A0A087XV74_POEFO Loading...

Syntaxin 6

AlphaFold DB , UniProt , Accession A0A087XV74, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 255 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	38.3	Very low	79.1	Confident	244 Å²	244	107.9 Å²	107.9	100%	1.202	57%	0.571	S	S	*	*				0	108.5	0	-75.3	167.1	154.9	0	0	106.2	M3	M1-M3 PolarHBondContact O-N 3.34Å
2	S	56.4	Low	80.3	Confident	123 Å²	123	101.7 Å²	101.7	86%	0.86	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-66.9	119.5	170.2	46.1	0	0	0	0	107.1	E4	S2-E4 PolarHBondContact O-N 3.16Å
3	M	65.8	Low	81.4	Confident	189 Å²	189	102.8 Å²	102.8	93%	0.931	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-57.6	133.3	169.7	-77.7	-175.2	-144.1	0	0	108.1	M1	M1-M3 PolarHBondContact O-N 3.34Å
4	E	76.9	Confident	82.5	Confident	184 Å²	184	95.5 Å²	95.5	86%	0.86	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-60.9	136.4	169.7	-169.3	157.6	-166.2	0	0	108.6	S2 P6	S2-E4 PolarHBondContact O-N 3.16Å; E4-P6 VanDerWaalsContact O-CD 3.31Å; E4-P6 WeakPolarHBondContact O-CD 3.36Å
5	D	84.6	Confident	83.3	Confident	53 Å²	53	95.5 Å²	95.5	28%	0.283	51%	0.508	S	S	.	.			trans	-68.6	114.3	-173	-171.6	-23.3	0	0	0	110	F7 F8 R88	D5-F7 PolarHBondContact O-N 3.47Å; D5-F7 VanDerWaalsContact O-N 3.11Å; D5-F7 WeakPolarHBondContact OD1-CB 3.16Å; D5-F7 PolarHBondContact OD1-N 3.13Å; D5-F8 HydrophobicContact CB-CD2 4.19Å; D5-F8 HydrophobicContact CB-CE2 4.29Å; D5-F8 PolarHBondContact O-N 3.42Å; D5-R88 IonicContact OD1-NH1 3.1Å; D5-R88 IonicContact OD2-CZ 2.78Å; D5-R88 IonicContact OD2-NH1 3.31Å; D5-R88 PolarHBondContact OD2-NH1 3.42Å; D5-R88 IonicContact OD2-NH2 3.45Å; D5-R88 PolarHBondContact OD2-NH2 2.95Å
6	P	88.2	Confident	84.2	Confident	89 Å²	89	99.9 Å²	99.9	58%	0.578	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-15.8	-176.2	28.8	-35.8	0	0	0	112.7	E4 F8 V9 V10	E4-P6 VanDerWaalsContact O-CD 3.31Å; E4-P6 WeakPolarHBondContact O-CD 3.36Å; P6-F8 VanDerWaalsContact C-N 3.25Å; P6-F8 PolarHBondContact O-N 2.97Å; P6-V9 PolarHBondContact O-N 2.99Å; P6-V9 VanDerWaalsContact O-N 3.11Å; P6-V10 PolarHBondContact O-N 2.88Å
7	F	89.9	Confident	84.8	Confident	8 Å²	8	96 Å²	96	4%	0.035	51%	0.507	C	S	.	.	H	α-helix	trans	-51.8	-43.7	178.2	179.4	-87.5	0	0	0	112.4	D5 V9 V10 K11 L64 R88 F91	D5-F7 PolarHBondContact O-N 3.47Å; D5-F7 VanDerWaalsContact O-N 3.11Å; D5-F7 WeakPolarHBondContact OD1-CB 3.16Å; D5-F7 PolarHBondContact OD1-N 3.13Å; F7-V9 VanDerWaalsContact C-N 3.31Å; F7-V9 PolarHBondContact O-N 3.45Å; F7-V10 PolarHBondContact O-N 2.96Å; F7-K11 HydrophobicContact CD1-CB 4.48Å; F7-K11 HydrophobicContact CE1-CB 4.17Å; F7-K11 HydrophobicContact CE1-CD 4.08Å; F7-K11 WeakPolarHBondContact O-CB 3.33Å; F7-K11 PolarHBondContact O-N 3.11Å; F7-L64 HydrophobicContact CD2-CD2 3.63Å; F7-L64 HydrophobicContact CE2-CB 4.49Å; F7-L64 HydrophobicContact CE2-CD2 3.74Å; F7-L64 HydrophobicContact CE2-CG 4.49Å; F7-L64 HydrophobicContact CG-CD2 4.48Å; F7-R88 HydrophobicContact CD1-CG 4.03Å; F7-R88 HydrophobicContact CD2-CG 4.37Å; F7-R88 HydrophobicContact CE1-CB 4.08Å; F7-R88 HydrophobicContact CE1-CG 3.46Å; F7-R88 VanDerWaalsContact CE1-CG 3.46Å; F7-R88 HydrophobicContact CE2-CB 3.8Å; F7-R88 HydrophobicContact CE2-CG 3.83Å; F7-R88 HydrophobicContact CG-CG 4.48Å; F7-R88 HydrophobicContact CZ-CB 3.45Å; F7-R88 VanDerWaalsContact CZ-CB 3.45Å; F7-R88 HydrophobicContact CZ-CG 3.36Å; F7-F91 HydrophobicContact CZ-CD1 4.47Å
8	F	90.1	Very high	85.4	Confident	102 Å²	102	91.4 Å²	91.4	45%	0.447	48%	0.483	S	S	.	.	H	α-helix	trans	-71.4	-27.5	-176	-64.5	-71.6	0	0	0	113.2	D5 P6 G12 E84	D5-F8 HydrophobicContact CB-CD2 4.19Å; D5-F8 HydrophobicContact CB-CE2 4.29Å; D5-F8 PolarHBondContact O-N 3.42Å; P6-F8 VanDerWaalsContact C-N 3.25Å; P6-F8 PolarHBondContact O-N 2.97Å; F8-G12 PolarHBondContact O-N 3.42Å; F8-G12 VanDerWaalsContact O-N 3.14Å; F8-E84 WeakPolarHBondContact CE1-OE1 3.41Å; F8-E84 VanDerWaalsContact CZ-OE1 3.26Å; F8-E84 WeakPolarHBondContact CZ-OE1 3.36Å
9	V	92.8	Very high	85.9	Confident	91 Å²	91	93.5 Å²	93.5	55%	0.552	49%	0.49	S	S	*	.	H	α-helix	trans	-69.4	-52.8	175.2	180	0	0	0	0	109.2	P6 F7 K11 G12 E13	P6-V9 PolarHBondContact O-N 2.99Å; P6-V9 VanDerWaalsContact O-N 3.11Å; F7-V9 VanDerWaalsContact C-N 3.31Å; F7-V9 PolarHBondContact O-N 3.45Å; V9-K11 VanDerWaalsContact C-N 3.31Å; V9-K11 PolarHBondContact O-N 2.91Å; V9-G12 PolarHBondContact O-N 3.26Å; V9-G12 VanDerWaalsContact O-N 3.09Å; V9-E13 PolarHBondContact O-N 3.5Å
10	V	94.3	Very high	86.4	Confident	45 Å²	45	91.2 Å²	91.2	27%	0.273	48%	0.484	S	S	.	.	H	α-helix	trans	-62.3	-41	178.8	-179.1	0	0	0	0	110.6	P6 F7 G12 E13 V14 L64	P6-V10 PolarHBondContact O-N 2.88Å; F7-V10 PolarHBondContact O-N 2.96Å; V10-G12 VanDerWaalsContact C-N 3.31Å; V10-G12 PolarHBondContact O-N 2.97Å; V10-E13 PolarHBondContact O-N 3.47Å; V10-E13 VanDerWaalsContact O-N 3.12Å; V10-V14 HydrophobicContact CG1-CG2 4.28Å; V10-V14 WeakPolarHBondContact O-CG2 3.18Å; V10-V14 PolarHBondContact O-N 2.99Å; V10-L64 HydrophobicContact CB-CD2 3.98Å; V10-L64 HydrophobicContact CG1-CD1 4.13Å; V10-L64 HydrophobicContact CG1-CD2 3.74Å; V10-L64 HydrophobicContact CG1-CG 3.92Å
11	K	93.1	Very high	86.7	Confident	59 Å²	59	87 Å²	87	26%	0.257	46%	0.462	S	S	.	.	H	α-helix	trans	-52.9	-48.2	172.6	179.8	-173.9	171.7	-173.2	0	111.6	F7 V9 E13 V14 E15 F91	F7-K11 HydrophobicContact CD1-CB 4.48Å; F7-K11 HydrophobicContact CE1-CB 4.17Å; F7-K11 HydrophobicContact CE1-CD 4.08Å; F7-K11 WeakPolarHBondContact O-CB 3.33Å; F7-K11 PolarHBondContact O-N 3.11Å; V9-K11 VanDerWaalsContact C-N 3.31Å; V9-K11 PolarHBondContact O-N 2.91Å; K11-E13 VanDerWaalsContact C-N 3.33Å; K11-E13 PolarHBondContact O-N 3.42Å; K11-V14 PolarHBondContact O-N 3.4Å; K11-E15 WeakPolarHBondContact CE-OE1 3.48Å; K11-E15 IonicContact NZ-OE1 2.84Å; K11-E15 WeakPolarHBondContact O-CG 3.39Å; K11-E15 PolarHBondContact O-N 2.95Å; K11-F91 HydrophobicContact CB-CE1 4.33Å; K11-F91 HydrophobicContact CB-CZ 4.48Å; K11-F91 HydrophobicContact CD-CD2 4.46Å; K11-F91 HydrophobicContact CD-CG 4.46Å; K11-F91 HydrophobicContact CG-CD1 4.12Å; K11-F91 HydrophobicContact CG-CD2 4.27Å; K11-F91 HydrophobicContact CG-CE1 3.75Å; K11-F91 HydrophobicContact CG-CE2 3.91Å; K11-F91 HydrophobicContact CG-CG 4.36Å; K11-F91 HydrophobicContact CG-CZ 3.64Å
12	G	93.4	Very high	89.3	Confident	33 Å²	33	79.2 Å²	79.2	34%	0.34	42%	0.423	S	S	.	.	H	α-helix	trans	-65.8	-35	179.2	0	0	0	0	0	113.2	F8 V9 V10 K16	F8-G12 PolarHBondContact O-N 3.42Å; F8-G12 VanDerWaalsContact O-N 3.14Å; V9-G12 PolarHBondContact O-N 3.26Å; V9-G12 VanDerWaalsContact O-N 3.09Å; V10-G12 VanDerWaalsContact C-N 3.31Å; V10-G12 PolarHBondContact O-N 2.97Å; G12-K16 WeakPolarHBondContact O-CB 3.37Å; G12-K16 PolarHBondContact O-N 3.17Å; G12-K16 VanDerWaalsContact O-N 3.09Å
13	E	94.9	Very high	91.1	Very high	117 Å²	117	76.1 Å²	76.1	55%	0.547	40%	0.402	S	S	.	.	H	α-helix	trans	-66.3	-44.7	174	-69.3	179.8	170.3	0	0	111.6	V9 V10 K11 K16 A17	V9-E13 PolarHBondContact O-N 3.5Å; V10-E13 PolarHBondContact O-N 3.47Å; V10-E13 VanDerWaalsContact O-N 3.12Å; K11-E13 VanDerWaalsContact C-N 3.33Å; K11-E13 PolarHBondContact O-N 3.42Å; E13-K16 WeakPolarHBondContact O-CB 3.36Å; E13-K16 PolarHBondContact O-N 3.32Å; E13-A17 WeakPolarHBondContact O-CB 3.47Å; E13-A17 PolarHBondContact O-N 3.3Å
14	V	95.9	Very high	92.2	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-61.1	-47.3	174.6	172.2	0	0	0	0	110.9	V10 K11 K16 A17 V18 I57 D60 L61 L64 F91 T95	V10-V14 HydrophobicContact CG1-CG2 4.28Å; V10-V14 WeakPolarHBondContact O-CG2 3.18Å; V10-V14 PolarHBondContact O-N 2.99Å; K11-V14 PolarHBondContact O-N 3.4Å; V14-K16 VanDerWaalsContact C-N 3.27Å; V14-K16 PolarHBondContact O-N 3.23Å; V14-A17 PolarHBondContact O-N 3.41Å; V14-A17 VanDerWaalsContact O-N 3.15Å; V14-V18 HydrophobicContact CG1-CG2 4.15Å; V14-V18 WeakPolarHBondContact O-CB 3.5Å; V14-V18 WeakPolarHBondContact O-CG2 3.4Å; V14-V18 PolarHBondContact O-N 3.41Å; V14-I57 HydrophobicContact CG1-CG2 4.31Å; V14-D60 HydrophobicContact CG2-CB 3.56Å; V14-L61 HydrophobicContact CG1-CD2 4.15Å; V14-L64 HydrophobicContact CG2-CD1 4.22Å; V14-F91 HydrophobicContact CB-CZ 4.17Å; V14-F91 HydrophobicContact CG1-CE1 4.26Å; V14-F91 HydrophobicContact CG1-CZ 3.83Å; V14-T95 HydrophobicContact CG1-CG2 4.01Å
15	E	95.6	Very high	92.8	Very high	96 Å²	96	61 Å²	61	45%	0.449	33%	0.33	S	S	.	.	H	α-helix	trans	-57.4	-41.5	177.1	-76.8	176.6	162.3	0	0	111.8	K11 H19 F91	K11-E15 WeakPolarHBondContact CE-OE1 3.48Å; K11-E15 IonicContact NZ-OE1 2.84Å; K11-E15 WeakPolarHBondContact O-CG 3.39Å; K11-E15 PolarHBondContact O-N 2.95Å; E15-H19 PolarHBondContact O-N 2.93Å; E15-F91 HydrophobicContact CG-CE2 3.61Å; E15-F91 HydrophobicContact CG-CZ 4.01Å
16	K	96.6	Very high	93	Very high	165 Å²	165	66.4 Å²	66.4	72%	0.717	35%	0.346	S	S	*	.	H	α-helix	trans	-66.5	-43.5	176.4	-175.3	-176.8	176.7	-172.2	0	111.9	G12 E13 V14 H19 A20	G12-K16 WeakPolarHBondContact O-CB 3.37Å; G12-K16 PolarHBondContact O-N 3.17Å; G12-K16 VanDerWaalsContact O-N 3.09Å; E13-K16 WeakPolarHBondContact O-CB 3.36Å; E13-K16 PolarHBondContact O-N 3.32Å; V14-K16 VanDerWaalsContact C-N 3.27Å; V14-K16 PolarHBondContact O-N 3.23Å; K16-H19 PolarHBondContact O-N 3.37Å; K16-A20 PolarHBondContact O-N 2.96Å
17	A	95.4	Very high	93	Very high	34 Å²	34	66.1 Å²	66.1	28%	0.281	33%	0.333	S	S	.	.	H	α-helix	trans	-63.2	-42.6	177.6	0	0	0	0	0	111.3	E13 V14 A20 A21 I57	E13-A17 WeakPolarHBondContact O-CB 3.47Å; E13-A17 PolarHBondContact O-N 3.3Å; V14-A17 PolarHBondContact O-N 3.41Å; V14-A17 VanDerWaalsContact O-N 3.15Å; A17-A20 PolarHBondContact O-N 3.36Å; A17-A21 WeakPolarHBondContact O-CB 3.41Å; A17-A21 PolarHBondContact O-N 3.36Å; A17-I57 HydrophobicContact CB-CD1 4.04Å; A17-I57 HydrophobicContact CB-CG1 3.71Å
18	V	94.4	Very high	92.8	Very high	14 Å²	14	66.4 Å²	66.4	9%	0.085	33%	0.334	C	S	.	.	H	α-helix	trans	-61.6	-45.5	176.1	172.1	0	0	0	0	111	V14 A20 A21 Q22 I57 T95 T98	V14-V18 HydrophobicContact CG1-CG2 4.15Å; V14-V18 WeakPolarHBondContact O-CB 3.5Å; V14-V18 WeakPolarHBondContact O-CG2 3.4Å; V14-V18 PolarHBondContact O-N 3.41Å; V18-A20 VanDerWaalsContact C-N 3.32Å; V18-A20 PolarHBondContact O-N 3.28Å; V18-A21 PolarHBondContact O-N 3.3Å; V18-Q22 HydrophobicContact CG1-CG 4.41Å; V18-Q22 WeakPolarHBondContact O-CB 3.47Å; V18-Q22 VanDerWaalsContact O-CG 3.32Å; V18-Q22 WeakPolarHBondContact O-CG 3.28Å; V18-Q22 PolarHBondContact O-N 2.93Å; V18-I57 HydrophobicContact CG2-CD1 3.97Å; V18-I57 HydrophobicContact CG2-CG1 4.41Å; V18-I57 HydrophobicContact CG2-CG2 3.99Å; V18-T95 HydrophobicContact CG2-CG2 3.46Å; V18-T95 VanDerWaalsContact CG2-CG2 3.46Å; V18-T98 HydrophobicContact CG1-CG2 4.35Å
19	H	95.8	Very high	92.5	Very high	131 Å²	131	63.7 Å²	63.7	61%	0.606	33%	0.326	S	S	*	.	H	α-helix	trans	-61.6	-40.7	176.7	-177.7	-81.7	0	0	0	112	E15 K16 Q22 S23	E15-H19 PolarHBondContact O-N 2.93Å; K16-H19 PolarHBondContact O-N 3.37Å; H19-Q22 PolarHBondContact O-N 3.39Å; H19-S23 PolarHBondContact O-N 2.84Å
20	A	95.4	Very high	92	Very high	46 Å²	46	63.5 Å²	63.5	38%	0.38	32%	0.319	S	S	.	.	H	α-helix	trans	-63.8	-44.3	174.6	0	0	0	0	0	111.6	K16 A17 V18 Q22 S23 L24	K16-A20 PolarHBondContact O-N 2.96Å; A17-A20 PolarHBondContact O-N 3.36Å; V18-A20 VanDerWaalsContact C-N 3.32Å; V18-A20 PolarHBondContact O-N 3.28Å; A20-Q22 PolarHBondContact O-N 3.46Å; A20-S23 PolarHBondContact O-N 2.77Å; A20-S23 PolarHBondContact O-OG 2.98Å; A20-L24 PolarHBondContact O-N 2.9Å
21	A	93.7	Very high	91.3	Very high	3 Å²	3	61.8 Å²	61.8	3%	0.025	31%	0.308	C	S	.	.	H	α-helix	trans	-61.1	-41.8	175.3	0	0	0	0	0	111.9	A17 V18 S23 L24 H25 L50 L54 I57 M102	A17-A21 WeakPolarHBondContact O-CB 3.41Å; A17-A21 PolarHBondContact O-N 3.36Å; V18-A21 PolarHBondContact O-N 3.3Å; A21-S23 VanDerWaalsContact C-N 3.34Å; A21-S23 PolarHBondContact O-N 3.41Å; A21-L24 PolarHBondContact O-N 2.9Å; A21-H25 VanDerWaalsContact O-CB 3.31Å; A21-H25 WeakPolarHBondContact O-CB 3.29Å; A21-H25 PolarHBondContact O-N 3.34Å; A21-L50 HydrophobicContact CB-CD1 4.14Å; A21-L50 WeakPolarHBondContact O-CD1 3.33Å; A21-L54 HydrophobicContact CB-CD2 4.17Å; A21-I57 HydrophobicContact CB-CD1 3.99Å; A21-M102 HydrophobicContact CB-CE 4.27Å
22	Q	93	Very high	90.3	Very high	81 Å²	81	63.3 Å²	63.3	38%	0.379	32%	0.316	S	S	.	.	H	α-helix	trans	-62.2	-39.7	175.3	-74.9	176.1	-20.4	0	0	112.5	V18 H19 A20 H25 R26 M102	V18-Q22 HydrophobicContact CG1-CG 4.41Å; V18-Q22 WeakPolarHBondContact O-CB 3.47Å; V18-Q22 VanDerWaalsContact O-CG 3.32Å; V18-Q22 WeakPolarHBondContact O-CG 3.28Å; V18-Q22 PolarHBondContact O-N 2.93Å; H19-Q22 PolarHBondContact O-N 3.39Å; A20-Q22 PolarHBondContact O-N 3.46Å; Q22-H25 PolarHBondContact O-N 2.97Å; Q22-R26 PolarHBondContact O-N 3.47Å; Q22-M102 HydrophobicContact CG-CE 4.36Å; Q22-M102 HydrophobicContact CG-SD 4.11Å
23	S	93	Very high	89.1	Confident	59 Å²	59	68.6 Å²	68.6	41%	0.413	33%	0.332	S	S	.	.	H	α-helix	trans	-65.6	-41	174.5	66	0	0	0	0	112.6	H19 A20 A21 H25 R26 R27	H19-S23 PolarHBondContact O-N 2.84Å; A20-S23 PolarHBondContact O-N 2.77Å; A20-S23 PolarHBondContact O-OG 2.98Å; A21-S23 VanDerWaalsContact C-N 3.34Å; A21-S23 PolarHBondContact O-N 3.41Å; S23-H25 VanDerWaalsContact C-N 3.35Å; S23-R26 PolarHBondContact O-N 3.12Å; S23-R27 PolarHBondContact O-N 2.92Å; S23-R27 VanDerWaalsContact O-N 3.09Å
24	L	90.1	Very high	87.9	Confident	34 Å²	34	67.6 Å²	67.6	18%	0.178	33%	0.328	C	S	.	.	H	α-helix	trans	-65.9	-40	176	-77.9	169.5	0	0	0	111	A20 A21 R27 W28 W45 T46 E49 L50	A20-L24 PolarHBondContact O-N 2.9Å; A21-L24 PolarHBondContact O-N 2.9Å; L24-R27 PolarHBondContact O-N 3.15Å; L24-W28 VanDerWaalsContact O-CB 3.31Å; L24-W28 WeakPolarHBondContact O-CB 3.46Å; L24-W28 PolarHBondContact O-N 3.41Å; L24-W45 HydrophobicContact CD2-CH2 4.43Å; L24-W45 HydrophobicContact CD2-CZ3 4.17Å; L24-T46 HydrophobicContact CD2-CG2 4.41Å; L24-E49 HydrophobicContact CD1-CB 4.41Å; L24-E49 HydrophobicContact CD1-CG 3.77Å; L24-E49 HydrophobicContact CD2-CG 4.46Å; L24-L50 HydrophobicContact CB-CB 4.37Å; L24-L50 HydrophobicContact CB-CD1 4.12Å
25	H	88.5	Confident	85.6	Confident	21 Å²	21	73.3 Å²	73.3	10%	0.097	36%	0.362	C	S	.	.	H	α-helix	trans	-63.1	-43.4	175.6	178.8	-96.7	0	0	0	111.8	A21 Q22 S23 R27 W28 V29 L50 M102 Q105	A21-H25 VanDerWaalsContact O-CB 3.31Å; A21-H25 WeakPolarHBondContact O-CB 3.29Å; A21-H25 PolarHBondContact O-N 3.34Å; Q22-H25 PolarHBondContact O-N 2.97Å; S23-H25 VanDerWaalsContact C-N 3.35Å; H25-R27 PolarHBondContact O-N 3.42Å; H25-W28 WeakPolarHBondContact O-CB 3.4Å; H25-W28 PolarHBondContact O-N 3.06Å; H25-V29 WeakPolarHBondContact O-CG2 3.48Å; H25-V29 PolarHBondContact O-N 2.92Å; H25-L50 HydrophobicContact CB-CD1 4.2Å; H25-L50 HydrophobicContact CB-CD2 3.96Å; H25-M102 HydrophobicContact CB-CG 4.24Å; H25-M102 HydrophobicContact CB-SD 3.76Å; H25-Q105 PolarHBondContact CE1-OE1 2.93Å; H25-Q105 PolarHBondContact NE2-OE1 3.4Å
26	R	89	Confident	83.7	Confident	167 Å²	167	72.9 Å²	72.9	63%	0.63	38%	0.383	S	S	*	.	H	α-helix	trans	-59.5	-46.7	174.1	-172	-177.2	-59.3	149.9	5.6	111.5	Q22 S23 W28 V29 E30	Q22-R26 PolarHBondContact O-N 3.47Å; S23-R26 PolarHBondContact O-N 3.12Å; R26-W28 VanDerWaalsContact C-N 3.31Å; R26-W28 PolarHBondContact O-N 3.48Å; R26-V29 PolarHBondContact O-N 3.11Å; R26-E30 WeakPolarHBondContact O-CG 3.48Å; R26-E30 PolarHBondContact O-N 3.43Å
27	R	88.2	Confident	81.5	Confident	83 Å²	83	68 Å²	68	31%	0.313	38%	0.38	S	S	.	.	H	α-helix	trans	-60.7	-42.9	176	-179.1	57.4	176.2	165.1	3.6	111.3	S23 L24 H25 V29 E30 L31 E42 T46	S23-R27 PolarHBondContact O-N 2.92Å; S23-R27 VanDerWaalsContact O-N 3.09Å; L24-R27 PolarHBondContact O-N 3.15Å; H25-R27 PolarHBondContact O-N 3.42Å; R27-V29 PolarHBondContact O-N 3.24Å; R27-E30 IonicContact NH1-OE2 2.83Å; R27-E30 PolarHBondContact NH1-OE2 3.38Å; R27-E30 WeakPolarHBondContact O-CB 3.37Å; R27-E30 PolarHBondContact O-N 3.14Å; R27-L31 HydrophobicContact CG-CD1 4.07Å; R27-L31 HydrophobicContact CG-CG 4.42Å; R27-L31 VanDerWaalsContact O-CG 3.27Å; R27-L31 WeakPolarHBondContact O-CG 3.49Å; R27-L31 PolarHBondContact O-N 3.2Å; R27-E42 IonicContact CZ-OE1 3.68Å; R27-E42 VanDerWaalsContact CZ-OE1 3.31Å; R27-E42 IonicContact NE-OE1 3.73Å; R27-E42 PolarHBondContact NE-OE1 2.85Å; R27-E42 VanDerWaalsContact NE-OE1 3.1Å; R27-E42 IonicContact NH2-OE1 2.64Å; R27-E42 PolarHBondContact NH2-OE1 3.24Å; R27-E42 IonicContact NH2-OE2 2.72Å; R27-T46 HydrophobicContact CG-CG2 4.38Å
28	W	86.1	Confident	79.7	Confident	14 Å²	14	67.9 Å²	67.9	5%	0.053	38%	0.379	C	S	.	.	H	α-helix	trans	-58.5	-46.8	175.8	179.7	84.9	0	0	0	111.4	L24 H25 R26 E30 L31 Q32 T46 T47 L50 M106	L24-W28 VanDerWaalsContact O-CB 3.31Å; L24-W28 WeakPolarHBondContact O-CB 3.46Å; L24-W28 PolarHBondContact O-N 3.41Å; H25-W28 WeakPolarHBondContact O-CB 3.4Å; H25-W28 PolarHBondContact O-N 3.06Å; R26-W28 VanDerWaalsContact C-N 3.31Å; R26-W28 PolarHBondContact O-N 3.48Å; W28-E30 VanDerWaalsContact C-N 3.34Å; W28-E30 PolarHBondContact O-N 3.5Å; W28-L31 PolarHBondContact O-N 3.12Å; W28-Q32 HydrophobicContact CD2-CG 4.23Å; W28-Q32 HydrophobicContact CE3-CG 4.49Å; W28-Q32 HydrophobicContact CH2-CG 4.24Å; W28-Q32 HydrophobicContact CZ2-CG 3.99Å; W28-Q32 VanDerWaalsContact CZ2-NE2 3.3Å; W28-Q32 HydrophobicContact CZ3-CG 4.5Å; W28-Q32 WeakPolarHBondContact O-CG 3.28Å; W28-Q32 PolarHBondContact O-N 2.92Å; W28-Q32 VanDerWaalsContact O-N 3.1Å; W28-T46 HydrophobicContact CB-CG2 3.94Å; W28-T47 VanDerWaalsContact CD1-OG1 3.3Å; W28-T47 PolarHBondContact NE1-OG1 3.29Å; W28-T47 VanDerWaalsContact NE1-OG1 3.14Å; W28-L50 HydrophobicContact CB-CD2 4.23Å; W28-L50 HydrophobicContact CG-CD2 4.34Å; W28-M106 HydrophobicContact CD2-CG 4.39Å; W28-M106 HydrophobicContact CE3-CG 4.29Å; W28-M106 HydrophobicContact CH2-CB 4.32Å; W28-M106 HydrophobicContact CH2-CG 4.07Å; W28-M106 HydrophobicContact CZ2-CB 4.39Å; W28-M106 HydrophobicContact CZ2-CG 4.11Å; W28-M106 HydrophobicContact CZ3-CG 4.14Å
29	V	82.9	Confident	78.3	Confident	45 Å²	45	70.2 Å²	70.2	27%	0.273	40%	0.396	S	S	.	.	H	α-helix	trans	-60.3	-41.7	176.5	172.8	0	0	0	0	111.9	H25 R26 R27 Q32 Q33	H25-V29 WeakPolarHBondContact O-CG2 3.48Å; H25-V29 PolarHBondContact O-N 2.92Å; R26-V29 PolarHBondContact O-N 3.11Å; R27-V29 PolarHBondContact O-N 3.24Å; V29-Q32 PolarHBondContact O-N 3.22Å; V29-Q33 WeakPolarHBondContact O-CG 3.4Å; V29-Q33 PolarHBondContact O-N 3.05Å
30	E	83.3	Confident	76.9	Confident	87 Å²	87	68.7 Å²	68.7	41%	0.407	39%	0.385	S	S	.	.	H	α-helix	trans	-61.4	-46.4	175.8	-70.4	167.7	-171	0	0	111.7	R26 R27 W28 Q32 Q33 E34	R26-E30 WeakPolarHBondContact O-CG 3.48Å; R26-E30 PolarHBondContact O-N 3.43Å; R27-E30 IonicContact NH1-OE2 2.83Å; R27-E30 PolarHBondContact NH1-OE2 3.38Å; R27-E30 WeakPolarHBondContact O-CB 3.37Å; R27-E30 PolarHBondContact O-N 3.14Å; W28-E30 VanDerWaalsContact C-N 3.34Å; W28-E30 PolarHBondContact O-N 3.5Å; E30-Q32 PolarHBondContact O-N 3.33Å; E30-Q33 PolarHBondContact O-N 2.79Å; E30-E34 PolarHBondContact O-N 3.36Å; E30-E34 VanDerWaalsContact O-N 3.1Å
31	L	78.6	Confident	76.1	Confident	8 Å²	8	74 Å²	74	4%	0.042	40%	0.402	C	S	.	.	H	α-helix	trans	-61.7	-32.2	179.3	-68.9	169.8	0	0	0	112.2	R27 W28 Q33 A38 E42 T46	R27-L31 HydrophobicContact CG-CD1 4.07Å; R27-L31 HydrophobicContact CG-CG 4.42Å; R27-L31 VanDerWaalsContact O-CG 3.27Å; R27-L31 WeakPolarHBondContact O-CG 3.49Å; R27-L31 PolarHBondContact O-N 3.2Å; W28-L31 PolarHBondContact O-N 3.12Å; L31-Q33 VanDerWaalsContact C-N 3.32Å; L31-A38 HydrophobicContact CD2-CB 3.53Å; L31-E42 HydrophobicContact CD1-CG 4.27Å; L31-E42 HydrophobicContact CD2-CG 4.5Å; L31-T46 HydrophobicContact CD1-CG2 4.26Å
32	Q	73.2	Confident	75.5	Confident	91 Å²	91	77.1 Å²	77.1	43%	0.425	42%	0.416	S	S	.	.	H	α-helix	trans	-74.6	-20.7	175.6	-61.2	-65.1	29.8	0	0	113.6	W28 V29 E30	W28-Q32 HydrophobicContact CD2-CG 4.23Å; W28-Q32 HydrophobicContact CE3-CG 4.49Å; W28-Q32 HydrophobicContact CH2-CG 4.24Å; W28-Q32 HydrophobicContact CZ2-CG 3.99Å; W28-Q32 VanDerWaalsContact CZ2-NE2 3.3Å; W28-Q32 HydrophobicContact CZ3-CG 4.5Å; W28-Q32 WeakPolarHBondContact O-CG 3.28Å; W28-Q32 PolarHBondContact O-N 2.92Å; W28-Q32 VanDerWaalsContact O-N 3.1Å; V29-Q32 PolarHBondContact O-N 3.22Å; E30-Q32 PolarHBondContact O-N 3.33Å
33	Q	67.9	Low	74.8	Confident	144 Å²	144	74.4 Å²	74.4	67%	0.673	41%	0.407	S	S	*	.	H	α-helix	trans	-91.3	-22.5	178.1	-67.3	179.4	20.5	0	0	112.7	V29 E30 L31 V35	V29-Q33 WeakPolarHBondContact O-CG 3.4Å; V29-Q33 PolarHBondContact O-N 3.05Å; E30-Q33 PolarHBondContact O-N 2.79Å; L31-Q33 VanDerWaalsContact C-N 3.32Å; Q33-V35 PolarHBondContact O-N 2.98Å
34	E	68.3	Low	74.1	Confident	97 Å²	97	75.4 Å²	75.4	45%	0.453	41%	0.408	S	S	.	.			trans	-70.3	91.9	174.9	-80.4	-171.5	165.6	0	0	111.6	E30 G36	E30-E34 PolarHBondContact O-N 3.36Å; E30-E34 VanDerWaalsContact O-N 3.1Å; E34-G36 VanDerWaalsContact C-N 3.35Å; E34-G36 PolarHBondContact O-N 3.25Å
35	V	49.2	Very low	73.9	Confident	119 Å²	119	80.8 Å²	80.8	72%	0.721	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	90.5	171	-177.1	0	0	0	0	109.1	Q33	Q33-V35 PolarHBondContact O-N 2.98Å
36	G	54.9	Low	73.7	Confident	87 Å²	87	79.9 Å²	79.9	90%	0.897	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.7	17.7	164.2	0	0	0	0	0	117.9	E34	E34-G36 VanDerWaalsContact C-N 3.35Å; E34-G36 PolarHBondContact O-N 3.25Å
37	G	50.3	Low	73.5	Confident	62 Å²	62	73.3 Å²	73.3	64%	0.639	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.3	-29.3	-177.3	0	0	0	0	0	116.7	S39	G37-S39 PolarHBondContact O-N 3.26Å
38	A	58.7	Low	73.4	Confident	32 Å²	32	73.7 Å²	73.7	26%	0.264	41%	0.408	S	S	.	.	S	Bend	trans	-66.9	130.7	-179.2	0	0	0	0	0	111.6	L31 R40	L31-A38 HydrophobicContact CD2-CB 3.53Å; A38-R40 PolarHBondContact O-N 3.17Å
39	S	64.8	Low	73.6	Confident	64 Å²	64	76.7 Å²	76.7	45%	0.448	42%	0.423	S	S	.	.			trans	-61.3	125.3	170.1	-172.9	0	0	0	0	108.2	G37 E41 E42 A43	G37-S39 PolarHBondContact O-N 3.26Å; S39-E41 PolarHBondContact O-N 2.66Å; S39-E42 WeakPolarHBondContact O-CA 3.44Å; S39-E42 VanDerWaalsContact O-CB 3.3Å; S39-E42 WeakPolarHBondContact O-CB 3.16Å; S39-E42 PolarHBondContact O-N 2.91Å; S39-A43 PolarHBondContact O-N 3.41Å
40	R	66.4	Low	73.9	Confident	99 Å²	99	74.6 Å²	74.6	37%	0.374	41%	0.41	S	S	.	.	H	α-helix	trans	-48.9	-37.5	179.3	178.3	172.9	174	171	2.4	112.1	A38 E42 A43 D44	A38-R40 PolarHBondContact O-N 3.17Å; R40-E42 VanDerWaalsContact C-N 3.35Å; R40-E42 PolarHBondContact O-N 3.09Å; R40-A43 PolarHBondContact O-N 2.85Å; R40-D44 PolarHBondContact O-N 2.9Å; R40-D44 VanDerWaalsContact O-N 3.16Å
41	E	77.3	Confident	74.1	Confident	156 Å²	156	71.2 Å²	71.2	73%	0.729	39%	0.394	S	S	*	.	H	α-helix	trans	-65.9	-34.2	177	-62.8	175.1	176	0	0	112.9	S39 W45	S39-E41 PolarHBondContact O-N 2.66Å; E41-W45 WeakPolarHBondContact O-CB 3.33Å; E41-W45 PolarHBondContact O-N 3.33Å
42	E	81.9	Confident	74.6	Confident	70 Å²	70	73.7 Å²	73.7	33%	0.327	41%	0.407	S	S	.	.	H	α-helix	trans	-72.2	-40	178.8	-170.6	-177.3	173.1	0	0	111.4	R27 L31 S39 R40 T46	R27-E42 IonicContact CZ-OE1 3.68Å; R27-E42 VanDerWaalsContact CZ-OE1 3.31Å; R27-E42 IonicContact NE-OE1 3.73Å; R27-E42 PolarHBondContact NE-OE1 2.85Å; R27-E42 VanDerWaalsContact NE-OE1 3.1Å; R27-E42 IonicContact NH2-OE1 2.64Å; R27-E42 PolarHBondContact NH2-OE1 3.24Å; R27-E42 IonicContact NH2-OE2 2.72Å; L31-E42 HydrophobicContact CD1-CG 4.27Å; L31-E42 HydrophobicContact CD2-CG 4.5Å; S39-E42 WeakPolarHBondContact O-CA 3.44Å; S39-E42 VanDerWaalsContact O-CB 3.3Å; S39-E42 WeakPolarHBondContact O-CB 3.16Å; S39-E42 PolarHBondContact O-N 2.91Å; R40-E42 VanDerWaalsContact C-N 3.35Å; R40-E42 PolarHBondContact O-N 3.09Å; E42-T46 VanDerWaalsContact O-CB 3.26Å; E42-T46 WeakPolarHBondContact O-CB 3.45Å; E42-T46 PolarHBondContact O-N 3.12Å; E42-T46 PolarHBondContact O-OG1 2.91Å
43	A	78.4	Confident	75.6	Confident	23 Å²	23	70.5 Å²	70.5	19%	0.19	40%	0.399	C	S	.	.	H	α-helix	trans	-65	-43.8	175.9	0	0	0	0	0	111.8	S39 R40 T47	S39-A43 PolarHBondContact O-N 3.41Å; R40-A43 PolarHBondContact O-N 2.85Å; A43-T47 WeakPolarHBondContact O-CB 3.26Å; A43-T47 PolarHBondContact O-N 3.25Å; A43-T47 PolarHBondContact O-OG1 3.48Å
44	D	78.1	Confident	76.7	Confident	80 Å²	80	63.7 Å²	63.7	43%	0.428	37%	0.367	S	S	.	.	H	α-helix	trans	-65.6	-45.6	177.4	-72.8	-17.8	0	0	0	111.2	R40 T47 N48	R40-D44 PolarHBondContact O-N 2.9Å; R40-D44 VanDerWaalsContact O-N 3.16Å; D44-T47 PolarHBondContact O-N 3.29Å; D44-N48 WeakPolarHBondContact O-CB 3.45Å; D44-N48 PolarHBondContact O-N 2.83Å
45	W	85.4	Confident	77.8	Confident	147 Å²	147	62.3 Å²	62.3	56%	0.557	36%	0.357	S	S	*	.	H	α-helix	trans	-61	-49.4	176.8	-179.7	86.3	0	0	0	111.8	L24 E41 T47 N48 E49	L24-W45 HydrophobicContact CD2-CH2 4.43Å; L24-W45 HydrophobicContact CD2-CZ3 4.17Å; E41-W45 WeakPolarHBondContact O-CB 3.33Å; E41-W45 PolarHBondContact O-N 3.33Å; W45-T47 VanDerWaalsContact C-N 3.31Å; W45-T47 PolarHBondContact O-N 3.47Å; W45-N48 PolarHBondContact O-N 2.76Å; W45-E49 HydrophobicContact CH2-CB 4.47Å; W45-E49 HydrophobicContact CH2-CG 4.2Å; W45-E49 HydrophobicContact CZ2-CB 4.38Å; W45-E49 HydrophobicContact CZ2-CG 4.15Å; W45-E49 WeakPolarHBondContact O-CB 3.4Å; W45-E49 PolarHBondContact O-N 2.97Å
46	T	85.8	Confident	79.9	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.012	34%	0.341	C	S	.	.	H	α-helix	trans	-61.6	-41.2	-179.2	-55.7	0	0	0	0	111	L24 R27 W28 L31 E42 L50	L24-T46 HydrophobicContact CD2-CG2 4.41Å; R27-T46 HydrophobicContact CG-CG2 4.38Å; W28-T46 HydrophobicContact CB-CG2 3.94Å; L31-T46 HydrophobicContact CD1-CG2 4.26Å; E42-T46 VanDerWaalsContact O-CB 3.26Å; E42-T46 WeakPolarHBondContact O-CB 3.45Å; E42-T46 PolarHBondContact O-N 3.12Å; E42-T46 PolarHBondContact O-OG1 2.91Å; T46-L50 VanDerWaalsContact O-CB 3.24Å; T46-L50 WeakPolarHBondContact O-CB 3.44Å; T46-L50 PolarHBondContact O-N 3.49Å
47	T	84	Confident	81.7	Confident	30 Å²	30	55.1 Å²	55.1	18%	0.184	30%	0.299	C	S	.	.	H	α-helix	trans	-64	-45.9	177.1	-58.9	0	0	0	0	111.3	W28 A43 D44 W45 R51 M106	W28-T47 VanDerWaalsContact CD1-OG1 3.3Å; W28-T47 PolarHBondContact NE1-OG1 3.29Å; W28-T47 VanDerWaalsContact NE1-OG1 3.14Å; A43-T47 WeakPolarHBondContact O-CB 3.26Å; A43-T47 PolarHBondContact O-N 3.25Å; A43-T47 PolarHBondContact O-OG1 3.48Å; D44-T47 PolarHBondContact O-N 3.29Å; W45-T47 VanDerWaalsContact C-N 3.31Å; W45-T47 PolarHBondContact O-N 3.47Å; T47-R51 WeakPolarHBondContact O-CD 2.95Å; T47-R51 WeakPolarHBondContact O-CG 3.43Å; T47-R51 PolarHBondContact O-N 3.1Å; T47-R51 VanDerWaalsContact O-N 3.14Å; T47-M106 HydrophobicContact CG2-CE 4.05Å
48	N	85.8	Confident	83.7	Confident	90 Å²	90	53.9 Å²	53.9	48%	0.481	28%	0.276	S	S	.	.	H	α-helix	trans	-66.9	-43.7	-179.9	-175.5	61.6	0	0	0	112.2	D44 W45 R51 N52	D44-N48 WeakPolarHBondContact O-CB 3.45Å; D44-N48 PolarHBondContact O-N 2.83Å; W45-N48 PolarHBondContact O-N 2.76Å; N48-R51 PolarHBondContact O-N 2.76Å; N48-N52 PolarHBondContact ND2-ND2 3.08Å; N48-N52 VanDerWaalsContact O-CG 3.31Å; N48-N52 PolarHBondContact O-N 3.3Å; N48-N52 PolarHBondContact O-ND2 3.36Å
49	E	90.1	Very high	85.3	Confident	78 Å²	78	59.6 Å²	59.6	36%	0.364	29%	0.291	S	S	.	.	H	α-helix	trans	-63.2	-46.1	179.5	-169.9	62	-161.8	0	0	111.3	L24 W45 R51 N52 G53	L24-E49 HydrophobicContact CD1-CB 4.41Å; L24-E49 HydrophobicContact CD1-CG 3.77Å; L24-E49 HydrophobicContact CD2-CG 4.46Å; W45-E49 HydrophobicContact CH2-CB 4.47Å; W45-E49 HydrophobicContact CH2-CG 4.2Å; W45-E49 HydrophobicContact CZ2-CB 4.38Å; W45-E49 HydrophobicContact CZ2-CG 4.15Å; W45-E49 WeakPolarHBondContact O-CB 3.4Å; W45-E49 PolarHBondContact O-N 2.97Å; E49-R51 VanDerWaalsContact C-N 3.3Å; E49-R51 PolarHBondContact O-N 2.67Å; E49-N52 PolarHBondContact O-N 3.37Å; E49-G53 PolarHBondContact O-N 3.28Å
50	L	89.1	Confident	86.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.4	-43.9	176.1	179.4	55.7	0	0	0	111.2	A21 L24 H25 W28 T46 N52 G53 L54 M106	A21-L50 HydrophobicContact CB-CD1 4.14Å; A21-L50 WeakPolarHBondContact O-CD1 3.33Å; L24-L50 HydrophobicContact CB-CB 4.37Å; L24-L50 HydrophobicContact CB-CD1 4.12Å; H25-L50 HydrophobicContact CB-CD1 4.2Å; H25-L50 HydrophobicContact CB-CD2 3.96Å; W28-L50 HydrophobicContact CB-CD2 4.23Å; W28-L50 HydrophobicContact CG-CD2 4.34Å; T46-L50 VanDerWaalsContact O-CB 3.24Å; T46-L50 WeakPolarHBondContact O-CB 3.44Å; T46-L50 PolarHBondContact O-N 3.49Å; L50-N52 PolarHBondContact O-N 3.32Å; L50-G53 PolarHBondContact O-N 3.12Å; L50-L54 HydrophobicContact CD1-CD1 4.05Å; L50-L54 HydrophobicContact CD1-CD2 4.39Å; L50-L54 HydrophobicContact CD1-CG 4.05Å; L50-L54 HydrophobicContact CG-CD1 4.03Å; L50-L54 HydrophobicContact CG-CG 4.45Å; L50-L54 WeakPolarHBondContact O-CG 3.22Å; L50-L54 PolarHBondContact O-N 3.21Å; L50-M106 HydrophobicContact CB-CE 4.38Å; L50-M106 HydrophobicContact CD2-CE 3.77Å; L50-M106 HydrophobicContact CD2-CG 4.3Å; L50-M106 HydrophobicContact CD2-SD 3.39Å; L50-M106 WeakPolarHBondContact CD2-SD 3.43Å; L50-M106 HydrophobicContact CG-CE 4.09Å; L50-M106 HydrophobicContact CG-SD 3.73Å
51	R	87.8	Confident	88	Confident	16 Å²	16	54.2 Å²	54.2	6%	0.06	27%	0.265	C	S	.	.	H	α-helix	trans	-64.7	-40.3	178.8	-69.4	170.5	73.1	101.2	19.7	112.9	T47 N48 E49 R55 M106 T179	T47-R51 WeakPolarHBondContact O-CD 2.95Å; T47-R51 WeakPolarHBondContact O-CG 3.43Å; T47-R51 PolarHBondContact O-N 3.1Å; T47-R51 VanDerWaalsContact O-N 3.14Å; N48-R51 PolarHBondContact O-N 2.76Å; E49-R51 VanDerWaalsContact C-N 3.3Å; E49-R51 PolarHBondContact O-N 2.67Å; R51-R55 WeakPolarHBondContact O-CB 3.37Å; R51-R55 PolarHBondContact O-N 3Å; R51-M106 HydrophobicContact CG-CE 3.75Å; R51-T179 PolarHBondContact NH1-O 3.31Å; R51-T179 PolarHBondContact NH2-O 3.01Å
52	N	89.9	Confident	88.8	Confident	60 Å²	60	51.1 Å²	51.1	32%	0.321	25%	0.25	S	S	.	.	H	α-helix	trans	-67.6	-40.9	177.1	-68.8	-25.1	0	0	0	111.1	N48 E49 L50 R55 S56	N48-N52 PolarHBondContact ND2-ND2 3.08Å; N48-N52 VanDerWaalsContact O-CG 3.31Å; N48-N52 PolarHBondContact O-N 3.3Å; N48-N52 PolarHBondContact O-ND2 3.36Å; E49-N52 PolarHBondContact O-N 3.37Å; L50-N52 PolarHBondContact O-N 3.32Å; N52-R55 PolarHBondContact O-N 2.66Å; N52-R55 PolarHBondContact OD1-NH1 3.27Å; N52-S56 PolarHBondContact O-N 2.94Å
53	G	92.9	Very high	89.3	Confident	24 Å²	24	52.4 Å²	52.4	25%	0.247	26%	0.259	C	S	.	.	H	α-helix	trans	-59.4	-49.6	173.6	0	0	0	0	0	112.5	E49 L50 R55 S56 I57	E49-G53 PolarHBondContact O-N 3.28Å; L50-G53 PolarHBondContact O-N 3.12Å; G53-R55 VanDerWaalsContact C-N 3.33Å; G53-R55 PolarHBondContact O-N 3.24Å; G53-S56 PolarHBondContact O-N 3.35Å; G53-I57 WeakPolarHBondContact O-CD1 3.31Å; G53-I57 VanDerWaalsContact O-CG1 3.3Å; G53-I57 WeakPolarHBondContact O-CG1 3.38Å; G53-I57 PolarHBondContact O-N 2.91Å
54	L	92.1	Very high	90	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-60.9	-40.8	178.2	-64.6	171.8	0	0	0	112	A21 L50 I57 E58 V99 M102 K103 M106	A21-L54 HydrophobicContact CB-CD2 4.17Å; L50-L54 HydrophobicContact CD1-CD1 4.05Å; L50-L54 HydrophobicContact CD1-CD2 4.39Å; L50-L54 HydrophobicContact CD1-CG 4.05Å; L50-L54 HydrophobicContact CG-CD1 4.03Å; L50-L54 HydrophobicContact CG-CG 4.45Å; L50-L54 WeakPolarHBondContact O-CG 3.22Å; L50-L54 PolarHBondContact O-N 3.21Å; L54-I57 PolarHBondContact O-N 3.1Å; L54-E58 WeakPolarHBondContact O-CG 3.45Å; L54-E58 PolarHBondContact O-N 3.36Å; L54-V99 HydrophobicContact CB-CG1 4.42Å; L54-V99 HydrophobicContact CD2-CB 4.49Å; L54-V99 HydrophobicContact CD2-CG1 4.1Å; L54-V99 HydrophobicContact CD2-CG2 4.3Å; L54-M102 HydrophobicContact CD1-CB 4.39Å; L54-M102 HydrophobicContact CD2-CB 4.34Å; L54-M102 HydrophobicContact CD2-CE 3.49Å; L54-M102 VanDerWaalsContact CD2-CE 3.49Å; L54-M102 HydrophobicContact CD2-SD 4.27Å; L54-K103 HydrophobicContact CD1-CG 3.84Å; L54-M106 HydrophobicContact CD1-SD 4Å
55	R	90.2	Very high	90.6	Very high	68 Å²	68	49.7 Å²	49.7	26%	0.257	24%	0.242	S	C	.	.	H	α-helix	trans	-65	-40.9	175.8	-171.1	-172.7	-58	112.2	-0.1	112.7	R51 N52 G53 I57 E58 W59	R51-R55 WeakPolarHBondContact O-CB 3.37Å; R51-R55 PolarHBondContact O-N 3Å; N52-R55 PolarHBondContact O-N 2.66Å; N52-R55 PolarHBondContact OD1-NH1 3.27Å; G53-R55 VanDerWaalsContact C-N 3.33Å; G53-R55 PolarHBondContact O-N 3.24Å; R55-I57 VanDerWaalsContact C-N 3.33Å; R55-E58 WeakPolarHBondContact O-CB 3.45Å; R55-E58 PolarHBondContact O-N 3.1Å; R55-W59 HydrophobicContact CG-CD2 4.36Å; R55-W59 HydrophobicContact CG-CH2 4.21Å; R55-W59 HydrophobicContact CG-CZ2 3.9Å; R55-W59 PolarHBondContact O-N 3.1Å; R55-W59 VanDerWaalsContact O-N 3.15Å
56	S	93.6	Very high	90.9	Very high	54 Å²	54	48 Å²	48	38%	0.378	24%	0.24	S	C	.	.	H	α-helix	trans	-61.5	-45.8	176.8	-168.4	0	0	0	0	110.7	N52 G53 E58 W59 D60	N52-S56 PolarHBondContact O-N 2.94Å; G53-S56 PolarHBondContact O-N 3.35Å; S56-E58 VanDerWaalsContact C-N 3.27Å; S56-E58 PolarHBondContact O-N 3.01Å; S56-W59 PolarHBondContact O-N 2.97Å; S56-D60 VanDerWaalsContact O-CG 3.29Å; S56-D60 PolarHBondContact O-N 2.87Å
57	I	94	Very high	91.2	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-61	-38.8	177.5	-65.6	160.7	0	0	0	110.7	V14 A17 V18 A21 G53 L54 R55 D60 L61 T95 V99	V14-I57 HydrophobicContact CG1-CG2 4.31Å; A17-I57 HydrophobicContact CB-CD1 4.04Å; A17-I57 HydrophobicContact CB-CG1 3.71Å; V18-I57 HydrophobicContact CG2-CD1 3.97Å; V18-I57 HydrophobicContact CG2-CG1 4.41Å; V18-I57 HydrophobicContact CG2-CG2 3.99Å; A21-I57 HydrophobicContact CB-CD1 3.99Å; G53-I57 WeakPolarHBondContact O-CD1 3.31Å; G53-I57 VanDerWaalsContact O-CG1 3.3Å; G53-I57 WeakPolarHBondContact O-CG1 3.38Å; G53-I57 PolarHBondContact O-N 2.91Å; L54-I57 PolarHBondContact O-N 3.1Å; R55-I57 VanDerWaalsContact C-N 3.33Å; I57-D60 PolarHBondContact O-N 3.43Å; I57-L61 HydrophobicContact CG2-CD1 3.77Å; I57-L61 HydrophobicContact CG2-CG 4.21Å; I57-L61 WeakPolarHBondContact O-CB 3.31Å; I57-L61 WeakPolarHBondContact O-CG 3.45Å; I57-L61 PolarHBondContact O-N 3.34Å; I57-T95 HydrophobicContact CG2-CG2 4.26Å; I57-V99 HydrophobicContact CB-CG2 4.45Å; I57-V99 HydrophobicContact CG2-CG2 3.73Å
58	E	91.3	Very high	91.4	Very high	36 Å²	36	49.5 Å²	49.5	17%	0.168	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-46.6	176	-75.7	166.8	-166.4	0	0	112.5	L54 R55 S56 L61 E62 V99 K103 I190	L54-E58 WeakPolarHBondContact O-CG 3.45Å; L54-E58 PolarHBondContact O-N 3.36Å; R55-E58 WeakPolarHBondContact O-CB 3.45Å; R55-E58 PolarHBondContact O-N 3.1Å; S56-E58 VanDerWaalsContact C-N 3.27Å; S56-E58 PolarHBondContact O-N 3.01Å; E58-L61 PolarHBondContact O-N 3.29Å; E58-E62 PolarHBondContact O-N 3.09Å; E58-V99 HydrophobicContact CG-CG1 4.13Å; E58-K103 VanDerWaalsContact OE1-CD 3.25Å; E58-K103 WeakPolarHBondContact OE1-CD 3.26Å; E58-K103 WeakPolarHBondContact OE1-CE 3.36Å; E58-K103 IonicContact OE1-NZ 2.66Å; E58-K103 PolarHBondContact OE1-NZ 2.98Å; E58-K103 IonicContact OE2-NZ 3.49Å; E58-I190 HydrophobicContact CG-CD1 4.23Å
59	W	92.8	Very high	91.5	Very high	153 Å²	153	47.8 Å²	47.8	58%	0.58	24%	0.244	S	C	*	.	H	α-helix	trans	-61.9	-44.2	176.2	-67.3	-30.3	0	0	0	111.9	R55 S56 L61 E62 D63	R55-W59 HydrophobicContact CG-CD2 4.36Å; R55-W59 HydrophobicContact CG-CH2 4.21Å; R55-W59 HydrophobicContact CG-CZ2 3.9Å; R55-W59 PolarHBondContact O-N 3.1Å; R55-W59 VanDerWaalsContact O-N 3.15Å; S56-W59 PolarHBondContact O-N 2.97Å; W59-L61 VanDerWaalsContact C-N 3.26Å; W59-L61 PolarHBondContact O-N 2.77Å; W59-E62 PolarHBondContact O-N 3.27Å; W59-D63 PolarHBondContact O-N 3.34Å
60	D	94.3	Very high	91.5	Very high	46 Å²	46	48.6 Å²	48.6	25%	0.246	25%	0.25	C	C	.	.	H	α-helix	trans	-62	-36.4	177.6	-61.4	-27.5	0	0	0	111.5	V14 S56 I57 L64	V14-D60 HydrophobicContact CG2-CB 3.56Å; S56-D60 VanDerWaalsContact O-CG 3.29Å; S56-D60 PolarHBondContact O-N 2.87Å; I57-D60 PolarHBondContact O-N 3.43Å; D60-L64 WeakPolarHBondContact O-CB 3.34Å; D60-L64 VanDerWaalsContact O-CG 3.23Å; D60-L64 WeakPolarHBondContact O-CG 3.24Å; D60-L64 PolarHBondContact O-N 3.47Å
61	L	94.1	Very high	91.4	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-72.7	-32.8	177	-69.9	170.6	0	0	0	113	V14 I57 E58 W59 D65 I92 T95 R96	V14-L61 HydrophobicContact CG1-CD2 4.15Å; I57-L61 HydrophobicContact CG2-CD1 3.77Å; I57-L61 HydrophobicContact CG2-CG 4.21Å; I57-L61 WeakPolarHBondContact O-CB 3.31Å; I57-L61 WeakPolarHBondContact O-CG 3.45Å; I57-L61 PolarHBondContact O-N 3.34Å; E58-L61 PolarHBondContact O-N 3.29Å; W59-L61 VanDerWaalsContact C-N 3.26Å; W59-L61 PolarHBondContact O-N 2.77Å; L61-D65 WeakPolarHBondContact O-CB 3.44Å; L61-D65 PolarHBondContact O-N 3.02Å; L61-I92 HydrophobicContact CD2-CB 4.47Å; L61-I92 HydrophobicContact CD2-CG1 4.38Å; L61-I92 HydrophobicContact CD2-CG2 4.26Å; L61-T95 HydrophobicContact CD1-CG2 3.83Å; L61-T95 HydrophobicContact CD2-CG2 4.07Å; L61-T95 HydrophobicContact CG-CG2 4.47Å; L61-R96 HydrophobicContact CD1-CG 3.83Å
62	E	92.7	Very high	91.3	Very high	92 Å²	92	52.7 Å²	52.7	43%	0.43	27%	0.271	S	S	.	.	H	α-helix	trans	-65.7	-48	173.3	-169.3	166.7	-155.4	0	0	110	E58 W59 L64 D65 E66	E58-E62 PolarHBondContact O-N 3.09Å; W59-E62 PolarHBondContact O-N 3.27Å; E62-L64 PolarHBondContact O-N 3.42Å; E62-D65 PolarHBondContact O-N 3.14Å; E62-D65 VanDerWaalsContact O-N 3.13Å; E62-E66 PolarHBondContact O-N 3.41Å
63	D	92.9	Very high	91.2	Very high	97 Å²	97	54.8 Å²	54.8	52%	0.519	29%	0.29	S	S	.	.	H	α-helix	trans	-59.1	-44.7	175.1	-77.9	-4.3	0	0	0	111.6	W59 D65 E66 T67	W59-D63 PolarHBondContact O-N 3.34Å; D63-D65 VanDerWaalsContact C-N 3.31Å; D63-D65 PolarHBondContact O-N 3.22Å; D63-E66 PolarHBondContact O-N 3.44Å; D63-T67 WeakPolarHBondContact O-CG2 3.45Å; D63-T67 PolarHBondContact O-N 3.16Å
64	L	93.5	Very high	90.9	Very high	5 Å²	5	57.1 Å²	57.1	3%	0.026	30%	0.297	C	S	.	.	H	α-helix	trans	-62.1	-38.7	176.7	-75.3	179.8	0	0	0	112	F7 V10 V14 D60 E62 T67 I68 F91 I92	F7-L64 HydrophobicContact CD2-CD2 3.63Å; F7-L64 HydrophobicContact CE2-CB 4.49Å; F7-L64 HydrophobicContact CE2-CD2 3.74Å; F7-L64 HydrophobicContact CE2-CG 4.49Å; F7-L64 HydrophobicContact CG-CD2 4.48Å; V10-L64 HydrophobicContact CB-CD2 3.98Å; V10-L64 HydrophobicContact CG1-CD1 4.13Å; V10-L64 HydrophobicContact CG1-CD2 3.74Å; V10-L64 HydrophobicContact CG1-CG 3.92Å; V14-L64 HydrophobicContact CG2-CD1 4.22Å; D60-L64 WeakPolarHBondContact O-CB 3.34Å; D60-L64 VanDerWaalsContact O-CG 3.23Å; D60-L64 WeakPolarHBondContact O-CG 3.24Å; D60-L64 PolarHBondContact O-N 3.47Å; E62-L64 PolarHBondContact O-N 3.42Å; L64-T67 PolarHBondContact O-N 2.84Å; L64-T67 PolarHBondContact O-OG1 3.05Å; L64-I68 WeakPolarHBondContact O-CG1 3.23Å; L64-I68 PolarHBondContact O-N 3.4Å; L64-I68 VanDerWaalsContact O-N 3.14Å; L64-F91 HydrophobicContact CD1-CE1 4.05Å; L64-I92 HydrophobicContact CB-CD1 3.73Å; L64-I92 HydrophobicContact CB-CG1 4.24Å
65	D	91.4	Very high	90.4	Very high	41 Å²	41	61 Å²	61	22%	0.219	32%	0.322	C	S	.	.	H	α-helix	trans	-70.7	-37.3	179.3	-162.7	49	0	0	0	112.2	L61 E62 D63 T67 I68 S69 I92 R96	L61-D65 WeakPolarHBondContact O-CB 3.44Å; L61-D65 PolarHBondContact O-N 3.02Å; E62-D65 PolarHBondContact O-N 3.14Å; E62-D65 VanDerWaalsContact O-N 3.13Å; D63-D65 VanDerWaalsContact C-N 3.31Å; D63-D65 PolarHBondContact O-N 3.22Å; D65-T67 VanDerWaalsContact C-N 3.29Å; D65-T67 PolarHBondContact O-N 3.38Å; D65-I68 PolarHBondContact O-N 2.99Å; D65-S69 PolarHBondContact O-N 2.82Å; D65-S69 PolarHBondContact O-OG 3.47Å; D65-I92 HydrophobicContact CB-CD1 4.13Å; D65-R96 IonicContact OD2-NH2 3.61Å
66	E	91.6	Very high	90	Very high	112 Å²	112	68.3 Å²	68.3	52%	0.523	35%	0.35	S	S	.	.	H	α-helix	trans	-59.1	-41.5	169.8	-72.1	-167.4	177	0	0	111.4	E62 D63 I68 S69 I70	E62-E66 PolarHBondContact O-N 3.41Å; D63-E66 PolarHBondContact O-N 3.44Å; E66-I68 VanDerWaalsContact C-N 3.32Å; E66-I68 PolarHBondContact O-N 3.48Å; E66-S69 WeakPolarHBondContact O-CB 3.45Å; E66-S69 PolarHBondContact O-N 3.45Å; E66-I70 VanDerWaalsContact O-CG1 3.28Å; E66-I70 WeakPolarHBondContact O-CG1 3.45Å; E66-I70 PolarHBondContact O-N 3.33Å
67	T	90.6	Very high	89.4	Confident	58 Å²	58	72.6 Å²	72.6	36%	0.356	36%	0.362	S	S	.	.	H	α-helix	trans	-63.9	-37.5	177.2	69.4	0	0	0	0	112.3	D63 L64 D65 I70 V71	D63-T67 WeakPolarHBondContact O-CG2 3.45Å; D63-T67 PolarHBondContact O-N 3.16Å; L64-T67 PolarHBondContact O-N 2.84Å; L64-T67 PolarHBondContact O-OG1 3.05Å; D65-T67 VanDerWaalsContact C-N 3.29Å; D65-T67 PolarHBondContact O-N 3.38Å; T67-I70 PolarHBondContact O-N 3.13Å; T67-V71 VanDerWaalsContact O-CG2 3.32Å; T67-V71 WeakPolarHBondContact O-CG2 3.47Å; T67-V71 PolarHBondContact O-N 2.75Å
68	I	89	Confident	88.6	Confident	4 Å²	4	76.2 Å²	76.2	2%	0.021	38%	0.377	C	S	.	.	H	α-helix	trans	-63.2	-47.4	174.1	-66.4	-179.7	0	0	0	109.8	L64 D65 E66 I70 V71 E72 L85 R88 K89 I92	L64-I68 WeakPolarHBondContact O-CG1 3.23Å; L64-I68 PolarHBondContact O-N 3.4Å; L64-I68 VanDerWaalsContact O-N 3.14Å; D65-I68 PolarHBondContact O-N 2.99Å; E66-I68 VanDerWaalsContact C-N 3.32Å; E66-I68 PolarHBondContact O-N 3.48Å; I68-I70 VanDerWaalsContact C-N 3.27Å; I68-I70 PolarHBondContact O-N 3.05Å; I68-V71 PolarHBondContact O-N 2.83Å; I68-E72 HydrophobicContact CG2-CG 4.29Å; I68-E72 WeakPolarHBondContact O-CG 3.46Å; I68-E72 PolarHBondContact O-N 3.34Å; I68-L85 HydrophobicContact CG2-CD2 4.1Å; I68-L85 HydrophobicContact CG2-CG 4.25Å; I68-R88 HydrophobicContact CD1-CB 3.6Å; I68-R88 HydrophobicContact CG1-CB 4.17Å; I68-K89 HydrophobicContact CD1-CG 3.9Å; I68-K89 HydrophobicContact CG2-CD 4.4Å; I68-K89 HydrophobicContact CG2-CG 3.97Å; I68-I92 HydrophobicContact CD1-CD1 3.4Å; I68-I92 HydrophobicContact CD1-CG1 4.44Å; I68-I92 HydrophobicContact CG1-CD1 4.32Å
69	S	88.5	Confident	88	Confident	55 Å²	55	82.4 Å²	82.4	39%	0.385	41%	0.406	S	S	.	.	H	α-helix	trans	-57.5	-38.4	177.7	-64.6	0	0	0	0	112.7	D65 E66 S73	D65-S69 PolarHBondContact O-N 2.82Å; D65-S69 PolarHBondContact O-OG 3.47Å; E66-S69 WeakPolarHBondContact O-CB 3.45Å; E66-S69 PolarHBondContact O-N 3.45Å; S69-S73 WeakPolarHBondContact O-CB 3.32Å; S69-S73 PolarHBondContact O-N 3.48Å; S69-S73 PolarHBondContact O-OG 3.28Å
70	I	88.4	Confident	87.3	Confident	94 Å²	94	77.4 Å²	77.4	48%	0.482	39%	0.39	S	S	.	.	H	α-helix	trans	-65.9	-42.1	174.8	-69	164.5	0	0	0	111.4	E66 T67 I68 S73 N74 F78	E66-I70 VanDerWaalsContact O-CG1 3.28Å; E66-I70 WeakPolarHBondContact O-CG1 3.45Å; E66-I70 PolarHBondContact O-N 3.33Å; T67-I70 PolarHBondContact O-N 3.13Å; I68-I70 VanDerWaalsContact C-N 3.27Å; I68-I70 PolarHBondContact O-N 3.05Å; I70-S73 PolarHBondContact O-N 3.5Å; I70-N74 PolarHBondContact O-N 3.49Å; I70-F78 HydrophobicContact CG2-CE2 3.9Å; I70-F78 HydrophobicContact CG2-CZ 3.78Å
71	V	87.7	Confident	86.7	Confident	14 Å²	14	80.3 Å²	80.3	9%	0.085	41%	0.406	C	S	.	.	H	α-helix	trans	-66	-43	178.3	173.8	0	0	0	0	110.8	T67 I68 S73 N74 F78 L80 L85	T67-V71 VanDerWaalsContact O-CG2 3.32Å; T67-V71 WeakPolarHBondContact O-CG2 3.47Å; T67-V71 PolarHBondContact O-N 2.75Å; I68-V71 PolarHBondContact O-N 2.83Å; V71-S73 VanDerWaalsContact C-N 3.32Å; V71-S73 PolarHBondContact O-N 3.24Å; V71-N74 CarbonylContact O-C 3.33Å; V71-N74 PolarHBondContact O-N 3.1Å; V71-F78 HydrophobicContact CB-CD2 4.32Å; V71-F78 HydrophobicContact CG1-CB 4.15Å; V71-F78 HydrophobicContact CG1-CD2 4.43Å; V71-F78 HydrophobicContact CG1-CG 4.46Å; V71-F78 HydrophobicContact CG2-CB 4.4Å; V71-F78 HydrophobicContact CG2-CD1 4.32Å; V71-F78 HydrophobicContact CG2-CD2 4.08Å; V71-F78 HydrophobicContact CG2-CE2 4.44Å; V71-F78 HydrophobicContact CG2-CG 4.02Å; V71-L80 HydrophobicContact CG1-CB 3.95Å; V71-L80 HydrophobicContact CG1-CD1 3.8Å; V71-L80 HydrophobicContact CG1-CG 4.48Å; V71-L80 HydrophobicContact CG2-CD1 4.01Å; V71-L85 HydrophobicContact CB-CD1 4.24Å; V71-L85 HydrophobicContact CG1-CD1 3.63Å
72	E	86.1	Confident	86.1	Confident	89 Å²	89	83.3 Å²	83.3	42%	0.416	43%	0.431	S	S	.	.	H	α-helix	trans	-63.7	-37.6	177	-68.9	-163.7	127.8	0	0	112.4	I68 N74 P75 L85 K89	I68-E72 HydrophobicContact CG2-CG 4.29Å; I68-E72 WeakPolarHBondContact O-CG 3.46Å; I68-E72 PolarHBondContact O-N 3.34Å; E72-N74 VanDerWaalsContact C-N 3.27Å; E72-N74 PolarHBondContact O-N 3.16Å; E72-P75 WeakPolarHBondContact O-CD 3.33Å; E72-P75 WeakPolarHBondContact O-CG 3.36Å; E72-L85 HydrophobicContact CG-CD1 3.7Å; E72-L85 HydrophobicContact CG-CD2 3.94Å; E72-L85 HydrophobicContact CG-CG 4.42Å; E72-L85 WeakPolarHBondContact OE1-CD2 3.48Å; E72-K89 VanDerWaalsContact OE1-CE 3.26Å; E72-K89 WeakPolarHBondContact OE1-CE 3.41Å; E72-K89 IonicContact OE1-NZ 3.89Å; E72-K89 PolarHBondContact OE1-NZ 3.3Å; E72-K89 IonicContact OE2-NZ 3.73Å; E72-K89 PolarHBondContact OE2-NZ 3.14Å
73	S	87.8	Confident	85.4	Confident	104 Å²	104	81.1 Å²	81.1	73%	0.727	43%	0.429	S	S	*	.	H	α-helix	trans	-69.3	-23.3	178	-63	0	0	0	0	113.2	S69 I70 V71	S69-S73 WeakPolarHBondContact O-CB 3.32Å; S69-S73 PolarHBondContact O-N 3.48Å; S69-S73 PolarHBondContact O-OG 3.28Å; I70-S73 PolarHBondContact O-N 3.5Å; V71-S73 VanDerWaalsContact C-N 3.32Å; V71-S73 PolarHBondContact O-N 3.24Å
74	N	86.6	Confident	85	Confident	73 Å²	73	78.4 Å²	78.4	39%	0.39	41%	0.413	S	S	.	.			trans	-140.9	66.8	-179.7	-162.2	5.8	0	0	0	114.5	I70 V71 E72 R76 K77 F78	I70-N74 PolarHBondContact O-N 3.49Å; V71-N74 CarbonylContact O-C 3.33Å; V71-N74 PolarHBondContact O-N 3.1Å; E72-N74 VanDerWaalsContact C-N 3.27Å; E72-N74 PolarHBondContact O-N 3.16Å; N74-R76 PolarHBondContact O-N 3.38Å; N74-R76 VanDerWaalsContact O-N 3.13Å; N74-K77 HydrophobicContact CB-CB 4.48Å; N74-K77 WeakPolarHBondContact ND2-CB 3.36Å; N74-K77 PolarHBondContact O-N 3.13Å; N74-K77 VanDerWaalsContact O-N 3.11Å; N74-F78 HydrophobicContact CB-CE2 4.26Å; N74-F78 VanDerWaalsContact O-CD2 3.3Å; N74-F78 WeakPolarHBondContact O-CD2 3.29Å
75	P	82.1	Confident	84.6	Confident	83 Å²	83	79.2 Å²	79.2	54%	0.539	42%	0.417	S	S	.	.	H	α-helix	trans	-61.8	-30.5	-173.2	-23.8	35.1	0	0	0	113.5	E72 K77 H79	E72-P75 WeakPolarHBondContact O-CD 3.33Å; E72-P75 WeakPolarHBondContact O-CG 3.36Å; P75-K77 VanDerWaalsContact C-N 3.26Å; P75-K77 PolarHBondContact O-N 2.64Å; P75-H79 PolarHBondContact O-N 3Å; P75-H79 VanDerWaalsContact O-N 3.16Å
76	R	80.6	Confident	84.3	Confident	220 Å²	220	78.5 Å²	78.5	83%	0.83	41%	0.414	S	S	*	.	H	α-helix	trans	-66.8	-25.3	-178.9	-66.1	-176.2	-178.4	179.8	1.7	113.4	N74 H79	N74-R76 PolarHBondContact O-N 3.38Å; N74-R76 VanDerWaalsContact O-N 3.13Å; R76-H79 PolarHBondContact O-CE1 2.78Å; R76-H79 VanDerWaalsContact O-CE1 3.26Å; R76-H79 PolarHBondContact O-NE2 3.26Å
77	K	81.1	Confident	84	Confident	145 Å²	145	79 Å²	79	63%	0.63	41%	0.414	S	S	*	.	H	α-helix	trans	-84.7	-35.3	-178.1	-176.1	-178.8	176.7	-171.7	0	112.2	N74 P75	N74-K77 HydrophobicContact CB-CB 4.48Å; N74-K77 WeakPolarHBondContact ND2-CB 3.36Å; N74-K77 PolarHBondContact O-N 3.13Å; N74-K77 VanDerWaalsContact O-N 3.11Å; P75-K77 VanDerWaalsContact C-N 3.26Å; P75-K77 PolarHBondContact O-N 2.64Å
78	F	78.3	Confident	84	Confident	77 Å²	77	76.8 Å²	76.8	34%	0.338	40%	0.4	S	S	.	.	H	α-helix	trans	-97.8	-18.5	-170.9	-63.1	-76.2	0	0	0	113.7	I70 V71 N74 L80	I70-F78 HydrophobicContact CG2-CE2 3.9Å; I70-F78 HydrophobicContact CG2-CZ 3.78Å; V71-F78 HydrophobicContact CB-CD2 4.32Å; V71-F78 HydrophobicContact CG1-CB 4.15Å; V71-F78 HydrophobicContact CG1-CD2 4.43Å; V71-F78 HydrophobicContact CG1-CG 4.46Å; V71-F78 HydrophobicContact CG2-CB 4.4Å; V71-F78 HydrophobicContact CG2-CD1 4.32Å; V71-F78 HydrophobicContact CG2-CD2 4.08Å; V71-F78 HydrophobicContact CG2-CE2 4.44Å; V71-F78 HydrophobicContact CG2-CG 4.02Å; N74-F78 HydrophobicContact CB-CE2 4.26Å; N74-F78 VanDerWaalsContact O-CD2 3.3Å; N74-F78 WeakPolarHBondContact O-CD2 3.29Å; F78-L80 HydrophobicContact CB-CD1 4.36Å; F78-L80 PolarHBondContact O-N 3.37Å
79	H	78.2	Confident	84	Confident	166 Å²	166	79.7 Å²	79.7	77%	0.769	41%	0.412	S	S	*	.			trans	47.7	35.2	179.7	-61.7	-64.5	0	0	0	113.3	P75 R76	P75-H79 PolarHBondContact O-N 3Å; P75-H79 VanDerWaalsContact O-N 3.16Å; R76-H79 PolarHBondContact O-CE1 2.78Å; R76-H79 VanDerWaalsContact O-CE1 3.26Å; R76-H79 PolarHBondContact O-NE2 3.26Å
80	L	78.3	Confident	83.9	Confident	47 Å²	47	78.3 Å²	78.3	25%	0.246	40%	0.404	C	S	.	.			trans	-82.7	135.1	-178.9	-115.1	149.7	0	0	0	109.3	V71 F78 E84	V71-L80 HydrophobicContact CG1-CB 3.95Å; V71-L80 HydrophobicContact CG1-CD1 3.8Å; V71-L80 HydrophobicContact CG1-CG 4.48Å; V71-L80 HydrophobicContact CG2-CD1 4.01Å; F78-L80 HydrophobicContact CB-CD1 4.36Å; F78-L80 PolarHBondContact O-N 3.37Å; L80-E84 HydrophobicContact CD2-CB 3.94Å; L80-E84 HydrophobicContact CD2-CG 3.78Å
81	D	81.4	Confident	84	Confident	107 Å²	107	75.2 Å²	75.2	57%	0.572	39%	0.387	S	S	*	.			trans	-67.7	139.6	177.1	-175.3	32.9	0	0	0	110.1	A83 E84 L85	D81-A83 VanDerWaalsContact C-N 3.26Å; D81-A83 PolarHBondContact O-N 3.15Å; D81-A83 WeakPolarHBondContact OD2-CB 3.32Å; D81-E84 HydrophobicContact CB-CB 4.17Å; D81-E84 WeakPolarHBondContact O-CB 3.46Å; D81-E84 PolarHBondContact O-N 3.04Å; D81-L85 PolarHBondContact O-N 3.25Å
82	A	80.6	Confident	84.2	Confident	66 Å²	66	74.6 Å²	74.6	55%	0.545	38%	0.384	S	S	.	.	H	α-helix	trans	-58.6	-43.1	179.7	0	0	0	0	0	110.2	E84 L85 T86	A82-E84 PolarHBondContact O-N 3.41Å; A82-L85 PolarHBondContact O-N 2.87Å; A82-T86 PolarHBondContact O-N 3.38Å; A82-T86 PolarHBondContact O-OG1 3.1Å
83	A	78.9	Confident	84.3	Confident	46 Å²	46	70.9 Å²	70.9	38%	0.38	37%	0.367	S	S	.	.	H	α-helix	trans	-63.4	-29.2	178.1	0	0	0	0	0	112.9	D81 K87	D81-A83 VanDerWaalsContact C-N 3.26Å; D81-A83 PolarHBondContact O-N 3.15Å; D81-A83 WeakPolarHBondContact OD2-CB 3.32Å; A83-K87 WeakPolarHBondContact O-CG 3.36Å; A83-K87 PolarHBondContact O-N 3.28Å
84	E	84.1	Confident	84.3	Confident	40 Å²	40	69.2 Å²	69.2	19%	0.187	36%	0.356	C	S	.	.	H	α-helix	trans	-74.7	-45.4	176	-171.1	58.1	-156.4	0	0	111.2	F8 L80 D81 A82 T86 K87 R88	F8-E84 WeakPolarHBondContact CE1-OE1 3.41Å; F8-E84 VanDerWaalsContact CZ-OE1 3.26Å; F8-E84 WeakPolarHBondContact CZ-OE1 3.36Å; L80-E84 HydrophobicContact CD2-CB 3.94Å; L80-E84 HydrophobicContact CD2-CG 3.78Å; D81-E84 HydrophobicContact CB-CB 4.17Å; D81-E84 WeakPolarHBondContact O-CB 3.46Å; D81-E84 PolarHBondContact O-N 3.04Å; A82-E84 PolarHBondContact O-N 3.41Å; E84-T86 PolarHBondContact O-N 2.97Å; E84-K87 WeakPolarHBondContact O-CB 3.37Å; E84-K87 PolarHBondContact O-N 2.8Å; E84-K87 VanDerWaalsContact O-N 3.07Å; E84-K87 IonicContact OE2-NZ 3.12Å; E84-K87 PolarHBondContact OE2-NZ 3.45Å; E84-R88 WeakPolarHBondContact O-CG 3.28Å; E84-R88 PolarHBondContact O-N 3.26Å; E84-R88 VanDerWaalsContact O-N 3.08Å
85	L	85.8	Confident	84.6	Confident	23 Å²	23	66.3 Å²	66.3	12%	0.12	34%	0.34	C	S	.	.	H	α-helix	trans	-55.6	-39.6	175	-167.1	141.7	0	0	0	111.5	I68 V71 E72 D81 A82 R88 K89	I68-L85 HydrophobicContact CG2-CD2 4.1Å; I68-L85 HydrophobicContact CG2-CG 4.25Å; V71-L85 HydrophobicContact CB-CD1 4.24Å; V71-L85 HydrophobicContact CG1-CD1 3.63Å; E72-L85 HydrophobicContact CG-CD1 3.7Å; E72-L85 HydrophobicContact CG-CD2 3.94Å; E72-L85 HydrophobicContact CG-CG 4.42Å; E72-L85 WeakPolarHBondContact OE1-CD2 3.48Å; D81-L85 PolarHBondContact O-N 3.25Å; A82-L85 PolarHBondContact O-N 2.87Å; L85-R88 WeakPolarHBondContact O-CB 3.43Å; L85-R88 PolarHBondContact O-N 3.48Å; L85-K89 HydrophobicContact CD2-CD 4.05Å; L85-K89 HydrophobicContact CD2-CG 4.38Å; L85-K89 PolarHBondContact O-N 3.46Å
86	T	83.7	Confident	85	Confident	26 Å²	26	63.3 Å²	63.3	16%	0.16	32%	0.318	C	S	.	.	H	α-helix	trans	-66.1	-40	177.1	-46.5	0	0	0	0	113.3	A82 E84 R88 K89 A90 F204	A82-T86 PolarHBondContact O-N 3.38Å; A82-T86 PolarHBondContact O-OG1 3.1Å; E84-T86 PolarHBondContact O-N 2.97Å; T86-R88 VanDerWaalsContact C-N 3.26Å; T86-R88 PolarHBondContact O-N 2.96Å; T86-K89 PolarHBondContact O-N 3.24Å; T86-A90 WeakPolarHBondContact O-CB 3.27Å; T86-A90 PolarHBondContact O-N 3.47Å; T86-F204 HydrophobicContact CG2-CB 4.48Å; T86-F204 HydrophobicContact CG2-CD1 4.44Å; T86-F204 HydrophobicContact CG2-CD2 2.96Å; T86-F204 HydrophobicContact CG2-CE1 4.46Å; T86-F204 HydrophobicContact CG2-CE2 3.02Å; T86-F204 HydrophobicContact CG2-CG 3.72Å; T86-F204 HydrophobicContact CG2-CZ 3.81Å
87	K	86.6	Confident	85.3	Confident	121 Å²	121	56.8 Å²	56.8	53%	0.526	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-35.5	172.8	-69	173.3	-155.2	156.1	0	112	A83 E84 A90 F91	A83-K87 WeakPolarHBondContact O-CG 3.36Å; A83-K87 PolarHBondContact O-N 3.28Å; E84-K87 WeakPolarHBondContact O-CB 3.37Å; E84-K87 PolarHBondContact O-N 2.8Å; E84-K87 VanDerWaalsContact O-N 3.07Å; E84-K87 IonicContact OE2-NZ 3.12Å; E84-K87 PolarHBondContact OE2-NZ 3.45Å; K87-A90 PolarHBondContact O-N 3.49Å; K87-F91 WeakPolarHBondContact O-CB 3.38Å; K87-F91 PolarHBondContact O-N 3.45Å
88	R	90.8	Very high	85.7	Confident	12 Å²	12	51.8 Å²	51.8	5%	0.045	28%	0.281	C	S	.	.	H	α-helix	trans	-64.1	-47.1	176.7	-59.9	-173.1	-177.5	-162.9	-2.6	111	D5 F7 I68 E84 L85 T86 F91 I92	D5-R88 IonicContact OD1-NH1 3.1Å; D5-R88 IonicContact OD2-CZ 2.78Å; D5-R88 IonicContact OD2-NH1 3.31Å; D5-R88 PolarHBondContact OD2-NH1 3.42Å; D5-R88 IonicContact OD2-NH2 3.45Å; D5-R88 PolarHBondContact OD2-NH2 2.95Å; F7-R88 HydrophobicContact CD1-CG 4.03Å; F7-R88 HydrophobicContact CD2-CG 4.37Å; F7-R88 HydrophobicContact CE1-CB 4.08Å; F7-R88 HydrophobicContact CE1-CG 3.46Å; F7-R88 VanDerWaalsContact CE1-CG 3.46Å; F7-R88 HydrophobicContact CE2-CB 3.8Å; F7-R88 HydrophobicContact CE2-CG 3.83Å; F7-R88 HydrophobicContact CG-CG 4.48Å; F7-R88 HydrophobicContact CZ-CB 3.45Å; F7-R88 VanDerWaalsContact CZ-CB 3.45Å; F7-R88 HydrophobicContact CZ-CG 3.36Å; I68-R88 HydrophobicContact CD1-CB 3.6Å; I68-R88 HydrophobicContact CG1-CB 4.17Å; E84-R88 WeakPolarHBondContact O-CG 3.28Å; E84-R88 PolarHBondContact O-N 3.26Å; E84-R88 VanDerWaalsContact O-N 3.08Å; L85-R88 WeakPolarHBondContact O-CB 3.43Å; L85-R88 PolarHBondContact O-N 3.48Å; T86-R88 VanDerWaalsContact C-N 3.26Å; T86-R88 PolarHBondContact O-N 2.96Å; R88-F91 WeakPolarHBondContact O-CB 3.49Å; R88-F91 PolarHBondContact O-N 3.2Å; R88-I92 WeakPolarHBondContact O-CG1 3.31Å; R88-I92 PolarHBondContact O-N 3Å; R88-I92 VanDerWaalsContact O-N 3.1Å
89	K	88.6	Confident	86.3	Confident	65 Å²	65	48.2 Å²	48.2	28%	0.283	27%	0.266	S	S	.	.	H	α-helix	trans	-57.4	-50.3	174.3	-70.9	-173.1	170.5	-172.1	0	111.6	I68 E72 L85 T86 F91 I92 T93	I68-K89 HydrophobicContact CD1-CG 3.9Å; I68-K89 HydrophobicContact CG2-CD 4.4Å; I68-K89 HydrophobicContact CG2-CG 3.97Å; E72-K89 VanDerWaalsContact OE1-CE 3.26Å; E72-K89 WeakPolarHBondContact OE1-CE 3.41Å; E72-K89 IonicContact OE1-NZ 3.89Å; E72-K89 PolarHBondContact OE1-NZ 3.3Å; E72-K89 IonicContact OE2-NZ 3.73Å; E72-K89 PolarHBondContact OE2-NZ 3.14Å; L85-K89 HydrophobicContact CD2-CD 4.05Å; L85-K89 HydrophobicContact CD2-CG 4.38Å; L85-K89 PolarHBondContact O-N 3.46Å; T86-K89 PolarHBondContact O-N 3.24Å; K89-F91 VanDerWaalsContact C-N 3.28Å; K89-F91 PolarHBondContact O-N 3.33Å; K89-I92 PolarHBondContact O-N 2.95Å; K89-I92 VanDerWaalsContact O-N 3.11Å; K89-T93 PolarHBondContact O-N 3.22Å; K89-T93 PolarHBondContact O-OG1 2.69Å; K89-T93 VanDerWaalsContact O-OG1 3.12Å
90	A	86.2	Confident	86.8	Confident	27 Å²	27	41.6 Å²	41.6	22%	0.223	24%	0.235	C	C	.	.	H	α-helix	trans	-58.6	-38.6	179	0	0	0	0	0	112.9	T86 K87 S94 F204	T86-A90 WeakPolarHBondContact O-CB 3.27Å; T86-A90 PolarHBondContact O-N 3.47Å; K87-A90 PolarHBondContact O-N 3.49Å; A90-S94 VanDerWaalsContact O-CB 3.27Å; A90-S94 WeakPolarHBondContact O-CB 3.31Å; A90-S94 PolarHBondContact O-N 3.24Å; A90-F204 HydrophobicContact CB-CE1 4.16Å
91	F	90.9	Very high	87.1	Confident	28 Å²	28	43.3 Å²	43.3	12%	0.123	24%	0.244	C	C	.	.	H	α-helix	trans	-62.4	-47.6	174.4	168.6	-100.5	0	0	0	112.2	F7 K11 V14 E15 L64 K87 R88 K89 S94 T95	F7-F91 HydrophobicContact CZ-CD1 4.47Å; K11-F91 HydrophobicContact CB-CE1 4.33Å; K11-F91 HydrophobicContact CB-CZ 4.48Å; K11-F91 HydrophobicContact CD-CD2 4.46Å; K11-F91 HydrophobicContact CD-CG 4.46Å; K11-F91 HydrophobicContact CG-CD1 4.12Å; K11-F91 HydrophobicContact CG-CD2 4.27Å; K11-F91 HydrophobicContact CG-CE1 3.75Å; K11-F91 HydrophobicContact CG-CE2 3.91Å; K11-F91 HydrophobicContact CG-CG 4.36Å; K11-F91 HydrophobicContact CG-CZ 3.64Å; V14-F91 HydrophobicContact CB-CZ 4.17Å; V14-F91 HydrophobicContact CG1-CE1 4.26Å; V14-F91 HydrophobicContact CG1-CZ 3.83Å; E15-F91 HydrophobicContact CG-CE2 3.61Å; E15-F91 HydrophobicContact CG-CZ 4.01Å; L64-F91 HydrophobicContact CD1-CE1 4.05Å; K87-F91 WeakPolarHBondContact O-CB 3.38Å; K87-F91 PolarHBondContact O-N 3.45Å; R88-F91 WeakPolarHBondContact O-CB 3.49Å; R88-F91 PolarHBondContact O-N 3.2Å; K89-F91 VanDerWaalsContact C-N 3.28Å; K89-F91 PolarHBondContact O-N 3.33Å; F91-S94 PolarHBondContact O-N 2.81Å; F91-T95 WeakPolarHBondContact O-CB 3.3Å; F91-T95 PolarHBondContact O-N 2.74Å; F91-T95 PolarHBondContact O-OG1 3.29Å
92	I	91.6	Very high	87.5	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-61.5	-49.8	179.2	-65.5	177.5	0	0	0	110	L61 L64 D65 I68 R88 K89 S94 T95 R96	L61-I92 HydrophobicContact CD2-CB 4.47Å; L61-I92 HydrophobicContact CD2-CG1 4.38Å; L61-I92 HydrophobicContact CD2-CG2 4.26Å; L64-I92 HydrophobicContact CB-CD1 3.73Å; L64-I92 HydrophobicContact CB-CG1 4.24Å; D65-I92 HydrophobicContact CB-CD1 4.13Å; I68-I92 HydrophobicContact CD1-CD1 3.4Å; I68-I92 HydrophobicContact CD1-CG1 4.44Å; I68-I92 HydrophobicContact CG1-CD1 4.32Å; R88-I92 WeakPolarHBondContact O-CG1 3.31Å; R88-I92 PolarHBondContact O-N 3Å; R88-I92 VanDerWaalsContact O-N 3.1Å; K89-I92 PolarHBondContact O-N 2.95Å; K89-I92 VanDerWaalsContact O-N 3.11Å; I92-S94 PolarHBondContact O-N 3.06Å; I92-T95 PolarHBondContact O-N 3.35Å; I92-R96 HydrophobicContact CG2-CG 4.31Å; I92-R96 WeakPolarHBondContact O-CB 3.28Å; I92-R96 WeakPolarHBondContact O-CG 3.46Å; I92-R96 PolarHBondContact O-N 3.41Å
93	T	88.2	Confident	87.8	Confident	11 Å²	11	35.3 Å²	35.3	7%	0.067	19%	0.192	C	C	.	.	H	α-helix	trans	-60.5	-47.1	179.9	-52.7	0	0	0	0	111.8	K89 T95 R96 L97 L194 Q197	K89-T93 PolarHBondContact O-N 3.22Å; K89-T93 PolarHBondContact O-OG1 2.69Å; K89-T93 VanDerWaalsContact O-OG1 3.12Å; T93-T95 VanDerWaalsContact C-N 3.29Å; T93-T95 PolarHBondContact O-N 2.9Å; T93-R96 PolarHBondContact O-N 2.79Å; T93-L97 HydrophobicContact CG2-CD1 4.36Å; T93-L97 WeakPolarHBondContact O-CG 3.4Å; T93-L97 PolarHBondContact O-N 2.84Å; T93-L194 HydrophobicContact CG2-CD2 3.88Å; T93-Q197 HydrophobicContact CG2-CB 4.34Å; T93-Q197 PolarHBondContact OG1-OE1 3.24Å
94	S	88	Confident	88	Confident	70 Å²	70	37.8 Å²	37.8	49%	0.49	20%	0.196	S	C	.	.	H	α-helix	trans	-61.6	-37.6	177.7	-175.6	0	0	0	0	112.4	A90 F91 I92 T98	A90-S94 VanDerWaalsContact O-CB 3.27Å; A90-S94 WeakPolarHBondContact O-CB 3.31Å; A90-S94 PolarHBondContact O-N 3.24Å; F91-S94 PolarHBondContact O-N 2.81Å; I92-S94 PolarHBondContact O-N 3.06Å; S94-T98 PolarHBondContact O-N 3.38Å; S94-T98 PolarHBondContact O-OG1 3.16Å
95	T	92.3	Very high	87.8	Confident	11 Å²	11	39.6 Å²	39.6	7%	0.067	20%	0.204	C	C	.	.	H	α-helix	trans	-72.8	-42.5	179.9	-52.7	0	0	0	0	111	V14 V18 I57 L61 F91 I92 T93 L97 T98 V99	V14-T95 HydrophobicContact CG1-CG2 4.01Å; V18-T95 HydrophobicContact CG2-CG2 3.46Å; V18-T95 VanDerWaalsContact CG2-CG2 3.46Å; I57-T95 HydrophobicContact CG2-CG2 4.26Å; L61-T95 HydrophobicContact CD1-CG2 3.83Å; L61-T95 HydrophobicContact CD2-CG2 4.07Å; L61-T95 HydrophobicContact CG-CG2 4.47Å; F91-T95 WeakPolarHBondContact O-CB 3.3Å; F91-T95 PolarHBondContact O-N 2.74Å; F91-T95 PolarHBondContact O-OG1 3.29Å; I92-T95 PolarHBondContact O-N 3.35Å; T93-T95 VanDerWaalsContact C-N 3.29Å; T93-T95 PolarHBondContact O-N 2.9Å; T95-L97 VanDerWaalsContact C-N 3.33Å; T95-L97 PolarHBondContact O-N 3.14Å; T95-T98 WeakPolarHBondContact O-CB 3.25Å; T95-T98 PolarHBondContact O-N 2.99Å; T95-T98 VanDerWaalsContact O-N 3.14Å; T95-V99 WeakPolarHBondContact O-CG2 3.44Å; T95-V99 PolarHBondContact O-N 2.89Å
96	R	91.3	Very high	87.4	Confident	20 Å²	20	38.8 Å²	38.8	8%	0.075	20%	0.2	C	C	.	.	H	α-helix	trans	-57.4	-44.1	173.7	-75.9	177.3	177	-124.5	20.9	111.9	L61 D65 I92 T93 T98 V99 Q100 E193 L194	L61-R96 HydrophobicContact CD1-CG 3.83Å; D65-R96 IonicContact OD2-NH2 3.61Å; I92-R96 HydrophobicContact CG2-CG 4.31Å; I92-R96 WeakPolarHBondContact O-CB 3.28Å; I92-R96 WeakPolarHBondContact O-CG 3.46Å; I92-R96 PolarHBondContact O-N 3.41Å; T93-R96 PolarHBondContact O-N 2.79Å; R96-T98 VanDerWaalsContact C-N 3.33Å; R96-T98 PolarHBondContact O-N 3Å; R96-V99 PolarHBondContact O-N 2.87Å; R96-Q100 WeakPolarHBondContact O-CB 3.39Å; R96-Q100 PolarHBondContact O-N 3.22Å; R96-E193 IonicContact CZ-OE1 3.17Å; R96-E193 IonicContact CZ-OE2 2.59Å; R96-E193 IonicContact NH1-OE1 2.95Å; R96-E193 PolarHBondContact NH1-OE1 3.41Å; R96-E193 IonicContact NH1-OE2 3.01Å; R96-E193 PolarHBondContact NH1-OE2 2.81Å; R96-E193 IonicContact NH2-OE1 2.64Å; R96-E193 PolarHBondContact NH2-OE1 3.24Å; R96-E193 IonicContact NH2-OE2 3.7Å; R96-L194 HydrophobicContact CB-CD1 4.23Å; R96-L194 HydrophobicContact CB-CD2 3.89Å; R96-L194 HydrophobicContact CB-CG 4.38Å
97	L	87.3	Confident	86.9	Confident	84 Å²	84	39 Å²	39	44%	0.44	20%	0.202	S	C	.	.	H	α-helix	trans	-59.2	-43.7	174.9	-74.9	166	0	0	0	112.2	T93 T95 Q100 D101 L194	T93-L97 HydrophobicContact CG2-CD1 4.36Å; T93-L97 WeakPolarHBondContact O-CG 3.4Å; T93-L97 PolarHBondContact O-N 2.84Å; T95-L97 VanDerWaalsContact C-N 3.33Å; T95-L97 PolarHBondContact O-N 3.14Å; L97-Q100 PolarHBondContact O-N 3.44Å; L97-D101 PolarHBondContact O-N 2.78Å; L97-L194 HydrophobicContact CD2-CD1 3.82Å; L97-L194 HydrophobicContact CD2-CD2 4.24Å; L97-L194 HydrophobicContact CD2-CG 4.5Å; L97-L194 HydrophobicContact CG-CD1 4.15Å; L97-L194 HydrophobicContact CG-CD2 4.01Å
98	T	89.4	Confident	85.7	Confident	40 Å²	40	34.2 Å²	34.2	25%	0.245	19%	0.188	C	C	.	.	H	α-helix	trans	-65.1	-41	179.1	-54.2	0	0	0	0	111.6	V18 S94 T95 R96 M102	V18-T98 HydrophobicContact CG1-CG2 4.35Å; S94-T98 PolarHBondContact O-N 3.38Å; S94-T98 PolarHBondContact O-OG1 3.16Å; T95-T98 WeakPolarHBondContact O-CB 3.25Å; T95-T98 PolarHBondContact O-N 2.99Å; T95-T98 VanDerWaalsContact O-N 3.14Å; R96-T98 VanDerWaalsContact C-N 3.33Å; R96-T98 PolarHBondContact O-N 3Å; T98-M102 HydrophobicContact CG2-CE 4.21Å; T98-M102 WeakPolarHBondContact O-CE 3.25Å; T98-M102 PolarHBondContact O-N 3.05Å
99	V	90.8	Very high	83.7	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-65.1	-44.1	174.8	169	0	0	0	0	110.8	L54 I57 E58 T95 R96 M102 K103	L54-V99 HydrophobicContact CB-CG1 4.42Å; L54-V99 HydrophobicContact CD2-CB 4.49Å; L54-V99 HydrophobicContact CD2-CG1 4.1Å; L54-V99 HydrophobicContact CD2-CG2 4.3Å; I57-V99 HydrophobicContact CB-CG2 4.45Å; I57-V99 HydrophobicContact CG2-CG2 3.73Å; E58-V99 HydrophobicContact CG-CG1 4.13Å; T95-V99 WeakPolarHBondContact O-CG2 3.44Å; T95-V99 PolarHBondContact O-N 2.89Å; R96-V99 PolarHBondContact O-N 2.87Å; V99-M102 PolarHBondContact O-N 3.36Å; V99-K103 HydrophobicContact CG1-CD 3.89Å; V99-K103 HydrophobicContact CG1-CG 4.47Å; V99-K103 VanDerWaalsContact O-CG 3.25Å; V99-K103 WeakPolarHBondContact O-CG 3.12Å; V99-K103 PolarHBondContact O-N 3.3Å
100	Q	87.6	Confident	81.6	Confident	27 Å²	27	39.3 Å²	39.3	13%	0.126	24%	0.236	C	C	.	.	H	α-helix	trans	-60	-47.2	177.8	-173.9	-173.9	-0.1	0	0	111.9	R96 L97 M102 K103 E104 I190 L194	R96-Q100 WeakPolarHBondContact O-CB 3.39Å; R96-Q100 PolarHBondContact O-N 3.22Å; L97-Q100 PolarHBondContact O-N 3.44Å; Q100-M102 PolarHBondContact O-N 2.95Å; Q100-K103 CarbonylContact O-C 3.57Å; Q100-K103 WeakPolarHBondContact O-CB 3.22Å; Q100-K103 PolarHBondContact O-N 2.72Å; Q100-E104 HydrophobicContact CG-CG 4.3Å; Q100-E104 WeakPolarHBondContact CG-OE1 3.32Å; Q100-E104 PolarHBondContact NE2-OE1 3.12Å; Q100-E104 WeakPolarHBondContact O-CG 3.2Å; Q100-E104 PolarHBondContact O-N 2.84Å; Q100-I190 HydrophobicContact CB-CG2 3.95Å; Q100-I190 HydrophobicContact CG-CG2 4.19Å; Q100-L194 HydrophobicContact CB-CD1 4.39Å
101	D	86.2	Confident	79.8	Confident	82 Å²	82	39 Å²	39	44%	0.439	23%	0.234	S	C	.	.	H	α-helix	trans	-56.9	-47.7	178.7	176	54.1	0	0	0	111.7	L97 K103 E104 Q105	L97-D101 PolarHBondContact O-N 2.78Å; D101-K103 VanDerWaalsContact C-N 3.29Å; D101-K103 PolarHBondContact O-N 3.23Å; D101-E104 PolarHBondContact O-N 2.99Å; D101-Q105 WeakPolarHBondContact O-CG 3.46Å; D101-Q105 PolarHBondContact O-N 2.93Å; D101-Q105 PolarHBondContact OD1-NE2 3.27Å; D101-Q105 PolarHBondContact OD2-NE2 3.33Å
102	M	87.8	Confident	77.7	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.025	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-39.7	175.2	-70.9	-172.8	-75	0	0	111.8	A21 Q22 H25 L54 T98 V99 Q100 M106	A21-M102 HydrophobicContact CB-CE 4.27Å; Q22-M102 HydrophobicContact CG-CE 4.36Å; Q22-M102 HydrophobicContact CG-SD 4.11Å; H25-M102 HydrophobicContact CB-CG 4.24Å; H25-M102 HydrophobicContact CB-SD 3.76Å; L54-M102 HydrophobicContact CD1-CB 4.39Å; L54-M102 HydrophobicContact CD2-CB 4.34Å; L54-M102 HydrophobicContact CD2-CE 3.49Å; L54-M102 VanDerWaalsContact CD2-CE 3.49Å; L54-M102 HydrophobicContact CD2-SD 4.27Å; T98-M102 HydrophobicContact CG2-CE 4.21Å; T98-M102 WeakPolarHBondContact O-CE 3.25Å; T98-M102 PolarHBondContact O-N 3.05Å; V99-M102 PolarHBondContact O-N 3.36Å; Q100-M102 PolarHBondContact O-N 2.95Å; M102-M106 VanDerWaalsContact O-CG 3.23Å; M102-M106 WeakPolarHBondContact O-CG 3.24Å; M102-M106 PolarHBondContact O-N 3.3Å; M102-M106 VanDerWaalsContact O-N 3.09Å
103	K	87.1	Confident	75.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-69.4	-37.3	178.5	-68.7	174.2	66.9	174.4	0	113.2	L54 E58 V99 Q100 D101 M106 S107 L183 S187 I190	L54-K103 HydrophobicContact CD1-CG 3.84Å; E58-K103 VanDerWaalsContact OE1-CD 3.25Å; E58-K103 WeakPolarHBondContact OE1-CD 3.26Å; E58-K103 WeakPolarHBondContact OE1-CE 3.36Å; E58-K103 IonicContact OE1-NZ 2.66Å; E58-K103 PolarHBondContact OE1-NZ 2.98Å; E58-K103 IonicContact OE2-NZ 3.49Å; V99-K103 HydrophobicContact CG1-CD 3.89Å; V99-K103 HydrophobicContact CG1-CG 4.47Å; V99-K103 VanDerWaalsContact O-CG 3.25Å; V99-K103 WeakPolarHBondContact O-CG 3.12Å; V99-K103 PolarHBondContact O-N 3.3Å; Q100-K103 CarbonylContact O-C 3.57Å; Q100-K103 WeakPolarHBondContact O-CB 3.22Å; Q100-K103 PolarHBondContact O-N 2.72Å; D101-K103 VanDerWaalsContact C-N 3.29Å; D101-K103 PolarHBondContact O-N 3.23Å; K103-M106 PolarHBondContact O-N 2.86Å; K103-S107 WeakPolarHBondContact O-CB 3.44Å; K103-S107 PolarHBondContact O-N 3.45Å; K103-S107 PolarHBondContact O-OG 3.09Å; K103-L183 HydrophobicContact CB-CD1 4.39Å; K103-L183 HydrophobicContact CB-CD2 4.02Å; K103-L183 HydrophobicContact CB-CG 3.97Å; K103-L183 HydrophobicContact CD-CD1 4.17Å; K103-L183 HydrophobicContact CD-CG 4.5Å; K103-L183 VanDerWaalsContact CE-CD1 3.49Å; K103-L183 HydrophobicContact CG-CD1 3.89Å; K103-L183 HydrophobicContact CG-CD2 4.24Å; K103-L183 HydrophobicContact CG-CG 4.03Å; K103-L183 WeakPolarHBondContact O-CD2 3.37Å; K103-S187 VanDerWaalsContact CB-OG 3.29Å; K103-S187 WeakPolarHBondContact CB-OG 3.28Å; K103-S187 WeakPolarHBondContact CE-OG 3.34Å; K103-I190 HydrophobicContact CD-CD1 4.35Å
104	E	83.3	Confident	73.4	Confident	99 Å²	99	44.3 Å²	44.3	46%	0.463	29%	0.285	S	S	.	.	H	α-helix	trans	-66.5	-42.7	176.7	-76	-179.7	-172.6	0	0	111	Q100 D101 M106 S107 G108	Q100-E104 HydrophobicContact CG-CG 4.3Å; Q100-E104 WeakPolarHBondContact CG-OE1 3.32Å; Q100-E104 PolarHBondContact NE2-OE1 3.12Å; Q100-E104 WeakPolarHBondContact O-CG 3.2Å; Q100-E104 PolarHBondContact O-N 2.84Å; D101-E104 PolarHBondContact O-N 2.99Å; E104-M106 VanDerWaalsContact C-N 3.3Å; E104-M106 PolarHBondContact O-N 3.4Å; E104-S107 CarbonylContact O-C 3.55Å; E104-S107 PolarHBondContact O-N 2.85Å; E104-S107 VanDerWaalsContact O-N 3.09Å; E104-G108 PolarHBondContact O-N 3.15Å
105	Q	80.6	Confident	71.6	Confident	77 Å²	77	44.1 Å²	44.1	36%	0.36	28%	0.282	S	S	.	.	H	α-helix	trans	-63	-36.8	175	-68.7	178.7	44.6	0	0	112.1	H25 D101 S107	H25-Q105 PolarHBondContact CE1-OE1 2.93Å; H25-Q105 PolarHBondContact NE2-OE1 3.4Å; D101-Q105 WeakPolarHBondContact O-CG 3.46Å; D101-Q105 PolarHBondContact O-N 2.93Å; D101-Q105 PolarHBondContact OD1-NE2 3.27Å; D101-Q105 PolarHBondContact OD2-NE2 3.33Å; Q105-S107 VanDerWaalsContact C-N 3.35Å
106	M	78.3	Confident	69.4	Low	7 Å²	7	47.5 Å²	47.5	3%	0.034	31%	0.31	C	S	.	.	H	α-helix	trans	-70.7	-26.9	173	-70.1	-179.5	82	0	0	114.1	W28 T47 L50 R51 L54 M102 K103 E104 L183	W28-M106 HydrophobicContact CD2-CG 4.39Å; W28-M106 HydrophobicContact CE3-CG 4.29Å; W28-M106 HydrophobicContact CH2-CB 4.32Å; W28-M106 HydrophobicContact CH2-CG 4.07Å; W28-M106 HydrophobicContact CZ2-CB 4.39Å; W28-M106 HydrophobicContact CZ2-CG 4.11Å; W28-M106 HydrophobicContact CZ3-CG 4.14Å; T47-M106 HydrophobicContact CG2-CE 4.05Å; L50-M106 HydrophobicContact CB-CE 4.38Å; L50-M106 HydrophobicContact CD2-CE 3.77Å; L50-M106 HydrophobicContact CD2-CG 4.3Å; L50-M106 HydrophobicContact CD2-SD 3.39Å; L50-M106 WeakPolarHBondContact CD2-SD 3.43Å; L50-M106 HydrophobicContact CG-CE 4.09Å; L50-M106 HydrophobicContact CG-SD 3.73Å; R51-M106 HydrophobicContact CG-CE 3.75Å; L54-M106 HydrophobicContact CD1-SD 4Å; M102-M106 VanDerWaalsContact O-CG 3.23Å; M102-M106 WeakPolarHBondContact O-CG 3.24Å; M102-M106 PolarHBondContact O-N 3.3Å; M102-M106 VanDerWaalsContact O-N 3.09Å; K103-M106 PolarHBondContact O-N 2.86Å; E104-M106 VanDerWaalsContact C-N 3.3Å; E104-M106 PolarHBondContact O-N 3.4Å; M106-L183 HydrophobicContact CB-CD2 3.66Å; M106-L183 HydrophobicContact SD-CD2 4.29Å
107	S	72.6	Confident	67.2	Low	29 Å²	29	53 Å²	53	20%	0.203	34%	0.341	C	S	.	.	H	α-helix	trans	-93.4	-13.9	-179.4	-53.9	0	0	0	0	113.3	K103 E104 Q105	K103-S107 WeakPolarHBondContact O-CB 3.44Å; K103-S107 PolarHBondContact O-N 3.45Å; K103-S107 PolarHBondContact O-OG 3.09Å; E104-S107 CarbonylContact O-C 3.55Å; E104-S107 PolarHBondContact O-N 2.85Å; E104-S107 VanDerWaalsContact O-N 3.09Å; Q105-S107 VanDerWaalsContact C-N 3.35Å
108	G	59.9	Low	65.2	Low	22 Å²	22	57.5 Å²	57.5	23%	0.227	35%	0.353	C	S	.	.	S	Bend	trans	-69.9	165.8	-176.4	0	0	0	0	0	114.2	E104 A110 A111	E104-G108 PolarHBondContact O-N 3.15Å; G108-A110 PolarHBondContact O-N 3.45Å; G108-A111 PolarHBondContact O-N 3.46Å
109	P	48.9	Very low	63.3	Low	105 Å²	105	61.7 Å²	61.7	68%	0.682	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-63.3	-5.7	-174.3	25.4	-33.8	0	0	0	114.7	A111 G112 S113	P109-A111 PolarHBondContact O-N 3.32Å; P109-G112 PolarHBondContact O-N 3.1Å; P109-G112 VanDerWaalsContact O-N 3.11Å; P109-S113 WeakPolarHBondContact O-CB 3.37Å; P109-S113 PolarHBondContact O-N 2.69Å
110	A	45.5	Very low	61.2	Low	78 Å²	78	64.2 Å²	64.2	65%	0.645	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-58.2	-28.2	174	0	0	0	0	0	113	G108	G108-A110 PolarHBondContact O-N 3.45Å
111	A	48.8	Very low	59.2	Low	22 Å²	22	70.8 Å²	70.8	18%	0.182	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-79.6	-14.9	177.8	0	0	0	0	0	114.3	G108 P109 L173 V176 I180	G108-A111 PolarHBondContact O-N 3.46Å; P109-A111 PolarHBondContact O-N 3.32Å; A111-L173 WeakPolarHBondContact O-CD2 3.47Å; A111-V176 HydrophobicContact CB-CG1 4.28Å; A111-I180 HydrophobicContact CB-CD1 4.14Å
112	G	46.8	Very low	57.2	Low	37 Å²	37	73.7 Å²	73.7	38%	0.381	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.1	-19	-170.1	0	0	0	0	0	117.4	P109	P109-G112 PolarHBondContact O-N 3.1Å; P109-G112 VanDerWaalsContact O-N 3.11Å
113	S	43.8	Very low	55.4	Low	80 Å²	80	78 Å²	78	56%	0.559	46%	0.456	S	S	*	.	S	Bend	trans	-103.4	-11.6	-171.7	140	0	0	0	0	114.5	P109	P109-S113 WeakPolarHBondContact O-CB 3.37Å; P109-S113 PolarHBondContact O-N 2.69Å
114	G	44.6	Very low	53.7	Low	33 Å²	33	85.5 Å²	85.5	34%	0.34	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-20.9	-172.8	0	0	0	0	0	115.7
115	T	50.2	Low	52.1	Low	67 Å²	67	87.8 Å²	87.8	41%	0.411	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-42.6	-170.2	50.3	0	0	0	0	112.8	D117	T115-D117 PolarHBondContact O-N 3.26Å
116	A	45.8	Very low	50.3	Low	81 Å²	81	87.1 Å²	87.1	67%	0.669	52%	0.524	S	S	*	.	H	α-helix	trans	-63	-39.4	-177.6	0	0	0	0	0	113.3
117	D	45.7	Very low	48.8	Very low	136 Å²	136	92.5 Å²	92.5	73%	0.727	55%	0.553	S	S	*	*	H	α-helix	trans	-87.2	-18.6	-172.2	-136.5	13.7	0	0	0	113.4	T115	T115-D117 PolarHBondContact O-N 3.26Å
118	R	46.5	Very low	47.4	Very low	179 Å²	179	95.8 Å²	95.8	68%	0.675	58%	0.582	S	S	*	*	H	α-helix	trans	-86	-34.4	179.8	-74.6	-173.6	-170.4	166.4	5.9	113.4	K121 Q122	R118-K121 PolarHBondContact O-N 3.03Å; R118-Q122 PolarHBondContact O-N 2.99Å
119	Y	48.9	Very low	46.5	Very low	128 Å²	128	104.4 Å²	104.4	50%	0.502	61%	0.607	S	S	.	*	H	α-helix	trans	-73.4	-33.4	177.8	-88.6	-86.5	0	0	0	112.8	K121 Q122 V123	Y119-K121 PolarHBondContact O-N 3.35Å; Y119-Q122 PolarHBondContact O-N 3.22Å; Y119-V123 WeakPolarHBondContact O-CG2 3.27Å; Y119-V123 PolarHBondContact O-N 2.87Å
120	G	46.5	Very low	46	Very low	54 Å²	54	106.3 Å²	106.3	56%	0.557	61%	0.612	S	S	*	*	H	α-helix	trans	-61.2	-30.4	173.3	0	0	0	0	0	113.4
121	K	46.3	Very low	46	Very low	165 Å²	165	107.4 Å²	107.4	72%	0.717	61%	0.612	S	S	*	*	H	α-helix	trans	-88.2	-24.9	-177.5	-151.6	171.2	-174.8	174	0	113.8	R118 Y119	R118-K121 PolarHBondContact O-N 3.03Å; Y119-K121 PolarHBondContact O-N 3.35Å
122	Q	43.9	Very low	45.4	Very low	144 Å²	144	113.7 Å²	113.7	67%	0.673	64%	0.641	S	S	*	*	H	α-helix	trans	-82.5	-29.3	178	-163.3	166.2	33	0	0	112.7	R118 Y119	R118-Q122 PolarHBondContact O-N 2.99Å; Y119-Q122 PolarHBondContact O-N 3.22Å
123	V	49.3	Very low	44.9	Very low	94 Å²	94	123.2 Å²	123.2	57%	0.57	67%	0.666	S	S	*	*	H	α-helix	trans	-76.5	-26.9	178.1	177.5	0	0	0	0	112.4	Y119 L125	Y119-V123 WeakPolarHBondContact O-CG2 3.27Å; Y119-V123 PolarHBondContact O-N 2.87Å; V123-L125 PolarHBondContact O-N 3.5Å
124	L	50.4	Low	44.8	Very low	158 Å²	158	127.6 Å²	127.6	83%	0.827	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-8.7	176.5	-141.1	81.9	0	0	0	113.8
125	L	50.7	Low	44.6	Very low	148 Å²	148	132.4 Å²	132.4	78%	0.775	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	20.5	179.4	-100.3	82.7	0	0	0	113.1	V123 D127	V123-L125 PolarHBondContact O-N 3.5Å; L125-D127 PolarHBondContact O-N 3.47Å; L125-D127 VanDerWaalsContact O-N 3.17Å
126	G	43.8	Very low	43.9	Very low	63 Å²	63	132.9 Å²	132.9	65%	0.649	72%	0.721	S	S	*	*	S	Bend	trans	-74.2	97.5	171.3	0	0	0	0	0	112.3
127	D	45.7	Very low	44	Very low	120 Å²	120	133.8 Å²	133.8	64%	0.642	72%	0.722	S	S	*	*			trans	48.8	72.2	154.8	-152.6	39.4	0	0	0	117.3	L125 R129	L125-D127 PolarHBondContact O-N 3.47Å; L125-D127 VanDerWaalsContact O-N 3.17Å; D127-R129 PolarHBondContact O-N 2.96Å; D127-R129 WeakPolarHBondContact OD1-CD 3.32Å; D127-R129 WeakPolarHBondContact OD1-CG 3.46Å
128	A	42.5	Very low	43.8	Very low	97 Å²	97	133.9 Å²	133.9	80%	0.802	72%	0.723	S	S	*	*			trans	-74.9	66.2	156.1	0	0	0	0	0	110	D130	A128-D130 PolarHBondContact O-N 3.35Å
129	R	41.2	Very low	43.4	Very low	204 Å²	204	136.9 Å²	136.9	77%	0.77	73%	0.734	S	S	*	*			trans	-88.3	88.8	160.4	-90.5	179.7	165	172.3	-1	108	D127 P131	D127-R129 PolarHBondContact O-N 2.96Å; D127-R129 WeakPolarHBondContact OD1-CD 3.32Å; D127-R129 WeakPolarHBondContact OD1-CG 3.46Å; R129-P131 WeakPolarHBondContact O-CD 3.49Å
130	D	40.1	Very low	43.1	Very low	145 Å²	145	141.4 Å²	141.4	78%	0.775	76%	0.757	S	S	*	*			trans	-50.7	123.3	170.4	-79.3	-46.7	0	0	0	111.2	A128 I132	A128-D130 PolarHBondContact O-N 3.35Å; D130-I132 PolarHBondContact O-N 2.79Å
131	P	43.7	Very low	43	Very low	100 Å²	100	141.6 Å²	141.6	65%	0.649	76%	0.759	S	S	*	*			trans	-80.5	114.4	158.6	-0.7	19.4	0	0	0	108.1	R129 W133	R129-P131 WeakPolarHBondContact O-CD 3.49Å; P131-W133 VanDerWaalsContact O-CD1 3.28Å; P131-W133 PolarHBondContact O-N 3.43Å; P131-W133 VanDerWaalsContact O-N 3.16Å
132	I	36.4	Very low	43.1	Very low	155 Å²	155	139.6 Å²	139.6	80%	0.795	76%	0.762	S	S	*	*			trans	-60	112	170.3	-67.4	166	0	0	0	108.9	D130	D130-I132 PolarHBondContact O-N 2.79Å
133	W	37	Very low	43.4	Very low	236 Å²	236	138.3 Å²	138.3	89%	0.894	77%	0.766	S	S	*	*			trans	-87.2	116.6	169.2	-73.9	85.6	0	0	0	109.9	P131	P131-W133 VanDerWaalsContact O-CD1 3.28Å; P131-W133 PolarHBondContact O-N 3.43Å; P131-W133 VanDerWaalsContact O-N 3.16Å
134	Q	41	Very low	43.4	Very low	172 Å²	172	139.9 Å²	139.9	80%	0.804	77%	0.772	S	S	*	*			trans	-92.5	136.4	161.6	-84	177.7	15.8	0	0	109.7
135	P	40.3	Very low	43.5	Very low	135 Å²	135	142.3 Å²	142.3	88%	0.877	77%	0.77	S	S	*	*			trans	-87.9	115.6	174.4	33.2	-26.8	0	0	0	109.6
136	G	35.9	Very low	43.4	Very low	76 Å²	76	144.8 Å²	144.8	78%	0.784	77%	0.769	S	S	*	*			trans	-135.7	130.7	171.9	0	0	0	0	0	109.4
137	S	47.6	Very low	43.8	Very low	100 Å²	100	146 Å²	146	70%	0.699	77%	0.765	S	S	*	*			trans	-61.5	157.8	-168.5	54	0	0	0	0	115.8
138	D	42	Very low	44	Very low	139 Å²	139	147.5 Å²	147.5	74%	0.743	77%	0.769	S	S	*	*			trans	109.7	123.9	145.2	-61.2	-52.4	0	0	0	119.5
139	R	37.8	Very low	44.7	Very low	241 Å²	241	145.7 Å²	145.7	91%	0.909	75%	0.75	S	S	*	*			trans	92.8	110.4	157	-63.5	172	-160.5	-141.2	3.8	118.2	G141	R139-G141 PolarHBondContact O-N 3.21Å
140	F	43.8	Very low	45.3	Very low	224 Å²	224	138.6 Å²	138.6	98%	0.982	74%	0.735	S	S	*	*			trans	-51	117.7	163.2	-80.8	-103.8	0	0	0	112
141	G	43.6	Very low	46.4	Very low	58 Å²	58	136.7 Å²	136.7	60%	0.598	73%	0.725	S	S	*	*			trans	-138.3	151.5	155.6	0	0	0	0	0	108	R139	R139-G141 PolarHBondContact O-N 3.21Å
142	P	48.6	Very low	47.4	Very low	122 Å²	122	134.9 Å²	134.9	79%	0.792	72%	0.719	S	S	*	*			trans	-58.3	139.1	-179.8	-12.6	25.7	0	0	0	109.2	D144	P142-D144 PolarHBondContact O-N 3.05Å
143	P	49.4	Very low	48.8	Very low	117 Å²	117	133.9 Å²	133.9	76%	0.76	71%	0.711	S	S	*	*			trans	-64.2	114.1	179.3	26	-30.7	0	0	0	108.1	R145	P143-R145 PolarHBondContact O-N 3.42Å
144	D	49.1	Very low	50.4	Low	128 Å²	128	129 Å²	129	68%	0.684	70%	0.696	S	S	*	*			trans	-55.6	102.6	170.5	-99.5	-46.1	0	0	0	108.2	P142 R146 P147	P142-D144 PolarHBondContact O-N 3.05Å; D144-R146 PolarHBondContact O-N 3.45Å; D144-R146 VanDerWaalsContact O-N 3.13Å; D144-P147 WeakPolarHBondContact O-CD 3.36Å
145	R	53.1	Low	51.7	Low	209 Å²	209	125.5 Å²	125.5	79%	0.789	68%	0.682	S	S	*	*			trans	-70.1	3.4	178.2	-82.7	-179.9	166.8	-179.9	-4.1	113.8	P143 S149	P143-R145 PolarHBondContact O-N 3.42Å; R145-S149 PolarHBondContact O-N 3.23Å
146	R	49.1	Very low	53.3	Low	200 Å²	200	120.3 Å²	120.3	76%	0.755	65%	0.653	S	S	*	*	H	α-helix	trans	-77.2	-37	-170.4	-65.2	-177.4	174.3	-159.8	-1	115.9	D144 S149 A150	D144-R146 PolarHBondContact O-N 3.45Å; D144-R146 VanDerWaalsContact O-N 3.13Å; R146-S149 PolarHBondContact O-OG 2.98Å; R146-S149 VanDerWaalsContact O-OG 3.11Å; R146-A150 PolarHBondContact O-N 2.84Å
147	P	51.7	Low	54.9	Low	88 Å²	88	122.2 Å²	122.2	57%	0.571	65%	0.645	S	S	*	*	H	α-helix	trans	-77.6	-26.6	178.3	28.2	-27.8	0	0	0	112.5	D144 N151	D144-P147 WeakPolarHBondContact O-CD 3.36Å; P147-N151 PolarHBondContact O-N 2.87Å
148	Q	50.9	Low	55.8	Low	152 Å²	152	121.9 Å²	121.9	71%	0.71	63%	0.632	S	S	*	*	H	α-helix	trans	-73.9	-35.1	176.5	-74.8	178.1	4.8	0	0	112.6	A152	Q148-A152 WeakPolarHBondContact O-CB 3.35Å; Q148-A152 PolarHBondContact O-N 2.83Å
149	S	55.7	Low	57.1	Low	59 Å²	59	120.4 Å²	120.4	41%	0.413	62%	0.621	S	S	.	*	H	α-helix	trans	-71.1	-36.3	177.1	63.3	0	0	0	0	112.8	R145 R146 A152 Q153	R145-S149 PolarHBondContact O-N 3.23Å; R146-S149 PolarHBondContact O-OG 2.98Å; R146-S149 VanDerWaalsContact O-OG 3.11Å; S149-A152 PolarHBondContact O-N 3.32Å; S149-Q153 WeakPolarHBondContact O-CB 3.45Å; S149-Q153 WeakPolarHBondContact O-CG 3.37Å; S149-Q153 PolarHBondContact O-N 3.47Å
150	A	55.3	Low	58.8	Low	55 Å²	55	112.5 Å²	112.5	46%	0.455	60%	0.599	S	S	.	*	H	α-helix	trans	-67.2	-40	175.9	0	0	0	0	0	111.6	R146 Q153 F154	R146-A150 PolarHBondContact O-N 2.84Å; A150-Q153 PolarHBondContact O-N 3.12Å; A150-F154 WeakPolarHBondContact O-CB 3.46Å; A150-F154 PolarHBondContact O-N 2.96Å
151	N	62.5	Low	59.9	Low	104 Å²	104	107.7 Å²	107.7	56%	0.556	58%	0.58	S	S	*	*	H	α-helix	trans	-66.8	-40.5	173.5	-119.5	5.8	0	0	0	112	P147 F154 I155	P147-N151 PolarHBondContact O-N 2.87Å; N151-F154 PolarHBondContact O-N 2.9Å; N151-I155 WeakPolarHBondContact O-CB 3.46Å; N151-I155 WeakPolarHBondContact O-CD1 3.39Å; N151-I155 WeakPolarHBondContact O-CG1 3.44Å; N151-I155 PolarHBondContact O-N 2.95Å
152	A	65.6	Low	60.6	Low	63 Å²	63	109 Å²	109	52%	0.521	57%	0.571	S	S	.	*	H	α-helix	trans	-65.5	-38	177.1	0	0	0	0	0	112.6	Q148 S149 G156	Q148-A152 WeakPolarHBondContact O-CB 3.35Å; Q148-A152 PolarHBondContact O-N 2.83Å; S149-A152 PolarHBondContact O-N 3.32Å; A152-G156 PolarHBondContact O-N 3.25Å
153	Q	65.3	Low	61.5	Low	134 Å²	134	108.3 Å²	108.3	63%	0.626	56%	0.557	S	S	*	*	H	α-helix	trans	-67.5	-45.3	173.8	-76.5	175.6	1.6	0	0	111.5	S149 A150 I155 G156 D157	S149-Q153 WeakPolarHBondContact O-CB 3.45Å; S149-Q153 WeakPolarHBondContact O-CG 3.37Å; S149-Q153 PolarHBondContact O-N 3.47Å; A150-Q153 PolarHBondContact O-N 3.12Å; Q153-I155 PolarHBondContact O-N 3.03Å; Q153-G156 PolarHBondContact O-N 2.93Å; Q153-D157 WeakPolarHBondContact O-CB 3.19Å; Q153-D157 VanDerWaalsContact O-CG 3.32Å; Q153-D157 PolarHBondContact O-N 3.01Å
154	F	69.6	Low	62.5	Low	132 Å²	132	107.1 Å²	107.1	58%	0.579	54%	0.544	S	S	*	.	H	α-helix	trans	-60.9	-42.1	176.6	-177.3	-100.8	0	0	0	112.5	A150 N151 Q158	A150-F154 WeakPolarHBondContact O-CB 3.46Å; A150-F154 PolarHBondContact O-N 2.96Å; N151-F154 PolarHBondContact O-N 2.9Å; F154-Q158 WeakPolarHBondContact O-CB 3.44Å; F154-Q158 PolarHBondContact O-N 3.19Å
155	I	69.6	Low	63.3	Low	100 Å²	100	104.8 Å²	104.8	51%	0.513	53%	0.53	S	S	.	.	H	α-helix	trans	-65.4	-42	175.9	-68.7	167.6	0	0	0	111	N151 Q153 Q158 Q159	N151-I155 WeakPolarHBondContact O-CB 3.46Å; N151-I155 WeakPolarHBondContact O-CD1 3.39Å; N151-I155 WeakPolarHBondContact O-CG1 3.44Å; N151-I155 PolarHBondContact O-N 2.95Å; Q153-I155 PolarHBondContact O-N 3.03Å; I155-Q158 PolarHBondContact O-N 3.28Å; I155-Q159 VanDerWaalsContact O-CB 3.28Å; I155-Q159 WeakPolarHBondContact O-CB 3.5Å; I155-Q159 PolarHBondContact O-N 3.22Å
156	G	72.4	Confident	63.8	Low	26 Å²	26	97.2 Å²	97.2	27%	0.268	51%	0.512	S	S	.	.	H	α-helix	trans	-66	-42.8	177.4	0	0	0	0	0	113.1	A152 Q153 Q159 T160	A152-G156 PolarHBondContact O-N 3.25Å; Q153-G156 PolarHBondContact O-N 2.93Å; G156-Q159 PolarHBondContact O-N 2.96Å; G156-T160 PolarHBondContact O-N 2.88Å; G156-T160 PolarHBondContact O-OG1 3.37Å
157	D	70.9	Confident	64.6	Low	115 Å²	115	93.9 Å²	93.9	62%	0.615	51%	0.505	S	S	*	.	H	α-helix	trans	-65	-41.3	176.1	-72.3	-16.1	0	0	0	110.7	Q153 T160 Q161	Q153-D157 WeakPolarHBondContact O-CB 3.19Å; Q153-D157 VanDerWaalsContact O-CG 3.32Å; Q153-D157 PolarHBondContact O-N 3.01Å; D157-T160 PolarHBondContact O-N 3.17Å; D157-Q161 WeakPolarHBondContact O-CB 3.43Å; D157-Q161 PolarHBondContact O-N 3.37Å
158	Q	66.4	Low	65	Low	93 Å²	93	94.7 Å²	94.7	44%	0.435	50%	0.501	S	S	.	.	H	α-helix	trans	-67.3	-38.2	176.7	-149.2	-154.5	-9.7	0	0	112.1	F154 I155 T160 Q161 Q162	F154-Q158 WeakPolarHBondContact O-CB 3.44Å; F154-Q158 PolarHBondContact O-N 3.19Å; I155-Q158 PolarHBondContact O-N 3.28Å; Q158-T160 VanDerWaalsContact C-N 3.35Å; Q158-Q161 PolarHBondContact O-N 3.41Å; Q158-Q162 WeakPolarHBondContact O-CB 3.3Å; Q158-Q162 VanDerWaalsContact O-CG 3.29Å; Q158-Q162 WeakPolarHBondContact O-CG 3.26Å; Q158-Q162 PolarHBondContact O-N 3.02Å
159	Q	69.8	Low	65.1	Low	108 Å²	108	90.6 Å²	90.6	51%	0.505	48%	0.482	S	S	.	.	H	α-helix	trans	-65.3	-39.1	176.3	-172.4	176.9	7	0	0	111.6	I155 G156 Q162 Q163	I155-Q159 VanDerWaalsContact O-CB 3.28Å; I155-Q159 WeakPolarHBondContact O-CB 3.5Å; I155-Q159 PolarHBondContact O-N 3.22Å; G156-Q159 PolarHBondContact O-N 2.96Å; Q159-Q162 PolarHBondContact O-N 3.4Å; Q159-Q163 WeakPolarHBondContact O-CG 3.38Å; Q159-Q163 PolarHBondContact O-N 3.38Å
160	T	71.7	Confident	65.3	Low	75 Å²	75	92.8 Å²	92.8	46%	0.46	49%	0.489	S	S	.	.	H	α-helix	trans	-67.6	-41.2	176.5	-50.6	0	0	0	0	111	G156 D157 Q158 Q162 Q163 L164	G156-T160 PolarHBondContact O-N 2.88Å; G156-T160 PolarHBondContact O-OG1 3.37Å; D157-T160 PolarHBondContact O-N 3.17Å; Q158-T160 VanDerWaalsContact C-N 3.35Å; T160-Q162 VanDerWaalsContact C-N 3.32Å; T160-Q162 PolarHBondContact O-N 2.94Å; T160-Q163 PolarHBondContact O-N 2.73Å; T160-L164 PolarHBondContact O-N 3.36Å
161	Q	67.3	Low	65.4	Low	123 Å²	123	94.2 Å²	94.2	58%	0.575	49%	0.487	S	S	*	.	H	α-helix	trans	-63.7	-38.2	174.7	-169.5	176.8	4.3	0	0	111.9	D157 Q158 L164 I165	D157-Q161 WeakPolarHBondContact O-CB 3.43Å; D157-Q161 PolarHBondContact O-N 3.37Å; Q158-Q161 PolarHBondContact O-N 3.41Å; Q161-L164 PolarHBondContact O-N 3.15Å; Q161-I165 HydrophobicContact CG-CD1 4.24Å; Q161-I165 WeakPolarHBondContact O-CD1 3.5Å; Q161-I165 VanDerWaalsContact O-CG1 3.28Å; Q161-I165 WeakPolarHBondContact O-CG1 3.5Å; Q161-I165 PolarHBondContact O-N 2.78Å; Q161-I165 VanDerWaalsContact O-N 3.12Å
162	Q	58.1	Low	65	Low	86 Å²	86	92.2 Å²	92.2	40%	0.402	47%	0.474	S	S	.	.	H	α-helix	trans	-66.6	-39.1	174.6	-75.7	175.7	2.8	0	0	112.5	Q158 Q159 T160 I165 A166	Q158-Q162 WeakPolarHBondContact O-CB 3.3Å; Q158-Q162 VanDerWaalsContact O-CG 3.29Å; Q158-Q162 WeakPolarHBondContact O-CG 3.26Å; Q158-Q162 PolarHBondContact O-N 3.02Å; Q159-Q162 PolarHBondContact O-N 3.4Å; T160-Q162 VanDerWaalsContact C-N 3.32Å; T160-Q162 PolarHBondContact O-N 2.94Å; Q162-I165 PolarHBondContact O-N 3.08Å; Q162-A166 WeakPolarHBondContact O-CB 3.47Å; Q162-A166 PolarHBondContact O-N 2.9Å
163	Q	68.6	Low	64.7	Low	107 Å²	107	92 Å²	92	50%	0.5	46%	0.464	S	S	.	.	H	α-helix	trans	-62.9	-43.6	175	-77.9	177	-4	0	0	111.8	Q159 T160 I165 A166 E167	Q159-Q163 WeakPolarHBondContact O-CG 3.38Å; Q159-Q163 PolarHBondContact O-N 3.38Å; T160-Q163 PolarHBondContact O-N 2.73Å; Q163-I165 VanDerWaalsContact C-N 3.32Å; Q163-I165 PolarHBondContact O-N 3.31Å; Q163-A166 PolarHBondContact O-N 2.78Å; Q163-E167 WeakPolarHBondContact O-CB 3.46Å; Q163-E167 WeakPolarHBondContact O-CG 3.39Å; Q163-E167 PolarHBondContact O-N 2.96Å
164	L	70.3	Confident	64.3	Low	93 Å²	93	92.6 Å²	92.6	49%	0.487	47%	0.466	S	S	.	.	H	α-helix	trans	-60.9	-39.7	175.5	-84.8	156.2	0	0	0	112.7	T160 Q161 Q168	T160-L164 PolarHBondContact O-N 3.36Å; Q161-L164 PolarHBondContact O-N 3.15Å; L164-Q168 WeakPolarHBondContact O-CB 3.46Å; L164-Q168 VanDerWaalsContact O-CG 3.26Å; L164-Q168 WeakPolarHBondContact O-CG 3.3Å; L164-Q168 PolarHBondContact O-N 3.32Å; L164-Q168 VanDerWaalsContact O-N 3.12Å
165	I	64.7	Low	63.6	Low	79 Å²	79	93.7 Å²	93.7	41%	0.405	47%	0.467	S	S	.	.	H	α-helix	trans	-69.9	-39.9	177.2	-66.8	165.3	0	0	0	110.8	Q161 Q162 Q163 Q169	Q161-I165 HydrophobicContact CG-CD1 4.24Å; Q161-I165 WeakPolarHBondContact O-CD1 3.5Å; Q161-I165 VanDerWaalsContact O-CG1 3.28Å; Q161-I165 WeakPolarHBondContact O-CG1 3.5Å; Q161-I165 PolarHBondContact O-N 2.78Å; Q161-I165 VanDerWaalsContact O-N 3.12Å; Q162-I165 PolarHBondContact O-N 3.08Å; Q163-I165 VanDerWaalsContact C-N 3.32Å; Q163-I165 PolarHBondContact O-N 3.31Å; I165-Q169 WeakPolarHBondContact O-CG 3.45Å; I165-Q169 PolarHBondContact O-N 2.99Å
166	A	65.3	Low	62.9	Low	49 Å²	49	91.2 Å²	91.2	41%	0.405	46%	0.456	S	S	.	.	H	α-helix	trans	-65.9	-45.8	177.4	0	0	0	0	0	111.8	Q162 Q163 Q168 Q169 D170	Q162-A166 WeakPolarHBondContact O-CB 3.47Å; Q162-A166 PolarHBondContact O-N 2.9Å; Q163-A166 PolarHBondContact O-N 2.78Å; A166-Q168 VanDerWaalsContact C-N 3.34Å; A166-Q168 PolarHBondContact O-N 2.79Å; A166-Q169 PolarHBondContact O-N 2.97Å; A166-Q169 VanDerWaalsContact O-N 3.15Å; A166-D170 PolarHBondContact O-N 3.39Å
167	E	65.9	Low	62.1	Low	131 Å²	131	93.6 Å²	93.6	61%	0.612	47%	0.469	S	S	*	.	H	α-helix	trans	-61.5	-40.6	176.9	-76	-178.7	173	0	0	112	Q163 Q169 D170 E171	Q163-E167 WeakPolarHBondContact O-CB 3.46Å; Q163-E167 WeakPolarHBondContact O-CG 3.39Å; Q163-E167 PolarHBondContact O-N 2.96Å; E167-Q169 VanDerWaalsContact C-N 3.27Å; E167-Q169 PolarHBondContact O-N 3.27Å; E167-D170 PolarHBondContact O-N 3.04Å; E167-E171 PolarHBondContact O-N 3.23Å
168	Q	58.6	Low	61.4	Low	104 Å²	104	90.7 Å²	90.7	49%	0.486	47%	0.466	S	S	.	.	H	α-helix	trans	-65	-30.7	176.4	-77.3	-178.7	1.4	0	0	113.1	L164 A166 Q172	L164-Q168 WeakPolarHBondContact O-CB 3.46Å; L164-Q168 VanDerWaalsContact O-CG 3.26Å; L164-Q168 WeakPolarHBondContact O-CG 3.3Å; L164-Q168 PolarHBondContact O-N 3.32Å; L164-Q168 VanDerWaalsContact O-N 3.12Å; A166-Q168 VanDerWaalsContact C-N 3.34Å; A166-Q168 PolarHBondContact O-N 2.79Å; Q168-Q172 WeakPolarHBondContact O-CG 3.47Å
169	Q	53.3	Low	60.7	Low	66 Å²	66	89.2 Å²	89.2	31%	0.308	46%	0.464	S	S	.	.	H	α-helix	trans	-81.4	-37.1	177.5	-71.5	177.7	15.9	0	0	112.1	I165 A166 E167 E171 Q172 L173	I165-Q169 WeakPolarHBondContact O-CG 3.45Å; I165-Q169 PolarHBondContact O-N 2.99Å; A166-Q169 PolarHBondContact O-N 2.97Å; A166-Q169 VanDerWaalsContact O-N 3.15Å; E167-Q169 VanDerWaalsContact C-N 3.27Å; E167-Q169 PolarHBondContact O-N 3.27Å; Q169-E171 PolarHBondContact O-N 3.27Å; Q169-Q172 WeakPolarHBondContact O-CB 3.17Å; Q169-Q172 PolarHBondContact O-N 3.49Å; Q169-Q172 VanDerWaalsContact O-N 3.14Å; Q169-L173 PolarHBondContact O-N 2.65Å
170	D	59.9	Low	60.2	Low	106 Å²	106	85.5 Å²	85.5	57%	0.567	45%	0.447	S	S	*	.	H	α-helix	trans	-64.2	-39.6	176.8	-88	-5.7	0	0	0	111.8	A166 E167 Q172 L173 E174	A166-D170 PolarHBondContact O-N 3.39Å; E167-D170 PolarHBondContact O-N 3.04Å; D170-Q172 PolarHBondContact O-N 3.4Å; D170-L173 PolarHBondContact O-N 3.25Å; D170-E174 PolarHBondContact O-N 2.81Å
171	E	58.6	Low	59.8	Low	85 Å²	85	83.9 Å²	83.9	40%	0.397	45%	0.445	S	S	.	.	H	α-helix	trans	-61.8	-30.3	174.9	-159.4	-167.3	170.7	0	0	112.1	E167 Q169 R175	E167-E171 PolarHBondContact O-N 3.23Å; Q169-E171 PolarHBondContact O-N 3.27Å; E171-R175 WeakPolarHBondContact O-CG 3.26Å; E171-R175 PolarHBondContact O-N 3.41Å; E171-R175 IonicContact OE1-CZ 2.69Å; E171-R175 IonicContact OE1-NE 3.78Å; E171-R175 IonicContact OE1-NH2 3.6Å; E171-R175 PolarHBondContact OE1-NH2 2.85Å
172	Q	53.1	Low	59.7	Low	62 Å²	62	81.3 Å²	81.3	29%	0.29	44%	0.437	S	S	.	.	H	α-helix	trans	-74.9	-43.3	175.5	-68.7	-176.2	-72.4	0	0	112	Q168 Q169 D170 E174 R175 V176	Q168-Q172 WeakPolarHBondContact O-CG 3.47Å; Q169-Q172 WeakPolarHBondContact O-CB 3.17Å; Q169-Q172 PolarHBondContact O-N 3.49Å; Q169-Q172 VanDerWaalsContact O-N 3.14Å; D170-Q172 PolarHBondContact O-N 3.4Å; Q172-E174 PolarHBondContact O-N 3.2Å; Q172-R175 PolarHBondContact O-N 3.1Å; Q172-V176 WeakPolarHBondContact O-CB 3.35Å; Q172-V176 VanDerWaalsContact O-CG2 3.31Å; Q172-V176 WeakPolarHBondContact O-CG2 3.42Å; Q172-V176 PolarHBondContact O-N 2.75Å
173	L	59.2	Low	60.1	Low	58 Å²	58	77.5 Å²	77.5	30%	0.304	42%	0.42	S	S	.	.	H	α-helix	trans	-59.5	-37.9	174.8	-70.6	177.8	0	0	0	110.9	A111 Q169 D170 S177	A111-L173 WeakPolarHBondContact O-CD2 3.47Å; Q169-L173 PolarHBondContact O-N 2.65Å; D170-L173 PolarHBondContact O-N 3.25Å; L173-S177 WeakPolarHBondContact O-CA 3.49Å; L173-S177 WeakPolarHBondContact O-CB 3.23Å; L173-S177 PolarHBondContact O-N 3.05Å
174	E	58.2	Low	60.2	Low	146 Å²	146	78.9 Å²	78.9	68%	0.682	42%	0.424	S	S	*	.	H	α-helix	trans	-67.4	-45	178.7	-169.9	173.9	-172	0	0	112.7	D170 Q172 S177 G178	D170-E174 PolarHBondContact O-N 2.81Å; Q172-E174 PolarHBondContact O-N 3.2Å; E174-S177 PolarHBondContact O-N 3.06Å; E174-G178 PolarHBondContact O-N 3.11Å
175	R	54.9	Low	60.2	Low	155 Å²	155	79.5 Å²	79.5	59%	0.585	43%	0.428	S	S	*	.	H	α-helix	trans	-67.6	-42.1	177.3	-69.6	-179.5	-168.3	-167.3	3.7	112.2	E171 Q172 S177 T179	E171-R175 WeakPolarHBondContact O-CG 3.26Å; E171-R175 PolarHBondContact O-N 3.41Å; E171-R175 IonicContact OE1-CZ 2.69Å; E171-R175 IonicContact OE1-NE 3.78Å; E171-R175 IonicContact OE1-NH2 3.6Å; E171-R175 PolarHBondContact OE1-NH2 2.85Å; Q172-R175 PolarHBondContact O-N 3.1Å; R175-S177 VanDerWaalsContact C-N 3.34Å; R175-T179 PolarHBondContact O-N 3.15Å; R175-T179 PolarHBondContact O-OG1 3.14Å
176	V	55	Low	60.2	Low	49 Å²	49	78.5 Å²	78.5	30%	0.297	42%	0.422	S	S	.	.	H	α-helix	trans	-64.6	-41	174.3	173.7	0	0	0	0	109.9	A111 Q172 T179 I180	A111-V176 HydrophobicContact CB-CG1 4.28Å; Q172-V176 WeakPolarHBondContact O-CB 3.35Å; Q172-V176 VanDerWaalsContact O-CG2 3.31Å; Q172-V176 WeakPolarHBondContact O-CG2 3.42Å; Q172-V176 PolarHBondContact O-N 2.75Å; V176-T179 CarbonylContact O-C 3.52Å; V176-T179 PolarHBondContact O-N 2.89Å; V176-I180 HydrophobicContact CG1-CD1 3.59Å; V176-I180 HydrophobicContact CG1-CG1 4.1Å; V176-I180 WeakPolarHBondContact O-CB 3.43Å; V176-I180 VanDerWaalsContact O-CG1 3.22Å; V176-I180 WeakPolarHBondContact O-CG1 3.34Å; V176-I180 PolarHBondContact O-N 3.28Å
177	S	53.8	Low	60.7	Low	75 Å²	75	76.6 Å²	76.6	52%	0.524	41%	0.406	S	S	.	.	H	α-helix	trans	-62.3	-46.7	177.8	179.4	0	0	0	0	113.5	L173 E174 R175 T179 I180 G181	L173-S177 WeakPolarHBondContact O-CA 3.49Å; L173-S177 WeakPolarHBondContact O-CB 3.23Å; L173-S177 PolarHBondContact O-N 3.05Å; E174-S177 PolarHBondContact O-N 3.06Å; R175-S177 VanDerWaalsContact C-N 3.34Å; S177-T179 PolarHBondContact O-N 2.83Å; S177-I180 PolarHBondContact O-N 3.42Å; S177-G181 PolarHBondContact O-N 2.99Å; S177-G181 VanDerWaalsContact O-N 3.08Å
178	G	56.8	Low	61.2	Low	54 Å²	54	76.1 Å²	76.1	56%	0.557	40%	0.404	S	S	*	.	H	α-helix	trans	-59.9	-35.3	175.6	0	0	0	0	0	112.4	E174	E174-G178 PolarHBondContact O-N 3.11Å
179	T	51.3	Low	62	Low	63 Å²	63	79.3 Å²	79.3	39%	0.387	41%	0.411	S	S	.	.	H	α-helix	trans	-81.3	-33.4	178.9	-32.3	0	0	0	0	111.2	R51 R175 V176 S177 G181 V182 L183	R51-T179 PolarHBondContact NH1-O 3.31Å; R51-T179 PolarHBondContact NH2-O 3.01Å; R175-T179 PolarHBondContact O-N 3.15Å; R175-T179 PolarHBondContact O-OG1 3.14Å; V176-T179 CarbonylContact O-C 3.52Å; V176-T179 PolarHBondContact O-N 2.89Å; S177-T179 PolarHBondContact O-N 2.83Å; T179-G181 PolarHBondContact O-N 3.03Å; T179-V182 PolarHBondContact O-N 2.59Å; T179-L183 PolarHBondContact O-N 2.66Å
180	I	60.3	Low	63	Low	30 Å²	30	76.8 Å²	76.8	15%	0.154	40%	0.4	C	S	.	.	H	α-helix	trans	-59	-36.6	171.4	-75.7	168.3	0	0	0	110.9	A111 V176 S177 V182 L183 K184	A111-I180 HydrophobicContact CB-CD1 4.14Å; V176-I180 HydrophobicContact CG1-CD1 3.59Å; V176-I180 HydrophobicContact CG1-CG1 4.1Å; V176-I180 WeakPolarHBondContact O-CB 3.43Å; V176-I180 VanDerWaalsContact O-CG1 3.22Å; V176-I180 WeakPolarHBondContact O-CG1 3.34Å; V176-I180 PolarHBondContact O-N 3.28Å; S177-I180 PolarHBondContact O-N 3.42Å; I180-V182 VanDerWaalsContact C-N 3.32Å; I180-V182 PolarHBondContact O-N 3.13Å; I180-L183 PolarHBondContact O-N 3.33Å; I180-L183 VanDerWaalsContact O-N 3.12Å; I180-K184 VanDerWaalsContact O-CB 3.31Å; I180-K184 WeakPolarHBondContact O-CB 3.43Å; I180-K184 PolarHBondContact O-N 3.23Å
181	G	63.4	Low	63.9	Low	40 Å²	40	72.8 Å²	72.8	41%	0.412	38%	0.384	S	S	.	.	H	α-helix	trans	-55.5	-42.7	177.1	0	0	0	0	0	113.8	S177 T179 N185	S177-G181 PolarHBondContact O-N 2.99Å; S177-G181 VanDerWaalsContact O-N 3.08Å; T179-G181 PolarHBondContact O-N 3.03Å; G181-N185 PolarHBondContact O-N 3.01Å; G181-N185 VanDerWaalsContact O-N 3.1Å
182	V	65.1	Low	64.8	Low	69 Å²	69	74.6 Å²	74.6	42%	0.418	40%	0.395	S	S	.	.	H	α-helix	trans	-67.6	-41.9	177	179.1	0	0	0	0	111.2	T179 I180 N185 M186	T179-V182 PolarHBondContact O-N 2.59Å; I180-V182 VanDerWaalsContact C-N 3.32Å; I180-V182 PolarHBondContact O-N 3.13Å; V182-N185 PolarHBondContact O-N 3.38Å; V182-M186 HydrophobicContact CG1-CE 3.8Å; V182-M186 HydrophobicContact CG1-SD 3.97Å; V182-M186 VanDerWaalsContact O-CG 3.28Å; V182-M186 WeakPolarHBondContact O-CG 3.35Å; V182-M186 PolarHBondContact O-N 3.37Å; V182-M186 VanDerWaalsContact O-N 3.13Å
183	L	66.6	Low	65.9	Low	7 Å²	7	74.1 Å²	74.1	4%	0.037	39%	0.393	C	S	.	.	H	α-helix	trans	-65.8	-42.9	-179.9	-156.5	70.8	0	0	0	110.9	K103 M106 T179 I180 M186 S187	K103-L183 HydrophobicContact CB-CD1 4.39Å; K103-L183 HydrophobicContact CB-CD2 4.02Å; K103-L183 HydrophobicContact CB-CG 3.97Å; K103-L183 HydrophobicContact CD-CD1 4.17Å; K103-L183 HydrophobicContact CD-CG 4.5Å; K103-L183 VanDerWaalsContact CE-CD1 3.49Å; K103-L183 HydrophobicContact CG-CD1 3.89Å; K103-L183 HydrophobicContact CG-CD2 4.24Å; K103-L183 HydrophobicContact CG-CG 4.03Å; K103-L183 WeakPolarHBondContact O-CD2 3.37Å; M106-L183 HydrophobicContact CB-CD2 3.66Å; M106-L183 HydrophobicContact SD-CD2 4.29Å; T179-L183 PolarHBondContact O-N 2.66Å; I180-L183 PolarHBondContact O-N 3.33Å; I180-L183 VanDerWaalsContact O-N 3.12Å; L183-M186 PolarHBondContact O-N 2.92Å; L183-S187 WeakPolarHBondContact O-CB 3.44Å; L183-S187 PolarHBondContact O-N 2.79Å; L183-S187 PolarHBondContact O-OG 2.89Å; L183-S187 VanDerWaalsContact O-OG 3.13Å
184	K	70.2	Confident	66.8	Low	136 Å²	136	71.8 Å²	71.8	59%	0.591	38%	0.381	S	S	*	.	H	α-helix	trans	-60.3	-46.2	177.7	-177.6	176.3	179.5	177.3	0	112.1	I180 M186 S187 E188	I180-K184 VanDerWaalsContact O-CB 3.31Å; I180-K184 WeakPolarHBondContact O-CB 3.43Å; I180-K184 PolarHBondContact O-N 3.23Å; K184-M186 VanDerWaalsContact C-N 3.32Å; K184-M186 PolarHBondContact O-N 3.46Å; K184-S187 PolarHBondContact O-N 3.44Å; K184-E188 WeakPolarHBondContact O-CB 3.41Å; K184-E188 PolarHBondContact O-N 3.03Å
185	N	69.2	Low	67.7	Low	105 Å²	105	70.9 Å²	70.9	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-63.8	-39.3	177.4	-175.2	-102	0	0	0	111.9	G181 V182 E188 R189	G181-N185 PolarHBondContact O-N 3.01Å; G181-N185 VanDerWaalsContact O-N 3.1Å; V182-N185 PolarHBondContact O-N 3.38Å; N185-E188 PolarHBondContact O-N 3.42Å; N185-R189 PolarHBondContact O-N 3.29Å
186	M	65.9	Low	68.5	Low	59 Å²	59	70 Å²	70	29%	0.291	38%	0.383	S	S	.	.	H	α-helix	trans	-68.9	-38.9	175	-66.1	169.9	166	0	0	112.1	V182 L183 K184 E188 R189 I190	V182-M186 HydrophobicContact CG1-CE 3.8Å; V182-M186 HydrophobicContact CG1-SD 3.97Å; V182-M186 VanDerWaalsContact O-CG 3.28Å; V182-M186 WeakPolarHBondContact O-CG 3.35Å; V182-M186 PolarHBondContact O-N 3.37Å; V182-M186 VanDerWaalsContact O-N 3.13Å; L183-M186 PolarHBondContact O-N 2.92Å; K184-M186 VanDerWaalsContact C-N 3.32Å; K184-M186 PolarHBondContact O-N 3.46Å; M186-E188 VanDerWaalsContact C-N 3.35Å; M186-R189 PolarHBondContact O-N 3.4Å; M186-I190 WeakPolarHBondContact O-CG1 3.34Å; M186-I190 PolarHBondContact O-N 3.04Å; M186-I190 VanDerWaalsContact O-N 3.1Å
187	S	75.3	Confident	69	Low	9 Å²	9	68.4 Å²	68.4	6%	0.063	37%	0.373	C	S	.	.	H	α-helix	trans	-63.9	-38.8	174.9	-69.2	0	0	0	0	112.1	K103 L183 K184 R189 I190 G191	K103-S187 VanDerWaalsContact CB-OG 3.29Å; K103-S187 WeakPolarHBondContact CB-OG 3.28Å; K103-S187 WeakPolarHBondContact CE-OG 3.34Å; L183-S187 WeakPolarHBondContact O-CB 3.44Å; L183-S187 PolarHBondContact O-N 2.79Å; L183-S187 PolarHBondContact O-OG 2.89Å; L183-S187 VanDerWaalsContact O-OG 3.13Å; K184-S187 PolarHBondContact O-N 3.44Å; S187-R189 VanDerWaalsContact C-N 3.32Å; S187-R189 PolarHBondContact O-N 3.22Å; S187-I190 PolarHBondContact O-N 2.95Å; S187-G191 PolarHBondContact O-N 3.41Å
188	E	77.4	Confident	69.6	Low	121 Å²	121	67.3 Å²	67.3	57%	0.565	37%	0.368	S	S	*	.	H	α-helix	trans	-62.3	-41.1	176.5	-173.1	175.2	-170	0	0	111.5	K184 N185 M186 G191 L192	K184-E188 WeakPolarHBondContact O-CB 3.41Å; K184-E188 PolarHBondContact O-N 3.03Å; N185-E188 PolarHBondContact O-N 3.42Å; M186-E188 VanDerWaalsContact C-N 3.35Å; E188-G191 PolarHBondContact O-N 2.99Å; E188-L192 WeakPolarHBondContact O-CG 3.41Å; E188-L192 PolarHBondContact O-N 3.19Å; E188-L192 VanDerWaalsContact O-N 3.12Å
189	R	74.8	Confident	70	Confident	170 Å²	170	66.8 Å²	66.8	64%	0.642	36%	0.363	S	S	*	.	H	α-helix	trans	-64.3	-43.6	176	-155.2	-178.8	-167.1	-117.1	3.1	112.1	N185 M186 S187 L192 E193	N185-R189 PolarHBondContact O-N 3.29Å; M186-R189 PolarHBondContact O-N 3.4Å; S187-R189 VanDerWaalsContact C-N 3.32Å; S187-R189 PolarHBondContact O-N 3.22Å; R189-L192 PolarHBondContact O-N 3.03Å; R189-E193 PolarHBondContact O-N 3.08Å
190	I	74.5	Confident	70.5	Confident	14 Å²	14	68.5 Å²	68.5	7%	0.072	37%	0.368	C	S	.	.	H	α-helix	trans	-63.9	-41.4	175.6	-69.3	169.5	0	0	0	110.9	E58 Q100 K103 M186 S187 L192 E193 L194	E58-I190 HydrophobicContact CG-CD1 4.23Å; Q100-I190 HydrophobicContact CB-CG2 3.95Å; Q100-I190 HydrophobicContact CG-CG2 4.19Å; K103-I190 HydrophobicContact CD-CD1 4.35Å; M186-I190 WeakPolarHBondContact O-CG1 3.34Å; M186-I190 PolarHBondContact O-N 3.04Å; M186-I190 VanDerWaalsContact O-N 3.1Å; S187-I190 PolarHBondContact O-N 2.95Å; I190-L192 PolarHBondContact O-N 3.37Å; I190-E193 PolarHBondContact O-N 2.94Å; I190-L194 HydrophobicContact CG2-CD1 3.45Å; I190-L194 VanDerWaalsContact CG2-CD1 3.45Å; I190-L194 HydrophobicContact CG2-CG 4.13Å; I190-L194 WeakPolarHBondContact O-CB 3.45Å; I190-L194 WeakPolarHBondContact O-CG 3.44Å; I190-L194 PolarHBondContact O-N 3.22Å
191	G	77.6	Confident	70.7	Confident	22 Å²	22	70.4 Å²	70.4	23%	0.227	38%	0.377	C	S	.	.	H	α-helix	trans	-61.7	-41.1	179.6	0	0	0	0	0	112.7	S187 E188 L194 D195	S187-G191 PolarHBondContact O-N 3.41Å; E188-G191 PolarHBondContact O-N 2.99Å; G191-L194 PolarHBondContact O-N 2.8Å; G191-D195 WeakPolarHBondContact O-CB 3.42Å; G191-D195 PolarHBondContact O-N 3.38Å
192	L	77.5	Confident	71.1	Confident	122 Å²	122	74.2 Å²	74.2	64%	0.639	39%	0.389	S	S	*	.	H	α-helix	trans	-65.4	-42.7	175.6	-69.4	171.3	0	0	0	112.2	E188 R189 I190 D195 E196	E188-L192 WeakPolarHBondContact O-CG 3.41Å; E188-L192 PolarHBondContact O-N 3.19Å; E188-L192 VanDerWaalsContact O-N 3.12Å; R189-L192 PolarHBondContact O-N 3.03Å; I190-L192 PolarHBondContact O-N 3.37Å; L192-D195 PolarHBondContact O-N 3.11Å; L192-E196 PolarHBondContact O-N 3.44Å; L192-E196 VanDerWaalsContact O-N 3.16Å
193	E	76.9	Confident	71.1	Confident	52 Å²	52	76.4 Å²	76.4	24%	0.243	40%	0.398	C	S	.	.	H	α-helix	trans	-70.3	-33.8	179.1	-167.5	175.7	167.9	0	0	112.1	R96 R189 I190 E196 Q197	R96-E193 IonicContact CZ-OE1 3.17Å; R96-E193 IonicContact CZ-OE2 2.59Å; R96-E193 IonicContact NH1-OE1 2.95Å; R96-E193 PolarHBondContact NH1-OE1 3.41Å; R96-E193 IonicContact NH1-OE2 3.01Å; R96-E193 PolarHBondContact NH1-OE2 2.81Å; R96-E193 IonicContact NH2-OE1 2.64Å; R96-E193 PolarHBondContact NH2-OE1 3.24Å; R96-E193 IonicContact NH2-OE2 3.7Å; R189-E193 PolarHBondContact O-N 3.08Å; I190-E193 PolarHBondContact O-N 2.94Å; E193-E196 PolarHBondContact O-N 3.26Å; E193-Q197 WeakPolarHBondContact O-CB 3.44Å; E193-Q197 VanDerWaalsContact O-CG 3.28Å; E193-Q197 WeakPolarHBondContact O-CG 3.42Å; E193-Q197 PolarHBondContact O-N 3.07Å
194	L	78.4	Confident	71	Confident	10 Å²	10	78.6 Å²	78.6	5%	0.052	41%	0.407	C	S	.	.	H	α-helix	trans	-72.4	-31.3	174	-77.4	170.3	0	0	0	112.8	T93 R96 L97 Q100 I190 G191 E196 Q197 A198	T93-L194 HydrophobicContact CG2-CD2 3.88Å; R96-L194 HydrophobicContact CB-CD1 4.23Å; R96-L194 HydrophobicContact CB-CD2 3.89Å; R96-L194 HydrophobicContact CB-CG 4.38Å; L97-L194 HydrophobicContact CD2-CD1 3.82Å; L97-L194 HydrophobicContact CD2-CD2 4.24Å; L97-L194 HydrophobicContact CD2-CG 4.5Å; L97-L194 HydrophobicContact CG-CD1 4.15Å; L97-L194 HydrophobicContact CG-CD2 4.01Å; Q100-L194 HydrophobicContact CB-CD1 4.39Å; I190-L194 HydrophobicContact CG2-CD1 3.45Å; I190-L194 VanDerWaalsContact CG2-CD1 3.45Å; I190-L194 HydrophobicContact CG2-CG 4.13Å; I190-L194 WeakPolarHBondContact O-CB 3.45Å; I190-L194 WeakPolarHBondContact O-CG 3.44Å; I190-L194 PolarHBondContact O-N 3.22Å; G191-L194 PolarHBondContact O-N 2.8Å; L194-E196 VanDerWaalsContact C-N 3.34Å; L194-Q197 CarbonylContact O-C 3.58Å; L194-Q197 PolarHBondContact O-N 3.34Å; L194-A198 VanDerWaalsContact O-CB 3.24Å; L194-A198 WeakPolarHBondContact O-CB 3.39Å; L194-A198 PolarHBondContact O-N 3.02Å
195	D	75.9	Confident	70.9	Confident	126 Å²	126	73.4 Å²	73.4	67%	0.674	39%	0.392	S	S	*	.	H	α-helix	trans	-66.8	-38.8	172.4	-156.9	34.8	0	0	0	110.7	G191 L192 A198 G199	G191-D195 WeakPolarHBondContact O-CB 3.42Å; G191-D195 PolarHBondContact O-N 3.38Å; L192-D195 PolarHBondContact O-N 3.11Å; D195-A198 PolarHBondContact O-N 3.01Å; D195-G199 PolarHBondContact O-N 3.23Å
196	E	72.2	Confident	71.2	Confident	137 Å²	137	75.2 Å²	75.2	64%	0.64	40%	0.397	S	S	*	.	H	α-helix	trans	-63.1	-45	170.6	-176.9	176.1	-171.1	0	0	111.8	L192 E193 L194 G199 M200	L192-E196 PolarHBondContact O-N 3.44Å; L192-E196 VanDerWaalsContact O-N 3.16Å; E193-E196 PolarHBondContact O-N 3.26Å; L194-E196 VanDerWaalsContact C-N 3.34Å; E196-G199 PolarHBondContact O-N 3.03Å; E196-M200 HydrophobicContact CG-CE 4.42Å
197	Q	66.6	Low	71.4	Confident	16 Å²	16	77.7 Å²	77.7	8%	0.075	41%	0.408	C	S	.	.	H	α-helix	trans	-71.9	-25.4	177.7	-69.2	-180	24.2	0	0	113.5	T93 E193 L194 G199 M200 L201	T93-Q197 HydrophobicContact CG2-CB 4.34Å; T93-Q197 PolarHBondContact OG1-OE1 3.24Å; E193-Q197 WeakPolarHBondContact O-CB 3.44Å; E193-Q197 VanDerWaalsContact O-CG 3.28Å; E193-Q197 WeakPolarHBondContact O-CG 3.42Å; E193-Q197 PolarHBondContact O-N 3.07Å; L194-Q197 CarbonylContact O-C 3.58Å; L194-Q197 PolarHBondContact O-N 3.34Å; Q197-G199 VanDerWaalsContact C-N 3.34Å; Q197-M200 HydrophobicContact CB-CE 4.27Å; Q197-M200 HydrophobicContact CG-CE 3.74Å; Q197-M200 CarbonylContact O-C 3.56Å; Q197-M200 PolarHBondContact O-N 3.08Å; Q197-M200 VanDerWaalsContact O-N 3.16Å; Q197-L201 WeakPolarHBondContact O-CB 3.48Å; Q197-L201 PolarHBondContact O-N 3.25Å
198	A	65.9	Low	71.3	Confident	51 Å²	51	82 Å²	82	42%	0.421	43%	0.428	S	S	.	.	H	α-helix	trans	-66.2	-37.7	176.5	0	0	0	0	0	111.4	L194 D195 M200 L201 D202	L194-A198 VanDerWaalsContact O-CB 3.24Å; L194-A198 WeakPolarHBondContact O-CB 3.39Å; L194-A198 PolarHBondContact O-N 3.02Å; D195-A198 PolarHBondContact O-N 3.01Å; A198-M200 VanDerWaalsContact C-N 3.34Å; A198-L201 PolarHBondContact O-N 3.02Å; A198-D202 PolarHBondContact O-N 2.9Å; A198-D202 VanDerWaalsContact O-N 3.1Å
199	G	64.1	Low	71.3	Confident	44 Å²	44	80.9 Å²	80.9	45%	0.454	43%	0.426	S	S	.	.	H	α-helix	trans	-60.7	-42.2	169.4	0	0	0	0	0	112.2	D195 E196 Q197 L201 D203	D195-G199 PolarHBondContact O-N 3.23Å; E196-G199 PolarHBondContact O-N 3.03Å; Q197-G199 VanDerWaalsContact C-N 3.34Å; G199-L201 VanDerWaalsContact C-N 3.35Å; G199-D203 PolarHBondContact O-N 3.36Å
200	M	62.4	Low	71.4	Confident	99 Å²	99	74.8 Å²	74.8	49%	0.488	41%	0.41	S	S	.	.	H	α-helix	trans	-71.8	-25.8	176.2	-65.6	-170.5	-75.2	0	0	113.5	E196 Q197 A198 F204	E196-M200 HydrophobicContact CG-CE 4.42Å; Q197-M200 HydrophobicContact CB-CE 4.27Å; Q197-M200 HydrophobicContact CG-CE 3.74Å; Q197-M200 CarbonylContact O-C 3.56Å; Q197-M200 PolarHBondContact O-N 3.08Å; Q197-M200 VanDerWaalsContact O-N 3.16Å; A198-M200 VanDerWaalsContact C-N 3.34Å; M200-F204 PolarHBondContact O-N 3.49Å
201	L	64.6	Low	71.4	Confident	69 Å²	69	77 Å²	77	36%	0.361	42%	0.424	S	S	.	.	H	α-helix	trans	-79.1	-31.7	179.5	-163.5	74.9	0	0	0	112.3	Q197 A198 G199 F204 G205	Q197-L201 WeakPolarHBondContact O-CB 3.48Å; Q197-L201 PolarHBondContact O-N 3.25Å; A198-L201 PolarHBondContact O-N 3.02Å; G199-L201 VanDerWaalsContact C-N 3.35Å; L201-F204 HydrophobicContact CD1-CD1 3.75Å; L201-F204 WeakPolarHBondContact O-CB 3.04Å; L201-F204 PolarHBondContact O-N 3.27Å; L201-G205 PolarHBondContact O-N 3.09Å
202	D	71.1	Confident	71.3	Confident	121 Å²	121	80.5 Å²	80.5	65%	0.647	43%	0.434	S	S	*	.	H	α-helix	trans	-64.1	-44.1	170.7	-169.1	49.5	0	0	0	110.7	A198 F204 G205 H206	A198-D202 PolarHBondContact O-N 2.9Å; A198-D202 VanDerWaalsContact O-N 3.1Å; D202-F204 VanDerWaalsContact C-N 3.27Å; D202-F204 PolarHBondContact O-N 3.14Å; D202-G205 PolarHBondContact O-N 3.09Å; D202-G205 VanDerWaalsContact O-N 3.15Å; D202-H206 PolarHBondContact O-N 3.33Å
203	D	66	Low	71.6	Confident	114 Å²	114	77.9 Å²	77.9	61%	0.61	43%	0.426	S	S	*	.	H	α-helix	trans	-60.1	-38.1	171.5	-75.3	-20	0	0	0	111.8	G199 H206 E207	G199-D203 PolarHBondContact O-N 3.36Å; D203-H206 PolarHBondContact O-N 3.12Å; D203-E207 PolarHBondContact O-N 2.82Å
204	F	63.8	Low	71.7	Confident	54 Å²	54	83.9 Å²	83.9	24%	0.237	45%	0.446	C	S	.	.	H	α-helix	trans	-63.4	-46.3	172.2	167.6	-126.3	0	0	0	112.6	T86 A90 M200 L201 D202 H206 E207 M208	T86-F204 HydrophobicContact CG2-CB 4.48Å; T86-F204 HydrophobicContact CG2-CD1 4.44Å; T86-F204 HydrophobicContact CG2-CD2 2.96Å; T86-F204 HydrophobicContact CG2-CE1 4.46Å; T86-F204 HydrophobicContact CG2-CE2 3.02Å; T86-F204 HydrophobicContact CG2-CG 3.72Å; T86-F204 HydrophobicContact CG2-CZ 3.81Å; A90-F204 HydrophobicContact CB-CE1 4.16Å; M200-F204 PolarHBondContact O-N 3.49Å; L201-F204 HydrophobicContact CD1-CD1 3.75Å; L201-F204 WeakPolarHBondContact O-CB 3.04Å; L201-F204 PolarHBondContact O-N 3.27Å; D202-F204 VanDerWaalsContact C-N 3.27Å; D202-F204 PolarHBondContact O-N 3.14Å; F204-H206 PolarHBondContact O-N 3.46Å; F204-E207 PolarHBondContact O-N 3.41Å; F204-E207 VanDerWaalsContact O-N 3.12Å; F204-M208 HydrophobicContact CD2-CB 4.38Å; F204-M208 HydrophobicContact CE2-CB 3.94Å; F204-M208 HydrophobicContact CE2-CG 4.46Å; F204-M208 HydrophobicContact CZ-CB 4.32Å; F204-M208 HydrophobicContact CZ-SD 4.11Å; F204-M208 WeakPolarHBondContact O-CB 3.47Å; F204-M208 PolarHBondContact O-N 3.25Å
205	G	69.6	Low	71.6	Confident	27 Å²	27	87.6 Å²	87.6	28%	0.278	47%	0.466	S	S	.	.	H	α-helix	trans	-54.3	-42.9	175.5	0	0	0	0	0	110.8	L201 D202 M208 D209	L201-G205 PolarHBondContact O-N 3.09Å; D202-G205 PolarHBondContact O-N 3.09Å; D202-G205 VanDerWaalsContact O-N 3.15Å; G205-M208 PolarHBondContact O-N 2.85Å; G205-D209 WeakPolarHBondContact O-CB 3.19Å; G205-D209 PolarHBondContact O-N 3.03Å
206	H	75.4	Confident	72	Confident	142 Å²	142	84.6 Å²	84.6	66%	0.657	45%	0.45	S	S	*	.	H	α-helix	trans	-67	-38.4	178.3	-145.7	-41	0	0	0	113.3	D202 D203 F204 S210	D202-H206 PolarHBondContact O-N 3.33Å; D203-H206 PolarHBondContact O-N 3.12Å; F204-H206 PolarHBondContact O-N 3.46Å; H206-S210 WeakPolarHBondContact O-CB 3.37Å; H206-S210 PolarHBondContact O-N 3.41Å; H206-S210 VanDerWaalsContact O-N 3.15Å
207	E	69.1	Low	72.6	Confident	112 Å²	112	82.3 Å²	82.3	52%	0.523	44%	0.442	S	S	.	.	H	α-helix	trans	-72.2	-37.3	175.6	-167.6	173.2	-167.4	0	0	112.2	D203 F204 S210 T211	D203-E207 PolarHBondContact O-N 2.82Å; F204-E207 PolarHBondContact O-N 3.41Å; F204-E207 VanDerWaalsContact O-N 3.12Å; E207-S210 WeakPolarHBondContact O-CB 3.49Å; E207-S210 PolarHBondContact O-N 3.44Å; E207-S210 PolarHBondContact O-OG 2.74Å; E207-T211 WeakPolarHBondContact O-CB 3.38Å; E207-T211 PolarHBondContact O-N 3.11Å; E207-T211 PolarHBondContact O-OG1 3.23Å
208	M	74.4	Confident	73.3	Confident	99 Å²	99	85.2 Å²	85.2	49%	0.488	46%	0.461	S	S	.	.	H	α-helix	trans	-63.8	-46.7	174.7	-170.3	-177.5	83.8	0	0	111.1	F204 G205 S210 T211 Q212	F204-M208 HydrophobicContact CD2-CB 4.38Å; F204-M208 HydrophobicContact CE2-CB 3.94Å; F204-M208 HydrophobicContact CE2-CG 4.46Å; F204-M208 HydrophobicContact CZ-CB 4.32Å; F204-M208 HydrophobicContact CZ-SD 4.11Å; F204-M208 WeakPolarHBondContact O-CB 3.47Å; F204-M208 PolarHBondContact O-N 3.25Å; G205-M208 PolarHBondContact O-N 2.85Å; M208-S210 VanDerWaalsContact C-N 3.25Å; M208-S210 PolarHBondContact O-N 3.43Å; M208-T211 CarbonylContact O-C 3.59Å; M208-T211 PolarHBondContact O-N 2.91Å; M208-T211 VanDerWaalsContact O-N 3.08Å; M208-Q212 WeakPolarHBondContact O-CB 3.34Å; M208-Q212 PolarHBondContact O-N 3.05Å
209	D	76.8	Confident	73.7	Confident	97 Å²	97	87.9 Å²	87.9	52%	0.519	47%	0.466	S	S	.	.	H	α-helix	trans	-61.1	-37.4	175.8	-80.4	-11.7	0	0	0	111.7	G205 S213	G205-D209 WeakPolarHBondContact O-CB 3.19Å; G205-D209 PolarHBondContact O-N 3.03Å; D209-S213 VanDerWaalsContact O-CB 3.3Å; D209-S213 WeakPolarHBondContact O-CB 3.24Å; D209-S213 PolarHBondContact O-N 2.85Å; D209-S213 PolarHBondContact O-OG 3.03Å
210	S	76.1	Confident	74.6	Confident	43 Å²	43	92.5 Å²	92.5	30%	0.301	47%	0.473	S	S	.	.	H	α-helix	trans	-66.6	-38.3	174.6	91.2	0	0	0	0	112	H206 E207 M208 R214	H206-S210 WeakPolarHBondContact O-CB 3.37Å; H206-S210 PolarHBondContact O-N 3.41Å; H206-S210 VanDerWaalsContact O-N 3.15Å; E207-S210 WeakPolarHBondContact O-CB 3.49Å; E207-S210 PolarHBondContact O-N 3.44Å; E207-S210 PolarHBondContact O-OG 2.74Å; M208-S210 VanDerWaalsContact C-N 3.25Å; M208-S210 PolarHBondContact O-N 3.43Å; S210-R214 VanDerWaalsContact O-CG 3.26Å; S210-R214 WeakPolarHBondContact O-CG 3.44Å; S210-R214 PolarHBondContact O-N 2.64Å
211	T	74.4	Confident	75.5	Confident	60 Å²	60	94.9 Å²	94.9	37%	0.368	48%	0.481	S	S	.	.	H	α-helix	trans	-71.9	-42.7	178.3	-61.7	0	0	0	0	111.1	E207 M208 S213 R214 L215	E207-T211 WeakPolarHBondContact O-CB 3.38Å; E207-T211 PolarHBondContact O-N 3.11Å; E207-T211 PolarHBondContact O-OG1 3.23Å; M208-T211 CarbonylContact O-C 3.59Å; M208-T211 PolarHBondContact O-N 2.91Å; M208-T211 VanDerWaalsContact O-N 3.08Å; T211-S213 VanDerWaalsContact C-N 3.31Å; T211-S213 PolarHBondContact O-N 2.95Å; T211-R214 CarbonylContact O-C 3.58Å; T211-R214 WeakPolarHBondContact O-CB 3.48Å; T211-R214 PolarHBondContact O-N 2.83Å; T211-R214 VanDerWaalsContact O-N 3.11Å; T211-L215 HydrophobicContact CG2-CD1 4.29Å; T211-L215 HydrophobicContact CG2-CG 4.49Å; T211-L215 WeakPolarHBondContact O-CG 3.32Å; T211-L215 PolarHBondContact O-N 3.23Å
212	Q	76.2	Confident	75.9	Confident	96 Å²	96	96.9 Å²	96.9	45%	0.449	49%	0.492	S	S	.	.	H	α-helix	trans	-59.1	-44.6	173.6	-173.2	67.3	6.1	0	0	110.6	M208 R214 L215 D216	M208-Q212 WeakPolarHBondContact O-CB 3.34Å; M208-Q212 PolarHBondContact O-N 3.05Å; Q212-R214 VanDerWaalsContact C-N 3.31Å; Q212-R214 PolarHBondContact O-N 2.96Å; Q212-L215 PolarHBondContact O-N 3.47Å; Q212-D216 WeakPolarHBondContact O-CB 3.29Å; Q212-D216 PolarHBondContact O-N 3.11Å
213	S	83.4	Confident	76	Confident	66 Å²	66	94 Å²	94	46%	0.462	49%	0.485	S	S	.	.	H	α-helix	trans	-61.4	-38.4	174.9	-62.9	0	0	0	0	112.4	D209 T211 N217	D209-S213 VanDerWaalsContact O-CB 3.3Å; D209-S213 WeakPolarHBondContact O-CB 3.24Å; D209-S213 PolarHBondContact O-N 2.85Å; D209-S213 PolarHBondContact O-OG 3.03Å; T211-S213 VanDerWaalsContact C-N 3.31Å; T211-S213 PolarHBondContact O-N 2.95Å; S213-N217 WeakPolarHBondContact O-CB 3.47Å; S213-N217 PolarHBondContact O-N 3.11Å; S213-N217 VanDerWaalsContact O-N 3.08Å; S213-N217 PolarHBondContact O-ND2 3.11Å
214	R	78.9	Confident	76.4	Confident	178 Å²	178	95.2 Å²	95.2	67%	0.672	49%	0.485	S	S	*	.	H	α-helix	trans	-67.6	-44.2	174.1	-72.2	170.8	-172.7	-140.6	5.4	111.6	S210 T211 Q212 N217 V218	S210-R214 VanDerWaalsContact O-CG 3.26Å; S210-R214 WeakPolarHBondContact O-CG 3.44Å; S210-R214 PolarHBondContact O-N 2.64Å; T211-R214 CarbonylContact O-C 3.58Å; T211-R214 WeakPolarHBondContact O-CB 3.48Å; T211-R214 PolarHBondContact O-N 2.83Å; T211-R214 VanDerWaalsContact O-N 3.11Å; Q212-R214 VanDerWaalsContact C-N 3.31Å; Q212-R214 PolarHBondContact O-N 2.96Å; R214-N217 WeakPolarHBondContact O-CB 3.36Å; R214-N217 PolarHBondContact O-N 3.16Å; R214-V218 WeakPolarHBondContact O-CG2 3.42Å; R214-V218 PolarHBondContact O-N 3.34Å
215	L	77.1	Confident	76.8	Confident	88 Å²	88	97 Å²	97	46%	0.461	50%	0.499	S	S	.	.	H	α-helix	trans	-62.6	-43.1	176.7	-75.8	174.4	0	0	0	111.5	T211 Q212 N217 V218 M219	T211-L215 HydrophobicContact CG2-CD1 4.29Å; T211-L215 HydrophobicContact CG2-CG 4.49Å; T211-L215 WeakPolarHBondContact O-CG 3.32Å; T211-L215 PolarHBondContact O-N 3.23Å; Q212-L215 PolarHBondContact O-N 3.47Å; L215-N217 VanDerWaalsContact C-N 3.3Å; L215-N217 PolarHBondContact O-N 3.33Å; L215-V218 CarbonylContact O-C 3.54Å; L215-V218 WeakPolarHBondContact O-CB 3.26Å; L215-V218 PolarHBondContact O-N 3.26Å; L215-V218 VanDerWaalsContact O-N 3.11Å; L215-M219 WeakPolarHBondContact O-CB 3.09Å; L215-M219 PolarHBondContact O-N 3.13Å
216	D	83.1	Confident	76.7	Confident	63 Å²	63	100.3 Å²	100.3	34%	0.337	52%	0.518	S	S	.	.	H	α-helix	trans	-61.7	-39.7	174.5	-81.3	-10.8	0	0	0	111.8	Q212 V218 M219 K220	Q212-D216 WeakPolarHBondContact O-CB 3.29Å; Q212-D216 PolarHBondContact O-N 3.11Å; D216-V218 VanDerWaalsContact C-N 3.34Å; D216-M219 PolarHBondContact O-N 3.18Å; D216-K220 WeakPolarHBondContact O-CB 3.3Å; D216-K220 VanDerWaalsContact O-CG 3.24Å; D216-K220 WeakPolarHBondContact O-CG 3.31Å; D216-K220 PolarHBondContact O-N 3.34Å
217	N	85.6	Confident	76.1	Confident	89 Å²	89	101.4 Å²	101.4	48%	0.476	52%	0.523	S	S	.	.	H	α-helix	trans	-65.6	-37.8	174	-75.3	-32.5	0	0	0	112.1	S213 R214 L215 K221	S213-N217 WeakPolarHBondContact O-CB 3.47Å; S213-N217 PolarHBondContact O-N 3.11Å; S213-N217 VanDerWaalsContact O-N 3.08Å; S213-N217 PolarHBondContact O-ND2 3.11Å; R214-N217 WeakPolarHBondContact O-CB 3.36Å; R214-N217 PolarHBondContact O-N 3.16Å; L215-N217 VanDerWaalsContact C-N 3.3Å; L215-N217 PolarHBondContact O-N 3.33Å; N217-K221 WeakPolarHBondContact O-CB 3.49Å; N217-K221 VanDerWaalsContact O-CG 3.29Å; N217-K221 WeakPolarHBondContact O-CG 3.21Å; N217-K221 PolarHBondContact O-N 3.41Å
218	V	81.4	Confident	75.4	Confident	77 Å²	77	101.7 Å²	101.7	47%	0.467	53%	0.526	S	S	.	.	H	α-helix	trans	-67.8	-45.3	174.1	171.6	0	0	0	0	110.8	R214 L215 D216 K220 K221 L222	R214-V218 WeakPolarHBondContact O-CG2 3.42Å; R214-V218 PolarHBondContact O-N 3.34Å; L215-V218 CarbonylContact O-C 3.54Å; L215-V218 WeakPolarHBondContact O-CB 3.26Å; L215-V218 PolarHBondContact O-N 3.26Å; L215-V218 VanDerWaalsContact O-N 3.11Å; D216-V218 VanDerWaalsContact C-N 3.34Å; V218-K220 VanDerWaalsContact C-N 3.34Å; V218-K220 PolarHBondContact O-N 2.91Å; V218-K221 CarbonylContact O-C 3.52Å; V218-K221 WeakPolarHBondContact O-CA 3.47Å; V218-K221 WeakPolarHBondContact O-CB 3.21Å; V218-K221 PolarHBondContact O-N 2.96Å; V218-K221 VanDerWaalsContact O-N 3.09Å; V218-L222 HydrophobicContact CG1-CD1 4.01Å; V218-L222 HydrophobicContact CG1-CG 4.31Å; V218-L222 WeakPolarHBondContact O-CG 3.33Å; V218-L222 PolarHBondContact O-N 2.76Å
219	M	74	Confident	74.6	Confident	107 Å²	107	101.5 Å²	101.5	53%	0.527	53%	0.527	S	S	.	.	H	α-helix	trans	-61.6	-41.4	176.5	-78.5	-164.4	-92.4	0	0	111.7	L215 D216 K221 L222 A223	L215-M219 WeakPolarHBondContact O-CB 3.09Å; L215-M219 PolarHBondContact O-N 3.13Å; D216-M219 PolarHBondContact O-N 3.18Å; M219-K221 VanDerWaalsContact C-N 3.33Å; M219-K221 PolarHBondContact O-N 2.76Å; M219-L222 PolarHBondContact O-N 3.01Å; M219-A223 WeakPolarHBondContact O-CB 3.48Å; M219-A223 PolarHBondContact O-N 3.09Å
220	K	83.5	Confident	73.8	Confident	142 Å²	142	99.4 Å²	99.4	62%	0.617	52%	0.52	S	S	*	.	H	α-helix	trans	-61.4	-41.1	172.1	-76.4	170.3	-175.5	167.9	0	111.9	D216 V218 K224	D216-K220 WeakPolarHBondContact O-CB 3.3Å; D216-K220 VanDerWaalsContact O-CG 3.24Å; D216-K220 WeakPolarHBondContact O-CG 3.31Å; D216-K220 PolarHBondContact O-N 3.34Å; V218-K220 VanDerWaalsContact C-N 3.34Å; V218-K220 PolarHBondContact O-N 2.91Å; K220-K224 WeakPolarHBondContact O-CB 3.43Å; K220-K224 PolarHBondContact O-N 2.8Å
221	K	81.4	Confident	73.3	Confident	149 Å²	149	101.9 Å²	101.9	65%	0.648	53%	0.53	S	S	*	.	H	α-helix	trans	-67.2	-39.4	175.1	-76	176.3	-178.5	-177.8	0	111.9	N217 V218 M219 K224 V225	N217-K221 WeakPolarHBondContact O-CB 3.49Å; N217-K221 VanDerWaalsContact O-CG 3.29Å; N217-K221 WeakPolarHBondContact O-CG 3.21Å; N217-K221 PolarHBondContact O-N 3.41Å; V218-K221 CarbonylContact O-C 3.52Å; V218-K221 WeakPolarHBondContact O-CA 3.47Å; V218-K221 WeakPolarHBondContact O-CB 3.21Å; V218-K221 PolarHBondContact O-N 2.96Å; V218-K221 VanDerWaalsContact O-N 3.09Å; M219-K221 VanDerWaalsContact C-N 3.33Å; M219-K221 PolarHBondContact O-N 2.76Å; K221-K224 CarbonylContact O-C 3.6Å; K221-K224 PolarHBondContact O-N 3.4Å; K221-V225 WeakPolarHBondContact O-CB 3.31Å; K221-V225 WeakPolarHBondContact O-CG2 3.33Å; K221-V225 PolarHBondContact O-N 3.27Å
222	L	73	Confident	73	Confident	111 Å²	111	109.6 Å²	109.6	58%	0.581	55%	0.552	S	S	*	*	H	α-helix	trans	-66.7	-44.7	175.6	-75	172.8	0	0	0	111.7	V218 M219 K224 V225 S226	V218-L222 HydrophobicContact CG1-CD1 4.01Å; V218-L222 HydrophobicContact CG1-CG 4.31Å; V218-L222 WeakPolarHBondContact O-CG 3.33Å; V218-L222 PolarHBondContact O-N 2.76Å; M219-L222 PolarHBondContact O-N 3.01Å; L222-K224 VanDerWaalsContact C-N 3.28Å; L222-K224 PolarHBondContact O-N 2.75Å; L222-V225 PolarHBondContact O-N 3.15Å; L222-S226 WeakPolarHBondContact O-CB 3.39Å; L222-S226 PolarHBondContact O-N 3.37Å
223	A	72.4	Confident	72.8	Confident	61 Å²	61	114.6 Å²	114.6	50%	0.504	57%	0.567	S	S	.	*	H	α-helix	trans	-59.6	-41.7	172.9	0	0	0	0	0	111	M219 H227	M219-A223 WeakPolarHBondContact O-CB 3.48Å; M219-A223 PolarHBondContact O-N 3.09Å; A223-H227 VanDerWaalsContact O-CB 3.31Å; A223-H227 WeakPolarHBondContact O-CB 3.45Å; A223-H227 PolarHBondContact O-N 3.46Å
224	K	74.8	Confident	72.5	Confident	139 Å²	139	116.2 Å²	116.2	60%	0.604	57%	0.567	S	S	*	*	H	α-helix	trans	-68.2	-41.4	176.7	-172.8	170.8	-176.5	172.8	0	112.6	K220 K221 L222 H227 M228	K220-K224 WeakPolarHBondContact O-CB 3.43Å; K220-K224 PolarHBondContact O-N 2.8Å; K221-K224 CarbonylContact O-C 3.6Å; K221-K224 PolarHBondContact O-N 3.4Å; L222-K224 VanDerWaalsContact C-N 3.28Å; L222-K224 PolarHBondContact O-N 2.75Å; K224-H227 CarbonylContact O-C 3.51Å; K224-H227 PolarHBondContact O-N 3.43Å; K224-M228 HydrophobicContact CD-SD 4.15Å; K224-M228 HydrophobicContact CG-CG 4.43Å; K224-M228 HydrophobicContact CG-SD 3.63Å; K224-M228 WeakPolarHBondContact O-CA 3.12Å; K224-M228 WeakPolarHBondContact O-CB 3.48Å; K224-M228 WeakPolarHBondContact O-CG 3.12Å; K224-M228 PolarHBondContact O-N 3.3Å
225	V	71.7	Confident	72.5	Confident	90 Å²	90	116.3 Å²	116.3	55%	0.545	57%	0.568	S	S	.	*	H	α-helix	trans	-69.2	-40.4	177.1	167.8	0	0	0	0	110.9	K221 L222 H227 M228 N229	K221-V225 WeakPolarHBondContact O-CB 3.31Å; K221-V225 WeakPolarHBondContact O-CG2 3.33Å; K221-V225 PolarHBondContact O-N 3.27Å; L222-V225 PolarHBondContact O-N 3.15Å; V225-H227 VanDerWaalsContact C-N 3.29Å; V225-H227 PolarHBondContact O-N 2.76Å; V225-M228 PolarHBondContact O-N 3.35Å; V225-M228 VanDerWaalsContact O-N 3.15Å; V225-N229 PolarHBondContact O-N 2.83Å; V225-N229 VanDerWaalsContact O-N 3.14Å
226	S	68.2	Low	72.8	Confident	97 Å²	97	116 Å²	116	68%	0.678	57%	0.572	S	S	*	*	H	α-helix	trans	-57.9	-42.9	171.8	171.8	0	0	0	0	111	L222	L222-S226 WeakPolarHBondContact O-CB 3.39Å; L222-S226 PolarHBondContact O-N 3.37Å
227	H	62.2	Low	73	Confident	165 Å²	165	115.9 Å²	115.9	76%	0.764	58%	0.58	S	S	*	*	H	α-helix	trans	-82.9	-15.3	177.1	-161.5	-67.5	0	0	0	113.8	A223 K224 V225	A223-H227 VanDerWaalsContact O-CB 3.31Å; A223-H227 WeakPolarHBondContact O-CB 3.45Å; A223-H227 PolarHBondContact O-N 3.46Å; K224-H227 CarbonylContact O-C 3.51Å; K224-H227 PolarHBondContact O-N 3.43Å; V225-H227 VanDerWaalsContact C-N 3.29Å; V225-H227 PolarHBondContact O-N 2.76Å
228	M	55.8	Low	73.1	Confident	119 Å²	119	116.3 Å²	116.3	59%	0.586	58%	0.581	S	S	*	*	H	α-helix	trans	-89.1	-4.4	176.4	-93.5	166.9	40.1	0	0	113.4	K224 V225 S230	K224-M228 HydrophobicContact CD-SD 4.15Å; K224-M228 HydrophobicContact CG-CG 4.43Å; K224-M228 HydrophobicContact CG-SD 3.63Å; K224-M228 WeakPolarHBondContact O-CA 3.12Å; K224-M228 WeakPolarHBondContact O-CB 3.48Å; K224-M228 WeakPolarHBondContact O-CG 3.12Å; K224-M228 PolarHBondContact O-N 3.3Å; V225-M228 PolarHBondContact O-N 3.35Å; V225-M228 VanDerWaalsContact O-N 3.15Å; M228-S230 PolarHBondContact O-N 3.39Å
229	N	56.9	Low	73.5	Confident	95 Å²	95	114.5 Å²	114.5	51%	0.508	58%	0.578	S	S	.	*	S	Bend	trans	-68.1	79.8	159.7	-163	17	0	0	0	107.6	V225 D231	V225-N229 PolarHBondContact O-N 2.83Å; V225-N229 VanDerWaalsContact O-N 3.14Å; N229-D231 VanDerWaalsContact C-N 3.31Å; N229-D231 PolarHBondContact O-N 3.14Å
230	S	60.2	Low	74.5	Confident	52 Å²	52	113.3 Å²	113.3	36%	0.364	58%	0.577	S	S	.	*			trans	-72.8	86.6	-168.3	67.3	0	0	0	0	109.7	M228 R232 R233 Q234	M228-S230 PolarHBondContact O-N 3.39Å; S230-R232 PolarHBondContact O-N 3.48Å; S230-R232 VanDerWaalsContact O-N 3.11Å; S230-R233 PolarHBondContact O-N 3.14Å; S230-Q234 PolarHBondContact O-N 2.76Å
231	D	64.9	Low	75	Confident	95 Å²	95	112.4 Å²	112.4	51%	0.508	58%	0.578	S	S	.	*	H	α-helix	trans	-45.5	-44.3	175.6	-84.4	-37.8	0	0	0	110.7	N229 R233 Q234 W235	N229-D231 VanDerWaalsContact C-N 3.31Å; N229-D231 PolarHBondContact O-N 3.14Å; D231-R233 VanDerWaalsContact C-N 3.31Å; D231-R233 PolarHBondContact O-N 3.06Å; D231-R233 VanDerWaalsContact O-N 3.14Å; D231-Q234 PolarHBondContact O-N 2.97Å; D231-W235 VanDerWaalsContact O-CB 3.28Å; D231-W235 WeakPolarHBondContact O-CB 3.18Å; D231-W235 PolarHBondContact O-N 3.2Å
232	R	68.4	Low	75.6	Confident	223 Å²	223	110.3 Å²	110.3	84%	0.842	57%	0.573	S	S	*	*	H	α-helix	trans	-59.1	-34.5	-176.8	-64.4	-172.3	-169.5	-168.4	3.4	114.9	S230 C236	S230-R232 PolarHBondContact O-N 3.48Å; S230-R232 VanDerWaalsContact O-N 3.11Å; R232-C236 WeakPolarHBondContact O-CB 3.28Å; R232-C236 PolarHBondContact O-N 2.81Å; R232-C236 VanDerWaalsContact O-N 3.1Å
233	R	71.6	Confident	76.6	Confident	201 Å²	201	110.5 Å²	110.5	76%	0.758	57%	0.574	S	S	*	*	H	α-helix	trans	-79.3	-39.4	179.4	-75.9	-179.7	150	-148.8	-5.3	111.8	S230 D231 C236 A237	S230-R233 PolarHBondContact O-N 3.14Å; D231-R233 VanDerWaalsContact C-N 3.31Å; D231-R233 PolarHBondContact O-N 3.06Å; D231-R233 VanDerWaalsContact O-N 3.14Å; R233-C236 PolarHBondContact O-N 3.1Å; R233-A237 WeakPolarHBondContact O-CB 3.43Å; R233-A237 PolarHBondContact O-N 3.11Å
234	Q	76.6	Confident	77.7	Confident	100 Å²	100	112.2 Å²	112.2	47%	0.467	57%	0.574	S	S	.	*	H	α-helix	trans	-67.6	-44.4	176.1	-73.1	179.6	-10.2	0	0	111.1	S230 D231 C236 A237 I238	S230-Q234 PolarHBondContact O-N 2.76Å; D231-Q234 PolarHBondContact O-N 2.97Å; Q234-C236 VanDerWaalsContact C-N 3.34Å; Q234-C236 PolarHBondContact O-N 3.48Å; Q234-A237 PolarHBondContact O-N 3.4Å; Q234-I238 WeakPolarHBondContact O-CB 3.43Å; Q234-I238 WeakPolarHBondContact O-CD1 3.25Å; Q234-I238 VanDerWaalsContact O-CG1 3.25Å; Q234-I238 WeakPolarHBondContact O-CG1 3.48Å; Q234-I238 PolarHBondContact O-N 3.25Å
235	W	80.8	Confident	78.6	Confident	180 Å²	180	110.2 Å²	110.2	68%	0.682	57%	0.569	S	S	*	*	H	α-helix	trans	-64.4	-35.7	175.3	-78.7	84.2	0	0	0	112.8	D231 G239	D231-W235 VanDerWaalsContact O-CB 3.28Å; D231-W235 WeakPolarHBondContact O-CB 3.18Å; D231-W235 PolarHBondContact O-N 3.2Å; W235-G239 PolarHBondContact O-N 3.45Å
236	C	82.9	Confident	79.7	Confident	81 Å²	81	110.4 Å²	110.4	55%	0.547	57%	0.567	S	S	.	*	H	α-helix	trans	-66.2	-45.4	172.3	-173.4	0	0	0	0	111.7	R232 R233 Q234 I238 G239 V240	R232-C236 WeakPolarHBondContact O-CB 3.28Å; R232-C236 PolarHBondContact O-N 2.81Å; R232-C236 VanDerWaalsContact O-N 3.1Å; R233-C236 PolarHBondContact O-N 3.1Å; Q234-C236 VanDerWaalsContact C-N 3.34Å; Q234-C236 PolarHBondContact O-N 3.48Å; C236-I238 PolarHBondContact O-N 2.97Å; C236-G239 PolarHBondContact O-N 2.89Å; C236-V240 WeakPolarHBondContact O-CG2 3.38Å; C236-V240 PolarHBondContact O-N 3.03Å
237	A	86	Confident	80.9	Confident	60 Å²	60	109.2 Å²	109.2	50%	0.496	56%	0.555	S	S	.	*	H	α-helix	trans	-61.3	-44.1	176.8	0	0	0	0	0	112	R233 Q234 V240 L241	R233-A237 WeakPolarHBondContact O-CB 3.43Å; R233-A237 PolarHBondContact O-N 3.11Å; Q234-A237 PolarHBondContact O-N 3.4Å; A237-V240 PolarHBondContact O-N 3.25Å; A237-L241 WeakPolarHBondContact O-CB 3.38Å; A237-L241 PolarHBondContact O-N 2.96Å
238	I	88.4	Confident	82.5	Confident	99 Å²	99	105.6 Å²	105.6	51%	0.508	54%	0.544	S	S	.	.	H	α-helix	trans	-59.6	-46.8	174.6	-69	162.5	0	0	0	110.4	Q234 C236 V240 L241 L242	Q234-I238 WeakPolarHBondContact O-CB 3.43Å; Q234-I238 WeakPolarHBondContact O-CD1 3.25Å; Q234-I238 VanDerWaalsContact O-CG1 3.25Å; Q234-I238 WeakPolarHBondContact O-CG1 3.48Å; Q234-I238 PolarHBondContact O-N 3.25Å; C236-I238 PolarHBondContact O-N 2.97Å; I238-V240 PolarHBondContact O-N 3.46Å; I238-L241 PolarHBondContact O-N 3.3Å; I238-L242 WeakPolarHBondContact O-CB 3.5Å; I238-L242 PolarHBondContact O-N 3.06Å
239	G	90.9	Very high	84.3	Confident	39 Å²	39	103.9 Å²	103.9	40%	0.402	54%	0.537	S	S	.	.	H	α-helix	trans	-60.3	-43.2	178.6	0	0	0	0	0	113.6	W235 C236 L242 L243	W235-G239 PolarHBondContact O-N 3.45Å; C236-G239 PolarHBondContact O-N 2.89Å; G239-L242 PolarHBondContact O-N 3.46Å; G239-L243 PolarHBondContact O-N 3.47Å; G239-L243 VanDerWaalsContact O-N 3.08Å
240	V	93.8	Very high	86.1	Confident	82 Å²	82	103.4 Å²	103.4	50%	0.497	53%	0.533	S	S	.	.	H	α-helix	trans	-63.8	-43.5	176.3	172	0	0	0	0	111.2	C236 A237 I238 L242 L243 I244	C236-V240 WeakPolarHBondContact O-CG2 3.38Å; C236-V240 PolarHBondContact O-N 3.03Å; A237-V240 PolarHBondContact O-N 3.25Å; I238-V240 PolarHBondContact O-N 3.46Å; V240-L242 VanDerWaalsContact C-N 3.34Å; V240-L242 PolarHBondContact O-N 3.08Å; V240-L243 PolarHBondContact O-N 2.97Å; V240-I244 HydrophobicContact CG1-CD1 4.01Å; V240-I244 WeakPolarHBondContact O-CG1 3.4Å; V240-I244 PolarHBondContact O-N 3.28Å
241	L	93.2	Very high	87.5	Confident	123 Å²	123	106 Å²	106	64%	0.644	54%	0.543	S	S	*	.	H	α-helix	trans	-65.3	-38.8	-179.4	-141.3	159.3	0	0	0	111.5	A237 I238 I244 L245	A237-L241 WeakPolarHBondContact O-CB 3.38Å; A237-L241 PolarHBondContact O-N 2.96Å; I238-L241 PolarHBondContact O-N 3.3Å; L241-I244 PolarHBondContact O-N 3.04Å; L241-L245 WeakPolarHBondContact O-CB 3.46Å; L241-L245 PolarHBondContact O-N 2.98Å
242	L	94.6	Very high	88.9	Confident	105 Å²	105	108.9 Å²	108.9	55%	0.55	55%	0.551	S	S	.	*	H	α-helix	trans	-65.8	-39.6	176.1	-136.7	166.6	0	0	0	111.9	I238 G239 V240 L245 L246	I238-L242 WeakPolarHBondContact O-CB 3.5Å; I238-L242 PolarHBondContact O-N 3.06Å; G239-L242 PolarHBondContact O-N 3.46Å; V240-L242 VanDerWaalsContact C-N 3.34Å; V240-L242 PolarHBondContact O-N 3.08Å; L242-L245 WeakPolarHBondContact O-CB 3.43Å; L242-L245 PolarHBondContact O-N 3.38Å; L242-L246 WeakPolarHBondContact O-CB 3.49Å; L242-L246 PolarHBondContact O-N 2.99Å
243	L	95.1	Very high	89.9	Confident	115 Å²	115	106.3 Å²	106.3	60%	0.602	55%	0.546	S	S	*	.	H	α-helix	trans	-64.6	-43.4	175.7	-174.7	143.3	0	0	0	111.6	G239 V240 L245 L246 V247	G239-L243 PolarHBondContact O-N 3.47Å; G239-L243 VanDerWaalsContact O-N 3.08Å; V240-L243 PolarHBondContact O-N 2.97Å; L243-L245 VanDerWaalsContact C-N 3.35Å; L243-L246 PolarHBondContact O-N 3.06Å; L243-V247 HydrophobicContact CD2-CG2 4.44Å; L243-V247 WeakPolarHBondContact O-CG2 3.5Å; L243-V247 PolarHBondContact O-N 3.28Å
244	I	95.4	Very high	90.7	Very high	97 Å²	97	103.1 Å²	103.1	50%	0.497	54%	0.543	S	S	.	.	H	α-helix	trans	-61.5	-44.9	175.5	-67.2	167.4	0	0	0	110.6	V240 L241 L246 V247 V248	V240-I244 HydrophobicContact CG1-CD1 4.01Å; V240-I244 WeakPolarHBondContact O-CG1 3.4Å; V240-I244 PolarHBondContact O-N 3.28Å; L241-I244 PolarHBondContact O-N 3.04Å; I244-L246 VanDerWaalsContact C-N 3.31Å; I244-L246 PolarHBondContact O-N 3.4Å; I244-V247 PolarHBondContact O-N 3.25Å; I244-V248 WeakPolarHBondContact O-CG2 3.44Å; I244-V248 PolarHBondContact O-N 3.4Å
245	L	93.8	Very high	90.8	Very high	97 Å²	97	108 Å²	108	51%	0.508	57%	0.571	S	S	.	*	H	α-helix	trans	-57.5	-44.8	176.2	-174.6	83.1	0	0	0	111.6	L241 L242 L243 V247 V248 I249	L241-L245 WeakPolarHBondContact O-CB 3.46Å; L241-L245 PolarHBondContact O-N 2.98Å; L242-L245 WeakPolarHBondContact O-CB 3.43Å; L242-L245 PolarHBondContact O-N 3.38Å; L243-L245 VanDerWaalsContact C-N 3.35Å; L245-V247 VanDerWaalsContact C-N 3.34Å; L245-V247 PolarHBondContact O-N 3.46Å; L245-V248 PolarHBondContact O-N 2.97Å; L245-I249 HydrophobicContact CD2-CD1 4.35Å; L245-I249 HydrophobicContact CG-CD1 4.1Å; L245-I249 WeakPolarHBondContact O-CG1 3.44Å; L245-I249 PolarHBondContact O-N 3.23Å
246	L	94.1	Very high	91.3	Very high	94 Å²	94	104.4 Å²	104.4	49%	0.492	57%	0.565	S	S	.	*	H	α-helix	trans	-61.8	-43.1	179.3	-164.8	160.3	0	0	0	111.2	L242 L243 I244 V248 I249 I250	L242-L246 WeakPolarHBondContact O-CB 3.49Å; L242-L246 PolarHBondContact O-N 2.99Å; L243-L246 PolarHBondContact O-N 3.06Å; I244-L246 VanDerWaalsContact C-N 3.31Å; I244-L246 PolarHBondContact O-N 3.4Å; L246-V248 VanDerWaalsContact C-N 3.34Å; L246-V248 PolarHBondContact O-N 2.97Å; L246-I249 PolarHBondContact O-N 3.38Å; L246-I250 HydrophobicContact CD2-CD1 3.35Å; L246-I250 HydrophobicContact CD2-CG1 3.96Å; L246-I250 WeakPolarHBondContact O-CG1 3.37Å; L246-I250 PolarHBondContact O-N 3.49Å
247	V	94.3	Very high	91.8	Very high	72 Å²	72	105.6 Å²	105.6	44%	0.436	57%	0.566	S	S	.	*	H	α-helix	trans	-59.9	-43.9	175.2	172.4	0	0	0	0	111.4	L243 I244 L245 I249 I250 L251	L243-V247 HydrophobicContact CD2-CG2 4.44Å; L243-V247 WeakPolarHBondContact O-CG2 3.5Å; L243-V247 PolarHBondContact O-N 3.28Å; I244-V247 PolarHBondContact O-N 3.25Å; L245-V247 VanDerWaalsContact C-N 3.34Å; L245-V247 PolarHBondContact O-N 3.46Å; V247-I249 PolarHBondContact O-N 2.94Å; V247-I250 PolarHBondContact O-N 3.26Å; V247-L251 HydrophobicContact CG1-CD1 4.18Å; V247-L251 WeakPolarHBondContact O-CG 3.17Å; V247-L251 PolarHBondContact O-N 3.46Å
248	V	94.4	Very high	92.1	Very high	88 Å²	88	108.1 Å²	108.1	53%	0.533	57%	0.57	S	S	.	*	H	α-helix	trans	-62.7	-42	177.1	172.9	0	0	0	0	111.4	I244 L245 L246 L251 F252	I244-V248 WeakPolarHBondContact O-CG2 3.44Å; I244-V248 PolarHBondContact O-N 3.4Å; L245-V248 PolarHBondContact O-N 2.97Å; L246-V248 VanDerWaalsContact C-N 3.34Å; L246-V248 PolarHBondContact O-N 2.97Å; V248-L251 PolarHBondContact O-N 3.19Å; V248-F252 WeakPolarHBondContact O-CB 3.45Å; V248-F252 PolarHBondContact O-N 3.1Å
249	I	93.6	Very high	92.3	Very high	83 Å²	83	108.6 Å²	108.6	43%	0.426	57%	0.574	S	S	.	*	H	α-helix	trans	-63.7	-45.3	177.4	-69.3	169.6	0	0	0	111	L245 L246 V247 L251 F252 F253	L245-I249 HydrophobicContact CD2-CD1 4.35Å; L245-I249 HydrophobicContact CG-CD1 4.1Å; L245-I249 WeakPolarHBondContact O-CG1 3.44Å; L245-I249 PolarHBondContact O-N 3.23Å; L246-I249 PolarHBondContact O-N 3.38Å; V247-I249 PolarHBondContact O-N 2.94Å; I249-L251 VanDerWaalsContact C-N 3.35Å; I249-L251 PolarHBondContact O-N 3.38Å; I249-F252 PolarHBondContact O-N 3.23Å; I249-F253 HydrophobicContact CG2-CD2 3.84Å; I249-F253 HydrophobicContact CG2-CE2 3.84Å; I249-F253 WeakPolarHBondContact O-CD2 3.43Å; I249-F253 PolarHBondContact O-N 2.96Å; I249-F253 VanDerWaalsContact O-N 3.1Å
250	I	94.1	Very high	92.4	Very high	86 Å²	86	113 Å²	113	44%	0.441	58%	0.584	S	S	.	*	H	α-helix	trans	-60.4	-46.5	177.1	-71.6	178.5	0	0	0	110.5	L246 V247 F252 F253 I254	L246-I250 HydrophobicContact CD2-CD1 3.35Å; L246-I250 HydrophobicContact CD2-CG1 3.96Å; L246-I250 WeakPolarHBondContact O-CG1 3.37Å; L246-I250 PolarHBondContact O-N 3.49Å; V247-I250 PolarHBondContact O-N 3.26Å; I250-F252 VanDerWaalsContact C-N 3.28Å; I250-F252 PolarHBondContact O-N 3.48Å; I250-F253 PolarHBondContact O-N 3.39Å; I250-I254 HydrophobicContact CG2-CD1 3.49Å; I250-I254 VanDerWaalsContact CG2-CD1 3.49Å; I250-I254 HydrophobicContact CG2-CG1 4.29Å; I250-I254 WeakPolarHBondContact O-CG1 3.33Å; I250-I254 PolarHBondContact O-N 3.05Å
251	L	91.5	Very high	92.3	Very high	107 Å²	107	115.1 Å²	115.1	56%	0.56	59%	0.59	S	S	*	*	H	α-helix	trans	-60.1	-39.1	177.5	-76.5	174.7	0	0	0	111.9	V247 V248 I249 F253 I254 L255	V247-L251 HydrophobicContact CG1-CD1 4.18Å; V247-L251 WeakPolarHBondContact O-CG 3.17Å; V247-L251 PolarHBondContact O-N 3.46Å; V248-L251 PolarHBondContact O-N 3.19Å; I249-L251 VanDerWaalsContact C-N 3.35Å; I249-L251 PolarHBondContact O-N 3.38Å; L251-F253 VanDerWaalsContact C-N 3.34Å; L251-F253 PolarHBondContact O-N 3.47Å; L251-I254 PolarHBondContact O-N 2.94Å; L251-L255 WeakPolarHBondContact O-CB 3.33Å; L251-L255 PolarHBondContact O-N 3.38Å
252	F	93.1	Very high	92.2	Very high	155 Å²	155	114.5 Å²	114.5	68%	0.68	59%	0.586	S	S	*	*	H	α-helix	trans	-65.9	-31.7	176.8	179.8	-96.3	0	0	0	113.9	V248 I249 I250	V248-F252 WeakPolarHBondContact O-CB 3.45Å; V248-F252 PolarHBondContact O-N 3.1Å; I249-F252 PolarHBondContact O-N 3.23Å; I250-F252 VanDerWaalsContact C-N 3.28Å; I250-F252 PolarHBondContact O-N 3.48Å
253	F	90.3	Very high	92.1	Very high	168 Å²	168	115.2 Å²	115.2	74%	0.737	59%	0.589	S	S	*	*	H	α-helix	trans	-82.4	-25	176.7	-85	-73.2	0	0	0	113.4	I249 I250 L251	I249-F253 HydrophobicContact CG2-CD2 3.84Å; I249-F253 HydrophobicContact CG2-CE2 3.84Å; I249-F253 WeakPolarHBondContact O-CD2 3.43Å; I249-F253 PolarHBondContact O-N 2.96Å; I249-F253 VanDerWaalsContact O-N 3.1Å; I250-F253 PolarHBondContact O-N 3.39Å; L251-F253 VanDerWaalsContact C-N 3.34Å; L251-F253 PolarHBondContact O-N 3.47Å
254	I	88.9	Confident	91.8	Very high	134 Å²	134	115.3 Å²	115.3	69%	0.687	59%	0.588	S	S	*	*	H	α-helix	trans	-85.8	-35.3	179.7	-67.8	175	0	0	0	111.7	I250 L251	I250-I254 HydrophobicContact CG2-CD1 3.49Å; I250-I254 VanDerWaalsContact CG2-CD1 3.49Å; I250-I254 HydrophobicContact CG2-CG1 4.29Å; I250-I254 WeakPolarHBondContact O-CG1 3.33Å; I250-I254 PolarHBondContact O-N 3.05Å; L251-I254 PolarHBondContact O-N 2.94Å
255	L	78.4	Confident	91.5	Very high	202 Å²	202	116.9 Å²	116.9	100%	1.058	60%	0.596	S	S	*	*			trans	-92.8	0	-176.7	-160.7	80.1	0	0	0	111.8	L251	L251-L255 WeakPolarHBondContact O-CB 3.33Å; L251-L255 PolarHBondContact O-N 3.38Å

Retrieved 255 of 255 residues in 145 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).