A0A3Q0KLF4_SCHMA Loading...

EB1 C-terminal domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KLF4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 293 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	57.8	Low	86.3	Confident	229 Å²	229	112.7 Å²	112.7	100%	1.128	58%	0.577	S	S	*	*				0	0.9	0	-74.8	-135.9	-103.6	0	0	113.8
2	S	77.9	Confident	87	Confident	77 Å²	77	106.7 Å²	106.7	54%	0.538	56%	0.563	S	S	.	*	H	α-helix	trans	-76.1	-35.2	177.8	52.9	0	0	0	0	113.9	S5 R6	S2-S5 PolarHBondContact O-N 2.87Å; S2-S5 PolarHBondContact O-OG 3.43Å; S2-R6 WeakPolarHBondContact O-CB 3.43Å; S2-R6 PolarHBondContact O-N 3.09Å
3	D	84.8	Confident	87.6	Confident	101 Å²	101	105.5 Å²	105.5	54%	0.54	56%	0.556	S	S	.	*	H	α-helix	trans	-76.3	-41.6	-163.4	-57	-14.2	0	0	0	113.7	S5 R6 L7	D3-S5 VanDerWaalsContact C-N 3.31Å; D3-S5 PolarHBondContact O-N 3.03Å; D3-R6 WeakPolarHBondContact O-CB 3.4Å; D3-R6 PolarHBondContact O-N 3.1Å; D3-L7 PolarHBondContact O-N 3.43Å
4	L	85.6	Confident	88.1	Confident	129 Å²	129	106.7 Å²	106.7	68%	0.675	56%	0.557	S	S	*	*	H	α-helix	trans	-63.4	-40.2	174	-176	65.8	0	0	0	111.2	R6 L7 V8	L4-R6 VanDerWaalsContact C-N 3.28Å; L4-R6 PolarHBondContact O-N 3.48Å; L4-L7 PolarHBondContact O-N 2.91Å; L4-V8 WeakPolarHBondContact O-CG2 3.21Å; L4-V8 PolarHBondContact O-N 3.33Å
5	S	88.5	Confident	88.6	Confident	63 Å²	63	105.6 Å²	105.6	44%	0.441	56%	0.557	S	S	.	*	H	α-helix	trans	-65.4	-34.6	177.2	82.9	0	0	0	0	112	S2 D3 K9	S2-S5 PolarHBondContact O-N 2.87Å; S2-S5 PolarHBondContact O-OG 3.43Å; D3-S5 VanDerWaalsContact C-N 3.31Å; D3-S5 PolarHBondContact O-N 3.03Å; S5-K9 WeakPolarHBondContact O-CG 3.3Å; S5-K9 PolarHBondContact O-N 3.03Å
6	R	89.9	Confident	89	Confident	148 Å²	148	107.6 Å²	107.6	56%	0.558	56%	0.562	S	S	*	*	H	α-helix	trans	-67.2	-47.9	174.2	-171.8	-176.8	69.2	-170.7	-3.4	110.4	S2 D3 L4 V8 K9 E10	S2-R6 WeakPolarHBondContact O-CB 3.43Å; S2-R6 PolarHBondContact O-N 3.09Å; D3-R6 WeakPolarHBondContact O-CB 3.4Å; D3-R6 PolarHBondContact O-N 3.1Å; L4-R6 VanDerWaalsContact C-N 3.28Å; L4-R6 PolarHBondContact O-N 3.48Å; R6-V8 PolarHBondContact O-N 3.21Å; R6-K9 WeakPolarHBondContact O-CB 3.4Å; R6-K9 PolarHBondContact O-N 3.48Å; R6-K9 VanDerWaalsContact O-N 3.16Å; R6-E10 WeakPolarHBondContact CG-OE1 3.42Å; R6-E10 IonicContact NE-OE1 2.83Å; R6-E10 WeakPolarHBondContact O-CG 3.45Å; R6-E10 PolarHBondContact O-N 2.99Å
7	L	92.9	Very high	89.5	Confident	85 Å²	85	108.4 Å²	108.4	45%	0.445	56%	0.562	S	S	.	*	H	α-helix	trans	-60.8	-44.5	179.2	-174.1	68.9	0	0	0	112.3	D3 L4 K9 E10 I11	D3-L7 PolarHBondContact O-N 3.43Å; L4-L7 PolarHBondContact O-N 2.91Å; L7-K9 VanDerWaalsContact C-N 3.29Å; L7-K9 PolarHBondContact O-N 3.27Å; L7-E10 PolarHBondContact O-N 3.37Å; L7-I11 HydrophobicContact CD1-CD1 4.41Å; L7-I11 HydrophobicContact CD2-CD1 4.49Å; L7-I11 HydrophobicContact CG-CD1 3.94Å; L7-I11 WeakPolarHBondContact O-CB 3.36Å; L7-I11 VanDerWaalsContact O-CG1 3.29Å; L7-I11 WeakPolarHBondContact O-CG1 3.4Å; L7-I11 PolarHBondContact O-N 3.24Å
8	V	92.5	Very high	89.8	Confident	92 Å²	92	108.8 Å²	108.8	56%	0.558	57%	0.565	S	S	*	*	H	α-helix	trans	-62.9	-37.3	177.1	171.7	0	0	0	0	111.4	L4 R6 G12	L4-V8 WeakPolarHBondContact O-CG2 3.21Å; L4-V8 PolarHBondContact O-N 3.33Å; R6-V8 PolarHBondContact O-N 3.21Å; V8-G12 PolarHBondContact O-N 3.46Å
9	K	92.2	Very high	90.2	Very high	151 Å²	151	107 Å²	107	66%	0.657	56%	0.562	S	S	*	*	H	α-helix	trans	-67.1	-43.5	173.7	-76.4	178.6	178.8	-176.8	0	112	S5 R6 L7 G12 I13	S5-K9 WeakPolarHBondContact O-CG 3.3Å; S5-K9 PolarHBondContact O-N 3.03Å; R6-K9 WeakPolarHBondContact O-CB 3.4Å; R6-K9 PolarHBondContact O-N 3.48Å; R6-K9 VanDerWaalsContact O-N 3.16Å; L7-K9 VanDerWaalsContact C-N 3.29Å; L7-K9 PolarHBondContact O-N 3.27Å; K9-G12 PolarHBondContact O-N 3.37Å; K9-I13 VanDerWaalsContact O-CG1 3.3Å; K9-I13 WeakPolarHBondContact O-CG1 3.46Å; K9-I13 PolarHBondContact O-N 3.04Å
10	E	92.9	Very high	90.5	Very high	83 Å²	83	105.4 Å²	105.4	39%	0.388	56%	0.56	S	S	.	*	H	α-helix	trans	-59.6	-49	176	-76.3	167	-174.8	0	0	110.9	R6 L7 G12 I13 E14	R6-E10 WeakPolarHBondContact CG-OE1 3.42Å; R6-E10 IonicContact NE-OE1 2.83Å; R6-E10 WeakPolarHBondContact O-CG 3.45Å; R6-E10 PolarHBondContact O-N 2.99Å; L7-E10 PolarHBondContact O-N 3.37Å; E10-G12 VanDerWaalsContact C-N 3.32Å; E10-G12 PolarHBondContact O-N 3.47Å; E10-I13 WeakPolarHBondContact O-CB 3.47Å; E10-I13 PolarHBondContact O-N 2.91Å; E10-I13 VanDerWaalsContact O-N 3.14Å; E10-E14 PolarHBondContact O-N 3.5Å
11	I	94.2	Very high	90.8	Very high	82 Å²	82	105 Å²	105	42%	0.421	56%	0.555	S	S	.	*	H	α-helix	trans	-59.2	-43.1	175	-67.7	167.3	0	0	0	110.9	L7 I13 E14 V15	L7-I11 HydrophobicContact CD1-CD1 4.41Å; L7-I11 HydrophobicContact CD2-CD1 4.49Å; L7-I11 HydrophobicContact CG-CD1 3.94Å; L7-I11 WeakPolarHBondContact O-CB 3.36Å; L7-I11 VanDerWaalsContact O-CG1 3.29Å; L7-I11 WeakPolarHBondContact O-CG1 3.4Å; L7-I11 PolarHBondContact O-N 3.24Å; I11-I13 VanDerWaalsContact C-N 3.31Å; I11-I13 PolarHBondContact O-N 3.24Å; I11-E14 PolarHBondContact O-N 3.45Å; I11-V15 HydrophobicContact CG2-CG2 4.13Å; I11-V15 WeakPolarHBondContact O-CB 3.4Å; I11-V15 VanDerWaalsContact O-CG2 3.26Å; I11-V15 WeakPolarHBondContact O-CG2 3.38Å; I11-V15 PolarHBondContact O-N 2.73Å
12	G	94.5	Very high	92.6	Very high	40 Å²	40	98 Å²	98	41%	0.412	53%	0.526	S	S	.	.	H	α-helix	trans	-59.8	-40.7	177	0	0	0	0	0	112.7	V8 K9 E10 Q16	V8-G12 PolarHBondContact O-N 3.46Å; K9-G12 PolarHBondContact O-N 3.37Å; E10-G12 VanDerWaalsContact C-N 3.32Å; E10-G12 PolarHBondContact O-N 3.47Å; G12-Q16 WeakPolarHBondContact O-CB 3.4Å; G12-Q16 PolarHBondContact O-N 2.69Å; G12-Q16 VanDerWaalsContact O-N 3.08Å
13	I	94.9	Very high	93.5	Very high	91 Å²	91	98.3 Å²	98.3	47%	0.467	52%	0.518	S	S	.	.	H	α-helix	trans	-66.7	-47.1	175.2	-66.7	163.5	0	0	0	110.4	K9 E10 I11 V15 Q16 Q17	K9-I13 VanDerWaalsContact O-CG1 3.3Å; K9-I13 WeakPolarHBondContact O-CG1 3.46Å; K9-I13 PolarHBondContact O-N 3.04Å; E10-I13 WeakPolarHBondContact O-CB 3.47Å; E10-I13 PolarHBondContact O-N 2.91Å; E10-I13 VanDerWaalsContact O-N 3.14Å; I11-I13 VanDerWaalsContact C-N 3.31Å; I11-I13 PolarHBondContact O-N 3.24Å; I13-V15 PolarHBondContact O-N 2.99Å; I13-Q16 PolarHBondContact O-N 3Å; I13-Q17 HydrophobicContact CG2-CG 4.42Å; I13-Q17 WeakPolarHBondContact O-CG 3.31Å; I13-Q17 PolarHBondContact O-N 3.07Å
14	E	95.4	Very high	94.1	Very high	123 Å²	123	98.2 Å²	98.2	58%	0.575	52%	0.517	S	S	*	.	H	α-helix	trans	-61.3	-43.5	178.9	-75.1	180	-172.5	0	0	112.1	E10 I11 Q16 Q17 L18	E10-E14 PolarHBondContact O-N 3.5Å; I11-E14 PolarHBondContact O-N 3.45Å; E14-Q16 VanDerWaalsContact C-N 3.33Å; E14-Q16 PolarHBondContact O-N 3.07Å; E14-Q17 PolarHBondContact O-N 2.96Å; E14-L18 WeakPolarHBondContact O-CB 3.25Å; E14-L18 PolarHBondContact O-N 3.44Å
15	V	95.7	Very high	94.7	Very high	90 Å²	90	95.9 Å²	95.9	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-39.8	176.1	171	0	0	0	0	110.9	I11 I13 L18 S19	I11-V15 HydrophobicContact CG2-CG2 4.13Å; I11-V15 WeakPolarHBondContact O-CB 3.4Å; I11-V15 VanDerWaalsContact O-CG2 3.26Å; I11-V15 WeakPolarHBondContact O-CG2 3.38Å; I11-V15 PolarHBondContact O-N 2.73Å; I13-V15 PolarHBondContact O-N 2.99Å; V15-L18 PolarHBondContact O-N 3.31Å; V15-S19 WeakPolarHBondContact O-CB 3.49Å; V15-S19 PolarHBondContact O-N 3.03Å
16	Q	95	Very high	95.1	Very high	137 Å²	137	98.5 Å²	98.5	64%	0.64	51%	0.506	S	S	*	.	H	α-helix	trans	-67.4	-39.2	176.6	-172.5	171.7	11.9	0	0	112.2	G12 I13 E14 S20	G12-Q16 WeakPolarHBondContact O-CB 3.4Å; G12-Q16 PolarHBondContact O-N 2.69Å; G12-Q16 VanDerWaalsContact O-N 3.08Å; I13-Q16 PolarHBondContact O-N 3Å; E14-Q16 VanDerWaalsContact C-N 3.33Å; E14-Q16 PolarHBondContact O-N 3.07Å; Q16-S20 WeakPolarHBondContact O-CB 3.48Å; Q16-S20 PolarHBondContact O-N 3.36Å; Q16-S20 PolarHBondContact O-OG 3.5Å
17	Q	96.2	Very high	95.4	Very high	122 Å²	122	96.3 Å²	96.3	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-63.4	-46.7	173.3	-74.3	175.6	-7	0	0	111	I13 E14 S19 S20 Q21	I13-Q17 HydrophobicContact CG2-CG 4.42Å; I13-Q17 WeakPolarHBondContact O-CG 3.31Å; I13-Q17 PolarHBondContact O-N 3.07Å; E14-Q17 PolarHBondContact O-N 2.96Å; Q17-S19 PolarHBondContact O-N 3.29Å; Q17-S20 WeakPolarHBondContact O-CB 3.47Å; Q17-S20 PolarHBondContact O-N 2.95Å; Q17-Q21 PolarHBondContact O-N 3.42Å
18	L	96.3	Very high	95.6	Very high	116 Å²	116	95.5 Å²	95.5	61%	0.607	50%	0.502	S	S	*	.	H	α-helix	trans	-62.4	-43.2	177.9	-173.1	65.1	0	0	0	111.4	E14 V15 S20 Q21 V22	E14-L18 WeakPolarHBondContact O-CB 3.25Å; E14-L18 PolarHBondContact O-N 3.44Å; V15-L18 PolarHBondContact O-N 3.31Å; L18-S20 VanDerWaalsContact C-N 3.3Å; L18-S20 PolarHBondContact O-N 2.85Å; L18-Q21 PolarHBondContact O-N 3.16Å; L18-V22 VanDerWaalsContact O-CG2 3.29Å; L18-V22 WeakPolarHBondContact O-CG2 3.43Å; L18-V22 PolarHBondContact O-N 3.25Å
19	S	96.3	Very high	95.9	Very high	74 Å²	74	95.4 Å²	95.4	52%	0.517	50%	0.497	S	S	.	.	H	α-helix	trans	-61.9	-38.5	175.6	-171.1	0	0	0	0	112.2	V15 Q17 E23	V15-S19 WeakPolarHBondContact O-CB 3.49Å; V15-S19 PolarHBondContact O-N 3.03Å; Q17-S19 PolarHBondContact O-N 3.29Å; S19-E23 PolarHBondContact O-N 3.38Å; S19-E23 VanDerWaalsContact O-N 3.15Å
20	S	96.3	Very high	96.1	Very high	75 Å²	75	91.4 Å²	91.4	52%	0.524	49%	0.488	S	S	.	.	H	α-helix	trans	-67.8	-41	176.4	-56.4	0	0	0	0	111.2	Q16 Q17 L18 E23 L24	Q16-S20 WeakPolarHBondContact O-CB 3.48Å; Q16-S20 PolarHBondContact O-N 3.36Å; Q16-S20 PolarHBondContact O-OG 3.5Å; Q17-S20 WeakPolarHBondContact O-CB 3.47Å; Q17-S20 PolarHBondContact O-N 2.95Å; L18-S20 VanDerWaalsContact C-N 3.3Å; L18-S20 PolarHBondContact O-N 2.85Å; S20-E23 PolarHBondContact O-N 3.48Å; S20-L24 WeakPolarHBondContact O-CB 3.4Å; S20-L24 PolarHBondContact O-N 3.43Å
21	Q	96.6	Very high	96.4	Very high	97 Å²	97	92.8 Å²	92.8	45%	0.453	50%	0.495	S	S	.	.	H	α-helix	trans	-63.8	-42.8	175.7	-170.8	65.6	23.8	0	0	111.4	Q17 L18 E23 L24 E25	Q17-Q21 PolarHBondContact O-N 3.42Å; L18-Q21 PolarHBondContact O-N 3.16Å; Q21-E23 PolarHBondContact O-N 2.91Å; Q21-L24 PolarHBondContact O-N 3.12Å; Q21-E25 PolarHBondContact NE2-OE1 3.25Å; Q21-E25 WeakPolarHBondContact O-CG 3.4Å; Q21-E25 PolarHBondContact O-N 2.87Å
22	V	96.8	Very high	96.5	Very high	83 Å²	83	93.4 Å²	93.4	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-62.3	-42.7	178.2	168.3	0	0	0	0	111.4	L18 E25 K26	L18-V22 VanDerWaalsContact O-CG2 3.29Å; L18-V22 WeakPolarHBondContact O-CG2 3.43Å; L18-V22 PolarHBondContact O-N 3.25Å; V22-E25 PolarHBondContact O-N 3.21Å; V22-K26 VanDerWaalsContact O-CB 3.27Å; V22-K26 WeakPolarHBondContact O-CB 3.35Å; V22-K26 PolarHBondContact O-N 2.86Å
23	E	96.4	Very high	96.7	Very high	83 Å²	83	97.1 Å²	97.1	39%	0.388	51%	0.505	S	S	.	.	H	α-helix	trans	-69	-34.1	175.2	-80.3	-58.8	159.8	0	0	112.7	S19 S20 Q21 K26 N27	S19-E23 PolarHBondContact O-N 3.38Å; S19-E23 VanDerWaalsContact O-N 3.15Å; S20-E23 PolarHBondContact O-N 3.48Å; Q21-E23 PolarHBondContact O-N 2.91Å; E23-K26 VanDerWaalsContact CD-NZ 3.27Å; E23-K26 PolarHBondContact O-N 2.92Å; E23-K26 IonicContact OE1-NZ 3.28Å; E23-K26 PolarHBondContact OE1-NZ 2.94Å; E23-K26 IonicContact OE2-NZ 2.76Å; E23-K26 PolarHBondContact OE2-NZ 3.36Å; E23-N27 WeakPolarHBondContact O-CB 3.45Å; E23-N27 VanDerWaalsContact O-CG 3.26Å; E23-N27 PolarHBondContact O-N 3.44Å; E23-N27 PolarHBondContact O-ND2 3.07Å; E23-N27 VanDerWaalsContact O-ND2 3.14Å
24	L	97.2	Very high	96.8	Very high	99 Å²	99	98.8 Å²	98.8	52%	0.518	51%	0.51	S	S	.	.	H	α-helix	trans	-64.2	-46.6	173.6	-169	147.3	0	0	0	111.5	S20 Q21 K26 N27 N28	S20-L24 WeakPolarHBondContact O-CB 3.4Å; S20-L24 PolarHBondContact O-N 3.43Å; Q21-L24 PolarHBondContact O-N 3.12Å; L24-K26 VanDerWaalsContact C-N 3.35Å; L24-K26 PolarHBondContact O-N 3.33Å; L24-N27 PolarHBondContact O-N 3.28Å; L24-N28 WeakPolarHBondContact O-CB 3.31Å; L24-N28 PolarHBondContact O-N 2.85Å
25	E	97	Very high	96.9	Very high	80 Å²	80	98.5 Å²	98.5	37%	0.374	51%	0.507	S	S	.	.	H	α-helix	trans	-64.4	-38.3	175.8	-71.1	-56.2	152.4	0	0	112	Q21 V22 N27 N28 I29	Q21-E25 PolarHBondContact NE2-OE1 3.25Å; Q21-E25 WeakPolarHBondContact O-CG 3.4Å; Q21-E25 PolarHBondContact O-N 2.87Å; V22-E25 PolarHBondContact O-N 3.21Å; E25-N27 VanDerWaalsContact C-N 3.35Å; E25-N27 PolarHBondContact O-N 2.99Å; E25-N28 WeakPolarHBondContact O-CB 3.44Å; E25-N28 PolarHBondContact O-N 3.19Å; E25-I29 WeakPolarHBondContact O-CB 3.38Å; E25-I29 VanDerWaalsContact O-CG1 3.24Å; E25-I29 WeakPolarHBondContact O-CG1 3.36Å; E25-I29 PolarHBondContact O-N 3.42Å
26	K	97	Very high	97	Very high	117 Å²	117	99.7 Å²	99.7	51%	0.509	51%	0.51	S	S	.	.	H	α-helix	trans	-62.9	-41.3	175	178.2	169.3	148.8	-124.1	0	111.9	V22 E23 L24 S30	V22-K26 VanDerWaalsContact O-CB 3.27Å; V22-K26 WeakPolarHBondContact O-CB 3.35Å; V22-K26 PolarHBondContact O-N 2.86Å; E23-K26 VanDerWaalsContact CD-NZ 3.27Å; E23-K26 PolarHBondContact O-N 2.92Å; E23-K26 IonicContact OE1-NZ 3.28Å; E23-K26 PolarHBondContact OE1-NZ 2.94Å; E23-K26 IonicContact OE2-NZ 2.76Å; E23-K26 PolarHBondContact OE2-NZ 3.36Å; L24-K26 VanDerWaalsContact C-N 3.35Å; L24-K26 PolarHBondContact O-N 3.33Å; K26-S30 WeakPolarHBondContact O-CB 3.38Å; K26-S30 PolarHBondContact O-N 3.29Å
27	N	97.4	Very high	97.2	Very high	103 Å²	103	97.9 Å²	97.9	55%	0.551	50%	0.504	S	S	*	.	H	α-helix	trans	-65.7	-40	173.2	-71.8	-31.5	0	0	0	111.9	E23 L24 E25 S30 H31	E23-N27 WeakPolarHBondContact O-CB 3.45Å; E23-N27 VanDerWaalsContact O-CG 3.26Å; E23-N27 PolarHBondContact O-N 3.44Å; E23-N27 PolarHBondContact O-ND2 3.07Å; E23-N27 VanDerWaalsContact O-ND2 3.14Å; L24-N27 PolarHBondContact O-N 3.28Å; E25-N27 VanDerWaalsContact C-N 3.35Å; E25-N27 PolarHBondContact O-N 2.99Å; N27-S30 PolarHBondContact O-N 3.46Å; N27-H31 PolarHBondContact O-N 3.26Å
28	N	98	Very high	97.3	Very high	68 Å²	68	95.1 Å²	95.1	36%	0.364	50%	0.498	S	S	.	.	H	α-helix	trans	-63.3	-45.2	176	-169.5	24.1	0	0	0	111.7	L24 E25 S30 H31 L32	L24-N28 WeakPolarHBondContact O-CB 3.31Å; L24-N28 PolarHBondContact O-N 2.85Å; E25-N28 WeakPolarHBondContact O-CB 3.44Å; E25-N28 PolarHBondContact O-N 3.19Å; N28-S30 VanDerWaalsContact C-N 3.35Å; N28-S30 PolarHBondContact O-N 3.3Å; N28-H31 PolarHBondContact O-N 2.98Å; N28-L32 WeakPolarHBondContact O-CG 3.41Å; N28-L32 PolarHBondContact O-N 3.48Å
29	I	97.4	Very high	97.3	Very high	90 Å²	90	93.9 Å²	93.9	46%	0.462	49%	0.491	S	S	.	.	H	α-helix	trans	-60.6	-44.5	175.4	-70.1	165.1	0	0	0	110.6	E25 H31 L32 Q33	E25-I29 WeakPolarHBondContact O-CB 3.38Å; E25-I29 VanDerWaalsContact O-CG1 3.24Å; E25-I29 WeakPolarHBondContact O-CG1 3.36Å; E25-I29 PolarHBondContact O-N 3.42Å; I29-H31 VanDerWaalsContact C-N 3.34Å; I29-H31 PolarHBondContact O-N 3.48Å; I29-L32 PolarHBondContact O-N 3.25Å; I29-Q33 HydrophobicContact CG2-CG 4.39Å; I29-Q33 WeakPolarHBondContact O-CB 3.33Å; I29-Q33 VanDerWaalsContact O-CG 3.3Å; I29-Q33 WeakPolarHBondContact O-CG 3.44Å; I29-Q33 PolarHBondContact O-N 3.38Å
30	S	97.3	Very high	97.4	Very high	66 Å²	66	93.5 Å²	93.5	46%	0.462	49%	0.486	S	S	.	.	H	α-helix	trans	-59.4	-44	175.9	-175	0	0	0	0	111.8	K26 N27 N28 Q33 Q34	K26-S30 WeakPolarHBondContact O-CB 3.38Å; K26-S30 PolarHBondContact O-N 3.29Å; N27-S30 PolarHBondContact O-N 3.46Å; N28-S30 VanDerWaalsContact C-N 3.35Å; N28-S30 PolarHBondContact O-N 3.3Å; S30-Q33 PolarHBondContact O-N 3.1Å; S30-Q34 PolarHBondContact O-N 2.92Å
31	H	97.8	Very high	97.4	Very high	113 Å²	113	95.8 Å²	95.8	52%	0.523	49%	0.488	S	S	.	.	H	α-helix	trans	-63.7	-43.6	176.1	-177.3	64.4	0	0	0	112.6	N27 N28 I29 Q34 K35	N27-H31 PolarHBondContact O-N 3.26Å; N28-H31 PolarHBondContact O-N 2.98Å; I29-H31 VanDerWaalsContact C-N 3.34Å; I29-H31 PolarHBondContact O-N 3.48Å; H31-Q34 PolarHBondContact O-N 2.78Å; H31-K35 WeakPolarHBondContact O-CB 3.49Å; H31-K35 PolarHBondContact O-N 2.7Å
32	L	98	Very high	97.5	Very high	94 Å²	94	96 Å²	96	49%	0.492	49%	0.489	S	S	.	.	H	α-helix	trans	-64.7	-38.3	176.7	-72	174	0	0	0	112.2	N28 I29 K35 L36	N28-L32 WeakPolarHBondContact O-CG 3.41Å; N28-L32 PolarHBondContact O-N 3.48Å; I29-L32 PolarHBondContact O-N 3.25Å; L32-K35 PolarHBondContact O-N 3.23Å; L32-L36 WeakPolarHBondContact O-CB 3.37Å; L32-L36 PolarHBondContact O-N 3.31Å
33	Q	97.7	Very high	97.5	Very high	119 Å²	119	94.8 Å²	94.8	56%	0.556	49%	0.488	S	S	*	.	H	α-helix	trans	-62.2	-44.1	173.7	-76.3	176.1	-19.9	0	0	111.3	I29 S30 L36 I37	I29-Q33 HydrophobicContact CG2-CG 4.39Å; I29-Q33 WeakPolarHBondContact O-CB 3.33Å; I29-Q33 VanDerWaalsContact O-CG 3.3Å; I29-Q33 WeakPolarHBondContact O-CG 3.44Å; I29-Q33 PolarHBondContact O-N 3.38Å; S30-Q33 PolarHBondContact O-N 3.1Å; Q33-L36 PolarHBondContact O-N 3.23Å; Q33-I37 WeakPolarHBondContact O-CG1 3.19Å; Q33-I37 PolarHBondContact O-N 3.18Å
34	Q	97.6	Very high	97.6	Very high	125 Å²	125	96.2 Å²	96.2	58%	0.584	50%	0.495	S	S	*	.	H	α-helix	trans	-63.7	-42.7	175.9	-168.1	175.4	9.8	0	0	111.7	S30 H31 L36 I37 S38	S30-Q34 PolarHBondContact O-N 2.92Å; H31-Q34 PolarHBondContact O-N 2.78Å; Q34-L36 VanDerWaalsContact C-N 3.34Å; Q34-L36 PolarHBondContact O-N 3.14Å; Q34-I37 PolarHBondContact O-N 3.21Å; Q34-S38 PolarHBondContact O-N 2.91Å; Q34-S38 PolarHBondContact O-OG 3.45Å
35	K	97.9	Very high	97.6	Very high	118 Å²	118	94.6 Å²	94.6	51%	0.513	49%	0.492	S	S	.	.	H	α-helix	trans	-62.4	-40.4	176.1	-172.5	174.9	-178.3	178.2	0	112.1	H31 L32 I37 S38 L39	H31-K35 WeakPolarHBondContact O-CB 3.49Å; H31-K35 PolarHBondContact O-N 2.7Å; L32-K35 PolarHBondContact O-N 3.23Å; K35-I37 VanDerWaalsContact C-N 3.35Å; K35-S38 PolarHBondContact O-N 3.27Å; K35-L39 HydrophobicContact CG-CD1 4.13Å; K35-L39 HydrophobicContact CG-CG 4.5Å; K35-L39 WeakPolarHBondContact O-CB 3.4Å; K35-L39 WeakPolarHBondContact O-CG 3.36Å; K35-L39 PolarHBondContact O-N 3.05Å
36	L	97.9	Very high	97.6	Very high	114 Å²	114	96.3 Å²	96.3	60%	0.597	50%	0.5	S	S	*	.	H	α-helix	trans	-62.4	-42.5	176.4	-178.4	64.6	0	0	0	111.4	L32 Q33 Q34 L39 T40	L32-L36 WeakPolarHBondContact O-CB 3.37Å; L32-L36 PolarHBondContact O-N 3.31Å; Q33-L36 PolarHBondContact O-N 3.23Å; Q34-L36 VanDerWaalsContact C-N 3.34Å; Q34-L36 PolarHBondContact O-N 3.14Å; L36-L39 PolarHBondContact O-N 2.57Å; L36-T40 WeakPolarHBondContact O-CB 3.45Å; L36-T40 PolarHBondContact O-N 3.21Å; L36-T40 PolarHBondContact O-OG1 2.98Å
37	I	98.1	Very high	97.6	Very high	99 Å²	99	97.3 Å²	97.3	51%	0.508	50%	0.504	S	S	.	.	H	α-helix	trans	-61.5	-48	175.9	-67.4	164.7	0	0	0	110.5	Q33 Q34 K35 L39 T40 Q41	Q33-I37 WeakPolarHBondContact O-CG1 3.19Å; Q33-I37 PolarHBondContact O-N 3.18Å; Q34-I37 PolarHBondContact O-N 3.21Å; K35-I37 VanDerWaalsContact C-N 3.35Å; I37-L39 PolarHBondContact O-N 3.45Å; I37-T40 PolarHBondContact O-N 2.73Å; I37-Q41 WeakPolarHBondContact O-CG 3.38Å; I37-Q41 PolarHBondContact O-N 3.18Å
38	S	97.5	Very high	97.6	Very high	64 Å²	64	99.2 Å²	99.2	45%	0.448	51%	0.508	S	S	.	.	H	α-helix	trans	-60.9	-45.7	178.5	-59.9	0	0	0	0	112.6	Q34 K35 T40 Q41 E42	Q34-S38 PolarHBondContact O-N 2.91Å; Q34-S38 PolarHBondContact O-OG 3.45Å; K35-S38 PolarHBondContact O-N 3.27Å; S38-T40 VanDerWaalsContact C-N 3.3Å; S38-T40 PolarHBondContact O-N 2.72Å; S38-Q41 PolarHBondContact O-N 3.32Å; S38-E42 PolarHBondContact O-N 3.49Å
39	L	97.8	Very high	97.6	Very high	90 Å²	90	102.2 Å²	102.2	47%	0.471	52%	0.518	S	S	.	.	H	α-helix	trans	-64.8	-34.7	177.7	-74	172.9	0	0	0	112.2	K35 L36 I37 E42 A43	K35-L39 HydrophobicContact CG-CD1 4.13Å; K35-L39 HydrophobicContact CG-CG 4.5Å; K35-L39 WeakPolarHBondContact O-CB 3.4Å; K35-L39 WeakPolarHBondContact O-CG 3.36Å; K35-L39 PolarHBondContact O-N 3.05Å; L36-L39 PolarHBondContact O-N 2.57Å; I37-L39 PolarHBondContact O-N 3.45Å; L39-E42 PolarHBondContact O-N 3.3Å; L39-A43 WeakPolarHBondContact O-CB 3.45Å; L39-A43 PolarHBondContact O-N 3.37Å
40	T	97.4	Very high	97.6	Very high	67 Å²	67	104 Å²	104	41%	0.411	52%	0.522	S	S	.	.	H	α-helix	trans	-65.2	-44.2	175.3	-56.2	0	0	0	0	110.7	L36 I37 S38 A43 E44	L36-T40 WeakPolarHBondContact O-CB 3.45Å; L36-T40 PolarHBondContact O-N 3.21Å; L36-T40 PolarHBondContact O-OG1 2.98Å; I37-T40 PolarHBondContact O-N 2.73Å; S38-T40 VanDerWaalsContact C-N 3.3Å; S38-T40 PolarHBondContact O-N 2.72Å; T40-A43 PolarHBondContact O-N 3.32Å; T40-E44 WeakPolarHBondContact O-CG 3.26Å; T40-E44 PolarHBondContact O-N 2.95Å
41	Q	97.6	Very high	97.6	Very high	122 Å²	122	105.7 Å²	105.7	57%	0.57	52%	0.523	S	S	*	.	H	α-helix	trans	-64.3	-39.2	176.4	-70.5	176.3	-8	0	0	112.5	I37 S38 E44 S45	I37-Q41 WeakPolarHBondContact O-CG 3.38Å; I37-Q41 PolarHBondContact O-N 3.18Å; S38-Q41 PolarHBondContact O-N 3.32Å; Q41-E44 PolarHBondContact O-N 3.02Å; Q41-S45 PolarHBondContact O-N 2.94Å
42	E	97.4	Very high	97.6	Very high	102 Å²	102	105 Å²	105	48%	0.477	52%	0.519	S	S	.	.	H	α-helix	trans	-66.8	-42.6	175.6	-176.1	172	-172.7	0	0	112.1	S38 L39 E44 S45 Q46	S38-E42 PolarHBondContact O-N 3.49Å; L39-E42 PolarHBondContact O-N 3.3Å; E42-E44 VanDerWaalsContact C-N 3.29Å; E42-E44 PolarHBondContact O-N 3.04Å; E42-S45 PolarHBondContact O-N 3.37Å; E42-S45 PolarHBondContact O-OG 2.99Å; E42-Q46 WeakPolarHBondContact O-CG 3.46Å; E42-Q46 PolarHBondContact O-N 3.13Å
43	A	97.2	Very high	97.5	Very high	58 Å²	58	104 Å²	104	48%	0.479	51%	0.514	S	S	.	.	H	α-helix	trans	-61.8	-39	175	0	0	0	0	0	111.8	L39 T40 K47	L39-A43 WeakPolarHBondContact O-CB 3.45Å; L39-A43 PolarHBondContact O-N 3.37Å; T40-A43 PolarHBondContact O-N 3.32Å; A43-K47 WeakPolarHBondContact O-CB 3.46Å; A43-K47 PolarHBondContact O-N 2.93Å
44	E	97.7	Very high	97.5	Very high	112 Å²	112	101.7 Å²	101.7	52%	0.523	50%	0.504	S	S	.	.	H	α-helix	trans	-66.1	-38.4	174.7	-74.7	179.2	-178.9	0	0	112.9	T40 Q41 E42 K48	T40-E44 WeakPolarHBondContact O-CG 3.26Å; T40-E44 PolarHBondContact O-N 2.95Å; Q41-E44 PolarHBondContact O-N 3.02Å; E42-E44 VanDerWaalsContact C-N 3.29Å; E42-E44 PolarHBondContact O-N 3.04Å; E44-K48 WeakPolarHBondContact O-CG 3.46Å; E44-K48 PolarHBondContact O-N 3.5Å; E44-K48 VanDerWaalsContact O-N 3.15Å
45	S	97.3	Very high	97.5	Very high	66 Å²	66	100.6 Å²	100.6	46%	0.462	50%	0.498	S	S	.	.	H	α-helix	trans	-70.1	-42.8	178	73.4	0	0	0	0	112	Q41 E42 K47 K48 F49	Q41-S45 PolarHBondContact O-N 2.94Å; E42-S45 PolarHBondContact O-N 3.37Å; E42-S45 PolarHBondContact O-OG 2.99Å; S45-K47 VanDerWaalsContact C-N 3.32Å; S45-K47 PolarHBondContact O-N 3.43Å; S45-K48 PolarHBondContact O-N 2.65Å; S45-F49 PolarHBondContact O-N 2.77Å
46	Q	97.4	Very high	97.4	Very high	116 Å²	116	99.7 Å²	99.7	54%	0.542	50%	0.496	S	S	.	.	H	α-helix	trans	-61.7	-40.3	174.4	-71.6	-178.4	6.7	0	0	111.7	E42 K48 F49 K50	E42-Q46 WeakPolarHBondContact O-CG 3.46Å; E42-Q46 PolarHBondContact O-N 3.13Å; Q46-K48 PolarHBondContact O-N 2.84Å; Q46-F49 PolarHBondContact O-N 3.26Å; Q46-K50 WeakPolarHBondContact O-CB 3.49Å; Q46-K50 PolarHBondContact O-N 2.78Å
47	K	97.7	Very high	97.3	Very high	137 Å²	137	99.7 Å²	99.7	60%	0.596	50%	0.496	S	S	*	.	H	α-helix	trans	-60.5	-44.3	175.4	-175	178	178.9	-179.1	0	111.8	A43 S45 K50 Q51	A43-K47 WeakPolarHBondContact O-CB 3.46Å; A43-K47 PolarHBondContact O-N 2.93Å; S45-K47 VanDerWaalsContact C-N 3.32Å; S45-K47 PolarHBondContact O-N 3.43Å; K47-K50 PolarHBondContact O-N 2.92Å; K47-Q51 VanDerWaalsContact O-CG 3.3Å; K47-Q51 WeakPolarHBondContact O-CG 3.32Å; K47-Q51 PolarHBondContact O-N 2.83Å; K47-Q51 VanDerWaalsContact O-N 3.08Å
48	K	97.6	Very high	97.1	Very high	144 Å²	144	101 Å²	101	63%	0.626	50%	0.495	S	S	*	.	H	α-helix	trans	-64.1	-40.7	175.8	-72.5	174.5	-178.7	174.3	0	111.9	E44 S45 Q46 Q51 H52	E44-K48 WeakPolarHBondContact O-CG 3.46Å; E44-K48 PolarHBondContact O-N 3.5Å; E44-K48 VanDerWaalsContact O-N 3.15Å; S45-K48 PolarHBondContact O-N 2.65Å; Q46-K48 PolarHBondContact O-N 2.84Å; K48-Q51 PolarHBondContact O-N 3.4Å; K48-H52 PolarHBondContact O-N 3.28Å
49	F	97.2	Very high	97	Very high	130 Å²	130	101.6 Å²	101.6	57%	0.57	49%	0.493	S	S	*	.	H	α-helix	trans	-65.1	-43.3	177.6	-177.4	-107.2	0	0	0	112.5	S45 Q46 Q51 H52 L53	S45-F49 PolarHBondContact O-N 2.77Å; Q46-F49 PolarHBondContact O-N 3.26Å; F49-Q51 VanDerWaalsContact C-N 3.34Å; F49-Q51 PolarHBondContact O-N 3.01Å; F49-H52 WeakPolarHBondContact O-CB 3.49Å; F49-H52 PolarHBondContact O-N 2.9Å; F49-L53 HydrophobicContact CD1-CD1 3.98Å; F49-L53 HydrophobicContact CE1-CD1 3.39Å; F49-L53 HydrophobicContact CE1-CG 4.12Å; F49-L53 HydrophobicContact CZ-CD1 3.79Å; F49-L53 HydrophobicContact CZ-CD2 4.49Å; F49-L53 HydrophobicContact CZ-CG 4.11Å; F49-L53 PolarHBondContact O-N 3.44Å
50	K	97.6	Very high	96.8	Very high	128 Å²	128	101.6 Å²	101.6	56%	0.557	49%	0.493	S	S	*	.	H	α-helix	trans	-59.6	-44.4	174	-172.4	-178.6	-170.7	-93.2	0	111.8	Q46 K47 H52 L53 E54	Q46-K50 WeakPolarHBondContact O-CB 3.49Å; Q46-K50 PolarHBondContact O-N 2.78Å; K47-K50 PolarHBondContact O-N 2.92Å; K50-H52 VanDerWaalsContact C-N 3.28Å; K50-H52 PolarHBondContact O-N 3.32Å; K50-L53 PolarHBondContact O-N 2.96Å; K50-E54 WeakPolarHBondContact CE-OE1 3.48Å; K50-E54 IonicContact NZ-OE1 2.86Å; K50-E54 PolarHBondContact NZ-OE1 3.13Å; K50-E54 WeakPolarHBondContact O-CB 3.42Å; K50-E54 WeakPolarHBondContact O-CG 3.43Å; K50-E54 PolarHBondContact O-N 3.5Å
51	Q	97.4	Very high	96.6	Very high	102 Å²	102	104.4 Å²	104.4	48%	0.477	50%	0.501	S	S	.	.	H	α-helix	trans	-60.2	-39.4	176.6	-75.1	175.3	-25.9	0	0	111.9	K47 K48 F49 E55	K47-Q51 VanDerWaalsContact O-CG 3.3Å; K47-Q51 WeakPolarHBondContact O-CG 3.32Å; K47-Q51 PolarHBondContact O-N 2.83Å; K47-Q51 VanDerWaalsContact O-N 3.08Å; K48-Q51 PolarHBondContact O-N 3.4Å; F49-Q51 VanDerWaalsContact C-N 3.34Å; F49-Q51 PolarHBondContact O-N 3.01Å; Q51-E55 WeakPolarHBondContact O-CB 3.27Å; Q51-E55 PolarHBondContact O-N 3.26Å; Q51-E55 VanDerWaalsContact O-N 3.07Å
52	H	97.1	Very high	96.2	Very high	97 Å²	97	105.6 Å²	105.6	45%	0.449	51%	0.507	S	S	.	.	H	α-helix	trans	-66	-46.7	176.4	-174.9	49.7	0	0	0	112.6	K48 F49 K50 E54 E55 E56	K48-H52 PolarHBondContact O-N 3.28Å; F49-H52 WeakPolarHBondContact O-CB 3.49Å; F49-H52 PolarHBondContact O-N 2.9Å; K50-H52 VanDerWaalsContact C-N 3.28Å; K50-H52 PolarHBondContact O-N 3.32Å; H52-E54 VanDerWaalsContact C-N 3.34Å; H52-E54 PolarHBondContact O-N 2.84Å; H52-E55 WeakPolarHBondContact O-CB 3.48Å; H52-E55 PolarHBondContact O-N 2.9Å; H52-E55 VanDerWaalsContact O-N 3.1Å; H52-E56 IonicContact CE1-OE1 2.82Å; H52-E56 IonicContact NE2-OE1 3.19Å; H52-E56 PolarHBondContact NE2-OE1 3.44Å; H52-E56 PolarHBondContact O-N 3.37Å
53	L	97.1	Very high	95.8	Very high	73 Å²	73	105.1 Å²	105.1	38%	0.382	51%	0.511	S	S	.	.	H	α-helix	trans	-61.1	-40.4	175.7	-79.1	173.2	0	0	0	112.8	F49 K50 E55 E56 L57	F49-L53 HydrophobicContact CD1-CD1 3.98Å; F49-L53 HydrophobicContact CE1-CD1 3.39Å; F49-L53 HydrophobicContact CE1-CG 4.12Å; F49-L53 HydrophobicContact CZ-CD1 3.79Å; F49-L53 HydrophobicContact CZ-CD2 4.49Å; F49-L53 HydrophobicContact CZ-CG 4.11Å; F49-L53 PolarHBondContact O-N 3.44Å; K50-L53 PolarHBondContact O-N 2.96Å; L53-E55 VanDerWaalsContact C-N 3.26Å; L53-E55 PolarHBondContact O-N 3.4Å; L53-E56 PolarHBondContact O-N 3.17Å; L53-L57 WeakPolarHBondContact O-CB 3.28Å; L53-L57 WeakPolarHBondContact O-CG 3.47Å; L53-L57 PolarHBondContact O-N 3.29Å
54	E	97.3	Very high	95.3	Very high	72 Å²	72	110.5 Å²	110.5	34%	0.336	52%	0.52	S	S	.	.	H	α-helix	trans	-64.5	-32.8	175.5	-73.2	172.4	179.5	0	0	111.8	K50 H52 R58	K50-E54 WeakPolarHBondContact CE-OE1 3.48Å; K50-E54 IonicContact NZ-OE1 2.86Å; K50-E54 PolarHBondContact NZ-OE1 3.13Å; K50-E54 WeakPolarHBondContact O-CB 3.42Å; K50-E54 WeakPolarHBondContact O-CG 3.43Å; K50-E54 PolarHBondContact O-N 3.5Å; H52-E54 VanDerWaalsContact C-N 3.34Å; H52-E54 PolarHBondContact O-N 2.84Å; E54-R58 WeakPolarHBondContact O-CG 3.07Å; E54-R58 PolarHBondContact O-N 3.24Å; E54-R58 VanDerWaalsContact O-N 3.09Å; E54-R58 PolarHBondContact O-NH1 3.3Å
55	E	97.2	Very high	94.6	Very high	101 Å²	101	112 Å²	112	47%	0.472	53%	0.525	S	S	.	.	H	α-helix	trans	-73.2	-41.4	174	-170.5	164.6	-160.7	0	0	112	Q51 H52 L53 L57 R58 N59	Q51-E55 WeakPolarHBondContact O-CB 3.27Å; Q51-E55 PolarHBondContact O-N 3.26Å; Q51-E55 VanDerWaalsContact O-N 3.07Å; H52-E55 WeakPolarHBondContact O-CB 3.48Å; H52-E55 PolarHBondContact O-N 2.9Å; H52-E55 VanDerWaalsContact O-N 3.1Å; L53-E55 VanDerWaalsContact C-N 3.26Å; L53-E55 PolarHBondContact O-N 3.4Å; E55-L57 PolarHBondContact O-N 2.92Å; E55-R58 PolarHBondContact O-N 2.96Å; E55-N59 WeakPolarHBondContact O-CB 3.42Å; E55-N59 PolarHBondContact O-N 2.93Å; E55-N59 PolarHBondContact O-ND2 3.37Å
56	E	96.7	Very high	93.4	Very high	100 Å²	100	116.4 Å²	116.4	47%	0.467	54%	0.538	S	S	.	.	H	α-helix	trans	-61.6	-42.1	173.1	-71.3	-169.4	153.7	0	0	112.3	H52 L53 N59 L60	H52-E56 IonicContact CE1-OE1 2.82Å; H52-E56 IonicContact NE2-OE1 3.19Å; H52-E56 PolarHBondContact NE2-OE1 3.44Å; H52-E56 PolarHBondContact O-N 3.37Å; L53-E56 PolarHBondContact O-N 3.17Å; E56-N59 PolarHBondContact O-N 3.42Å; E56-L60 WeakPolarHBondContact O-CB 3.35Å; E56-L60 PolarHBondContact O-N 2.87Å
57	L	95.9	Very high	92.1	Very high	113 Å²	113	116.6 Å²	116.6	59%	0.592	55%	0.55	S	S	*	.	H	α-helix	trans	-64.4	-42.9	175.7	-76.5	174.7	0	0	0	112	L53 E55 N59 L60 E61	L53-L57 WeakPolarHBondContact O-CB 3.28Å; L53-L57 WeakPolarHBondContact O-CG 3.47Å; L53-L57 PolarHBondContact O-N 3.29Å; E55-L57 PolarHBondContact O-N 2.92Å; L57-N59 VanDerWaalsContact C-N 3.35Å; L57-L60 PolarHBondContact O-N 3.28Å; L57-E61 WeakPolarHBondContact O-CB 3.4Å; L57-E61 PolarHBondContact O-N 3.05Å
58	R	94.1	Very high	90.5	Very high	127 Å²	127	115.3 Å²	115.3	48%	0.479	55%	0.549	S	S	.	.	H	α-helix	trans	-62.2	-42.2	173.5	-81.2	-170.7	-58.5	-85.8	-3.8	112	E54 E55 L60 E61 E62	E54-R58 WeakPolarHBondContact O-CG 3.07Å; E54-R58 PolarHBondContact O-N 3.24Å; E54-R58 VanDerWaalsContact O-N 3.09Å; E54-R58 PolarHBondContact O-NH1 3.3Å; E55-R58 PolarHBondContact O-N 2.96Å; R58-L60 VanDerWaalsContact C-N 3.32Å; R58-L60 PolarHBondContact O-N 3.22Å; R58-E61 PolarHBondContact O-N 3.37Å; R58-E62 WeakPolarHBondContact O-CB 3.47Å; R58-E62 PolarHBondContact O-N 2.85Å
59	N	94.1	Very high	88.8	Confident	77 Å²	77	115.7 Å²	115.7	41%	0.412	56%	0.558	S	S	.	*	H	α-helix	trans	-64.5	-38.7	176.9	-70.2	-20.5	0	0	0	111.2	E55 E56 L57 T63	E55-N59 WeakPolarHBondContact O-CB 3.42Å; E55-N59 PolarHBondContact O-N 2.93Å; E55-N59 PolarHBondContact O-ND2 3.37Å; E56-N59 PolarHBondContact O-N 3.42Å; L57-N59 VanDerWaalsContact C-N 3.35Å; N59-T63 WeakPolarHBondContact O-CB 3.38Å; N59-T63 PolarHBondContact O-N 2.63Å; N59-T63 PolarHBondContact O-OG1 2.92Å
60	L	94.4	Very high	86.8	Confident	89 Å²	89	118 Å²	118	47%	0.466	57%	0.565	S	S	.	*	H	α-helix	trans	-66.1	-43.6	175.6	-164	78.7	0	0	0	111	E56 L57 R58 T63 Y64	E56-L60 WeakPolarHBondContact O-CB 3.35Å; E56-L60 PolarHBondContact O-N 2.87Å; L57-L60 PolarHBondContact O-N 3.28Å; R58-L60 VanDerWaalsContact C-N 3.32Å; R58-L60 PolarHBondContact O-N 3.22Å; L60-T63 PolarHBondContact O-N 3.48Å; L60-Y64 HydrophobicContact CD1-CD2 3.49Å; L60-Y64 VanDerWaalsContact CD1-CD2 3.49Å; L60-Y64 HydrophobicContact CD1-CE2 3.43Å; L60-Y64 VanDerWaalsContact CD1-CE2 3.43Å; L60-Y64 HydrophobicContact CG-CD2 3.9Å; L60-Y64 HydrophobicContact CG-CE2 4.34Å; L60-Y64 WeakPolarHBondContact O-CB 3.44Å; L60-Y64 WeakPolarHBondContact O-CD2 3.47Å; L60-Y64 PolarHBondContact O-N 3.12Å
61	E	91.8	Very high	84.8	Confident	127 Å²	127	116.6 Å²	116.6	59%	0.593	57%	0.57	S	S	*	*	H	α-helix	trans	-58.2	-52.7	173.9	-167.6	173.7	-172.1	0	0	110.5	L57 R58 T63 F65	L57-E61 WeakPolarHBondContact O-CB 3.4Å; L57-E61 PolarHBondContact O-N 3.05Å; R58-E61 PolarHBondContact O-N 3.37Å; E61-T63 PolarHBondContact O-N 3.27Å; E61-F65 HydrophobicContact CG-CB 4.47Å; E61-F65 CarbonylContact O-C 3.44Å; E61-F65 VanDerWaalsContact O-CA 3.26Å; E61-F65 WeakPolarHBondContact O-CA 3.29Å; E61-F65 WeakPolarHBondContact O-CB 3.38Å; E61-F65 PolarHBondContact O-N 3.39Å; E61-F65 VanDerWaalsContact O-O 3.09Å
62	E	89.5	Confident	82.6	Confident	147 Å²	147	114.9 Å²	114.9	69%	0.687	57%	0.569	S	S	*	*	H	α-helix	trans	-65.7	-36.4	-179.5	-172.4	175.3	-174.9	0	0	113.5	R58	R58-E62 WeakPolarHBondContact O-CB 3.47Å; R58-E62 PolarHBondContact O-N 2.85Å
63	T	90.1	Very high	80.7	Confident	92 Å²	92	112.1 Å²	112.1	56%	0.564	57%	0.567	S	S	*	*	H	α-helix	trans	-73.9	-39.9	-178	-58.8	0	0	0	0	112.1	N59 L60 E61	N59-T63 WeakPolarHBondContact O-CB 3.38Å; N59-T63 PolarHBondContact O-N 2.63Å; N59-T63 PolarHBondContact O-OG1 2.92Å; L60-T63 PolarHBondContact O-N 3.48Å; E61-T63 PolarHBondContact O-N 3.27Å
64	Y	87	Confident	78.9	Confident	170 Å²	170	115.7 Å²	115.7	67%	0.667	59%	0.586	S	S	*	*	H	α-helix	trans	-111	-17.8	-168.7	-64	-80.8	0	0	0	113.9	L60	L60-Y64 HydrophobicContact CD1-CD2 3.49Å; L60-Y64 VanDerWaalsContact CD1-CD2 3.49Å; L60-Y64 HydrophobicContact CD1-CE2 3.43Å; L60-Y64 VanDerWaalsContact CD1-CE2 3.43Å; L60-Y64 HydrophobicContact CG-CD2 3.9Å; L60-Y64 HydrophobicContact CG-CE2 4.34Å; L60-Y64 WeakPolarHBondContact O-CB 3.44Å; L60-Y64 WeakPolarHBondContact O-CD2 3.47Å; L60-Y64 PolarHBondContact O-N 3.12Å
65	F	81.5	Confident	77.4	Confident	143 Å²	143	115.4 Å²	115.4	63%	0.627	59%	0.592	S	S	*	*			trans	-120.6	89.8	-179.6	-56.4	-97.2	0	0	0	109	E61	E61-F65 HydrophobicContact CG-CB 4.47Å; E61-F65 CarbonylContact O-C 3.44Å; E61-F65 VanDerWaalsContact O-CA 3.26Å; E61-F65 WeakPolarHBondContact O-CA 3.29Å; E61-F65 WeakPolarHBondContact O-CB 3.38Å; E61-F65 PolarHBondContact O-N 3.39Å; E61-F65 VanDerWaalsContact O-O 3.09Å
66	Q	72.8	Confident	76.4	Confident	159 Å²	159	114 Å²	114	74%	0.743	59%	0.588	S	S	*	*			trans	-82.3	140.8	166.8	-64.2	-162.2	-19.1	0	0	109.1	D68	Q66-D68 PolarHBondContact O-N 3.43Å
67	P	69.8	Low	75.7	Confident	120 Å²	120	113 Å²	113	78%	0.779	59%	0.588	S	S	*	*			trans	-55.2	109.2	167.8	-19.4	30.4	0	0	0	107.8	D69	P67-D69 PolarHBondContact O-N 3.4Å
68	D	64.5	Low	75.1	Confident	110 Å²	110	110.7 Å²	110.7	59%	0.588	58%	0.581	S	S	*	*			trans	-76.1	107.9	175.7	-158.8	-13	0	0	0	106.9	Q66 Y70 S71	Q66-D68 PolarHBondContact O-N 3.43Å; D68-Y70 PolarHBondContact O-N 3.01Å; D68-Y70 PolarHBondContact OD1-N 3.42Å; D68-S71 PolarHBondContact O-N 2.94Å
69	D	62.1	Low	74.8	Confident	153 Å²	153	110.6 Å²	110.6	82%	0.818	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-11.3	169.8	-74.9	-27.5	0	0	0	111.2	P67	P67-D69 PolarHBondContact O-N 3.4Å
70	Y	53.9	Low	74.5	Confident	179 Å²	179	111.4 Å²	111.4	70%	0.702	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.2	70.9	172.6	-56.5	-88.3	0	0	0	110.9	D68 C72 G73	D68-Y70 PolarHBondContact O-N 3.01Å; D68-Y70 PolarHBondContact OD1-N 3.42Å; Y70-C72 PolarHBondContact O-N 3.41Å; Y70-G73 PolarHBondContact O-N 3.45Å
71	S	55.7	Low	74.3	Confident	97 Å²	97	111 Å²	111	68%	0.678	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	-4.3	165	70.2	0	0	0	0	114.3	D68 G73 S75	D68-S71 PolarHBondContact O-N 2.94Å; S71-G73 VanDerWaalsContact C-N 3.34Å; S71-G73 PolarHBondContact O-N 3.14Å; S71-S75 WeakPolarHBondContact O-CB 3.41Å; S71-S75 PolarHBondContact O-N 3.43Å
72	C	52.5	Low	74.4	Confident	66 Å²	66	109.3 Å²	109.3	45%	0.446	59%	0.586	S	S	.	*	H	α-helix	trans	-51.5	-45.8	174.6	-149.3	0	0	0	0	111.7	Y70 L74 S75 D76	Y70-C72 PolarHBondContact O-N 3.41Å; C72-L74 PolarHBondContact O-N 2.95Å; C72-S75 PolarHBondContact O-N 2.92Å; C72-D76 VanDerWaalsContact O-CB 3.26Å; C72-D76 WeakPolarHBondContact O-CB 3.33Å; C72-D76 PolarHBondContact O-N 2.94Å; C72-D76 VanDerWaalsContact O-OD2 3.14Å; C72-D76 PolarHBondContact SG-OD1 3.23Å; C72-D76 VanDerWaalsContact SG-OD1 3.42Å; C72-D76 PolarHBondContact SG-OD2 2.98Å
73	G	57.5	Low	74.5	Confident	40 Å²	40	106 Å²	106	41%	0.412	57%	0.571	S	S	.	*	H	α-helix	trans	-61.5	-44.5	-168.4	0	0	0	0	0	115.9	Y70 S71 V77	Y70-G73 PolarHBondContact O-N 3.45Å; S71-G73 VanDerWaalsContact C-N 3.34Å; S71-G73 PolarHBondContact O-N 3.14Å; G73-V77 WeakPolarHBondContact O-CG2 3.24Å; G73-V77 PolarHBondContact O-N 3.42Å; G73-V77 VanDerWaalsContact O-N 3.16Å
74	L	58.5	Low	74.7	Confident	147 Å²	147	107.2 Å²	107.2	77%	0.77	57%	0.57	S	S	*	*	H	α-helix	trans	-80	-32	177.7	-72.2	175.5	0	0	0	112.5	C72 D76 V77 S78	C72-L74 PolarHBondContact O-N 2.95Å; L74-D76 VanDerWaalsContact C-N 3.3Å; L74-V77 PolarHBondContact O-N 3.35Å; L74-S78 WeakPolarHBondContact O-CB 3.34Å; L74-S78 PolarHBondContact O-N 2.91Å
75	S	66	Low	75.1	Confident	66 Å²	66	103.1 Å²	103.1	46%	0.462	56%	0.559	S	S	.	*	H	α-helix	trans	-60.9	-44.3	171.1	-171.2	0	0	0	0	110.1	S71 C72 S78 E79	S71-S75 WeakPolarHBondContact O-CB 3.41Å; S71-S75 PolarHBondContact O-N 3.43Å; C72-S75 PolarHBondContact O-N 2.92Å; S75-S78 PolarHBondContact O-N 3.23Å; S75-E79 WeakPolarHBondContact O-CB 3.47Å; S75-E79 PolarHBondContact O-N 3.5Å
76	D	76.4	Confident	75.8	Confident	72 Å²	72	103 Å²	103	39%	0.385	55%	0.554	S	S	.	*	H	α-helix	trans	-63.7	-44.3	178.6	-64.7	-17.5	0	0	0	110.9	C72 L74 E79 V80	C72-D76 VanDerWaalsContact O-CB 3.26Å; C72-D76 WeakPolarHBondContact O-CB 3.33Å; C72-D76 PolarHBondContact O-N 2.94Å; C72-D76 VanDerWaalsContact O-OD2 3.14Å; C72-D76 PolarHBondContact SG-OD1 3.23Å; C72-D76 VanDerWaalsContact SG-OD1 3.42Å; C72-D76 PolarHBondContact SG-OD2 2.98Å; L74-D76 VanDerWaalsContact C-N 3.3Å; D76-E79 PolarHBondContact O-N 2.88Å; D76-V80 VanDerWaalsContact O-CB 3.3Å; D76-V80 WeakPolarHBondContact O-CB 3.48Å; D76-V80 WeakPolarHBondContact O-CG2 3.36Å; D76-V80 PolarHBondContact O-N 2.97Å
77	V	81.1	Confident	77	Confident	80 Å²	80	98 Å²	98	49%	0.485	54%	0.536	S	S	.	.	H	α-helix	trans	-65.5	-44.9	176.9	173.4	0	0	0	0	111.4	G73 L74 E79 V80 I81	G73-V77 WeakPolarHBondContact O-CG2 3.24Å; G73-V77 PolarHBondContact O-N 3.42Å; G73-V77 VanDerWaalsContact O-N 3.16Å; L74-V77 PolarHBondContact O-N 3.35Å; V77-E79 VanDerWaalsContact C-N 3.34Å; V77-V80 PolarHBondContact O-N 3.42Å; V77-I81 HydrophobicContact CG1-CD1 3.77Å; V77-I81 HydrophobicContact CG1-CG1 4.42Å; V77-I81 WeakPolarHBondContact O-CB 3.47Å; V77-I81 VanDerWaalsContact O-CG1 3.26Å; V77-I81 WeakPolarHBondContact O-CG1 3.22Å; V77-I81 PolarHBondContact O-N 3.49Å
78	S	83.4	Confident	78.3	Confident	63 Å²	63	97 Å²	97	44%	0.441	52%	0.524	S	S	.	.	H	α-helix	trans	-61.6	-43.5	176.4	-176	0	0	0	0	111.1	L74 S75 I81 N82	L74-S78 WeakPolarHBondContact O-CB 3.34Å; L74-S78 PolarHBondContact O-N 2.91Å; S75-S78 PolarHBondContact O-N 3.23Å; S78-I81 PolarHBondContact O-N 2.89Å; S78-N82 VanDerWaalsContact O-CB 3.29Å; S78-N82 WeakPolarHBondContact O-CB 3.36Å; S78-N82 PolarHBondContact O-N 3Å; S78-N82 PolarHBondContact O-ND2 2.97Å; S78-N82 PolarHBondContact OG-ND2 3.06Å
79	E	87.9	Confident	79.8	Confident	125 Å²	125	95.9 Å²	95.9	58%	0.584	52%	0.518	S	S	*	.	H	α-helix	trans	-64.1	-44.5	177.2	-172	171.3	-174.1	0	0	111.4	S75 D76 V77 I81 N82 E83	S75-E79 WeakPolarHBondContact O-CB 3.47Å; S75-E79 PolarHBondContact O-N 3.5Å; D76-E79 PolarHBondContact O-N 2.88Å; V77-E79 VanDerWaalsContact C-N 3.34Å; E79-I81 PolarHBondContact O-N 3Å; E79-N82 PolarHBondContact O-N 3.17Å; E79-E83 WeakPolarHBondContact O-CB 3.45Å; E79-E83 PolarHBondContact O-N 2.82Å
80	V	88.5	Confident	81.5	Confident	95 Å²	95	91.8 Å²	91.8	58%	0.576	50%	0.498	S	S	*	.	H	α-helix	trans	-61.3	-44.1	175.1	168.7	0	0	0	0	111.3	D76 V77 E83 Q84	D76-V80 VanDerWaalsContact O-CB 3.3Å; D76-V80 WeakPolarHBondContact O-CB 3.48Å; D76-V80 WeakPolarHBondContact O-CG2 3.36Å; D76-V80 PolarHBondContact O-N 2.97Å; V77-V80 PolarHBondContact O-N 3.42Å; V80-E83 PolarHBondContact O-N 3.43Å; V80-Q84 WeakPolarHBondContact O-CB 3.31Å; V80-Q84 PolarHBondContact O-N 3.3Å
81	I	90.8	Very high	83.5	Confident	81 Å²	81	87.5 Å²	87.5	42%	0.415	49%	0.486	S	S	.	.	H	α-helix	trans	-64.9	-45.3	177.2	-71.2	169.3	0	0	0	110.5	V77 S78 E79 E83 Q84 I85	V77-I81 HydrophobicContact CG1-CD1 3.77Å; V77-I81 HydrophobicContact CG1-CG1 4.42Å; V77-I81 WeakPolarHBondContact O-CB 3.47Å; V77-I81 VanDerWaalsContact O-CG1 3.26Å; V77-I81 WeakPolarHBondContact O-CG1 3.22Å; V77-I81 PolarHBondContact O-N 3.49Å; S78-I81 PolarHBondContact O-N 2.89Å; E79-I81 PolarHBondContact O-N 3Å; I81-E83 VanDerWaalsContact C-N 3.33Å; I81-E83 PolarHBondContact O-N 3.46Å; I81-Q84 PolarHBondContact O-N 3.03Å; I81-I85 HydrophobicContact CG2-CD1 3.78Å; I81-I85 HydrophobicContact CG2-CG1 4.41Å; I81-I85 VanDerWaalsContact O-CG1 3.29Å; I81-I85 WeakPolarHBondContact O-CG1 3.14Å; I81-I85 PolarHBondContact O-N 2.96Å
82	N	92.7	Very high	85.5	Confident	90 Å²	90	87.3 Å²	87.3	48%	0.481	48%	0.477	S	S	.	.	H	α-helix	trans	-64.6	-39.3	179.1	-74.1	-40.7	0	0	0	111.7	S78 E79 I85 R86	S78-N82 VanDerWaalsContact O-CB 3.29Å; S78-N82 WeakPolarHBondContact O-CB 3.36Å; S78-N82 PolarHBondContact O-N 3Å; S78-N82 PolarHBondContact O-ND2 2.97Å; S78-N82 PolarHBondContact OG-ND2 3.06Å; E79-N82 PolarHBondContact O-N 3.17Å; N82-I85 PolarHBondContact O-N 3.05Å; N82-R86 VanDerWaalsContact O-CB 3.32Å; N82-R86 WeakPolarHBondContact O-CB 3.45Å; N82-R86 PolarHBondContact O-N 3.45Å
83	E	92.2	Very high	87.7	Confident	79 Å²	79	87.5 Å²	87.5	37%	0.369	48%	0.479	S	S	.	.	H	α-helix	trans	-65.7	-39.8	174.8	-178.7	53.5	-147.8	0	0	111.5	E79 V80 I81 R86 C87	E79-E83 WeakPolarHBondContact O-CB 3.45Å; E79-E83 PolarHBondContact O-N 2.82Å; V80-E83 PolarHBondContact O-N 3.43Å; I81-E83 VanDerWaalsContact C-N 3.33Å; I81-E83 PolarHBondContact O-N 3.46Å; E83-R86 WeakPolarHBondContact O-CB 3.47Å; E83-R86 PolarHBondContact O-N 3.07Å; E83-R86 IonicContact OE1-CZ 3.46Å; E83-R86 VanDerWaalsContact OE1-CZ 3.28Å; E83-R86 IonicContact OE1-NE 3.56Å; E83-R86 IonicContact OE1-NH2 3.78Å; E83-R86 PolarHBondContact OE1-NH2 3.14Å; E83-R86 IonicContact OE2-CZ 2.77Å; E83-R86 IonicContact OE2-NE 2.63Å; E83-R86 PolarHBondContact OE2-NE 3.33Å; E83-R86 IonicContact OE2-NH2 2.83Å; E83-R86 PolarHBondContact OE2-NH2 3.49Å; E83-C87 WeakPolarHBondContact O-CB 3.38Å; E83-C87 PolarHBondContact O-N 3.39Å; E83-C87 PolarHBondContact O-SG 2.98Å; E83-C87 PolarHBondContact OE1-SG 3.35Å
84	Q	94.4	Very high	89.6	Confident	117 Å²	117	91.5 Å²	91.5	55%	0.547	49%	0.487	S	S	.	.	H	α-helix	trans	-64.4	-45.8	173.8	-172.6	177.2	9.3	0	0	111.7	V80 I81 R86 C87 L88	V80-Q84 WeakPolarHBondContact O-CB 3.31Å; V80-Q84 PolarHBondContact O-N 3.3Å; I81-Q84 PolarHBondContact O-N 3.03Å; Q84-R86 VanDerWaalsContact C-N 3.29Å; Q84-R86 PolarHBondContact O-N 3.36Å; Q84-C87 PolarHBondContact O-N 2.8Å; Q84-L88 HydrophobicContact CG-CD1 4.21Å; Q84-L88 WeakPolarHBondContact O-CB 3.37Å; Q84-L88 VanDerWaalsContact O-CG 3.31Å; Q84-L88 WeakPolarHBondContact O-CG 3.45Å; Q84-L88 PolarHBondContact O-N 3.46Å
85	I	95.7	Very high	91.4	Very high	83 Å²	83	88.4 Å²	88.4	43%	0.426	47%	0.471	S	S	.	.	H	α-helix	trans	-58.8	-44	174.8	-71	167.9	0	0	0	110	I81 N82 L88 N89	I81-I85 HydrophobicContact CG2-CD1 3.78Å; I81-I85 HydrophobicContact CG2-CG1 4.41Å; I81-I85 VanDerWaalsContact O-CG1 3.29Å; I81-I85 WeakPolarHBondContact O-CG1 3.14Å; I81-I85 PolarHBondContact O-N 2.96Å; N82-I85 PolarHBondContact O-N 3.05Å; I85-L88 PolarHBondContact O-N 3.03Å; I85-N89 WeakPolarHBondContact O-CB 3.46Å; I85-N89 VanDerWaalsContact O-CG 3.3Å; I85-N89 PolarHBondContact O-N 3.41Å; I85-N89 PolarHBondContact O-ND2 2.97Å
86	R	96.4	Very high	92.9	Very high	141 Å²	141	91 Å²	91	53%	0.532	48%	0.477	S	S	.	.	H	α-helix	trans	-60	-49.1	176.9	-171.9	180	71.2	87.1	-9.1	111.6	N82 E83 Q84 L88 N89 V90	N82-R86 VanDerWaalsContact O-CB 3.32Å; N82-R86 WeakPolarHBondContact O-CB 3.45Å; N82-R86 PolarHBondContact O-N 3.45Å; E83-R86 WeakPolarHBondContact O-CB 3.47Å; E83-R86 PolarHBondContact O-N 3.07Å; E83-R86 IonicContact OE1-CZ 3.46Å; E83-R86 VanDerWaalsContact OE1-CZ 3.28Å; E83-R86 IonicContact OE1-NE 3.56Å; E83-R86 IonicContact OE1-NH2 3.78Å; E83-R86 PolarHBondContact OE1-NH2 3.14Å; E83-R86 IonicContact OE2-CZ 2.77Å; E83-R86 IonicContact OE2-NE 2.63Å; E83-R86 PolarHBondContact OE2-NE 3.33Å; E83-R86 IonicContact OE2-NH2 2.83Å; E83-R86 PolarHBondContact OE2-NH2 3.49Å; Q84-R86 VanDerWaalsContact C-N 3.29Å; Q84-R86 PolarHBondContact O-N 3.36Å; R86-L88 PolarHBondContact O-N 2.9Å; R86-N89 PolarHBondContact O-N 3.15Å; R86-V90 WeakPolarHBondContact O-CG2 3.35Å; R86-V90 PolarHBondContact O-N 2.87Å; R86-V90 VanDerWaalsContact O-N 3.1Å
87	C	96	Very high	93.9	Very high	54 Å²	54	91.5 Å²	91.5	37%	0.365	49%	0.486	S	S	.	.	H	α-helix	trans	-60.4	-44.3	177.9	-72.4	0	0	0	0	112.3	E83 Q84 N89 V90 I91	E83-C87 WeakPolarHBondContact O-CB 3.38Å; E83-C87 PolarHBondContact O-N 3.39Å; E83-C87 PolarHBondContact O-SG 2.98Å; E83-C87 PolarHBondContact OE1-SG 3.35Å; Q84-C87 PolarHBondContact O-N 2.8Å; C87-N89 VanDerWaalsContact C-N 3.33Å; C87-N89 PolarHBondContact O-N 2.83Å; C87-V90 PolarHBondContact O-N 3.01Å; C87-I91 WeakPolarHBondContact O-CG1 3.33Å; C87-I91 PolarHBondContact O-N 3.34Å; C87-I91 VanDerWaalsContact O-N 3.08Å
88	L	97.2	Very high	94.7	Very high	100 Å²	100	89.8 Å²	89.8	52%	0.524	48%	0.478	S	S	.	.	H	α-helix	trans	-62.7	-39.7	177.8	-72.3	171.9	0	0	0	111.9	Q84 I85 R86 V90 I91 L92	Q84-L88 HydrophobicContact CG-CD1 4.21Å; Q84-L88 WeakPolarHBondContact O-CB 3.37Å; Q84-L88 VanDerWaalsContact O-CG 3.31Å; Q84-L88 WeakPolarHBondContact O-CG 3.45Å; Q84-L88 PolarHBondContact O-N 3.46Å; I85-L88 PolarHBondContact O-N 3.03Å; R86-L88 PolarHBondContact O-N 2.9Å; L88-V90 VanDerWaalsContact C-N 3.35Å; L88-V90 PolarHBondContact O-N 3.4Å; L88-I91 PolarHBondContact O-N 3.22Å; L88-L92 WeakPolarHBondContact O-CB 3.48Å; L88-L92 PolarHBondContact O-N 2.76Å
89	N	97.3	Very high	95.4	Very high	86 Å²	86	91.4 Å²	91.4	46%	0.46	48%	0.482	S	S	.	.	H	α-helix	trans	-65.8	-35.6	176.5	-75.2	-30.9	0	0	0	112.8	I85 R86 C87 S93	I85-N89 WeakPolarHBondContact O-CB 3.46Å; I85-N89 VanDerWaalsContact O-CG 3.3Å; I85-N89 PolarHBondContact O-N 3.41Å; I85-N89 PolarHBondContact O-ND2 2.97Å; R86-N89 PolarHBondContact O-N 3.15Å; C87-N89 VanDerWaalsContact C-N 3.33Å; C87-N89 PolarHBondContact O-N 2.83Å; N89-S93 WeakPolarHBondContact O-CB 3.48Å; N89-S93 PolarHBondContact O-N 3.45Å; N89-S93 PolarHBondContact O-OG 3.48Å
90	V	97.6	Very high	95.8	Very high	66 Å²	66	89.6 Å²	89.6	40%	0.4	47%	0.473	S	S	.	.	H	α-helix	trans	-63.3	-51.6	173.2	172.6	0	0	0	0	110.3	R86 C87 L88 L92 S93 E94	R86-V90 WeakPolarHBondContact O-CG2 3.35Å; R86-V90 PolarHBondContact O-N 2.87Å; R86-V90 VanDerWaalsContact O-N 3.1Å; C87-V90 PolarHBondContact O-N 3.01Å; L88-V90 VanDerWaalsContact C-N 3.35Å; L88-V90 PolarHBondContact O-N 3.4Å; V90-L92 VanDerWaalsContact C-N 3.31Å; V90-L92 PolarHBondContact O-N 2.91Å; V90-S93 WeakPolarHBondContact O-CB 3.47Å; V90-S93 PolarHBondContact O-N 3.47Å; V90-S93 VanDerWaalsContact O-N 3.13Å; V90-E94 PolarHBondContact O-N 3.34Å
91	I	96.4	Very high	96.3	Very high	89 Å²	89	91.8 Å²	91.8	46%	0.456	47%	0.471	S	S	.	.	H	α-helix	trans	-59.8	-42.6	179.2	-66.4	168.9	0	0	0	111.1	C87 L88 S93 E94 I95	C87-I91 WeakPolarHBondContact O-CG1 3.33Å; C87-I91 PolarHBondContact O-N 3.34Å; C87-I91 VanDerWaalsContact O-N 3.08Å; L88-I91 PolarHBondContact O-N 3.22Å; I91-S93 VanDerWaalsContact C-N 3.32Å; I91-S93 PolarHBondContact O-N 3.21Å; I91-E94 PolarHBondContact O-N 3.39Å; I91-I95 HydrophobicContact CG2-CD1 3.83Å; I91-I95 HydrophobicContact CG2-CG1 4.41Å; I91-I95 WeakPolarHBondContact O-CG1 3.3Å; I91-I95 PolarHBondContact O-N 2.82Å
92	L	97.2	Very high	96.5	Very high	94 Å²	94	91.8 Å²	91.8	49%	0.492	47%	0.471	S	S	.	.	H	α-helix	trans	-59.6	-44.1	177	-177.9	63.1	0	0	0	111.4	L88 V90 E94 I95 M96	L88-L92 WeakPolarHBondContact O-CB 3.48Å; L88-L92 PolarHBondContact O-N 2.76Å; V90-L92 VanDerWaalsContact C-N 3.31Å; V90-L92 PolarHBondContact O-N 2.91Å; L92-E94 PolarHBondContact O-N 3.29Å; L92-I95 PolarHBondContact O-N 3.29Å; L92-M96 HydrophobicContact CG-SD 4.31Å; L92-M96 VanDerWaalsContact O-CG 3.3Å; L92-M96 WeakPolarHBondContact O-CG 3.32Å; L92-M96 PolarHBondContact O-N 3.13Å
93	S	97.7	Very high	96.8	Very high	69 Å²	69	92.8 Å²	92.8	48%	0.483	47%	0.468	S	S	.	.	H	α-helix	trans	-64.5	-38.6	178.3	-58.1	0	0	0	0	112.4	N89 V90 I91 S97	N89-S93 WeakPolarHBondContact O-CB 3.48Å; N89-S93 PolarHBondContact O-N 3.45Å; N89-S93 PolarHBondContact O-OG 3.48Å; V90-S93 WeakPolarHBondContact O-CB 3.47Å; V90-S93 PolarHBondContact O-N 3.47Å; V90-S93 VanDerWaalsContact O-N 3.13Å; I91-S93 VanDerWaalsContact C-N 3.32Å; I91-S93 PolarHBondContact O-N 3.21Å; S93-S97 WeakPolarHBondContact O-CB 3.31Å; S93-S97 PolarHBondContact O-N 3.25Å; S93-S97 PolarHBondContact O-OG 3.08Å
94	E	97.5	Very high	97	Very high	124 Å²	124	94.7 Å²	94.7	58%	0.579	48%	0.475	S	S	*	.	H	α-helix	trans	-65.5	-44.3	174.8	-72	178	-175.6	0	0	112	V90 I91 L92 S97 S98	V90-E94 PolarHBondContact O-N 3.34Å; I91-E94 PolarHBondContact O-N 3.39Å; L92-E94 PolarHBondContact O-N 3.29Å; E94-S97 PolarHBondContact O-N 3.1Å; E94-S98 WeakPolarHBondContact O-CB 3.21Å; E94-S98 PolarHBondContact O-N 3.43Å
95	I	97.1	Very high	97.2	Very high	83 Å²	83	94 Å²	94	43%	0.426	47%	0.472	S	S	.	.	H	α-helix	trans	-61.1	-46.4	176.5	-70.2	169.3	0	0	0	110.4	I91 L92 S97 S98 N99	I91-I95 HydrophobicContact CG2-CD1 3.83Å; I91-I95 HydrophobicContact CG2-CG1 4.41Å; I91-I95 WeakPolarHBondContact O-CG1 3.3Å; I91-I95 PolarHBondContact O-N 2.82Å; L92-I95 PolarHBondContact O-N 3.29Å; I95-S97 VanDerWaalsContact C-N 3.35Å; I95-S97 PolarHBondContact O-N 3.49Å; I95-S98 PolarHBondContact O-N 3.35Å; I95-N99 WeakPolarHBondContact O-CB 3.48Å; I95-N99 VanDerWaalsContact O-CG 3.27Å; I95-N99 PolarHBondContact O-N 2.95Å; I95-N99 PolarHBondContact O-ND2 3.38Å
96	M	96.9	Very high	97.3	Very high	120 Å²	120	97.1 Å²	97.1	59%	0.591	48%	0.478	S	S	*	.	H	α-helix	trans	-59.6	-45.8	177.5	-72.1	178.1	68.4	0	0	111.7	L92 N99 E100	L92-M96 HydrophobicContact CG-SD 4.31Å; L92-M96 VanDerWaalsContact O-CG 3.3Å; L92-M96 WeakPolarHBondContact O-CG 3.32Å; L92-M96 PolarHBondContact O-N 3.13Å; M96-N99 PolarHBondContact O-N 3.36Å; M96-E100 PolarHBondContact O-N 2.99Å
97	S	97.6	Very high	97.3	Very high	82 Å²	82	93.5 Å²	93.5	57%	0.573	47%	0.469	S	S	*	.	H	α-helix	trans	-64.4	-41.6	178.6	-58.6	0	0	0	0	112.3	S93 E94 I95 E100 R101	S93-S97 WeakPolarHBondContact O-CB 3.31Å; S93-S97 PolarHBondContact O-N 3.25Å; S93-S97 PolarHBondContact O-OG 3.08Å; E94-S97 PolarHBondContact O-N 3.1Å; I95-S97 VanDerWaalsContact C-N 3.35Å; I95-S97 PolarHBondContact O-N 3.49Å; S97-E100 PolarHBondContact O-N 3.06Å; S97-R101 PolarHBondContact O-N 2.89Å
98	S	98	Very high	97.3	Very high	45 Å²	45	95.8 Å²	95.8	32%	0.315	48%	0.477	S	S	.	.	H	α-helix	trans	-65	-43.5	177.1	-171.5	0	0	0	0	111.9	E94 I95 E100 R101 I102	E94-S98 WeakPolarHBondContact O-CB 3.21Å; E94-S98 PolarHBondContact O-N 3.43Å; I95-S98 PolarHBondContact O-N 3.35Å; S98-E100 VanDerWaalsContact C-N 3.35Å; S98-E100 PolarHBondContact O-N 2.58Å; S98-R101 PolarHBondContact O-N 3.27Å; S98-I102 WeakPolarHBondContact O-CG1 3.49Å; S98-I102 PolarHBondContact O-N 3.47Å
99	N	97.7	Very high	97.2	Very high	97 Å²	97	96.4 Å²	96.4	52%	0.519	48%	0.476	S	S	.	.	H	α-helix	trans	-62.1	-42	177	-76.4	-20.3	0	0	0	111.9	I95 M96 I102 R103	I95-N99 WeakPolarHBondContact O-CB 3.48Å; I95-N99 VanDerWaalsContact O-CG 3.27Å; I95-N99 PolarHBondContact O-N 2.95Å; I95-N99 PolarHBondContact O-ND2 3.38Å; M96-N99 PolarHBondContact O-N 3.36Å; N99-I102 PolarHBondContact O-N 2.8Å; N99-R103 WeakPolarHBondContact O-CB 3.29Å; N99-R103 PolarHBondContact O-N 2.94Å
100	E	97.6	Very high	97.2	Very high	86 Å²	86	96 Å²	96	40%	0.402	47%	0.473	S	S	.	.	H	α-helix	trans	-65.8	-39.5	177.8	-176.7	54.1	-154.6	0	0	111.8	M96 S97 S98 R103 K104	M96-E100 PolarHBondContact O-N 2.99Å; S97-E100 PolarHBondContact O-N 3.06Å; S98-E100 VanDerWaalsContact C-N 3.35Å; S98-E100 PolarHBondContact O-N 2.58Å; E100-R103 PolarHBondContact O-N 3.31Å; E100-K104 WeakPolarHBondContact O-CG 3.12Å; E100-K104 PolarHBondContact O-N 3.34Å; E100-K104 VanDerWaalsContact OE1-CE 3.24Å; E100-K104 WeakPolarHBondContact OE1-CE 3.35Å
101	R	98.1	Very high	97.2	Very high	142 Å²	142	97.6 Å²	97.6	54%	0.536	48%	0.479	S	S	.	.	H	α-helix	trans	-60.6	-50	173.2	-179.7	-175.5	59.4	144.8	-1.3	111.8	S97 S98 R103 K104 E105	S97-R101 PolarHBondContact O-N 2.89Å; S98-R101 PolarHBondContact O-N 3.27Å; R101-R103 VanDerWaalsContact C-N 3.26Å; R101-R103 PolarHBondContact O-N 2.89Å; R101-K104 PolarHBondContact O-N 3.46Å; R101-K104 VanDerWaalsContact O-N 3.14Å; R101-E105 HydrophobicContact CG-CG 4.49Å; R101-E105 WeakPolarHBondContact CG-OE1 3.29Å; R101-E105 WeakPolarHBondContact O-CG 3.3Å; R101-E105 PolarHBondContact O-N 2.91Å
102	I	96.5	Very high	97.3	Very high	81 Å²	81	97.8 Å²	97.8	42%	0.415	48%	0.478	S	S	.	.	H	α-helix	trans	-61.2	-38.1	178.8	-68.1	166.7	0	0	0	110.8	S98 N99 R106	S98-I102 WeakPolarHBondContact O-CG1 3.49Å; S98-I102 PolarHBondContact O-N 3.47Å; N99-I102 PolarHBondContact O-N 2.8Å; I102-R106 WeakPolarHBondContact O-CB 3.16Å; I102-R106 PolarHBondContact O-N 3.17Å
103	R	97.1	Very high	97.3	Very high	111 Å²	111	99.2 Å²	99.2	42%	0.419	48%	0.477	S	S	.	.	H	α-helix	trans	-60.3	-46	175.3	178.1	-175.5	151.7	90.7	3.9	111.2	N99 E100 R101 R106 I107	N99-R103 WeakPolarHBondContact O-CB 3.29Å; N99-R103 PolarHBondContact O-N 2.94Å; E100-R103 PolarHBondContact O-N 3.31Å; R101-R103 VanDerWaalsContact C-N 3.26Å; R101-R103 PolarHBondContact O-N 2.89Å; R103-R106 PolarHBondContact O-N 2.85Å; R103-I107 HydrophobicContact CG-CD1 4.05Å; R103-I107 VanDerWaalsContact O-CG1 3.31Å; R103-I107 WeakPolarHBondContact O-CG1 3.32Å; R103-I107 PolarHBondContact O-N 3.4Å
104	K	97.5	Very high	97.3	Very high	119 Å²	119	101.3 Å²	101.3	52%	0.517	48%	0.478	S	S	.	.	H	α-helix	trans	-63.1	-50.3	176.5	-72.3	178	-179.1	176.4	0	112	E100 R101 R106 I107 D108	E100-K104 WeakPolarHBondContact O-CG 3.12Å; E100-K104 PolarHBondContact O-N 3.34Å; E100-K104 VanDerWaalsContact OE1-CE 3.24Å; E100-K104 WeakPolarHBondContact OE1-CE 3.35Å; R101-K104 PolarHBondContact O-N 3.46Å; R101-K104 VanDerWaalsContact O-N 3.14Å; K104-R106 PolarHBondContact O-N 3.4Å; K104-I107 PolarHBondContact O-N 3.31Å; K104-D108 PolarHBondContact O-N 3.43Å
105	E	97.5	Very high	97.3	Very high	103 Å²	103	100.3 Å²	100.3	48%	0.481	47%	0.473	S	S	.	.	H	α-helix	trans	-55	-41.1	177.2	-71.2	171.4	-174.7	0	0	111.8	R101 F109	R101-E105 HydrophobicContact CG-CG 4.49Å; R101-E105 WeakPolarHBondContact CG-OE1 3.29Å; R101-E105 WeakPolarHBondContact O-CG 3.3Å; R101-E105 PolarHBondContact O-N 2.91Å; E105-F109 VanDerWaalsContact O-CB 3.29Å; E105-F109 WeakPolarHBondContact O-CB 3.36Å; E105-F109 PolarHBondContact O-N 3.47Å
106	R	97.7	Very high	97.3	Very high	148 Å²	148	100.2 Å²	100.2	56%	0.558	47%	0.47	S	S	*	.	H	α-helix	trans	-66.4	-41.2	175.9	-176	177.8	66	-165.3	0.2	112.6	I102 R103 K104 I110	I102-R106 WeakPolarHBondContact O-CB 3.16Å; I102-R106 PolarHBondContact O-N 3.17Å; R103-R106 PolarHBondContact O-N 2.85Å; K104-R106 PolarHBondContact O-N 3.4Å; R106-I110 HydrophobicContact CG-CD1 3.96Å; R106-I110 WeakPolarHBondContact O-CB 3.32Å; R106-I110 WeakPolarHBondContact O-CD1 3.12Å; R106-I110 VanDerWaalsContact O-CG1 3.22Å; R106-I110 WeakPolarHBondContact O-CG1 3.26Å; R106-I110 PolarHBondContact O-N 3.42Å
107	I	96.4	Very high	97.3	Very high	65 Å²	65	99.5 Å²	99.5	33%	0.333	47%	0.468	S	S	.	.	H	α-helix	trans	-64.2	-47.8	177.3	-71.3	165.9	0	0	0	109.9	R103 K104 F109 I110 L111	R103-I107 HydrophobicContact CG-CD1 4.05Å; R103-I107 VanDerWaalsContact O-CG1 3.31Å; R103-I107 WeakPolarHBondContact O-CG1 3.32Å; R103-I107 PolarHBondContact O-N 3.4Å; K104-I107 PolarHBondContact O-N 3.31Å; I107-F109 VanDerWaalsContact C-N 3.33Å; I107-F109 PolarHBondContact O-N 2.85Å; I107-I110 PolarHBondContact O-N 3.04Å; I107-L111 HydrophobicContact CG2-CD1 3.92Å; I107-L111 HydrophobicContact CG2-CG 4.34Å; I107-L111 WeakPolarHBondContact O-CG 3.26Å; I107-L111 PolarHBondContact O-N 3.19Å
108	D	96.9	Very high	97.3	Very high	101 Å²	101	99.9 Å²	99.9	54%	0.54	46%	0.463	S	S	.	.	H	α-helix	trans	-59.8	-44.5	179.3	-65.9	-20.2	0	0	0	111	K104 I110 L111 E112	K104-D108 PolarHBondContact O-N 3.43Å; D108-I110 PolarHBondContact O-N 2.99Å; D108-L111 PolarHBondContact O-N 2.85Å; D108-E112 PolarHBondContact O-N 2.88Å
109	F	96	Very high	97.1	Very high	114 Å²	114	100 Å²	100	50%	0.5	46%	0.46	S	S	.	.	H	α-helix	trans	-61.3	-43.7	175.3	-173.8	-94.2	0	0	0	112.5	E105 I107 L111 E112 Y113	E105-F109 VanDerWaalsContact O-CB 3.29Å; E105-F109 WeakPolarHBondContact O-CB 3.36Å; E105-F109 PolarHBondContact O-N 3.47Å; I107-F109 VanDerWaalsContact C-N 3.33Å; I107-F109 PolarHBondContact O-N 2.85Å; F109-L111 VanDerWaalsContact C-N 3.34Å; F109-L111 PolarHBondContact O-N 3.45Å; F109-E112 PolarHBondContact O-N 3.35Å; F109-Y113 HydrophobicContact CD1-CD2 4.12Å; F109-Y113 HydrophobicContact CD1-CE2 4.34Å; F109-Y113 HydrophobicContact CD2-CD2 4.34Å; F109-Y113 HydrophobicContact CD2-CE2 4.06Å; F109-Y113 AromaticContact CE1-CD2 3.78Å; F109-Y113 HydrophobicContact CE1-CD2 3.78Å; F109-Y113 AromaticContact CE1-CE2 3.69Å; F109-Y113 HydrophobicContact CE1-CE2 3.69Å; F109-Y113 HydrophobicContact CE2-CD2 4.04Å; F109-Y113 AromaticContact CE2-CE2 3.38Å; F109-Y113 HydrophobicContact CE2-CE2 3.38Å; F109-Y113 HydrophobicContact CG-CD2 4.39Å; F109-Y113 AromaticContact CZ-CD2 3.75Å; F109-Y113 HydrophobicContact CZ-CD2 3.75Å; F109-Y113 AromaticContact CZ-CE2 3.16Å; F109-Y113 HydrophobicContact CZ-CE2 3.16Å; F109-Y113 AromaticContact CZ-CZ 3.74Å; F109-Y113 WeakPolarHBondContact O-CD2 3.22Å; F109-Y113 PolarHBondContact O-N 3.4Å; F109-Y113 VanDerWaalsContact O-N 3.12Å
110	I	97	Very high	97	Very high	78 Å²	78	102.5 Å²	102.5	40%	0.4	46%	0.463	S	S	.	.	H	α-helix	trans	-63.4	-41.8	176.6	-71.7	166.2	0	0	0	110.8	R106 I107 D108 Y113 K114	R106-I110 HydrophobicContact CG-CD1 3.96Å; R106-I110 WeakPolarHBondContact O-CB 3.32Å; R106-I110 WeakPolarHBondContact O-CD1 3.12Å; R106-I110 VanDerWaalsContact O-CG1 3.22Å; R106-I110 WeakPolarHBondContact O-CG1 3.26Å; R106-I110 PolarHBondContact O-N 3.42Å; I107-I110 PolarHBondContact O-N 3.04Å; D108-I110 PolarHBondContact O-N 2.99Å; I110-Y113 PolarHBondContact O-N 2.82Å; I110-K114 HydrophobicContact CG2-CD 4.1Å; I110-K114 HydrophobicContact CG2-CG 4.37Å; I110-K114 WeakPolarHBondContact O-CB 3.43Å; I110-K114 WeakPolarHBondContact O-CG 3.36Å; I110-K114 PolarHBondContact O-N 3.48Å
111	L	97	Very high	97	Very high	99 Å²	99	102.3 Å²	102.3	52%	0.518	47%	0.465	S	S	.	.	H	α-helix	trans	-64.4	-42.6	178.3	-71.8	174	0	0	0	111.6	I107 D108 F109 Y113 K114 Q115	I107-L111 HydrophobicContact CG2-CD1 3.92Å; I107-L111 HydrophobicContact CG2-CG 4.34Å; I107-L111 WeakPolarHBondContact O-CG 3.26Å; I107-L111 PolarHBondContact O-N 3.19Å; D108-L111 PolarHBondContact O-N 2.85Å; F109-L111 VanDerWaalsContact C-N 3.34Å; F109-L111 PolarHBondContact O-N 3.45Å; L111-Y113 VanDerWaalsContact C-N 3.34Å; L111-Y113 PolarHBondContact O-N 3.32Å; L111-K114 PolarHBondContact O-N 3.42Å; L111-Q115 WeakPolarHBondContact O-CB 3.37Å; L111-Q115 PolarHBondContact O-N 2.9Å
112	E	97.9	Very high	96.9	Very high	93 Å²	93	100.5 Å²	100.5	44%	0.435	46%	0.458	S	S	.	.	H	α-helix	trans	-57.8	-46	175	-171.5	-167.6	154.8	0	0	111.6	D108 F109 Q115 K116	D108-E112 PolarHBondContact O-N 2.88Å; F109-E112 PolarHBondContact O-N 3.35Å; E112-Q115 PolarHBondContact O-N 3.37Å; E112-K116 WeakPolarHBondContact O-CG 3.44Å; E112-K116 PolarHBondContact O-N 2.78Å; E112-K116 VanDerWaalsContact OE1-CE 3.28Å; E112-K116 WeakPolarHBondContact OE1-CE 3.42Å; E112-K116 IonicContact OE1-NZ 2.84Å; E112-K116 PolarHBondContact OE1-NZ 3Å
113	Y	97.4	Very high	96.9	Very high	123 Å²	123	97.8 Å²	97.8	48%	0.482	44%	0.444	S	S	.	.	H	α-helix	trans	-72.6	-33.7	-179.6	-88.6	-98.2	0	0	0	113.5	F109 I110 L111 K116 L117	F109-Y113 HydrophobicContact CD1-CD2 4.12Å; F109-Y113 HydrophobicContact CD1-CE2 4.34Å; F109-Y113 HydrophobicContact CD2-CD2 4.34Å; F109-Y113 HydrophobicContact CD2-CE2 4.06Å; F109-Y113 AromaticContact CE1-CD2 3.78Å; F109-Y113 HydrophobicContact CE1-CD2 3.78Å; F109-Y113 AromaticContact CE1-CE2 3.69Å; F109-Y113 HydrophobicContact CE1-CE2 3.69Å; F109-Y113 HydrophobicContact CE2-CD2 4.04Å; F109-Y113 AromaticContact CE2-CE2 3.38Å; F109-Y113 HydrophobicContact CE2-CE2 3.38Å; F109-Y113 HydrophobicContact CG-CD2 4.39Å; F109-Y113 AromaticContact CZ-CD2 3.75Å; F109-Y113 HydrophobicContact CZ-CD2 3.75Å; F109-Y113 AromaticContact CZ-CE2 3.16Å; F109-Y113 HydrophobicContact CZ-CE2 3.16Å; F109-Y113 AromaticContact CZ-CZ 3.74Å; F109-Y113 WeakPolarHBondContact O-CD2 3.22Å; F109-Y113 PolarHBondContact O-N 3.4Å; F109-Y113 VanDerWaalsContact O-N 3.12Å; I110-Y113 PolarHBondContact O-N 2.82Å; L111-Y113 VanDerWaalsContact C-N 3.34Å; L111-Y113 PolarHBondContact O-N 3.32Å; Y113-K116 PolarHBondContact O-N 3.38Å; Y113-L117 WeakPolarHBondContact O-CB 3.26Å; Y113-L117 PolarHBondContact O-N 3.5Å
114	K	97.6	Very high	96.9	Very high	114 Å²	114	96.9 Å²	96.9	50%	0.496	45%	0.446	S	S	.	.	H	α-helix	trans	-61.1	-46.9	170.5	-78.3	-179.6	175.5	-174.4	0	110.8	I110 L111 K116 L117 D118	I110-K114 HydrophobicContact CG2-CD 4.1Å; I110-K114 HydrophobicContact CG2-CG 4.37Å; I110-K114 WeakPolarHBondContact O-CB 3.43Å; I110-K114 WeakPolarHBondContact O-CG 3.36Å; I110-K114 PolarHBondContact O-N 3.48Å; L111-K114 PolarHBondContact O-N 3.42Å; K114-K116 PolarHBondContact O-N 3.36Å; K114-L117 WeakPolarHBondContact O-CB 3.48Å; K114-L117 PolarHBondContact O-N 2.78Å; K114-L117 VanDerWaalsContact O-N 3.14Å; K114-D118 PolarHBondContact O-N 3.24Å
115	Q	97.6	Very high	96.8	Very high	102 Å²	102	93.2 Å²	93.2	48%	0.477	44%	0.438	S	S	.	.	H	α-helix	trans	-59.4	-45.6	177.1	-175.8	59	51.3	0	0	111.9	L111 E112 L117 D118 D119	L111-Q115 WeakPolarHBondContact O-CB 3.37Å; L111-Q115 PolarHBondContact O-N 2.9Å; E112-Q115 PolarHBondContact O-N 3.37Å; Q115-L117 VanDerWaalsContact C-N 3.33Å; Q115-L117 PolarHBondContact O-N 3.2Å; Q115-D118 PolarHBondContact O-N 3.26Å; Q115-D119 PolarHBondContact NE2-OD1 2.9Å; Q115-D119 VanDerWaalsContact O-CG 3.32Å; Q115-D119 PolarHBondContact O-N 3.47Å
116	K	96.5	Very high	96.8	Very high	81 Å²	81	89.1 Å²	89.1	35%	0.352	42%	0.419	S	S	.	.	H	α-helix	trans	-60.9	-40.5	175.2	-73.8	177.6	-173.9	167.5	0	112.5	E112 Y113 K114 D118 D119 Y120	E112-K116 WeakPolarHBondContact O-CG 3.44Å; E112-K116 PolarHBondContact O-N 2.78Å; E112-K116 VanDerWaalsContact OE1-CE 3.28Å; E112-K116 WeakPolarHBondContact OE1-CE 3.42Å; E112-K116 IonicContact OE1-NZ 2.84Å; E112-K116 PolarHBondContact OE1-NZ 3Å; Y113-K116 PolarHBondContact O-N 3.38Å; K114-K116 PolarHBondContact O-N 3.36Å; K116-D118 VanDerWaalsContact C-N 3.34Å; K116-D119 PolarHBondContact O-N 2.9Å; K116-Y120 WeakPolarHBondContact O-CD2 3.33Å; K116-Y120 PolarHBondContact O-N 2.85Å
117	L	97.6	Very high	96.8	Very high	106 Å²	106	84.1 Å²	84.1	56%	0.555	40%	0.403	S	S	*	.	H	α-helix	trans	-62.7	-43.7	176.6	-167.6	87.9	0	0	0	110.9	Y113 K114 Q115 Y120 N121	Y113-L117 WeakPolarHBondContact O-CB 3.26Å; Y113-L117 PolarHBondContact O-N 3.5Å; K114-L117 WeakPolarHBondContact O-CB 3.48Å; K114-L117 PolarHBondContact O-N 2.78Å; K114-L117 VanDerWaalsContact O-N 3.14Å; Q115-L117 VanDerWaalsContact C-N 3.33Å; Q115-L117 PolarHBondContact O-N 3.2Å; L117-Y120 PolarHBondContact O-N 3.07Å; L117-N121 WeakPolarHBondContact O-CB 3.39Å; L117-N121 VanDerWaalsContact O-CG 3.28Å; L117-N121 PolarHBondContact O-N 3.41Å; L117-N121 PolarHBondContact O-ND2 2.56Å
118	D	97.3	Very high	96.8	Very high	90 Å²	90	87.2 Å²	87.2	48%	0.481	42%	0.417	S	S	.	.	H	α-helix	trans	-64.3	-39.9	177.8	-68.5	-23	0	0	0	111.7	K114 Q115 K116 N121 R122	K114-D118 PolarHBondContact O-N 3.24Å; Q115-D118 PolarHBondContact O-N 3.26Å; K116-D118 VanDerWaalsContact C-N 3.34Å; D118-N121 PolarHBondContact O-N 3.03Å; D118-R122 WeakPolarHBondContact O-CB 3.32Å; D118-R122 PolarHBondContact O-N 3.26Å
119	D	95.1	Very high	96.8	Very high	46 Å²	46	88.4 Å²	88.4	25%	0.246	42%	0.417	C	S	.	.	H	α-helix	trans	-62.2	-44.4	173.2	-69.6	-32.4	0	0	0	111.8	Q115 K116 R122 H123	Q115-D119 PolarHBondContact NE2-OD1 2.9Å; Q115-D119 VanDerWaalsContact O-CG 3.32Å; Q115-D119 PolarHBondContact O-N 3.47Å; K116-D119 PolarHBondContact O-N 2.9Å; D119-R122 WeakPolarHBondContact O-CB 3.5Å; D119-R122 PolarHBondContact O-N 2.76Å; D119-R122 IonicContact OD1-CZ 3.97Å; D119-R122 VanDerWaalsContact OD1-CZ 3.24Å; D119-R122 IonicContact OD1-NH1 3.89Å; D119-R122 PolarHBondContact OD1-NH1 2.75Å; D119-R122 IonicContact OD1-NH2 3.24Å; D119-R122 PolarHBondContact OD1-NH2 3.23Å; D119-H123 PolarHBondContact O-CD2 3.16Å; D119-H123 PolarHBondContact O-N 2.94Å
120	Y	95.7	Very high	96.9	Very high	150 Å²	150	83.5 Å²	83.5	59%	0.588	40%	0.396	S	S	*	.	H	α-helix	trans	-65	-41.2	175.4	-73.1	-52.8	0	0	0	112.6	K116 L117 R122 H123 I124	K116-Y120 WeakPolarHBondContact O-CD2 3.33Å; K116-Y120 PolarHBondContact O-N 2.85Å; L117-Y120 PolarHBondContact O-N 3.07Å; Y120-R122 VanDerWaalsContact C-N 3.29Å; Y120-R122 PolarHBondContact O-N 3.47Å; Y120-H123 PolarHBondContact O-N 3.45Å; Y120-I124 VanDerWaalsContact O-CG1 3.27Å; Y120-I124 WeakPolarHBondContact O-CG1 3.43Å; Y120-I124 PolarHBondContact O-N 3.43Å
121	N	96.9	Very high	96.9	Very high	82 Å²	82	85.4 Å²	85.4	44%	0.439	40%	0.403	S	S	.	.	H	α-helix	trans	-60.5	-40.7	175.2	-74.2	-31.6	0	0	0	111.2	L117 D118 I124 A125	L117-N121 WeakPolarHBondContact O-CB 3.39Å; L117-N121 VanDerWaalsContact O-CG 3.28Å; L117-N121 PolarHBondContact O-N 3.41Å; L117-N121 PolarHBondContact O-ND2 2.56Å; D118-N121 PolarHBondContact O-N 3.03Å; N121-I124 PolarHBondContact O-N 3.29Å; N121-A125 PolarHBondContact O-N 2.99Å
122	R	96.3	Very high	96.9	Very high	104 Å²	104	83.5 Å²	83.5	39%	0.392	40%	0.402	S	S	.	.	H	α-helix	trans	-61.2	-47.5	173.7	-175.8	173.7	71	-113.2	-8	111.5	D118 D119 Y120 I124 A125 Q126 E160	D118-R122 WeakPolarHBondContact O-CB 3.32Å; D118-R122 PolarHBondContact O-N 3.26Å; D119-R122 WeakPolarHBondContact O-CB 3.5Å; D119-R122 PolarHBondContact O-N 2.76Å; D119-R122 IonicContact OD1-CZ 3.97Å; D119-R122 VanDerWaalsContact OD1-CZ 3.24Å; D119-R122 IonicContact OD1-NH1 3.89Å; D119-R122 PolarHBondContact OD1-NH1 2.75Å; D119-R122 IonicContact OD1-NH2 3.24Å; D119-R122 PolarHBondContact OD1-NH2 3.23Å; Y120-R122 VanDerWaalsContact C-N 3.29Å; Y120-R122 PolarHBondContact O-N 3.47Å; R122-I124 VanDerWaalsContact C-N 3.34Å; R122-I124 PolarHBondContact O-N 3.43Å; R122-A125 PolarHBondContact O-N 3.37Å; R122-Q126 WeakPolarHBondContact O-CB 3.47Å; R122-Q126 WeakPolarHBondContact O-CG 3.16Å; R122-Q126 PolarHBondContact O-N 3.07Å; R122-E160 VanDerWaalsContact CD-OE1 3.26Å; R122-E160 WeakPolarHBondContact CD-OE1 3.29Å; R122-E160 IonicContact CZ-OE1 2.73Å; R122-E160 IonicContact NE-OE1 2.68Å; R122-E160 PolarHBondContact NE-OE1 2.91Å
123	H	95.9	Very high	96.9	Very high	25 Å²	25	80.5 Å²	80.5	12%	0.116	39%	0.387	C	S	.	.	H	α-helix	trans	-63.6	-36.7	177.1	-68.7	-178	0	0	0	112.6	D119 Y120 Q126 N127 I161 S164	D119-H123 PolarHBondContact O-CD2 3.16Å; D119-H123 PolarHBondContact O-N 2.94Å; Y120-H123 PolarHBondContact O-N 3.45Å; H123-Q126 PolarHBondContact O-N 3.18Å; H123-N127 WeakPolarHBondContact O-CB 3.4Å; H123-N127 PolarHBondContact O-N 3.32Å; H123-N127 PolarHBondContact O-ND2 2.79Å; H123-I161 HydrophobicContact CB-CG2 4.23Å; H123-S164 PolarHBondContact ND1-OG 3.2Å; H123-S164 VanDerWaalsContact ND1-OG 3.13Å
124	I	96.1	Very high	96.8	Very high	91 Å²	91	77.2 Å²	77.2	47%	0.467	38%	0.378	S	S	.	.	H	α-helix	trans	-62.3	-50.5	175.2	-71.3	165.1	0	0	0	110	Y120 N121 R122 Q126 N127 E128	Y120-I124 VanDerWaalsContact O-CG1 3.27Å; Y120-I124 WeakPolarHBondContact O-CG1 3.43Å; Y120-I124 PolarHBondContact O-N 3.43Å; N121-I124 PolarHBondContact O-N 3.29Å; R122-I124 VanDerWaalsContact C-N 3.34Å; R122-I124 PolarHBondContact O-N 3.43Å; I124-Q126 VanDerWaalsContact C-N 3.25Å; I124-Q126 PolarHBondContact O-N 2.92Å; I124-N127 WeakPolarHBondContact O-CB 3.49Å; I124-N127 PolarHBondContact O-N 3.41Å; I124-N127 VanDerWaalsContact O-N 3.13Å; I124-E128 WeakPolarHBondContact O-CG 3.49Å; I124-E128 PolarHBondContact O-N 2.83Å
125	A	97.2	Very high	96.8	Very high	42 Å²	42	75.4 Å²	75.4	35%	0.347	37%	0.371	S	S	.	.	H	α-helix	trans	-60.8	-34.8	178.4	0	0	0	0	0	112.6	N121 R122 E128 K129	N121-A125 PolarHBondContact O-N 2.99Å; R122-A125 PolarHBondContact O-N 3.37Å; A125-E128 PolarHBondContact O-N 3.32Å; A125-K129 WeakPolarHBondContact O-CG 3.36Å; A125-K129 PolarHBondContact O-N 3.48Å
126	Q	97.3	Very high	96.7	Very high	18 Å²	18	75.3 Å²	75.3	8%	0.084	37%	0.373	C	S	.	.	H	α-helix	trans	-69.3	-41.8	174.3	-82.3	161.2	2.5	0	0	113	R122 H123 I124 E128 K129 L130 I157 E160 I161	R122-Q126 WeakPolarHBondContact O-CB 3.47Å; R122-Q126 WeakPolarHBondContact O-CG 3.16Å; R122-Q126 PolarHBondContact O-N 3.07Å; H123-Q126 PolarHBondContact O-N 3.18Å; I124-Q126 VanDerWaalsContact C-N 3.25Å; I124-Q126 PolarHBondContact O-N 2.92Å; Q126-E128 VanDerWaalsContact C-N 3.29Å; Q126-E128 PolarHBondContact O-N 2.85Å; Q126-K129 PolarHBondContact O-N 2.85Å; Q126-L130 PolarHBondContact O-N 3.34Å; Q126-I157 HydrophobicContact CB-CG2 3.99Å; Q126-I157 HydrophobicContact CG-CG1 4.48Å; Q126-I157 HydrophobicContact CG-CG2 4.36Å; Q126-I157 WeakPolarHBondContact O-CG2 3.37Å; Q126-E160 PolarHBondContact NE2-OE1 3.35Å; Q126-E160 PolarHBondContact NE2-OE2 3.37Å; Q126-E160 VanDerWaalsContact OE1-CD 3.23Å; Q126-E160 PolarHBondContact OE1-OE1 2.87Å; Q126-I161 HydrophobicContact CB-CG2 3.56Å; Q126-I161 HydrophobicContact CG-CG2 4.38Å
127	N	96.2	Very high	96.7	Very high	42 Å²	42	73 Å²	73	23%	0.225	36%	0.362	C	S	.	.	H	α-helix	trans	-60.1	-40.1	172.5	-82.4	-57.6	0	0	0	111.7	H123 I124 L130 H131 I161 Y165	H123-N127 WeakPolarHBondContact O-CB 3.4Å; H123-N127 PolarHBondContact O-N 3.32Å; H123-N127 PolarHBondContact O-ND2 2.79Å; I124-N127 WeakPolarHBondContact O-CB 3.49Å; I124-N127 PolarHBondContact O-N 3.41Å; I124-N127 VanDerWaalsContact O-N 3.13Å; N127-L130 PolarHBondContact O-N 3.09Å; N127-H131 WeakPolarHBondContact O-CB 3.44Å; N127-H131 PolarHBondContact O-N 3.49Å; N127-I161 WeakPolarHBondContact OD1-CD1 3.5Å; N127-Y165 VanDerWaalsContact CG-OH 3.29Å; N127-Y165 PolarHBondContact ND2-OH 3.02Å; N127-Y165 PolarHBondContact OD1-OH 3.47Å
128	E	97.6	Very high	96.5	Very high	131 Å²	131	73.3 Å²	73.3	61%	0.612	36%	0.359	S	S	*	.	H	α-helix	trans	-61.7	-44.1	175.5	-71.4	176.7	171.1	0	0	112.1	I124 A125 Q126 H131 A132	I124-E128 WeakPolarHBondContact O-CG 3.49Å; I124-E128 PolarHBondContact O-N 2.83Å; A125-E128 PolarHBondContact O-N 3.32Å; Q126-E128 VanDerWaalsContact C-N 3.29Å; Q126-E128 PolarHBondContact O-N 2.85Å; E128-H131 PolarHBondContact O-N 3.39Å; E128-A132 WeakPolarHBondContact O-CB 3.3Å; E128-A132 PolarHBondContact O-N 2.68Å
129	K	97.1	Very high	96.4	Very high	126 Å²	126	72.4 Å²	72.4	55%	0.548	36%	0.356	S	S	.	.	H	α-helix	trans	-61.4	-44.4	174.6	-70.7	173.5	-176.3	176.6	0	111.9	A125 Q126 A132 F133 I157	A125-K129 WeakPolarHBondContact O-CG 3.36Å; A125-K129 PolarHBondContact O-N 3.48Å; Q126-K129 PolarHBondContact O-N 2.85Å; K129-A132 PolarHBondContact O-N 2.65Å; K129-F133 PolarHBondContact O-N 3.29Å; K129-I157 HydrophobicContact CB-CD1 3.95Å; K129-I157 HydrophobicContact CD-CD1 3.9Å
130	L	96.9	Very high	96.4	Very high	11 Å²	11	74 Å²	74	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-64.1	-42.7	178.1	-178.7	62.5	0	0	0	111.3	Q126 N127 F133 I134 I154 I157 I161 I169 L173	Q126-L130 PolarHBondContact O-N 3.34Å; N127-L130 PolarHBondContact O-N 3.09Å; L130-F133 WeakPolarHBondContact O-CB 3.45Å; L130-F133 PolarHBondContact O-N 3.3Å; L130-I134 HydrophobicContact CD1-CD1 4.38Å; L130-I134 HydrophobicContact CG-CD1 4.1Å; L130-I134 WeakPolarHBondContact O-CG1 3.43Å; L130-I134 PolarHBondContact O-N 2.91Å; L130-I154 HydrophobicContact CD1-CG2 3.79Å; L130-I157 HydrophobicContact CB-CG2 4.15Å; L130-I161 HydrophobicContact CD2-CD1 3.9Å; L130-I169 HydrophobicContact CD2-CD1 4.45Å; L130-I169 HydrophobicContact CD2-CG2 3.7Å; L130-L173 HydrophobicContact CD1-CD1 4.2Å
131	H	97	Very high	96.1	Very high	117 Å²	117	69.2 Å²	69.2	54%	0.542	35%	0.349	S	S	.	.	H	α-helix	trans	-61.7	-46.3	175.8	-173.6	-79.1	0	0	0	111.5	N127 E128 F133 I134 E135	N127-H131 WeakPolarHBondContact O-CB 3.44Å; N127-H131 PolarHBondContact O-N 3.49Å; E128-H131 PolarHBondContact O-N 3.39Å; H131-F133 VanDerWaalsContact C-N 3.29Å; H131-F133 PolarHBondContact O-N 3.33Å; H131-I134 PolarHBondContact O-N 3.35Å; H131-E135 WeakPolarHBondContact O-CG 3.37Å; H131-E135 PolarHBondContact O-N 2.88Å
132	A	97.8	Very high	95.9	Very high	60 Å²	60	70.8 Å²	70.8	50%	0.496	36%	0.362	S	S	.	.	H	α-helix	trans	-59.3	-39.6	176.2	0	0	0	0	0	112.3	E128 K129 L136	E128-A132 WeakPolarHBondContact O-CB 3.3Å; E128-A132 PolarHBondContact O-N 2.68Å; K129-A132 PolarHBondContact O-N 2.65Å; A132-L136 WeakPolarHBondContact O-CB 3.4Å; A132-L136 PolarHBondContact O-N 2.85Å
133	F	97.5	Very high	95.7	Very high	30 Å²	30	70 Å²	70	13%	0.132	36%	0.363	C	S	.	.	H	α-helix	trans	-63.6	-45.7	173.7	169.8	-100.7	0	0	0	112.5	K129 L130 H131 E135 L136 W137 L147 P151 I154	K129-F133 PolarHBondContact O-N 3.29Å; L130-F133 WeakPolarHBondContact O-CB 3.45Å; L130-F133 PolarHBondContact O-N 3.3Å; H131-F133 VanDerWaalsContact C-N 3.29Å; H131-F133 PolarHBondContact O-N 3.33Å; F133-E135 PolarHBondContact O-N 2.85Å; F133-L136 PolarHBondContact O-N 3.49Å; F133-W137 AromaticContact CE1-CE3 3.97Å; F133-W137 HydrophobicContact CE1-CE3 3.97Å; F133-W137 HydrophobicContact CZ-CE3 4.36Å; F133-W137 WeakPolarHBondContact O-CB 3.47Å; F133-W137 PolarHBondContact O-N 3.1Å; F133-L147 HydrophobicContact CZ-CD2 3.81Å; F133-P151 HydrophobicContact CE2-CG 4.02Å; F133-P151 HydrophobicContact CZ-CG 4.47Å; F133-I154 HydrophobicContact CB-CD1 3.58Å; F133-I154 HydrophobicContact CB-CG1 4.29Å; F133-I154 HydrophobicContact CD1-CD1 4.19Å; F133-I154 HydrophobicContact CD1-CG1 4.09Å; F133-I154 HydrophobicContact CD1-CG2 3.75Å; F133-I154 HydrophobicContact CD2-CD1 3.94Å; F133-I154 HydrophobicContact CD2-CG1 3.75Å; F133-I154 HydrophobicContact CE1-CG1 4.38Å; F133-I154 HydrophobicContact CE1-CG2 3.86Å; F133-I154 HydrophobicContact CE2-CG1 4.06Å; F133-I154 HydrophobicContact CG-CD1 3.62Å; F133-I154 HydrophobicContact CG-CG1 3.76Å; F133-I154 HydrophobicContact CG-CG2 4.27Å; F133-I154 HydrophobicContact CZ-CG1 4.36Å; F133-I154 HydrophobicContact CZ-CG2 4.46Å
134	I	96	Very high	95.4	Very high	54 Å²	54	76.2 Å²	76.2	28%	0.277	40%	0.397	S	S	.	.	H	α-helix	trans	-62.1	-43.7	178.9	-70.1	167.4	0	0	0	110.8	L130 H131 W137 K138	L130-I134 HydrophobicContact CD1-CD1 4.38Å; L130-I134 HydrophobicContact CG-CD1 4.1Å; L130-I134 WeakPolarHBondContact O-CG1 3.43Å; L130-I134 PolarHBondContact O-N 2.91Å; H131-I134 PolarHBondContact O-N 3.35Å; I134-W137 PolarHBondContact O-N 3.04Å; I134-K138 HydrophobicContact CG2-CD 4.42Å; I134-K138 WeakPolarHBondContact O-CG 3.38Å; I134-K138 PolarHBondContact O-N 3.34Å
135	E	97.2	Very high	95.1	Very high	75 Å²	75	77.7 Å²	77.7	35%	0.35	40%	0.4	S	S	.	.	H	α-helix	trans	-64.9	-42.1	177	-69.9	-54.2	120.4	0	0	112	H131 F133 W137 K138 V139	H131-E135 WeakPolarHBondContact O-CG 3.37Å; H131-E135 PolarHBondContact O-N 2.88Å; F133-E135 PolarHBondContact O-N 2.85Å; E135-W137 VanDerWaalsContact C-N 3.33Å; E135-W137 PolarHBondContact O-N 3.4Å; E135-K138 PolarHBondContact O-N 3Å; E135-K138 IonicContact OE1-NZ 2.7Å; E135-K138 PolarHBondContact OE1-NZ 3.46Å; E135-V139 WeakPolarHBondContact O-CG2 3.38Å; E135-V139 PolarHBondContact O-N 3.07Å
136	L	96.7	Very high	94.8	Very high	101 Å²	101	81.8 Å²	81.8	53%	0.529	41%	0.41	S	S	.	.	H	α-helix	trans	-60.6	-42.7	173.1	178.6	62.4	0	0	0	111.7	A132 F133 V139 K140	A132-L136 WeakPolarHBondContact O-CB 3.4Å; A132-L136 PolarHBondContact O-N 2.85Å; F133-L136 PolarHBondContact O-N 3.49Å; L136-V139 PolarHBondContact O-N 3.49Å; L136-K140 HydrophobicContact CD1-CG 4.15Å; L136-K140 HydrophobicContact CG-CG 4.46Å; L136-K140 WeakPolarHBondContact O-CB 3.38Å; L136-K140 WeakPolarHBondContact O-CG 3.44Å; L136-K140 PolarHBondContact O-N 3.43Å
137	W	95.6	Very high	94.5	Very high	32 Å²	32	82.9 Å²	82.9	12%	0.121	42%	0.416	C	S	.	.	H	α-helix	trans	-62.6	-44.9	178.1	-177.6	12.4	0	0	0	111.2	F133 I134 E135 V139 K140 C141 L147 L173 A176 L177	F133-W137 AromaticContact CE1-CE3 3.97Å; F133-W137 HydrophobicContact CE1-CE3 3.97Å; F133-W137 HydrophobicContact CZ-CE3 4.36Å; F133-W137 WeakPolarHBondContact O-CB 3.47Å; F133-W137 PolarHBondContact O-N 3.1Å; I134-W137 PolarHBondContact O-N 3.04Å; E135-W137 VanDerWaalsContact C-N 3.33Å; E135-W137 PolarHBondContact O-N 3.4Å; W137-V139 PolarHBondContact O-N 3.2Å; W137-K140 PolarHBondContact O-N 3.43Å; W137-C141 PolarHBondContact NE1-SG 2.98Å; W137-C141 VanDerWaalsContact NE1-SG 3.36Å; W137-C141 PolarHBondContact O-N 3.23Å; W137-C141 PolarHBondContact O-SG 2.95Å; W137-L147 HydrophobicContact CD2-CD2 3.71Å; W137-L147 HydrophobicContact CE3-CD2 3.99Å; W137-L147 HydrophobicContact CG-CD2 4.23Å; W137-L147 HydrophobicContact CH2-CD2 4.09Å; W137-L147 HydrophobicContact CZ2-CB 4.28Å; W137-L147 HydrophobicContact CZ2-CD2 3.82Å; W137-L147 HydrophobicContact CZ3-CD2 4.17Å; W137-L173 HydrophobicContact CZ3-CD2 4.23Å; W137-A176 HydrophobicContact CH2-CB 3.94Å; W137-A176 HydrophobicContact CZ3-CB 4.38Å; W137-L177 HydrophobicContact CH2-CB 4.28Å; W137-L177 HydrophobicContact CH2-CD1 4.44Å; W137-L177 HydrophobicContact CZ2-CD1 4.11Å
138	K	93.9	Very high	94.3	Very high	113 Å²	113	87 Å²	87	49%	0.491	44%	0.443	S	S	.	.	H	α-helix	trans	-57.1	-48.4	174.7	-72.6	173.5	-175.5	168.7	0	112	I134 E135 K140 C141 T142	I134-K138 HydrophobicContact CG2-CD 4.42Å; I134-K138 WeakPolarHBondContact O-CG 3.38Å; I134-K138 PolarHBondContact O-N 3.34Å; E135-K138 PolarHBondContact O-N 3Å; E135-K138 IonicContact OE1-NZ 2.7Å; E135-K138 PolarHBondContact OE1-NZ 3.46Å; K138-K140 PolarHBondContact O-N 3.08Å; K138-C141 PolarHBondContact O-N 3.15Å; K138-T142 PolarHBondContact O-N 3.38Å
139	V	95.5	Very high	94.1	Very high	70 Å²	70	83.6 Å²	83.6	42%	0.424	44%	0.437	S	S	.	.	H	α-helix	trans	-62.4	-41.7	178.2	173.6	0	0	0	0	111.4	E135 L136 W137 C141 T142 E143	E135-V139 WeakPolarHBondContact O-CG2 3.38Å; E135-V139 PolarHBondContact O-N 3.07Å; L136-V139 PolarHBondContact O-N 3.49Å; W137-V139 PolarHBondContact O-N 3.2Å; V139-C141 VanDerWaalsContact C-N 3.32Å; V139-C141 PolarHBondContact O-N 3.44Å; V139-T142 PolarHBondContact O-N 3.27Å; V139-T142 PolarHBondContact O-OG1 3.22Å; V139-E143 PolarHBondContact O-N 2.9Å
140	K	94.4	Very high	94	Very high	79 Å²	79	78.1 Å²	78.1	34%	0.343	41%	0.414	S	S	.	.	H	α-helix	trans	-67.7	-32.3	179	-73.5	-71.4	163.7	-157.7	0	112.9	L136 W137 K138 E143 N144 F145	L136-K140 HydrophobicContact CD1-CG 4.15Å; L136-K140 HydrophobicContact CG-CG 4.46Å; L136-K140 WeakPolarHBondContact O-CB 3.38Å; L136-K140 WeakPolarHBondContact O-CG 3.44Å; L136-K140 PolarHBondContact O-N 3.43Å; W137-K140 PolarHBondContact O-N 3.43Å; K138-K140 PolarHBondContact O-N 3.08Å; K140-E143 IonicContact NZ-OE1 3.5Å; K140-E143 IonicContact NZ-OE2 2.58Å; K140-E143 PolarHBondContact NZ-OE2 2.99Å; K140-E143 CarbonylContact O-C 3.57Å; K140-E143 PolarHBondContact O-N 3.48Å; K140-N144 PolarHBondContact O-N 3.02Å; K140-F145 HydrophobicContact CB-CB 4.14Å; K140-F145 HydrophobicContact CD-CD2 3.87Å; K140-F145 HydrophobicContact CD-CE2 4.37Å; K140-F145 HydrophobicContact CD-CG 4.28Å; K140-F145 WeakPolarHBondContact O-CB 3.34Å; K140-F145 PolarHBondContact O-N 3.39Å
141	C	90	Very high	94	Very high	51 Å²	51	80.3 Å²	80.3	35%	0.345	43%	0.428	S	S	.	.	H	α-helix	trans	-64.8	-37.6	173.7	-67.3	0	0	0	0	112.2	W137 K138 V139 E143 N144	W137-C141 PolarHBondContact NE1-SG 2.98Å; W137-C141 VanDerWaalsContact NE1-SG 3.36Å; W137-C141 PolarHBondContact O-N 3.23Å; W137-C141 PolarHBondContact O-SG 2.95Å; K138-C141 PolarHBondContact O-N 3.15Å; V139-C141 VanDerWaalsContact C-N 3.32Å; V139-C141 PolarHBondContact O-N 3.44Å; C141-E143 PolarHBondContact O-N 3.03Å; C141-N144 PolarHBondContact O-N 3.46Å; C141-N144 VanDerWaalsContact O-N 3.1Å
142	T	91.6	Very high	94	Very high	114 Å²	114	79.3 Å²	79.3	70%	0.699	43%	0.427	S	S	*	.	H	α-helix	trans	-69.6	-23.2	176.3	63.3	0	0	0	0	112.6	K138 V139 N144	K138-T142 PolarHBondContact O-N 3.38Å; V139-T142 PolarHBondContact O-N 3.27Å; V139-T142 PolarHBondContact O-OG1 3.22Å; T142-N144 VanDerWaalsContact C-N 3.26Å; T142-N144 PolarHBondContact O-N 2.95Å
143	E	93	Very high	93.9	Very high	88 Å²	88	80.9 Å²	80.9	41%	0.411	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	9	172.2	-67.3	174.4	-171.1	0	0	113.3	V139 K140 C141 F145	V139-E143 PolarHBondContact O-N 2.9Å; K140-E143 IonicContact NZ-OE1 3.5Å; K140-E143 IonicContact NZ-OE2 2.58Å; K140-E143 PolarHBondContact NZ-OE2 2.99Å; K140-E143 CarbonylContact O-C 3.57Å; K140-E143 PolarHBondContact O-N 3.48Å; C141-E143 PolarHBondContact O-N 3.03Å; E143-F145 VanDerWaalsContact C-N 3.3Å; E143-F145 HydrophobicContact CB-CD2 3.62Å; E143-F145 HydrophobicContact CB-CE2 3.83Å; E143-F145 PolarHBondContact O-N 2.89Å
144	N	89.2	Confident	93.9	Very high	156 Å²	156	80.2 Å²	80.2	83%	0.834	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	23	-176.8	-51.1	-70	0	0	0	115.2	K140 C141 T142	K140-N144 PolarHBondContact O-N 3.02Å; C141-N144 PolarHBondContact O-N 3.46Å; C141-N144 VanDerWaalsContact O-N 3.1Å; T142-N144 VanDerWaalsContact C-N 3.26Å; T142-N144 PolarHBondContact O-N 2.95Å
145	F	90.5	Very high	93.9	Very high	122 Å²	122	81.8 Å²	81.8	54%	0.535	43%	0.431	S	S	.	.			trans	-86.6	138.7	167.2	-65.6	-89.1	0	0	0	110.5	K140 E143	K140-F145 HydrophobicContact CB-CB 4.14Å; K140-F145 HydrophobicContact CD-CD2 3.87Å; K140-F145 HydrophobicContact CD-CE2 4.37Å; K140-F145 HydrophobicContact CD-CG 4.28Å; K140-F145 WeakPolarHBondContact O-CB 3.34Å; K140-F145 PolarHBondContact O-N 3.39Å; E143-F145 VanDerWaalsContact C-N 3.3Å; E143-F145 HydrophobicContact CB-CD2 3.62Å; E143-F145 HydrophobicContact CB-CE2 3.83Å; E143-F145 PolarHBondContact O-N 2.89Å
146	K	89.4	Confident	93.8	Very high	128 Å²	128	84 Å²	84	56%	0.557	44%	0.441	S	S	*	.			trans	-106.3	127.9	175.3	-176.6	172.3	-178.5	173.4	0	110.6	T148	K146-T148 PolarHBondContact O-N 3.4Å
147	L	92.4	Very high	93.9	Very high	40 Å²	40	79.9 Å²	79.9	21%	0.209	42%	0.419	C	S	.	.			trans	-71.1	125.7	168.1	-171.5	68	0	0	0	108.7	F133 W137 A149 L177	F133-L147 HydrophobicContact CZ-CD2 3.81Å; W137-L147 HydrophobicContact CD2-CD2 3.71Å; W137-L147 HydrophobicContact CE3-CD2 3.99Å; W137-L147 HydrophobicContact CG-CD2 4.23Å; W137-L147 HydrophobicContact CH2-CD2 4.09Å; W137-L147 HydrophobicContact CZ2-CB 4.28Å; W137-L147 HydrophobicContact CZ2-CD2 3.82Å; W137-L147 HydrophobicContact CZ3-CD2 4.17Å; L147-A149 WeakPolarHBondContact CD1-O 3.3Å; L147-A149 WeakPolarHBondContact CG-O 3.39Å; L147-L177 HydrophobicContact CB-CD1 3.98Å; L147-L177 HydrophobicContact CD2-CD1 4.03Å; L147-L177 HydrophobicContact CG-CD1 3.99Å; L147-L177 WeakPolarHBondContact O-CD1 3.26Å
148	T	91.5	Very high	93.9	Very high	130 Å²	130	78.4 Å²	78.4	80%	0.798	41%	0.414	S	S	*	.			trans	-95.7	-25.3	-177.8	51.7	0	0	0	0	113	K146	K146-T148 PolarHBondContact O-N 3.4Å
149	A	93.7	Very high	93.9	Very high	58 Å²	58	78.2 Å²	78.2	48%	0.479	42%	0.415	S	S	.	.	S	Bend	trans	-156.4	156.5	178.4	0	0	0	0	0	110.6	L147 P151	L147-A149 WeakPolarHBondContact CD1-O 3.3Å; L147-A149 WeakPolarHBondContact CG-O 3.39Å; A149-P151 WeakPolarHBondContact O-CD 3.49Å
150	I	95.1	Very high	93.8	Very high	12 Å²	12	78.6 Å²	78.6	6%	0.062	41%	0.412	C	S	.	.			trans	-78.2	120.4	171.9	-60	163.3	0	0	0	108.3	I154 R155 L173 K174 L177	I150-I154 HydrophobicContact CG2-CB 4.15Å; I150-I154 HydrophobicContact CG2-CG2 4.03Å; I150-R155 HydrophobicContact CG2-CB 4.5Å; I150-R155 PolarHBondContact O-NH2 2.94Å; I150-L173 HydrophobicContact CD1-CB 3.56Å; I150-L173 HydrophobicContact CG1-CB 4.34Å; I150-K174 HydrophobicContact CD1-CG 3.78Å; I150-L177 HydrophobicContact CG1-CD2 4.35Å
151	P	95.9	Very high	93.9	Very high	56 Å²	56	74.9 Å²	74.9	36%	0.364	40%	0.396	S	S	.	.			trans	-56.6	142.9	176.7	-24	34	0	0	0	112.3	F133 A149 V153 I154 R155	F133-P151 HydrophobicContact CE2-CG 4.02Å; F133-P151 HydrophobicContact CZ-CG 4.47Å; A149-P151 WeakPolarHBondContact O-CD 3.49Å; P151-V153 VanDerWaalsContact C-N 3.3Å; P151-V153 PolarHBondContact O-N 3.42Å; P151-I154 HydrophobicContact CB-CG1 4.18Å; P151-I154 HydrophobicContact CG-CG1 4.32Å; P151-I154 WeakPolarHBondContact O-CB 3.44Å; P151-I154 PolarHBondContact O-N 2.92Å; P151-R155 PolarHBondContact O-N 3.45Å; P151-R155 VanDerWaalsContact O-N 3.07Å
152	D	96.6	Very high	94	Very high	97 Å²	97	73.7 Å²	73.7	52%	0.519	39%	0.388	S	S	.	.	H	α-helix	trans	-57.7	-42.1	-175.7	-62	-37.8	0	0	0	112.4	I154 R155 E156	D152-I154 VanDerWaalsContact C-N 3.26Å; D152-I154 PolarHBondContact O-N 2.96Å; D152-R155 CarbonylContact O-C 3.6Å; D152-R155 WeakPolarHBondContact O-CA 3.38Å; D152-R155 VanDerWaalsContact O-CB 3.3Å; D152-R155 WeakPolarHBondContact O-CB 3.44Å; D152-R155 PolarHBondContact O-N 3.26Å; D152-R155 IonicContact OD1-CZ 3.11Å; D152-R155 IonicContact OD1-NH1 2.69Å; D152-R155 PolarHBondContact OD1-NH1 3.25Å; D152-R155 IonicContact OD1-NH2 2.73Å; D152-R155 PolarHBondContact OD1-NH2 3.42Å; D152-E156 WeakPolarHBondContact O-CG 3.44Å; D152-E156 PolarHBondContact O-N 3.49Å
153	V	96.5	Very high	93.9	Very high	93 Å²	93	73 Å²	73	56%	0.564	39%	0.388	S	S	*	.	H	α-helix	trans	-57.6	-38.2	176.3	179.9	0	0	0	0	112.1	P151 I157	P151-V153 VanDerWaalsContact C-N 3.3Å; P151-V153 PolarHBondContact O-N 3.42Å; V153-I157 HydrophobicContact CG1-CD1 3.99Å; V153-I157 WeakPolarHBondContact O-CB 3.43Å; V153-I157 WeakPolarHBondContact O-CD1 3.24Å; V153-I157 WeakPolarHBondContact O-CG1 3.29Å; V153-I157 PolarHBondContact O-N 2.94Å; V153-I157 VanDerWaalsContact O-N 3.07Å
154	I	97.3	Very high	93.8	Very high	16 Å²	16	71.9 Å²	71.9	8%	0.082	39%	0.39	C	S	.	.	H	α-helix	trans	-72.7	-34.9	177.5	-61.1	-58.4	0	0	0	110.8	L130 F133 I150 P151 D152 A158 L173	L130-I154 HydrophobicContact CD1-CG2 3.79Å; F133-I154 HydrophobicContact CB-CD1 3.58Å; F133-I154 HydrophobicContact CB-CG1 4.29Å; F133-I154 HydrophobicContact CD1-CD1 4.19Å; F133-I154 HydrophobicContact CD1-CG1 4.09Å; F133-I154 HydrophobicContact CD1-CG2 3.75Å; F133-I154 HydrophobicContact CD2-CD1 3.94Å; F133-I154 HydrophobicContact CD2-CG1 3.75Å; F133-I154 HydrophobicContact CE1-CG1 4.38Å; F133-I154 HydrophobicContact CE1-CG2 3.86Å; F133-I154 HydrophobicContact CE2-CG1 4.06Å; F133-I154 HydrophobicContact CG-CD1 3.62Å; F133-I154 HydrophobicContact CG-CG1 3.76Å; F133-I154 HydrophobicContact CG-CG2 4.27Å; F133-I154 HydrophobicContact CZ-CG1 4.36Å; F133-I154 HydrophobicContact CZ-CG2 4.46Å; I150-I154 HydrophobicContact CG2-CB 4.15Å; I150-I154 HydrophobicContact CG2-CG2 4.03Å; P151-I154 HydrophobicContact CB-CG1 4.18Å; P151-I154 HydrophobicContact CG-CG1 4.32Å; P151-I154 WeakPolarHBondContact O-CB 3.44Å; P151-I154 PolarHBondContact O-N 2.92Å; D152-I154 VanDerWaalsContact C-N 3.26Å; D152-I154 PolarHBondContact O-N 2.96Å; I154-A158 VanDerWaalsContact O-CB 3.25Å; I154-A158 WeakPolarHBondContact O-CB 3.5Å; I154-A158 PolarHBondContact O-N 3.02Å; I154-L173 HydrophobicContact CG2-CD1 4.03Å
155	R	96.4	Very high	93.9	Very high	86 Å²	86	69.9 Å²	69.9	33%	0.325	37%	0.371	S	S	.	.	H	α-helix	trans	-64.4	-47.6	175.1	-163.4	-174.4	-50.1	120.6	14.5	111	I150 P151 D152 I157 A158 E159 V170	I150-R155 HydrophobicContact CG2-CB 4.5Å; I150-R155 PolarHBondContact O-NH2 2.94Å; P151-R155 PolarHBondContact O-N 3.45Å; P151-R155 VanDerWaalsContact O-N 3.07Å; D152-R155 CarbonylContact O-C 3.6Å; D152-R155 WeakPolarHBondContact O-CA 3.38Å; D152-R155 VanDerWaalsContact O-CB 3.3Å; D152-R155 WeakPolarHBondContact O-CB 3.44Å; D152-R155 PolarHBondContact O-N 3.26Å; D152-R155 IonicContact OD1-CZ 3.11Å; D152-R155 IonicContact OD1-NH1 2.69Å; D152-R155 PolarHBondContact OD1-NH1 3.25Å; D152-R155 IonicContact OD1-NH2 2.73Å; D152-R155 PolarHBondContact OD1-NH2 3.42Å; R155-I157 PolarHBondContact O-N 3.04Å; R155-A158 PolarHBondContact O-N 2.7Å; R155-E159 VanDerWaalsContact O-CG 3.31Å; R155-E159 WeakPolarHBondContact O-CG 3.35Å; R155-E159 PolarHBondContact O-N 3.36Å; R155-V170 HydrophobicContact CG-CG1 4.3Å
156	E	95.8	Very high	93.9	Very high	123 Å²	123	72.7 Å²	72.7	58%	0.575	39%	0.392	S	S	*	.	H	α-helix	trans	-58.9	-47	176.3	-71.2	173	-174.1	0	0	111.5	D152 A158 E159 E160	D152-E156 WeakPolarHBondContact O-CG 3.44Å; D152-E156 PolarHBondContact O-N 3.49Å; E156-A158 VanDerWaalsContact C-N 3.34Å; E156-A158 PolarHBondContact O-N 3.49Å; E156-E159 PolarHBondContact O-N 3.07Å; E156-E160 WeakPolarHBondContact O-CB 3.47Å; E156-E160 PolarHBondContact O-N 2.87Å
157	I	96.9	Very high	94	Very high	14 Å²	14	71 Å²	71	7%	0.072	39%	0.392	C	S	.	.	H	α-helix	trans	-58.8	-45.9	175.6	-72.9	168	0	0	0	111.2	Q126 K129 L130 V153 R155 E159 E160 I161	Q126-I157 HydrophobicContact CB-CG2 3.99Å; Q126-I157 HydrophobicContact CG-CG1 4.48Å; Q126-I157 HydrophobicContact CG-CG2 4.36Å; Q126-I157 WeakPolarHBondContact O-CG2 3.37Å; K129-I157 HydrophobicContact CB-CD1 3.95Å; K129-I157 HydrophobicContact CD-CD1 3.9Å; L130-I157 HydrophobicContact CB-CG2 4.15Å; V153-I157 HydrophobicContact CG1-CD1 3.99Å; V153-I157 WeakPolarHBondContact O-CB 3.43Å; V153-I157 WeakPolarHBondContact O-CD1 3.24Å; V153-I157 WeakPolarHBondContact O-CG1 3.29Å; V153-I157 PolarHBondContact O-N 2.94Å; V153-I157 VanDerWaalsContact O-N 3.07Å; R155-I157 PolarHBondContact O-N 3.04Å; I157-E159 VanDerWaalsContact C-N 3.34Å; I157-E160 PolarHBondContact O-N 3.47Å; I157-I161 HydrophobicContact CG2-CD1 4.21Å; I157-I161 WeakPolarHBondContact O-CG1 3.49Å; I157-I161 PolarHBondContact O-N 3.29Å
158	A	95.7	Very high	94	Very high	0 Å²	0	72 Å²	72	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-64.9	-38.2	179.3	0	0	0	0	0	111.8	I154 R155 E156 S162 I169 V170 L173	I154-A158 VanDerWaalsContact O-CB 3.25Å; I154-A158 WeakPolarHBondContact O-CB 3.5Å; I154-A158 PolarHBondContact O-N 3.02Å; R155-A158 PolarHBondContact O-N 2.7Å; E156-A158 VanDerWaalsContact C-N 3.34Å; E156-A158 PolarHBondContact O-N 3.49Å; A158-S162 VanDerWaalsContact O-CB 3.31Å; A158-S162 WeakPolarHBondContact O-CB 3.45Å; A158-S162 PolarHBondContact O-N 2.88Å; A158-S162 PolarHBondContact O-OG 2.8Å; A158-I169 HydrophobicContact CB-CB 4.05Å; A158-I169 HydrophobicContact CB-CG2 3.65Å; A158-V170 HydrophobicContact CB-CG2 3.76Å; A158-L173 HydrophobicContact CB-CD1 4.18Å
159	E	95.1	Very high	94.2	Very high	110 Å²	110	66.8 Å²	66.8	51%	0.514	37%	0.369	S	S	.	.	H	α-helix	trans	-66.5	-44.9	176.1	-73.6	172.9	-173.1	0	0	111.6	R155 E156 I157 I161 S162 V170	R155-E159 VanDerWaalsContact O-CG 3.31Å; R155-E159 WeakPolarHBondContact O-CG 3.35Å; R155-E159 PolarHBondContact O-N 3.36Å; E156-E159 PolarHBondContact O-N 3.07Å; I157-E159 VanDerWaalsContact C-N 3.34Å; E159-I161 PolarHBondContact O-N 3.29Å; E159-S162 WeakPolarHBondContact O-CB 3.45Å; E159-S162 PolarHBondContact O-N 3.34Å; E159-V170 HydrophobicContact CG-CG2 3.59Å
160	E	93.6	Very high	94.2	Very high	78 Å²	78	64.6 Å²	64.6	36%	0.364	35%	0.35	S	S	.	.	H	α-helix	trans	-60.6	-47	-178.8	-170.8	173.2	161.7	0	0	112	R122 Q126 E156 I157	R122-E160 VanDerWaalsContact CD-OE1 3.26Å; R122-E160 WeakPolarHBondContact CD-OE1 3.29Å; R122-E160 IonicContact CZ-OE1 2.73Å; R122-E160 IonicContact NE-OE1 2.68Å; R122-E160 PolarHBondContact NE-OE1 2.91Å; Q126-E160 PolarHBondContact NE2-OE1 3.35Å; Q126-E160 PolarHBondContact NE2-OE2 3.37Å; Q126-E160 VanDerWaalsContact OE1-CD 3.23Å; Q126-E160 PolarHBondContact OE1-OE1 2.87Å; E156-E160 WeakPolarHBondContact O-CB 3.47Å; E156-E160 PolarHBondContact O-N 2.87Å; I157-E160 PolarHBondContact O-N 3.47Å
161	I	95.2	Very high	94.2	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-86.5	-5.8	-178.6	74.2	-163.2	0	0	0	113.3	H123 Q126 N127 L130 I157 E159 S163 S164 Y165 I169	H123-I161 HydrophobicContact CB-CG2 4.23Å; Q126-I161 HydrophobicContact CB-CG2 3.56Å; Q126-I161 HydrophobicContact CG-CG2 4.38Å; N127-I161 WeakPolarHBondContact OD1-CD1 3.5Å; L130-I161 HydrophobicContact CD2-CD1 3.9Å; I157-I161 HydrophobicContact CG2-CD1 4.21Å; I157-I161 WeakPolarHBondContact O-CG1 3.49Å; I157-I161 PolarHBondContact O-N 3.29Å; E159-I161 PolarHBondContact O-N 3.29Å; I161-S163 PolarHBondContact O-N 3.22Å; I161-S163 VanDerWaalsContact O-N 3.14Å; I161-S164 WeakPolarHBondContact O-CB 3.36Å; I161-S164 PolarHBondContact O-N 3.46Å; I161-Y165 HydrophobicContact CG1-CE2 4.28Å; I161-Y165 WeakPolarHBondContact O-CD2 3.45Å; I161-I169 HydrophobicContact CD1-CD1 3.89Å; I161-I169 HydrophobicContact CG1-CD1 3.42Å; I161-I169 VanDerWaalsContact CG1-CD1 3.42Å
162	S	93.5	Very high	94.1	Very high	26 Å²	26	69.2 Å²	69.2	18%	0.182	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-57.5	-31.5	-177.9	-82.7	0	0	0	0	112.6	A158 E159 S164 Y165	A158-S162 VanDerWaalsContact O-CB 3.31Å; A158-S162 WeakPolarHBondContact O-CB 3.45Å; A158-S162 PolarHBondContact O-N 2.88Å; A158-S162 PolarHBondContact O-OG 2.8Å; E159-S162 WeakPolarHBondContact O-CB 3.45Å; E159-S162 PolarHBondContact O-N 3.34Å; S162-S164 PolarHBondContact O-N 3.45Å; S162-Y165 PolarHBondContact O-N 3.29Å; S162-Y165 VanDerWaalsContact O-O 3.11Å
163	S	89.2	Confident	94	Very high	101 Å²	101	65.1 Å²	65.1	71%	0.706	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-61.8	-22.3	176.1	63.3	0	0	0	0	113.8	I161 Y165	I161-S163 PolarHBondContact O-N 3.22Å; I161-S163 VanDerWaalsContact O-N 3.14Å; S163-Y165 VanDerWaalsContact C-N 3.35Å
164	S	89.8	Confident	93.9	Very high	64 Å²	64	65.2 Å²	65.2	45%	0.448	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-86.2	-5.5	-179.9	-57.7	0	0	0	0	113.5	H123 I161 S162	H123-S164 PolarHBondContact ND1-OG 3.2Å; H123-S164 VanDerWaalsContact ND1-OG 3.13Å; I161-S164 WeakPolarHBondContact O-CB 3.36Å; I161-S164 PolarHBondContact O-N 3.46Å; S162-S164 PolarHBondContact O-N 3.45Å
165	Y	91.7	Very high	93.7	Very high	114 Å²	114	68.7 Å²	68.7	45%	0.447	36%	0.361	S	S	.	.	S	Bend	trans	-124.2	149.3	-176.6	-66.8	-91.7	0	0	0	111	N127 I161 S162 S163 V167 I169	N127-Y165 VanDerWaalsContact CG-OH 3.29Å; N127-Y165 PolarHBondContact ND2-OH 3.02Å; N127-Y165 PolarHBondContact OD1-OH 3.47Å; I161-Y165 HydrophobicContact CG1-CE2 4.28Å; I161-Y165 WeakPolarHBondContact O-CD2 3.45Å; S162-Y165 PolarHBondContact O-N 3.29Å; S162-Y165 VanDerWaalsContact O-O 3.11Å; S163-Y165 VanDerWaalsContact C-N 3.35Å; Y165-V167 PolarHBondContact O-N 2.85Å; Y165-I169 HydrophobicContact CD2-CD1 3.58Å; Y165-I169 HydrophobicContact CD2-CG1 4.31Å; Y165-I169 HydrophobicContact CE2-CD1 3.82Å; Y165-I169 HydrophobicContact CG-CD1 4.24Å
166	N	91.3	Very high	93.5	Very high	181 Å²	181	66.9 Å²	66.9	97%	0.968	37%	0.365	S	S	*	.	S	Bend	trans	-73	-6.4	176.5	-67	-31.5	0	0	0	113.5
167	V	90.9	Very high	93.3	Very high	93 Å²	93	62.7 Å²	62.7	56%	0.564	35%	0.346	S	S	*	.	S	Bend	trans	-128.5	141.1	-174.1	-177.2	0	0	0	0	108.8	Y165 I169	Y165-V167 PolarHBondContact O-N 2.85Å; V167-I169 PolarHBondContact O-N 2.86Å; V167-I169 VanDerWaalsContact O-N 3.12Å
168	S	93.3	Very high	92.9	Very high	59 Å²	59	65.5 Å²	65.5	41%	0.413	37%	0.367	S	S	.	.			trans	-65.6	112.3	171.9	178.8	0	0	0	0	110.2	V170 E171 T172	S168-V170 VanDerWaalsContact C-N 3.3Å; S168-V170 PolarHBondContact O-N 3.48Å; S168-E171 PolarHBondContact O-N 3.43Å; S168-E171 PolarHBondContact OG-N 3.48Å; S168-T172 PolarHBondContact O-N 2.85Å; S168-T172 PolarHBondContact O-OG1 3.46Å
169	I	94.9	Very high	92.3	Very high	21 Å²	21	68.2 Å²	68.2	11%	0.108	39%	0.39	C	S	.	.	H	α-helix	trans	-63.8	-42	177.9	-59.6	175	0	0	0	109.9	L130 A158 I161 Y165 V167 E171 T172 L173	L130-I169 HydrophobicContact CD2-CD1 4.45Å; L130-I169 HydrophobicContact CD2-CG2 3.7Å; A158-I169 HydrophobicContact CB-CB 4.05Å; A158-I169 HydrophobicContact CB-CG2 3.65Å; I161-I169 HydrophobicContact CD1-CD1 3.89Å; I161-I169 HydrophobicContact CG1-CD1 3.42Å; I161-I169 VanDerWaalsContact CG1-CD1 3.42Å; Y165-I169 HydrophobicContact CD2-CD1 3.58Å; Y165-I169 HydrophobicContact CD2-CG1 4.31Å; Y165-I169 HydrophobicContact CE2-CD1 3.82Å; Y165-I169 HydrophobicContact CG-CD1 4.24Å; V167-I169 PolarHBondContact O-N 2.86Å; V167-I169 VanDerWaalsContact O-N 3.12Å; I169-E171 VanDerWaalsContact C-N 3.3Å; I169-E171 PolarHBondContact O-N 2.84Å; I169-T172 WeakPolarHBondContact O-CB 3.47Å; I169-T172 PolarHBondContact O-N 3.49Å; I169-T172 VanDerWaalsContact O-N 3.16Å; I169-L173 HydrophobicContact CG2-CD1 4.22Å; I169-L173 HydrophobicContact CG2-CG 4.44Å; I169-L173 WeakPolarHBondContact O-CG 3.49Å; I169-L173 PolarHBondContact O-N 3.21Å
170	V	94.6	Very high	90.8	Very high	13 Å²	13	65.5 Å²	65.5	8%	0.079	38%	0.383	C	S	.	.	H	α-helix	trans	-57.3	-45.9	178.1	179.7	0	0	0	0	111	R155 A158 E159 S168 T172 L173 K174	R155-V170 HydrophobicContact CG-CG1 4.3Å; A158-V170 HydrophobicContact CB-CG2 3.76Å; E159-V170 HydrophobicContact CG-CG2 3.59Å; S168-V170 VanDerWaalsContact C-N 3.3Å; S168-V170 PolarHBondContact O-N 3.48Å; V170-T172 VanDerWaalsContact C-N 3.34Å; V170-L173 PolarHBondContact O-N 3.25Å; V170-K174 HydrophobicContact CG1-CD 4.39Å; V170-K174 WeakPolarHBondContact O-CG 3.45Å; V170-K174 PolarHBondContact O-N 3.41Å
171	E	94	Very high	89	Confident	90 Å²	90	64.2 Å²	64.2	42%	0.421	39%	0.385	S	S	.	.	H	α-helix	trans	-67.9	-37.8	179.3	-163	57.3	-155.4	0	0	111.6	S168 I169 L173 K174 N175	S168-E171 PolarHBondContact O-N 3.43Å; S168-E171 PolarHBondContact OG-N 3.48Å; I169-E171 VanDerWaalsContact C-N 3.3Å; I169-E171 PolarHBondContact O-N 2.84Å; E171-L173 VanDerWaalsContact C-N 3.33Å; E171-L173 PolarHBondContact O-N 2.87Å; E171-K174 PolarHBondContact O-N 3.19Å; E171-N175 WeakPolarHBondContact O-CB 3.27Å; E171-N175 PolarHBondContact O-N 3.47Å; E171-N175 PolarHBondContact O-ND2 3.23Å
172	T	94.8	Very high	87	Confident	75 Å²	75	69.6 Å²	69.6	46%	0.46	42%	0.418	S	S	.	.	H	α-helix	trans	-59.5	-43.9	174.2	-54.9	0	0	0	0	111.5	S168 I169 V170 N175 A176	S168-T172 PolarHBondContact O-N 2.85Å; S168-T172 PolarHBondContact O-OG1 3.46Å; I169-T172 WeakPolarHBondContact O-CB 3.47Å; I169-T172 PolarHBondContact O-N 3.49Å; I169-T172 VanDerWaalsContact O-N 3.16Å; V170-T172 VanDerWaalsContact C-N 3.34Å; T172-N175 PolarHBondContact O-N 3.29Å; T172-A176 WeakPolarHBondContact O-CB 3.36Å; T172-A176 PolarHBondContact O-N 2.86Å
173	L	94.5	Very high	84.9	Confident	11 Å²	11	76.9 Å²	76.9	6%	0.058	45%	0.449	C	S	.	.	H	α-helix	trans	-66.1	-41	177	-68.8	172	0	0	0	112.2	L130 W137 I150 I154 A158 I169 V170 E171 A176 L177	L130-L173 HydrophobicContact CD1-CD1 4.2Å; W137-L173 HydrophobicContact CZ3-CD2 4.23Å; I150-L173 HydrophobicContact CD1-CB 3.56Å; I150-L173 HydrophobicContact CG1-CB 4.34Å; I154-L173 HydrophobicContact CG2-CD1 4.03Å; A158-L173 HydrophobicContact CB-CD1 4.18Å; I169-L173 HydrophobicContact CG2-CD1 4.22Å; I169-L173 HydrophobicContact CG2-CG 4.44Å; I169-L173 WeakPolarHBondContact O-CG 3.49Å; I169-L173 PolarHBondContact O-N 3.21Å; V170-L173 PolarHBondContact O-N 3.25Å; E171-L173 VanDerWaalsContact C-N 3.33Å; E171-L173 PolarHBondContact O-N 2.87Å; L173-A176 PolarHBondContact O-N 3.39Å; L173-L177 WeakPolarHBondContact O-CB 3.46Å; L173-L177 PolarHBondContact O-N 3.16Å
174	K	94.3	Very high	82.7	Confident	94 Å²	94	77 Å²	77	41%	0.409	45%	0.45	S	S	.	.	H	α-helix	trans	-64.4	-40.8	176.8	-73.4	175.3	-178.3	172.4	0	112	I150 V170 E171 L177 S178	I150-K174 HydrophobicContact CD1-CG 3.78Å; V170-K174 HydrophobicContact CG1-CD 4.39Å; V170-K174 WeakPolarHBondContact O-CG 3.45Å; V170-K174 PolarHBondContact O-N 3.41Å; E171-K174 PolarHBondContact O-N 3.19Å; K174-L177 PolarHBondContact O-N 3.31Å; K174-S178 PolarHBondContact O-N 2.88Å; K174-S178 PolarHBondContact O-OG 3.23Å
175	N	93.5	Very high	80.2	Confident	90 Å²	90	82.3 Å²	82.3	48%	0.481	47%	0.468	S	S	.	.	H	α-helix	trans	-64.2	-43.5	175.7	-71.3	-25.6	0	0	0	111.3	E171 T172 L177 S178 A179	E171-N175 WeakPolarHBondContact O-CB 3.27Å; E171-N175 PolarHBondContact O-N 3.47Å; E171-N175 PolarHBondContact O-ND2 3.23Å; T172-N175 PolarHBondContact O-N 3.29Å; N175-L177 PolarHBondContact O-N 2.86Å; N175-S178 PolarHBondContact O-N 3.14Å; N175-A179 WeakPolarHBondContact O-CB 3.45Å; N175-A179 PolarHBondContact O-N 3.38Å
176	A	91.9	Very high	77.7	Confident	47 Å²	47	85.4 Å²	85.4	39%	0.388	49%	0.486	S	S	.	.	H	α-helix	trans	-62.3	-40.4	175.4	0	0	0	0	0	112.6	W137 T172 L173 S178 A179 S180	W137-A176 HydrophobicContact CH2-CB 3.94Å; W137-A176 HydrophobicContact CZ3-CB 4.38Å; T172-A176 WeakPolarHBondContact O-CB 3.36Å; T172-A176 PolarHBondContact O-N 2.86Å; L173-A176 PolarHBondContact O-N 3.39Å; A176-S178 VanDerWaalsContact C-N 3.31Å; A176-S178 PolarHBondContact O-N 3.45Å; A176-A179 PolarHBondContact O-N 3.46Å; A176-S180 PolarHBondContact O-N 2.77Å
177	L	91.8	Very high	75.2	Confident	35 Å²	35	82.4 Å²	82.4	18%	0.183	48%	0.475	C	S	.	.	H	α-helix	trans	-63	-38.7	176	-172.9	68.7	0	0	0	111.9	W137 L147 I150 L173 K174 N175	W137-L177 HydrophobicContact CH2-CB 4.28Å; W137-L177 HydrophobicContact CH2-CD1 4.44Å; W137-L177 HydrophobicContact CZ2-CD1 4.11Å; L147-L177 HydrophobicContact CB-CD1 3.98Å; L147-L177 HydrophobicContact CD2-CD1 4.03Å; L147-L177 HydrophobicContact CG-CD1 3.99Å; L147-L177 WeakPolarHBondContact O-CD1 3.26Å; I150-L177 HydrophobicContact CG1-CD2 4.35Å; L173-L177 WeakPolarHBondContact O-CB 3.46Å; L173-L177 PolarHBondContact O-N 3.16Å; K174-L177 PolarHBondContact O-N 3.31Å; N175-L177 PolarHBondContact O-N 2.86Å
178	S	88.8	Confident	72.6	Confident	74 Å²	74	89.2 Å²	89.2	52%	0.517	49%	0.49	S	S	.	.	H	α-helix	trans	-74.5	-39.7	-179.8	-55.3	0	0	0	0	112.3	K174 N175 A176 S180 A181	K174-S178 PolarHBondContact O-N 2.88Å; K174-S178 PolarHBondContact O-OG 3.23Å; N175-S178 PolarHBondContact O-N 3.14Å; A176-S178 VanDerWaalsContact C-N 3.31Å; A176-S178 PolarHBondContact O-N 3.45Å; S178-S180 VanDerWaalsContact C-N 3.32Å; S178-S180 PolarHBondContact O-N 2.9Å; S178-A181 WeakPolarHBondContact O-CB 3.41Å; S178-A181 PolarHBondContact O-N 3.32Å; S178-A181 VanDerWaalsContact O-N 3.09Å
179	A	81.2	Confident	70.1	Confident	57 Å²	57	93.6 Å²	93.6	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-61.9	-39.1	177.5	0	0	0	0	0	112.1	N175 A176 A181 V182	N175-A179 WeakPolarHBondContact O-CB 3.45Å; N175-A179 PolarHBondContact O-N 3.38Å; A176-A179 PolarHBondContact O-N 3.46Å; A179-A181 PolarHBondContact O-N 2.98Å; A179-V182 PolarHBondContact O-N 3.41Å; A179-V182 VanDerWaalsContact O-N 3.1Å
180	S	64.6	Low	67.3	Low	53 Å²	53	98.3 Å²	98.3	37%	0.371	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.1	175.5	176.7	0	0	0	0	113.7	A176 S178	A176-S180 PolarHBondContact O-N 2.77Å; S178-S180 VanDerWaalsContact C-N 3.32Å; S178-S180 PolarHBondContact O-N 2.9Å
181	A	56.5	Low	64.4	Low	50 Å²	50	103.2 Å²	103.2	41%	0.413	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.7	-14.2	178.3	0	0	0	0	0	114.4	S178 A179	S178-A181 WeakPolarHBondContact O-CB 3.41Å; S178-A181 PolarHBondContact O-N 3.32Å; S178-A181 VanDerWaalsContact O-N 3.09Å; A179-A181 PolarHBondContact O-N 2.98Å
182	V	53	Low	61.9	Low	114 Å²	114	104.8 Å²	104.8	69%	0.691	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-20.9	-171.5	-175.7	0	0	0	0	112.8	A179 S184	A179-V182 PolarHBondContact O-N 3.41Å; A179-V182 VanDerWaalsContact O-N 3.1Å; V182-S184 PolarHBondContact O-N 3.26Å
183	E	47.8	Very low	59.3	Low	178 Å²	178	110.3 Å²	110.3	83%	0.832	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	21.6	-175.5	-67	-171.8	159.8	0	0	115.5
184	S	42.9	Very low	56.4	Low	105 Å²	105	117.1 Å²	117.1	73%	0.734	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-2.7	178.9	-53.7	0	0	0	0	114.8	V182	V182-S184 PolarHBondContact O-N 3.26Å
185	E	38.2	Very low	53.8	Low	174 Å²	174	119.2 Å²	119.2	81%	0.813	67%	0.673	S	S	*	*	S	Bend	trans	-132.6	133.9	172.7	-69.6	-164.9	158.4	0	0	110.5
186	E	39.1	Very low	50.8	Low	180 Å²	180	120.5 Å²	120.5	84%	0.841	69%	0.688	S	S	*	*			trans	84.9	98.6	167	-67.2	-177.2	153.2	0	0	120.4
187	T	38	Very low	48.3	Very low	118 Å²	118	126.5 Å²	126.5	72%	0.724	71%	0.711	S	S	*	*				81.3	101.7	121.4	-36.2	0	0	0	0	118.2	I189	T187-I189 PolarHBondContact O-N 3.02Å
188	R	36.5	Very low	45.8	Very low	235 Å²	235	129.2 Å²	129.2	89%	0.887	74%	0.739	S	S	*	*			trans	-22	128.7	146.9	-58.7	173.1	-177.9	172.2	0.3	111.5
189	I	41.7	Very low	43.1	Very low	152 Å²	152	134.8 Å²	134.8	78%	0.779	76%	0.757	S	S	*	*			trans	173.3	118.5	134.8	-80.3	144.1	0	0	0	109.2	T187	T187-I189 PolarHBondContact O-N 3.02Å
190	S	36.5	Very low	41.1	Very low	119 Å²	119	141.9 Å²	141.9	83%	0.832	78%	0.777	S	S	*	*			trans	80.9	123.5	148.4	-64.1	0	0	0	0	123.3
191	S	34.1	Very low	39.9	Very low	116 Å²	116	148.9 Å²	148.9	81%	0.811	80%	0.801	S	S	*	*			trans	-56.4	155.8	172	-167	0	0	0	0	115.2
192	P	39.5	Very low	38.8	Very low	124 Å²	124	155.4 Å²	155.4	81%	0.805	82%	0.822	S	S	*	*			trans	-90.9	148.8	-162.6	35.6	-31.2	0	0	0	113.7
193	Q	41.4	Very low	38.3	Very low	191 Å²	191	157.8 Å²	157.8	89%	0.893	83%	0.83	S	S	*	*			trans	-109.6	122.8	174.8	-159.5	170	9	0	0	110.4
194	N	33.8	Very low	37.7	Very low	153 Å²	153	154.3 Å²	154.3	82%	0.818	82%	0.823	S	S	*	*			trans	-43	138.6	173.4	-84.4	-35.1	0	0	0	114.6
195	V	38.6	Very low	37.4	Very low	139 Å²	139	154 Å²	154	84%	0.842	83%	0.826	S	S	*	*			trans	-137	113.9	148.6	-178.7	0	0	0	0	109.3
196	C	30.2	Very low	37.4	Very low	117 Å²	117	153 Å²	153	79%	0.791	83%	0.825	S	S	*	*			trans	-63.4	143.5	171.6	-65.6	0	0	0	0	112.2
197	I	40.6	Very low	37.6	Very low	172 Å²	172	151.7 Å²	151.7	88%	0.882	82%	0.822	S	S	*	*			trans	-131.9	133.4	146.6	-58.9	-176.6	0	0	0	109.3
198	A	38.4	Very low	37.5	Very low	93 Å²	93	151.4 Å²	151.4	77%	0.769	82%	0.822	S	S	*	*			trans	-61.6	154.1	-160	0	0	0	0	0	119.1
199	E	31.9	Very low	37.2	Very low	191 Å²	191	149.8 Å²	149.8	89%	0.893	82%	0.821	S	S	*	*			trans	-43.4	144	164.7	-62.6	166.1	136.5	0	0	115.4
200	K	41	Very low	37	Very low	205 Å²	205	149.2 Å²	149.2	89%	0.891	83%	0.825	S	S	*	*			trans	-148.4	97.7	146.7	-111.8	175.7	-175.3	177.9	0	112
201	K	39	Very low	36.9	Very low	201 Å²	201	151.6 Å²	151.6	87%	0.874	82%	0.823	S	S	*	*			trans	57.5	103.5	144.1	-68.4	-174.1	174.7	-175.5	0	119.8
202	E	32.9	Very low	37	Very low	186 Å²	186	151.8 Å²	151.8	87%	0.869	83%	0.825	S	S	*	*			trans	-56.6	146.2	152.7	-74.4	174.6	124.8	0	0	113.7
203	I	43.3	Very low	36.5	Very low	165 Å²	165	152.9 Å²	152.9	85%	0.846	82%	0.823	S	S	*	*			trans	-131	120.9	146.6	-58.7	174.8	0	0	0	106.3
204	P	34.6	Very low	36.3	Very low	105 Å²	105	149.8 Å²	149.8	68%	0.682	82%	0.818	S	S	*	*			trans	-93.4	126.5	180	32.6	-27.4	0	0	0	111.1
205	A	36.2	Very low	36.2	Very low	97 Å²	97	148.7 Å²	148.7	80%	0.802	82%	0.817	S	S	*	*			trans	-103.2	109.8	168.4	0	0	0	0	0	109.9
206	I	39.2	Very low	36.2	Very low	155 Å²	155	147.8 Å²	147.8	80%	0.795	82%	0.817	S	S	*	*			trans	-77.1	125.4	172.8	-61.4	165.1	0	0	0	108
207	I	43.1	Very low	36.3	Very low	152 Å²	152	149.8 Å²	149.8	78%	0.779	82%	0.82	S	S	*	*			trans	-128.4	125	160.7	-56.9	179.4	0	0	0	108.1
208	P	35.5	Very low	36.3	Very low	111 Å²	111	150.7 Å²	150.7	72%	0.721	82%	0.82	S	S	*	*			trans	-76.6	139	-178.3	-4.2	21.2	0	0	0	111.7
209	K	30.7	Very low	36.2	Very low	201 Å²	201	153.8 Å²	153.8	87%	0.874	82%	0.819	S	S	*	*			trans	-70.8	133.9	165.6	-78.4	174.7	174	173.5	0	110.2
210	T	37.5	Very low	36.4	Very low	140 Å²	140	152.4 Å²	152.4	86%	0.859	82%	0.816	S	S	*	*			trans	-124.6	117.3	151	-39.5	0	0	0	0	108
211	Q	32.7	Very low	36	Very low	170 Å²	170	148.7 Å²	148.7	79%	0.794	81%	0.806	S	S	*	*			trans	-75.6	141.2	172.4	-73.4	170	-41.4	0	0	110.4
212	S	37	Very low	36	Very low	120 Å²	120	146.5 Å²	146.5	84%	0.839	80%	0.803	S	S	*	*			trans	-165	124.9	130.4	53.8	0	0	0	0	110.2
213	N	30.1	Very low	36.1	Very low	146 Å²	146	142.7 Å²	142.7	78%	0.781	80%	0.797	S	S	*	*			trans	-64.3	148.9	179.8	-54.2	-41	0	0	0	112.2
214	T	36.6	Very low	35.8	Very low	127 Å²	127	140.1 Å²	140.1	78%	0.779	79%	0.793	S	S	*	*				173.3	114.8	107.7	35.4	0	0	0	0	112.2
215	T	32.1	Very low	35.8	Very low	129 Å²	129	140.7 Å²	140.7	79%	0.791	79%	0.79	S	S	*	*			trans	25.7	115.1	134.9	53.1	0	0	0	0	120.3
216	S	37.7	Very low	36.4	Very low	120 Å²	120	142.2 Å²	142.2	84%	0.839	78%	0.784	S	S	*	*				174.2	144.1	114.3	39.7	0	0	0	0	110.4	E218	S216-E218 PolarHBondContact O-N 2.97Å
217	D	33.2	Very low	36.7	Very low	160 Å²	160	140.8 Å²	140.8	86%	0.856	78%	0.778	S	S	*	*			trans	-47.2	125.5	171.6	-75.2	-53.7	0	0	0	111.8
218	E	40	Very low	37	Very low	191 Å²	191	138.1 Å²	138.1	89%	0.893	77%	0.769	S	S	*	*			trans	-162.5	137.4	146.7	-111.7	164.6	-158.8	0	0	111.5	S216	S216-E218 PolarHBondContact O-N 2.97Å
219	Q	36.5	Very low	37.3	Very low	158 Å²	158	140.8 Å²	140.8	74%	0.738	77%	0.771	S	S	*	*			trans	-52.9	134.8	-172.4	-65.2	165.2	-20.4	0	0	112.7	N221	Q219-N221 PolarHBondContact O-N 3Å; Q219-N221 PolarHBondContact OE1-ND2 3.37Å
220	L	35.5	Very low	37.8	Very low	161 Å²	161	139.4 Å²	139.4	84%	0.843	77%	0.766	S	S	*	*			trans	-72.2	72.9	166.7	-68.1	173.5	0	0	0	110.1	L222	L220-L222 VanDerWaalsContact C-N 3.28Å; L220-L222 PolarHBondContact O-N 2.89Å
221	N	32.9	Very low	38.2	Very low	127 Å²	127	141 Å²	141	68%	0.679	76%	0.763	S	S	*	*			trans	-76.1	80.9	165.8	-81.5	-36.2	0	0	0	109.1	Q219 S223	Q219-N221 PolarHBondContact O-N 3Å; Q219-N221 PolarHBondContact OE1-ND2 3.37Å; N221-S223 PolarHBondContact O-N 3.21Å
222	L	38.9	Very low	38.6	Very low	155 Å²	155	142 Å²	142	81%	0.812	77%	0.768	S	S	*	*			trans	-78.6	61	167.8	-75.2	162.7	0	0	0	110.1	L220	L220-L222 VanDerWaalsContact C-N 3.28Å; L220-L222 PolarHBondContact O-N 2.89Å
223	S	35	Very low	38.5	Very low	106 Å²	106	140.7 Å²	140.7	74%	0.741	76%	0.758	S	S	*	*			trans	-141.7	70.5	172.5	168.2	0	0	0	0	108.3	N221	N221-S223 PolarHBondContact O-N 3.21Å
224	C	36.3	Very low	38.9	Very low	112 Å²	112	141.9 Å²	141.9	76%	0.757	76%	0.764	S	S	*	*	S	Bend	trans	-156.8	136	163.9	-143	0	0	0	0	109.6	I226	C224-I226 PolarHBondContact O-N 2.89Å; C224-I226 VanDerWaalsContact O-N 3.15Å
225	D	35.6	Very low	39.2	Very low	116 Å²	116	141.1 Å²	141.1	62%	0.62	76%	0.759	S	S	*	*			trans	-43.2	111	-176.2	-91.9	-50.5	0	0	0	113.6	D227 T228	D225-D227 PolarHBondContact O-N 2.97Å; D225-T228 WeakPolarHBondContact CB-OG1 3.3Å; D225-T228 PolarHBondContact O-N 3.49Å; D225-T228 PolarHBondContact O-OG1 3.29Å
226	I	49.4	Very low	39.6	Very low	130 Å²	130	142.8 Å²	142.8	67%	0.667	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-16.9	175.8	-58.2	173.7	0	0	0	110.7	C224 F230	C224-I226 PolarHBondContact O-N 2.89Å; C224-I226 VanDerWaalsContact O-N 3.15Å; I226-F230 HydrophobicContact CG2-CE2 4.35Å; I226-F230 WeakPolarHBondContact O-CD2 3.38Å
227	D	45.6	Very low	39.6	Very low	125 Å²	125	143 Å²	143	67%	0.668	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-16.8	-179.8	-72.9	-37.4	0	0	0	114.1	D225	D225-D227 PolarHBondContact O-N 2.97Å
228	T	48.5	Very low	39.8	Very low	96 Å²	96	139.6 Å²	139.6	59%	0.589	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-15.6	-179.5	22	0	0	0	0	115.2	D225	D225-T228 WeakPolarHBondContact CB-OG1 3.3Å; D225-T228 PolarHBondContact O-N 3.49Å; D225-T228 PolarHBondContact O-OG1 3.29Å
229	Q	40.8	Very low	39.9	Very low	167 Å²	167	136.6 Å²	136.6	78%	0.78	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-91	-5.1	-175.8	-133.2	177.1	55.6	0	0	114.4	Q231	Q229-Q231 VanDerWaalsContact C-N 3.33Å; Q229-Q231 PolarHBondContact O-N 3.44Å
230	F	42.4	Very low	40.4	Very low	171 Å²	171	138 Å²	138	75%	0.75	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-83.6	1.8	176.7	-87.1	-80.9	0	0	0	114.8	I226	I226-F230 HydrophobicContact CG2-CE2 4.35Å; I226-F230 WeakPolarHBondContact O-CD2 3.38Å
231	Q	45.5	Very low	40.8	Very low	174 Å²	174	138.2 Å²	138.2	81%	0.813	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-90.1	-0.7	-179.1	-83.7	176	-4.9	0	0	115.4	Q229	Q229-Q231 VanDerWaalsContact C-N 3.33Å; Q229-Q231 PolarHBondContact O-N 3.44Å
232	Q	40.5	Very low	41.3	Very low	192 Å²	192	142.3 Å²	142.3	90%	0.897	75%	0.754	S	S	*	*	S	Bend	trans	-128.9	6.4	-175.8	-91.9	178.3	-9.4	0	0	116.4
233	C	35.7	Very low	41.5	Very low	92 Å²	92	140.9 Å²	140.9	62%	0.622	75%	0.751	S	S	*	*			trans	-105	96.7	177.1	-137.5	0	0	0	0	111.4	V235	C233-V235 PolarHBondContact O-N 3.14Å
234	N	38.6	Very low	41.7	Very low	171 Å²	171	141.3 Å²	141.3	91%	0.914	75%	0.754	S	S	*	*			trans	-68.4	58.5	164.8	-85.2	-23.4	0	0	0	111.1
235	V	43.5	Very low	42.3	Very low	111 Å²	111	139.5 Å²	139.5	67%	0.673	75%	0.747	S	S	*	*			trans	-122.7	94.4	176.3	-172.7	0	0	0	0	108.5	C233	C233-V235 PolarHBondContact O-N 3.14Å
236	L	39	Very low	42.7	Very low	164 Å²	164	141.1 Å²	141.1	86%	0.859	76%	0.755	S	S	*	*			trans	-11.7	136.1	152.1	-64.2	155	0	0	0	114.6
237	D	38.6	Very low	42.3	Very low	125 Å²	125	140.8 Å²	140.8	67%	0.668	76%	0.755	S	S	*	*			trans	90.2	53.6	151.9	-147.5	21.4	0	0	0	118.5	R240	D237-R240 WeakPolarHBondContact OD1-CD 3.35Å
238	A	37.6	Very low	42.6	Very low	88 Å²	88	138.8 Å²	138.8	73%	0.727	75%	0.747	S	S	*	*			trans	-125.8	-4.4	157.2	0	0	0	0	0	114.4	R240	A238-R240 PolarHBondContact O-N 3.15Å
239	S	42.6	Very low	42.6	Very low	128 Å²	128	138 Å²	138	90%	0.895	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	15.1	179.1	-44.7	0	0	0	0	114.7
240	R	46.4	Very low	43	Very low	186 Å²	186	134.6 Å²	134.6	70%	0.702	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	3.9	-176.7	-66.8	-175.8	84.4	-164	5.9	114.8	D237 A238 R242	D237-R240 WeakPolarHBondContact OD1-CD 3.35Å; A238-R240 PolarHBondContact O-N 3.15Å; R240-R242 PolarHBondContact O-N 2.99Å
241	L	43.1	Very low	43.2	Very low	167 Å²	167	132.3 Å²	132.3	87%	0.874	73%	0.73	S	S	*	*			trans	-77.3	80.4	167.1	-97.9	153.9	0	0	0	110.3	V243	L241-V243 PolarHBondContact O-N 3.44Å; L241-V243 VanDerWaalsContact O-N 3.17Å
242	R	43	Very low	43.2	Very low	212 Å²	212	128.8 Å²	128.8	80%	0.8	73%	0.725	S	S	*	*			trans	-53.3	107.3	166.9	-67.5	174.6	169.7	-177.6	-4.8	109.7	R240	R240-R242 PolarHBondContact O-N 2.99Å
243	V	44.4	Very low	43.5	Very low	126 Å²	126	123.4 Å²	123.4	76%	0.764	71%	0.709	S	S	*	*			trans	-94.4	89.1	150.3	-173.6	0	0	0	0	106.5	L241 A245	L241-V243 PolarHBondContact O-N 3.44Å; L241-V243 VanDerWaalsContact O-N 3.17Å; V243-A245 HydrophobicContact CG1-CB 3.74Å; V243-A245 PolarHBondContact O-N 2.86Å
244	S	39	Very low	43.9	Very low	115 Å²	115	126.4 Å²	126.4	80%	0.804	72%	0.718	S	S	*	*			trans	-68.1	67.9	168.8	-60.4	0	0	0	0	110.5
245	A	47.9	Very low	44.3	Very low	73 Å²	73	124.6 Å²	124.6	60%	0.603	71%	0.712	S	S	*	*			trans	-133.7	8.5	-178.4	0	0	0	0	0	115.4	V243	V243-A245 HydrophobicContact CG1-CB 3.74Å; V243-A245 PolarHBondContact O-N 2.86Å
246	L	45.5	Very low	44.2	Very low	151 Å²	151	128.2 Å²	128.2	79%	0.791	72%	0.719	S	S	*	*			trans	-124.4	76	170.4	-71.1	171.8	0	0	0	109.2	T248	L246-T248 HydrophobicContact CB-CG2 4.42Å; L246-T248 PolarHBondContact O-N 3.08Å
247	D	40.8	Very low	44.5	Very low	123 Å²	123	129 Å²	129	66%	0.658	72%	0.716	S	S	*	*			trans	-74.2	83.5	162.6	-170.7	7.4	0	0	0	108.4	S249	D247-S249 VanDerWaalsContact CG-OG 3.29Å; D247-S249 PolarHBondContact O-N 2.8Å; D247-S249 WeakPolarHBondContact OD1-CB 3.36Å; D247-S249 PolarHBondContact OD1-N 3.23Å; D247-S249 PolarHBondContact OD1-OG 2.88Å; D247-S249 PolarHBondContact OD2-OG 3Å
248	T	50.5	Low	44.6	Very low	83 Å²	83	131 Å²	131	51%	0.509	72%	0.721	S	S	.	*	G	3₁₀ helix	trans	-80.7	10.8	174.5	51.6	0	0	0	0	112.5	L246 V250 I251	L246-T248 HydrophobicContact CB-CG2 4.42Å; L246-T248 PolarHBondContact O-N 3.08Å; T248-V250 PolarHBondContact O-N 3.41Å; T248-I251 HydrophobicContact CG2-CD1 4.1Å; T248-I251 PolarHBondContact O-N 3.26Å; T248-I251 VanDerWaalsContact O-N 3.07Å
249	S	48.4	Very low	44.6	Very low	80 Å²	80	131.2 Å²	131.2	56%	0.559	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-63.1	-11.5	176.8	70.2	0	0	0	0	113.7	D247	D247-S249 VanDerWaalsContact CG-OG 3.29Å; D247-S249 PolarHBondContact O-N 2.8Å; D247-S249 WeakPolarHBondContact OD1-CB 3.36Å; D247-S249 PolarHBondContact OD1-N 3.23Å; D247-S249 PolarHBondContact OD1-OG 2.88Å; D247-S249 PolarHBondContact OD2-OG 3Å
250	V	49.2	Very low	44.5	Very low	95 Å²	95	135.3 Å²	135.3	58%	0.576	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-85	-19.5	176.1	-146.2	0	0	0	0	113.2	T248 S252 S253	T248-V250 PolarHBondContact O-N 3.41Å; V250-S252 VanDerWaalsContact C-N 3.33Å; V250-S252 PolarHBondContact O-N 3.22Å; V250-S253 PolarHBondContact O-N 2.98Å; V250-S253 PolarHBondContact O-OG 2.95Å
251	I	47.9	Very low	44.1	Very low	123 Å²	123	130.5 Å²	130.5	63%	0.631	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-74.8	-26.1	-178.9	-59	177.6	0	0	0	111.2	T248 S253	T248-I251 HydrophobicContact CG2-CD1 4.1Å; T248-I251 PolarHBondContact O-N 3.26Å; T248-I251 VanDerWaalsContact O-N 3.07Å; I251-S253 PolarHBondContact O-N 2.95Å
252	S	46.3	Very low	43.9	Very low	100 Å²	100	131.8 Å²	131.8	70%	0.699	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-77.7	2.6	177.3	-54.3	0	0	0	0	114.7	V250	V250-S252 VanDerWaalsContact C-N 3.33Å; V250-S252 PolarHBondContact O-N 3.22Å
253	S	46.6	Very low	43.8	Very low	79 Å²	79	127.2 Å²	127.2	55%	0.552	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-99.9	-6.7	-177.4	69.2	0	0	0	0	115.1	V250 I251	V250-S253 PolarHBondContact O-N 2.98Å; V250-S253 PolarHBondContact O-OG 2.95Å; I251-S253 PolarHBondContact O-N 2.95Å
254	L	42.6	Very low	43.2	Very low	155 Å²	155	128.8 Å²	128.8	81%	0.812	71%	0.709	S	S	*	*	S	Bend	trans	-96.7	5.2	-178.3	-94.3	126.8	0	0	0	115.4
255	V	47.1	Very low	43.3	Very low	133 Å²	133	133 Å²	133	81%	0.806	71%	0.713	S	S	*	*	S	Bend	trans	-122.9	43.6	-178.7	-165.6	0	0	0	0	111.6
256	K	41.4	Very low	42.7	Very low	187 Å²	187	136.3 Å²	136.3	81%	0.813	72%	0.721	S	S	*	*			trans	-129.8	81	173.1	-83.2	-174.4	177.7	175.5	0	111.4
257	K	45	Very low	42.6	Very low	180 Å²	180	140 Å²	140	78%	0.783	73%	0.726	S	S	*	*	S	Bend	trans	-162.2	120.2	144.3	-118.4	178	176.8	-176.2	0	109.8
258	E	40.7	Very low	42.6	Very low	168 Å²	168	142.5 Å²	142.5	79%	0.785	73%	0.733	S	S	*	*			trans	68.5	130.9	164.8	-67.4	150.4	-160.1	0	0	115.4
259	S	39.3	Very low	41.8	Very low	91 Å²	91	147.3 Å²	147.3	64%	0.636	75%	0.75	S	S	*	*			cis	-175.5	132.4	4.6	-97.4	0	0	0	0	108
260	Y	38.9	Very low	41.5	Very low	214 Å²	214	148.9 Å²	148.9	84%	0.839	76%	0.761	S	S	*	*			trans	56.8	115.3	145.7	-67.3	-86.8	0	0	0	123.3
261	S	37.7	Very low	41	Very low	86 Å²	86	150.8 Å²	150.8	60%	0.601	77%	0.768	S	S	*	*			trans	59	125.3	135.8	60.8	0	0	0	0	119.1
262	F	39.8	Very low	40.8	Very low	193 Å²	193	151.7 Å²	151.7	85%	0.846	78%	0.779	S	S	*	*				-161.5	162.5	62.2	-91.5	-88	0	0	0	111.9
263	P	40.2	Very low	40.5	Very low	116 Å²	116	156 Å²	156	75%	0.753	79%	0.789	S	S	*	*			trans	-92.3	154.3	-166	35.2	-31	0	0	0	115.7
264	L	33.5	Very low	40.3	Very low	159 Å²	159	163.4 Å²	163.4	83%	0.832	80%	0.804	S	S	*	*			trans	-39.3	135.4	172	-87.9	76.8	0	0	0	114.8
265	K	40.5	Very low	40	Very low	204 Å²	204	163.2 Å²	163.2	89%	0.887	80%	0.804	S	S	*	*			trans	-142.2	136.1	138.1	-80.1	-166	179.1	176.3	0	111.7
266	N	35.8	Very low	39.8	Very low	143 Å²	143	162.6 Å²	162.6	77%	0.765	81%	0.805	S	S	*	*			trans	-48.5	143.4	-179.3	-51.4	-51.9	0	0	0	113.8
267	Y	42.4	Very low	39.9	Very low	229 Å²	229	160 Å²	160	90%	0.898	80%	0.804	S	S	*	*			trans	-134.9	131.6	148.4	-109.5	-85.7	0	0	0	110.9
268	E	41.2	Very low	39.7	Very low	174 Å²	174	158.5 Å²	158.5	81%	0.813	80%	0.802	S	S	*	*			trans	-65.3	146	-176.4	-72.1	164	131	0	0	112.7
269	Q	34.2	Very low	40	Very low	184 Å²	184	158.3 Å²	158.3	86%	0.86	81%	0.806	S	S	*	*			trans	-51.7	128.1	162.8	-170.4	173.6	-2	0	0	111.2
270	S	42.2	Very low	40.1	Very low	114 Å²	114	160.6 Å²	160.6	80%	0.797	81%	0.809	S	S	*	*			trans	-135.6	122.2	159.2	35.2	0	0	0	0	110.1
271	D	38.5	Very low	40.2	Very low	134 Å²	134	158.4 Å²	158.4	72%	0.717	81%	0.811	S	S	*	*			trans	-56.6	139.4	173.9	-68.5	-55.3	0	0	0	111.8
272	T	43.6	Very low	40.5	Very low	142 Å²	142	160.3 Å²	160.3	87%	0.871	82%	0.819	S	S	*	*				164.9	97.4	118	35.6	0	0	0	0	110.6
273	Q	39.1	Very low	40.6	Very low	191 Å²	191	157.5 Å²	157.5	89%	0.893	82%	0.818	S	S	*	*			trans	-116.6	93.5	156.9	-164.3	177.4	7.6	0	0	107.3
274	R	41.9	Very low	40.6	Very low	235 Å²	235	159.3 Å²	159.3	89%	0.887	82%	0.82	S	S	*	*			trans	-124.3	106.9	160.5	-90.1	-170.2	-172.9	165.1	3.7	106.5
275	D	37.8	Very low	41.2	Very low	150 Å²	150	158 Å²	158	80%	0.802	82%	0.822	S	S	*	*			trans	170.9	88.6	134.3	-88.5	-13.3	0	0	0	108.4
276	C	41.1	Very low	41.3	Very low	121 Å²	121	151.5 Å²	151.5	82%	0.818	81%	0.813	S	S	*	*			trans	-131.4	94.8	155.9	-76.5	0	0	0	0	105.9	M278	C276-M278 PolarHBondContact O-N 3.44Å
277	T	45.3	Very low	41.6	Very low	132 Å²	132	152.9 Å²	152.9	81%	0.81	82%	0.815	S	S	*	*			trans	-59.3	117.7	176	-31.2	0	0	0	0	108.7	N279	T277-N279 PolarHBondContact O-N 2.86Å
278	M	39.7	Very low	41.7	Very low	149 Å²	149	148.1 Å²	148.1	73%	0.734	81%	0.806	S	S	*	*			trans	-68.5	124.5	167.2	-76.8	-169.7	165.4	0	0	109.1	C276 M280	C276-M278 PolarHBondContact O-N 3.44Å; M278-M280 HydrophobicContact CE-CE 4.29Å; M278-M280 HydrophobicContact SD-CE 4.35Å
279	N	46.3	Very low	41.7	Very low	163 Å²	163	147.9 Å²	147.9	87%	0.872	81%	0.81	S	S	*	*			trans	-127.9	95.4	146.9	-85.1	-21.5	0	0	0	106.2	T277	T277-N279 PolarHBondContact O-N 2.86Å
280	M	42.8	Very low	42.2	Very low	140 Å²	140	143.8 Å²	143.8	69%	0.69	81%	0.808	S	S	*	*			trans	-78.6	130.3	159.9	-69	-164.2	-149.6	0	0	107.3	M278	M278-M280 HydrophobicContact CE-CE 4.29Å; M278-M280 HydrophobicContact SD-CE 4.35Å
281	D	40	Very low	42.6	Very low	167 Å²	167	144.2 Å²	144.2	89%	0.893	81%	0.81	S	S	*	*			trans	-147.6	103	138.5	-95.6	-31.3	0	0	0	107.3
282	V	45.6	Very low	43.1	Very low	127 Å²	127	142.4 Å²	142.4	77%	0.77	81%	0.808	S	S	*	*			trans	-81.5	123	173.8	169.2	0	0	0	0	107.9	I284	V282-I284 PolarHBondContact O-N 2.83Å
283	T	39.8	Very low	43.5	Very low	134 Å²	134	149.6 Å²	149.6	82%	0.822	82%	0.822	S	S	*	*			trans	-63.9	112.8	174.6	-46	0	0	0	0	111.7
284	I	41.5	Very low	43.7	Very low	153 Å²	153	147.6 Å²	147.6	79%	0.785	82%	0.818	S	S	*	*			trans	-153.8	104.2	145.2	-49.7	-178.9	0	0	0	109.1	V282	V282-I284 PolarHBondContact O-N 2.83Å
285	C	45.2	Very low	43.8	Very low	131 Å²	131	142.9 Å²	142.9	89%	0.885	82%	0.815	S	S	*	*			trans	-154	98.6	147.9	-95.9	0	0	0	0	106.7
286	G	42.7	Very low	44.1	Very low	68 Å²	68	142.6 Å²	142.6	70%	0.701	82%	0.815	S	S	*	*			trans	-75	134.6	159.5	0	0	0	0	0	108.5
287	E	43.6	Very low	44.3	Very low	173 Å²	173	143.8 Å²	143.8	81%	0.808	82%	0.815	S	S	*	*			trans	172	128.7	132.8	-97.3	178	-173.5	0	0	108.6
288	N	43.4	Very low	44.3	Very low	129 Å²	129	144.6 Å²	144.6	69%	0.69	82%	0.815	S	S	*	*			trans	60.7	111	149.4	-52.7	-29.8	0	0	0	117.7
289	D	41.9	Very low	44.6	Very low	168 Å²	168	144.3 Å²	144.3	90%	0.898	82%	0.821	S	S	*	*				-160.5	135.7	106.2	-97.9	-26.3	0	0	0	112.7
290	A	43.5	Very low	44.4	Very low	99 Å²	99	142.9 Å²	142.9	82%	0.818	82%	0.817	S	S	*	*			trans	-63.7	141.4	168.8	0	0	0	0	0	110.7
291	S	51	Low	44.6	Very low	122 Å²	122	143.2 Å²	143.2	85%	0.853	83%	0.827	S	S	*	*			trans	-143.7	123.9	148.8	91.5	0	0	0	0	110.8
292	S	49.4	Very low	45	Very low	97 Å²	97	141.2 Å²	141.2	68%	0.678	82%	0.821	S	S	*	*			trans	-48.4	127.4	169.8	165.7	0	0	0	0	114.1
293	Y	51.7	Low	44.9	Very low	293 Å²	293	142.5 Å²	142.5	100%	1.149	83%	0.826	S	S	*	*				-178	0	113.2	-109.9	-81	0	0	0	110.1

Retrieved 293 of 293 residues in 401.8 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).