A0A3B3UDU6_9TELE Loading...

HUWE1 associated protein modifying stress responses a

AlphaFold DB , UniProt , Accession A0A3B3UDU6, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 291 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	43.2	Very low	39.8	Very low	242 Å²	242	166.7 Å²	166.7	100%	1.192	85%	0.846	S	S	*	*				0	97.6	0	-163.5	175.5	-157.5	0	0	105.6
2	E	39.5	Very low	40.3	Very low	200 Å²	200	165.8 Å²	165.8	94%	0.935	84%	0.841	S	S	*	*			trans	-169.5	87.6	159.6	-112.5	175.2	171.2	0	0	107.2
3	E	41.5	Very low	40.6	Very low	197 Å²	197	163.2 Å²	163.2	92%	0.921	82%	0.824	S	S	*	*			trans	-94.1	122.5	156.2	-84.2	-168.3	135.1	0	0	107.5
4	K	42.7	Very low	40.6	Very low	197 Å²	197	164.6 Å²	164.6	86%	0.857	83%	0.826	S	S	*	*			trans	-170.9	100.2	151.2	-120.4	175	168.5	179.8	0	107.2
5	K	38.2	Very low	40.9	Very low	170 Å²	170	160.4 Å²	160.4	74%	0.739	80%	0.803	S	S	*	*				106.1	97.6	78.7	-171.9	177.1	-174.4	-176.6	0	106.3	D7	K5-D7 PolarHBondContact O-N 3.2Å; K5-D7 VanDerWaalsContact O-N 3.13Å
6	E	39.9	Very low	41.8	Very low	193 Å²	193	152.1 Å²	152.1	90%	0.902	77%	0.771	S	S	*	*			trans	-50.7	112.6	162.6	-81.6	174.4	131.9	0	0	108	G8	E6-G8 PolarHBondContact O-N 3.46Å
7	D	37.1	Very low	42.9	Very low	148 Å²	148	146.9 Å²	146.9	79%	0.791	75%	0.749	S	S	*	*			trans	-72.9	109.3	160	-89.7	-30.2	0	0	0	106.4	K5 D9	K5-D7 PolarHBondContact O-N 3.2Å; K5-D7 VanDerWaalsContact O-N 3.13Å; D7-D9 PolarHBondContact O-N 2.71Å
8	G	40.4	Very low	43.8	Very low	64 Å²	64	143.4 Å²	143.4	66%	0.66	73%	0.73	S	S	*	*			trans	-56.3	106.5	170.5	0	0	0	0	0	109.1	E6 S10	E6-G8 PolarHBondContact O-N 3.46Å; G8-S10 PolarHBondContact O-N 3.24Å
9	D	36.5	Very low	45.1	Very low	155 Å²	155	140 Å²	140	83%	0.829	71%	0.71	S	S	*	*			trans	-62.9	83.8	155.1	-157.5	13.3	0	0	0	105.6	D7 E11	D7-D9 PolarHBondContact O-N 2.71Å; D9-E11 PolarHBondContact O-N 2.99Å
10	S	40.1	Very low	46.6	Very low	97 Å²	97	140.1 Å²	140.1	68%	0.678	70%	0.702	S	S	*	*			trans	-64.8	88.7	164.2	-61.8	0	0	0	0	103.9	G8 I12	G8-S10 PolarHBondContact O-N 3.24Å; S10-I12 PolarHBondContact O-N 3.39Å
11	E	38.3	Very low	48.4	Very low	171 Å²	171	134.6 Å²	134.6	80%	0.799	67%	0.673	S	S	*	*			trans	-34.4	101.5	155.5	-175.9	176.2	-172.2	0	0	104.7	D9 Q13	D9-E11 PolarHBondContact O-N 2.99Å; E11-Q13 PolarHBondContact O-N 3.39Å
12	I	46.1	Very low	50.4	Low	155 Å²	155	126.1 Å²	126.1	80%	0.795	64%	0.638	S	S	*	*			trans	-65.2	90.7	171.8	-61.7	168.1	0	0	0	100.5	S10 E14	S10-I12 PolarHBondContact O-N 3.39Å; I12-E14 PolarHBondContact O-N 3.4Å
13	Q	44.3	Very low	52.7	Low	132 Å²	132	125.1 Å²	125.1	62%	0.617	63%	0.631	S	S	*	*			trans	-54.4	96.4	169.5	-175.5	171.5	13.4	0	0	102.3	E11 H15	E11-Q13 PolarHBondContact O-N 3.39Å; Q13-H15 PolarHBondContact O-CD2 2.86Å; Q13-H15 VanDerWaalsContact O-CD2 3.27Å; Q13-H15 PolarHBondContact O-N 3.07Å; Q13-H15 PolarHBondContact OE1-CE1 3.15Å; Q13-H15 PolarHBondContact OE1-NE2 2.93Å
14	E	40.4	Very low	55	Low	183 Å²	183	124.4 Å²	124.4	86%	0.855	62%	0.62	S	S	*	*			trans	-65.8	88.7	-179.9	-168.9	-178.1	-176.3	0	0	103	I12 G16	I12-E14 PolarHBondContact O-N 3.4Å; E14-G16 PolarHBondContact O-N 3.23Å
15	H	45.4	Very low	57.1	Low	102 Å²	102	118.6 Å²	118.6	47%	0.472	60%	0.596	S	S	.	*			trans	-71.7	75.5	-175.4	-92.5	-60.4	0	0	0	105.8	Q13 H19	Q13-H15 PolarHBondContact O-CD2 2.86Å; Q13-H15 VanDerWaalsContact O-CD2 3.27Å; Q13-H15 PolarHBondContact O-N 3.07Å; Q13-H15 PolarHBondContact OE1-CE1 3.15Å; Q13-H15 PolarHBondContact OE1-NE2 2.93Å; H15-H19 VanDerWaalsContact CB-CD2 3.43Å; H15-H19 WeakPolarHBondContact CB-CD2 3.36Å; H15-H19 WeakPolarHBondContact CB-NE2 3.31Å; H15-H19 AromaticContact CG-CD2 3.75Å; H15-H19 AromaticContact CG-CE1 3.97Å; H15-H19 AromaticContact CG-NE2 3.71Å; H15-H19 AromaticContact ND1-CD2 3.51Å; H15-H19 AromaticContact ND1-CE1 3.68Å; H15-H19 AromaticContact ND1-CG 3.36Å; H15-H19 AromaticContact ND1-ND1 3.54Å; H15-H19 AromaticContact ND1-NE2 3.74Å
16	G	55.4	Low	59.4	Low	28 Å²	28	114.9 Å²	114.9	29%	0.289	58%	0.577	S	S	.	*			trans	-55.6	153.9	170.2	0	0	0	0	0	109	E14 E18 H19	E14-G16 PolarHBondContact O-N 3.23Å; G16-E18 PolarHBondContact O-N 3.39Å; G16-H19 PolarHBondContact O-CD2 2.99Å; G16-H19 VanDerWaalsContact O-CD2 3.29Å; G16-H19 PolarHBondContact O-N 3.48Å
17	P	59.6	Low	61.7	Low	63 Å²	63	110.8 Å²	110.8	41%	0.409	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-47.5	-23.3	-178.4	-25.7	31.9	0	0	0	114.7	H19 W20 F21	P17-H19 PolarHBondContact O-N 3.08Å; P17-H19 VanDerWaalsContact O-N 3.16Å; P17-W20 PolarHBondContact O-N 3.3Å; P17-F21 HydrophobicContact CB-CE2 4.41Å; P17-F21 WeakPolarHBondContact O-CD2 3.39Å
18	E	59.5	Low	63.9	Low	85 Å²	85	106 Å²	106	40%	0.397	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-47.2	-32.2	172.6	-60.3	-54.9	136.6	0	0	115.1	G16 W20 F21 R26	G16-E18 PolarHBondContact O-N 3.39Å; E18-W20 VanDerWaalsContact C-N 3.32Å; E18-W20 PolarHBondContact O-N 2.98Å; E18-F21 PolarHBondContact O-N 3.41Å; E18-R26 VanDerWaalsContact O-CZ 3.27Å; E18-R26 PolarHBondContact O-NE 3.49Å; E18-R26 PolarHBondContact O-NH2 3.15Å
19	H	68.4	Low	65.9	Low	78 Å²	78	103.7 Å²	103.7	36%	0.361	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-77.5	-16.9	-174.6	90.1	97.5	0	0	0	114	H15 G16 P17	H15-H19 VanDerWaalsContact CB-CD2 3.43Å; H15-H19 WeakPolarHBondContact CB-CD2 3.36Å; H15-H19 WeakPolarHBondContact CB-NE2 3.31Å; H15-H19 AromaticContact CG-CD2 3.75Å; H15-H19 AromaticContact CG-CE1 3.97Å; H15-H19 AromaticContact CG-NE2 3.71Å; H15-H19 AromaticContact ND1-CD2 3.51Å; H15-H19 AromaticContact ND1-CE1 3.68Å; H15-H19 AromaticContact ND1-CG 3.36Å; H15-H19 AromaticContact ND1-ND1 3.54Å; H15-H19 AromaticContact ND1-NE2 3.74Å; G16-H19 PolarHBondContact O-CD2 2.99Å; G16-H19 VanDerWaalsContact O-CD2 3.29Å; G16-H19 PolarHBondContact O-N 3.48Å; P17-H19 PolarHBondContact O-N 3.08Å; P17-H19 VanDerWaalsContact O-N 3.16Å
20	W	76.4	Confident	68.2	Low	142 Å²	142	98.6 Å²	98.6	54%	0.538	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-89.1	-12.5	176.2	-64.6	-17.6	0	0	0	113.9	P17 E18 R124	P17-W20 PolarHBondContact O-N 3.3Å; E18-W20 VanDerWaalsContact C-N 3.32Å; E18-W20 PolarHBondContact O-N 2.98Å; W20-R124 HydrophobicContact CH2-CG 3.96Å; W20-R124 HydrophobicContact CZ3-CB 4.31Å; W20-R124 HydrophobicContact CZ3-CG 3.99Å
21	F	82.5	Confident	70.2	Confident	24 Å²	24	99.1 Å²	99.1	11%	0.105	48%	0.479	C	S	.	.	S	Bend	trans	-80.6	139.9	177.2	-67.6	-62	0	0	0	111.4	P17 E18 E25 R26 L29 V121 K122	P17-F21 HydrophobicContact CB-CE2 4.41Å; P17-F21 WeakPolarHBondContact O-CD2 3.39Å; E18-F21 PolarHBondContact O-N 3.41Å; F21-E25 VanDerWaalsContact CA-OE2 3.28Å; F21-E25 WeakPolarHBondContact CA-OE2 3.19Å; F21-E25 HydrophobicContact CB-CB 3.98Å; F21-E25 HydrophobicContact CD1-CB 4.09Å; F21-E25 HydrophobicContact CG-CB 4.39Å; F21-R26 HydrophobicContact CB-CG 3.9Å; F21-R26 PolarHBondContact O-NH2 3Å; F21-L29 HydrophobicContact CD2-CD1 4.08Å; F21-L29 HydrophobicContact CE2-CD1 4.16Å; F21-L29 HydrophobicContact CG-CD1 4.33Å; F21-L29 HydrophobicContact CZ-CD1 4.46Å; F21-V121 HydrophobicContact CE1-CG1 4.2Å; F21-V121 HydrophobicContact CZ-CG1 4.48Å; F21-K122 HydrophobicContact CE2-CG 3.99Å; F21-K122 HydrophobicContact CZ-CG 3.93Å
22	S	87.1	Confident	72.1	Confident	65 Å²	65	93 Å²	93	46%	0.455	46%	0.457	S	S	.	.			trans	-59.5	157	166.7	173.3	0	0	0	0	110.7	W24 E25 R26	S22-W24 PolarHBondContact O-N 3.33Å; S22-W24 PolarHBondContact OG-N 2.82Å; S22-E25 PolarHBondContact N-OE2 3.26Å; S22-E25 PolarHBondContact O-N 3.29Å; S22-E25 VanDerWaalsContact O-N 3.09Å; S22-R26 PolarHBondContact O-N 3.32Å
23	K	86.9	Confident	73.4	Confident	179 Å²	179	92 Å²	92	78%	0.778	45%	0.45	S	S	*	.	H	α-helix	trans	-54.2	-39.1	172.4	-69.6	-174.4	178.5	-175.9	0	112	Q27	K23-Q27 PolarHBondContact O-N 3.01Å
24	W	89.8	Confident	74.7	Confident	182 Å²	182	91.1 Å²	91.1	69%	0.689	45%	0.454	S	S	*	.	H	α-helix	trans	-64.9	-43.4	176.6	172.6	78.8	0	0	0	112	S22 R26 Q27 C28	S22-W24 PolarHBondContact O-N 3.33Å; S22-W24 PolarHBondContact OG-N 2.82Å; W24-R26 VanDerWaalsContact C-N 3.33Å; W24-R26 PolarHBondContact O-N 3.09Å; W24-Q27 WeakPolarHBondContact O-CB 3.42Å; W24-Q27 PolarHBondContact O-N 3.36Å; W24-C28 VanDerWaalsContact CE2-SG 3.55Å; W24-C28 PolarHBondContact O-N 3.27Å; W24-C28 VanDerWaalsContact O-N 3.08Å; W24-C28 PolarHBondContact O-SG 3.31Å
25	E	87.5	Confident	75.7	Confident	75 Å²	75	88.8 Å²	88.8	35%	0.35	44%	0.444	S	S	.	.	H	α-helix	trans	-64.3	-39.1	179.6	-67	174.4	138.7	0	0	111.5	F21 S22 Q27 C28 L29	F21-E25 VanDerWaalsContact CA-OE2 3.28Å; F21-E25 WeakPolarHBondContact CA-OE2 3.19Å; F21-E25 HydrophobicContact CB-CB 3.98Å; F21-E25 HydrophobicContact CD1-CB 4.09Å; F21-E25 HydrophobicContact CG-CB 4.39Å; S22-E25 PolarHBondContact N-OE2 3.26Å; S22-E25 PolarHBondContact O-N 3.29Å; S22-E25 VanDerWaalsContact O-N 3.09Å; E25-Q27 VanDerWaalsContact C-N 3.34Å; E25-Q27 PolarHBondContact O-N 3.41Å; E25-C28 PolarHBondContact O-N 3.1Å; E25-L29 VanDerWaalsContact O-CG 3.29Å; E25-L29 WeakPolarHBondContact O-CG 3.16Å; E25-L29 PolarHBondContact O-N 3.35Å
26	R	86.4	Confident	76.4	Confident	92 Å²	92	89.6 Å²	89.6	35%	0.347	45%	0.452	S	S	.	.	H	α-helix	trans	-63.5	-39.5	174.8	-65.9	-172.6	-161.9	111.7	5	112.6	E18 F21 S22 W24 L29 A30	E18-R26 VanDerWaalsContact O-CZ 3.27Å; E18-R26 PolarHBondContact O-NE 3.49Å; E18-R26 PolarHBondContact O-NH2 3.15Å; F21-R26 HydrophobicContact CB-CG 3.9Å; F21-R26 PolarHBondContact O-NH2 3Å; S22-R26 PolarHBondContact O-N 3.32Å; W24-R26 VanDerWaalsContact C-N 3.33Å; W24-R26 PolarHBondContact O-N 3.09Å; R26-L29 PolarHBondContact O-N 2.81Å; R26-A30 PolarHBondContact O-N 3.42Å
27	Q	86.8	Confident	76.5	Confident	106 Å²	106	92.8 Å²	92.8	50%	0.495	47%	0.468	S	S	.	.	H	α-helix	trans	-61.5	-46.8	175.7	-178	61.3	25.9	0	0	110.9	K23 W24 E25 L29 A30 E31	K23-Q27 PolarHBondContact O-N 3.01Å; W24-Q27 WeakPolarHBondContact O-CB 3.42Å; W24-Q27 PolarHBondContact O-N 3.36Å; E25-Q27 VanDerWaalsContact C-N 3.34Å; E25-Q27 PolarHBondContact O-N 3.41Å; Q27-L29 VanDerWaalsContact C-N 3.3Å; Q27-L29 PolarHBondContact O-N 3.02Å; Q27-A30 PolarHBondContact O-N 3.26Å; Q27-E31 WeakPolarHBondContact CG-OE1 3.36Å; Q27-E31 PolarHBondContact NE2-OE1 3.42Å; Q27-E31 WeakPolarHBondContact O-CG 3.46Å; Q27-E31 PolarHBondContact O-N 3.49Å
28	C	84.3	Confident	76.6	Confident	49 Å²	49	90.3 Å²	90.3	33%	0.331	45%	0.454	S	S	.	.	H	α-helix	trans	-62.1	-36.4	176.9	-65.5	0	0	0	0	113	W24 E25 A32	W24-C28 VanDerWaalsContact CE2-SG 3.55Å; W24-C28 PolarHBondContact O-N 3.27Å; W24-C28 VanDerWaalsContact O-N 3.08Å; W24-C28 PolarHBondContact O-SG 3.31Å; E25-C28 PolarHBondContact O-N 3.1Å; C28-A32 PolarHBondContact O-N 3.25Å
29	L	82.8	Confident	76.9	Confident	14 Å²	14	94.1 Å²	94.1	7%	0.073	47%	0.471	C	S	.	.	H	α-helix	trans	-66.6	-42.9	176.3	-73.4	171.1	0	0	0	112	F21 E25 R26 Q27 A32 E33 L118	F21-L29 HydrophobicContact CD2-CD1 4.08Å; F21-L29 HydrophobicContact CE2-CD1 4.16Å; F21-L29 HydrophobicContact CG-CD1 4.33Å; F21-L29 HydrophobicContact CZ-CD1 4.46Å; E25-L29 VanDerWaalsContact O-CG 3.29Å; E25-L29 WeakPolarHBondContact O-CG 3.16Å; E25-L29 PolarHBondContact O-N 3.35Å; R26-L29 PolarHBondContact O-N 2.81Å; Q27-L29 VanDerWaalsContact C-N 3.3Å; Q27-L29 PolarHBondContact O-N 3.02Å; L29-A32 PolarHBondContact O-N 2.99Å; L29-E33 PolarHBondContact O-N 2.84Å; L29-L118 HydrophobicContact CD2-CB 4.26Å; L29-L118 HydrophobicContact CD2-CD1 4Å; L29-L118 HydrophobicContact CD2-CD2 3.67Å; L29-L118 HydrophobicContact CD2-CG 4.17Å
30	A	83.6	Confident	77	Confident	48 Å²	48	97.8 Å²	97.8	40%	0.397	49%	0.489	S	S	.	.	H	α-helix	trans	-65.3	-40.5	178.2	0	0	0	0	0	112.2	R26 Q27 A32 E33 T34	R26-A30 PolarHBondContact O-N 3.42Å; Q27-A30 PolarHBondContact O-N 3.26Å; A30-A32 VanDerWaalsContact C-N 3.3Å; A30-A32 PolarHBondContact O-N 3.15Å; A30-E33 PolarHBondContact O-N 3.18Å; A30-T34 PolarHBondContact O-N 2.94Å; A30-T34 PolarHBondContact O-OG1 3.47Å
31	E	83.2	Confident	77	Confident	108 Å²	108	95.2 Å²	95.2	51%	0.505	48%	0.483	S	S	.	.	H	α-helix	trans	-64.6	-32.5	175.6	-72.5	171.8	-169.2	0	0	112.9	Q27 E33 T34	Q27-E31 WeakPolarHBondContact CG-OE1 3.36Å; Q27-E31 PolarHBondContact NE2-OE1 3.42Å; Q27-E31 WeakPolarHBondContact O-CG 3.46Å; Q27-E31 PolarHBondContact O-N 3.49Å; E31-E33 VanDerWaalsContact C-N 3.33Å; E31-T34 PolarHBondContact O-OG1 2.88Å; E31-T34 VanDerWaalsContact O-OG1 3.12Å
32	A	77.1	Confident	76.8	Confident	42 Å²	42	96.2 Å²	96.2	35%	0.347	50%	0.495	S	S	.	.	H	α-helix	trans	-73.3	-24.4	177.3	0	0	0	0	0	113.2	C28 L29 A30 L118	C28-A32 PolarHBondContact O-N 3.25Å; L29-A32 PolarHBondContact O-N 2.99Å; A30-A32 VanDerWaalsContact C-N 3.3Å; A30-A32 PolarHBondContact O-N 3.15Å; A32-L118 HydrophobicContact CB-CD1 3.85Å
33	E	74.8	Confident	76.6	Confident	135 Å²	135	98.1 Å²	98.1	63%	0.631	50%	0.5	S	S	*	.	H	α-helix	trans	-83.8	-23.1	-179.5	-73.5	174.3	-170.6	0	0	112.8	L29 A30 E31 K122	L29-E33 PolarHBondContact O-N 2.84Å; A30-E33 PolarHBondContact O-N 3.18Å; E31-E33 VanDerWaalsContact C-N 3.33Å; E33-K122 IonicContact OE1-NZ 3.19Å; E33-K122 PolarHBondContact OE1-NZ 3Å; E33-K122 VanDerWaalsContact OE1-NZ 3.15Å
34	T	70.4	Confident	76.7	Confident	114 Å²	114	94.3 Å²	94.3	70%	0.699	49%	0.488	S	S	*	.	S	Bend	trans	-87.5	-10.9	-179	48.6	0	0	0	0	114.8	A30 E31 D36	A30-T34 PolarHBondContact O-N 2.94Å; A30-T34 PolarHBondContact O-OG1 3.47Å; E31-T34 PolarHBondContact O-OG1 2.88Å; E31-T34 VanDerWaalsContact O-OG1 3.12Å; T34-D36 PolarHBondContact O-N 3.39Å
35	M	61.4	Low	76.7	Confident	133 Å²	133	87.1 Å²	87.1	66%	0.655	46%	0.463	S	S	*	.			trans	-80.5	34.7	-173.4	-158.6	-179.9	174.9	0	0	114.2	P37 Q111	M35-P37 WeakPolarHBondContact O-CD 3.47Å; M35-Q111 PolarHBondContact O-NE2 3.25Å; M35-Q111 VanDerWaalsContact O-NE2 3.15Å
36	D	61.5	Low	77	Confident	120 Å²	120	90 Å²	90	64%	0.642	48%	0.477	S	S	*	.			trans	-110.9	68.2	-180	-159.5	18.8	0	0	0	115.2	T34	T34-D36 PolarHBondContact O-N 3.39Å
37	P	56.8	Low	77.4	Confident	95 Å²	95	90 Å²	90	62%	0.617	48%	0.484	S	S	*	.			trans	-107.4	32.7	175.6	39.5	-34.5	0	0	0	113.5	M35	M35-P37 WeakPolarHBondContact O-CD 3.47Å
38	G	61.7	Low	77.8	Confident	11 Å²	11	89.3 Å²	89.3	11%	0.113	48%	0.479	C	S	.	.			trans	-93.1	-19	-159.6	0	0	0	0	0	119.6
39	E	64.4	Low	78.4	Confident	165 Å²	165	89 Å²	89	77%	0.771	47%	0.474	S	S	*	.	H	α-helix	trans	-83.5	-38.7	-171.2	-62.7	-174.1	162	0	0	112.2	E41 A42 D43	E39-E41 VanDerWaalsContact C-N 3.32Å; E39-E41 PolarHBondContact O-N 3Å; E39-A42 PolarHBondContact O-N 3.46Å; E39-D43 PolarHBondContact O-N 3.19Å
40	E	71.9	Confident	79.2	Confident	154 Å²	154	94.8 Å²	94.8	72%	0.72	50%	0.495	S	S	*	.	H	α-helix	trans	-66.2	-31.5	-176.5	-161	173.8	-166.6	0	0	112.8	N44	E40-N44 VanDerWaalsContact O-CG 3.29Å; E40-N44 PolarHBondContact O-N 3.29Å; E40-N44 PolarHBondContact O-ND2 3.34Å
41	E	76	Confident	79.9	Confident	89 Å²	89	98 Å²	98	42%	0.416	50%	0.502	S	S	.	.	H	α-helix	trans	-71.9	-34	178.2	-163.1	180	-172.1	0	0	112.3	E39 D45 R104	E39-E41 VanDerWaalsContact C-N 3.32Å; E39-E41 PolarHBondContact O-N 3Å; E41-D45 PolarHBondContact O-N 3.34Å; E41-R104 IonicContact OE2-CZ 3.43Å; E41-R104 IonicContact OE2-NE 2.95Å; E41-R104 PolarHBondContact OE2-NE 3.23Å; E41-R104 IonicContact OE2-NH2 2.73Å; E41-R104 PolarHBondContact OE2-NH2 3.16Å
42	A	78.7	Confident	80.6	Confident	45 Å²	45	94.5 Å²	94.5	37%	0.372	49%	0.486	S	S	.	.	H	α-helix	trans	-71.7	-40.3	-179.7	0	0	0	0	0	112.2	E39 N44 D45 Q46	E39-A42 PolarHBondContact O-N 3.46Å; A42-N44 VanDerWaalsContact C-N 3.33Å; A42-D45 PolarHBondContact O-N 3.42Å; A42-Q46 PolarHBondContact O-N 3.29Å; A42-Q46 VanDerWaalsContact O-N 3.12Å
43	D	82.9	Confident	81.6	Confident	104 Å²	104	97.4 Å²	97.4	56%	0.556	49%	0.491	S	S	*	.	H	α-helix	trans	-63.8	-41.5	175.5	-77.9	-8.4	0	0	0	111	E39 D45 Q46 D47	E39-D43 PolarHBondContact O-N 3.19Å; D43-D45 VanDerWaalsContact C-N 3.31Å; D43-D45 PolarHBondContact O-N 2.87Å; D43-Q46 PolarHBondContact O-N 3.24Å; D43-D47 PolarHBondContact O-N 3.28Å
44	N	87.9	Confident	82.7	Confident	99 Å²	99	94.7 Å²	94.7	53%	0.529	48%	0.479	S	S	.	.	H	α-helix	trans	-59.3	-39.9	175.4	-78	-44.8	0	0	0	112.7	E40 A42 K48	E40-N44 VanDerWaalsContact O-CG 3.29Å; E40-N44 PolarHBondContact O-N 3.29Å; E40-N44 PolarHBondContact O-ND2 3.34Å; A42-N44 VanDerWaalsContact C-N 3.33Å; N44-K48 WeakPolarHBondContact O-CB 3.41Å; N44-K48 PolarHBondContact O-N 3.14Å
45	D	90.8	Very high	84.1	Confident	31 Å²	31	93.3 Å²	93.3	17%	0.166	47%	0.467	C	S	.	.	H	α-helix	trans	-66.6	-40.8	176.7	-77.6	-32.7	0	0	0	112.5	E41 A42 D43 K48 L49 R100	E41-D45 PolarHBondContact O-N 3.34Å; A42-D45 PolarHBondContact O-N 3.42Å; D43-D45 VanDerWaalsContact C-N 3.31Å; D43-D45 PolarHBondContact O-N 2.87Å; D45-K48 PolarHBondContact O-N 2.93Å; D45-L49 WeakPolarHBondContact O-CB 3.48Å; D45-L49 VanDerWaalsContact O-CG 3.29Å; D45-L49 WeakPolarHBondContact O-CG 3.31Å; D45-L49 PolarHBondContact O-N 3.48Å; D45-R100 VanDerWaalsContact CG-NH2 3.3Å; D45-R100 IonicContact OD1-CZ 3.8Å; D45-R100 IonicContact OD1-NH1 3.5Å; D45-R100 PolarHBondContact OD1-NH1 3.31Å; D45-R100 IonicContact OD1-NH2 2.64Å; D45-R100 PolarHBondContact OD1-NH2 3.01Å; D45-R100 IonicContact OD2-CZ 3.86Å; D45-R100 IonicContact OD2-NH1 2.75Å; D45-R100 PolarHBondContact OD2-NH1 2.9Å; D45-R100 IonicContact OD2-NH2 3.89Å; D45-R100 PolarHBondContact OD2-NH2 3.17Å
46	Q	92.7	Very high	85.8	Confident	136 Å²	136	87.4 Å²	87.4	64%	0.636	44%	0.439	S	S	*	.	H	α-helix	trans	-65.3	-44.4	179	-177.2	159	-16.2	0	0	111.3	A42 D43 L49 W50	A42-Q46 PolarHBondContact O-N 3.29Å; A42-Q46 VanDerWaalsContact O-N 3.12Å; D43-Q46 PolarHBondContact O-N 3.24Å; Q46-L49 PolarHBondContact O-N 2.9Å; Q46-W50 WeakPolarHBondContact O-CB 3.43Å; Q46-W50 PolarHBondContact O-N 3.44Å
47	D	95.3	Very high	87.6	Confident	93 Å²	93	83.8 Å²	83.8	50%	0.497	43%	0.426	S	S	.	.	H	α-helix	trans	-63.4	-43	175.9	-76.6	-15.4	0	0	0	111.7	D43 W50 H51	D43-D47 PolarHBondContact O-N 3.28Å; D47-W50 PolarHBondContact O-N 3.31Å; D47-H51 PolarHBondContact O-CD2 3.47Å; D47-H51 PolarHBondContact O-N 3.22Å
48	K	96	Very high	89.5	Confident	90 Å²	90	83 Å²	83	39%	0.391	42%	0.419	S	S	.	.	H	α-helix	trans	-59.8	-48.3	175.6	-174.4	-173.6	179.9	-165.1	0	111.6	N44 D45 W50 H51 L52 E93	N44-K48 WeakPolarHBondContact O-CB 3.41Å; N44-K48 PolarHBondContact O-N 3.14Å; D45-K48 PolarHBondContact O-N 2.93Å; K48-W50 VanDerWaalsContact C-N 3.32Å; K48-W50 PolarHBondContact O-N 3.25Å; K48-H51 PolarHBondContact O-N 3.39Å; K48-L52 HydrophobicContact CG-CD1 4.3Å; K48-L52 WeakPolarHBondContact O-CG 3.34Å; K48-L52 PolarHBondContact O-N 3.2Å; K48-E93 WeakPolarHBondContact CE-OE2 3.34Å; K48-E93 IonicContact NZ-OE1 2.71Å; K48-E93 PolarHBondContact NZ-OE1 3.31Å; K48-E93 IonicContact NZ-OE2 3.43Å; K48-E93 PolarHBondContact NZ-OE2 3.26Å
49	L	97.3	Very high	91.2	Very high	43 Å²	43	82.8 Å²	82.8	23%	0.225	42%	0.416	C	S	.	.	H	α-helix	trans	-63.1	-39.9	178.5	-75.4	174.7	0	0	0	111.9	D45 Q46 L52 F53 E93 A97	D45-L49 WeakPolarHBondContact O-CB 3.48Å; D45-L49 VanDerWaalsContact O-CG 3.29Å; D45-L49 WeakPolarHBondContact O-CG 3.31Å; D45-L49 PolarHBondContact O-N 3.48Å; Q46-L49 PolarHBondContact O-N 2.9Å; L49-L52 PolarHBondContact O-N 3.49Å; L49-F53 WeakPolarHBondContact O-CB 3.46Å; L49-F53 PolarHBondContact O-N 3Å; L49-E93 HydrophobicContact CD2-CB 4.16Å; L49-A97 HydrophobicContact CD1-CB 3.69Å; L49-A97 HydrophobicContact CD2-CB 4.38Å; L49-A97 HydrophobicContact CG-CB 4.27Å
50	W	98	Very high	92.7	Very high	135 Å²	135	77.3 Å²	77.3	51%	0.511	39%	0.394	S	S	.	.	H	α-helix	trans	-61	-45.3	176.1	176.9	-120.2	0	0	0	111.8	Q46 D47 K48 L52 F53 Q54	Q46-W50 WeakPolarHBondContact O-CB 3.43Å; Q46-W50 PolarHBondContact O-N 3.44Å; D47-W50 PolarHBondContact O-N 3.31Å; K48-W50 VanDerWaalsContact C-N 3.32Å; K48-W50 PolarHBondContact O-N 3.25Å; W50-L52 PolarHBondContact O-N 3.28Å; W50-F53 AromaticContact CE3-CD1 3.69Å; W50-F53 HydrophobicContact CE3-CD1 3.69Å; W50-F53 HydrophobicContact CE3-CE1 4.37Å; W50-F53 HydrophobicContact CE3-CG 4.42Å; W50-F53 HydrophobicContact CH2-CD1 4.05Å; W50-F53 HydrophobicContact CH2-CE1 4.03Å; W50-F53 AromaticContact CZ3-CD1 3.33Å; W50-F53 HydrophobicContact CZ3-CD1 3.33Å; W50-F53 AromaticContact CZ3-CE1 3.56Å; W50-F53 HydrophobicContact CZ3-CE1 3.56Å; W50-F53 HydrophobicContact CZ3-CG 4.36Å; W50-F53 WeakPolarHBondContact O-CB 3.4Å; W50-F53 PolarHBondContact O-N 3.5Å; W50-Q54 HydrophobicContact CD2-CG 4.26Å; W50-Q54 HydrophobicContact CH2-CG 4.5Å; W50-Q54 HydrophobicContact CZ2-CG 4Å; W50-Q54 WeakPolarHBondContact O-CG 3.35Å; W50-Q54 PolarHBondContact O-N 3.43Å
51	H	98.1	Very high	93.9	Very high	116 Å²	116	72.2 Å²	72.2	54%	0.537	38%	0.378	S	S	.	.	H	α-helix	trans	-63.7	-40.7	175.6	-73.9	-47.7	0	0	0	113.1	D47 K48 F53 Q54 N55	D47-H51 PolarHBondContact O-CD2 3.47Å; D47-H51 PolarHBondContact O-N 3.22Å; K48-H51 PolarHBondContact O-N 3.39Å; H51-F53 VanDerWaalsContact C-N 3.3Å; H51-F53 PolarHBondContact O-N 3.3Å; H51-Q54 PolarHBondContact ND1-OE1 3.46Å; H51-Q54 PolarHBondContact O-N 2.96Å; H51-N55 WeakPolarHBondContact O-CB 3.45Å; H51-N55 PolarHBondContact O-N 3.03Å
52	L	98.3	Very high	94.6	Very high	35 Å²	35	72 Å²	72	18%	0.183	38%	0.377	C	S	.	.	H	α-helix	trans	-63.2	-38.6	174.7	-72.2	170.1	0	0	0	111.7	K48 L49 W50 N55 S56 L90 E93	K48-L52 HydrophobicContact CG-CD1 4.3Å; K48-L52 WeakPolarHBondContact O-CG 3.34Å; K48-L52 PolarHBondContact O-N 3.2Å; L49-L52 PolarHBondContact O-N 3.49Å; W50-L52 PolarHBondContact O-N 3.28Å; L52-N55 PolarHBondContact O-N 2.8Å; L52-S56 VanDerWaalsContact O-CB 3.27Å; L52-S56 WeakPolarHBondContact O-CB 3.31Å; L52-S56 PolarHBondContact O-N 3.13Å; L52-L90 HydrophobicContact CB-CB 4.42Å; L52-L90 HydrophobicContact CB-CD1 3.78Å; L52-E93 HydrophobicContact CD1-CB 3.54Å; L52-E93 HydrophobicContact CD1-CG 3.63Å
53	F	98.6	Very high	95.2	Very high	103 Å²	103	70.5 Å²	70.5	45%	0.452	36%	0.363	S	S	.	.	H	α-helix	trans	-61.8	-49.1	174.1	169.9	-97.3	0	0	0	111.2	L49 W50 H51 N55 S56 A57 L90	L49-F53 WeakPolarHBondContact O-CB 3.46Å; L49-F53 PolarHBondContact O-N 3Å; W50-F53 AromaticContact CE3-CD1 3.69Å; W50-F53 HydrophobicContact CE3-CD1 3.69Å; W50-F53 HydrophobicContact CE3-CE1 4.37Å; W50-F53 HydrophobicContact CE3-CG 4.42Å; W50-F53 HydrophobicContact CH2-CD1 4.05Å; W50-F53 HydrophobicContact CH2-CE1 4.03Å; W50-F53 AromaticContact CZ3-CD1 3.33Å; W50-F53 HydrophobicContact CZ3-CD1 3.33Å; W50-F53 AromaticContact CZ3-CE1 3.56Å; W50-F53 HydrophobicContact CZ3-CE1 3.56Å; W50-F53 HydrophobicContact CZ3-CG 4.36Å; W50-F53 WeakPolarHBondContact O-CB 3.4Å; W50-F53 PolarHBondContact O-N 3.5Å; H51-F53 VanDerWaalsContact C-N 3.3Å; H51-F53 PolarHBondContact O-N 3.3Å; F53-N55 VanDerWaalsContact C-N 3.33Å; F53-N55 PolarHBondContact O-N 2.73Å; F53-S56 PolarHBondContact O-N 2.91Å; F53-A57 WeakPolarHBondContact O-CB 3.43Å; F53-A57 PolarHBondContact O-N 2.74Å; F53-L90 HydrophobicContact CB-CD1 4.23Å; F53-L90 HydrophobicContact CB-CD2 4.35Å; F53-L90 HydrophobicContact CD2-CD2 4.31Å
54	Q	98.4	Very high	95.5	Very high	78 Å²	78	72.2 Å²	72.2	36%	0.364	36%	0.362	S	S	.	.	H	α-helix	trans	-59.2	-44	177.2	-70.9	-179.7	-44.4	0	0	112	W50 H51 T58	W50-Q54 HydrophobicContact CD2-CG 4.26Å; W50-Q54 HydrophobicContact CH2-CG 4.5Å; W50-Q54 HydrophobicContact CZ2-CG 4Å; W50-Q54 WeakPolarHBondContact O-CG 3.35Å; W50-Q54 PolarHBondContact O-N 3.43Å; H51-Q54 PolarHBondContact ND1-OE1 3.46Å; H51-Q54 PolarHBondContact O-N 2.96Å; Q54-T58 VanDerWaalsContact O-CB 3.29Å; Q54-T58 WeakPolarHBondContact O-CB 3.24Å; Q54-T58 PolarHBondContact O-N 2.98Å; Q54-T58 PolarHBondContact O-OG1 2.99Å
55	N	98.4	Very high	95.4	Very high	85 Å²	85	73.7 Å²	73.7	46%	0.455	36%	0.364	S	S	.	.	H	α-helix	trans	-63.4	-46.4	178	-174.8	26.2	0	0	0	111.3	H51 L52 F53 T58 A59	H51-N55 WeakPolarHBondContact O-CB 3.45Å; H51-N55 PolarHBondContact O-N 3.03Å; L52-N55 PolarHBondContact O-N 2.8Å; F53-N55 VanDerWaalsContact C-N 3.33Å; F53-N55 PolarHBondContact O-N 2.73Å; N55-T58 PolarHBondContact O-N 3.29Å; N55-A59 WeakPolarHBondContact O-CB 3.49Å; N55-A59 PolarHBondContact O-N 2.95Å
56	S	98.6	Very high	94.6	Very high	9 Å²	9	75 Å²	75	6%	0.063	37%	0.371	C	S	.	.	H	α-helix	trans	-60.4	-50.1	176.7	-178.3	0	0	0	0	111.9	L52 F53 T58 A59 V60 V87	L52-S56 VanDerWaalsContact O-CB 3.27Å; L52-S56 WeakPolarHBondContact O-CB 3.31Å; L52-S56 PolarHBondContact O-N 3.13Å; F53-S56 PolarHBondContact O-N 2.91Å; S56-T58 VanDerWaalsContact C-N 3.29Å; S56-T58 PolarHBondContact O-N 3.48Å; S56-A59 PolarHBondContact O-N 2.91Å; S56-V60 WeakPolarHBondContact O-CG2 3.39Å; S56-V60 PolarHBondContact O-N 3.03Å; S56-V87 WeakPolarHBondContact OG-CA 3.47Å; S56-V87 WeakPolarHBondContact OG-CG2 3.28Å
57	A	98.4	Very high	93.3	Very high	44 Å²	44	74.3 Å²	74.3	36%	0.364	36%	0.363	S	S	.	.	H	α-helix	trans	-59.6	-41.1	177.6	0	0	0	0	0	111.8	F53 V60 A61	F53-A57 WeakPolarHBondContact O-CB 3.43Å; F53-A57 PolarHBondContact O-N 2.74Å; A57-V60 PolarHBondContact O-N 3.32Å; A57-A61 VanDerWaalsContact O-CB 3.31Å; A57-A61 WeakPolarHBondContact O-CB 3.38Å; A57-A61 PolarHBondContact O-N 2.94Å
58	T	97.8	Very high	91.7	Very high	79 Å²	79	75 Å²	75	49%	0.485	37%	0.37	S	S	.	.	H	α-helix	trans	-65.1	-46.7	176.8	-58.6	0	0	0	0	111.3	Q54 N55 S56 V60 A61 Q62	Q54-T58 VanDerWaalsContact O-CB 3.29Å; Q54-T58 WeakPolarHBondContact O-CB 3.24Å; Q54-T58 PolarHBondContact O-N 2.98Å; Q54-T58 PolarHBondContact O-OG1 2.99Å; N55-T58 PolarHBondContact O-N 3.29Å; S56-T58 VanDerWaalsContact C-N 3.29Å; S56-T58 PolarHBondContact O-N 3.48Å; T58-V60 VanDerWaalsContact C-N 3.32Å; T58-V60 PolarHBondContact O-N 3.5Å; T58-A61 PolarHBondContact O-N 2.88Å; T58-Q62 HydrophobicContact CG2-CG 4.41Å; T58-Q62 WeakPolarHBondContact O-CG 3.11Å; T58-Q62 PolarHBondContact O-N 3.22Å
59	A	96.9	Very high	90	Very high	6 Å²	6	73 Å²	73	5%	0.05	37%	0.367	C	S	.	.	H	α-helix	trans	-61.8	-40.4	179.1	0	0	0	0	0	111.9	N55 S56 Q62 L63 A83 A86	N55-A59 WeakPolarHBondContact O-CB 3.49Å; N55-A59 PolarHBondContact O-N 2.95Å; S56-A59 PolarHBondContact O-N 2.91Å; A59-Q62 PolarHBondContact O-N 3.05Å; A59-L63 PolarHBondContact O-N 3.29Å; A59-A83 HydrophobicContact CB-CB 4.2Å; A59-A86 HydrophobicContact CB-CB 4.11Å
60	V	96.7	Very high	88.3	Confident	49 Å²	49	75.5 Å²	75.5	30%	0.297	38%	0.377	S	S	.	.	H	α-helix	trans	-66.1	-45.1	174.2	174.8	0	0	0	0	111	S56 A57 T58 Q62 L63 Y64 A83 V87	S56-V60 WeakPolarHBondContact O-CG2 3.39Å; S56-V60 PolarHBondContact O-N 3.03Å; A57-V60 PolarHBondContact O-N 3.32Å; T58-V60 VanDerWaalsContact C-N 3.32Å; T58-V60 PolarHBondContact O-N 3.5Å; V60-Q62 VanDerWaalsContact C-N 3.3Å; V60-Q62 PolarHBondContact O-N 2.88Å; V60-L63 WeakPolarHBondContact O-CB 3.29Å; V60-L63 PolarHBondContact O-N 3.48Å; V60-Y64 HydrophobicContact CG1-CD2 4.08Å; V60-Y64 HydrophobicContact CG1-CE2 3.91Å; V60-Y64 VanDerWaalsContact O-CD2 3.29Å; V60-Y64 WeakPolarHBondContact O-CD2 3.22Å; V60-Y64 PolarHBondContact O-N 3.47Å; V60-A83 HydrophobicContact CG2-CB 4.24Å; V60-V87 HydrophobicContact CG2-CG2 3.95Å
61	A	95.7	Very high	86.5	Confident	48 Å²	48	78 Å²	78	40%	0.397	39%	0.394	S	S	.	.	H	α-helix	trans	-60.5	-40.9	177.7	0	0	0	0	0	111.9	A57 T58 Y64 K65	A57-A61 VanDerWaalsContact O-CB 3.31Å; A57-A61 WeakPolarHBondContact O-CB 3.38Å; A57-A61 PolarHBondContact O-N 2.94Å; T58-A61 PolarHBondContact O-N 2.88Å; A61-Y64 PolarHBondContact O-N 3.45Å; A61-K65 PolarHBondContact O-N 2.94Å
62	Q	91.3	Very high	84.9	Confident	84 Å²	84	79.1 Å²	79.1	39%	0.393	40%	0.4	S	S	.	.	H	α-helix	trans	-65.5	-39.8	176	-67.3	-61.7	1.7	0	0	112.1	T58 A59 V60 Y64 K65 D66	T58-Q62 HydrophobicContact CG2-CG 4.41Å; T58-Q62 WeakPolarHBondContact O-CG 3.11Å; T58-Q62 PolarHBondContact O-N 3.22Å; A59-Q62 PolarHBondContact O-N 3.05Å; V60-Q62 VanDerWaalsContact C-N 3.3Å; V60-Q62 PolarHBondContact O-N 2.88Å; Q62-Y64 PolarHBondContact O-N 3.36Å; Q62-K65 PolarHBondContact O-N 2.89Å; Q62-K65 VanDerWaalsContact O-N 3.13Å; Q62-D66 WeakPolarHBondContact O-CB 3.16Å; Q62-D66 PolarHBondContact O-N 3.35Å
63	L	91.2	Very high	83.5	Confident	14 Å²	14	80.7 Å²	80.7	7%	0.073	43%	0.425	C	S	.	.	H	α-helix	trans	-54.9	-39.8	174.2	178.3	63.2	0	0	0	112.1	A59 V60 R67 P79 F80 A83	A59-L63 PolarHBondContact O-N 3.29Å; V60-L63 WeakPolarHBondContact O-CB 3.29Å; V60-L63 PolarHBondContact O-N 3.48Å; L63-R67 VanDerWaalsContact O-CG 3.31Å; L63-R67 WeakPolarHBondContact O-CG 3.4Å; L63-R67 PolarHBondContact O-N 3.41Å; L63-P79 HydrophobicContact CD1-CB 3.93Å; L63-F80 HydrophobicContact CD1-CB 3.93Å; L63-F80 HydrophobicContact CD2-CD2 4.17Å; L63-A83 HydrophobicContact CB-CB 4.41Å; L63-A83 HydrophobicContact CD2-CB 4.19Å
64	Y	88.8	Confident	82.4	Confident	139 Å²	139	81.5 Å²	81.5	55%	0.545	43%	0.433	S	S	.	.	H	α-helix	trans	-78.8	-31.6	178	-76.5	-79.3	0	0	0	113.7	V60 A61 Q62	V60-Y64 HydrophobicContact CG1-CD2 4.08Å; V60-Y64 HydrophobicContact CG1-CE2 3.91Å; V60-Y64 VanDerWaalsContact O-CD2 3.29Å; V60-Y64 WeakPolarHBondContact O-CD2 3.22Å; V60-Y64 PolarHBondContact O-N 3.47Å; A61-Y64 PolarHBondContact O-N 3.45Å; Q62-Y64 PolarHBondContact O-N 3.36Å
65	K	85.6	Confident	81.7	Confident	131 Å²	131	81.8 Å²	81.8	57%	0.57	44%	0.444	S	S	*	.	H	α-helix	trans	-66	-44.9	171.1	-75	-179.4	177.3	-179.6	0	111.5	A61 Q62 R67 V68	A61-K65 PolarHBondContact O-N 2.94Å; Q62-K65 PolarHBondContact O-N 2.89Å; Q62-K65 VanDerWaalsContact O-N 3.13Å; K65-R67 PolarHBondContact O-N 2.84Å; K65-V68 VanDerWaalsContact O-CB 3.22Å; K65-V68 WeakPolarHBondContact O-CB 3.36Å; K65-V68 WeakPolarHBondContact O-CG2 3.43Å; K65-V68 PolarHBondContact O-N 3.36Å
66	D	73.9	Confident	81.2	Confident	57 Å²	57	79.7 Å²	79.7	31%	0.305	43%	0.432	S	S	.	.	H	α-helix	trans	-72.2	-17.1	-178.9	-71.4	-13.2	0	0	0	113	Q62 V68 C69 H70 L76	Q62-D66 WeakPolarHBondContact O-CB 3.16Å; Q62-D66 PolarHBondContact O-N 3.35Å; D66-V68 PolarHBondContact O-N 3.49Å; D66-C69 CarbonylContact O-C 3.32Å; D66-C69 WeakPolarHBondContact O-CA 3.28Å; D66-C69 WeakPolarHBondContact O-CB 3.45Å; D66-C69 PolarHBondContact O-N 3.48Å; D66-H70 PolarHBondContact O-N 2.95Å; D66-L76 HydrophobicContact CB-CD2 4.25Å
67	R	66.3	Low	80.8	Confident	122 Å²	122	86.5 Å²	86.5	46%	0.46	46%	0.457	S	S	.	.	H	α-helix	trans	-62.7	-30.6	166	-78.9	175.5	-168.5	-155.7	5.6	112.5	L63 K65 C69 H70 L76	L63-R67 VanDerWaalsContact O-CG 3.31Å; L63-R67 WeakPolarHBondContact O-CG 3.4Å; L63-R67 PolarHBondContact O-N 3.41Å; K65-R67 PolarHBondContact O-N 2.84Å; R67-C69 VanDerWaalsContact C-N 3.3Å; R67-H70 WeakPolarHBondContact O-CB 3.35Å; R67-H70 PolarHBondContact O-N 3.23Å; R67-L76 HydrophobicContact CG-CD1 3.83Å; R67-L76 HydrophobicContact CG-CD2 4.01Å
68	V	61.3	Low	80.4	Confident	109 Å²	109	89.1 Å²	89.1	66%	0.661	47%	0.468	S	S	*	.	H	α-helix	trans	-68	-37.9	170.2	-171.9	0	0	0	0	109.6	K65 D66 H70	K65-V68 VanDerWaalsContact O-CB 3.22Å; K65-V68 WeakPolarHBondContact O-CB 3.36Å; K65-V68 WeakPolarHBondContact O-CG2 3.43Å; K65-V68 PolarHBondContact O-N 3.36Å; D66-V68 PolarHBondContact O-N 3.49Å; V68-H70 VanDerWaalsContact C-N 3.34Å; V68-H70 PolarHBondContact O-N 3.33Å
69	C	60.2	Low	80.2	Confident	46 Å²	46	86.6 Å²	86.6	31%	0.311	45%	0.453	S	S	.	.	H	α-helix	trans	-75.2	-14.7	176.3	-52	0	0	0	0	114.3	D66 R67 Q71 Q72	D66-C69 CarbonylContact O-C 3.32Å; D66-C69 WeakPolarHBondContact O-CA 3.28Å; D66-C69 WeakPolarHBondContact O-CB 3.45Å; D66-C69 PolarHBondContact O-N 3.48Å; R67-C69 VanDerWaalsContact C-N 3.3Å; C69-Q71 PolarHBondContact O-N 3.4Å; C69-Q72 VanDerWaalsContact CA-OE1 3.22Å; C69-Q72 WeakPolarHBondContact O-CA 3.34Å; C69-Q72 VanDerWaalsContact O-CB 3.31Å; C69-Q72 WeakPolarHBondContact O-CB 3.42Å; C69-Q72 PolarHBondContact O-N 2.96Å; C69-Q72 PolarHBondContact O-OE1 2.97Å
70	H	61	Low	80	Confident	97 Å²	97	90.9 Å²	90.9	45%	0.449	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-64	-24	176.8	-171.2	58.6	0	0	0	111.7	D66 R67 V68 Q72 G73 L74 L76	D66-H70 PolarHBondContact O-N 2.95Å; R67-H70 WeakPolarHBondContact O-CB 3.35Å; R67-H70 PolarHBondContact O-N 3.23Å; V68-H70 VanDerWaalsContact C-N 3.34Å; V68-H70 PolarHBondContact O-N 3.33Å; H70-Q72 PolarHBondContact O-N 3.39Å; H70-G73 PolarHBondContact O-N 2.88Å; H70-L74 PolarHBondContact ND1-O 3.01Å; H70-L76 HydrophobicContact CB-CD1 3.76Å; H70-L76 HydrophobicContact CB-CD2 4.13Å; H70-L76 HydrophobicContact CB-CG 3.9Å
71	Q	60.5	Low	80	Confident	186 Å²	186	93.3 Å²	93.3	87%	0.869	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-59.5	-20.7	167.2	-76.4	-151.1	-13.4	0	0	113.2	C69	C69-Q71 PolarHBondContact O-N 3.4Å
72	Q	65	Low	80	Confident	141 Å²	141	95.4 Å²	95.4	66%	0.659	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-88.4	7.4	173.1	-76.3	82.1	9.1	0	0	114.5	C69 H70	C69-Q72 VanDerWaalsContact CA-OE1 3.22Å; C69-Q72 WeakPolarHBondContact O-CA 3.34Å; C69-Q72 VanDerWaalsContact O-CB 3.31Å; C69-Q72 WeakPolarHBondContact O-CB 3.42Å; C69-Q72 PolarHBondContact O-N 2.96Å; C69-Q72 PolarHBondContact O-OE1 2.97Å; H70-Q72 PolarHBondContact O-N 3.39Å
73	G	69.8	Low	80.4	Confident	68 Å²	68	91.6 Å²	91.6	70%	0.701	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	11.9	172.4	0	0	0	0	0	115.9	H70	H70-G73 PolarHBondContact O-N 2.88Å
74	L	75	Confident	80.7	Confident	120 Å²	120	92.8 Å²	92.8	63%	0.628	48%	0.478	S	S	*	.			trans	-80.2	140.3	173.6	-64	173.6	0	0	0	111.3	H70 L76	H70-L74 PolarHBondContact ND1-O 3.01Å; L74-L76 PolarHBondContact O-N 3.13Å
75	S	84.5	Confident	81.2	Confident	84 Å²	84	89.3 Å²	89.3	59%	0.587	47%	0.471	S	S	*	.			trans	-71.9	122.4	178.8	179.4	0	0	0	0	111.7	W77	S75-W77 PolarHBondContact O-N 3.26Å; S75-W77 WeakPolarHBondContact OG-CB 3.41Å; S75-W77 PolarHBondContact OG-N 3.02Å
76	L	87.3	Confident	81.8	Confident	40 Å²	40	83.3 Å²	83.3	21%	0.209	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-7.3	174.8	-70.6	172.3	0	0	0	113.7	D66 R67 H70 L74 V78 P79 F80	D66-L76 HydrophobicContact CB-CD2 4.25Å; R67-L76 HydrophobicContact CG-CD1 3.83Å; R67-L76 HydrophobicContact CG-CD2 4.01Å; H70-L76 HydrophobicContact CB-CD1 3.76Å; H70-L76 HydrophobicContact CB-CD2 4.13Å; H70-L76 HydrophobicContact CB-CG 3.9Å; L74-L76 PolarHBondContact O-N 3.13Å; L76-V78 PolarHBondContact O-N 3.4Å; L76-P79 WeakPolarHBondContact O-CD 3.31Å; L76-F80 VanDerWaalsContact O-CB 3.24Å; L76-F80 WeakPolarHBondContact O-CB 3.23Å; L76-F80 PolarHBondContact O-N 3.01Å
77	W	89.9	Confident	83	Confident	153 Å²	153	83.7 Å²	83.7	58%	0.58	45%	0.45	S	S	*	.	H	α-helix	trans	-62.4	-44.1	-175.5	177	-114	0	0	0	112.5	S75 F80 Q81	S75-W77 PolarHBondContact O-N 3.26Å; S75-W77 WeakPolarHBondContact OG-CB 3.41Å; S75-W77 PolarHBondContact OG-N 3.02Å; W77-F80 AromaticContact CE3-CD1 3.77Å; W77-F80 HydrophobicContact CE3-CD1 3.77Å; W77-F80 HydrophobicContact CE3-CE1 4.38Å; W77-F80 HydrophobicContact CH2-CD1 4.26Å; W77-F80 HydrophobicContact CH2-CE1 4.23Å; W77-F80 AromaticContact CZ3-CD1 3.48Å; W77-F80 HydrophobicContact CZ3-CD1 3.48Å; W77-F80 VanDerWaalsContact CZ3-CD1 3.48Å; W77-F80 AromaticContact CZ3-CE1 3.63Å; W77-F80 HydrophobicContact CZ3-CE1 3.63Å; W77-F80 PolarHBondContact O-N 3.23Å; W77-Q81 WeakPolarHBondContact O-CB 3.48Å; W77-Q81 PolarHBondContact O-N 3.43Å
78	V	91	Very high	84.5	Confident	99 Å²	99	82 Å²	82	60%	0.6	45%	0.454	S	S	*	.	H	α-helix	trans	-67.5	-49	-178.3	175.3	0	0	0	0	111.8	L76 F80 Q81 N82	L76-V78 PolarHBondContact O-N 3.4Å; V78-F80 VanDerWaalsContact C-N 3.27Å; V78-F80 PolarHBondContact O-N 3.23Å; V78-Q81 PolarHBondContact O-N 2.91Å; V78-N82 PolarHBondContact O-N 3.29Å
79	P	91.8	Very high	86.2	Confident	25 Å²	25	80.6 Å²	80.6	16%	0.162	44%	0.442	C	S	.	.	H	α-helix	trans	-57.6	-38.3	172.3	-27.1	34.8	0	0	0	113.4	L63 L76 N82 A83	L63-P79 HydrophobicContact CD1-CB 3.93Å; L76-P79 WeakPolarHBondContact O-CD 3.31Å; P79-N82 PolarHBondContact O-N 2.96Å; P79-A83 WeakPolarHBondContact O-CB 3.41Å; P79-A83 PolarHBondContact O-N 3.31Å
80	F	94.2	Very high	88.1	Confident	97 Å²	97	80 Å²	80	43%	0.425	44%	0.436	S	S	.	.	H	α-helix	trans	-64.5	-48.5	177.5	169.9	-98.2	0	0	0	111.4	L63 L76 W77 V78 N82 A83 A84	L63-F80 HydrophobicContact CD1-CB 3.93Å; L63-F80 HydrophobicContact CD2-CD2 4.17Å; L76-F80 VanDerWaalsContact O-CB 3.24Å; L76-F80 WeakPolarHBondContact O-CB 3.23Å; L76-F80 PolarHBondContact O-N 3.01Å; W77-F80 AromaticContact CE3-CD1 3.77Å; W77-F80 HydrophobicContact CE3-CD1 3.77Å; W77-F80 HydrophobicContact CE3-CE1 4.38Å; W77-F80 HydrophobicContact CH2-CD1 4.26Å; W77-F80 HydrophobicContact CH2-CE1 4.23Å; W77-F80 AromaticContact CZ3-CD1 3.48Å; W77-F80 HydrophobicContact CZ3-CD1 3.48Å; W77-F80 VanDerWaalsContact CZ3-CD1 3.48Å; W77-F80 AromaticContact CZ3-CE1 3.63Å; W77-F80 HydrophobicContact CZ3-CE1 3.63Å; W77-F80 PolarHBondContact O-N 3.23Å; V78-F80 VanDerWaalsContact C-N 3.27Å; V78-F80 PolarHBondContact O-N 3.23Å; F80-N82 VanDerWaalsContact C-N 3.29Å; F80-N82 PolarHBondContact O-N 2.86Å; F80-A83 PolarHBondContact O-N 3.46Å; F80-A84 WeakPolarHBondContact O-CB 3.46Å; F80-A84 PolarHBondContact O-N 2.88Å
81	Q	96.4	Very high	89.9	Confident	99 Å²	99	83.1 Å²	83.1	46%	0.463	45%	0.445	S	S	.	.	H	α-helix	trans	-59.7	-41.9	178.2	-176.8	-179.2	-24	0	0	111.2	W77 V78 T85	W77-Q81 WeakPolarHBondContact O-CB 3.48Å; W77-Q81 PolarHBondContact O-N 3.43Å; V78-Q81 PolarHBondContact O-N 2.91Å; Q81-T85 WeakPolarHBondContact O-CB 3.32Å; Q81-T85 PolarHBondContact O-N 2.92Å; Q81-T85 PolarHBondContact O-OG1 3.37Å
82	N	95.9	Very high	91.6	Very high	92 Å²	92	79.9 Å²	79.9	49%	0.492	43%	0.428	S	S	.	.	H	α-helix	trans	-62.3	-48.2	176.4	-175.1	39.5	0	0	0	111.8	V78 P79 F80 A84 T85 A86	V78-N82 PolarHBondContact O-N 3.29Å; P79-N82 PolarHBondContact O-N 2.96Å; F80-N82 VanDerWaalsContact C-N 3.29Å; F80-N82 PolarHBondContact O-N 2.86Å; N82-A84 PolarHBondContact O-N 3.32Å; N82-T85 PolarHBondContact O-N 3.05Å; N82-A86 WeakPolarHBondContact O-CB 3.27Å; N82-A86 PolarHBondContact O-N 3Å
83	A	98.1	Very high	93.2	Very high	4 Å²	4	75.2 Å²	75.2	3%	0.033	41%	0.406	C	S	.	.	H	α-helix	trans	-60.6	-46.9	177.4	0	0	0	0	0	112	A59 V60 L63 P79 F80 T85 A86 V87	A59-A83 HydrophobicContact CB-CB 4.2Å; V60-A83 HydrophobicContact CG2-CB 4.24Å; L63-A83 HydrophobicContact CB-CB 4.41Å; L63-A83 HydrophobicContact CD2-CB 4.19Å; P79-A83 WeakPolarHBondContact O-CB 3.41Å; P79-A83 PolarHBondContact O-N 3.31Å; F80-A83 PolarHBondContact O-N 3.46Å; A83-T85 VanDerWaalsContact C-N 3.33Å; A83-T85 PolarHBondContact O-N 3.41Å; A83-A86 PolarHBondContact O-N 2.91Å; A83-V87 VanDerWaalsContact O-CG2 3.28Å; A83-V87 WeakPolarHBondContact O-CG2 3.34Å; A83-V87 PolarHBondContact O-N 2.74Å
84	A	98.3	Very high	94.5	Very high	39 Å²	39	74.7 Å²	74.7	32%	0.322	39%	0.392	S	S	.	.	H	α-helix	trans	-60.8	-42.3	177.7	0	0	0	0	0	112	F80 N82 T88	F80-A84 WeakPolarHBondContact O-CB 3.46Å; F80-A84 PolarHBondContact O-N 2.88Å; N82-A84 PolarHBondContact O-N 3.32Å; A84-T88 WeakPolarHBondContact O-CB 2.86Å; A84-T88 PolarHBondContact O-N 3.45Å; A84-T88 PolarHBondContact O-OG1 3.45Å
85	T	98.5	Very high	95.6	Very high	66 Å²	66	72.4 Å²	72.4	41%	0.405	38%	0.383	S	S	.	.	H	α-helix	trans	-63.9	-46.2	177	-56.7	0	0	0	0	111.1	Q81 N82 A83 V87 T88 N89	Q81-T85 WeakPolarHBondContact O-CB 3.32Å; Q81-T85 PolarHBondContact O-N 2.92Å; Q81-T85 PolarHBondContact O-OG1 3.37Å; N82-T85 PolarHBondContact O-N 3.05Å; A83-T85 VanDerWaalsContact C-N 3.33Å; A83-T85 PolarHBondContact O-N 3.41Å; T85-V87 PolarHBondContact O-N 3.39Å; T85-T88 PolarHBondContact O-N 2.85Å; T85-N89 WeakPolarHBondContact O-CB 3.44Å; T85-N89 VanDerWaalsContact O-CG 3.24Å; T85-N89 PolarHBondContact O-N 3.08Å; T85-N89 PolarHBondContact O-ND2 2.96Å
86	A	98.6	Very high	96.1	Very high	6 Å²	6	72.2 Å²	72.2	5%	0.05	37%	0.372	C	S	.	.	H	α-helix	trans	-63.2	-42.3	179.7	0	0	0	0	0	112.4	A59 N82 A83 L90	A59-A86 HydrophobicContact CB-CB 4.11Å; N82-A86 WeakPolarHBondContact O-CB 3.27Å; N82-A86 PolarHBondContact O-N 3Å; A83-A86 PolarHBondContact O-N 2.91Å; A86-L90 WeakPolarHBondContact O-CB 3.39Å; A86-L90 PolarHBondContact O-N 2.99Å
87	V	98.7	Very high	96.5	Very high	64 Å²	64	70.7 Å²	70.7	39%	0.388	37%	0.366	S	S	.	.	H	α-helix	trans	-64.1	-43.4	174.7	174.4	0	0	0	0	111.4	S56 V60 A83 T85 N89 L90 Y91	S56-V87 WeakPolarHBondContact OG-CA 3.47Å; S56-V87 WeakPolarHBondContact OG-CG2 3.28Å; V60-V87 HydrophobicContact CG2-CG2 3.95Å; A83-V87 VanDerWaalsContact O-CG2 3.28Å; A83-V87 WeakPolarHBondContact O-CG2 3.34Å; A83-V87 PolarHBondContact O-N 2.74Å; T85-V87 PolarHBondContact O-N 3.39Å; V87-N89 PolarHBondContact O-N 3.45Å; V87-L90 PolarHBondContact O-N 2.98Å; V87-Y91 PolarHBondContact O-N 2.95Å
88	T	98.5	Very high	96.6	Very high	87 Å²	87	69.6 Å²	69.6	53%	0.534	37%	0.367	S	S	.	.	H	α-helix	trans	-63.9	-42.8	179.7	-56.5	0	0	0	0	111.4	A84 T85 Y91 K92	A84-T88 WeakPolarHBondContact O-CB 2.86Å; A84-T88 PolarHBondContact O-N 3.45Å; A84-T88 PolarHBondContact O-OG1 3.45Å; T85-T88 PolarHBondContact O-N 2.85Å; T88-Y91 PolarHBondContact O-N 3.16Å; T88-K92 WeakPolarHBondContact O-CB 3.4Å; T88-K92 PolarHBondContact O-N 3.32Å
89	N	98.3	Very high	96.8	Very high	79 Å²	79	69.8 Å²	69.8	42%	0.422	36%	0.361	S	S	.	.	H	α-helix	trans	-63.6	-45	176.5	-71.4	-13.8	0	0	0	111.5	T85 V87 Y91 K92 E93	T85-N89 WeakPolarHBondContact O-CB 3.44Å; T85-N89 VanDerWaalsContact O-CG 3.24Å; T85-N89 PolarHBondContact O-N 3.08Å; T85-N89 PolarHBondContact O-ND2 2.96Å; V87-N89 PolarHBondContact O-N 3.45Å; N89-Y91 VanDerWaalsContact C-N 3.34Å; N89-Y91 PolarHBondContact O-N 2.87Å; N89-K92 PolarHBondContact O-N 2.99Å; N89-E93 WeakPolarHBondContact O-CB 3.33Å; N89-E93 VanDerWaalsContact O-CG 3.28Å; N89-E93 WeakPolarHBondContact O-CG 3.41Å; N89-E93 PolarHBondContact O-N 3.32Å
90	L	98.4	Very high	96.9	Very high	35 Å²	35	72.8 Å²	72.8	18%	0.183	37%	0.369	C	S	.	.	H	α-helix	trans	-57.6	-46.8	174.9	173.1	62.9	0	0	0	111.6	L52 F53 A86 V87 S94	L52-L90 HydrophobicContact CB-CB 4.42Å; L52-L90 HydrophobicContact CB-CD1 3.78Å; F53-L90 HydrophobicContact CB-CD1 4.23Å; F53-L90 HydrophobicContact CB-CD2 4.35Å; F53-L90 HydrophobicContact CD2-CD2 4.31Å; A86-L90 WeakPolarHBondContact O-CB 3.39Å; A86-L90 PolarHBondContact O-N 2.99Å; V87-L90 PolarHBondContact O-N 2.98Å; L90-S94 VanDerWaalsContact O-CB 3.23Å; L90-S94 WeakPolarHBondContact O-CB 3.41Å; L90-S94 PolarHBondContact O-N 2.64Å
91	Y	98.4	Very high	96.8	Very high	162 Å²	162	71.8 Å²	71.8	64%	0.635	38%	0.375	S	S	*	.	H	α-helix	trans	-60.3	-50.3	179.2	174.4	-101.8	0	0	0	111.6	V87 T88 N89 E93 S94 V95	V87-Y91 PolarHBondContact O-N 2.95Å; T88-Y91 PolarHBondContact O-N 3.16Å; N89-Y91 VanDerWaalsContact C-N 3.34Å; N89-Y91 PolarHBondContact O-N 2.87Å; Y91-E93 PolarHBondContact O-N 3.39Å; Y91-S94 PolarHBondContact O-N 3.39Å; Y91-V95 HydrophobicContact CD2-CG2 4.46Å; Y91-V95 HydrophobicContact CE1-CG2 4.23Å; Y91-V95 HydrophobicContact CE2-CG2 4.02Å; Y91-V95 WeakPolarHBondContact O-CG2 3.21Å; Y91-V95 PolarHBondContact O-N 2.91Å
92	K	98.1	Very high	96.7	Very high	118 Å²	118	69.7 Å²	69.7	51%	0.513	37%	0.37	S	S	.	.	H	α-helix	trans	-57.5	-51.8	179.4	-179.3	-177	170.5	-173	0	111.5	T88 N89 S94 V95 E96	T88-K92 WeakPolarHBondContact O-CB 3.4Å; T88-K92 PolarHBondContact O-N 3.32Å; N89-K92 PolarHBondContact O-N 2.99Å; K92-S94 VanDerWaalsContact C-N 3.3Å; K92-S94 PolarHBondContact O-N 3.49Å; K92-V95 PolarHBondContact O-N 3.45Å; K92-E96 WeakPolarHBondContact CE-OE1 3.44Å; K92-E96 IonicContact NZ-OE1 3.46Å; K92-E96 WeakPolarHBondContact O-CG 3.4Å; K92-E96 PolarHBondContact O-N 3.47Å
93	E	97.6	Very high	96.5	Very high	43 Å²	43	68.6 Å²	68.6	20%	0.201	36%	0.364	C	S	.	.	H	α-helix	trans	-64.4	-35.5	-178.9	-71.5	-78.1	-178	0	0	111.9	K48 L49 L52 N89 Y91 E96 A97	K48-E93 WeakPolarHBondContact CE-OE2 3.34Å; K48-E93 IonicContact NZ-OE1 2.71Å; K48-E93 PolarHBondContact NZ-OE1 3.31Å; K48-E93 IonicContact NZ-OE2 3.43Å; K48-E93 PolarHBondContact NZ-OE2 3.26Å; L49-E93 HydrophobicContact CD2-CB 4.16Å; L52-E93 HydrophobicContact CD1-CB 3.54Å; L52-E93 HydrophobicContact CD1-CG 3.63Å; N89-E93 WeakPolarHBondContact O-CB 3.33Å; N89-E93 VanDerWaalsContact O-CG 3.28Å; N89-E93 WeakPolarHBondContact O-CG 3.41Å; N89-E93 PolarHBondContact O-N 3.32Å; Y91-E93 PolarHBondContact O-N 3.39Å; E93-E96 PolarHBondContact O-N 2.88Å; E93-A97 WeakPolarHBondContact O-CB 3.29Å; E93-A97 PolarHBondContact O-N 3.26Å
94	S	97.1	Very high	96.1	Very high	56 Å²	56	71 Å²	71	39%	0.392	37%	0.373	S	S	.	.	H	α-helix	trans	-64.2	-41.3	174.9	-179.1	0	0	0	0	112.4	L90 Y91 K92 H98	L90-S94 VanDerWaalsContact O-CB 3.23Å; L90-S94 WeakPolarHBondContact O-CB 3.41Å; L90-S94 PolarHBondContact O-N 2.64Å; Y91-S94 PolarHBondContact O-N 3.39Å; K92-S94 VanDerWaalsContact C-N 3.3Å; K92-S94 PolarHBondContact O-N 3.49Å; S94-H98 WeakPolarHBondContact O-CB 3.48Å; S94-H98 PolarHBondContact O-N 3.43Å
95	V	97.4	Very high	95.7	Very high	73 Å²	73	71.2 Å²	71.2	44%	0.442	38%	0.378	S	S	.	.	H	α-helix	trans	-67.5	-44.8	177.5	173	0	0	0	0	110.3	Y91 K92 H98 Q99	Y91-V95 HydrophobicContact CD2-CG2 4.46Å; Y91-V95 HydrophobicContact CE1-CG2 4.23Å; Y91-V95 HydrophobicContact CE2-CG2 4.02Å; Y91-V95 WeakPolarHBondContact O-CG2 3.21Å; Y91-V95 PolarHBondContact O-N 2.91Å; K92-V95 PolarHBondContact O-N 3.45Å; V95-H98 PolarHBondContact O-N 3.16Å; V95-Q99 PolarHBondContact O-N 3.43Å
96	E	95.9	Very high	95.5	Very high	79 Å²	79	72.7 Å²	72.7	37%	0.369	38%	0.382	S	S	.	.	H	α-helix	trans	-64.2	-41.5	178.6	-71.9	176.1	-175.9	0	0	112.1	K92 E93 Q99 R100	K92-E96 WeakPolarHBondContact CE-OE1 3.44Å; K92-E96 IonicContact NZ-OE1 3.46Å; K92-E96 WeakPolarHBondContact O-CG 3.4Å; K92-E96 PolarHBondContact O-N 3.47Å; E93-E96 PolarHBondContact O-N 2.88Å; E96-Q99 PolarHBondContact O-N 2.73Å; E96-R100 WeakPolarHBondContact O-CG 3.39Å; E96-R100 PolarHBondContact O-N 2.92Å; E96-R100 PolarHBondContact O-NE 2.98Å
97	A	95.1	Very high	95.1	Very high	8 Å²	8	77.4 Å²	77.4	7%	0.066	40%	0.403	C	S	.	.	H	α-helix	trans	-64.9	-40.5	174.7	0	0	0	0	0	112.2	L49 E93 R100 S101	L49-A97 HydrophobicContact CD1-CB 3.69Å; L49-A97 HydrophobicContact CD2-CB 4.38Å; L49-A97 HydrophobicContact CG-CB 4.27Å; E93-A97 WeakPolarHBondContact O-CB 3.29Å; E93-A97 PolarHBondContact O-N 3.26Å; A97-R100 PolarHBondContact O-N 3.43Å; A97-S101 WeakPolarHBondContact O-CB 3.41Å; A97-S101 PolarHBondContact O-N 3.34Å
98	H	93.3	Very high	94.7	Very high	130 Å²	130	78.5 Å²	78.5	60%	0.602	41%	0.406	S	S	*	.	H	α-helix	trans	-62.7	-44.6	176.1	-169.4	72.2	0	0	0	111.7	S94 V95 S101 C102	S94-H98 WeakPolarHBondContact O-CB 3.48Å; S94-H98 PolarHBondContact O-N 3.43Å; V95-H98 PolarHBondContact O-N 3.16Å; H98-S101 WeakPolarHBondContact O-CB 3.35Å; H98-S101 PolarHBondContact O-N 2.98Å; H98-C102 PolarHBondContact O-N 2.88Å; H98-C102 PolarHBondContact O-SG 2.99Å; H98-C102 VanDerWaalsContact O-SG 3.4Å
99	Q	95.2	Very high	94.4	Very high	104 Å²	104	76.3 Å²	76.3	49%	0.486	40%	0.401	S	S	.	.	H	α-helix	trans	-60	-48.1	176	-178.3	58.2	51.6	0	0	111.6	V95 E96 S101 C102 D103	V95-Q99 PolarHBondContact O-N 3.43Å; E96-Q99 PolarHBondContact O-N 2.73Å; Q99-S101 VanDerWaalsContact C-N 3.28Å; Q99-S101 PolarHBondContact O-N 2.69Å; Q99-C102 WeakPolarHBondContact O-CB 3.37Å; Q99-C102 PolarHBondContact O-N 3.32Å; Q99-C102 VanDerWaalsContact O-N 3.16Å; Q99-D103 VanDerWaalsContact NE2-CG 3.34Å; Q99-D103 PolarHBondContact NE2-OD1 3.11Å; Q99-D103 VanDerWaalsContact NE2-OD1 3.08Å; Q99-D103 PolarHBondContact NE2-OD2 2.95Å; Q99-D103 PolarHBondContact O-N 2.75Å
100	R	93.6	Very high	94.1	Very high	87 Å²	87	76.7 Å²	76.7	33%	0.328	40%	0.4	S	S	.	.	H	α-helix	trans	-61.1	-37.7	177	-72.5	-177	-64.5	120.3	-0.4	112.1	D45 E96 A97 D103 R104	D45-R100 VanDerWaalsContact CG-NH2 3.3Å; D45-R100 IonicContact OD1-CZ 3.8Å; D45-R100 IonicContact OD1-NH1 3.5Å; D45-R100 PolarHBondContact OD1-NH1 3.31Å; D45-R100 IonicContact OD1-NH2 2.64Å; D45-R100 PolarHBondContact OD1-NH2 3.01Å; D45-R100 IonicContact OD2-CZ 3.86Å; D45-R100 IonicContact OD2-NH1 2.75Å; D45-R100 PolarHBondContact OD2-NH1 2.9Å; D45-R100 IonicContact OD2-NH2 3.89Å; D45-R100 PolarHBondContact OD2-NH2 3.17Å; E96-R100 WeakPolarHBondContact O-CG 3.39Å; E96-R100 PolarHBondContact O-N 2.92Å; E96-R100 PolarHBondContact O-NE 2.98Å; A97-R100 PolarHBondContact O-N 3.43Å; R100-D103 PolarHBondContact O-N 3.46Å; R100-R104 VanDerWaalsContact O-CB 3.26Å; R100-R104 WeakPolarHBondContact O-CB 3.29Å; R100-R104 PolarHBondContact O-N 3.39Å
101	S	91.9	Very high	93.6	Very high	77 Å²	77	77.9 Å²	77.9	54%	0.538	40%	0.404	S	S	.	.	H	α-helix	trans	-62.8	-44.6	174	-175.2	0	0	0	0	112.1	A97 H98 Q99 R104 G105	A97-S101 WeakPolarHBondContact O-CB 3.41Å; A97-S101 PolarHBondContact O-N 3.34Å; H98-S101 WeakPolarHBondContact O-CB 3.35Å; H98-S101 PolarHBondContact O-N 2.98Å; Q99-S101 VanDerWaalsContact C-N 3.28Å; Q99-S101 PolarHBondContact O-N 2.69Å; S101-R104 PolarHBondContact O-N 3.01Å; S101-G105 PolarHBondContact O-N 3.16Å
102	C	93.1	Very high	93.3	Very high	55 Å²	55	78.8 Å²	78.8	37%	0.372	41%	0.407	S	S	.	.	H	α-helix	trans	-61.3	-46.8	175	-68.7	0	0	0	0	112.1	H98 Q99 R104 G105 I106	H98-C102 PolarHBondContact O-N 2.88Å; H98-C102 PolarHBondContact O-SG 2.99Å; H98-C102 VanDerWaalsContact O-SG 3.4Å; Q99-C102 WeakPolarHBondContact O-CB 3.37Å; Q99-C102 PolarHBondContact O-N 3.32Å; Q99-C102 VanDerWaalsContact O-N 3.16Å; C102-R104 VanDerWaalsContact C-N 3.32Å; C102-R104 PolarHBondContact O-N 3.43Å; C102-G105 PolarHBondContact O-N 3.41Å; C102-G105 VanDerWaalsContact O-N 3.16Å; C102-I106 WeakPolarHBondContact O-CG1 3.37Å; C102-I106 PolarHBondContact O-N 3.31Å
103	D	93	Very high	92.9	Very high	68 Å²	68	79.5 Å²	79.5	36%	0.364	41%	0.406	S	S	.	.	H	α-helix	trans	-62.9	-40.6	179.2	-67.6	-29.9	0	0	0	111.3	Q99 R100 I106 Q107	Q99-D103 VanDerWaalsContact NE2-CG 3.34Å; Q99-D103 PolarHBondContact NE2-OD1 3.11Å; Q99-D103 VanDerWaalsContact NE2-OD1 3.08Å; Q99-D103 PolarHBondContact NE2-OD2 2.95Å; Q99-D103 PolarHBondContact O-N 2.75Å; R100-D103 PolarHBondContact O-N 3.46Å; D103-I106 WeakPolarHBondContact O-CB 3.46Å; D103-I106 PolarHBondContact O-N 3.07Å; D103-Q107 WeakPolarHBondContact O-CG 3.37Å; D103-Q107 PolarHBondContact O-N 3.47Å
104	R	88.5	Confident	92.5	Very high	56 Å²	56	81 Å²	81	21%	0.211	42%	0.416	C	S	.	.	H	α-helix	trans	-63.8	-40.9	173.3	-177.2	153.7	-78.5	-80.2	10.6	111.8	E41 R100 S101 C102 I106 Q107 I108	E41-R104 IonicContact OE2-CZ 3.43Å; E41-R104 IonicContact OE2-NE 2.95Å; E41-R104 PolarHBondContact OE2-NE 3.23Å; E41-R104 IonicContact OE2-NH2 2.73Å; E41-R104 PolarHBondContact OE2-NH2 3.16Å; R100-R104 VanDerWaalsContact O-CB 3.26Å; R100-R104 WeakPolarHBondContact O-CB 3.29Å; R100-R104 PolarHBondContact O-N 3.39Å; S101-R104 PolarHBondContact O-N 3.01Å; C102-R104 VanDerWaalsContact C-N 3.32Å; C102-R104 PolarHBondContact O-N 3.43Å; R104-I106 VanDerWaalsContact C-N 3.32Å; R104-I106 PolarHBondContact O-N 3.39Å; R104-Q107 PolarHBondContact O-N 3.24Å; R104-I108 HydrophobicContact CG-CD1 3.95Å; R104-I108 HydrophobicContact CG-CG1 4.43Å; R104-I108 VanDerWaalsContact O-CG1 3.3Å; R104-I108 WeakPolarHBondContact O-CG1 3.46Å; R104-I108 PolarHBondContact O-N 2.81Å
105	G	91.2	Very high	92.1	Very high	42 Å²	42	85.8 Å²	85.8	43%	0.433	43%	0.429	S	S	.	.	H	α-helix	trans	-58.8	-41	173.1	0	0	0	0	0	113	S101 C102 G109	S101-G105 PolarHBondContact O-N 3.16Å; C102-G105 PolarHBondContact O-N 3.41Å; C102-G105 VanDerWaalsContact O-N 3.16Å; G105-G109 PolarHBondContact O-N 2.91Å
106	I	94.1	Very high	91.7	Very high	97 Å²	97	87.1 Å²	87.1	50%	0.497	43%	0.434	S	S	.	.	H	α-helix	trans	-62.8	-45.7	174.1	-68.5	166.9	0	0	0	110.7	C102 D103 R104 G109 H110	C102-I106 WeakPolarHBondContact O-CG1 3.37Å; C102-I106 PolarHBondContact O-N 3.31Å; D103-I106 WeakPolarHBondContact O-CB 3.46Å; D103-I106 PolarHBondContact O-N 3.07Å; R104-I106 VanDerWaalsContact C-N 3.32Å; R104-I106 PolarHBondContact O-N 3.39Å; I106-G109 PolarHBondContact O-N 3.18Å; I106-H110 PolarHBondContact O-CD2 3.3Å; I106-H110 VanDerWaalsContact O-CD2 3.23Å; I106-H110 PolarHBondContact O-N 3.37Å
107	Q	90.4	Very high	91.3	Very high	105 Å²	105	87.9 Å²	87.9	49%	0.491	44%	0.439	S	S	.	.	H	α-helix	trans	-62.3	-46	178.1	-70.4	175.7	5.9	0	0	112.1	D103 R104 G109 H110 Q111	D103-Q107 WeakPolarHBondContact O-CG 3.37Å; D103-Q107 PolarHBondContact O-N 3.47Å; R104-Q107 PolarHBondContact O-N 3.24Å; Q107-G109 VanDerWaalsContact C-N 3.28Å; Q107-G109 PolarHBondContact O-N 3.41Å; Q107-H110 WeakPolarHBondContact O-CB 3.29Å; Q107-H110 PolarHBondContact O-N 3.12Å; Q107-H110 VanDerWaalsContact O-N 3.16Å; Q107-Q111 WeakPolarHBondContact O-CB 3.26Å; Q107-Q111 PolarHBondContact O-N 2.86Å
108	I	90.3	Very high	91	Very high	88 Å²	88	90.3 Å²	90.3	45%	0.451	45%	0.451	S	S	.	.	H	α-helix	trans	-59	-42.4	174.8	-68.5	166.2	0	0	0	110.3	R104 Q111 R112	R104-I108 HydrophobicContact CG-CD1 3.95Å; R104-I108 HydrophobicContact CG-CG1 4.43Å; R104-I108 VanDerWaalsContact O-CG1 3.3Å; R104-I108 WeakPolarHBondContact O-CG1 3.46Å; R104-I108 PolarHBondContact O-N 2.81Å; I108-Q111 PolarHBondContact O-N 3.24Å; I108-R112 WeakPolarHBondContact O-CB 3.29Å; I108-R112 PolarHBondContact O-N 2.98Å
109	G	91.8	Very high	90.7	Very high	41 Å²	41	86.6 Å²	86.6	42%	0.423	44%	0.442	S	S	.	.	H	α-helix	trans	-60.3	-44.9	175.1	0	0	0	0	0	112.8	G105 I106 Q107 R113	G105-G109 PolarHBondContact O-N 2.91Å; I106-G109 PolarHBondContact O-N 3.18Å; Q107-G109 VanDerWaalsContact C-N 3.28Å; Q107-G109 PolarHBondContact O-N 3.41Å; G109-R113 WeakPolarHBondContact O-CB 3.32Å; G109-R113 PolarHBondContact O-N 3.46Å
110	H	91.3	Very high	90.3	Very high	86 Å²	86	85.1 Å²	85.1	40%	0.398	43%	0.432	S	S	.	.	H	α-helix	trans	-62.6	-44.9	174	-77.1	-53.5	0	0	0	112.2	I106 Q107 R113 N114	I106-H110 PolarHBondContact O-CD2 3.3Å; I106-H110 VanDerWaalsContact O-CD2 3.23Å; I106-H110 PolarHBondContact O-N 3.37Å; Q107-H110 WeakPolarHBondContact O-CB 3.29Å; Q107-H110 PolarHBondContact O-N 3.12Å; Q107-H110 VanDerWaalsContact O-N 3.16Å; H110-R113 PolarHBondContact ND1-NH1 3.47Å; H110-R113 PolarHBondContact ND1-NH2 2.71Å; H110-R113 PolarHBondContact O-N 3.19Å; H110-N114 VanDerWaalsContact O-CB 3.25Å; H110-N114 WeakPolarHBondContact O-CB 3.48Å; H110-N114 PolarHBondContact O-N 3.23Å; H110-N114 PolarHBondContact O-OD1 3.46Å
111	Q	89.5	Confident	89.9	Confident	60 Å²	60	83.4 Å²	83.4	28%	0.28	43%	0.431	S	S	.	.	H	α-helix	trans	-62.4	-46	179.1	-170.1	-176.4	8.5	0	0	111	M35 Q107 I108 N114 K115	M35-Q111 PolarHBondContact O-NE2 3.25Å; M35-Q111 VanDerWaalsContact O-NE2 3.15Å; Q107-Q111 WeakPolarHBondContact O-CB 3.26Å; Q107-Q111 PolarHBondContact O-N 2.86Å; I108-Q111 PolarHBondContact O-N 3.24Å; Q111-N114 PolarHBondContact O-N 2.66Å; Q111-K115 WeakPolarHBondContact O-CB 3.29Å; Q111-K115 PolarHBondContact O-N 3.19Å
112	R	90.3	Very high	89.6	Confident	182 Å²	182	82.3 Å²	82.3	69%	0.687	42%	0.417	S	S	*	.	H	α-helix	trans	-61.5	-49.2	177.1	-172.4	172.8	-172.8	175.1	4.9	111.9	I108 N114 K115 D116	I108-R112 WeakPolarHBondContact O-CB 3.29Å; I108-R112 PolarHBondContact O-N 2.98Å; R112-N114 VanDerWaalsContact C-N 3.32Å; R112-N114 PolarHBondContact O-N 3.05Å; R112-K115 WeakPolarHBondContact O-CB 3.46Å; R112-K115 PolarHBondContact O-N 3.35Å; R112-D116 PolarHBondContact O-N 3.06Å
113	R	90.9	Very high	89.2	Confident	132 Å²	132	85.9 Å²	85.9	50%	0.498	43%	0.426	S	S	.	.	H	α-helix	trans	-57.6	-46.1	175.2	-178.7	-160.4	67.7	-167.9	-1.5	111.2	G109 H110 D116 M117	G109-R113 WeakPolarHBondContact O-CB 3.32Å; G109-R113 PolarHBondContact O-N 3.46Å; H110-R113 PolarHBondContact ND1-NH1 3.47Å; H110-R113 PolarHBondContact ND1-NH2 2.71Å; H110-R113 PolarHBondContact O-N 3.19Å; R113-D116 PolarHBondContact O-N 3.36Å; R113-M117 WeakPolarHBondContact O-CB 3.45Å; R113-M117 VanDerWaalsContact O-CG 3.31Å; R113-M117 WeakPolarHBondContact O-CG 3.36Å; R113-M117 PolarHBondContact O-N 3.31Å
114	N	89.4	Confident	88.5	Confident	75 Å²	75	91.8 Å²	91.8	40%	0.401	44%	0.443	S	S	.	.	H	α-helix	trans	-64.1	-42.2	-179.8	-70.6	-0.5	0	0	0	110.7	H110 Q111 R112 D116 M117 L118	H110-N114 VanDerWaalsContact O-CB 3.25Å; H110-N114 WeakPolarHBondContact O-CB 3.48Å; H110-N114 PolarHBondContact O-N 3.23Å; H110-N114 PolarHBondContact O-OD1 3.46Å; Q111-N114 PolarHBondContact O-N 2.66Å; R112-N114 VanDerWaalsContact C-N 3.32Å; R112-N114 PolarHBondContact O-N 3.05Å; N114-D116 PolarHBondContact O-N 3.45Å; N114-M117 PolarHBondContact O-N 3.43Å; N114-L118 WeakPolarHBondContact O-CB 3.4Å; N114-L118 VanDerWaalsContact O-CG 3.24Å; N114-L118 WeakPolarHBondContact O-CG 3.3Å; N114-L118 PolarHBondContact O-N 3.47Å
115	K	88.7	Confident	88	Confident	156 Å²	156	98.7 Å²	98.7	68%	0.678	47%	0.469	S	S	*	.	H	α-helix	trans	-58.4	-45.6	175.3	-173	174	-176.8	169.5	0	112	Q111 R112 L118 A119	Q111-K115 WeakPolarHBondContact O-CB 3.29Å; Q111-K115 PolarHBondContact O-N 3.19Å; R112-K115 WeakPolarHBondContact O-CB 3.46Å; R112-K115 PolarHBondContact O-N 3.35Å; K115-L118 PolarHBondContact O-N 2.98Å; K115-A119 WeakPolarHBondContact O-CB 3.32Å; K115-A119 PolarHBondContact O-N 2.84Å
116	D	88.5	Confident	87.7	Confident	102 Å²	102	103.7 Å²	103.7	55%	0.545	48%	0.475	S	S	.	.	H	α-helix	trans	-64.8	-41.3	177.5	-69.8	-19.6	0	0	0	112	R112 R113 N114 A119 W120	R112-D116 PolarHBondContact O-N 3.06Å; R113-D116 PolarHBondContact O-N 3.36Å; N114-D116 PolarHBondContact O-N 3.45Å; D116-A119 PolarHBondContact O-N 2.8Å; D116-W120 PolarHBondContact O-N 3.12Å
117	M	88.1	Confident	87.4	Confident	94 Å²	94	105.2 Å²	105.2	46%	0.463	49%	0.489	S	S	.	.	H	α-helix	trans	-64.4	-44.1	175.6	-74.1	-58.2	-54.8	0	0	112	R113 N114 W120 V121	R113-M117 WeakPolarHBondContact O-CB 3.45Å; R113-M117 VanDerWaalsContact O-CG 3.31Å; R113-M117 WeakPolarHBondContact O-CG 3.36Å; R113-M117 PolarHBondContact O-N 3.31Å; N114-M117 PolarHBondContact O-N 3.43Å; M117-W120 HydrophobicContact CE-CE3 3.6Å; M117-W120 HydrophobicContact CE-CZ3 3.76Å; M117-W120 WeakPolarHBondContact O-CB 3.39Å; M117-W120 PolarHBondContact O-N 3.01Å; M117-V121 WeakPolarHBondContact O-CG2 3.34Å; M117-V121 PolarHBondContact O-N 3.3Å
118	L	87.1	Confident	87.2	Confident	60 Å²	60	104.2 Å²	104.2	31%	0.314	49%	0.486	S	S	.	.	H	α-helix	trans	-63.2	-43.5	175.8	-70.8	177.2	0	0	0	110.7	L29 A32 N114 K115 W120 V121 K122	L29-L118 HydrophobicContact CD2-CB 4.26Å; L29-L118 HydrophobicContact CD2-CD1 4Å; L29-L118 HydrophobicContact CD2-CD2 3.67Å; L29-L118 HydrophobicContact CD2-CG 4.17Å; A32-L118 HydrophobicContact CB-CD1 3.85Å; N114-L118 WeakPolarHBondContact O-CB 3.4Å; N114-L118 VanDerWaalsContact O-CG 3.24Å; N114-L118 WeakPolarHBondContact O-CG 3.3Å; N114-L118 PolarHBondContact O-N 3.47Å; K115-L118 PolarHBondContact O-N 2.98Å; L118-W120 VanDerWaalsContact C-N 3.27Å; L118-W120 PolarHBondContact O-N 3.39Å; L118-V121 PolarHBondContact O-N 3.02Å; L118-K122 WeakPolarHBondContact O-CG 3.34Å; L118-K122 PolarHBondContact O-N 2.89Å
119	A	87.1	Confident	87.2	Confident	51 Å²	51	106.9 Å²	106.9	42%	0.421	49%	0.49	S	S	.	.	H	α-helix	trans	-60.4	-36.3	174.2	0	0	0	0	0	112.3	K115 D116	K115-A119 WeakPolarHBondContact O-CB 3.32Å; K115-A119 PolarHBondContact O-N 2.84Å; D116-A119 PolarHBondContact O-N 2.8Å
120	W	87.1	Confident	87.2	Confident	73 Å²	73	114.2 Å²	114.2	28%	0.277	51%	0.506	S	S	.	.	H	α-helix	trans	-68	-44.6	173.2	170.5	74.1	0	0	0	112.6	D116 M117 L118 K122 K123 R126 I128	D116-W120 PolarHBondContact O-N 3.12Å; M117-W120 HydrophobicContact CE-CE3 3.6Å; M117-W120 HydrophobicContact CE-CZ3 3.76Å; M117-W120 WeakPolarHBondContact O-CB 3.39Å; M117-W120 PolarHBondContact O-N 3.01Å; L118-W120 VanDerWaalsContact C-N 3.27Å; L118-W120 PolarHBondContact O-N 3.39Å; W120-K122 VanDerWaalsContact C-N 3.27Å; W120-K122 PolarHBondContact O-N 2.91Å; W120-K123 VanDerWaalsContact O-CB 3.32Å; W120-K123 WeakPolarHBondContact O-CB 3.31Å; W120-K123 PolarHBondContact O-N 3.35Å; W120-R126 WeakPolarHBondContact CH2-O 3.48Å; W120-R126 HydrophobicContact CZ2-CB 4.45Å; W120-R126 WeakPolarHBondContact CZ2-O 3.25Å; W120-I128 HydrophobicContact CD2-CD1 4.25Å; W120-I128 VanDerWaalsContact CE2-CD1 3.44Å; W120-I128 HydrophobicContact CH2-CD1 4.01Å; W120-I128 HydrophobicContact CZ2-CB 4.47Å; W120-I128 HydrophobicContact CZ2-CD1 3.3Å; W120-I128 HydrophobicContact CZ2-CG1 3.53Å
121	V	85.8	Confident	87.3	Confident	52 Å²	52	113.3 Å²	113.3	32%	0.315	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-34.2	177.8	172.3	0	0	0	0	111.7	F21 M117 L118 K123	F21-V121 HydrophobicContact CE1-CG1 4.2Å; F21-V121 HydrophobicContact CZ-CG1 4.48Å; M117-V121 WeakPolarHBondContact O-CG2 3.34Å; M117-V121 PolarHBondContact O-N 3.3Å; L118-V121 PolarHBondContact O-N 3.02Å; V121-K123 PolarHBondContact O-N 2.98Å
122	K	84.7	Confident	87.3	Confident	53 Å²	53	112.4 Å²	112.4	23%	0.23	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-13.2	173.9	-71.4	-178.3	-179.6	-169.7	0	113.3	F21 E33 L118 W120	F21-K122 HydrophobicContact CE2-CG 3.99Å; F21-K122 HydrophobicContact CZ-CG 3.93Å; E33-K122 IonicContact OE1-NZ 3.19Å; E33-K122 PolarHBondContact OE1-NZ 3Å; E33-K122 VanDerWaalsContact OE1-NZ 3.15Å; L118-K122 WeakPolarHBondContact O-CG 3.34Å; L118-K122 PolarHBondContact O-N 2.89Å; W120-K122 VanDerWaalsContact C-N 3.27Å; W120-K122 PolarHBondContact O-N 2.91Å
123	K	85.4	Confident	87.3	Confident	130 Å²	130	107.5 Å²	107.5	57%	0.565	49%	0.485	S	S	*	.	S	Bend	trans	-78.5	141.6	177.8	-65.4	176.9	-178.1	177.4	0	112.5	W120 V121 R125	W120-K123 VanDerWaalsContact O-CB 3.32Å; W120-K123 WeakPolarHBondContact O-CB 3.31Å; W120-K123 PolarHBondContact O-N 3.35Å; V121-K123 PolarHBondContact O-N 2.98Å; K123-R125 VanDerWaalsContact C-N 3.26Å; K123-R125 PolarHBondContact O-N 3.37Å
124	R	77.6	Confident	87.3	Confident	193 Å²	193	104.5 Å²	104.5	73%	0.728	48%	0.479	S	S	*	.	S	Bend	trans	-59.1	-31.1	176.3	-175.3	171	-175.7	165.5	1.2	114	W20	W20-R124 HydrophobicContact CH2-CG 3.96Å; W20-R124 HydrophobicContact CZ3-CB 4.31Å; W20-R124 HydrophobicContact CZ3-CG 3.99Å
125	R	79.6	Confident	87.5	Confident	201 Å²	201	101.5 Å²	101.5	76%	0.758	46%	0.464	S	S	*	.			trans	-109.8	92.3	174.9	-67.8	-70	-170.8	-124	0.9	109	K123	K123-R125 VanDerWaalsContact C-N 3.26Å; K123-R125 PolarHBondContact O-N 3.37Å
126	R	84.4	Confident	87.5	Confident	147 Å²	147	102 Å²	102	56%	0.555	47%	0.466	S	S	*	.			trans	-105.1	21.4	-175	63.1	-172.4	172.4	-159.1	-0.1	114	W120	W120-R126 WeakPolarHBondContact CH2-O 3.48Å; W120-R126 HydrophobicContact CZ2-CB 4.45Å; W120-R126 WeakPolarHBondContact CZ2-O 3.25Å
127	T	87.4	Confident	87.6	Confident	128 Å²	128	103.2 Å²	103.2	79%	0.785	47%	0.472	S	S	*	.			trans	-98.6	124.4	177.9	50.3	0	0	0	0	109.9
128	I	86.8	Confident	87.9	Confident	85 Å²	85	102.4 Å²	102.4	44%	0.436	47%	0.474	S	S	.	.			trans	-106.6	133.6	171.2	-63.4	163.4	0	0	0	107.4	W120 D132 L133	W120-I128 HydrophobicContact CD2-CD1 4.25Å; W120-I128 VanDerWaalsContact CE2-CD1 3.44Å; W120-I128 HydrophobicContact CH2-CD1 4.01Å; W120-I128 HydrophobicContact CZ2-CB 4.47Å; W120-I128 HydrophobicContact CZ2-CD1 3.3Å; W120-I128 HydrophobicContact CZ2-CG1 3.53Å; I128-D132 HydrophobicContact CG2-CB 4.21Å; I128-L133 HydrophobicContact CG2-CB 3.85Å
129	R	88.9	Confident	88	Confident	143 Å²	143	103 Å²	103	54%	0.54	50%	0.496	S	S	.	.			trans	-77.4	151.5	175.5	-54.9	-166.6	176	-167.9	-8.9	110.9	E131 D132 L133 R145	R129-E131 VanDerWaalsContact C-N 3.3Å; R129-E131 VanDerWaalsContact CB-CD 3.47Å; R129-E131 HydrophobicContact CB-CG 4.43Å; R129-E131 WeakPolarHBondContact CB-OE1 3.17Å; R129-E131 WeakPolarHBondContact CB-OE2 3.36Å; R129-E131 WeakPolarHBondContact CD-OE1 3.33Å; R129-E131 IonicContact NH1-OE1 3.15Å; R129-E131 PolarHBondContact NH1-OE1 2.82Å; R129-E131 PolarHBondContact O-N 3.46Å; R129-D132 WeakPolarHBondContact CB-OD2 3.34Å; R129-D132 PolarHBondContact O-N 3.21Å; R129-D132 VanDerWaalsContact O-N 3.13Å; R129-L133 PolarHBondContact O-N 3.33Å; R129-R145 VanDerWaalsContact NH1-NH1 3.15Å
130	R	92.9	Very high	88.2	Confident	196 Å²	196	107.9 Å²	107.9	74%	0.74	51%	0.507	S	S	*	.	H	α-helix	trans	-55.6	-45.4	-177.6	179.4	-178.1	178.5	-84.2	-0.4	111.9	D132 L133 I134	R130-D132 VanDerWaalsContact C-N 3.33Å; R130-D132 PolarHBondContact O-N 3.29Å; R130-L133 PolarHBondContact O-N 2.85Å; R130-I134 HydrophobicContact CG-CD1 3.75Å; R130-I134 HydrophobicContact CG-CG1 4.46Å; R130-I134 VanDerWaalsContact CZ-CD1 3.41Å; R130-I134 VanDerWaalsContact O-CG1 3.29Å; R130-I134 WeakPolarHBondContact O-CG1 2.95Å; R130-I134 PolarHBondContact O-N 3.41Å
131	E	92.8	Very high	87.7	Confident	67 Å²	67	108.6 Å²	108.6	31%	0.313	53%	0.529	S	S	.	.	H	α-helix	trans	-63.3	-37.3	-179.9	65.2	-82.8	-164	0	0	112.8	R129 S135 P143 R145	R129-E131 VanDerWaalsContact C-N 3.3Å; R129-E131 VanDerWaalsContact CB-CD 3.47Å; R129-E131 HydrophobicContact CB-CG 4.43Å; R129-E131 WeakPolarHBondContact CB-OE1 3.17Å; R129-E131 WeakPolarHBondContact CB-OE2 3.36Å; R129-E131 WeakPolarHBondContact CD-OE1 3.33Å; R129-E131 IonicContact NH1-OE1 3.15Å; R129-E131 PolarHBondContact NH1-OE1 2.82Å; R129-E131 PolarHBondContact O-N 3.46Å; E131-S135 VanDerWaalsContact O-CB 3.32Å; E131-S135 WeakPolarHBondContact O-CB 3.46Å; E131-S135 PolarHBondContact O-N 3.2Å; E131-S135 PolarHBondContact O-OG 2.75Å; E131-P143 HydrophobicContact CB-CG 4.12Å; E131-P143 HydrophobicContact CG-CG 4.47Å; E131-R145 IonicContact OE1-NH2 3.9Å
132	D	89.1	Confident	87.2	Confident	41 Å²	41	109.8 Å²	109.8	22%	0.219	54%	0.538	C	S	.	.	H	α-helix	trans	-70.8	-43.4	178.4	-59.3	-32.5	0	0	0	110.3	I128 R129 R130 S135 F136 R145	I128-D132 HydrophobicContact CG2-CB 4.21Å; R129-D132 WeakPolarHBondContact CB-OD2 3.34Å; R129-D132 PolarHBondContact O-N 3.21Å; R129-D132 VanDerWaalsContact O-N 3.13Å; R130-D132 VanDerWaalsContact C-N 3.33Å; R130-D132 PolarHBondContact O-N 3.29Å; D132-S135 PolarHBondContact O-N 2.94Å; D132-F136 WeakPolarHBondContact O-CB 3.41Å; D132-F136 PolarHBondContact O-N 2.83Å; D132-R145 IonicContact OD1-CZ 2.66Å; D132-R145 IonicContact OD1-NH2 3.9Å; D132-R145 PolarHBondContact OD1-NH2 3.31Å; D132-R145 IonicContact OD2-CZ 3.34Å; D132-R145 IonicContact OD2-NH2 2.7Å; D132-R145 PolarHBondContact OD2-NH2 2.8Å
133	L	90.2	Very high	86.7	Confident	78 Å²	78	110.8 Å²	110.8	41%	0.408	55%	0.549	S	S	.	.	H	α-helix	trans	-63.2	-46	177.9	-178.3	60.4	0	0	0	111.7	I128 R129 R130 S135 F136 L137	I128-L133 HydrophobicContact CG2-CB 3.85Å; R129-L133 PolarHBondContact O-N 3.33Å; R130-L133 PolarHBondContact O-N 2.85Å; L133-S135 VanDerWaalsContact C-N 3.31Å; L133-S135 PolarHBondContact O-N 3.5Å; L133-F136 PolarHBondContact O-N 3.15Å; L133-L137 HydrophobicContact CD1-CD1 4Å; L133-L137 HydrophobicContact CD1-CG 4.07Å; L133-L137 HydrophobicContact CG-CD1 3.94Å; L133-L137 HydrophobicContact CG-CG 4.39Å; L133-L137 WeakPolarHBondContact O-CB 3.48Å; L133-L137 VanDerWaalsContact O-CG 3.29Å; L133-L137 WeakPolarHBondContact O-CG 3.46Å; L133-L137 PolarHBondContact O-N 3.39Å
134	I	91.9	Very high	85.9	Confident	70 Å²	70	113.4 Å²	113.4	36%	0.359	56%	0.563	S	S	.	*	H	α-helix	trans	-61.9	-43.1	177.4	-69.4	170.1	0	0	0	110.4	R130 L137 C138	R130-I134 HydrophobicContact CG-CD1 3.75Å; R130-I134 HydrophobicContact CG-CG1 4.46Å; R130-I134 VanDerWaalsContact CZ-CD1 3.41Å; R130-I134 VanDerWaalsContact O-CG1 3.29Å; R130-I134 WeakPolarHBondContact O-CG1 2.95Å; R130-I134 PolarHBondContact O-N 3.41Å; I134-L137 PolarHBondContact O-N 2.95Å; I134-C138 VanDerWaalsContact O-CB 3.29Å; I134-C138 WeakPolarHBondContact O-CB 3.39Å; I134-C138 PolarHBondContact O-N 3.17Å; I134-C138 PolarHBondContact O-SG 3Å; I134-C138 VanDerWaalsContact O-SG 3.34Å
135	S	92.7	Very high	85.5	Confident	12 Å²	12	109.8 Å²	109.8	8%	0.084	55%	0.549	C	S	.	.	H	α-helix	trans	-63.3	-44.5	179.1	-57.3	0	0	0	0	111.3	E131 D132 L133 C138 G139 K140 P143	E131-S135 VanDerWaalsContact O-CB 3.32Å; E131-S135 WeakPolarHBondContact O-CB 3.46Å; E131-S135 PolarHBondContact O-N 3.2Å; E131-S135 PolarHBondContact O-OG 2.75Å; D132-S135 PolarHBondContact O-N 2.94Å; L133-S135 VanDerWaalsContact C-N 3.31Å; L133-S135 PolarHBondContact O-N 3.5Å; S135-C138 PolarHBondContact O-N 3.3Å; S135-G139 PolarHBondContact O-N 3.34Å; S135-K140 CarbonylContact C-O 3.49Å; S135-K140 WeakPolarHBondContact CB-O 3.39Å; S135-K140 PolarHBondContact O-N 3.13Å; S135-P143 WeakPolarHBondContact OG-CD 2.93Å
136	F	88.6	Confident	84.3	Confident	167 Å²	167	105 Å²	105	73%	0.732	55%	0.547	S	S	*	.	H	α-helix	trans	-60.1	-51.8	175.6	178	-99.5	0	0	0	112.4	D132 L133 C138 G139	D132-F136 WeakPolarHBondContact O-CB 3.41Å; D132-F136 PolarHBondContact O-N 2.83Å; L133-F136 PolarHBondContact O-N 3.15Å; F136-C138 VanDerWaalsContact C-N 3.26Å; F136-C138 PolarHBondContact O-N 3.04Å; F136-G139 PolarHBondContact O-N 3.5Å; F136-G139 VanDerWaalsContact O-N 3.16Å
137	L	90.9	Very high	82.6	Confident	126 Å²	126	102.6 Å²	102.6	66%	0.66	55%	0.553	S	S	*	*	H	α-helix	trans	-63.9	-30.7	-179.3	-68.9	174.8	0	0	0	112.9	L133 I134	L133-L137 HydrophobicContact CD1-CD1 4Å; L133-L137 HydrophobicContact CD1-CG 4.07Å; L133-L137 HydrophobicContact CG-CD1 3.94Å; L133-L137 HydrophobicContact CG-CG 4.39Å; L133-L137 WeakPolarHBondContact O-CB 3.48Å; L133-L137 VanDerWaalsContact O-CG 3.29Å; L133-L137 WeakPolarHBondContact O-CG 3.46Å; L133-L137 PolarHBondContact O-N 3.39Å; I134-L137 PolarHBondContact O-N 2.95Å
138	C	94.2	Very high	81.1	Confident	77 Å²	77	107.5 Å²	107.5	52%	0.52	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.8	1.2	178.4	-63.8	0	0	0	0	114	I134 S135 F136 K140	I134-C138 VanDerWaalsContact O-CB 3.29Å; I134-C138 WeakPolarHBondContact O-CB 3.39Å; I134-C138 PolarHBondContact O-N 3.17Å; I134-C138 PolarHBondContact O-SG 3Å; I134-C138 VanDerWaalsContact O-SG 3.34Å; S135-C138 PolarHBondContact O-N 3.3Å; F136-C138 VanDerWaalsContact C-N 3.26Å; F136-C138 PolarHBondContact O-N 3.04Å; C138-K140 HydrophobicContact CB-CD 4.33Å; C138-K140 HydrophobicContact CB-CG 4.18Å; C138-K140 PolarHBondContact O-N 3.45Å
139	G	90.6	Very high	79.1	Confident	74 Å²	74	109 Å²	109	76%	0.763	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.8	26	-177.2	0	0	0	0	0	114.3	S135 F136	S135-G139 PolarHBondContact O-N 3.34Å; F136-G139 PolarHBondContact O-N 3.5Å; F136-G139 VanDerWaalsContact O-N 3.16Å
140	K	89.9	Confident	77.1	Confident	152 Å²	152	109.5 Å²	109.5	66%	0.661	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-100.3	149.7	179.5	-63.7	-176	-179.7	178.9	0	110.2	S135 C138	S135-K140 CarbonylContact C-O 3.49Å; S135-K140 WeakPolarHBondContact CB-O 3.39Å; S135-K140 PolarHBondContact O-N 3.13Å; C138-K140 HydrophobicContact CB-CD 4.33Å; C138-K140 HydrophobicContact CB-CG 4.18Å; C138-K140 PolarHBondContact O-N 3.45Å
141	A	77.6	Confident	74.7	Confident	88 Å²	88	105.5 Å²	105.5	73%	0.727	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-60.5	134.9	171	0	0	0	0	0	109.7
142	P	75.2	Confident	72.7	Confident	78 Å²	78	113 Å²	113	51%	0.506	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-53.6	143.6	174.4	-25	33.6	0	0	0	110.7	H144	P142-H144 PolarHBondContact O-N 3.38Å
143	P	73.1	Confident	70.8	Confident	73 Å²	73	119.3 Å²	119.3	47%	0.474	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-53.8	129.6	179.7	-22.1	31.7	0	0	0	109.6	E131 S135 R145	E131-P143 HydrophobicContact CB-CG 4.12Å; E131-P143 HydrophobicContact CG-CG 4.47Å; S135-P143 WeakPolarHBondContact OG-CD 2.93Å; P143-R145 PolarHBondContact O-N 2.66Å
144	H	68.5	Low	68.8	Low	185 Å²	185	119.6 Å²	119.6	86%	0.856	66%	0.657	S	S	*	*			trans	-59.1	112.7	-178.3	-157.7	-80.8	0	0	0	108.1	P142 S146	P142-H144 PolarHBondContact O-N 3.38Å; H144-S146 PolarHBondContact O-N 2.81Å
145	R	70.7	Confident	66.8	Low	117 Å²	117	124.6 Å²	124.6	44%	0.442	68%	0.681	S	S	.	*			trans	-71.3	101.8	176.2	-62.4	-178.7	-173.6	-139.2	-3	105.5	R129 E131 D132 P143 S147	R129-R145 VanDerWaalsContact NH1-NH1 3.15Å; E131-R145 IonicContact OE1-NH2 3.9Å; D132-R145 IonicContact OD1-CZ 2.66Å; D132-R145 IonicContact OD1-NH2 3.9Å; D132-R145 PolarHBondContact OD1-NH2 3.31Å; D132-R145 IonicContact OD2-CZ 3.34Å; D132-R145 IonicContact OD2-NH2 2.7Å; D132-R145 PolarHBondContact OD2-NH2 2.8Å; P143-R145 PolarHBondContact O-N 2.66Å; R145-S147 PolarHBondContact O-N 2.9Å
146	S	53	Low	64.5	Low	100 Å²	100	130.3 Å²	130.3	70%	0.699	72%	0.715	S	S	*	*			trans	-56.5	96.1	152.4	46.2	0	0	0	0	104.9	H144 R148	H144-S146 PolarHBondContact O-N 2.81Å; S146-R148 VanDerWaalsContact C-N 3.25Å; S146-R148 PolarHBondContact O-N 3.2Å
147	S	49.8	Very low	62	Low	97 Å²	97	126.5 Å²	126.5	68%	0.678	72%	0.715	S	S	*	*			trans	-47.1	104.6	163.6	179	0	0	0	0	103.8	R145 T149	R145-S147 PolarHBondContact O-N 2.9Å; S147-T149 PolarHBondContact O-N 2.92Å
148	R	55.4	Low	59.8	Low	232 Å²	232	126.5 Å²	126.5	88%	0.875	72%	0.722	S	S	*	*			trans	-63.1	91.6	164.1	-70.9	-177	109.9	177	4	101.7	S146 N150	S146-R148 VanDerWaalsContact C-N 3.25Å; S146-R148 PolarHBondContact O-N 3.2Å; R148-N150 PolarHBondContact O-N 3.25Å
149	T	44.3	Very low	57	Low	115 Å²	115	128.5 Å²	128.5	71%	0.706	74%	0.737	S	S	*	*			trans	-38	116.4	164.8	46.7	0	0	0	0	104.3	S147 S151	S147-T149 PolarHBondContact O-N 2.92Å; T149-S151 VanDerWaalsContact C-N 3.33Å; T149-S151 PolarHBondContact O-N 3.41Å
150	N	48.5	Very low	54.4	Low	155 Å²	155	136.3 Å²	136.3	83%	0.829	74%	0.744	S	S	*	*			trans	-41.1	110.1	167.9	-87.5	-21.4	0	0	0	105.4	R148 R152	R148-N150 PolarHBondContact O-N 3.25Å; N150-R152 VanDerWaalsContact C-N 3.29Å; N150-R152 PolarHBondContact O-N 3Å
151	S	42	Very low	51.7	Low	111 Å²	111	133.2 Å²	133.2	78%	0.776	75%	0.746	S	S	*	*			trans	-57.3	107	177.6	-176.3	0	0	0	0	103.7	T149 L153	T149-S151 VanDerWaalsContact C-N 3.33Å; T149-S151 PolarHBondContact O-N 3.41Å; S151-L153 PolarHBondContact O-N 3.45Å
152	R	49.8	Very low	49.6	Very low	225 Å²	225	137 Å²	137	85%	0.849	75%	0.754	S	S	*	*			trans	-49.1	114.2	177.7	-70	174.9	175.1	171.6	-2.8	105.1	N150 A154	N150-R152 VanDerWaalsContact C-N 3.29Å; N150-R152 PolarHBondContact O-N 3Å; R152-A154 PolarHBondContact O-N 2.86Å
153	L	49.4	Very low	47.6	Very low	173 Å²	173	138.5 Å²	138.5	91%	0.906	77%	0.767	S	S	*	*			trans	-67.6	73.6	163.7	-71.4	171.5	0	0	0	106.6	S151	S151-L153 PolarHBondContact O-N 3.45Å
154	A	49.1	Very low	46.1	Very low	85 Å²	85	141 Å²	141	70%	0.702	78%	0.783	S	S	*	*			trans	-101	75.9	157.2	0	0	0	0	0	104.9	R152	R152-A154 PolarHBondContact O-N 2.86Å
155	M	49.9	Very low	44.5	Very low	175 Å²	175	136 Å²	136	86%	0.862	77%	0.774	S	S	*	*			trans	-113.9	121	162.9	-85.6	-67	-177.5	0	0	107.7
156	V	43.2	Very low	43	Very low	131 Å²	131	139.5 Å²	139.5	79%	0.794	80%	0.795	S	S	*	*			trans	-49.3	132.8	-176.1	170.8	0	0	0	0	111.5	P158	V156-P158 WeakPolarHBondContact O-CD 3.33Å
157	A	37.9	Very low	42.3	Very low	87 Å²	87	141.6 Å²	141.6	72%	0.719	80%	0.804	S	S	*	*			trans	-69.5	127.7	165	0	0	0	0	0	110
158	P	43.9	Very low	41.6	Very low	126 Å²	126	140.3 Å²	140.3	82%	0.818	81%	0.806	S	S	*	*			trans	-94.7	111.9	164.9	30.2	-20.5	0	0	0	109.3	V156	V156-P158 WeakPolarHBondContact O-CD 3.33Å
159	S	34.7	Very low	40.8	Very low	120 Å²	120	133.6 Å²	133.6	84%	0.839	80%	0.795	S	S	*	*			trans	-80.7	122.3	164.8	-79	0	0	0	0	110.7
160	R	37.1	Very low	41.1	Very low	238 Å²	238	133.7 Å²	133.7	90%	0.898	80%	0.8	S	S	*	*			trans	78.5	110.4	139.1	-150.9	178.4	-175.7	161	1.4	119.2
161	A	33.2	Very low	41	Very low	87 Å²	87	132 Å²	132	72%	0.719	80%	0.795	S	S	*	*				157.3	140.4	101	0	0	0	0	0	113.8
162	N	32.1	Very low	41.6	Very low	166 Å²	166	131.9 Å²	131.9	89%	0.888	78%	0.782	S	S	*	*			trans	83.1	113.6	158.1	-81.5	32.8	0	0	0	122.1
163	S	34.5	Very low	42	Very low	111 Å²	111	127.3 Å²	127.3	78%	0.776	78%	0.779	S	S	*	*			trans	-79.7	174.1	172.9	58.2	0	0	0	0	113
164	P	42.1	Very low	42.8	Very low	125 Å²	125	124.8 Å²	124.8	81%	0.812	77%	0.767	S	S	*	*				-139	167.9	65.4	32.3	-10.7	0	0	0	115.8
165	A	35.1	Very low	44.1	Very low	81 Å²	81	124.4 Å²	124.4	67%	0.669	75%	0.753	S	S	*	*			trans	-61.2	138.4	-177.1	0	0	0	0	0	114.5
166	E	37.9	Very low	45.3	Very low	190 Å²	190	122.1 Å²	122.1	89%	0.888	74%	0.74	S	S	*	*			trans	-135.3	137.1	146.8	-78.7	-62.2	142.6	0	0	107.6
167	T	38.6	Very low	46.8	Very low	144 Å²	144	119.1 Å²	119.1	88%	0.883	72%	0.723	S	S	*	*			trans	-92	119.6	-164.2	-53.5	0	0	0	0	109
168	G	34.1	Very low	48.4	Very low	70 Å²	70	122.1 Å²	122.1	72%	0.722	72%	0.72	S	S	*	*			trans	163.9	117.9	168.4	0	0	0	0	0	116.4
169	S	40.1	Very low	50	Low	90 Å²	90	122.6 Å²	122.6	63%	0.629	71%	0.706	S	S	*	*			trans	81.7	89.3	152.9	-154.5	0	0	0	0	119.3	V171	S169-V171 PolarHBondContact O-N 3.25Å; S169-V171 WeakPolarHBondContact OG-CG2 3.48Å
170	S	50.6	Low	51.8	Low	118 Å²	118	123 Å²	123	83%	0.825	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	36	165.1	179.4	0	0	0	0	113.7
171	V	46.6	Very low	53.4	Low	119 Å²	119	113.6 Å²	113.6	72%	0.721	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.2	4.3	-177.8	-132.1	0	0	0	0	113.7	S169	S169-V171 PolarHBondContact O-N 3.25Å; S169-V171 WeakPolarHBondContact OG-CG2 3.48Å
172	E	53.7	Low	55.2	Low	109 Å²	109	113.3 Å²	113.3	51%	0.509	65%	0.653	S	S	.	*			trans	-97.5	9.1	-179.4	-159.3	60.3	-144.1	0	0	112.7	D174 R179	E172-D174 PolarHBondContact O-N 3.26Å; E172-R179 IonicContact OE1-CZ 2.69Å; E172-R179 IonicContact OE1-NH2 2.75Å; E172-R179 PolarHBondContact OE1-NH2 3.44Å
173	T	59	Low	56.9	Low	128 Å²	128	108.9 Å²	108.9	79%	0.785	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	100.6	-174.8	-18.3	0	0	0	0	110.3
174	D	66.4	Low	58.5	Low	121 Å²	121	110.1 Å²	110.1	65%	0.647	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	96.1	43.6	172	-148.8	34.9	0	0	0	117.8	E172 P177	E172-D174 PolarHBondContact O-N 3.26Å; D174-P177 VanDerWaalsContact OD1-CD 3.24Å; D174-P177 WeakPolarHBondContact OD1-CD 3.4Å
175	L	74.9	Confident	59.5	Low	77 Å²	77	111 Å²	111	40%	0.403	63%	0.63	S	S	.	*			trans	-79.9	3.9	157	-67.8	174.7	0	0	0	112.7	F178 R179	L175-F178 WeakPolarHBondContact O-CB 3.44Å; L175-F178 PolarHBondContact O-N 3.32Å; L175-F178 VanDerWaalsContact O-N 3.09Å; L175-R179 WeakPolarHBondContact O-CG 3.44Å; L175-R179 PolarHBondContact O-N 3.19Å
176	Q	75.1	Confident	60.6	Low	126 Å²	126	109.9 Å²	109.9	59%	0.589	63%	0.626	S	S	*	*	H	α-helix	trans	-63.3	-40.6	-174.7	-152.5	65.6	-7.4	0	0	113.7	F178 R179 E180	Q176-F178 PolarHBondContact O-N 2.99Å; Q176-R179 PolarHBondContact O-N 3.12Å; Q176-E180 WeakPolarHBondContact O-CB 3.42Å; Q176-E180 PolarHBondContact O-N 3.43Å
177	P	76.3	Confident	61.6	Low	69 Å²	69	105.5 Å²	105.5	45%	0.448	61%	0.609	S	S	.	*	H	α-helix	trans	-62.1	-33	172.8	-23.6	34.5	0	0	0	112.7	D174 A181	D174-P177 VanDerWaalsContact OD1-CD 3.24Å; D174-P177 WeakPolarHBondContact OD1-CD 3.4Å; P177-A181 WeakPolarHBondContact O-CB 3.24Å; P177-A181 PolarHBondContact O-N 3.31Å
178	F	69.8	Low	62.5	Low	150 Å²	150	103.9 Å²	103.9	66%	0.658	60%	0.603	S	S	*	*	H	α-helix	trans	-74	-42.1	177.6	-112.4	-90.6	0	0	0	111.9	L175 Q176 E180 A181 I182	L175-F178 WeakPolarHBondContact O-CB 3.44Å; L175-F178 PolarHBondContact O-N 3.32Å; L175-F178 VanDerWaalsContact O-N 3.09Å; Q176-F178 PolarHBondContact O-N 2.99Å; F178-E180 VanDerWaalsContact C-N 3.3Å; F178-E180 PolarHBondContact O-N 3.43Å; F178-A181 PolarHBondContact O-N 3.04Å; F178-I182 WeakPolarHBondContact O-CG1 3.33Å; F178-I182 PolarHBondContact O-N 3.44Å
179	R	79.1	Confident	63.5	Low	136 Å²	136	103.7 Å²	103.7	51%	0.513	60%	0.601	S	S	.	*	H	α-helix	trans	-62	-40.2	174.7	-67.5	172	-169.9	-76.7	2.6	110.9	E172 L175 Q176 A183	E172-R179 IonicContact OE1-CZ 2.69Å; E172-R179 IonicContact OE1-NH2 2.75Å; E172-R179 PolarHBondContact OE1-NH2 3.44Å; L175-R179 WeakPolarHBondContact O-CG 3.44Å; L175-R179 PolarHBondContact O-N 3.19Å; Q176-R179 PolarHBondContact O-N 3.12Å; R179-A183 PolarHBondContact O-N 3.2Å
180	E	72.6	Confident	63.9	Low	127 Å²	127	103 Å²	103	59%	0.593	60%	0.601	S	S	*	*	H	α-helix	trans	-67.4	-42.2	176.2	-164.6	174.9	-162.3	0	0	112	Q176 F178 I182 A183 L184	Q176-E180 WeakPolarHBondContact O-CB 3.42Å; Q176-E180 PolarHBondContact O-N 3.43Å; F178-E180 VanDerWaalsContact C-N 3.3Å; F178-E180 PolarHBondContact O-N 3.43Å; E180-I182 PolarHBondContact O-N 3.42Å; E180-A183 PolarHBondContact O-N 3.08Å; E180-L184 HydrophobicContact CG-CD1 4.24Å; E180-L184 WeakPolarHBondContact O-CG 3.4Å; E180-L184 PolarHBondContact O-N 2.81Å
181	A	70.4	Confident	63.6	Low	42 Å²	42	102.8 Å²	102.8	35%	0.347	59%	0.588	S	S	.	*	H	α-helix	trans	-63.1	-39.2	176.1	0	0	0	0	0	112.9	P177 F178 L184 H185	P177-A181 WeakPolarHBondContact O-CB 3.24Å; P177-A181 PolarHBondContact O-N 3.31Å; F178-A181 PolarHBondContact O-N 3.04Å; A181-L184 PolarHBondContact O-N 2.77Å; A181-H185 PolarHBondContact O-N 2.79Å; A181-H185 VanDerWaalsContact O-N 3.12Å; A181-H185 PolarHBondContact O-ND1 2.94Å
182	I	70.3	Confident	63.7	Low	80 Å²	80	102 Å²	102	41%	0.41	60%	0.595	S	S	.	*	H	α-helix	trans	-66.9	-39	177	-69.8	179	0	0	0	111.4	F178 E180 G186	F178-I182 WeakPolarHBondContact O-CG1 3.33Å; F178-I182 PolarHBondContact O-N 3.44Å; E180-I182 PolarHBondContact O-N 3.42Å; I182-G186 PolarHBondContact O-N 2.89Å
183	A	67.6	Low	63.3	Low	74 Å²	74	101.9 Å²	101.9	61%	0.612	61%	0.606	S	S	*	*	H	α-helix	trans	-65.7	-40	176.5	0	0	0	0	0	112.1	R179 E180	R179-A183 PolarHBondContact O-N 3.2Å; E180-A183 PolarHBondContact O-N 3.08Å
184	L	68.1	Low	62.5	Low	137 Å²	137	101.2 Å²	101.2	72%	0.717	60%	0.596	S	S	*	*	H	α-helix	trans	-72.5	-30.4	-179.6	-71	171.7	0	0	0	113.7	E180 A181	E180-L184 HydrophobicContact CG-CD1 4.24Å; E180-L184 WeakPolarHBondContact O-CG 3.4Å; E180-L184 PolarHBondContact O-N 2.81Å; A181-L184 PolarHBondContact O-N 2.77Å
185	H	62.8	Low	61.4	Low	142 Å²	142	101 Å²	101	66%	0.657	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	8.4	-178.7	-66.9	83.7	0	0	0	113.9	A181 L187	A181-H185 PolarHBondContact O-N 2.79Å; A181-H185 VanDerWaalsContact O-N 3.12Å; A181-H185 PolarHBondContact O-ND1 2.94Å; H185-L187 HydrophobicContact CB-CD1 4.12Å; H185-L187 PolarHBondContact O-N 3.47Å
186	G	59.4	Low	59.8	Low	58 Å²	58	103.7 Å²	103.7	60%	0.598	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.5	18	172.4	0	0	0	0	0	115.3	I182	I182-G186 PolarHBondContact O-N 2.89Å
187	L	59.3	Low	58	Low	98 Å²	98	109 Å²	109	51%	0.513	64%	0.638	S	S	.	*	G	3₁₀ helix	trans	-82.6	-10.6	-175.4	-83.6	156.8	0	0	0	113.7	H185 G189 A190	H185-L187 HydrophobicContact CB-CD1 4.12Å; H185-L187 PolarHBondContact O-N 3.47Å; L187-G189 PolarHBondContact O-N 3.3Å; L187-A190 PolarHBondContact O-N 3.33Å
188	S	55.6	Low	56.4	Low	110 Å²	110	111.9 Å²	111.9	77%	0.769	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-70.9	0.6	-175.3	-164.1	0	0	0	0	115.1
189	G	55.3	Low	54.6	Low	66 Å²	66	108.6 Å²	108.6	68%	0.68	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-128.7	-11.6	174.8	0	0	0	0	0	115.5	L187	L187-G189 PolarHBondContact O-N 3.3Å
190	A	50.1	Low	52.4	Low	76 Å²	76	106.8 Å²	106.8	63%	0.628	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-8.5	-166.4	0	0	0	0	0	115.2	L187	L187-A190 PolarHBondContact O-N 3.33Å
191	M	44.4	Very low	51.8	Low	113 Å²	113	107.1 Å²	107.1	56%	0.557	70%	0.695	S	S	*	*			trans	-129.4	30.3	-176.6	-69.1	-119.7	-63.3	0	0	113.9	S193 I194	M191-S193 PolarHBondContact O-N 3.09Å; M191-S193 VanDerWaalsContact O-N 3.11Å; M191-I194 HydrophobicContact CE-CD1 3.51Å; M191-I194 HydrophobicContact CE-CG1 4.4Å; M191-I194 HydrophobicContact SD-CD1 3.8Å; M191-I194 HydrophobicContact SD-CG1 4.37Å
192	A	47.7	Very low	49.9	Very low	104 Å²	104	109 Å²	109	86%	0.86	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	2.8	174.5	0	0	0	0	0	114
193	S	45.3	Very low	48.3	Very low	106 Å²	106	110.8 Å²	110.8	74%	0.741	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136	38.6	-170.5	70.1	0	0	0	0	114.6	M191	M191-S193 PolarHBondContact O-N 3.09Å; M191-S193 VanDerWaalsContact O-N 3.11Å
194	I	42.9	Very low	47.3	Very low	114 Å²	114	112.5 Å²	112.5	59%	0.585	74%	0.743	S	S	*	*			trans	-114.6	97.3	169.1	57.6	161.2	0	0	0	111	M191	M191-I194 HydrophobicContact CE-CD1 3.51Å; M191-I194 HydrophobicContact CE-CG1 4.4Å; M191-I194 HydrophobicContact SD-CD1 3.8Å; M191-I194 HydrophobicContact SD-CG1 4.37Å
195	S	43.5	Very low	45.9	Very low	116 Å²	116	111.3 Å²	111.3	81%	0.811	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-70.2	122.3	168.7	-177.9	0	0	0	0	109.3	R197	S195-R197 PolarHBondContact O-N 3.2Å
196	V	40.9	Very low	44.5	Very low	133 Å²	133	112.8 Å²	112.8	81%	0.806	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-74.2	118.7	175.7	-78.4	0	0	0	0	110.6
197	R	36.7	Very low	43.3	Very low	239 Å²	239	116.4 Å²	116.4	90%	0.902	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-102.6	117.2	158.8	-77.8	-176.7	162.8	-89.2	-0.6	108.3	S195	S195-R197 PolarHBondContact O-N 3.2Å
198	S	42.5	Very low	42.5	Very low	129 Å²	129	118 Å²	118	90%	0.902	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-65.3	136.8	175.9	-59.3	0	0	0	0	112.2
199	G	31.9	Very low	41.3	Very low	80 Å²	80	116.4 Å²	116.4	83%	0.825	78%	0.779	S	S	*	*			trans	-171.9	128.1	166.6	0	0	0	0	0	111.3
200	A	33.7	Very low	40.3	Very low	99 Å²	99	119 Å²	119	82%	0.818	79%	0.787	S	S	*	*			trans	-104.1	-174.9	178.4	0	0	0	0	0	110.9
201	P	60	Low	39.5	Very low	133 Å²	133	120.7 Å²	120.7	86%	0.864	79%	0.794	S	S	*	*				-118.7	171.5	-90.1	34.8	-18.1	0	0	0	112.5
202	G	31	Very low	39	Very low	81 Å²	81	120.8 Å²	120.8	84%	0.835	81%	0.806	S	S	*	*			trans	-171.1	105.5	169.9	0	0	0	0	0	114.9
203	S	36.7	Very low	38.5	Very low	118 Å²	118	123.2 Å²	123.2	83%	0.825	80%	0.804	S	S	*	*			trans	-84.1	156.2	152.5	-55.6	0	0	0	0	107.7
204	P	45.3	Very low	37.9	Very low	110 Å²	110	125.1 Å²	125.1	71%	0.714	81%	0.812	S	S	*	*				-162.4	167.7	65.4	42	-18.3	0	0	0	120
205	T	38.9	Very low	37.3	Very low	113 Å²	113	122.9 Å²	122.9	69%	0.693	82%	0.817	S	S	*	*			trans	65.7	130.9	135	50.6	0	0	0	0	125.3
206	H	33.6	Very low	36.7	Very low	173 Å²	173	123.3 Å²	123.3	80%	0.801	82%	0.82	S	S	*	*			trans	61.7	139.3	137.8	-75.6	-120.2	0	0	0	118.5
207	V	35	Very low	36.4	Very low	134 Å²	134	121.4 Å²	121.4	81%	0.812	82%	0.818	S	S	*	*				-167.1	148.1	59.3	-79.8	0	0	0	0	110.6
208	S	40.4	Very low	36.2	Very low	130 Å²	130	115.9 Å²	115.9	91%	0.909	82%	0.816	S	S	*	*			trans	-80.2	143	160.7	-60.1	0	0	0	0	110.6
209	G	31.9	Very low	35.8	Very low	77 Å²	77	113.7 Å²	113.7	79%	0.794	81%	0.814	S	S	*	*			trans	-153.8	104.5	172.1	0	0	0	0	0	112.2
210	S	34.3	Very low	35.7	Very low	122 Å²	122	114 Å²	114	85%	0.853	82%	0.817	S	S	*	*			trans	-73.9	137.1	167.3	-70.4	0	0	0	0	111.5
211	S	33	Very low	35.5	Very low	111 Å²	111	113.3 Å²	113.3	78%	0.776	82%	0.819	S	S	*	*			trans	-166.7	106.6	150.6	-41.9	0	0	0	0	108.2
212	S	34.2	Very low	34.2	Very low	114 Å²	114	111.8 Å²	111.8	80%	0.797	82%	0.818	S	S	*	*				80.2	120.4	98.5	69.9	0	0	0	0	116.1
213	N	37.9	Very low	34.4	Very low	155 Å²	155	113 Å²	113	83%	0.829	81%	0.814	S	S	*	*			trans	-36	149	166.1	-77.7	-6.8	0	0	0	115.7
214	T	32.3	Very low	34.5	Very low	146 Å²	146	113.2 Å²	113.2	90%	0.896	82%	0.816	S	S	*	*				-166.7	148.4	126.5	23.3	0	0	0	0	109.8
215	G	29.9	Very low	33.9	Very low	67 Å²	67	111.8 Å²	111.8	69%	0.691	82%	0.821	S	S	*	*			trans	-55.5	174.2	-169.5	0	0	0	0	0	116.4
216	S	31	Very low	34	Very low	126 Å²	126	112.9 Å²	112.9	88%	0.881	83%	0.833	S	S	*	*				-176.4	160.2	69.4	-58.9	0	0	0	0	110.4
217	A	33.3	Very low	34.2	Very low	93 Å²	93	107.3 Å²	107.3	77%	0.769	82%	0.822	S	S	*	*			trans	-52.7	153.4	-175.7	0	0	0	0	0	117.2
218	S	34	Very low	34.5	Very low	123 Å²	123	107.4 Å²	107.4	86%	0.86	83%	0.826	S	S	*	*				173.6	140.2	120.2	44.9	0	0	0	0	113.2
219	G	33.6	Very low	34.4	Very low	82 Å²	82	107.4 Å²	107.4	85%	0.845	82%	0.82	S	S	*	*			trans	78.3	117.1	160.2	0	0	0	0	0	115.4
220	G	28.8	Very low	34.7	Very low	87 Å²	87	109.9 Å²	109.9	90%	0.897	82%	0.823	S	S	*	*			cis	100.6	103.9	37.5	0	0	0	0	0	108.7
221	G	30	Very low	34.9	Very low	84 Å²	84	114.8 Å²	114.8	87%	0.866	82%	0.823	S	S	*	*			trans	157.9	97.2	173.7	0	0	0	0	0	113.9
222	A	33.6	Very low	35.2	Very low	102 Å²	102	114.9 Å²	114.9	84%	0.843	82%	0.824	S	S	*	*			trans	-78.4	144.5	175.1	0	0	0	0	0	112.2
223	S	35.1	Very low	35.6	Very low	107 Å²	107	120.7 Å²	120.7	75%	0.748	83%	0.828	S	S	*	*				179.1	127	125	57.3	0	0	0	0	113.4
224	S	37.7	Very low	36.1	Very low	122 Å²	122	123.9 Å²	123.9	85%	0.853	83%	0.829	S	S	*	*			trans	61.7	117.8	142	62.9	0	0	0	0	121.1
225	G	34.1	Very low	36.3	Very low	80 Å²	80	124.8 Å²	124.8	83%	0.825	83%	0.828	S	S	*	*			trans	168	90.5	158.4	0	0	0	0	0	113.5
226	S	39.5	Very low	36.7	Very low	136 Å²	136	124.9 Å²	124.9	95%	0.951	83%	0.829	S	S	*	*			trans	-56.9	136.5	-180	-58.7	0	0	0	0	114.8
227	G	38.8	Very low	37.7	Very low	55 Å²	55	127.3 Å²	127.3	57%	0.567	83%	0.831	S	S	*	*			trans	179.3	136	165.1	0	0	0	0	0	110.8	V229	G227-V229 PolarHBondContact O-N 3.03Å; G227-V229 VanDerWaalsContact O-N 3.1Å
228	P	41	Very low	38.8	Very low	137 Å²	137	131.7 Å²	131.7	89%	0.89	84%	0.836	S	S	*	*			trans	-76.2	105.8	-170.6	29.9	-31.4	0	0	0	110.4
229	V	38.9	Very low	39.8	Very low	129 Å²	129	133.8 Å²	133.8	78%	0.782	84%	0.837	S	S	*	*			trans	-90	119.8	168.8	-176.4	0	0	0	0	108	G227 R231	G227-V229 PolarHBondContact O-N 3.03Å; G227-V229 VanDerWaalsContact O-N 3.1Å; V229-R231 PolarHBondContact O-N 3.38Å
230	C	37	Very low	41.3	Very low	129 Å²	129	134.5 Å²	134.5	87%	0.872	83%	0.825	S	S	*	*			trans	-54.2	102.4	175.9	-56.8	0	0	0	0	110.6	S232	C230-S232 PolarHBondContact O-N 3.35Å
231	R	38.7	Very low	43.7	Very low	226 Å²	226	134.7 Å²	134.7	85%	0.853	81%	0.806	S	S	*	*			trans	-78.8	106.6	171.1	-87.7	-173.1	-179	-135.5	1.5	109.5	V229 R233	V229-R231 PolarHBondContact O-N 3.38Å; R231-R233 PolarHBondContact O-N 2.93Å
232	S	40.9	Very low	45.7	Very low	112 Å²	112	136.4 Å²	136.4	78%	0.783	79%	0.794	S	S	*	*			trans	-52.1	113.7	155.9	-174.6	0	0	0	0	109.2	C230	C230-S232 PolarHBondContact O-N 3.35Å
233	R	41.5	Very low	47.8	Very low	237 Å²	237	136.7 Å²	136.7	89%	0.894	78%	0.782	S	S	*	*			trans	-100.2	94.1	168.8	-74.5	-166.1	-179	-159	3.4	108.7	R231	R231-R233 PolarHBondContact O-N 2.93Å
234	R	47.7	Very low	50	Low	222 Å²	222	134.9 Å²	134.9	84%	0.838	77%	0.766	S	S	*	*			trans	-90.5	119.7	140.4	-74.3	-176.3	-165.4	165	4.5	106.5
235	N	38	Very low	52.2	Low	165 Å²	165	134.1 Å²	134.1	88%	0.882	75%	0.748	S	S	*	*			trans	161.1	135.7	137.1	-86.8	14.6	0	0	0	111.8
236	G	36.8	Very low	54.3	Low	69 Å²	69	134.2 Å²	134.2	71%	0.711	73%	0.728	S	S	*	*			trans	97.7	76.6	141.8	0	0	0	0	0	116.7	Q238	G236-Q238 VanDerWaalsContact C-N 3.34Å; G236-Q238 PolarHBondContact O-N 3.15Å; G236-Q238 VanDerWaalsContact O-N 3.08Å
237	L	52.3	Low	56.3	Low	176 Å²	176	132.3 Å²	132.3	92%	0.921	71%	0.711	S	S	*	*			trans	-64	96.5	151.2	-109.3	113	0	0	0	107.9
238	Q	57	Low	58.2	Low	186 Å²	186	135.1 Å²	135.1	87%	0.869	71%	0.709	S	S	*	*	S	Bend	trans	-165	114.4	156.1	-106.7	152.6	54.4	0	0	108.6	G236	G236-Q238 VanDerWaalsContact C-N 3.34Å; G236-Q238 PolarHBondContact O-N 3.15Å; G236-Q238 VanDerWaalsContact O-N 3.08Å
239	D	55.8	Low	60.1	Low	166 Å²	166	132 Å²	132	89%	0.888	68%	0.683	S	S	*	*			trans	65	61.7	168.8	-145.7	31.3	0	0	0	116.4
240	V	64.6	Low	61.9	Low	98 Å²	98	132 Å²	132	59%	0.594	68%	0.676	S	S	*	*			trans	-90.4	111.2	158.4	-175.2	0	0	0	0	106.6	L242 F245	V240-L242 PolarHBondContact O-N 3.34Å; V240-F245 HydrophobicContact CG1-CB 4.16Å
241	D	77.9	Confident	63.7	Low	91 Å²	91	127.9 Å²	127.9	49%	0.487	65%	0.652	S	S	.	*			trans	-50.8	124.8	171.7	166.9	34.5	0	0	0	109.5	N243 T244 F245	D241-N243 PolarHBondContact O-N 3Å; D241-N243 VanDerWaalsContact O-N 3.15Å; D241-N243 PolarHBondContact OD1-N 2.74Å; D241-N243 WeakPolarHBondContact OD2-CB 3.32Å; D241-T244 WeakPolarHBondContact O-CA 3.33Å; D241-T244 VanDerWaalsContact O-CB 3.31Å; D241-T244 WeakPolarHBondContact O-CB 3.28Å; D241-T244 PolarHBondContact O-N 3.26Å; D241-T244 PolarHBondContact OD2-N 3.5Å; D241-T244 PolarHBondContact OD2-OG1 3.31Å; D241-F245 PolarHBondContact O-N 3.37Å; D241-F245 VanDerWaalsContact O-N 3.07Å
242	L	72.3	Confident	65.3	Low	120 Å²	120	124.8 Å²	124.8	63%	0.628	64%	0.64	S	S	*	*	H	α-helix	trans	-55.4	-34.8	-176.9	-179.4	62.5	0	0	0	111.1	V240 T244 F245 I246	V240-L242 PolarHBondContact O-N 3.34Å; L242-T244 VanDerWaalsContact C-N 3.34Å; L242-F245 PolarHBondContact O-N 3.4Å; L242-I246 HydrophobicContact CD1-CD1 4.2Å; L242-I246 HydrophobicContact CD1-CG1 4.39Å; L242-I246 HydrophobicContact CG-CD1 3.84Å; L242-I246 HydrophobicContact CG-CG1 4.47Å; L242-I246 WeakPolarHBondContact O-CB 3.24Å; L242-I246 WeakPolarHBondContact O-CD1 3.4Å; L242-I246 WeakPolarHBondContact O-CG1 3.38Å; L242-I246 PolarHBondContact O-N 3Å
243	N	77.5	Confident	66.5	Low	108 Å²	108	125.5 Å²	125.5	58%	0.578	63%	0.63	S	S	*	*	H	α-helix	trans	-65.8	-36.5	175.1	-97.5	-6.4	0	0	0	112.7	D241 T247	D241-N243 PolarHBondContact O-N 3Å; D241-N243 VanDerWaalsContact O-N 3.15Å; D241-N243 PolarHBondContact OD1-N 2.74Å; D241-N243 WeakPolarHBondContact OD2-CB 3.32Å; N243-T247 WeakPolarHBondContact O-CB 3.39Å; N243-T247 PolarHBondContact O-N 3.05Å; N243-T247 PolarHBondContact O-OG1 3.18Å
244	T	82	Confident	67.5	Low	68 Å²	68	119.8 Å²	119.8	42%	0.417	62%	0.617	S	S	.	*	H	α-helix	trans	-67.7	-42.7	176.4	-59.3	0	0	0	0	110.7	D241 L242 T247 E248	D241-T244 WeakPolarHBondContact O-CA 3.33Å; D241-T244 VanDerWaalsContact O-CB 3.31Å; D241-T244 WeakPolarHBondContact O-CB 3.28Å; D241-T244 PolarHBondContact O-N 3.26Å; D241-T244 PolarHBondContact OD2-N 3.5Å; D241-T244 PolarHBondContact OD2-OG1 3.31Å; L242-T244 VanDerWaalsContact C-N 3.34Å; T244-T247 PolarHBondContact O-N 3.09Å; T244-E248 PolarHBondContact O-N 2.78Å
245	F	84.4	Confident	68	Low	107 Å²	107	114.9 Å²	114.9	47%	0.469	61%	0.607	S	S	.	*	H	α-helix	trans	-62.9	-46.9	175	179.4	-100.1	0	0	0	112.2	V240 D241 L242 T247 E248 E249	V240-F245 HydrophobicContact CG1-CB 4.16Å; D241-F245 PolarHBondContact O-N 3.37Å; D241-F245 VanDerWaalsContact O-N 3.07Å; L242-F245 PolarHBondContact O-N 3.4Å; F245-T247 VanDerWaalsContact C-N 3.3Å; F245-T247 PolarHBondContact O-N 3.25Å; F245-E248 PolarHBondContact O-N 2.7Å; F245-E249 WeakPolarHBondContact O-CB 3.29Å; F245-E249 PolarHBondContact O-N 2.7Å
246	I	78.6	Confident	68.6	Low	81 Å²	81	111.4 Å²	111.4	42%	0.415	60%	0.596	S	S	.	*	H	α-helix	trans	-60.5	-41.5	177.9	-68.7	165.4	0	0	0	110.9	L242 M250	L242-I246 HydrophobicContact CD1-CD1 4.2Å; L242-I246 HydrophobicContact CD1-CG1 4.39Å; L242-I246 HydrophobicContact CG-CD1 3.84Å; L242-I246 HydrophobicContact CG-CG1 4.47Å; L242-I246 WeakPolarHBondContact O-CB 3.24Å; L242-I246 WeakPolarHBondContact O-CD1 3.4Å; L242-I246 WeakPolarHBondContact O-CG1 3.38Å; L242-I246 PolarHBondContact O-N 3Å; I246-M250 HydrophobicContact CG2-CG 4.3Å; I246-M250 WeakPolarHBondContact O-CB 3.47Å; I246-M250 WeakPolarHBondContact O-CG 3.45Å; I246-M250 PolarHBondContact O-N 3.22Å
247	T	80.1	Confident	69.1	Low	97 Å²	97	113 Å²	113	60%	0.595	59%	0.593	S	S	*	*	H	α-helix	trans	-68.5	-44.8	-179.3	-54.5	0	0	0	0	111.8	N243 T244 F245 E249 A251	N243-T247 WeakPolarHBondContact O-CB 3.39Å; N243-T247 PolarHBondContact O-N 3.05Å; N243-T247 PolarHBondContact O-OG1 3.18Å; T244-T247 PolarHBondContact O-N 3.09Å; F245-T247 VanDerWaalsContact C-N 3.3Å; F245-T247 PolarHBondContact O-N 3.25Å; T247-E249 VanDerWaalsContact C-N 3.33Å; T247-E249 PolarHBondContact O-N 3.41Å; T247-A251 PolarHBondContact O-N 3.45Å; T247-A251 VanDerWaalsContact O-N 3.15Å
248	E	79.6	Confident	68.7	Low	114 Å²	114	106.4 Å²	106.4	53%	0.533	57%	0.567	S	S	.	*	H	α-helix	trans	-63.7	-38.6	176.8	-83	-168.2	149	0	0	112.2	T244 F245 A251 R252	T244-E248 PolarHBondContact O-N 2.78Å; F245-E248 PolarHBondContact O-N 2.7Å; E248-A251 PolarHBondContact O-N 3.25Å; E248-R252 PolarHBondContact O-N 2.97Å
249	E	81.1	Confident	67.7	Low	72 Å²	72	101.6 Å²	101.6	34%	0.336	56%	0.558	S	S	.	*	H	α-helix	trans	-75	-38.5	-178.3	-153.3	75	136.3	0	0	112.3	F245 T247 A251 R252 H253	F245-E249 WeakPolarHBondContact O-CB 3.29Å; F245-E249 PolarHBondContact O-N 2.7Å; T247-E249 VanDerWaalsContact C-N 3.33Å; T247-E249 PolarHBondContact O-N 3.41Å; E249-A251 VanDerWaalsContact C-N 3.29Å; E249-A251 PolarHBondContact O-N 3.41Å; E249-R252 PolarHBondContact O-N 2.83Å; E249-R252 IonicContact OE2-NH1 3.47Å; E249-R252 PolarHBondContact OE2-NH1 2.77Å; E249-H253 PolarHBondContact O-CD2 2.75Å; E249-H253 VanDerWaalsContact O-CD2 3.32Å; E249-H253 PolarHBondContact O-N 2.84Å
250	M	76.1	Confident	66.9	Low	127 Å²	127	100 Å²	100	63%	0.626	56%	0.555	S	S	*	*	H	α-helix	trans	-61.8	-36.6	173	-72.6	-81.4	-79.1	0	0	112.2	I246 H253 L254	I246-M250 HydrophobicContact CG2-CG 4.3Å; I246-M250 WeakPolarHBondContact O-CB 3.47Å; I246-M250 WeakPolarHBondContact O-CG 3.45Å; I246-M250 PolarHBondContact O-N 3.22Å; M250-H253 PolarHBondContact O-N 3.22Å; M250-L254 WeakPolarHBondContact O-CG 3.43Å; M250-L254 PolarHBondContact O-N 2.79Å
251	A	75.1	Confident	65.7	Low	44 Å²	44	99.4 Å²	99.4	36%	0.364	56%	0.561	S	S	.	*	H	α-helix	trans	-64.3	-40.7	176.5	0	0	0	0	0	112.2	T247 E248 E249 H253 L254 D255	T247-A251 PolarHBondContact O-N 3.45Å; T247-A251 VanDerWaalsContact O-N 3.15Å; E248-A251 PolarHBondContact O-N 3.25Å; E249-A251 VanDerWaalsContact C-N 3.29Å; E249-A251 PolarHBondContact O-N 3.41Å; A251-H253 VanDerWaalsContact C-N 3.3Å; A251-H253 PolarHBondContact O-N 3.16Å; A251-L254 PolarHBondContact O-N 2.86Å; A251-D255 PolarHBondContact O-N 3.29Å; A251-D255 VanDerWaalsContact O-N 3.09Å
252	R	72.6	Confident	64	Low	160 Å²	160	99.7 Å²	99.7	60%	0.604	58%	0.576	S	S	*	*	H	α-helix	trans	-63	-34.4	177.8	-74.7	-173.9	165.4	124.3	6.6	113.6	E248 E249 S256	E248-R252 PolarHBondContact O-N 2.97Å; E249-R252 PolarHBondContact O-N 2.83Å; E249-R252 IonicContact OE2-NH1 3.47Å; E249-R252 PolarHBondContact OE2-NH1 2.77Å; R252-S256 PolarHBondContact O-N 3.03Å
253	H	66.4	Low	62	Low	127 Å²	127	97.8 Å²	97.8	59%	0.588	59%	0.585	S	S	*	*	H	α-helix	trans	-75.7	-29.9	178.8	-81.5	-105.2	0	0	0	113	E249 M250 A251 T257	E249-H253 PolarHBondContact O-CD2 2.75Å; E249-H253 VanDerWaalsContact O-CD2 3.32Å; E249-H253 PolarHBondContact O-N 2.84Å; M250-H253 PolarHBondContact O-N 3.22Å; A251-H253 VanDerWaalsContact C-N 3.3Å; A251-H253 PolarHBondContact O-N 3.16Å; H253-T257 PolarHBondContact O-N 2.66Å; H253-T257 PolarHBondContact O-OG1 3.45Å
254	L	62.5	Low	59.8	Low	118 Å²	118	96.6 Å²	96.6	62%	0.618	60%	0.598	S	S	*	*	H	α-helix	trans	-75.7	-38.6	175.7	-70.4	167.7	0	0	0	112.2	M250 A251 S256 T257 G258	M250-L254 WeakPolarHBondContact O-CG 3.43Å; M250-L254 PolarHBondContact O-N 2.79Å; A251-L254 PolarHBondContact O-N 2.86Å; L254-S256 VanDerWaalsContact C-N 3.33Å; L254-S256 PolarHBondContact O-N 2.92Å; L254-T257 PolarHBondContact O-N 2.98Å; L254-T257 PolarHBondContact O-OG1 2.7Å; L254-T257 VanDerWaalsContact O-OG1 3.14Å; L254-G258 PolarHBondContact O-N 3.27Å
255	D	57.5	Low	57.5	Low	118 Å²	118	97.7 Å²	97.7	63%	0.631	62%	0.623	S	S	*	*	H	α-helix	trans	-70.2	-30.4	177.3	-74.2	-24	0	0	0	112.4	A251 T257 G258 A259	A251-D255 PolarHBondContact O-N 3.29Å; A251-D255 VanDerWaalsContact O-N 3.09Å; D255-T257 VanDerWaalsContact C-N 3.32Å; D255-T257 PolarHBondContact O-N 3.38Å; D255-G258 PolarHBondContact O-N 2.68Å; D255-A259 WeakPolarHBondContact O-CB 3.46Å; D255-A259 PolarHBondContact O-N 2.75Å
256	S	51.3	Low	55	Low	93 Å²	93	96.3 Å²	96.3	65%	0.65	64%	0.638	S	S	*	*	H	α-helix	trans	-68	-30.9	174	-170.2	0	0	0	0	112.8	R252 L254	R252-S256 PolarHBondContact O-N 3.03Å; L254-S256 VanDerWaalsContact C-N 3.33Å; L254-S256 PolarHBondContact O-N 2.92Å
257	T	46.9	Very low	53.3	Low	103 Å²	103	100.2 Å²	100.2	63%	0.632	66%	0.66	S	S	*	*	H	α-helix	trans	-89.8	-20.7	176.3	40.1	0	0	0	0	113.3	H253 L254 D255	H253-T257 PolarHBondContact O-N 2.66Å; H253-T257 PolarHBondContact O-OG1 3.45Å; L254-T257 PolarHBondContact O-N 2.98Å; L254-T257 PolarHBondContact O-OG1 2.7Å; L254-T257 VanDerWaalsContact O-OG1 3.14Å; D255-T257 VanDerWaalsContact C-N 3.32Å; D255-T257 PolarHBondContact O-N 3.38Å
258	G	42.5	Very low	51.3	Low	37 Å²	37	107.2 Å²	107.2	38%	0.381	68%	0.676	S	S	.	*	H	α-helix	trans	-92	-21.1	175.3	0	0	0	0	0	115.6	L254 D255 T260 A261	L254-G258 PolarHBondContact O-N 3.27Å; D255-G258 PolarHBondContact O-N 2.68Å; G258-T260 PolarHBondContact O-N 2.66Å; G258-A261 PolarHBondContact O-N 2.78Å
259	A	37.5	Very low	49.8	Very low	84 Å²	84	111.3 Å²	111.3	69%	0.694	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-6.4	-177.6	0	0	0	0	0	114.8	D255 A261	D255-A259 WeakPolarHBondContact O-CB 3.46Å; D255-A259 PolarHBondContact O-N 2.75Å; A259-A261 VanDerWaalsContact C-N 3.35Å
260	T	38.1	Very low	47.8	Very low	133 Å²	133	118.9 Å²	118.9	82%	0.816	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-1.5	167.4	56.8	0	0	0	0	113.2	G258	G258-T260 PolarHBondContact O-N 2.66Å
261	A	39.8	Very low	45.7	Very low	86 Å²	86	119.5 Å²	119.5	71%	0.711	72%	0.723	S	S	*	*	S	Bend	trans	-131	28	-170.9	0	0	0	0	0	115.2	G258 A259	G258-A261 PolarHBondContact O-N 2.78Å; A259-A261 VanDerWaalsContact C-N 3.35Å
262	A	42.7	Very low	43.9	Very low	97 Å²	97	122.1 Å²	122.1	80%	0.802	74%	0.739	S	S	*	*			trans	-145	88	170.6	0	0	0	0	0	112.6
263	G	30.7	Very low	42.1	Very low	80 Å²	80	120.9 Å²	120.9	83%	0.825	75%	0.75	S	S	*	*	S	Bend	trans	-177.6	90.3	170	0	0	0	0	0	114.7
264	G	29.8	Very low	40.9	Very low	83 Å²	83	123.5 Å²	123.5	86%	0.856	76%	0.762	S	S	*	*			trans	98.1	112.8	148.1	0	0	0	0	0	117.4
265	G	34.3	Very low	39.5	Very low	91 Å²	91	124 Å²	124	94%	0.938	77%	0.774	S	S	*	*			trans	-61.1	157.9	-174.9	0	0	0	0	0	117.6
266	G	32.1	Very low	38.5	Very low	77 Å²	77	123.5 Å²	123.5	79%	0.794	78%	0.78	S	S	*	*			trans	178.4	82.7	172.8	0	0	0	0	0	112.7	R268	G266-R268 PolarHBondContact O-N 2.79Å; G266-R268 VanDerWaalsContact O-N 3.13Å
267	N	42.6	Very low	38	Very low	164 Å²	164	126.4 Å²	126.4	88%	0.877	79%	0.788	S	S	*	*			trans	-53.4	105	178.1	-167.7	40.2	0	0	0	113.3
268	R	38.8	Very low	37.8	Very low	243 Å²	243	127.4 Å²	127.4	92%	0.917	79%	0.793	S	S	*	*			trans	-145.6	89.4	160	-71.4	-168.3	-173.3	158.3	3.7	112.7	G266	G266-R268 PolarHBondContact O-N 2.79Å; G266-R268 VanDerWaalsContact O-N 3.13Å
269	K	48.6	Very low	37.8	Very low	200 Å²	200	132.2 Å²	132.2	87%	0.87	81%	0.809	S	S	*	*			trans	-18.3	118.7	151.7	-154.7	172.4	-178.3	-177.9	0	114.5
270	R	38.1	Very low	38.5	Very low	231 Å²	231	134.3 Å²	134.3	87%	0.872	81%	0.813	S	S	*	*			trans	-154.8	114.3	145.3	-102.9	170.4	-155.5	-177.3	4.8	110.8
271	N	31.3	Very low	38.4	Very low	140 Å²	140	135.7 Å²	135.7	75%	0.749	82%	0.816	S	S	*	*			trans	-7	130.6	164.6	45.3	30.6	0	0	0	120.7
272	S	37.6	Very low	38.4	Very low	100 Å²	100	136.1 Å²	136.1	70%	0.699	81%	0.814	S	S	*	*			trans	-61.8	136.7	153.4	166.1	0	0	0	0	111.7
273	T	34.9	Very low	38.6	Very low	134 Å²	134	137.8 Å²	137.8	82%	0.822	82%	0.816	S	S	*	*			trans	-135.3	107	145.9	39.7	0	0	0	0	108.8
274	Q	42.1	Very low	39.3	Very low	181 Å²	181	140.4 Å²	140.4	85%	0.846	82%	0.817	S	S	*	*			trans	-53.3	135.4	156.1	-71.5	168.9	-19	0	0	109.4
275	C	31.9	Very low	40	Very low	130 Å²	130	145.1 Å²	145.1	88%	0.878	82%	0.816	S	S	*	*			trans	-130.7	129.5	158.2	-86.4	0	0	0	0	109.2
276	S	36.4	Very low	40.9	Very low	107 Å²	107	149.6 Å²	149.6	75%	0.748	81%	0.81	S	S	*	*			trans	-78.5	153.8	-167.4	46.7	0	0	0	0	114.5
277	D	42	Very low	41.9	Very low	154 Å²	154	157.3 Å²	157.3	82%	0.824	82%	0.815	S	S	*	*			trans	-43.9	124	161.6	-154.7	-10.4	0	0	0	114
278	V	41.1	Very low	42.2	Very low	123 Å²	123	156.9 Å²	156.9	75%	0.745	81%	0.812	S	S	*	*			trans	-151.7	100	160.1	-176.7	0	0	0	0	110.5
279	I	43.4	Very low	43	Very low	138 Å²	138	156.4 Å²	156.4	71%	0.708	81%	0.811	S	S	*	*				36.9	115.6	127.8	-54.5	169.7	0	0	0	119
280	T	53.2	Low	43.1	Very low	128 Å²	128	153.3 Å²	153.3	79%	0.785	81%	0.808	S	S	*	*			trans	8.7	126.9	148.4	65.6	0	0	0	0	120.2
281	D	35.5	Very low	43.7	Very low	163 Å²	163	152.8 Å²	152.8	87%	0.872	82%	0.82	S	S	*	*			trans	-148.6	138.1	134.1	-158.1	9.7	0	0	0	111.6
282	S	39.3	Very low	44.3	Very low	95 Å²	95	153.4 Å²	153.4	66%	0.664	82%	0.824	S	S	*	*			trans	-93.8	140.9	-175.7	-65.8	0	0	0	0	111.2	T284	S282-T284 PolarHBondContact O-N 2.98Å
283	P	46.6	Very low	44.6	Very low	132 Å²	132	156.2 Å²	156.2	86%	0.857	83%	0.83	S	S	*	*			trans	-73.6	113.9	178.1	-18.1	32.2	0	0	0	112.8
284	T	46.5	Very low	45.2	Very low	135 Å²	135	157.4 Å²	157.4	83%	0.828	83%	0.831	S	S	*	*			trans	-77.7	121.5	170.3	56.6	0	0	0	0	111.2	S282 K286	S282-T284 PolarHBondContact O-N 2.98Å; T284-K286 PolarHBondContact O-N 3.27Å
285	H	43	Very low	45.4	Very low	182 Å²	182	156.1 Å²	156.1	84%	0.843	83%	0.83	S	S	*	*			trans	-75.5	110.8	175.3	-160.3	-21.1	0	0	0	110.6	R287	H285-R287 PolarHBondContact O-N 3.13Å
286	K	53.6	Low	46.2	Very low	185 Å²	185	157.7 Å²	157.7	80%	0.804	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-75.3	122	165.9	-87.4	-170.5	175.9	-178.5	0	109.6	T284	T284-K286 PolarHBondContact O-N 3.27Å
287	R	54	Low	46.8	Very low	239 Å²	239	161.1 Å²	161.1	90%	0.902	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-78.4	124.9	164.4	-77.4	178.3	164.4	115.6	-3.9	108.5	H285	H285-R287 PolarHBondContact O-N 3.13Å
288	N	49.3	Very low	47.2	Very low	155 Å²	155	161.6 Å²	161.6	83%	0.829	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-83.3	124.1	163.7	-83.7	0.3	0	0	0	109.1
289	R	53.9	Low	47.7	Very low	233 Å²	233	164.5 Å²	164.5	88%	0.879	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-91.2	120	169.5	-160	179.9	-165.9	-130.6	4.3	106.8
290	V	51.4	Low	48	Very low	135 Å²	135	166.8 Å²	166.8	82%	0.818	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-91.8	129.9	171.2	-172.1	0	0	0	0	107.5
291	I	49.8	Very low	47.5	Very low	219 Å²	219	170.3 Å²	170.3	100%	1.123	86%	0.856	S	S	*	*			trans	-89.3	0	164.6	-67.6	171.5	0	0	0	106.7

Retrieved 291 of 291 residues in 142 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).