²	104.8	46%	0.455	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-73.9	122.5	173.2	-121.9	-9.7	0	0	0	108.8	T14	N12-T14 PolarHBondContact O-N 3Å
13	W	51.5	Low	58.6	Low	166 Å²	166	98.5 Å²	98.5	63%	0.629	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-14.1	-175.1	-62.2	87.5	0	0	0	113.2	D15 Q16	W13-D15 PolarHBondContact O-N 3.22Å; W13-Q16 VanDerWaalsContact CE3-CD 3.46Å; W13-Q16 VanDerWaalsContact CZ3-NE2 3.25Å; W13-Q16 WeakPolarHBondContact O-CB 3.35Å; W13-Q16 PolarHBondContact O-N 3.23Å
14	T	58.9	Low	60	Low	95 Å²	95	96 Å²	96	58%	0.583	50%	0.5	S	S	*	.	H	α-helix	trans	-58	-30.2	176.1	53.4	0	0	0	0	112.5	N12 Q16 Y18	N12-T14 PolarHBondContact O-N 3Å; T14-Q16 VanDerWaalsContact C-N 3.31Å; T14-Q16 PolarHBondContact O-N 3.4Å; T14-Y18 PolarHBondContact O-N 3.3Å
15	D	59.8	Low	61.7	Low	72 Å²	72	96.5 Å²	96.5	39%	0.385	49%	0.492	S	S	.	.	H	α-helix	trans	-70.8	-24.1	174.1	-90.7	-28.3	0	0	0	113	W13 Y18 L19	W13-D15 PolarHBondContact O-N 3.22Å; D15-Y18 WeakPolarHBondContact O-CB 3.48Å; D15-Y18 PolarHBondContact O-N 3Å; D15-L19 WeakPolarHBondContact O-CG 3.41Å; D15-L19 PolarHBondContact O-N 3.2Å
16	Q	61.3	Low	63.3	Low	49 Å²	49	94.4 Å²	94.4	23%	0.229	48%	0.479	C	S	.	.	H	α-helix	trans	-74.2	-34.8	176.5	-86.1	161.4	-92.1	0	0	112.4	W13 T14 Y18 L19 L20 L110	W13-Q16 VanDerWaalsContact CE3-CD 3.46Å; W13-Q16 VanDerWaalsContact CZ3-NE2 3.25Å; W13-Q16 WeakPolarHBondContact O-CB 3.35Å; W13-Q16 PolarHBondContact O-N 3.23Å; T14-Q16 VanDerWaalsContact C-N 3.31Å; T14-Q16 PolarHBondContact O-N 3.4Å; Q16-Y18 PolarHBondContact O-N 3.48Å; Q16-L19 PolarHBondContact O-N 3.36Å; Q16-L20 WeakPolarHBondContact O-CB 3.43Å; Q16-L20 PolarHBondContact O-N 3.21Å; Q16-L110 HydrophobicContact CG-CD2 3.86Å
17	D	68.7	Low	65	Low	115 Å²	115	96.5 Å²	96.5	62%	0.615	48%	0.484	S	S	*	.	H	α-helix	trans	-60.6	-38.1	170.9	-67.2	-32	0	0	0	110.3	L20 S21	D17-L20 PolarHBondContact O-N 3.48Å; D17-S21 VanDerWaalsContact O-CB 3.32Å; D17-S21 WeakPolarHBondContact O-CB 3.29Å; D17-S21 PolarHBondContact O-N 2.91Å
18	Y	73.1	Confident	66.3	Low	118 Å²	118	93.8 Å²	93.8	46%	0.463	46%	0.46	S	S	.	.	H	α-helix	trans	-64.1	-45.9	172.7	-177.7	-109.9	0	0	0	112.4	M1 T14 D15 Q16 L20 S21 N22	M1-Y18 HydrophobicContact CE-CE1 4.12Å; T14-Y18 PolarHBondContact O-N 3.3Å; D15-Y18 WeakPolarHBondContact O-CB 3.48Å; D15-Y18 PolarHBondContact O-N 3Å; Q16-Y18 PolarHBondContact O-N 3.48Å; Y18-L20 VanDerWaalsContact C-N 3.31Å; Y18-L20 PolarHBondContact O-N 2.8Å; Y18-S21 PolarHBondContact O-N 3.12Å; Y18-N22 WeakPolarHBondContact CD1-ND2 3.49Å; Y18-N22 WeakPolarHBondContact CE1-ND2 3.4Å; Y18-N22 WeakPolarHBondContact O-CB 3.36Å; Y18-N22 PolarHBondContact O-N 3.4Å; Y18-N22 PolarHBondContact O-ND2 3.05Å
19	L	70.6	Confident	67.9	Low	71 Å²	71	89 Å²	89	37%	0.372	45%	0.448	S	S	.	.	H	α-helix	trans	-59.6	-40.9	175.8	-71.3	175.3	0	0	0	112.3	D15 Q16 Y23 M106	D15-L19 WeakPolarHBondContact O-CG 3.41Å; D15-L19 PolarHBondContact O-N 3.2Å; Q16-L19 PolarHBondContact O-N 3.36Å; L19-Y23 WeakPolarHBondContact O-CB 3.49Å; L19-Y23 PolarHBondContact O-N 3.47Å; L19-M106 HydrophobicContact CB-CE 4.35Å
20	L	74.3	Confident	69.5	Low	96 Å²	96	88.5 Å²	88.5	50%	0.503	43%	0.429	S	S	.	.	H	α-helix	trans	-70	-40.1	178	-172.4	62.9	0	0	0	112	Q16 D17 Y18 Y23 T24 M106	Q16-L20 WeakPolarHBondContact O-CB 3.43Å; Q16-L20 PolarHBondContact O-N 3.21Å; D17-L20 PolarHBondContact O-N 3.48Å; Y18-L20 VanDerWaalsContact C-N 3.31Å; Y18-L20 PolarHBondContact O-N 2.8Å; L20-Y23 WeakPolarHBondContact O-CB 3.41Å; L20-Y23 PolarHBondContact O-N 3.04Å; L20-T24 PolarHBondContact O-N 2.91Å; L20-T24 PolarHBondContact O-OG1 3.39Å; L20-M106 HydrophobicContact CB-CE 4.3Å; L20-M106 HydrophobicContact CD1-CE 4.01Å
21	S	78.6	Confident	71	Confident	67 Å²	67	84.8 Å²	84.8	47%	0.469	41%	0.414	S	S	.	.	H	α-helix	trans	-62	-45.7	173.8	-175.6	0	0	0	0	111.7	D17 Y18 Y23 T24 Q25	D17-S21 VanDerWaalsContact O-CB 3.32Å; D17-S21 WeakPolarHBondContact O-CB 3.29Å; D17-S21 PolarHBondContact O-N 2.91Å; Y18-S21 PolarHBondContact O-N 3.12Å; S21-Y23 VanDerWaalsContact C-N 3.3Å; S21-Y23 PolarHBondContact O-N 3.02Å; S21-T24 WeakPolarHBondContact O-CB 3.39Å; S21-T24 PolarHBondContact O-N 2.99Å; S21-Q25 WeakPolarHBondContact O-CG 3.26Å; S21-Q25 PolarHBondContact O-N 3.05Å
22	N	75	Confident	72.2	Confident	62 Å²	62	85.2 Å²	85.2	33%	0.332	42%	0.423	S	S	.	.	H	α-helix	trans	-62.1	-38	176.9	-69.4	-35.8	0	0	0	112.4	Y18 Q25 H26	Y18-N22 WeakPolarHBondContact CD1-ND2 3.49Å; Y18-N22 WeakPolarHBondContact CE1-ND2 3.4Å; Y18-N22 WeakPolarHBondContact O-CB 3.36Å; Y18-N22 PolarHBondContact O-N 3.4Å; Y18-N22 PolarHBondContact O-ND2 3.05Å; N22-Q25 PolarHBondContact O-N 3.08Å; N22-H26 VanDerWaalsContact O-CB 3.26Å; N22-H26 WeakPolarHBondContact O-CB 3.41Å; N22-H26 PolarHBondContact O-N 3.14Å
23	Y	75.6	Confident	73.6	Confident	52 Å²	52	85.9 Å²	85.9	20%	0.204	42%	0.424	C	S	.	.	H	α-helix	trans	-62.1	-46.2	174.6	178.3	-93.9	0	0	0	111.8	L19 L20 S21 Q25 H26 Y27 S99 D102 A103 M106	L19-Y23 WeakPolarHBondContact O-CB 3.49Å; L19-Y23 PolarHBondContact O-N 3.47Å; L20-Y23 WeakPolarHBondContact O-CB 3.41Å; L20-Y23 PolarHBondContact O-N 3.04Å; S21-Y23 VanDerWaalsContact C-N 3.3Å; S21-Y23 PolarHBondContact O-N 3.02Å; Y23-Q25 VanDerWaalsContact C-N 3.34Å; Y23-Q25 PolarHBondContact O-N 3.35Å; Y23-H26 PolarHBondContact O-N 2.98Å; Y23-Y27 WeakPolarHBondContact O-CB 3.36Å; Y23-Y27 PolarHBondContact O-N 2.94Å; Y23-S99 PolarHBondContact OH-O 3.33Å; Y23-S99 PolarHBondContact OH-OG 3.09Å; Y23-D102 HydrophobicContact CD2-CB 4.03Å; Y23-D102 HydrophobicContact CE2-CB 3.59Å; Y23-A103 HydrophobicContact CE2-CB 4.13Å; Y23-M106 WeakPolarHBondContact CB-SD 3.44Å; Y23-M106 HydrophobicContact CD1-SD 4.26Å; Y23-M106 HydrophobicContact CD2-CG 4.42Å; Y23-M106 HydrophobicContact CD2-SD 3.39Å; Y23-M106 WeakPolarHBondContact CD2-SD 3.35Å; Y23-M106 HydrophobicContact CE2-SD 4.23Å; Y23-M106 HydrophobicContact CG-SD 3.4Å
24	T	79.6	Confident	74.9	Confident	68 Å²	68	78.4 Å²	78.4	42%	0.417	40%	0.396	S	S	.	.	H	α-helix	trans	-60.1	-45.1	177.1	-56.8	0	0	0	0	111.2	L20 S21 Y27 N28	L20-T24 PolarHBondContact O-N 2.91Å; L20-T24 PolarHBondContact O-OG1 3.39Å; S21-T24 WeakPolarHBondContact O-CB 3.39Å; S21-T24 PolarHBondContact O-N 2.99Å; T24-Y27 WeakPolarHBondContact O-CB 3.43Å; T24-Y27 PolarHBondContact O-N 2.72Å; T24-N28 PolarHBondContact O-N 2.9Å; T24-N28 PolarHBondContact O-ND2 3.33Å
25	Q	78.9	Confident	76	Confident	107 Å²	107	77.1 Å²	77.1	50%	0.5	39%	0.391	S	S	.	.	H	α-helix	trans	-64.2	-47	177.8	-69.3	-64.6	69.1	0	0	112.4	S21 N22 Y23 Y27 N28 D29	S21-Q25 WeakPolarHBondContact O-CG 3.26Å; S21-Q25 PolarHBondContact O-N 3.05Å; N22-Q25 PolarHBondContact O-N 3.08Å; Y23-Q25 VanDerWaalsContact C-N 3.34Å; Y23-Q25 PolarHBondContact O-N 3.35Å; Q25-Y27 VanDerWaalsContact C-N 3.25Å; Q25-Y27 PolarHBondContact O-N 3.23Å; Q25-N28 WeakPolarHBondContact O-CB 3.49Å; Q25-N28 PolarHBondContact O-N 3.37Å; Q25-N28 VanDerWaalsContact O-N 3.09Å; Q25-N28 PolarHBondContact OE1-ND2 3.14Å; Q25-D29 PolarHBondContact O-N 3Å
26	H	79	Confident	76.9	Confident	82 Å²	82	80 Å²	80	38%	0.38	40%	0.397	S	S	.	.	H	α-helix	trans	-61.7	-34	176.5	-177.2	-120.2	0	0	0	112.8	N22 Y23 K30 D102	N22-H26 VanDerWaalsContact O-CB 3.26Å; N22-H26 WeakPolarHBondContact O-CB 3.41Å; N22-H26 PolarHBondContact O-N 3.14Å; Y23-H26 PolarHBondContact O-N 2.98Å; H26-K30 WeakPolarHBondContact CE1-CE 3.44Å; H26-K30 PolarHBondContact CE1-NZ 3.4Å; H26-K30 VanDerWaalsContact NE2-CE 3.32Å; H26-K30 WeakPolarHBondContact NE2-CE 3.49Å; H26-K30 WeakPolarHBondContact O-CB 3.35Å; H26-K30 WeakPolarHBondContact O-CG 3.34Å; H26-K30 PolarHBondContact O-N 3.48Å; H26-D102 IonicContact CE1-OD2 3.76Å; H26-D102 PolarHBondContact CE1-OD2 3Å; H26-D102 IonicContact ND1-OD2 2.66Å; H26-D102 PolarHBondContact ND1-OD2 3.37Å; H26-D102 VanDerWaalsContact ND1-OD2 3.12Å
27	Y	78.5	Confident	77.5	Confident	97 Å²	97	79 Å²	79	38%	0.38	40%	0.395	S	S	.	.	H	α-helix	trans	-64.2	-47.6	172.3	-178.7	-93.5	0	0	0	111.3	Y23 T24 Q25 K30 Q31 S99	Y23-Y27 WeakPolarHBondContact O-CB 3.36Å; Y23-Y27 PolarHBondContact O-N 2.94Å; T24-Y27 WeakPolarHBondContact O-CB 3.43Å; T24-Y27 PolarHBondContact O-N 2.72Å; Q25-Y27 VanDerWaalsContact C-N 3.25Å; Q25-Y27 PolarHBondContact O-N 3.23Å; Y27-K30 PolarHBondContact O-N 3.36Å; Y27-Q31 HydrophobicContact CD1-CG 4.08Å; Y27-Q31 HydrophobicContact CE1-CG 3.71Å; Y27-Q31 VanDerWaalsContact CZ-NE2 3.26Å; Y27-Q31 WeakPolarHBondContact O-CG 3.46Å; Y27-Q31 PolarHBondContact O-N 3.22Å; Y27-Q31 PolarHBondContact OH-NE2 3.1Å; Y27-S99 WeakPolarHBondContact CD2-OG 3.44Å; Y27-S99 WeakPolarHBondContact CE2-OG 3.36Å
28	N	82	Confident	77.9	Confident	64 Å²	64	76.1 Å²	76.1	34%	0.342	38%	0.379	S	S	.	.	H	α-helix	trans	-61.5	-45.6	179.4	-67	-26	0	0	0	111.8	T24 Q25 K30 Q31 N32	T24-N28 PolarHBondContact O-N 2.9Å; T24-N28 PolarHBondContact O-ND2 3.33Å; Q25-N28 WeakPolarHBondContact O-CB 3.49Å; Q25-N28 PolarHBondContact O-N 3.37Å; Q25-N28 VanDerWaalsContact O-N 3.09Å; Q25-N28 PolarHBondContact OE1-ND2 3.14Å; N28-K30 VanDerWaalsContact C-N 3.29Å; N28-K30 PolarHBondContact O-N 2.85Å; N28-Q31 WeakPolarHBondContact O-CB 3.4Å; N28-Q31 PolarHBondContact O-N 2.88Å; N28-Q31 VanDerWaalsContact O-N 3.09Å; N28-N32 PolarHBondContact O-N 2.95Å; N28-N32 PolarHBondContact O-ND2 3.13Å
29	D	82.2	Confident	78	Confident	102 Å²	102	73.4 Å²	73.4	55%	0.545	38%	0.375	S	S	.	.	H	α-helix	trans	-59.7	-39.9	177.6	-70.9	-22.4	0	0	0	112.1	Q25 N32 H33	Q25-D29 PolarHBondContact O-N 3Å; D29-N32 WeakPolarHBondContact O-CB 3.41Å; D29-N32 PolarHBondContact O-N 3.27Å; D29-H33 PolarHBondContact O-N 3.12Å
30	K	79	Confident	77.8	Confident	47 Å²	47	72.4 Å²	72.4	20%	0.204	37%	0.37	C	S	.	.	H	α-helix	trans	-68.2	-35.5	175.1	-77.5	-178.9	176.1	176.6	0	112.9	H26 Y27 N28 N32 H33 L34 T95 D102	H26-K30 WeakPolarHBondContact CE1-CE 3.44Å; H26-K30 PolarHBondContact CE1-NZ 3.4Å; H26-K30 VanDerWaalsContact NE2-CE 3.32Å; H26-K30 WeakPolarHBondContact NE2-CE 3.49Å; H26-K30 WeakPolarHBondContact O-CB 3.35Å; H26-K30 WeakPolarHBondContact O-CG 3.34Å; H26-K30 PolarHBondContact O-N 3.48Å; Y27-K30 PolarHBondContact O-N 3.36Å; N28-K30 VanDerWaalsContact C-N 3.29Å; N28-K30 PolarHBondContact O-N 2.85Å; K30-N32 VanDerWaalsContact C-N 3.33Å; K30-H33 PolarHBondContact O-N 3.15Å; K30-L34 WeakPolarHBondContact O-CB 3.49Å; K30-L34 PolarHBondContact O-N 3.01Å; K30-T95 HydrophobicContact CB-CG2 3.92Å; K30-D102 IonicContact NZ-OD2 3.22Å; K30-D102 PolarHBondContact NZ-OD2 2.79Å
31	Q	79	Confident	77.4	Confident	68 Å²	68	69.3 Å²	69.3	32%	0.318	36%	0.355	S	S	.	.	H	α-helix	trans	-66.1	-37.9	173.1	-66.5	-56.7	-28	0	0	111.4	Y27 N28 L34 S35	Y27-Q31 HydrophobicContact CD1-CG 4.08Å; Y27-Q31 HydrophobicContact CE1-CG 3.71Å; Y27-Q31 VanDerWaalsContact CZ-NE2 3.26Å; Y27-Q31 WeakPolarHBondContact O-CG 3.46Å; Y27-Q31 PolarHBondContact O-N 3.22Å; Y27-Q31 PolarHBondContact OH-NE2 3.1Å; N28-Q31 WeakPolarHBondContact O-CB 3.4Å; N28-Q31 PolarHBondContact O-N 2.88Å; N28-Q31 VanDerWaalsContact O-N 3.09Å; Q31-L34 PolarHBondContact O-N 3.11Å; Q31-S35 WeakPolarHBondContact O-CB 3.45Å; Q31-S35 PolarHBondContact O-N 3.29Å
32	N	80.1	Confident	76.7	Confident	106 Å²	106	72.9 Å²	72.9	57%	0.567	36%	0.363	S	S	*	.	H	α-helix	trans	-64.5	-44.9	174.6	-67.6	-32.2	0	0	0	111.6	N28 D29 K30 L34 S35 Y36	N28-N32 PolarHBondContact O-N 2.95Å; N28-N32 PolarHBondContact O-ND2 3.13Å; D29-N32 WeakPolarHBondContact O-CB 3.41Å; D29-N32 PolarHBondContact O-N 3.27Å; K30-N32 VanDerWaalsContact C-N 3.33Å; N32-L34 VanDerWaalsContact C-N 3.31Å; N32-L34 PolarHBondContact O-N 3.15Å; N32-S35 WeakPolarHBondContact O-CB 3.39Å; N32-S35 PolarHBondContact O-N 3.14Å; N32-Y36 PolarHBondContact O-N 3.48Å
33	H	80.4	Confident	76	Confident	99 Å²	99	74.8 Å²	74.8	46%	0.458	37%	0.373	S	S	.	.	H	α-helix	trans	-60.2	-41.7	173.8	179.4	-92.8	0	0	0	111.8	D29 K30 S35 Y36 C37	D29-H33 PolarHBondContact O-N 3.12Å; K30-H33 PolarHBondContact O-N 3.15Å; H33-S35 VanDerWaalsContact C-N 3.34Å; H33-S35 PolarHBondContact O-N 2.78Å; H33-Y36 WeakPolarHBondContact O-CB 3.45Å; H33-Y36 PolarHBondContact O-N 3.48Å; H33-C37 PolarHBondContact CE1-SG 3.31Å; H33-C37 PolarHBondContact O-N 3.15Å; H33-C37 PolarHBondContact O-SG 3.31Å
34	L	78	Confident	75.2	Confident	10 Å²	10	78.5 Å²	78.5	5%	0.052	39%	0.392	C	S	.	.	H	α-helix	trans	-64.2	-40.6	176.4	-173.8	65.7	0	0	0	111.8	K30 Q31 N32 Y36 C37 I38 E91 R92	K30-L34 WeakPolarHBondContact O-CB 3.49Å; K30-L34 PolarHBondContact O-N 3.01Å; Q31-L34 PolarHBondContact O-N 3.11Å; N32-L34 VanDerWaalsContact C-N 3.31Å; N32-L34 PolarHBondContact O-N 3.15Å; L34-Y36 VanDerWaalsContact C-N 3.32Å; L34-Y36 PolarHBondContact O-N 2.97Å; L34-C37 PolarHBondContact O-N 3.31Å; L34-I38 HydrophobicContact CG-CD1 4.09Å; L34-I38 WeakPolarHBondContact O-CD1 3.46Å; L34-I38 WeakPolarHBondContact O-CG1 3.19Å; L34-I38 PolarHBondContact O-N 3.22Å; L34-E91 HydrophobicContact CD1-CB 4.4Å; L34-E91 HydrophobicContact CD1-CG 4.22Å; L34-R92 VanDerWaalsContact CD1-CA 3.45Å; L34-R92 HydrophobicContact CD1-CB 3.86Å; L34-R92 HydrophobicContact CD2-CB 4Å; L34-R92 HydrophobicContact CD2-CG 3.82Å
35	S	82.3	Confident	73.9	Confident	67 Å²	67	77.6 Å²	77.6	47%	0.469	39%	0.388	S	S	.	.	H	α-helix	trans	-58.2	-45.2	172.9	-176.6	0	0	0	0	111.1	Q31 N32 H33 I38 T39	Q31-S35 WeakPolarHBondContact O-CB 3.45Å; Q31-S35 PolarHBondContact O-N 3.29Å; N32-S35 WeakPolarHBondContact O-CB 3.39Å; N32-S35 PolarHBondContact O-N 3.14Å; H33-S35 VanDerWaalsContact C-N 3.34Å; H33-S35 PolarHBondContact O-N 2.78Å; S35-I38 WeakPolarHBondContact O-CB 3.36Å; S35-I38 PolarHBondContact O-N 3.39Å; S35-T39 WeakPolarHBondContact O-CG2 3.45Å; S35-T39 PolarHBondContact O-N 3.37Å; S35-T39 PolarHBondContact O-OG1 3.27Å
36	Y	78.6	Confident	72.8	Confident	133 Å²	133	77 Å²	77	52%	0.522	40%	0.396	S	S	.	.	H	α-helix	trans	-61.1	-45.8	176.1	-178.5	-94.6	0	0	0	112.6	N32 H33 L34 I38 T39 D40	N32-Y36 PolarHBondContact O-N 3.48Å; H33-Y36 WeakPolarHBondContact O-CB 3.45Å; H33-Y36 PolarHBondContact O-N 3.48Å; L34-Y36 VanDerWaalsContact C-N 3.32Å; L34-Y36 PolarHBondContact O-N 2.97Å; Y36-I38 VanDerWaalsContact C-N 3.26Å; Y36-I38 PolarHBondContact O-N 3.13Å; Y36-T39 WeakPolarHBondContact CA-OG1 3.48Å; Y36-T39 PolarHBondContact O-N 3.31Å; Y36-T39 PolarHBondContact O-OG1 3.13Å; Y36-D40 WeakPolarHBondContact CE1-OD2 3.49Å; Y36-D40 WeakPolarHBondContact O-CB 3.19Å; Y36-D40 PolarHBondContact O-N 3.29Å; Y36-D40 PolarHBondContact OH-OD2 3.39Å
37	C	74.7	Confident	71.5	Confident	28 Å²	28	77.9 Å²	77.9	19%	0.189	41%	0.407	C	S	.	.	H	α-helix	trans	-62.2	-34	175.6	-65.7	0	0	0	0	112.8	H33 L34 T41	H33-C37 PolarHBondContact CE1-SG 3.31Å; H33-C37 PolarHBondContact O-N 3.15Å; H33-C37 PolarHBondContact O-SG 3.31Å; L34-C37 PolarHBondContact O-N 3.31Å; C37-T41 WeakPolarHBondContact O-CB 3.4Å; C37-T41 PolarHBondContact O-N 2.97Å; C37-T41 PolarHBondContact O-OG1 3Å
38	I	75.9	Confident	70.1	Confident	55 Å²	55	77.6 Å²	77.6	28%	0.282	41%	0.411	S	S	.	.	H	α-helix	trans	-67.6	-50.6	174.9	-69	162.7	0	0	0	109.6	L34 S35 Y36 T41 F42 V88	L34-I38 HydrophobicContact CG-CD1 4.09Å; L34-I38 WeakPolarHBondContact O-CD1 3.46Å; L34-I38 WeakPolarHBondContact O-CG1 3.19Å; L34-I38 PolarHBondContact O-N 3.22Å; S35-I38 WeakPolarHBondContact O-CB 3.36Å; S35-I38 PolarHBondContact O-N 3.39Å; Y36-I38 VanDerWaalsContact C-N 3.26Å; Y36-I38 PolarHBondContact O-N 3.13Å; I38-T41 WeakPolarHBondContact O-CB 3.48Å; I38-T41 PolarHBondContact O-N 3.35Å; I38-F42 HydrophobicContact CG2-CD2 3.76Å; I38-F42 HydrophobicContact CG2-CE2 3.52Å; I38-F42 VanDerWaalsContact O-CD2 3.23Å; I38-F42 WeakPolarHBondContact O-CD2 3.2Å; I38-F42 PolarHBondContact O-N 3.36Å; I38-F42 VanDerWaalsContact O-N 3.1Å; I38-V88 HydrophobicContact CB-CG1 4.5Å; I38-V88 HydrophobicContact CG1-CG1 3.57Å
39	T	75.6	Confident	68.3	Low	61 Å²	61	82.9 Å²	82.9	37%	0.374	43%	0.434	S	S	.	.	H	α-helix	trans	-65.4	-40.4	-178	52.4	0	0	0	0	112.9	S35 Y36 T41 F42 N43	S35-T39 WeakPolarHBondContact O-CG2 3.45Å; S35-T39 PolarHBondContact O-N 3.37Å; S35-T39 PolarHBondContact O-OG1 3.27Å; Y36-T39 WeakPolarHBondContact CA-OG1 3.48Å; Y36-T39 PolarHBondContact O-N 3.31Å; Y36-T39 PolarHBondContact O-OG1 3.13Å; T39-T41 PolarHBondContact O-N 2.99Å; T39-F42 PolarHBondContact O-N 3.41Å; T39-N43 WeakPolarHBondContact O-CB 3.45Å; T39-N43 PolarHBondContact O-N 3.19Å
40	D	66.4	Low	66.3	Low	50 Å²	50	85.7 Å²	85.7	27%	0.267	45%	0.449	S	S	.	.	H	α-helix	trans	-62.3	-33.2	175.6	-93.3	-2	0	0	0	111.9	Y36 Q44	Y36-D40 WeakPolarHBondContact CE1-OD2 3.49Å; Y36-D40 WeakPolarHBondContact O-CB 3.19Å; Y36-D40 PolarHBondContact O-N 3.29Å; Y36-D40 PolarHBondContact OH-OD2 3.39Å; D40-Q44 WeakPolarHBondContact O-CB 3.47Å; D40-Q44 WeakPolarHBondContact O-CG 3.28Å; D40-Q44 PolarHBondContact O-N 3.42Å; D40-Q44 PolarHBondContact O-NE2 3.43Å
41	T	65.8	Low	64.7	Low	31 Å²	31	88 Å²	88	19%	0.19	47%	0.471	C	S	.	.	H	α-helix	trans	-71	-39	176.1	-56.5	0	0	0	0	111.8	C37 I38 T39 C45 P83 V88	C37-T41 WeakPolarHBondContact O-CB 3.4Å; C37-T41 PolarHBondContact O-N 2.97Å; C37-T41 PolarHBondContact O-OG1 3Å; I38-T41 WeakPolarHBondContact O-CB 3.48Å; I38-T41 PolarHBondContact O-N 3.35Å; T39-T41 PolarHBondContact O-N 2.99Å; T41-C45 PolarHBondContact O-N 3.12Å; T41-P83 HydrophobicContact CG2-CB 3.74Å; T41-V88 HydrophobicContact CG2-CG2 3.62Å; T41-V88 WeakPolarHBondContact OG1-CG2 3.46Å
42	F	63.7	Low	62.6	Low	142 Å²	142	92 Å²	92	62%	0.623	49%	0.494	S	S	*	.	H	α-helix	trans	-64.9	-45.4	173.1	-80.2	-71.6	0	0	0	111.3	I38 T39 Q44 C45 S46	I38-F42 HydrophobicContact CG2-CD2 3.76Å; I38-F42 HydrophobicContact CG2-CE2 3.52Å; I38-F42 VanDerWaalsContact O-CD2 3.23Å; I38-F42 WeakPolarHBondContact O-CD2 3.2Å; I38-F42 PolarHBondContact O-N 3.36Å; I38-F42 VanDerWaalsContact O-N 3.1Å; T39-F42 PolarHBondContact O-N 3.41Å; F42-Q44 PolarHBondContact O-N 3.03Å; F42-C45 WeakPolarHBondContact O-CB 3.46Å; F42-C45 PolarHBondContact O-N 3.43Å; F42-C45 VanDerWaalsContact O-N 3.11Å; F42-S46 PolarHBondContact O-N 3.04Å; F42-S46 PolarHBondContact O-OG 3.23Å
43	N	61.3	Low	60.8	Low	101 Å²	101	92.2 Å²	92.2	54%	0.54	50%	0.504	S	S	.	.	H	α-helix	trans	-65.4	-38.3	-179.2	-76.3	-11.1	0	0	0	113	T39 C45 S46 T47	T39-N43 WeakPolarHBondContact O-CB 3.45Å; T39-N43 PolarHBondContact O-N 3.19Å; N43-C45 PolarHBondContact O-N 3.05Å; N43-S46 PolarHBondContact O-N 3.42Å; N43-T47 PolarHBondContact O-N 3.05Å
44	Q	58.2	Low	58.8	Low	130 Å²	130	92.3 Å²	92.3	61%	0.607	51%	0.512	S	S	*	.	H	α-helix	trans	-65.4	-21.9	174.4	-78.8	174.2	54.7	0	0	113.3	D40 F42 T47	D40-Q44 WeakPolarHBondContact O-CB 3.47Å; D40-Q44 WeakPolarHBondContact O-CG 3.28Å; D40-Q44 PolarHBondContact O-N 3.42Å; D40-Q44 PolarHBondContact O-NE2 3.43Å; F42-Q44 PolarHBondContact O-N 3.03Å; Q44-T47 PolarHBondContact O-OG1 2.84Å
45	C	52.5	Low	56.8	Low	50 Å²	50	99.3 Å²	99.3	34%	0.338	55%	0.549	S	S	.	.	H	α-helix	trans	-81.2	-34.9	172.6	-150.5	0	0	0	0	112	T41 F42 N43 T47 L48 P83	T41-C45 PolarHBondContact O-N 3.12Å; F42-C45 WeakPolarHBondContact O-CB 3.46Å; F42-C45 PolarHBondContact O-N 3.43Å; F42-C45 VanDerWaalsContact O-N 3.11Å; N43-C45 PolarHBondContact O-N 3.05Å; C45-T47 PolarHBondContact O-N 3.42Å; C45-L48 PolarHBondContact O-N 3.21Å; C45-P83 HydrophobicContact CB-CB 4.49Å; C45-P83 HydrophobicContact CB-CG 3.37Å; C45-P83 WeakPolarHBondContact SG-CG 3.28Å
46	S	54.7	Low	54.6	Low	94 Å²	94	104 Å²	104	66%	0.657	57%	0.569	S	S	*	*	H	α-helix	trans	-69.6	-15	-178.9	-61.9	0	0	0	0	113.9	F42 N43 L48	F42-S46 PolarHBondContact O-N 3.04Å; F42-S46 PolarHBondContact O-OG 3.23Å; N43-S46 PolarHBondContact O-N 3.42Å; S46-L48 PolarHBondContact O-N 3.5Å
47	T	51.9	Low	52.6	Low	101 Å²	101	105.5 Å²	105.5	62%	0.62	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	4.6	172.4	53.2	0	0	0	0	113.8	N43 Q44 C45 H49	N43-T47 PolarHBondContact O-N 3.05Å; Q44-T47 PolarHBondContact O-OG1 2.84Å; C45-T47 PolarHBondContact O-N 3.42Å; T47-H49 PolarHBondContact O-CD2 3.23Å; T47-H49 VanDerWaalsContact O-CD2 3.32Å; T47-H49 PolarHBondContact O-N 3.2Å
48	L	48.9	Very low	50.6	Low	90 Å²	90	111.5 Å²	111.5	47%	0.471	61%	0.613	S	S	.	*	S	Bend	trans	-71	101.4	160.7	-69.7	174.4	0	0	0	107.7	C45 S46 D50 Y81	C45-L48 PolarHBondContact O-N 3.21Å; S46-L48 PolarHBondContact O-N 3.5Å; L48-D50 PolarHBondContact O-N 3.34Å; L48-Y81 HydrophobicContact CD2-CD1 4.11Å; L48-Y81 HydrophobicContact CD2-CE1 4.23Å; L48-Y81 HydrophobicContact CD2-CG 4.33Å
49	H	44.2	Very low	49	Very low	176 Å²	176	116.5 Å²	116.5	82%	0.815	64%	0.635	S	S	*	*			trans	-45.2	97	170.7	-68.3	-104.8	0	0	0	110.6	T47 S51	T47-H49 PolarHBondContact O-CD2 3.23Å; T47-H49 VanDerWaalsContact O-CD2 3.32Å; T47-H49 PolarHBondContact O-N 3.2Å; H49-S51 PolarHBondContact O-N 2.88Å
50	D	40.2	Very low	47.1	Very low	161 Å²	161	119.4 Å²	119.4	86%	0.861	65%	0.652	S	S	*	*			trans	-74	90.6	152.9	-112.5	-25.1	0	0	0	105.5	L48 N52	L48-D50 PolarHBondContact O-N 3.34Å; D50-N52 VanDerWaalsContact C-N 3.27Å; D50-N52 PolarHBondContact O-N 3.42Å
51	S	45.7	Very low	45.7	Very low	96 Å²	96	122 Å²	122	67%	0.671	67%	0.672	S	S	*	*			trans	-55.6	104.8	159.3	-71.1	0	0	0	0	105.9	H49 S53	H49-S51 PolarHBondContact O-N 2.88Å; S51-S53 PolarHBondContact O-N 3.48Å
52	N	36.2	Very low	44	Very low	151 Å²	151	126.5 Å²	126.5	81%	0.807	70%	0.7	S	S	*	*			trans	-61.8	71	176.3	-162.3	15.1	0	0	0	109.1	D50 T54	D50-N52 VanDerWaalsContact C-N 3.27Å; D50-N52 PolarHBondContact O-N 3.42Å; N52-T54 PolarHBondContact O-N 3.11Å
53	S	42	Very low	42.6	Very low	110 Å²	110	125.7 Å²	125.7	77%	0.769	71%	0.706	S	S	*	*			trans	-80.2	86.6	168.5	-83.3	0	0	0	0	106.9	S51 N55	S51-S53 PolarHBondContact O-N 3.48Å; S53-N55 PolarHBondContact O-N 3.3Å
54	T	39.1	Very low	41.1	Very low	102 Å²	102	126.2 Å²	126.2	63%	0.626	71%	0.714	S	S	*	*			trans	-21.8	124.8	158.5	55.7	0	0	0	0	113.8	N52	N52-T54 PolarHBondContact O-N 3.11Å
55	N	35.3	Very low	39.8	Very low	157 Å²	157	126.1 Å²	126.1	84%	0.84	72%	0.722	S	S	*	*			trans	38.9	98	143.1	-51.3	-33.2	0	0	0	116	S53	S53-N55 PolarHBondContact O-N 3.3Å
56	N	35.4	Very low	38.9	Very low	166 Å²	166	128.2 Å²	128.2	89%	0.888	74%	0.737	S	S	*	*			trans	-135.8	132.2	148.5	-146.1	2.5	0	0	0	111.9
57	M	37.3	Very low	37.8	Very low	163 Å²	163	129.1 Å²	129.1	80%	0.803	74%	0.744	S	S	*	*			trans	-58.8	152.9	-169.1	-71.5	-78.4	179.7	0	0	113.1	H59	M57-H59 PolarHBondContact O-N 3.42Å
58	D	33.3	Very low	37.1	Very low	155 Å²	155	129.7 Å²	129.7	83%	0.829	75%	0.752	S	S	*	*			trans	-38.7	123.4	169.8	-58.5	-71.4	0	0	0	113
59	H	40.7	Very low	36.3	Very low	159 Å²	159	131 Å²	131	74%	0.736	77%	0.769	S	S	*	*			trans	-139.5	90.6	160.3	-167.1	-70.2	0	0	0	109.2	M57 P61	M57-H59 PolarHBondContact O-N 3.42Å; H59-P61 WeakPolarHBondContact O-CD 3.37Å
60	V	36.2	Very low	35.9	Very low	122 Å²	122	127.7 Å²	127.7	74%	0.739	77%	0.765	S	S	*	*			trans	-69.1	110.5	168.7	174.3	0	0	0	0	108.1	T62	V60-T62 PolarHBondContact O-N 3.15Å
61	P	38.1	Very low	35.8	Very low	106 Å²	106	124.8 Å²	124.8	69%	0.688	76%	0.757	S	S	*	*			trans	-89.3	100.5	178.9	3.2	18.6	0	0	0	108.6	H59 T63	H59-P61 WeakPolarHBondContact O-CD 3.37Å; P61-T63 PolarHBondContact O-N 2.92Å
62	T	29.7	Very low	35.4	Very low	125 Å²	125	125.1 Å²	125.1	77%	0.767	76%	0.76	S	S	*	*			trans	-85.3	96.8	164.1	-59.9	0	0	0	0	108.3	V60	V60-T62 PolarHBondContact O-N 3.15Å
63	T	33.2	Very low	35.8	Very low	124 Å²	124	125.6 Å²	125.6	76%	0.761	76%	0.759	S	S	*	*			trans	-155.7	105.2	156.3	-30	0	0	0	0	111.5	P61	P61-T63 PolarHBondContact O-N 2.92Å
64	T	30.6	Very low	35.7	Very low	113 Å²	113	125.1 Å²	125.1	69%	0.693	76%	0.756	S	S	*	*			trans	-9.1	131.8	140.2	39.8	0	0	0	0	116.3
65	T	30.4	Very low	35.8	Very low	128 Å²	128	124.4 Å²	124.4	79%	0.785	76%	0.755	S	S	*	*				147.8	134.4	119.2	48.9	0	0	0	0	113.7
66	S	34.3	Very low	36.3	Very low	93 Å²	93	121.9 Å²	121.9	65%	0.65	75%	0.75	S	S	*	*			trans	63.6	96.7	147.9	49.6	0	0	0	0	120.5
67	S	31.8	Very low	36.7	Very low	114 Å²	114	121 Å²	121	80%	0.797	74%	0.744	S	S	*	*				37.5	102.1	114.9	61.7	0	0	0	0	118.1
68	S	36.1	Very low	37	Very low	113 Å²	113	117.7 Å²	117.7	79%	0.79	74%	0.737	S	S	*	*			trans	-158.6	104.7	139.2	32.5	0	0	0	0	109.8
69	S	32.8	Very low	37.3	Very low	118 Å²	118	114.5 Å²	114.5	83%	0.825	73%	0.726	S	S	*	*			trans	-54.2	124.4	162	45.6	0	0	0	0	111.1
70	S	35.9	Very low	37.5	Very low	106 Å²	106	115.8 Å²	115.8	74%	0.741	73%	0.732	S	S	*	*			trans	-178.5	134.2	140.6	34.9	0	0	0	0	111.9
71	S	37.8	Very low	38.2	Very low	100 Å²	100	117.2 Å²	117.2	70%	0.699	73%	0.725	S	S	*	*			trans	57.4	72.9	161.1	50.2	0	0	0	0	116.6	M73	S71-M73 PolarHBondContact O-N 2.97Å
72	S	38.4	Very low	38.7	Very low	103 Å²	103	118.9 Å²	118.9	72%	0.72	72%	0.724	S	S	*	*			trans	-60.7	70.9	146.7	42.7	0	0	0	0	110.2	S74	S72-S74 VanDerWaalsContact C-N 3.31Å
73	M	43.4	Very low	39.9	Very low	160 Å²	160	114.2 Å²	114.2	79%	0.788	70%	0.696	S	S	*	*			trans	-106	42	156.6	-65.8	-75	96.5	0	0	107.7	S71 S75	S71-M73 PolarHBondContact O-N 2.97Å; M73-S75 PolarHBondContact O-N 3.34Å
74	S	40.5	Very low	41.1	Very low	100 Å²	100	110.6 Å²	110.6	70%	0.699	67%	0.674	S	S	*	*			trans	-67.8	79.1	153.8	51	0	0	0	0	105.7	S72 S76	S72-S74 VanDerWaalsContact C-N 3.31Å; S74-S76 PolarHBondContact O-N 3.37Å
75	S	40.6	Very low	43	Very low	88 Å²	88	110.6 Å²	110.6	62%	0.615	67%	0.669	S	S	*	*			trans	-28	113	151.4	28.5	0	0	0	0	106.2	M73 L77	M73-S75 PolarHBondContact O-N 3.34Å; S75-L77 PolarHBondContact O-N 3.03Å
76	S	45.7	Very low	45.4	Very low	104 Å²	104	112.6 Å²	112.6	73%	0.727	67%	0.667	S	S	*	*			trans	-63.1	71.4	173.9	40.5	0	0	0	0	108.2	S74 S78	S74-S76 PolarHBondContact O-N 3.37Å; S76-S78 PolarHBondContact O-N 3.37Å; S76-S78 VanDerWaalsContact O-N 3.09Å
77	L	43.6	Very low	47.7	Very low	147 Å²	147	117 Å²	117	77%	0.77	67%	0.669	S	S	*	*			trans	-69.4	23.9	149	-69.6	162.9	0	0	0	109.2	S75 C79	S75-L77 PolarHBondContact O-N 3.03Å; L77-C79 PolarHBondContact O-N 2.91Å
78	S	43.8	Very low	50	Low	94 Å²	94	112.9 Å²	112.9	66%	0.657	64%	0.639	S	S	*	*			trans	-58.5	86.6	163	61.6	0	0	0	0	106.7	S76 Q80	S76-S78 PolarHBondContact O-N 3.37Å; S76-S78 VanDerWaalsContact O-N 3.09Å; S78-Q80 PolarHBondContact O-N 3.18Å
79	C	40.7	Very low	52.4	Low	88 Å²	88	110 Å²	110	60%	0.595	62%	0.622	S	S	*	*			trans	42.3	83.4	156.3	-123.8	0	0	0	0	113.1	L77 Y81	L77-C79 PolarHBondContact O-N 2.91Å; C79-Y81 PolarHBondContact O-N 3.04Å
80	Q	43.4	Very low	55.1	Low	185 Å²	185	109 Å²	109	86%	0.864	61%	0.607	S	S	*	*	S	Bend	trans	-61.7	2.5	156.4	-72.6	-172.3	-4.7	0	0	112.6	S78	S78-Q80 PolarHBondContact O-N 3.18Å
81	Y	50.6	Low	57.5	Low	152 Å²	152	106.2 Å²	106.2	60%	0.596	58%	0.582	S	S	*	*			trans	-112	47.8	-178.5	-69.1	-88.7	0	0	0	112.4	L48 C79 P83	L48-Y81 HydrophobicContact CD2-CD1 4.11Å; L48-Y81 HydrophobicContact CD2-CE1 4.23Å; L48-Y81 HydrophobicContact CD2-CG 4.33Å; C79-Y81 PolarHBondContact O-N 3.04Å; Y81-P83 VanDerWaalsContact C-CD 3.41Å; Y81-P83 WeakPolarHBondContact O-CD 3.23Å
82	Q	49	Very low	59.9	Low	141 Å²	141	109.6 Å²	109.6	66%	0.659	58%	0.58	S	S	*	*			trans	-82.8	101.2	141.8	-71.9	-147.8	-21.9	0	0	106.3	P84	Q82-P84 WeakPolarHBondContact O-CA 3.38Å
83	P	55.2	Low	62.6	Low	28 Å²	28	108.9 Å²	108.9	18%	0.182	57%	0.565	C	S	.	*			trans	-47.9	123.3	159.8	-2.6	2.4	0	0	0	105.6	T41 C45 Y81 I85	T41-P83 HydrophobicContact CG2-CB 3.74Å; C45-P83 HydrophobicContact CB-CB 4.49Å; C45-P83 HydrophobicContact CB-CG 3.37Å; C45-P83 WeakPolarHBondContact SG-CG 3.28Å; Y81-P83 VanDerWaalsContact C-CD 3.41Å; Y81-P83 WeakPolarHBondContact O-CD 3.23Å; P83-I85 VanDerWaalsContact C-N 3.34Å; P83-I85 PolarHBondContact O-N 3.5Å
84	P	58.3	Low	64.9	Low	47 Å²	47	109.3 Å²	109.3	31%	0.305	56%	0.558	S	S	.	*			trans	-70.8	92.5	-152	23.4	-34.2	0	0	0	109.8	Q82 K86 R87 V88	Q82-P84 WeakPolarHBondContact O-CA 3.38Å; P84-K86 CarbonylContact O-C 3.56Å; P84-K86 PolarHBondContact O-N 2.99Å; P84-R87 HydrophobicContact CB-CB 3.98Å; P84-R87 HydrophobicContact CB-CG 3.69Å; P84-R87 HydrophobicContact CG-CB 3.83Å; P84-R87 HydrophobicContact CG-CG 3.59Å; P84-R87 WeakPolarHBondContact O-CA 3.09Å; P84-R87 WeakPolarHBondContact O-CB 2.91Å; P84-R87 PolarHBondContact O-N 3.32Å; P84-V88 PolarHBondContact O-N 2.91Å
85	I	71.5	Confident	67.3	Low	113 Å²	113	105.1 Å²	105.1	58%	0.579	53%	0.528	S	S	*	.	H	α-helix	trans	-47.1	-37.1	169.4	-63.3	168.2	0	0	0	109.3	P83 R87 V88 A89	P83-I85 VanDerWaalsContact C-N 3.34Å; P83-I85 PolarHBondContact O-N 3.5Å; I85-R87 PolarHBondContact O-N 2.99Å; I85-V88 PolarHBondContact O-N 2.91Å; I85-A89 VanDerWaalsContact O-CB 3.28Å; I85-A89 WeakPolarHBondContact O-CB 3.38Å; I85-A89 PolarHBondContact O-N 3.35Å
86	K	79.9	Confident	69.8	Low	170 Å²	170	107.1 Å²	107.1	74%	0.739	52%	0.522	S	S	*	.	H	α-helix	trans	-55.7	-44.5	171.8	-62.2	-178.3	-177.7	176.4	0	112.9	P84 N90	P84-K86 CarbonylContact O-C 3.56Å; P84-K86 PolarHBondContact O-N 2.99Å; K86-N90 WeakPolarHBondContact O-CB 3.41Å; K86-N90 PolarHBondContact O-N 3.2Å; K86-N90 PolarHBondContact O-ND2 3.36Å; K86-N90 PolarHBondContact O-OD1 3.18Å
87	R	82	Confident	72.2	Confident	187 Å²	187	104.4 Å²	104.4	71%	0.706	50%	0.501	S	S	*	.	H	α-helix	trans	-66.2	-45.5	177.8	-72.2	-173.7	-162.1	-172.4	-0.7	111.7	P84 I85 N90 E91	P84-R87 HydrophobicContact CB-CB 3.98Å; P84-R87 HydrophobicContact CB-CG 3.69Å; P84-R87 HydrophobicContact CG-CB 3.83Å; P84-R87 HydrophobicContact CG-CG 3.59Å; P84-R87 WeakPolarHBondContact O-CA 3.09Å; P84-R87 WeakPolarHBondContact O-CB 2.91Å; P84-R87 PolarHBondContact O-N 3.32Å; I85-R87 PolarHBondContact O-N 2.99Å; R87-N90 PolarHBondContact O-N 2.85Å; R87-E91 WeakPolarHBondContact O-CB 3.39Å; R87-E91 PolarHBondContact O-N 2.91Å
88	V	81.5	Confident	74.5	Confident	27 Å²	27	98.8 Å²	98.8	16%	0.164	48%	0.476	C	S	.	.	H	α-helix	trans	-61.7	-45.9	177.3	178	0	0	0	0	111	I38 T41 P84 I85 N90 E91 R92	I38-V88 HydrophobicContact CB-CG1 4.5Å; I38-V88 HydrophobicContact CG1-CG1 3.57Å; T41-V88 HydrophobicContact CG2-CG2 3.62Å; T41-V88 WeakPolarHBondContact OG1-CG2 3.46Å; P84-V88 PolarHBondContact O-N 2.91Å; I85-V88 PolarHBondContact O-N 2.91Å; V88-N90 VanDerWaalsContact C-N 3.34Å; V88-N90 PolarHBondContact O-N 3.07Å; V88-E91 PolarHBondContact O-N 3.33Å; V88-R92 WeakPolarHBondContact O-CB 3.41Å; V88-R92 PolarHBondContact O-N 3.26Å
89	A	84.9	Confident	76.7	Confident	51 Å²	51	95.1 Å²	95.1	42%	0.421	45%	0.45	S	S	.	.	H	α-helix	trans	-61.1	-43.2	176	0	0	0	0	0	111.9	I85 E91 R92 E93	I85-A89 VanDerWaalsContact O-CB 3.28Å; I85-A89 WeakPolarHBondContact O-CB 3.38Å; I85-A89 PolarHBondContact O-N 3.35Å; A89-E91 VanDerWaalsContact C-N 3.35Å; A89-E91 PolarHBondContact O-N 2.89Å; A89-R92 PolarHBondContact O-N 3.49Å; A89-E93 WeakPolarHBondContact O-CB 3.38Å; A89-E93 PolarHBondContact O-N 3.48Å
90	N	89.9	Confident	79.4	Confident	97 Å²	97	93.6 Å²	93.6	52%	0.519	44%	0.438	S	S	.	.	H	α-helix	trans	-63.4	-40.5	176.4	-70.8	-12.3	0	0	0	111.8	K86 R87 V88 E93 R94	K86-N90 WeakPolarHBondContact O-CB 3.41Å; K86-N90 PolarHBondContact O-N 3.2Å; K86-N90 PolarHBondContact O-ND2 3.36Å; K86-N90 PolarHBondContact O-OD1 3.18Å; R87-N90 PolarHBondContact O-N 2.85Å; V88-N90 VanDerWaalsContact C-N 3.34Å; V88-N90 PolarHBondContact O-N 3.07Å; N90-E93 PolarHBondContact O-N 3.33Å; N90-R94 VanDerWaalsContact O-CG 3.32Å; N90-R94 WeakPolarHBondContact O-CG 3.4Å; N90-R94 PolarHBondContact O-N 3.13Å
91	E	87.6	Confident	81.9	Confident	48 Å²	48	88 Å²	88	22%	0.224	41%	0.414	C	S	.	.	H	α-helix	trans	-67.8	-40.4	178.5	-169.3	53.1	-139.5	0	0	111.8	L34 R87 V88 A89 E93 R94 T95	L34-E91 HydrophobicContact CD1-CB 4.4Å; L34-E91 HydrophobicContact CD1-CG 4.22Å; R87-E91 WeakPolarHBondContact O-CB 3.39Å; R87-E91 PolarHBondContact O-N 2.91Å; V88-E91 PolarHBondContact O-N 3.33Å; A89-E91 VanDerWaalsContact C-N 3.35Å; A89-E91 PolarHBondContact O-N 2.89Å; E91-E93 VanDerWaalsContact C-N 3.32Å; E91-E93 PolarHBondContact O-N 3.2Å; E91-R94 PolarHBondContact O-N 3.11Å; E91-R94 IonicContact OE2-NH1 3.78Å; E91-T95 WeakPolarHBondContact O-CB 3.34Å; E91-T95 PolarHBondContact O-N 2.98Å; E91-T95 PolarHBondContact O-OG1 3.37Å; E91-T95 VanDerWaalsContact O-OG1 3.05Å
92	R	88.1	Confident	83.9	Confident	172 Å²	172	82.6 Å²	82.6	65%	0.649	40%	0.395	S	S	*	.	H	α-helix	trans	-57.7	-46	171.6	-179.8	168.4	-175.6	-147.2	1.8	111.7	L34 V88 A89 T95 R96	L34-R92 VanDerWaalsContact CD1-CA 3.45Å; L34-R92 HydrophobicContact CD1-CB 3.86Å; L34-R92 HydrophobicContact CD2-CB 4Å; L34-R92 HydrophobicContact CD2-CG 3.82Å; V88-R92 WeakPolarHBondContact O-CB 3.41Å; V88-R92 PolarHBondContact O-N 3.26Å; A89-R92 PolarHBondContact O-N 3.49Å; R92-T95 PolarHBondContact O-N 3.21Å; R92-R96 WeakPolarHBondContact O-CB 3.5Å; R92-R96 PolarHBondContact O-N 3.4Å
93	E	93.4	Very high	86.1	Confident	87 Å²	87	77.8 Å²	77.8	41%	0.407	38%	0.38	S	S	.	.	H	α-helix	trans	-69	-36.9	-178.7	-179.1	52.4	-154.2	0	0	112.6	A89 N90 E91 R96 T97	A89-E93 WeakPolarHBondContact O-CB 3.38Å; A89-E93 PolarHBondContact O-N 3.48Å; N90-E93 PolarHBondContact O-N 3.33Å; E91-E93 VanDerWaalsContact C-N 3.32Å; E91-E93 PolarHBondContact O-N 3.2Å; E93-R96 PolarHBondContact O-N 2.87Å; E93-R96 IonicContact OE1-CZ 2.88Å; E93-R96 IonicContact OE1-NE 3.12Å; E93-R96 PolarHBondContact OE1-NE 3.11Å; E93-R96 IonicContact OE1-NH2 3.34Å; E93-R96 PolarHBondContact OE1-NH2 2.78Å; E93-R96 IonicContact OE2-CZ 3.53Å; E93-R96 IonicContact OE2-NE 3.02Å; E93-R96 PolarHBondContact OE2-NE 3.38Å; E93-R96 IonicContact OE2-NH2 3.72Å; E93-T97 WeakPolarHBondContact O-CB 3.37Å; E93-T97 PolarHBondContact O-N 3.34Å; E93-T97 PolarHBondContact O-OG1 3.38Å; E93-T97 VanDerWaalsContact O-OG1 3.04Å; E93-T97 PolarHBondContact OE1-OG1 3.41Å
94	R	92.2	Very high	88.1	Confident	170 Å²	170	78.2 Å²	78.2	64%	0.642	38%	0.379	S	S	*	.	H	α-helix	trans	-60.3	-46.8	170.9	-75.8	172.5	178.1	-176.2	-2.8	111.5	N90 E91 T97 A98	N90-R94 VanDerWaalsContact O-CG 3.32Å; N90-R94 WeakPolarHBondContact O-CG 3.4Å; N90-R94 PolarHBondContact O-N 3.13Å; E91-R94 PolarHBondContact O-N 3.11Å; E91-R94 IonicContact OE2-NH1 3.78Å; R94-T97 PolarHBondContact O-N 3.33Å; R94-A98 WeakPolarHBondContact O-CB 3.38Å; R94-A98 PolarHBondContact O-N 3.09Å
95	T	90.5	Very high	89.8	Confident	11 Å²	11	80.2 Å²	80.2	7%	0.067	39%	0.387	C	S	.	.	H	α-helix	trans	-60.9	-46.4	178.4	-63.9	0	0	0	0	111.6	K30 E91 R92 T97 A98 S99	K30-T95 HydrophobicContact CB-CG2 3.92Å; E91-T95 WeakPolarHBondContact O-CB 3.34Å; E91-T95 PolarHBondContact O-N 2.98Å; E91-T95 PolarHBondContact O-OG1 3.37Å; E91-T95 VanDerWaalsContact O-OG1 3.05Å; R92-T95 PolarHBondContact O-N 3.21Å; T95-T97 VanDerWaalsContact C-N 3.35Å; T95-T97 PolarHBondContact O-N 3.11Å; T95-A98 PolarHBondContact O-N 3.38Å; T95-S99 PolarHBondContact O-N 2.95Å
96	R	93	Very high	90.8	Very high	130 Å²	130	77 Å²	77	49%	0.491	37%	0.37	S	S	.	.	H	α-helix	trans	-57.5	-47.4	175.4	-169.5	-162.9	69.8	73.2	1	111.6	R92 E93 S99 V100	R92-R96 WeakPolarHBondContact O-CB 3.5Å; R92-R96 PolarHBondContact O-N 3.4Å; E93-R96 PolarHBondContact O-N 2.87Å; E93-R96 IonicContact OE1-CZ 2.88Å; E93-R96 IonicContact OE1-NE 3.12Å; E93-R96 PolarHBondContact OE1-NE 3.11Å; E93-R96 IonicContact OE1-NH2 3.34Å; E93-R96 PolarHBondContact OE1-NH2 2.78Å; E93-R96 IonicContact OE2-CZ 3.53Å; E93-R96 IonicContact OE2-NE 3.02Å; E93-R96 PolarHBondContact OE2-NE 3.38Å; E93-R96 IonicContact OE2-NH2 3.72Å; R96-S99 PolarHBondContact O-N 2.85Å; R96-V100 WeakPolarHBondContact O-CG2 3.34Å; R96-V100 PolarHBondContact O-N 2.87Å
97	T	96.1	Very high	91.6	Very high	48 Å²	48	71.7 Å²	71.7	29%	0.294	35%	0.349	S	S	.	.	H	α-helix	trans	-66.2	-39.1	179.4	-64.1	0	0	0	0	112	E93 R94 T95 V100 N101	E93-T97 WeakPolarHBondContact O-CB 3.37Å; E93-T97 PolarHBondContact O-N 3.34Å; E93-T97 PolarHBondContact O-OG1 3.38Å; E93-T97 VanDerWaalsContact O-OG1 3.04Å; E93-T97 PolarHBondContact OE1-OG1 3.41Å; R94-T97 PolarHBondContact O-N 3.33Å; T95-T97 VanDerWaalsContact C-N 3.35Å; T95-T97 PolarHBondContact O-N 3.11Å; T97-V100 PolarHBondContact O-N 3.41Å; T97-N101 VanDerWaalsContact O-CG 3.25Å; T97-N101 PolarHBondContact O-N 3.12Å; T97-N101 PolarHBondContact O-ND2 3.4Å
98	A	92.2	Very high	92.2	Very high	28 Å²	28	66 Å²	66	23%	0.231	33%	0.328	C	S	.	.	H	α-helix	trans	-62.2	-46	176.5	0	0	0	0	0	111.2	R94 T95 V100 N101 D102	R94-A98 WeakPolarHBondContact O-CB 3.38Å; R94-A98 PolarHBondContact O-N 3.09Å; T95-A98 PolarHBondContact O-N 3.38Å; A98-V100 VanDerWaalsContact C-N 3.32Å; A98-V100 PolarHBondContact O-N 2.92Å; A98-N101 PolarHBondContact O-N 2.8Å; A98-N101 VanDerWaalsContact O-N 3.1Å; A98-D102 WeakPolarHBondContact O-CB 3.5Å; A98-D102 PolarHBondContact O-N 3.45Å
99	S	91.3	Very high	92.7	Very high	17 Å²	17	68.5 Å²	68.5	12%	0.119	34%	0.34	C	S	.	.	H	α-helix	trans	-57.6	-41.8	175.2	162.5	0	0	0	0	112.9	Y23 Y27 T95 R96 D102 A103	Y23-S99 PolarHBondContact OH-O 3.33Å; Y23-S99 PolarHBondContact OH-OG 3.09Å; Y27-S99 WeakPolarHBondContact CD2-OG 3.44Å; Y27-S99 WeakPolarHBondContact CE2-OG 3.36Å; T95-S99 PolarHBondContact O-N 2.95Å; R96-S99 PolarHBondContact O-N 2.85Å; S99-D102 PolarHBondContact O-N 3.43Å; S99-A103 PolarHBondContact O-N 3.19Å; S99-A103 VanDerWaalsContact O-N 3.1Å
100	V	96.2	Very high	93.1	Very high	57 Å²	57	69.2 Å²	69.2	35%	0.345	34%	0.337	S	S	.	.	H	α-helix	trans	-64.9	-42.6	175.1	171.3	0	0	0	0	111.1	R96 T97 A98 D102 A103 F104	R96-V100 WeakPolarHBondContact O-CG2 3.34Å; R96-V100 PolarHBondContact O-N 2.87Å; T97-V100 PolarHBondContact O-N 3.41Å; A98-V100 VanDerWaalsContact C-N 3.32Å; A98-V100 PolarHBondContact O-N 2.92Å; V100-D102 VanDerWaalsContact C-N 3.34Å; V100-A103 PolarHBondContact O-N 2.98Å; V100-F104 HydrophobicContact CG1-CD2 3.98Å; V100-F104 HydrophobicContact CG1-CE2 4.06Å; V100-F104 WeakPolarHBondContact O-CD2 3.01Å; V100-F104 PolarHBondContact O-N 3.41Å
101	N	95.8	Very high	93.4	Very high	66 Å²	66	64.9 Å²	64.9	35%	0.353	31%	0.313	S	S	.	.	H	α-helix	trans	-66.3	-37.1	178.7	-69.7	-26.4	0	0	0	112	T97 A98 A103 F104 L105 K122	T97-N101 VanDerWaalsContact O-CG 3.25Å; T97-N101 PolarHBondContact O-N 3.12Å; T97-N101 PolarHBondContact O-ND2 3.4Å; A98-N101 PolarHBondContact O-N 2.8Å; A98-N101 VanDerWaalsContact O-N 3.1Å; N101-A103 VanDerWaalsContact C-N 3.33Å; N101-F104 WeakPolarHBondContact O-CB 3.28Å; N101-F104 PolarHBondContact O-N 3.37Å; N101-L105 PolarHBondContact O-N 3.11Å; N101-K122 WeakPolarHBondContact OD1-CE 3.29Å; N101-K122 PolarHBondContact OD1-NZ 2.99Å
102	D	93.3	Very high	93.6	Very high	39 Å²	39	64.6 Å²	64.6	21%	0.209	32%	0.316	C	S	.	.	H	α-helix	trans	-61.8	-41.6	174.6	-66.4	-22	0	0	0	110.4	Y23 H26 K30 A98 S99 V100 F104 L105 M106	Y23-D102 HydrophobicContact CD2-CB 4.03Å; Y23-D102 HydrophobicContact CE2-CB 3.59Å; H26-D102 IonicContact CE1-OD2 3.76Å; H26-D102 PolarHBondContact CE1-OD2 3Å; H26-D102 IonicContact ND1-OD2 2.66Å; H26-D102 PolarHBondContact ND1-OD2 3.37Å; H26-D102 VanDerWaalsContact ND1-OD2 3.12Å; K30-D102 IonicContact NZ-OD2 3.22Å; K30-D102 PolarHBondContact NZ-OD2 2.79Å; A98-D102 WeakPolarHBondContact O-CB 3.5Å; A98-D102 PolarHBondContact O-N 3.45Å; S99-D102 PolarHBondContact O-N 3.43Å; V100-D102 VanDerWaalsContact C-N 3.34Å; D102-F104 PolarHBondContact O-N 2.9Å; D102-L105 WeakPolarHBondContact O-CB 3.32Å; D102-L105 PolarHBondContact O-N 3.26Å; D102-M106 PolarHBondContact O-N 3.27Å
103	A	94.9	Very high	93.7	Very high	40 Å²	40	57.6 Å²	57.6	33%	0.331	29%	0.292	S	S	.	.	H	α-helix	trans	-65	-39.8	174.7	0	0	0	0	0	112.5	Y23 S99 V100 N101 L105 M106 L107	Y23-A103 HydrophobicContact CE2-CB 4.13Å; S99-A103 PolarHBondContact O-N 3.19Å; S99-A103 VanDerWaalsContact O-N 3.1Å; V100-A103 PolarHBondContact O-N 2.98Å; N101-A103 VanDerWaalsContact C-N 3.33Å; A103-L105 VanDerWaalsContact C-N 3.29Å; A103-L105 PolarHBondContact O-N 3.26Å; A103-M106 PolarHBondContact O-N 2.98Å; A103-L107 PolarHBondContact O-N 3.06Å
104	F	97.7	Very high	93.4	Very high	37 Å²	37	61.4 Å²	61.4	16%	0.162	31%	0.31	C	S	.	.	H	α-helix	trans	-62.3	-36.5	172.8	-95.2	-80.9	0	0	0	112.3	V100 N101 D102 L107 R108 K122 T125 L126	V100-F104 HydrophobicContact CG1-CD2 3.98Å; V100-F104 HydrophobicContact CG1-CE2 4.06Å; V100-F104 WeakPolarHBondContact O-CD2 3.01Å; V100-F104 PolarHBondContact O-N 3.41Å; N101-F104 WeakPolarHBondContact O-CB 3.28Å; N101-F104 PolarHBondContact O-N 3.37Å; D102-F104 PolarHBondContact O-N 2.9Å; F104-L107 PolarHBondContact O-N 2.94Å; F104-R108 WeakPolarHBondContact O-CG 3.49Å; F104-R108 PolarHBondContact O-N 3.48Å; F104-R108 VanDerWaalsContact O-N 3.11Å; F104-K122 HydrophobicContact CD1-CB 4.37Å; F104-K122 HydrophobicContact CD1-CG 4.14Å; F104-K122 HydrophobicContact CE1-CB 3.85Å; F104-K122 HydrophobicContact CE1-CG 4.01Å; F104-K122 HydrophobicContact CE2-CD 4.27Å; F104-K122 HydrophobicContact CE2-CG 4.5Å; F104-K122 HydrophobicContact CG-CG 4.44Å; F104-K122 HydrophobicContact CZ-CB 4.15Å; F104-K122 HydrophobicContact CZ-CD 4.29Å; F104-K122 HydrophobicContact CZ-CG 4.2Å; F104-T125 HydrophobicContact CD1-CG2 4.25Å; F104-L126 HydrophobicContact CE1-CD1 4.47Å; F104-L126 HydrophobicContact CE1-CD2 4.14Å; F104-L126 HydrophobicContact CE1-CG 4.07Å; F104-L126 HydrophobicContact CZ-CD1 4.42Å; F104-L126 HydrophobicContact CZ-CD2 4.37Å; F104-L126 HydrophobicContact CZ-CG 4.43Å
105	L	93.7	Very high	93.1	Very high	89 Å²	89	56.5 Å²	56.5	47%	0.466	30%	0.3	S	S	.	.	H	α-helix	trans	-65.5	-46.3	176.8	-178.7	64.5	0	0	0	111.1	N101 D102 A103 L107 R108 N109	N101-L105 PolarHBondContact O-N 3.11Å; D102-L105 WeakPolarHBondContact O-CB 3.32Å; D102-L105 PolarHBondContact O-N 3.26Å; A103-L105 VanDerWaalsContact C-N 3.29Å; A103-L105 PolarHBondContact O-N 3.26Å; L105-L107 VanDerWaalsContact C-N 3.32Å; L105-L107 PolarHBondContact O-N 2.88Å; L105-R108 WeakPolarHBondContact O-CB 3.33Å; L105-R108 PolarHBondContact O-N 3.22Å; L105-N109 PolarHBondContact O-N 3.37Å
106	M	93	Very high	92.8	Very high	46 Å²	46	60.9 Å²	60.9	23%	0.227	32%	0.322	C	S	.	.	H	α-helix	trans	-56.9	-47.4	174.2	-70.8	-179.9	73.6	0	0	111.5	L19 L20 Y23 D102 A103 R108 N109 L110	L19-M106 HydrophobicContact CB-CE 4.35Å; L20-M106 HydrophobicContact CB-CE 4.3Å; L20-M106 HydrophobicContact CD1-CE 4.01Å; Y23-M106 WeakPolarHBondContact CB-SD 3.44Å; Y23-M106 HydrophobicContact CD1-SD 4.26Å; Y23-M106 HydrophobicContact CD2-CG 4.42Å; Y23-M106 HydrophobicContact CD2-SD 3.39Å; Y23-M106 WeakPolarHBondContact CD2-SD 3.35Å; Y23-M106 HydrophobicContact CE2-SD 4.23Å; Y23-M106 HydrophobicContact CG-SD 3.4Å; D102-M106 PolarHBondContact O-N 3.27Å; A103-M106 PolarHBondContact O-N 2.98Å; M106-R108 VanDerWaalsContact C-N 3.27Å; M106-R108 PolarHBondContact O-N 3.09Å; M106-N109 WeakPolarHBondContact O-CB 3.4Å; M106-N109 PolarHBondContact O-N 3Å; M106-L110 PolarHBondContact O-N 3.03Å
107	L	96.1	Very high	92.5	Very high	58 Å²	58	60.7 Å²	60.7	30%	0.304	33%	0.331	S	S	.	.	H	α-helix	trans	-57.9	-39.8	179.2	-175.7	59	0	0	0	112	A103 F104 L105 N109 L110 I111 T125 L126 A129	A103-L107 PolarHBondContact O-N 3.06Å; F104-L107 PolarHBondContact O-N 2.94Å; L105-L107 VanDerWaalsContact C-N 3.32Å; L105-L107 PolarHBondContact O-N 2.88Å; L107-N109 VanDerWaalsContact C-N 3.33Å; L107-N109 PolarHBondContact O-N 3.32Å; L107-L110 PolarHBondContact O-N 3.03Å; L107-I111 WeakPolarHBondContact O-CG1 3.41Å; L107-T125 HydrophobicContact CB-CG2 4.18Å; L107-T125 HydrophobicContact CD2-CG2 3.81Å; L107-T125 HydrophobicContact CG-CG2 3.82Å; L107-L126 HydrophobicContact CD2-CD2 4.41Å; L107-A129 HydrophobicContact CD1-CB 4.01Å; L107-A129 HydrophobicContact CD2-CB 4.23Å; L107-A129 HydrophobicContact CG-CB 4.28Å
108	R	95.2	Very high	92.3	Very high	69 Å²	69	64 Å²	64	26%	0.26	34%	0.338	S	S	.	.	H	α-helix	trans	-60.9	-40.4	175.7	-70.2	171.1	-165.7	162	4.8	112.6	F104 L105 M106 L110 I111 L120 T125	F104-R108 WeakPolarHBondContact O-CG 3.49Å; F104-R108 PolarHBondContact O-N 3.48Å; F104-R108 VanDerWaalsContact O-N 3.11Å; L105-R108 WeakPolarHBondContact O-CB 3.33Å; L105-R108 PolarHBondContact O-N 3.22Å; M106-R108 VanDerWaalsContact C-N 3.27Å; M106-R108 PolarHBondContact O-N 3.09Å; R108-L110 PolarHBondContact O-N 3.35Å; R108-I111 PolarHBondContact O-N 2.99Å; R108-I111 VanDerWaalsContact O-N 3.11Å; R108-L120 HydrophobicContact CG-CB 4.34Å; R108-L120 PolarHBondContact NE-O 3.38Å; R108-L120 VanDerWaalsContact NE-O 3.08Å; R108-L120 PolarHBondContact NH2-O 3.31Å; R108-T125 HydrophobicContact CG-CG2 3.7Å; R108-T125 WeakPolarHBondContact CG-OG1 3.47Å; R108-T125 PolarHBondContact NE-OG1 3.04Å
109	N	92.4	Very high	92.4	Very high	78 Å²	78	72 Å²	72	42%	0.417	37%	0.367	S	S	.	.	H	α-helix	trans	-65.9	-23.8	-178.6	-65.2	-16.1	0	0	0	112.6	L105 M106 L107	L105-N109 PolarHBondContact O-N 3.37Å; M106-N109 WeakPolarHBondContact O-CB 3.4Å; M106-N109 PolarHBondContact O-N 3Å; L107-N109 VanDerWaalsContact C-N 3.33Å; L107-N109 PolarHBondContact O-N 3.32Å
110	L	93.8	Very high	92.6	Very high	67 Å²	67	71.5 Å²	71.5	35%	0.351	36%	0.363	S	S	.	.	H	α-helix	trans	-81.3	-19.7	176.3	-56.9	-174.1	0	0	0	113.3	Q16 M106 L107 R108 P112 Y132	Q16-L110 HydrophobicContact CG-CD2 3.86Å; M106-L110 PolarHBondContact O-N 3.03Å; L107-L110 PolarHBondContact O-N 3.03Å; R108-L110 PolarHBondContact O-N 3.35Å; L110-P112 WeakPolarHBondContact O-CD 3.41Å; L110-Y132 WeakPolarHBondContact O-CE1 3.4Å
111	I	94.7	Very high	92.7	Very high	5 Å²	5	71.1 Å²	71.1	3%	0.026	36%	0.363	C	S	.	.	S	Bend	trans	-84.7	121.1	-177.9	-60.4	167.3	0	0	0	109.3	L107 R108 T113 L120 T125 L128 A129 F198	L107-I111 WeakPolarHBondContact O-CG1 3.41Å; R108-I111 PolarHBondContact O-N 2.99Å; R108-I111 VanDerWaalsContact O-N 3.11Å; I111-T113 HydrophobicContact CG2-CG2 3.86Å; I111-T113 PolarHBondContact O-N 3.47Å; I111-T113 VanDerWaalsContact O-N 3.11Å; I111-L120 HydrophobicContact CD1-CD1 4.26Å; I111-T125 HydrophobicContact CD1-CG2 3.81Å; I111-T125 WeakPolarHBondContact CD1-O 3.45Å; I111-L128 HydrophobicContact CD1-CB 4.12Å; I111-L128 HydrophobicContact CG2-CB 3.82Å; I111-L128 HydrophobicContact CG2-CD1 4.42Å; I111-A129 HydrophobicContact CD1-CB 4.02Å; I111-A129 HydrophobicContact CG1-CB 4.35Å; I111-F198 HydrophobicContact CG2-CE1 4.23Å; I111-F198 HydrophobicContact CG2-CZ 4.06Å
112	P	91.4	Very high	92.8	Very high	43 Å²	43	72.7 Å²	72.7	28%	0.279	37%	0.367	S	S	.	.			trans	-72.1	107.8	177.6	27.1	-30.2	0	0	0	110.6	L110 Y132 F198	L110-P112 WeakPolarHBondContact O-CD 3.41Å; P112-Y132 HydrophobicContact CG-CD2 3.82Å; P112-Y132 HydrophobicContact CG-CE1 4.24Å; P112-Y132 HydrophobicContact CG-CE2 3.51Å; P112-Y132 HydrophobicContact CG-CG 4.34Å; P112-F198 HydrophobicContact CG-CD1 3.8Å; P112-F198 HydrophobicContact CG-CE1 3.68Å; P112-F198 WeakPolarHBondContact O-CE1 2.94Å
113	T	90.9	Very high	93	Very high	25 Å²	25	75 Å²	75	15%	0.153	38%	0.378	C	S	.	.			trans	-127.4	158	175.2	59.8	0	0	0	0	111	I111 P115 I116 L120 L128	I111-T113 HydrophobicContact CG2-CG2 3.86Å; I111-T113 PolarHBondContact O-N 3.47Å; I111-T113 VanDerWaalsContact O-N 3.11Å; T113-P115 CarbonylContact C-O 3.47Å; T113-P115 CarbonylContact O-C 3.53Å; T113-P115 VanDerWaalsContact O-C 3.27Å; T113-P115 PolarHBondContact OG1-O 2.88Å; T113-I116 WeakPolarHBondContact O-CA 2.91Å; T113-I116 PolarHBondContact O-N 3.04Å; T113-L120 HydrophobicContact CG2-CD1 4.15Å; T113-L128 HydrophobicContact CG2-CD1 4.31Å
114	Q	86.5	Confident	93	Very high	166 Å²	166	76.4 Å²	76.4	78%	0.776	38%	0.378	S	S	*	.	S	Bend	trans	-112.9	124.2	170.5	-168.2	64.2	23	0	0	109.3
115	P	86.8	Confident	93	Very high	68 Å²	68	74.6 Å²	74.6	44%	0.442	37%	0.37	S	S	.	.	S	Bend	cis	-68.2	162	-10.7	32.9	-37.2	0	0	0	112.3	T113 N117 R118	T113-P115 CarbonylContact C-O 3.47Å; T113-P115 CarbonylContact O-C 3.53Å; T113-P115 VanDerWaalsContact O-C 3.27Å; T113-P115 PolarHBondContact OG1-O 2.88Å; P115-N117 PolarHBondContact O-N 3.29Å; P115-N117 VanDerWaalsContact O-N 3.09Å; P115-R118 VanDerWaalsContact O-CB 3.29Å; P115-R118 WeakPolarHBondContact O-CB 3.14Å; P115-R118 PolarHBondContact O-N 3.05Å
116	I	83.2	Confident	93.2	Very high	102 Å²	102	74.7 Å²	74.7	52%	0.523	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-26.6	-174.3	-165.5	164.1	0	0	0	114.1	M3 T113	M3-I116 HydrophobicContact CE-CD1 4.47Å; T113-I116 WeakPolarHBondContact O-CA 2.91Å; T113-I116 PolarHBondContact O-N 3.04Å
117	N	86.8	Confident	93.2	Very high	126 Å²	126	80.7 Å²	80.7	67%	0.674	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	24.4	179.1	62.2	-19.8	0	0	0	112.7	P115 K119	P115-N117 PolarHBondContact O-N 3.29Å; P115-N117 VanDerWaalsContact O-N 3.09Å; N117-K119 PolarHBondContact O-N 3.39Å
118	R	92.4	Very high	93.1	Very high	118 Å²	118	79.1 Å²	79.1	45%	0.445	38%	0.382	S	S	.	.			trans	-57	126.3	177.2	178.4	176.2	167.9	170.7	-6.2	110.4	P115 L120 E124	P115-R118 VanDerWaalsContact O-CB 3.29Å; P115-R118 WeakPolarHBondContact O-CB 3.14Å; P115-R118 PolarHBondContact O-N 3.05Å; R118-L120 HydrophobicContact CG-CD2 4.01Å; R118-L120 HydrophobicContact CG-CG 4.5Å; R118-L120 PolarHBondContact O-N 2.88Å; R118-L120 VanDerWaalsContact O-N 3.15Å; R118-E124 IonicContact NH2-OE1 2.81Å
119	K	94.1	Very high	93.2	Very high	197 Å²	197	76.3 Å²	76.3	86%	0.857	37%	0.374	S	S	*	.			trans	-76.3	102.5	176.3	-63.8	-173.8	178.5	-179.2	0	109.9	N117	N117-K119 PolarHBondContact O-N 3.39Å
120	L	95.3	Very high	93.3	Very high	6 Å²	6	76 Å²	76	3%	0.031	38%	0.378	C	S	.	.			trans	-92.9	139.2	176.2	-60.4	174.1	0	0	0	111.2	R108 I111 T113 R118 E124 L128	R108-L120 HydrophobicContact CG-CB 4.34Å; R108-L120 PolarHBondContact NE-O 3.38Å; R108-L120 VanDerWaalsContact NE-O 3.08Å; R108-L120 PolarHBondContact NH2-O 3.31Å; I111-L120 HydrophobicContact CD1-CD1 4.26Å; T113-L120 HydrophobicContact CG2-CD1 4.15Å; R118-L120 HydrophobicContact CG-CD2 4.01Å; R118-L120 HydrophobicContact CG-CG 4.5Å; R118-L120 PolarHBondContact O-N 2.88Å; R118-L120 VanDerWaalsContact O-N 3.15Å; L120-E124 HydrophobicContact CB-CB 4.31Å; L120-E124 HydrophobicContact CD2-CB 4.39Å; L120-L128 HydrophobicContact CD1-CD1 3.73Å; L120-L128 HydrophobicContact CD2-CD1 3.72Å; L120-L128 HydrophobicContact CG-CD1 4.37Å
121	S	97.9	Very high	93.1	Very high	49 Å²	49	74.4 Å²	74.4	34%	0.343	37%	0.373	S	S	.	.			trans	-66.7	167	168	67.2	0	0	0	0	111.8	I123 E124 T125	S121-I123 VanDerWaalsContact C-N 3.34Å; S121-I123 PolarHBondContact O-N 3.39Å; S121-I123 WeakPolarHBondContact OG-CG2 3.17Å; S121-E124 WeakPolarHBondContact CB-OE2 3.21Å; S121-E124 PolarHBondContact N-OE2 2.95Å; S121-E124 PolarHBondContact O-N 3Å; S121-E124 WeakPolarHBondContact OG-CB 3.49Å; S121-E124 VanDerWaalsContact OG-CG 3.25Å; S121-E124 WeakPolarHBondContact OG-CG 3.5Å; S121-E124 PolarHBondContact OG-N 3.42Å; S121-E124 PolarHBondContact OG-OE2 3.06Å; S121-T125 WeakPolarHBondContact O-CB 3.4Å; S121-T125 PolarHBondContact O-N 3.28Å; S121-T125 PolarHBondContact O-OG1 3.11Å
122	K	98.1	Very high	93.1	Very high	99 Å²	99	76.2 Å²	76.2	43%	0.43	38%	0.379	S	S	.	.	H	α-helix	trans	-57.9	-45.4	178.1	-70.2	-173.1	176.2	-174.6	0	111.6	N101 F104 T125 L126	N101-K122 WeakPolarHBondContact OD1-CE 3.29Å; N101-K122 PolarHBondContact OD1-NZ 2.99Å; F104-K122 HydrophobicContact CD1-CB 4.37Å; F104-K122 HydrophobicContact CD1-CG 4.14Å; F104-K122 HydrophobicContact CE1-CB 3.85Å; F104-K122 HydrophobicContact CE1-CG 4.01Å; F104-K122 HydrophobicContact CE2-CD 4.27Å; F104-K122 HydrophobicContact CE2-CG 4.5Å; F104-K122 HydrophobicContact CG-CG 4.44Å; F104-K122 HydrophobicContact CZ-CB 4.15Å; F104-K122 HydrophobicContact CZ-CD 4.29Å; F104-K122 HydrophobicContact CZ-CG 4.2Å; K122-T125 PolarHBondContact O-N 3.37Å; K122-L126 WeakPolarHBondContact O-CG 3.4Å; K122-L126 PolarHBondContact O-N 3.2Å
123	I	97.8	Very high	93.2	Very high	88 Å²	88	79 Å²	79	45%	0.451	39%	0.391	S	S	.	.	H	α-helix	trans	-68.9	-40.5	179.8	-174.2	58.7	0	0	0	112.5	S121 T125 L126 R127	S121-I123 VanDerWaalsContact C-N 3.34Å; S121-I123 PolarHBondContact O-N 3.39Å; S121-I123 WeakPolarHBondContact OG-CG2 3.17Å; I123-T125 VanDerWaalsContact C-N 3.34Å; I123-L126 PolarHBondContact O-N 3.44Å; I123-R127 HydrophobicContact CD1-CG 4.37Å; I123-R127 VanDerWaalsContact O-CG 3.31Å; I123-R127 WeakPolarHBondContact O-CG 3.5Å; I123-R127 PolarHBondContact O-N 3.42Å
124	E	95.5	Very high	93.2	Very high	68 Å²	68	79 Å²	79	32%	0.318	39%	0.391	S	S	.	.	H	α-helix	trans	-63.2	-41.9	174.9	-74.7	170.1	105.4	0	0	111.6	R118 L120 S121 L126 R127 L128	R118-E124 IonicContact NH2-OE1 2.81Å; L120-E124 HydrophobicContact CB-CB 4.31Å; L120-E124 HydrophobicContact CD2-CB 4.39Å; S121-E124 WeakPolarHBondContact CB-OE2 3.21Å; S121-E124 PolarHBondContact N-OE2 2.95Å; S121-E124 PolarHBondContact O-N 3Å; S121-E124 WeakPolarHBondContact OG-CB 3.49Å; S121-E124 VanDerWaalsContact OG-CG 3.25Å; S121-E124 WeakPolarHBondContact OG-CG 3.5Å; S121-E124 PolarHBondContact OG-N 3.42Å; S121-E124 PolarHBondContact OG-OE2 3.06Å; E124-L126 VanDerWaalsContact C-N 3.33Å; E124-L126 PolarHBondContact O-N 3.46Å; E124-R127 PolarHBondContact O-N 2.9Å; E124-L128 WeakPolarHBondContact O-CB 3.48Å; E124-L128 WeakPolarHBondContact O-CG 3.31Å; E124-L128 PolarHBondContact O-N 2.85Å
125	T	97.2	Very high	93.4	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-57.3	-48	178	-54.6	0	0	0	0	110.4	F104 L107 R108 I111 S121 K122 I123 A129	F104-T125 HydrophobicContact CD1-CG2 4.25Å; L107-T125 HydrophobicContact CB-CG2 4.18Å; L107-T125 HydrophobicContact CD2-CG2 3.81Å; L107-T125 HydrophobicContact CG-CG2 3.82Å; R108-T125 HydrophobicContact CG-CG2 3.7Å; R108-T125 WeakPolarHBondContact CG-OG1 3.47Å; R108-T125 PolarHBondContact NE-OG1 3.04Å; I111-T125 HydrophobicContact CD1-CG2 3.81Å; I111-T125 WeakPolarHBondContact CD1-O 3.45Å; S121-T125 WeakPolarHBondContact O-CB 3.4Å; S121-T125 PolarHBondContact O-N 3.28Å; S121-T125 PolarHBondContact O-OG1 3.11Å; K122-T125 PolarHBondContact O-N 3.37Å; I123-T125 VanDerWaalsContact C-N 3.34Å; T125-A129 WeakPolarHBondContact O-CB 3.46Å; T125-A129 PolarHBondContact O-N 3.23Å
126	L	97.9	Very high	93.6	Very high	90 Å²	90	71.4 Å²	71.4	47%	0.471	35%	0.352	S	S	.	.	H	α-helix	trans	-64.2	-44.5	178.8	-65.9	174	0	0	0	112.3	F104 L107 K122 I123 E124 A129 S130	F104-L126 HydrophobicContact CE1-CD1 4.47Å; F104-L126 HydrophobicContact CE1-CD2 4.14Å; F104-L126 HydrophobicContact CE1-CG 4.07Å; F104-L126 HydrophobicContact CZ-CD1 4.42Å; F104-L126 HydrophobicContact CZ-CD2 4.37Å; F104-L126 HydrophobicContact CZ-CG 4.43Å; L107-L126 HydrophobicContact CD2-CD2 4.41Å; K122-L126 WeakPolarHBondContact O-CG 3.4Å; K122-L126 PolarHBondContact O-N 3.2Å; I123-L126 PolarHBondContact O-N 3.44Å; E124-L126 VanDerWaalsContact C-N 3.33Å; E124-L126 PolarHBondContact O-N 3.46Å; L126-A129 PolarHBondContact O-N 3.15Å; L126-S130 WeakPolarHBondContact O-CB 3.39Å; L126-S130 PolarHBondContact O-N 3.39Å
127	R	93.5	Very high	94	Very high	172 Å²	172	69.7 Å²	69.7	65%	0.649	34%	0.342	S	S	*	.	H	α-helix	trans	-63.4	-45.5	179.2	-72.9	176	178.5	171.4	1.6	111.9	I123 E124 S131	I123-R127 HydrophobicContact CD1-CG 4.37Å; I123-R127 VanDerWaalsContact O-CG 3.31Å; I123-R127 WeakPolarHBondContact O-CG 3.5Å; I123-R127 PolarHBondContact O-N 3.42Å; E124-R127 PolarHBondContact O-N 2.9Å; R127-S131 WeakPolarHBondContact O-CB 3.41Å; R127-S131 PolarHBondContact O-N 3.22Å
128	L	94.3	Very high	94	Very high	25 Å²	25	63.7 Å²	63.7	13%	0.131	31%	0.31	C	S	.	.	H	α-helix	trans	-70.1	-38.7	179.2	-72.3	174.6	0	0	0	111.8	I111 T113 L120 E124 S131 Y132 F198	I111-L128 HydrophobicContact CD1-CB 4.12Å; I111-L128 HydrophobicContact CG2-CB 3.82Å; I111-L128 HydrophobicContact CG2-CD1 4.42Å; T113-L128 HydrophobicContact CG2-CD1 4.31Å; L120-L128 HydrophobicContact CD1-CD1 3.73Å; L120-L128 HydrophobicContact CD2-CD1 3.72Å; L120-L128 HydrophobicContact CG-CD1 4.37Å; E124-L128 WeakPolarHBondContact O-CB 3.48Å; E124-L128 WeakPolarHBondContact O-CG 3.31Å; E124-L128 PolarHBondContact O-N 2.85Å; L128-S131 PolarHBondContact O-N 3.43Å; L128-Y132 VanDerWaalsContact O-CB 3.28Å; L128-Y132 WeakPolarHBondContact O-CB 3.45Å; L128-Y132 PolarHBondContact O-N 2.99Å; L128-F198 HydrophobicContact CB-CZ 4.39Å; L128-F198 HydrophobicContact CD2-CZ 4.21Å; L128-F198 WeakPolarHBondContact O-CE2 3.34Å
129	A	96.3	Very high	93.9	Very high	11 Å²	11	60.7 Å²	60.7	9%	0.091	30%	0.302	C	S	.	.	H	α-helix	trans	-60.3	-48.9	174.1	0	0	0	0	0	111.6	L107 I111 T125 L126 S131 Y132 I133	L107-A129 HydrophobicContact CD1-CB 4.01Å; L107-A129 HydrophobicContact CD2-CB 4.23Å; L107-A129 HydrophobicContact CG-CB 4.28Å; I111-A129 HydrophobicContact CD1-CB 4.02Å; I111-A129 HydrophobicContact CG1-CB 4.35Å; T125-A129 WeakPolarHBondContact O-CB 3.46Å; T125-A129 PolarHBondContact O-N 3.23Å; L126-A129 PolarHBondContact O-N 3.15Å; A129-S131 VanDerWaalsContact C-N 3.34Å; A129-S131 PolarHBondContact O-N 3.26Å; A129-Y132 PolarHBondContact O-N 3.3Å; A129-Y132 VanDerWaalsContact O-N 3.12Å; A129-I133 WeakPolarHBondContact O-CG1 3.26Å; A129-I133 PolarHBondContact O-N 2.89Å
130	S	94.1	Very high	93.7	Very high	72 Å²	72	58.2 Å²	58.2	50%	0.503	30%	0.297	S	S	.	.	H	α-helix	trans	-59.3	-44.3	176.5	174.7	0	0	0	0	112.2	L126 Y132 S134	L126-S130 WeakPolarHBondContact O-CB 3.39Å; L126-S130 PolarHBondContact O-N 3.39Å; S130-Y132 VanDerWaalsContact C-N 3.31Å; S130-Y132 PolarHBondContact O-N 3.2Å; S130-S134 PolarHBondContact O-N 3.48Å; S130-S134 VanDerWaalsContact O-N 3.09Å; S130-S134 PolarHBondContact O-OG 3.43Å
131	S	91	Very high	93.3	Very high	33 Å²	33	61 Å²	61	23%	0.231	32%	0.315	C	S	.	.	H	α-helix	trans	-63.3	-36.8	175.1	-178.5	0	0	0	0	112.1	R127 L128 A129 S134 H135	R127-S131 WeakPolarHBondContact O-CB 3.41Å; R127-S131 PolarHBondContact O-N 3.22Å; L128-S131 PolarHBondContact O-N 3.43Å; A129-S131 VanDerWaalsContact C-N 3.34Å; A129-S131 PolarHBondContact O-N 3.26Å; S131-S134 WeakPolarHBondContact O-CB 3.49Å; S131-S134 PolarHBondContact O-N 3.44Å; S131-H135 WeakPolarHBondContact O-CB 3.4Å; S131-H135 PolarHBondContact O-N 3.17Å
132	Y	94.4	Very high	92.7	Very high	43 Å²	43	60.2 Å²	60.2	17%	0.169	31%	0.307	C	S	.	.	H	α-helix	trans	-71.9	-43.6	-179	-175.4	-137.3	0	0	0	111.6	L110 P112 L128 A129 S130 S134 H135 L136 F198	L110-Y132 WeakPolarHBondContact O-CE1 3.4Å; P112-Y132 HydrophobicContact CG-CD2 3.82Å; P112-Y132 HydrophobicContact CG-CE1 4.24Å; P112-Y132 HydrophobicContact CG-CE2 3.51Å; P112-Y132 HydrophobicContact CG-CG 4.34Å; L128-Y132 VanDerWaalsContact O-CB 3.28Å; L128-Y132 WeakPolarHBondContact O-CB 3.45Å; L128-Y132 PolarHBondContact O-N 2.99Å; A129-Y132 PolarHBondContact O-N 3.3Å; A129-Y132 VanDerWaalsContact O-N 3.12Å; S130-Y132 VanDerWaalsContact C-N 3.31Å; S130-Y132 PolarHBondContact O-N 3.2Å; Y132-S134 VanDerWaalsContact C-N 3.27Å; Y132-S134 PolarHBondContact O-N 2.88Å; Y132-H135 WeakPolarHBondContact O-CB 3.5Å; Y132-H135 PolarHBondContact O-N 3.18Å; Y132-L136 HydrophobicContact CD1-CD1 4.21Å; Y132-L136 HydrophobicContact CD2-CD1 4.44Å; Y132-L136 HydrophobicContact CD2-CD2 4.5Å; Y132-L136 HydrophobicContact CD2-CG 4.09Å; Y132-L136 HydrophobicContact CE1-CD1 3.81Å; Y132-L136 HydrophobicContact CE1-CG 4.41Å; Y132-L136 HydrophobicContact CE2-CD1 4.05Å; Y132-L136 HydrophobicContact CE2-CD2 3.71Å; Y132-L136 HydrophobicContact CE2-CG 3.74Å; Y132-L136 WeakPolarHBondContact O-CG 3.46Å; Y132-L136 PolarHBondContact O-N 3.25Å; Y132-F198 HydrophobicContact CD2-CD1 4.35Å; Y132-F198 HydrophobicContact CD2-CD2 4.28Å; Y132-F198 HydrophobicContact CD2-CE1 4.33Å; Y132-F198 HydrophobicContact CD2-CE2 4.29Å; Y132-F198 HydrophobicContact CD2-CG 4.32Å; Y132-F198 HydrophobicContact CD2-CZ 4.31Å; Y132-F198 HydrophobicContact CG-CE2 4.33Å; Y132-F198 HydrophobicContact CG-CZ 4.23Å; Y132-F198 VanDerWaalsContact N-CE2 3.3Å
133	I	94.1	Very high	92.1	Very high	101 Å²	101	58.9 Å²	58.9	52%	0.518	32%	0.322	S	S	.	.	H	α-helix	trans	-55.5	-47.4	172.1	-67.5	164.6	0	0	0	109.9	A129 H135 L136 H137	A129-I133 WeakPolarHBondContact O-CG1 3.26Å; A129-I133 PolarHBondContact O-N 2.89Å; I133-H135 VanDerWaalsContact C-N 3.27Å; I133-H135 PolarHBondContact O-N 3.39Å; I133-L136 PolarHBondContact O-N 2.9Å; I133-H137 WeakPolarHBondContact O-CB 3.4Å; I133-H137 PolarHBondContact O-N 3.1Å
134	S	89.6	Confident	91.1	Very high	24 Å²	24	55.1 Å²	55.1	17%	0.168	30%	0.304	C	S	.	.	H	α-helix	trans	-62.1	-35.9	177.6	-59.7	0	0	0	0	112.7	S130 S131 Y132 A138	S130-S134 PolarHBondContact O-N 3.48Å; S130-S134 VanDerWaalsContact O-N 3.09Å; S130-S134 PolarHBondContact O-OG 3.43Å; S131-S134 WeakPolarHBondContact O-CB 3.49Å; S131-S134 PolarHBondContact O-N 3.44Å; Y132-S134 VanDerWaalsContact C-N 3.27Å; Y132-S134 PolarHBondContact O-N 2.88Å; S134-A138 WeakPolarHBondContact O-CB 3.47Å; S134-A138 PolarHBondContact O-N 3.17Å
135	H	90.5	Very high	89.9	Confident	11 Å²	11	53.4 Å²	53.4	5%	0.051	30%	0.304	C	S	.	.	H	α-helix	trans	-69.8	-44.9	177.4	177	70.7	0	0	0	112.3	S131 Y132 I133 H137 A138 I139 C151 F198 C199	S131-H135 WeakPolarHBondContact O-CB 3.4Å; S131-H135 PolarHBondContact O-N 3.17Å; Y132-H135 WeakPolarHBondContact O-CB 3.5Å; Y132-H135 PolarHBondContact O-N 3.18Å; I133-H135 VanDerWaalsContact C-N 3.27Å; I133-H135 PolarHBondContact O-N 3.39Å; H135-H137 VanDerWaalsContact C-N 3.33Å; H135-H137 PolarHBondContact O-N 2.94Å; H135-A138 WeakPolarHBondContact O-CB 3.35Å; H135-A138 PolarHBondContact O-N 3.49Å; H135-I139 WeakPolarHBondContact O-CG1 3.47Å; H135-I139 PolarHBondContact O-N 3.42Å; H135-C151 PolarHBondContact ND1-SG 3.04Å; H135-F198 HydrophobicContact CB-CB 4.4Å; H135-F198 HydrophobicContact CB-CD2 4.14Å; H135-C199 VanDerWaalsContact CE1-SG 3.55Å; H135-C199 PolarHBondContact ND1-SG 2.8Å; H135-C199 VanDerWaalsContact ND1-SG 3.42Å
136	L	92	Very high	88.2	Confident	65 Å²	65	56.5 Å²	56.5	34%	0.34	32%	0.324	S	S	.	.	H	α-helix	trans	-61.4	-43.4	174.3	-67.7	177.7	0	0	0	111.3	Y132 I133 A138 I139 L140	Y132-L136 HydrophobicContact CD1-CD1 4.21Å; Y132-L136 HydrophobicContact CD2-CD1 4.44Å; Y132-L136 HydrophobicContact CD2-CD2 4.5Å; Y132-L136 HydrophobicContact CD2-CG 4.09Å; Y132-L136 HydrophobicContact CE1-CD1 3.81Å; Y132-L136 HydrophobicContact CE1-CG 4.41Å; Y132-L136 HydrophobicContact CE2-CD1 4.05Å; Y132-L136 HydrophobicContact CE2-CD2 3.71Å; Y132-L136 HydrophobicContact CE2-CG 3.74Å; Y132-L136 WeakPolarHBondContact O-CG 3.46Å; Y132-L136 PolarHBondContact O-N 3.25Å; I133-L136 PolarHBondContact O-N 2.9Å; L136-A138 VanDerWaalsContact C-N 3.31Å; L136-A138 PolarHBondContact O-N 3.3Å; L136-I139 HydrophobicContact CD2-CD1 4.48Å; L136-I139 WeakPolarHBondContact O-CB 3.21Å; L136-I139 PolarHBondContact O-N 2.71Å; L136-L140 WeakPolarHBondContact O-CG 3.25Å; L136-L140 PolarHBondContact O-N 3.27Å
137	H	90.8	Very high	86.7	Confident	66 Å²	66	55 Å²	55	31%	0.306	32%	0.324	S	S	.	.	H	α-helix	trans	-57.3	-45.8	174.2	-176.8	-83.1	0	0	0	111.7	I133 H135 I139 L140 V141 H154 Y158	I133-H137 WeakPolarHBondContact O-CB 3.4Å; I133-H137 PolarHBondContact O-N 3.1Å; H135-H137 VanDerWaalsContact C-N 3.33Å; H135-H137 PolarHBondContact O-N 2.94Å; H137-I139 VanDerWaalsContact C-N 3.33Å; H137-I139 PolarHBondContact O-N 3.42Å; H137-L140 PolarHBondContact O-N 3.37Å; H137-V141 VanDerWaalsContact CE1-CG2 3.48Å; H137-V141 WeakPolarHBondContact CE1-CG2 3.4Å; H137-V141 WeakPolarHBondContact O-CG2 3.49Å; H137-V141 PolarHBondContact O-N 3.22Å; H137-H154 AromaticContact CE1-CE1 3.36Å; H137-H154 PolarHBondContact CE1-CE1 2.88Å; H137-H154 AromaticContact ND1-CE1 3.18Å; H137-H154 PolarHBondContact ND1-CE1 2.98Å; H137-H154 AromaticContact ND1-ND1 3.86Å; H137-H154 AromaticContact ND1-NE2 3.78Å; H137-Y158 PolarHBondContact CE1-OH 3.47Å
138	A	88	Confident	85.9	Confident	0 Å²	0	50 Å²	50	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60	-43	177.7	0	0	0	0	0	112	S134 H135 L136 L140 V141 T142 P150 H154	S134-A138 WeakPolarHBondContact O-CB 3.47Å; S134-A138 PolarHBondContact O-N 3.17Å; H135-A138 WeakPolarHBondContact O-CB 3.35Å; H135-A138 PolarHBondContact O-N 3.49Å; L136-A138 VanDerWaalsContact C-N 3.31Å; L136-A138 PolarHBondContact O-N 3.3Å; A138-L140 VanDerWaalsContact C-N 3.31Å; A138-L140 PolarHBondContact O-N 3.42Å; A138-V141 PolarHBondContact O-N 3.08Å; A138-T142 WeakPolarHBondContact O-CB 3.45Å; A138-T142 WeakPolarHBondContact O-CG2 3.38Å; A138-T142 PolarHBondContact O-N 2.94Å; A138-T142 PolarHBondContact O-OG1 2.63Å; A138-P150 HydrophobicContact CB-CB 4.14Å; A138-H154 HydrophobicContact CB-CB 3.62Å
139	I	89.3	Confident	85.2	Confident	55 Å²	55	52.7 Å²	52.7	28%	0.282	32%	0.323	S	S	.	.	H	α-helix	trans	-58.2	-44.1	175.3	-69.2	165	0	0	0	111.2	H135 L136 H137 G143 P150	H135-I139 WeakPolarHBondContact O-CG1 3.47Å; H135-I139 PolarHBondContact O-N 3.42Å; L136-I139 HydrophobicContact CD2-CD1 4.48Å; L136-I139 WeakPolarHBondContact O-CB 3.21Å; L136-I139 PolarHBondContact O-N 2.71Å; H137-I139 VanDerWaalsContact C-N 3.33Å; H137-I139 PolarHBondContact O-N 3.42Å; I139-G143 WeakPolarHBondContact O-CA 3.49Å; I139-G143 PolarHBondContact O-N 3.29Å; I139-P150 HydrophobicContact CB-CB 4.47Å; I139-P150 HydrophobicContact CD1-CG 4.43Å; I139-P150 HydrophobicContact CG1-CB 3.75Å; I139-P150 HydrophobicContact CG1-CG 3.58Å
140	L	90.5	Very high	84.7	Confident	145 Å²	145	52.1 Å²	52.1	76%	0.759	32%	0.318	S	S	*	.	H	α-helix	trans	-65.3	-40.9	-179.7	-67.4	174.4	0	0	0	112.1	L136 H137 A138	L136-L140 WeakPolarHBondContact O-CG 3.25Å; L136-L140 PolarHBondContact O-N 3.27Å; H137-L140 PolarHBondContact O-N 3.37Å; A138-L140 VanDerWaalsContact C-N 3.31Å; A138-L140 PolarHBondContact O-N 3.42Å
141	V	87	Confident	84.4	Confident	65 Å²	65	49.1 Å²	49.1	39%	0.394	30%	0.297	S	S	.	.	H	α-helix	trans	-73.1	-41.6	-179.1	171.1	0	0	0	0	112.1	H137 A138 I157	H137-V141 VanDerWaalsContact CE1-CG2 3.48Å; H137-V141 WeakPolarHBondContact CE1-CG2 3.4Å; H137-V141 WeakPolarHBondContact O-CG2 3.49Å; H137-V141 PolarHBondContact O-N 3.22Å; A138-V141 PolarHBondContact O-N 3.08Å; V141-I157 HydrophobicContact CG1-CD1 4.27Å
142	T	85.9	Confident	84	Confident	31 Å²	31	51.3 Å²	51.3	19%	0.19	31%	0.306	C	S	.	.	H	α-helix	trans	-85.1	-14.8	-176.1	62.8	0	0	0	0	112.9	A138 S144 K153 H154 I157	A138-T142 WeakPolarHBondContact O-CB 3.45Å; A138-T142 WeakPolarHBondContact O-CG2 3.38Å; A138-T142 PolarHBondContact O-N 2.94Å; A138-T142 PolarHBondContact O-OG1 2.63Å; T142-S144 PolarHBondContact O-N 2.91Å; T142-S144 VanDerWaalsContact O-N 3.09Å; T142-S144 WeakPolarHBondContact OG1-CB 3.5Å; T142-S144 PolarHBondContact OG1-N 2.95Å; T142-S144 PolarHBondContact OG1-OG 3.09Å; T142-K153 HydrophobicContact CG2-CB 3.59Å; T142-H154 HydrophobicContact CG2-CB 4.02Å; T142-I157 HydrophobicContact CG2-CD1 4.03Å
143	G	84.5	Confident	83.4	Confident	72 Å²	72	53 Å²	53	74%	0.742	31%	0.314	S	S	*	.			trans	61.1	13.3	-171.6	0	0	0	0	0	113.4	I139	I139-G143 WeakPolarHBondContact O-CA 3.49Å; I139-G143 PolarHBondContact O-N 3.29Å
144	S	76.5	Confident	83	Confident	9 Å²	9	48.3 Å²	48.3	6%	0.063	29%	0.29	C	S	.	.			trans	-100.3	146.7	-163.2	80.9	0	0	0	0	111.8	T142 D148	T142-S144 PolarHBondContact O-N 2.91Å; T142-S144 VanDerWaalsContact O-N 3.09Å; T142-S144 WeakPolarHBondContact OG1-CB 3.5Å; T142-S144 PolarHBondContact OG1-N 2.95Å; T142-S144 PolarHBondContact OG1-OG 3.09Å; S144-D148 WeakPolarHBondContact CB-OD2 3.38Å; S144-D148 WeakPolarHBondContact OG-CB 3.41Å
145	G	71.1	Confident	82.5	Confident	32 Å²	32	49.9 Å²	49.9	33%	0.33	29%	0.294	S	S	.	.			trans	-70.7	175.7	178	0	0	0	0	0	112.8	A147 D148	G145-A147 PolarHBondContact O-N 3.34Å; G145-D148 PolarHBondContact N-OD2 3.29Å; G145-D148 WeakPolarHBondContact O-CB 3.41Å; G145-D148 PolarHBondContact O-N 3.09Å; G145-D148 VanDerWaalsContact O-N 3.08Å
146	P	62.1	Low	82	Confident	64 Å²	64	54.4 Å²	54.4	42%	0.416	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-57.4	-32.9	176.8	18.9	-29.2	0	0	0	113.4	D148 E202	P146-D148 PolarHBondContact O-N 3.29Å; P146-E202 HydrophobicContact CB-CB 3.81Å; P146-E202 HydrophobicContact CB-CG 4.04Å
147	A	65.9	Low	81.2	Confident	58 Å²	58	54.6 Å²	54.6	48%	0.479	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-67.9	-22	179	0	0	0	0	0	113.5	G145 Q149	G145-A147 PolarHBondContact O-N 3.34Å; A147-Q149 VanDerWaalsContact C-N 3.29Å; A147-Q149 PolarHBondContact O-N 3.2Å
148	D	75.5	Confident	80.3	Confident	69 Å²	69	55.5 Å²	55.5	37%	0.369	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-85.4	3.5	-173.9	-75.5	-62.2	0	0	0	114.5	S144 G145 P146 K153	S144-D148 WeakPolarHBondContact CB-OD2 3.38Å; S144-D148 WeakPolarHBondContact OG-CB 3.41Å; G145-D148 PolarHBondContact N-OD2 3.29Å; G145-D148 WeakPolarHBondContact O-CB 3.41Å; G145-D148 PolarHBondContact O-N 3.09Å; G145-D148 VanDerWaalsContact O-N 3.08Å; P146-D148 PolarHBondContact O-N 3.29Å; D148-K153 HydrophobicContact CB-CD 4.37Å; D148-K153 WeakPolarHBondContact O-CD 3.42Å; D148-K153 VanDerWaalsContact O-CE 3.29Å; D148-K153 WeakPolarHBondContact O-CE 3.5Å; D148-K153 IonicContact OD1-NZ 2.91Å; D148-K153 PolarHBondContact OD1-NZ 2.95Å
149	Q	80.9	Confident	79.4	Confident	80 Å²	80	61.1 Å²	61.1	37%	0.374	34%	0.344	S	S	.	.			trans	50.2	62.6	-175.3	-54.3	-174.3	23.2	0	0	112	A147 C151 L152 K153	A147-Q149 VanDerWaalsContact C-N 3.29Å; A147-Q149 PolarHBondContact O-N 3.2Å; Q149-C151 VanDerWaalsContact C-N 3.25Å; Q149-C151 PolarHBondContact O-N 3.01Å; Q149-C151 VanDerWaalsContact O-N 3.11Å; Q149-L152 HydrophobicContact CB-CB 4.12Å; Q149-L152 WeakPolarHBondContact O-CB 3.32Å; Q149-L152 PolarHBondContact O-N 2.99Å; Q149-K153 PolarHBondContact O-N 3.43Å
150	P	84.9	Confident	78.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-53.6	-41.5	-171.4	20.3	-33.5	0	0	0	112.4	A138 I139 L152 K153 H154	A138-P150 HydrophobicContact CB-CB 4.14Å; I139-P150 HydrophobicContact CB-CB 4.47Å; I139-P150 HydrophobicContact CD1-CG 4.43Å; I139-P150 HydrophobicContact CG1-CB 3.75Å; I139-P150 HydrophobicContact CG1-CG 3.58Å; P150-L152 VanDerWaalsContact C-N 3.25Å; P150-L152 PolarHBondContact O-N 3.42Å; P150-K153 PolarHBondContact O-N 2.85Å; P150-H154 WeakPolarHBondContact O-CB 3.48Å; P150-H154 PolarHBondContact O-N 3.36Å
151	C	87.3	Confident	76.4	Confident	8 Å²	8	61.5 Å²	61.5	5%	0.054	35%	0.347	C	S	.	.	H	α-helix	trans	-59.8	-31.7	178	-66.8	0	0	0	0	114.3	H135 Q149 Q155 C196 C199	H135-C151 PolarHBondContact ND1-SG 3.04Å; Q149-C151 VanDerWaalsContact C-N 3.25Å; Q149-C151 PolarHBondContact O-N 3.01Å; Q149-C151 VanDerWaalsContact O-N 3.11Å; C151-Q155 PolarHBondContact O-N 3.02Å; C151-C196 HydrophobicContact CB-CB 3.96Å; C151-C199 PolarHBondContact SG-SG 2.85Å
152	L	83.7	Confident	74.9	Confident	80 Å²	80	61.4 Å²	61.4	42%	0.419	35%	0.352	S	S	.	.	H	α-helix	trans	-79.6	-46.1	179.3	-173.6	64.8	0	0	0	110.5	Q149 P150 H154 Q155 Q156	Q149-L152 HydrophobicContact CB-CB 4.12Å; Q149-L152 WeakPolarHBondContact O-CB 3.32Å; Q149-L152 PolarHBondContact O-N 2.99Å; P150-L152 VanDerWaalsContact C-N 3.25Å; P150-L152 PolarHBondContact O-N 3.42Å; L152-H154 VanDerWaalsContact C-N 3.3Å; L152-H154 PolarHBondContact O-N 3.34Å; L152-Q155 WeakPolarHBondContact O-CB 3.19Å; L152-Q155 PolarHBondContact O-N 3.12Å; L152-Q155 VanDerWaalsContact O-N 3.13Å; L152-Q156 WeakPolarHBondContact O-CG 3.44Å; L152-Q156 PolarHBondContact O-N 2.95Å
153	K	81.6	Confident	73.3	Confident	78 Å²	78	64.4 Å²	64.4	34%	0.339	37%	0.371	S	S	.	.	H	α-helix	trans	-58.3	-43.7	173.9	-74.6	-173	-178.8	178.9	0	111.6	T142 D148 Q149 P150 Q155 Q156 I157	T142-K153 HydrophobicContact CG2-CB 3.59Å; D148-K153 HydrophobicContact CB-CD 4.37Å; D148-K153 WeakPolarHBondContact O-CD 3.42Å; D148-K153 VanDerWaalsContact O-CE 3.29Å; D148-K153 WeakPolarHBondContact O-CE 3.5Å; D148-K153 IonicContact OD1-NZ 2.91Å; D148-K153 PolarHBondContact OD1-NZ 2.95Å; Q149-K153 PolarHBondContact O-N 3.43Å; P150-K153 PolarHBondContact O-N 2.85Å; K153-Q155 VanDerWaalsContact C-N 3.33Å; K153-Q155 PolarHBondContact O-N 3Å; K153-Q156 WeakPolarHBondContact O-CB 3.49Å; K153-Q156 PolarHBondContact O-N 3.1Å; K153-Q156 VanDerWaalsContact O-N 3.12Å; K153-I157 WeakPolarHBondContact O-CG1 3.49Å; K153-I157 PolarHBondContact O-N 3.46Å
154	H	84.8	Confident	71.7	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.009	36%	0.364	C	S	.	.	H	α-helix	trans	-57.1	-45.6	174.6	-178.1	85.3	0	0	0	111.7	H137 A138 T142 P150 L152 Q156 I157 Y158 Y188	H137-H154 AromaticContact CE1-CE1 3.36Å; H137-H154 PolarHBondContact CE1-CE1 2.88Å; H137-H154 AromaticContact ND1-CE1 3.18Å; H137-H154 PolarHBondContact ND1-CE1 2.98Å; H137-H154 AromaticContact ND1-ND1 3.86Å; H137-H154 AromaticContact ND1-NE2 3.78Å; A138-H154 HydrophobicContact CB-CB 3.62Å; T142-H154 HydrophobicContact CG2-CB 4.02Å; P150-H154 WeakPolarHBondContact O-CB 3.48Å; P150-H154 PolarHBondContact O-N 3.36Å; L152-H154 VanDerWaalsContact C-N 3.3Å; L152-H154 PolarHBondContact O-N 3.34Å; H154-Q156 VanDerWaalsContact C-N 3.31Å; H154-Q156 PolarHBondContact O-N 3.17Å; H154-I157 PolarHBondContact O-N 3.31Å; H154-Y158 AromaticContact CD2-CD2 3.91Å; H154-Y158 AromaticContact CD2-CE2 3.92Å; H154-Y158 AromaticContact CE1-CD2 3.66Å; H154-Y158 AromaticContact CE1-CE2 2.91Å; H154-Y158 WeakPolarHBondContact CE1-CE2 3.47Å; H154-Y158 AromaticContact CE1-CZ 3.48Å; H154-Y158 VanDerWaalsContact CE1-CZ 3.48Å; H154-Y158 AromaticContact ND1-CE2 3.66Å; H154-Y158 AromaticContact NE2-CD2 3.49Å; H154-Y158 WeakPolarHBondContact NE2-CD2 3.36Å; H154-Y158 AromaticContact NE2-CE2 3.09Å; H154-Y158 WeakPolarHBondContact NE2-CE2 3.44Å; H154-Y158 AromaticContact NE2-CZ 3.52Å; H154-Y158 WeakPolarHBondContact O-CD2 3.41Å; H154-Y158 PolarHBondContact O-N 3.32Å; H154-Y158 VanDerWaalsContact O-N 3.13Å; H154-Y188 PolarHBondContact NE2-OH 3.35Å
155	Q	79.7	Confident	70.3	Confident	57 Å²	57	71.9 Å²	71.9	27%	0.266	40%	0.397	S	S	.	.	H	α-helix	trans	-61.8	-38.8	176.4	-179.1	174.3	0.4	0	0	112.3	C151 L152 K153 Y158 H159	C151-Q155 PolarHBondContact O-N 3.02Å; L152-Q155 WeakPolarHBondContact O-CB 3.19Å; L152-Q155 PolarHBondContact O-N 3.12Å; L152-Q155 VanDerWaalsContact O-N 3.13Å; K153-Q155 VanDerWaalsContact C-N 3.33Å; K153-Q155 PolarHBondContact O-N 3Å; Q155-Y158 PolarHBondContact O-N 2.96Å; Q155-H159 PolarHBondContact O-CD2 3.24Å; Q155-H159 PolarHBondContact O-N 3.05Å
156	Q	79.7	Confident	68.9	Low	107 Å²	107	75.8 Å²	75.8	50%	0.5	41%	0.414	S	S	.	.	H	α-helix	trans	-64	-44.4	176.9	-68.3	169.6	-25.6	0	0	111.7	L152 K153 H154 Y158 H159 L160	L152-Q156 WeakPolarHBondContact O-CG 3.44Å; L152-Q156 PolarHBondContact O-N 2.95Å; K153-Q156 WeakPolarHBondContact O-CB 3.49Å; K153-Q156 PolarHBondContact O-N 3.1Å; K153-Q156 VanDerWaalsContact O-N 3.12Å; H154-Q156 VanDerWaalsContact C-N 3.31Å; H154-Q156 PolarHBondContact O-N 3.17Å; Q156-Y158 VanDerWaalsContact C-N 3.27Å; Q156-Y158 PolarHBondContact O-N 2.94Å; Q156-H159 PolarHBondContact O-N 3.27Å; Q156-L160 WeakPolarHBondContact O-CD1 3.41Å; Q156-L160 PolarHBondContact O-N 2.84Å
157	I	76	Confident	68	Low	68 Å²	68	77.9 Å²	77.9	35%	0.349	43%	0.426	S	S	.	.	H	α-helix	trans	-58.2	-41.8	176.3	-65.2	165.8	0	0	0	110.7	V141 T142 K153 H154 N161	V141-I157 HydrophobicContact CG1-CD1 4.27Å; T142-I157 HydrophobicContact CG2-CD1 4.03Å; K153-I157 WeakPolarHBondContact O-CG1 3.49Å; K153-I157 PolarHBondContact O-N 3.46Å; H154-I157 PolarHBondContact O-N 3.31Å; I157-N161 PolarHBondContact O-N 2.87Å; I157-N161 PolarHBondContact O-ND2 2.96Å; I157-N161 PolarHBondContact O-OD1 3.28Å
158	Y	72	Confident	66.8	Low	85 Å²	85	82.2 Å²	82.2	33%	0.333	44%	0.441	S	S	.	.	H	α-helix	trans	-71.9	-39.2	179.8	-83.8	-109.5	0	0	0	113.2	H137 H154 Q155 Q156 N161 A162 Y188	H137-Y158 PolarHBondContact CE1-OH 3.47Å; H154-Y158 AromaticContact CD2-CD2 3.91Å; H154-Y158 AromaticContact CD2-CE2 3.92Å; H154-Y158 AromaticContact CE1-CD2 3.66Å; H154-Y158 AromaticContact CE1-CE2 2.91Å; H154-Y158 WeakPolarHBondContact CE1-CE2 3.47Å; H154-Y158 AromaticContact CE1-CZ 3.48Å; H154-Y158 VanDerWaalsContact CE1-CZ 3.48Å; H154-Y158 AromaticContact ND1-CE2 3.66Å; H154-Y158 AromaticContact NE2-CD2 3.49Å; H154-Y158 WeakPolarHBondContact NE2-CD2 3.36Å; H154-Y158 AromaticContact NE2-CE2 3.09Å; H154-Y158 WeakPolarHBondContact NE2-CE2 3.44Å; H154-Y158 AromaticContact NE2-CZ 3.52Å; H154-Y158 WeakPolarHBondContact O-CD2 3.41Å; H154-Y158 PolarHBondContact O-N 3.32Å; H154-Y158 VanDerWaalsContact O-N 3.13Å; Q155-Y158 PolarHBondContact O-N 2.96Å; Q156-Y158 VanDerWaalsContact C-N 3.27Å; Q156-Y158 PolarHBondContact O-N 2.94Å; Y158-N161 PolarHBondContact O-N 3.04Å; Y158-A162 PolarHBondContact O-N 2.81Å; Y158-A162 VanDerWaalsContact O-N 3.14Å; Y158-Y188 AromaticContact CD1-CE1 3.96Å; Y158-Y188 HydrophobicContact CD1-CE1 3.96Å; Y158-Y188 HydrophobicContact CD1-CE2 4.16Å; Y158-Y188 AromaticContact CD1-CZ 3.71Å; Y158-Y188 HydrophobicContact CE1-CE1 4.36Å; Y158-Y188 AromaticContact CE1-CE2 3.94Å; Y158-Y188 HydrophobicContact CE1-CE2 3.94Å; Y158-Y188 AromaticContact CE1-CZ 3.65Å; Y158-Y188 WeakPolarHBondContact CE1-OH 3.37Å; Y158-Y188 HydrophobicContact CG-CE1 4.27Å
159	H	69.1	Low	65.2	Low	118 Å²	118	85.7 Å²	85.7	55%	0.546	46%	0.46	S	S	.	.	H	α-helix	trans	-67.8	-37.7	176.3	-91	-83.8	0	0	0	112.4	Q155 Q156 N161 A162 T163	Q155-H159 PolarHBondContact O-CD2 3.24Å; Q155-H159 PolarHBondContact O-N 3.05Å; Q156-H159 PolarHBondContact O-N 3.27Å; H159-N161 VanDerWaalsContact C-N 3.34Å; H159-N161 PolarHBondContact O-N 3.31Å; H159-A162 PolarHBondContact O-N 3.22Å; H159-T163 PolarHBondContact O-N 3.34Å; H159-T163 VanDerWaalsContact O-N 3.15Å; H159-T163 PolarHBondContact O-OG1 3.44Å
160	L	61.8	Low	63.1	Low	113 Å²	113	88.7 Å²	88.7	59%	0.592	48%	0.478	S	S	*	.	H	α-helix	trans	-59	-47.3	175.1	-101.4	70.9	0	0	0	110.9	Q156 A162 T163 T164	Q156-L160 WeakPolarHBondContact O-CD1 3.41Å; Q156-L160 PolarHBondContact O-N 2.84Å; L160-A162 VanDerWaalsContact C-N 3.25Å; L160-A162 PolarHBondContact O-N 2.66Å; L160-T163 PolarHBondContact O-N 2.91Å; L160-T163 VanDerWaalsContact O-N 3.12Å; L160-T163 PolarHBondContact O-OG1 3.38Å; L160-T164 PolarHBondContact O-N 3.49Å; L160-T164 VanDerWaalsContact O-N 3.13Å
161	N	54.8	Low	60.9	Low	96 Å²	96	97.4 Å²	97.4	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-65	-28.6	179.3	-63.9	-9.2	0	0	0	112.9	I157 Y158 H159 T164	I157-N161 PolarHBondContact O-N 2.87Å; I157-N161 PolarHBondContact O-ND2 2.96Å; I157-N161 PolarHBondContact O-OD1 3.28Å; Y158-N161 PolarHBondContact O-N 3.04Å; H159-N161 VanDerWaalsContact C-N 3.34Å; H159-N161 PolarHBondContact O-N 3.31Å; N161-T164 PolarHBondContact O-OG1 3.23Å
162	A	54.5	Low	58.4	Low	62 Å²	62	104.7 Å²	104.7	51%	0.512	56%	0.557	S	S	.	*	H	α-helix	trans	-70.7	-37.1	174.5	0	0	0	0	0	111.9	Y158 H159 L160	Y158-A162 PolarHBondContact O-N 2.81Å; Y158-A162 VanDerWaalsContact O-N 3.14Å; H159-A162 PolarHBondContact O-N 3.22Å; L160-A162 VanDerWaalsContact C-N 3.25Å; L160-A162 PolarHBondContact O-N 2.66Å
163	T	53.2	Low	55.8	Low	94 Å²	94	106 Å²	106	58%	0.577	57%	0.573	S	S	*	*	H	α-helix	trans	-77.6	-28.6	-179.2	42.6	0	0	0	0	114.7	H159 L160 N165 T166	H159-T163 PolarHBondContact O-N 3.34Å; H159-T163 VanDerWaalsContact O-N 3.15Å; H159-T163 PolarHBondContact O-OG1 3.44Å; L160-T163 PolarHBondContact O-N 2.91Å; L160-T163 VanDerWaalsContact O-N 3.12Å; L160-T163 PolarHBondContact O-OG1 3.38Å; T163-N165 PolarHBondContact O-N 2.91Å; T163-N165 VanDerWaalsContact O-N 3.1Å; T163-T166 PolarHBondContact O-N 2.92Å
164	T	50.3	Low	53.5	Low	97 Å²	97	107.8 Å²	107.8	60%	0.595	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-10.4	178.8	49	0	0	0	0	113.6	L160 N161	L160-T164 PolarHBondContact O-N 3.49Å; L160-T164 VanDerWaalsContact O-N 3.13Å; N161-T164 PolarHBondContact O-OG1 3.23Å
165	N	46.5	Very low	51	Low	141 Å²	141	112.4 Å²	112.4	75%	0.754	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	1.4	179.3	-68	-0.8	0	0	0	114	T163	T163-N165 PolarHBondContact O-N 2.91Å; T163-N165 VanDerWaalsContact O-N 3.1Å
166	T	42	Very low	48.9	Very low	115 Å²	115	117.3 Å²	117.3	71%	0.706	66%	0.656	S	S	*	*	S	Bend	trans	-120.8	20.5	-172.2	-28.2	0	0	0	0	115.1	T163	T163-T166 PolarHBondContact O-N 2.92Å
167	T	43.3	Very low	46.9	Very low	108 Å²	108	119 Å²	119	66%	0.663	67%	0.668	S	S	*	*	S	Bend	trans	-131.5	84.3	166	59.4	0	0	0	0	108.8
168	N	41.1	Very low	45.1	Very low	148 Å²	148	123.2 Å²	123.2	79%	0.791	69%	0.691	S	S	*	*	S	Bend	trans	-178.6	113.8	144.6	-81.7	-26.2	0	0	0	108.4
169	N	41.4	Very low	43.7	Very low	143 Å²	143	124.5 Å²	124.5	77%	0.765	70%	0.704	S	S	*	*			trans	76.7	101.8	154.3	-51.6	-26.7	0	0	0	118.2
170	D	36.8	Very low	42.4	Very low	143 Å²	143	123.6 Å²	123.6	77%	0.765	70%	0.703	S	S	*	*				24.8	125.8	125	-58.6	-36.4	0	0	0	119
171	H	39.7	Very low	41.6	Very low	183 Å²	183	126.4 Å²	126.4	85%	0.847	71%	0.71	S	S	*	*			trans	49.9	93.2	154.4	-66.8	-66	0	0	0	118
172	N	34.6	Very low	40.9	Very low	160 Å²	160	127 Å²	127	86%	0.856	71%	0.714	S	S	*	*				-179.3	132.8	113.1	-121.6	-28.9	0	0	0	111.6	S174	N172-S174 PolarHBondContact O-N 3.19Å
173	S	29.6	Very low	40.2	Very low	109 Å²	109	130.9 Å²	130.9	76%	0.762	72%	0.721	S	S	*	*			trans	-63.4	121.2	160.3	-56.3	0	0	0	0	109.5
174	S	31.6	Very low	39.7	Very low	114 Å²	114	131.7 Å²	131.7	80%	0.797	72%	0.721	S	S	*	*			trans	-163.4	123.6	146.2	-88.9	0	0	0	0	110.6	N172	N172-S174 PolarHBondContact O-N 3.19Å
175	S	34.2	Very low	39.4	Very low	99 Å²	99	133.9 Å²	133.9	69%	0.692	73%	0.728	S	S	*	*			trans	-37.7	132	172.2	-46	0	0	0	0	113.2
176	N	35.1	Very low	39.6	Very low	160 Å²	160	131.2 Å²	131.2	86%	0.856	71%	0.71	S	S	*	*			trans	-128.8	89.9	152	-83.7	-43.8	0	0	0	107.6	N178	N176-N178 VanDerWaalsContact C-N 3.34Å; N176-N178 PolarHBondContact O-N 3.24Å
177	D	36.2	Very low	39.6	Very low	143 Å²	143	131.8 Å²	131.8	77%	0.765	71%	0.708	S	S	*	*			trans	-62.3	91.7	166.1	-65.6	-54.5	0	0	0	109.2
178	N	39.6	Very low	39.8	Very low	156 Å²	156	131.2 Å²	131.2	83%	0.834	70%	0.695	S	S	*	*			trans	-142.2	57.1	158	-93.8	-59.1	0	0	0	108.4	N176 D180	N176-N178 VanDerWaalsContact C-N 3.34Å; N176-N178 PolarHBondContact O-N 3.24Å; N178-D180 PolarHBondContact O-N 3.48Å
179	L	42.7	Very low	39.9	Very low	112 Å²	112	130.8 Å²	130.8	59%	0.586	69%	0.692	S	S	*	*			trans	-70.1	85.4	168.8	-173.8	63.7	0	0	0	107.8	K181 L184	L179-K181 PolarHBondContact O-N 3.32Å; L179-L184 HydrophobicContact CD2-CD1 3.72Å; L179-L184 HydrophobicContact CD2-CD2 3.94Å; L179-L184 HydrophobicContact CD2-CG 3.8Å; L179-L184 HydrophobicContact CG-CD1 4.33Å; L179-L184 HydrophobicContact CG-CG 4.19Å
180	D	42.1	Very low	40	Very low	100 Å²	100	131.9 Å²	131.9	54%	0.535	69%	0.69	S	S	.	*			trans	-53.7	115.1	168.7	-170.4	-6.3	0	0	0	107.8	N178 N182 Q183	N178-D180 PolarHBondContact O-N 3.48Å; D180-N182 PolarHBondContact O-N 3.2Å; D180-N182 PolarHBondContact OD1-ND2 3.32Å; D180-N182 VanDerWaalsContact OD1-ND2 3.11Å; D180-Q183 PolarHBondContact O-N 2.99Å
181	K	43.9	Very low	40.5	Very low	171 Å²	171	131.5 Å²	131.5	74%	0.743	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-57.6	-15.8	-167.9	-67.7	174.5	179.6	170.7	0	112.8	L179 Q183 L184	L179-K181 PolarHBondContact O-N 3.32Å; K181-Q183 VanDerWaalsContact C-N 3.25Å; K181-Q183 PolarHBondContact O-N 2.95Å; K181-L184 PolarHBondContact O-N 3.42Å
182	N	39.6	Very low	40.6	Very low	110 Å²	110	132 Å²	132	59%	0.588	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-66.4	-22.9	174.7	-63.9	-46.8	0	0	0	113.4	D180 F186	D180-N182 PolarHBondContact O-N 3.2Å; D180-N182 PolarHBondContact OD1-ND2 3.32Å; D180-N182 VanDerWaalsContact OD1-ND2 3.11Å; N182-F186 WeakPolarHBondContact O-CD2 3.42Å
183	Q	40.4	Very low	41.6	Very low	142 Å²	142	128.8 Å²	128.8	66%	0.664	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-82.1	-20.3	175.9	-67.8	-163	36.3	0	0	113.8	D180 K181 I185 F186	D180-Q183 PolarHBondContact O-N 2.99Å; K181-Q183 VanDerWaalsContact C-N 3.25Å; K181-Q183 PolarHBondContact O-N 2.95Å; Q183-I185 PolarHBondContact O-N 2.99Å; Q183-F186 CarbonylContact O-C 3.27Å; Q183-F186 PolarHBondContact O-N 3.43Å
184	L	43.4	Very low	43.1	Very low	112 Å²	112	127.8 Å²	127.8	59%	0.586	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-73.3	-26.2	-178.3	-82.2	176.7	0	0	0	113.8	L179 K181 F186	L179-L184 HydrophobicContact CD2-CD1 3.72Å; L179-L184 HydrophobicContact CD2-CD2 3.94Å; L179-L184 HydrophobicContact CD2-CG 3.8Å; L179-L184 HydrophobicContact CG-CD1 4.33Å; L179-L184 HydrophobicContact CG-CG 4.19Å; K181-L184 PolarHBondContact O-N 3.42Å; L184-F186 PolarHBondContact O-N 3.35Å
185	I	43.4	Very low	45.1	Very low	143 Å²	143	127.6 Å²	127.6	73%	0.733	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-70.9	-22.4	174.6	-55.7	-174.2	0	0	0	110.7	Q183	Q183-I185 PolarHBondContact O-N 2.99Å
186	F	50.9	Low	47.7	Very low	85 Å²	85	123.6 Å²	123.6	37%	0.373	63%	0.626	S	S	.	*	G	3₁₀ helix	trans	-108	57.8	-179.6	-61.9	-82.3	0	0	0	111.5	N182 Q183 L184 Y188	N182-F186 WeakPolarHBondContact O-CD2 3.42Å; Q183-F186 CarbonylContact O-C 3.27Å; Q183-F186 PolarHBondContact O-N 3.43Å; L184-F186 PolarHBondContact O-N 3.35Å; F186-Y188 HydrophobicContact CB-CD2 4.18Å; F186-Y188 HydrophobicContact CB-CE2 3.9Å; F186-Y188 WeakPolarHBondContact O-CD2 3.49Å; F186-Y188 PolarHBondContact O-N 3.4Å
187	N	42.4	Very low	50.1	Low	126 Å²	126	119.4 Å²	119.4	67%	0.674	61%	0.606	S	S	*	*			trans	-57	99.8	177	-170	-12.5	0	0	0	111.2	N189	N187-N189 VanDerWaalsContact C-N 3.26Å; N187-N189 PolarHBondContact O-N 2.95Å; N187-N189 PolarHBondContact OD1-N 3.35Å
188	Y	46.5	Very low	52.6	Low	97 Å²	97	112.9 Å²	112.9	38%	0.38	57%	0.571	S	S	.	*			trans	-77.3	3.2	-175.3	-91.9	-84	0	0	0	114.1	H154 Y158 F186 K190	H154-Y188 PolarHBondContact NE2-OH 3.35Å; Y158-Y188 AromaticContact CD1-CE1 3.96Å; Y158-Y188 HydrophobicContact CD1-CE1 3.96Å; Y158-Y188 HydrophobicContact CD1-CE2 4.16Å; Y158-Y188 AromaticContact CD1-CZ 3.71Å; Y158-Y188 HydrophobicContact CE1-CE1 4.36Å; Y158-Y188 AromaticContact CE1-CE2 3.94Å; Y158-Y188 HydrophobicContact CE1-CE2 3.94Å; Y158-Y188 AromaticContact CE1-CZ 3.65Å; Y158-Y188 WeakPolarHBondContact CE1-OH 3.37Å; Y158-Y188 HydrophobicContact CG-CE1 4.27Å; F186-Y188 HydrophobicContact CB-CD2 4.18Å; F186-Y188 HydrophobicContact CB-CE2 3.9Å; F186-Y188 WeakPolarHBondContact O-CD2 3.49Å; F186-Y188 PolarHBondContact O-N 3.4Å; Y188-K190 PolarHBondContact O-N 2.92Å
189	N	44.7	Very low	54.9	Low	138 Å²	138	106.1 Å²	106.1	74%	0.738	54%	0.536	S	S	*	.			trans	-99.4	31.6	-169.7	-65.5	-44.4	0	0	0	115.1	N187 P191	N187-N189 VanDerWaalsContact C-N 3.26Å; N187-N189 PolarHBondContact O-N 2.95Å; N187-N189 PolarHBondContact OD1-N 3.35Å; N189-P191 WeakPolarHBondContact O-CD 3.19Å
190	K	43.5	Very low	56.9	Low	166 Å²	166	103.5 Å²	103.5	72%	0.722	52%	0.524	S	S	*	.			trans	-94.2	102.1	163.1	-159.8	167.7	-175	177.9	0	108.6	Y188 Y192	Y188-K190 PolarHBondContact O-N 2.92Å; K190-Y192 CarbonylContact O-C 3.58Å; K190-Y192 PolarHBondContact O-N 2.94Å
191	P	45.3	Very low	58.8	Low	135 Å²	135	101.5 Å²	101.5	88%	0.877	52%	0.516	S	S	*	.	S	Bend	trans	-67	6.4	-176	27	-34.6	0	0	0	114.2	N189	N189-P191 WeakPolarHBondContact O-CD 3.19Å
192	Y	42.8	Very low	60.5	Low	194 Å²	194	96.5 Å²	96.5	76%	0.761	50%	0.495	S	S	*	.			trans	-118.6	82	170.2	-142.5	-93.7	0	0	0	106.6	K190 S194	K190-Y192 CarbonylContact O-C 3.58Å; K190-Y192 PolarHBondContact O-N 2.94Å; Y192-S194 PolarHBondContact O-N 2.89Å
193	R	56.3	Low	62.4	Low	93 Å²	93	94.4 Å²	94.4	35%	0.351	48%	0.483	S	S	.	.			trans	-73.2	88.2	172	-147.2	-175.5	-160	-102.5	3.4	107	V195	R193-V195 PolarHBondContact O-N 3.25Å
194	S	61	Low	64.3	Low	87 Å²	87	93 Å²	93	61%	0.608	47%	0.474	S	S	*	.			trans	-43.4	127.3	174.8	55.1	0	0	0	0	108.8	Y192 C196	Y192-S194 PolarHBondContact O-N 2.89Å; S194-C196 PolarHBondContact O-N 3.1Å; S194-C196 VanDerWaalsContact O-N 3.11Å
195	V	73.9	Confident	66.1	Low	110 Å²	110	92.1 Å²	92.1	67%	0.667	47%	0.467	S	S	*	.			trans	-34.7	118.6	172.4	175.8	0	0	0	0	110.2	R193 T197 V200	R193-V195 PolarHBondContact O-N 3.25Å; V195-T197 PolarHBondContact O-N 3.2Å; V195-V200 HydrophobicContact CB-CG2 4.42Å; V195-V200 HydrophobicContact CG1-CB 4.43Å; V195-V200 HydrophobicContact CG1-CG2 2.98Å
196	C	87.4	Confident	67.8	Low	15 Å²	15	89.3 Å²	89.3	10%	0.101	45%	0.451	C	S	.	.			trans	-64.2	120.7	-177.7	175.1	0	0	0	0	109.5	C151 S194 F198 C199 V200	C151-C196 HydrophobicContact CB-CB 3.96Å; S194-C196 PolarHBondContact O-N 3.1Å; S194-C196 VanDerWaalsContact O-N 3.11Å; C196-F198 PolarHBondContact O-N 3.32Å; C196-C199 HydrophobicContact CB-CB 4Å; C196-C199 PolarHBondContact O-N 2.88Å; C196-C199 VanDerWaalsContact O-N 3.15Å; C196-V200 PolarHBondContact O-N 2.88Å
197	T	85.9	Confident	69.2	Low	72 Å²	72	90 Å²	90	44%	0.442	46%	0.455	S	S	.	.	H	α-helix	trans	-53.4	-41.2	-179.1	-50.2	0	0	0	0	111.8	V195 V200 T201	V195-T197 PolarHBondContact O-N 3.2Å; T197-V200 PolarHBondContact O-N 3.18Å; T197-T201 WeakPolarHBondContact O-CG2 3.44Å; T197-T201 PolarHBondContact O-N 3.33Å; T197-T201 PolarHBondContact O-OG1 2.74Å; T197-T201 VanDerWaalsContact O-OG1 3.13Å
198	F	89.2	Confident	71.1	Confident	7 Å²	7	91.7 Å²	91.7	3%	0.031	45%	0.452	C	S	.	.	H	α-helix	trans	-69.4	-42.5	-179.8	-54.8	-69.5	0	0	0	112.6	I111 P112 L128 Y132 H135 C196 V200 T201 E202	I111-F198 HydrophobicContact CG2-CE1 4.23Å; I111-F198 HydrophobicContact CG2-CZ 4.06Å; P112-F198 HydrophobicContact CG-CD1 3.8Å; P112-F198 HydrophobicContact CG-CE1 3.68Å; P112-F198 WeakPolarHBondContact O-CE1 2.94Å; L128-F198 HydrophobicContact CB-CZ 4.39Å; L128-F198 HydrophobicContact CD2-CZ 4.21Å; L128-F198 WeakPolarHBondContact O-CE2 3.34Å; Y132-F198 HydrophobicContact CD2-CD1 4.35Å; Y132-F198 HydrophobicContact CD2-CD2 4.28Å; Y132-F198 HydrophobicContact CD2-CE1 4.33Å; Y132-F198 HydrophobicContact CD2-CE2 4.29Å; Y132-F198 HydrophobicContact CD2-CG 4.32Å; Y132-F198 HydrophobicContact CD2-CZ 4.31Å; Y132-F198 HydrophobicContact CG-CE2 4.33Å; Y132-F198 HydrophobicContact CG-CZ 4.23Å; Y132-F198 VanDerWaalsContact N-CE2 3.3Å; H135-F198 HydrophobicContact CB-CB 4.4Å; H135-F198 HydrophobicContact CB-CD2 4.14Å; C196-F198 PolarHBondContact O-N 3.32Å; F198-V200 VanDerWaalsContact C-N 3.29Å; F198-V200 PolarHBondContact O-N 3.47Å; F198-T201 WeakPolarHBondContact CA-OG1 3.48Å; F198-T201 PolarHBondContact O-N 2.88Å; F198-T201 PolarHBondContact O-OG1 3.27Å; F198-E202 WeakPolarHBondContact O-CB 3.32Å; F198-E202 VanDerWaalsContact O-CG 3.28Å; F198-E202 WeakPolarHBondContact O-CG 3.4Å; F198-E202 PolarHBondContact O-N 3.49Å
199	C	87.6	Confident	72.7	Confident	14 Å²	14	91.5 Å²	91.5	10%	0.095	46%	0.457	C	S	.	.	H	α-helix	trans	-60.4	-40.2	173.4	-68.1	0	0	0	0	111.9	H135 C151 C196 M203	H135-C199 VanDerWaalsContact CE1-SG 3.55Å; H135-C199 PolarHBondContact ND1-SG 2.8Å; H135-C199 VanDerWaalsContact ND1-SG 3.42Å; C151-C199 PolarHBondContact SG-SG 2.85Å; C196-C199 HydrophobicContact CB-CB 4Å; C196-C199 PolarHBondContact O-N 2.88Å; C196-C199 VanDerWaalsContact O-N 3.15Å; C199-M203 WeakPolarHBondContact O-CB 3.47Å; C199-M203 PolarHBondContact O-N 3.27Å
200	V	84.4	Confident	74.3	Confident	56 Å²	56	88.7 Å²	88.7	34%	0.339	44%	0.441	S	S	.	.	H	α-helix	trans	-66.5	-45.4	178.3	173.4	0	0	0	0	111.7	V195 C196 T197 F198 E202 K204	V195-V200 HydrophobicContact CB-CG2 4.42Å; V195-V200 HydrophobicContact CG1-CB 4.43Å; V195-V200 HydrophobicContact CG1-CG2 2.98Å; C196-V200 PolarHBondContact O-N 2.88Å; T197-V200 PolarHBondContact O-N 3.18Å; F198-V200 VanDerWaalsContact C-N 3.29Å; F198-V200 PolarHBondContact O-N 3.47Å; V200-E202 VanDerWaalsContact C-N 3.33Å; V200-K204 VanDerWaalsContact O-CB 3.23Å; V200-K204 WeakPolarHBondContact O-CB 3.49Å; V200-K204 PolarHBondContact O-N 3.47Å
201	T	82.2	Confident	76	Confident	59 Å²	59	85.7 Å²	85.7	36%	0.362	43%	0.433	S	S	.	.	H	α-helix	trans	-64.2	-41.2	-179.6	49.5	0	0	0	0	111.3	T197 F198 Q205	T197-T201 WeakPolarHBondContact O-CG2 3.44Å; T197-T201 PolarHBondContact O-N 3.33Å; T197-T201 PolarHBondContact O-OG1 2.74Å; T197-T201 VanDerWaalsContact O-OG1 3.13Å; F198-T201 WeakPolarHBondContact CA-OG1 3.48Å; F198-T201 PolarHBondContact O-N 2.88Å; F198-T201 PolarHBondContact O-OG1 3.27Å; T201-Q205 VanDerWaalsContact O-CG 3.28Å; T201-Q205 WeakPolarHBondContact O-CG 3.28Å; T201-Q205 PolarHBondContact O-N 2.72Å; T201-Q205 PolarHBondContact O-NE2 3.36Å
202	E	79.9	Confident	77.5	Confident	66 Å²	66	86 Å²	86	31%	0.308	42%	0.421	S	S	.	.	H	α-helix	trans	-67.9	-46	177.4	-71.8	-55.8	116.7	0	0	112	P146 F198 V200 K204 Q205 H206	P146-E202 HydrophobicContact CB-CB 3.81Å; P146-E202 HydrophobicContact CB-CG 4.04Å; F198-E202 WeakPolarHBondContact O-CB 3.32Å; F198-E202 VanDerWaalsContact O-CG 3.28Å; F198-E202 WeakPolarHBondContact O-CG 3.4Å; F198-E202 PolarHBondContact O-N 3.49Å; V200-E202 VanDerWaalsContact C-N 3.33Å; E202-K204 VanDerWaalsContact C-N 3.31Å; E202-K204 PolarHBondContact O-N 3.32Å; E202-Q205 WeakPolarHBondContact O-CB 3.44Å; E202-Q205 PolarHBondContact O-N 2.71Å; E202-Q205 VanDerWaalsContact O-N 3.14Å; E202-Q205 PolarHBondContact OE1-NE2 3.2Å; E202-H206 PolarHBondContact O-N 3.24Å
203	M	79.5	Confident	79.2	Confident	66 Å²	66	81.6 Å²	81.6	33%	0.325	41%	0.407	S	S	.	.	H	α-helix	trans	-59.7	-42.3	175.7	-175.7	-177.6	68.7	0	0	111.6	C199 Q205 H206 Q207	C199-M203 WeakPolarHBondContact O-CB 3.47Å; C199-M203 PolarHBondContact O-N 3.27Å; M203-Q205 VanDerWaalsContact C-N 3.33Å; M203-Q205 PolarHBondContact O-N 3.24Å; M203-H206 PolarHBondContact O-N 3.45Å; M203-Q207 WeakPolarHBondContact O-CG 3.48Å; M203-Q207 PolarHBondContact O-N 3.29Å
204	K	80.9	Confident	80.1	Confident	113 Å²	113	81.5 Å²	81.5	49%	0.491	42%	0.417	S	S	.	.	H	α-helix	trans	-67.4	-32.8	177.2	-172.3	170.9	-176.4	171.8	0	112.4	V200 E202 R208	V200-K204 VanDerWaalsContact O-CB 3.23Å; V200-K204 WeakPolarHBondContact O-CB 3.49Å; V200-K204 PolarHBondContact O-N 3.47Å; E202-K204 VanDerWaalsContact C-N 3.31Å; E202-K204 PolarHBondContact O-N 3.32Å; K204-R208 WeakPolarHBondContact O-CG 3.39Å; K204-R208 PolarHBondContact O-N 3.33Å
205	Q	81.1	Confident	80.8	Confident	92 Å²	92	82 Å²	82	43%	0.43	41%	0.411	S	S	.	.	H	α-helix	trans	-66.7	-46.1	172.6	-78.1	175.3	72.4	0	0	111	T201 E202 M203 Q207 R208 I209	T201-Q205 VanDerWaalsContact O-CG 3.28Å; T201-Q205 WeakPolarHBondContact O-CG 3.28Å; T201-Q205 PolarHBondContact O-N 2.72Å; T201-Q205 PolarHBondContact O-NE2 3.36Å; E202-Q205 WeakPolarHBondContact O-CB 3.44Å; E202-Q205 PolarHBondContact O-N 2.71Å; E202-Q205 VanDerWaalsContact O-N 3.14Å; E202-Q205 PolarHBondContact OE1-NE2 3.2Å; M203-Q205 VanDerWaalsContact C-N 3.33Å; M203-Q205 PolarHBondContact O-N 3.24Å; Q205-Q207 VanDerWaalsContact C-N 3.34Å; Q205-Q207 PolarHBondContact O-N 3.44Å; Q205-R208 WeakPolarHBondContact O-CB 3.09Å; Q205-R208 PolarHBondContact O-N 3.05Å; Q205-R208 VanDerWaalsContact O-N 3.11Å; Q205-I209 WeakPolarHBondContact O-CG1 3.42Å; Q205-I209 PolarHBondContact O-N 3.18Å; Q205-I209 VanDerWaalsContact O-N 3.12Å
206	H	79.5	Confident	80.6	Confident	85 Å²	85	82.1 Å²	82.1	39%	0.394	41%	0.408	S	S	.	.	H	α-helix	trans	-61	-41.3	177.8	-162.2	-74.7	0	0	0	112.3	E202 M203 R208 I209 L210	E202-H206 PolarHBondContact O-N 3.24Å; M203-H206 PolarHBondContact O-N 3.45Å; H206-R208 VanDerWaalsContact C-N 3.29Å; H206-R208 PolarHBondContact O-N 2.99Å; H206-I209 PolarHBondContact O-N 3.5Å; H206-L210 WeakPolarHBondContact O-CG 3.42Å; H206-L210 PolarHBondContact O-N 3.33Å
207	Q	79.5	Confident	79.9	Confident	99 Å²	99	87.5 Å²	87.5	46%	0.463	44%	0.435	S	S	.	.	H	α-helix	trans	-60.3	-37.1	174.8	-73.2	175.3	21.7	0	0	112.7	M203 Q205 N211	M203-Q207 WeakPolarHBondContact O-CG 3.48Å; M203-Q207 PolarHBondContact O-N 3.29Å; Q205-Q207 VanDerWaalsContact C-N 3.34Å; Q205-Q207 PolarHBondContact O-N 3.44Å; Q207-N211 WeakPolarHBondContact O-CB 3.23Å; Q207-N211 PolarHBondContact O-N 3.32Å; Q207-N211 PolarHBondContact O-ND2 3.05Å; Q207-N211 PolarHBondContact O-OD1 3.01Å
208	R	82.2	Confident	79.3	Confident	161 Å²	161	87.6 Å²	87.6	61%	0.608	44%	0.439	S	S	*	.	H	α-helix	trans	-68.6	-36.9	176.7	-72.3	170.1	172.9	-178.4	-4.8	112.4	K204 Q205 H206 K212	K204-R208 WeakPolarHBondContact O-CG 3.39Å; K204-R208 PolarHBondContact O-N 3.33Å; Q205-R208 WeakPolarHBondContact O-CB 3.09Å; Q205-R208 PolarHBondContact O-N 3.05Å; Q205-R208 VanDerWaalsContact O-N 3.11Å; H206-R208 VanDerWaalsContact C-N 3.29Å; H206-R208 PolarHBondContact O-N 2.99Å; R208-K212 WeakPolarHBondContact O-CB 3.38Å; R208-K212 PolarHBondContact O-N 3.18Å
209	I	80.1	Confident	78.3	Confident	93 Å²	93	93 Å²	93	48%	0.477	47%	0.468	S	S	.	.	H	α-helix	trans	-64.9	-49.8	177.1	-65.2	167	0	0	0	109.5	Q205 H206 N211 K212 E213	Q205-I209 WeakPolarHBondContact O-CG1 3.42Å; Q205-I209 PolarHBondContact O-N 3.18Å; Q205-I209 VanDerWaalsContact O-N 3.12Å; H206-I209 PolarHBondContact O-N 3.5Å; I209-N211 PolarHBondContact O-N 3.21Å; I209-K212 WeakPolarHBondContact O-CA 3.22Å; I209-K212 WeakPolarHBondContact O-CB 3.34Å; I209-K212 PolarHBondContact O-N 3.3Å; I209-E213 PolarHBondContact O-N 3.47Å
210	L	78.5	Confident	77.1	Confident	80 Å²	80	95.5 Å²	95.5	42%	0.419	50%	0.496	S	S	.	.	H	α-helix	trans	-58.8	-45.2	177.4	-67	177.5	0	0	0	112	H206 K212 E213 T214	H206-L210 WeakPolarHBondContact O-CG 3.42Å; H206-L210 PolarHBondContact O-N 3.33Å; L210-K212 PolarHBondContact O-N 3.11Å; L210-E213 PolarHBondContact O-N 3.15Å; L210-T214 PolarHBondContact O-N 2.85Å; L210-T214 PolarHBondContact O-OG1 3.5Å
211	N	78.1	Confident	75.5	Confident	103 Å²	103	104.2 Å²	104.2	55%	0.551	53%	0.533	S	S	*	.	H	α-helix	trans	-62.1	-33.9	176.9	-69.6	-7.5	0	0	0	112.3	Q207 I209 I215	Q207-N211 WeakPolarHBondContact O-CB 3.23Å; Q207-N211 PolarHBondContact O-N 3.32Å; Q207-N211 PolarHBondContact O-ND2 3.05Å; Q207-N211 PolarHBondContact O-OD1 3.01Å; I209-N211 PolarHBondContact O-N 3.21Å; N211-I215 WeakPolarHBondContact O-CD1 3.27Å; N211-I215 VanDerWaalsContact O-CG1 3.26Å; N211-I215 WeakPolarHBondContact O-CG1 3.43Å; N211-I215 PolarHBondContact O-N 2.68Å
212	K	78.3	Confident	75.2	Confident	142 Å²	142	106.5 Å²	106.5	62%	0.617	54%	0.542	S	S	*	.	H	α-helix	trans	-71	-41.9	176.4	-171	179.3	178.9	-174.5	0	111.3	R208 I209 L210 T214 I215 L216	R208-K212 WeakPolarHBondContact O-CB 3.38Å; R208-K212 PolarHBondContact O-N 3.18Å; I209-K212 WeakPolarHBondContact O-CA 3.22Å; I209-K212 WeakPolarHBondContact O-CB 3.34Å; I209-K212 PolarHBondContact O-N 3.3Å; L210-K212 PolarHBondContact O-N 3.11Å; K212-T214 VanDerWaalsContact C-N 3.35Å; K212-I215 PolarHBondContact O-N 2.89Å; K212-L216 WeakPolarHBondContact O-CG 3.01Å; K212-L216 PolarHBondContact O-N 3.48Å
213	E	77	Confident	75	Confident	101 Å²	101	108.6 Å²	108.6	47%	0.472	55%	0.554	S	S	.	*	H	α-helix	trans	-61.5	-42.6	174.9	-70.8	175.8	164.9	0	0	111.4	I209 L210 I215 L216 L217	I209-E213 PolarHBondContact O-N 3.47Å; L210-E213 PolarHBondContact O-N 3.15Å; E213-I215 VanDerWaalsContact C-N 3.34Å; E213-I215 PolarHBondContact O-N 3.07Å; E213-L216 PolarHBondContact O-N 3.06Å; E213-L217 WeakPolarHBondContact O-CG 3.48Å; E213-L217 PolarHBondContact O-N 2.7Å
214	T	77.1	Confident	74.7	Confident	91 Å²	91	111 Å²	111	56%	0.558	57%	0.567	S	S	*	*	H	α-helix	trans	-59.3	-41.8	175.1	-53.7	0	0	0	0	112.5	L210 K212 L217 S218	L210-T214 PolarHBondContact O-N 2.85Å; L210-T214 PolarHBondContact O-OG1 3.5Å; K212-T214 VanDerWaalsContact C-N 3.35Å; T214-L217 PolarHBondContact O-N 3.09Å; T214-S218 PolarHBondContact O-N 3Å
215	I	74.6	Confident	74.4	Confident	96 Å²	96	110.9 Å²	110.9	49%	0.492	57%	0.571	S	S	.	*	H	α-helix	trans	-69	-38.6	177.8	-66.9	163.9	0	0	0	111.3	N211 K212 E213 L217 S218 N219	N211-I215 WeakPolarHBondContact O-CD1 3.27Å; N211-I215 VanDerWaalsContact O-CG1 3.26Å; N211-I215 WeakPolarHBondContact O-CG1 3.43Å; N211-I215 PolarHBondContact O-N 2.68Å; K212-I215 PolarHBondContact O-N 2.89Å; E213-I215 VanDerWaalsContact C-N 3.34Å; E213-I215 PolarHBondContact O-N 3.07Å; I215-L217 VanDerWaalsContact C-N 3.32Å; I215-S218 PolarHBondContact O-N 2.78Å; I215-S218 PolarHBondContact O-OG 3.35Å; I215-N219 WeakPolarHBondContact O-CB 3.11Å; I215-N219 VanDerWaalsContact O-CG 3.22Å; I215-N219 PolarHBondContact O-N 2.79Å; I215-N219 PolarHBondContact O-ND2 3.32Å
216	L	69.9	Low	73.9	Confident	114 Å²	114	112.1 Å²	112.1	60%	0.597	58%	0.58	S	S	*	*	H	α-helix	trans	-66.7	-35.9	177.2	-69.4	178.4	0	0	0	111.9	K212 E213 G220	K212-L216 WeakPolarHBondContact O-CG 3.01Å; K212-L216 PolarHBondContact O-N 3.48Å; E213-L216 PolarHBondContact O-N 3.06Å; L216-G220 PolarHBondContact O-N 3.5Å
217	L	71.9	Confident	73.6	Confident	128 Å²	128	113.9 Å²	113.9	67%	0.67	59%	0.592	S	S	*	*	H	α-helix	trans	-68.8	-40.7	173.9	-74.3	159	0	0	0	112	E213 T214 I215 G220	E213-L217 WeakPolarHBondContact O-CG 3.48Å; E213-L217 PolarHBondContact O-N 2.7Å; T214-L217 PolarHBondContact O-N 3.09Å; I215-L217 VanDerWaalsContact C-N 3.32Å; L217-G220 PolarHBondContact O-N 2.65Å
218	S	74.9	Confident	73.1	Confident	73 Å²	73	114.9 Å²	114.9	51%	0.51	60%	0.602	S	S	.	*	H	α-helix	trans	-71.7	-29.4	179.6	82	0	0	0	0	113.6	T214 I215 G220	T214-S218 PolarHBondContact O-N 3Å; I215-S218 PolarHBondContact O-N 2.78Å; I215-S218 PolarHBondContact O-OG 3.35Å; S218-G220 VanDerWaalsContact C-N 3.31Å
219	N	67.5	Low	72.4	Confident	122 Å²	122	111.4 Å²	111.4	65%	0.652	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-6.6	179	-65.6	-9.1	0	0	0	113	I215	I215-N219 WeakPolarHBondContact O-CB 3.11Å; I215-N219 VanDerWaalsContact O-CG 3.22Å; I215-N219 PolarHBondContact O-N 2.79Å; I215-N219 PolarHBondContact O-ND2 3.32Å
220	G	62.4	Low	71.8	Confident	66 Å²	66	112.9 Å²	112.9	68%	0.68	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	1	179.9	0	0	0	0	0	114.9	L216 L217 S218	L216-G220 PolarHBondContact O-N 3.5Å; L217-G220 PolarHBondContact O-N 2.65Å; S218-G220 VanDerWaalsContact C-N 3.31Å
221	Q	51.6	Low	71.2	Confident	239 Å²	239	115.9 Å²	115.9	100%	1.117	63%	0.629	S	S	*	*			trans	-111.5	0	173.5	-61.4	-162.2	-80.9	0	0	110.4

Retrieved 221 of 221 residues in 38.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).