A0A087Y605_POEFO Loading...

Cytochrome b-c1 complex subunit 7

Component of the ubiquinol-cytochrome c oxidoreductase, a multisubunit transmembrane complex that is part of the mitochondrial electron transport chain which drives oxidative phosphorylation.

AlphaFold DB , UniProt , Accession A0A087Y605, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 110 aa.

						>A0A087Y605_POEFO|A0A087Y605
MASRAPAATGRLMLGVRKWYYNLCGFNKLGLMRDDTIYEDSDVKEALRRLPENVYNDRTFRMKRAFDLSMKQQILPKDQWTKYEEDVNYLTPYLEEVIRERKEREEWMKK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.8	Very low	61.6	Low	242 Å²	242	122.3 Å²	122.3	100%	1.192	72%	0.724	S	S	*	*				0	93.5	0	-70	-69.1	-134.6	0	0	108.4	S3	M1-S3 PolarHBondContact O-N 3.28Å
2	A	48.8	Very low	63.5	Low	104 Å²	104	122.4 Å²	122.4	86%	0.86	72%	0.718	S	S	*	*			trans	-74	109.7	174	0	0	0	0	0	108.1	R4	A2-R4 PolarHBondContact O-N 3.31Å; A2-R4 VanDerWaalsContact O-N 3.12Å
3	S	57.2	Low	65.4	Low	117 Å²	117	120.6 Å²	120.6	82%	0.818	70%	0.7	S	S	*	*			trans	-61.3	114	173	45.2	0	0	0	0	108.2	M1 A5	M1-S3 PolarHBondContact O-N 3.28Å; S3-A5 PolarHBondContact O-N 3.49Å; S3-A5 VanDerWaalsContact O-N 3.09Å
4	R	61.5	Low	67.1	Low	241 Å²	241	118.6 Å²	118.6	91%	0.909	68%	0.684	S	S	*	*			trans	-62.7	114.4	171.2	-73.9	-178	167.9	-171.8	-3.5	107	A2	A2-R4 PolarHBondContact O-N 3.31Å; A2-R4 VanDerWaalsContact O-N 3.12Å
5	A	59.7	Low	68.7	Low	84 Å²	84	113.5 Å²	113.5	69%	0.694	67%	0.668	S	S	*	*			trans	-51.9	135.3	173.6	0	0	0	0	0	109.2	S3 A7	S3-A5 PolarHBondContact O-N 3.49Å; S3-A5 VanDerWaalsContact O-N 3.09Å; A5-A7 PolarHBondContact O-N 2.95Å
6	P	58	Low	70.3	Confident	85 Å²	85	111.3 Å²	111.3	55%	0.552	66%	0.656	S	S	*	*			trans	-63.6	134.4	-177.1	22.9	-29	0	0	0	109.6	A8 T9	P6-A8 PolarHBondContact O-N 3.31Å; P6-T9 PolarHBondContact O-N 2.87Å
7	A	62.7	Low	71.6	Confident	84 Å²	84	113.2 Å²	113.2	69%	0.694	65%	0.649	S	S	*	*	H	α-helix	trans	-54.2	-23	-176.7	0	0	0	0	0	113.8	A5 G10 R11	A5-A7 PolarHBondContact O-N 2.95Å; A7-G10 PolarHBondContact O-N 3.29Å; A7-R11 PolarHBondContact O-N 3.22Å
8	A	65.4	Low	72.9	Confident	74 Å²	74	111.8 Å²	111.8	61%	0.612	64%	0.635	S	S	*	*	H	α-helix	trans	-64.7	-38.5	174.4	0	0	0	0	0	113.4	P6 G10 R11 L12	P6-A8 PolarHBondContact O-N 3.31Å; A8-G10 VanDerWaalsContact C-N 3.31Å; A8-G10 PolarHBondContact O-N 2.95Å; A8-R11 PolarHBondContact O-N 2.87Å; A8-L12 PolarHBondContact O-N 3.46Å
9	T	68.8	Low	74	Confident	75 Å²	75	114.6 Å²	114.6	46%	0.46	63%	0.634	S	S	.	*	H	α-helix	trans	-65.9	-36.2	178.8	-53.6	0	0	0	0	111.3	P6 M13	P6-T9 PolarHBondContact O-N 2.87Å; T9-M13 VanDerWaalsContact O-CG 3.32Å; T9-M13 WeakPolarHBondContact O-CG 3.18Å; T9-M13 PolarHBondContact O-N 2.83Å; T9-M13 VanDerWaalsContact O-N 3.14Å
10	G	77	Confident	75.1	Confident	41 Å²	41	116.1 Å²	116.1	42%	0.423	63%	0.631	S	S	.	*	H	α-helix	trans	-62.8	-43.6	175.7	0	0	0	0	0	113	A7 A8 M13 L14	A7-G10 PolarHBondContact O-N 3.29Å; A8-G10 VanDerWaalsContact C-N 3.31Å; A8-G10 PolarHBondContact O-N 2.95Å; G10-M13 PolarHBondContact O-N 3.46Å; G10-L14 WeakPolarHBondContact O-CG 3.39Å; G10-L14 PolarHBondContact O-N 2.73Å
11	R	80.1	Confident	76	Confident	198 Å²	198	111.3 Å²	111.3	75%	0.747	60%	0.604	S	S	*	*	H	α-helix	trans	-66.2	-40.4	179	-70.4	-177.9	-179.2	-171.1	-0.2	112.7	A7 A8 L14 G15	A7-R11 PolarHBondContact O-N 3.22Å; A8-R11 PolarHBondContact O-N 2.87Å; R11-L14 PolarHBondContact O-N 3.14Å; R11-G15 PolarHBondContact O-N 3.15Å; R11-G15 VanDerWaalsContact O-N 3.07Å
12	L	84.3	Confident	78.6	Confident	124 Å²	124	103.2 Å²	103.2	65%	0.649	57%	0.565	S	S	*	*	H	α-helix	trans	-61.6	-46.3	175.9	-177.8	64.7	0	0	0	111.2	A8 L14 G15 V16	A8-L12 PolarHBondContact O-N 3.46Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L12-L14 PolarHBondContact O-N 2.99Å; L12-G15 PolarHBondContact O-N 3.48Å; L12-G15 VanDerWaalsContact O-N 3.16Å; L12-V16 PolarHBondContact O-N 2.73Å; L12-V16 VanDerWaalsContact O-N 3.07Å
13	M	87.8	Confident	80.9	Confident	99 Å²	99	103.5 Å²	103.5	49%	0.488	55%	0.552	S	S	.	*	H	α-helix	trans	-62.8	-37.9	178.1	-71.2	-64.5	-74.9	0	0	112.6	T9 G10 V16 R17	T9-M13 VanDerWaalsContact O-CG 3.32Å; T9-M13 WeakPolarHBondContact O-CG 3.18Å; T9-M13 PolarHBondContact O-N 2.83Å; T9-M13 VanDerWaalsContact O-N 3.14Å; G10-M13 PolarHBondContact O-N 3.46Å; M13-V16 PolarHBondContact O-N 2.96Å; M13-R17 WeakPolarHBondContact O-CB 3.48Å; M13-R17 VanDerWaalsContact O-CG 3.27Å; M13-R17 WeakPolarHBondContact O-CG 3.04Å; M13-R17 PolarHBondContact O-N 3.42Å
14	L	88.8	Confident	82.6	Confident	92 Å²	92	100.8 Å²	100.8	48%	0.482	53%	0.532	S	S	.	.	H	α-helix	trans	-63.4	-40.7	173.8	-71.4	171.3	0	0	0	111.9	G10 R11 L12 R17 K18	G10-L14 WeakPolarHBondContact O-CG 3.39Å; G10-L14 PolarHBondContact O-N 2.73Å; R11-L14 PolarHBondContact O-N 3.14Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L12-L14 PolarHBondContact O-N 2.99Å; L14-R17 PolarHBondContact O-N 3.38Å; L14-K18 WeakPolarHBondContact O-CB 3.36Å; L14-K18 PolarHBondContact O-N 2.83Å
15	G	92	Very high	84.2	Confident	43 Å²	43	90.2 Å²	90.2	44%	0.443	50%	0.498	S	S	.	.	H	α-helix	trans	-59.8	-46.7	174.9	0	0	0	0	0	112.5	R11 L12 K18 W19	R11-G15 PolarHBondContact O-N 3.15Å; R11-G15 VanDerWaalsContact O-N 3.07Å; L12-G15 PolarHBondContact O-N 3.48Å; L12-G15 VanDerWaalsContact O-N 3.16Å; G15-K18 PolarHBondContact O-N 3.34Å; G15-W19 WeakPolarHBondContact O-CB 3.03Å; G15-W19 PolarHBondContact O-N 3.11Å
16	V	93.6	Very high	85.9	Confident	78 Å²	78	87.4 Å²	87.4	47%	0.473	47%	0.47	S	S	.	.	H	α-helix	trans	-62.8	-43	176.7	176.2	0	0	0	0	111.5	L12 M13 W19 Y20	L12-V16 PolarHBondContact O-N 2.73Å; L12-V16 VanDerWaalsContact O-N 3.07Å; M13-V16 PolarHBondContact O-N 2.96Å; V16-W19 PolarHBondContact O-N 2.81Å; V16-Y20 PolarHBondContact O-N 2.83Å
17	R	93.2	Very high	87.6	Confident	144 Å²	144	83.5 Å²	83.5	54%	0.543	44%	0.444	S	S	.	.	H	α-helix	trans	-62.1	-45.3	177	-74	172.8	178.4	-170.5	-0.6	112.4	M13 L14 W19 Y20 Y21	M13-R17 WeakPolarHBondContact O-CB 3.48Å; M13-R17 VanDerWaalsContact O-CG 3.27Å; M13-R17 WeakPolarHBondContact O-CG 3.04Å; M13-R17 PolarHBondContact O-N 3.42Å; L14-R17 PolarHBondContact O-N 3.38Å; R17-W19 VanDerWaalsContact C-N 3.33Å; R17-W19 PolarHBondContact O-N 3.38Å; R17-Y20 PolarHBondContact O-N 2.92Å; R17-Y21 WeakPolarHBondContact O-CB 3.37Å; R17-Y21 PolarHBondContact O-N 3.4Å
18	K	94.1	Very high	89.2	Confident	88 Å²	88	83.4 Å²	83.4	38%	0.383	43%	0.428	S	S	.	.	H	α-helix	trans	-65.2	-37.3	177.5	-173.4	168.5	-176.6	168.2	0	111.6	L14 G15 N22 Y83 E84	L14-K18 WeakPolarHBondContact O-CB 3.36Å; L14-K18 PolarHBondContact O-N 2.83Å; G15-K18 PolarHBondContact O-N 3.34Å; K18-N22 PolarHBondContact O-N 3.44Å; K18-N22 PolarHBondContact O-ND2 3.02Å; K18-Y83 HydrophobicContact CB-CD1 4.19Å; K18-Y83 HydrophobicContact CB-CE1 4.36Å; K18-Y83 HydrophobicContact CB-CG 4.35Å; K18-Y83 HydrophobicContact CD-CD1 4.13Å; K18-Y83 HydrophobicContact CD-CG 4.46Å; K18-Y83 HydrophobicContact CG-CD1 4.06Å; K18-Y83 HydrophobicContact CG-CG 4.03Å; K18-E84 IonicContact NZ-OE1 2.8Å; K18-E84 PolarHBondContact NZ-OE1 3.42Å
19	W	94.2	Very high	90.7	Very high	165 Å²	165	81.9 Å²	81.9	63%	0.625	41%	0.41	S	S	*	.	H	α-helix	trans	-62.8	-50.1	173.3	174	80.2	0	0	0	111.5	G15 V16 R17 Y21 N22 L23	G15-W19 WeakPolarHBondContact O-CB 3.03Å; G15-W19 PolarHBondContact O-N 3.11Å; V16-W19 PolarHBondContact O-N 2.81Å; R17-W19 VanDerWaalsContact C-N 3.33Å; R17-W19 PolarHBondContact O-N 3.38Å; W19-Y21 PolarHBondContact O-N 3.42Å; W19-N22 PolarHBondContact O-N 2.92Å; W19-L23 HydrophobicContact CH2-CD2 4.09Å; W19-L23 HydrophobicContact CZ2-CD2 4.41Å; W19-L23 HydrophobicContact CZ3-CD2 4.5Å; W19-L23 PolarHBondContact O-N 2.79Å
20	Y	95.4	Very high	92	Very high	144 Å²	144	78.3 Å²	78.3	57%	0.565	39%	0.388	S	S	*	.	H	α-helix	trans	-61.9	-41.6	179.1	-177.3	-108.2	0	0	0	112.5	V16 R17 N22 L23 C24	V16-Y20 PolarHBondContact O-N 2.83Å; R17-Y20 PolarHBondContact O-N 2.92Å; Y20-N22 VanDerWaalsContact C-N 3.31Å; Y20-N22 PolarHBondContact O-N 3.26Å; Y20-L23 HydrophobicContact CD2-CD2 4.49Å; Y20-L23 WeakPolarHBondContact O-CA 3.49Å; Y20-L23 VanDerWaalsContact O-CB 3.28Å; Y20-L23 WeakPolarHBondContact O-CB 3.46Å; Y20-L23 PolarHBondContact O-N 3.47Å; Y20-C24 PolarHBondContact O-N 2.91Å; Y20-C24 VanDerWaalsContact O-N 3.13Å; Y20-C24 PolarHBondContact O-SG 3.31Å
21	Y	94.9	Very high	92.9	Very high	16 Å²	16	77.1 Å²	77.1	6%	0.063	37%	0.372	C	S	.	.	H	α-helix	trans	-53.1	-46.7	174.6	177.1	-88.8	0	0	0	112.6	R17 W19 L23 C24 F26 N27 T81 Y83 D86	R17-Y21 WeakPolarHBondContact O-CB 3.37Å; R17-Y21 PolarHBondContact O-N 3.4Å; W19-Y21 PolarHBondContact O-N 3.42Å; Y21-L23 VanDerWaalsContact C-N 3.26Å; Y21-L23 PolarHBondContact O-N 3.36Å; Y21-C24 PolarHBondContact O-N 2.96Å; Y21-F26 HydrophobicContact CD2-CE1 4.41Å; Y21-F26 HydrophobicContact CD2-CE2 4.2Å; Y21-F26 AromaticContact CD2-CZ 3.52Å; Y21-F26 HydrophobicContact CD2-CZ 3.52Å; Y21-F26 HydrophobicContact CE2-CE1 4.39Å; Y21-F26 AromaticContact CE2-CE2 3.42Å; Y21-F26 HydrophobicContact CE2-CE2 3.42Å; Y21-F26 VanDerWaalsContact CE2-CE2 3.42Å; Y21-F26 AromaticContact CE2-CZ 3.19Å; Y21-F26 HydrophobicContact CE2-CZ 3.19Å; Y21-F26 HydrophobicContact CG-CZ 4.35Å; Y21-F26 AromaticContact CZ-CE2 3.58Å; Y21-F26 AromaticContact CZ-CZ 3.79Å; Y21-N27 HydrophobicContact CE1-CB 4.02Å; Y21-T81 WeakPolarHBondContact OH-CG2 3.41Å; Y21-Y83 AromaticContact CD1-CD2 3.89Å; Y21-Y83 HydrophobicContact CD1-CD2 3.89Å; Y21-Y83 HydrophobicContact CD1-CG 4.49Å; Y21-Y83 AromaticContact CD2-CD2 3.65Å; Y21-Y83 HydrophobicContact CD2-CD2 3.65Å; Y21-Y83 HydrophobicContact CD2-CE2 4.12Å; Y21-Y83 HydrophobicContact CE1-CD2 4.43Å; Y21-Y83 HydrophobicContact CE2-CD2 4.19Å; Y21-Y83 AromaticContact CG-CD2 3.48Å; Y21-Y83 HydrophobicContact CG-CD2 3.48Å; Y21-Y83 VanDerWaalsContact CG-CD2 3.48Å; Y21-Y83 HydrophobicContact CG-CE2 4.16Å; Y21-Y83 HydrophobicContact CG-CG 4.46Å; Y21-D86 HydrophobicContact CE2-CB 4.19Å; Y21-D86 VanDerWaalsContact CE2-OD2 3.27Å; Y21-D86 WeakPolarHBondContact CE2-OD2 3.4Å
22	N	93.8	Very high	93.6	Very high	72 Å²	72	69.2 Å²	69.2	39%	0.385	34%	0.344	S	S	.	.	H	α-helix	trans	-70.2	-24	178.9	-71.5	-56.2	0	0	0	113	K18 W19 Y20 N27	K18-N22 PolarHBondContact O-N 3.44Å; K18-N22 PolarHBondContact O-ND2 3.02Å; W19-N22 PolarHBondContact O-N 2.92Å; Y20-N22 VanDerWaalsContact C-N 3.31Å; Y20-N22 PolarHBondContact O-N 3.26Å; N22-N27 PolarHBondContact OD1-ND2 3.38Å
23	L	95.6	Very high	94.2	Very high	110 Å²	110	67.8 Å²	67.8	58%	0.576	33%	0.33	S	S	*	.	H	α-helix	trans	-73.7	-33.9	176.7	-166.7	74.2	0	0	0	111.7	W19 Y20 Y21 G25	W19-L23 HydrophobicContact CH2-CD2 4.09Å; W19-L23 HydrophobicContact CZ2-CD2 4.41Å; W19-L23 HydrophobicContact CZ3-CD2 4.5Å; W19-L23 PolarHBondContact O-N 2.79Å; Y20-L23 HydrophobicContact CD2-CD2 4.49Å; Y20-L23 WeakPolarHBondContact O-CA 3.49Å; Y20-L23 VanDerWaalsContact O-CB 3.28Å; Y20-L23 WeakPolarHBondContact O-CB 3.46Å; Y20-L23 PolarHBondContact O-N 3.47Å; Y21-L23 VanDerWaalsContact C-N 3.26Å; Y21-L23 PolarHBondContact O-N 3.36Å; L23-G25 PolarHBondContact O-N 3.26Å
24	C	94	Very high	94.6	Very high	60 Å²	60	63.5 Å²	63.5	41%	0.405	31%	0.309	S	S	.	.	S	Bend	trans	-62	-22.4	-179.5	-62.9	0	0	0	0	113.9	Y20 Y21 F26	Y20-C24 PolarHBondContact O-N 2.91Å; Y20-C24 VanDerWaalsContact O-N 3.13Å; Y20-C24 PolarHBondContact O-SG 3.31Å; Y21-C24 PolarHBondContact O-N 2.96Å; C24-F26 HydrophobicContact CB-CD1 3.48Å; C24-F26 VanDerWaalsContact CB-CD1 3.48Å; C24-F26 HydrophobicContact CB-CE1 3.46Å; C24-F26 VanDerWaalsContact CB-CE1 3.46Å; C24-F26 PolarHBondContact O-N 3.37Å; C24-F26 VanDerWaalsContact O-N 3.09Å
25	G	93.8	Very high	94.9	Very high	19 Å²	19	59.4 Å²	59.4	20%	0.196	29%	0.287	C	S	.	.			trans	77.7	-11.1	167.7	0	0	0	0	0	116.7	L23 N27 K28	L23-G25 PolarHBondContact O-N 3.26Å; G25-N27 VanDerWaalsContact C-OD1 3.3Å; G25-N27 WeakPolarHBondContact CA-OD1 3.49Å; G25-N27 PolarHBondContact O-N 2.99Å; G25-N27 PolarHBondContact O-OD1 3.38Å; G25-K28 WeakPolarHBondContact O-CB 3.39Å; G25-K28 PolarHBondContact O-N 2.94Å
26	F	95.8	Very high	95.1	Very high	24 Å²	24	60.9 Å²	60.9	11%	0.105	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-62.8	-27.4	176	64.3	-101.7	0	0	0	112.8	Y21 C24 K28 L29 G30 L31 R33 T36	Y21-F26 HydrophobicContact CD2-CE1 4.41Å; Y21-F26 HydrophobicContact CD2-CE2 4.2Å; Y21-F26 AromaticContact CD2-CZ 3.52Å; Y21-F26 HydrophobicContact CD2-CZ 3.52Å; Y21-F26 HydrophobicContact CE2-CE1 4.39Å; Y21-F26 AromaticContact CE2-CE2 3.42Å; Y21-F26 HydrophobicContact CE2-CE2 3.42Å; Y21-F26 VanDerWaalsContact CE2-CE2 3.42Å; Y21-F26 AromaticContact CE2-CZ 3.19Å; Y21-F26 HydrophobicContact CE2-CZ 3.19Å; Y21-F26 HydrophobicContact CG-CZ 4.35Å; Y21-F26 AromaticContact CZ-CE2 3.58Å; Y21-F26 AromaticContact CZ-CZ 3.79Å; C24-F26 HydrophobicContact CB-CD1 3.48Å; C24-F26 VanDerWaalsContact CB-CD1 3.48Å; C24-F26 HydrophobicContact CB-CE1 3.46Å; C24-F26 VanDerWaalsContact CB-CE1 3.46Å; C24-F26 PolarHBondContact O-N 3.37Å; C24-F26 VanDerWaalsContact O-N 3.09Å; F26-K28 PolarHBondContact O-N 3.22Å; F26-L29 CarbonylContact O-C 3.58Å; F26-L29 PolarHBondContact O-N 3Å; F26-G30 PolarHBondContact O-N 3.45Å; F26-L31 HydrophobicContact CB-CB 4.12Å; F26-L31 HydrophobicContact CB-CD1 4.25Å; F26-L31 HydrophobicContact CD2-CB 4.39Å; F26-L31 PolarHBondContact O-N 2.9Å; F26-R33 HydrophobicContact CE2-CB 4.49Å; F26-R33 HydrophobicContact CZ-CB 4.33Å; F26-T36 HydrophobicContact CB-CG2 3.81Å; F26-T36 HydrophobicContact CD1-CG2 4.28Å; F26-T36 HydrophobicContact CG-CG2 3.99Å
27	N	95.2	Very high	95.2	Very high	3 Å²	3	60.1 Å²	60.1	2%	0.016	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-58.5	-33.1	172.3	63	-31.2	0	0	0	112.7	Y21 N22 G25 L29 G30 W80 T81	Y21-N27 HydrophobicContact CE1-CB 4.02Å; N22-N27 PolarHBondContact OD1-ND2 3.38Å; G25-N27 VanDerWaalsContact C-OD1 3.3Å; G25-N27 WeakPolarHBondContact CA-OD1 3.49Å; G25-N27 PolarHBondContact O-N 2.99Å; G25-N27 PolarHBondContact O-OD1 3.38Å; N27-L29 PolarHBondContact O-N 3.42Å; N27-G30 PolarHBondContact O-N 2.97Å; N27-G30 VanDerWaalsContact O-N 3.14Å; N27-W80 WeakPolarHBondContact O-CA 3.48Å; N27-T81 WeakPolarHBondContact CB-O 3.47Å; N27-T81 PolarHBondContact O-N 2.93Å
28	K	95.6	Very high	95.3	Very high	82 Å²	82	62.4 Å²	62.4	36%	0.357	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-71.7	-18.4	177	-54.3	-179.1	-178	172.2	0	113.2	G25 F26 I74 L75 W80	G25-K28 WeakPolarHBondContact O-CB 3.39Å; G25-K28 PolarHBondContact O-N 2.94Å; F26-K28 PolarHBondContact O-N 3.22Å; K28-I74 HydrophobicContact CB-CB 4.49Å; K28-I74 HydrophobicContact CB-CG2 4.44Å; K28-L75 WeakPolarHBondContact O-CB 3.09Å; K28-L75 PolarHBondContact O-N 3.46Å; K28-W80 HydrophobicContact CB-CD2 4.43Å; K28-W80 HydrophobicContact CB-CZ2 4.26Å; K28-W80 HydrophobicContact CD-CH2 4.02Å; K28-W80 HydrophobicContact CD-CZ2 4.18Å; K28-W80 HydrophobicContact CD-CZ3 4.45Å; K28-W80 HydrophobicContact CG-CD2 4.06Å; K28-W80 HydrophobicContact CG-CE3 4.06Å; K28-W80 HydrophobicContact CG-CH2 3.82Å; K28-W80 HydrophobicContact CG-CZ2 3.8Å; K28-W80 HydrophobicContact CG-CZ3 3.94Å
29	L	96.6	Very high	95.3	Very high	42 Å²	42	61.9 Å²	61.9	22%	0.22	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-98	1	174	-60.5	176.8	0	0	0	112	F26 N27 L31 A65 L68 L75	F26-L29 CarbonylContact O-C 3.58Å; F26-L29 PolarHBondContact O-N 3Å; N27-L29 PolarHBondContact O-N 3.42Å; L29-L31 HydrophobicContact CB-CD1 4.35Å; L29-L31 HydrophobicContact CB-CG 4.21Å; L29-L31 PolarHBondContact O-N 3Å; L29-A65 HydrophobicContact CB-CB 4.06Å; L29-L68 HydrophobicContact CD2-CB 3.89Å; L29-L68 HydrophobicContact CD2-CD1 4.29Å; L29-L75 VanDerWaalsContact O-CD1 3.29Å; L29-L75 WeakPolarHBondContact O-CD1 3.27Å
30	G	95.4	Very high	95.3	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.01	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	26.3	179.7	0	0	0	0	0	112.5	F26 N27 R64 L75 T81	F26-G30 PolarHBondContact O-N 3.45Å; N27-G30 PolarHBondContact O-N 2.97Å; N27-G30 VanDerWaalsContact O-N 3.14Å; G30-R64 PolarHBondContact O-NH2 3.48Å; G30-L75 VanDerWaalsContact N-CD1 3.3Å; G30-T81 WeakPolarHBondContact CA-OG1 3.47Å
31	L	96.7	Very high	95.4	Very high	16 Å²	16	54.5 Å²	54.5	8%	0.084	28%	0.279	C	S	.	.			trans	-81.5	155.6	171.3	-66.3	174.9	0	0	0	109.6	F26 L29 D35 T36 R61 A65 T81	F26-L31 HydrophobicContact CB-CB 4.12Å; F26-L31 HydrophobicContact CB-CD1 4.25Å; F26-L31 HydrophobicContact CD2-CB 4.39Å; F26-L31 PolarHBondContact O-N 2.9Å; L29-L31 HydrophobicContact CB-CD1 4.35Å; L29-L31 HydrophobicContact CB-CG 4.21Å; L29-L31 PolarHBondContact O-N 3Å; L31-D35 WeakPolarHBondContact CA-OD2 3.46Å; L31-D35 HydrophobicContact CB-CB 4.26Å; L31-D35 HydrophobicContact CD2-CB 3.95Å; L31-D35 WeakPolarHBondContact CD2-OD2 3.29Å; L31-T36 HydrophobicContact CD1-CG2 4.32Å; L31-R61 HydrophobicContact CD2-CB 4.4Å; L31-A65 HydrophobicContact CD1-CB 3.95Å; L31-A65 HydrophobicContact CD2-CB 3.56Å; L31-A65 HydrophobicContact CG-CB 3.79Å; L31-T81 WeakPolarHBondContact O-CB 3.36Å; L31-T81 PolarHBondContact O-OG1 3.34Å
32	M	95.6	Very high	95.5	Very high	32 Å²	32	54.3 Å²	54.3	16%	0.158	28%	0.279	C	S	.	.			trans	-96.8	161.3	165	-60.1	179.7	86.8	0	0	108.8	D34 D35 R61 D86 V87 Y89	M32-D34 VanDerWaalsContact C-N 3.26Å; M32-D34 PolarHBondContact O-N 3.3Å; M32-D35 PolarHBondContact N-OD2 3.32Å; M32-D35 VanDerWaalsContact O-CB 3.3Å; M32-D35 WeakPolarHBondContact O-CB 3.42Å; M32-D35 PolarHBondContact O-N 2.91Å; M32-R61 PolarHBondContact SD-NH1 3.24Å; M32-D86 WeakPolarHBondContact CA-OD1 3.21Å; M32-D86 VanDerWaalsContact CB-OD1 3.23Å; M32-D86 WeakPolarHBondContact CB-OD1 3.41Å; M32-V87 HydrophobicContact CE-CB 3.93Å; M32-V87 WeakPolarHBondContact CE-O 3.27Å; M32-Y89 HydrophobicContact CB-CE1 4.12Å; M32-Y89 HydrophobicContact CE-CD1 4.44Å; M32-Y89 HydrophobicContact SD-CD1 4.03Å; M32-Y89 HydrophobicContact SD-CE1 4.02Å
33	R	95.3	Very high	95.6	Very high	93 Å²	93	51 Å²	51	35%	0.351	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-56.2	-42.4	-177.9	178.2	-160.8	74.2	161.9	10	112.3	F26 D35 T36 D86 N88 T91	F26-R33 HydrophobicContact CE2-CB 4.49Å; F26-R33 HydrophobicContact CZ-CB 4.33Å; R33-D35 PolarHBondContact O-N 3.09Å; R33-T36 PolarHBondContact O-N 3.39Å; R33-T36 PolarHBondContact O-OG1 2.85Å; R33-D86 WeakPolarHBondContact CB-OD2 3.32Å; R33-D86 PolarHBondContact N-OD1 2.97Å; R33-D86 PolarHBondContact N-OD2 3.17Å; R33-N88 VanDerWaalsContact CZ-ND2 3.34Å; R33-N88 PolarHBondContact NE-OD1 2.99Å; R33-N88 PolarHBondContact NH1-ND2 3.42Å; R33-N88 VanDerWaalsContact NH1-ND2 3.1Å; R33-N88 PolarHBondContact NH1-OD1 2.95Å; R33-N88 VanDerWaalsContact NH2-CB 3.34Å; R33-N88 PolarHBondContact NH2-ND2 3.37Å; R33-N88 VanDerWaalsContact NH2-ND2 3.19Å; R33-N88 PolarHBondContact NH2-OD1 3.23Å; R33-T91 PolarHBondContact NH2-OG1 3.35Å
34	D	96.4	Very high	95.7	Very high	9 Å²	9	51.8 Å²	51.8	5%	0.048	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-70	-9.1	-178.1	-72.2	5.3	0	0	0	113.2	M32 I37 N88 Y89 L90 T91	M32-D34 VanDerWaalsContact C-N 3.26Å; M32-D34 PolarHBondContact O-N 3.3Å; D34-I37 WeakPolarHBondContact O-CG2 3.47Å; D34-N88 VanDerWaalsContact OD2-CA 3.29Å; D34-N88 WeakPolarHBondContact OD2-CA 3.46Å; D34-Y89 HydrophobicContact CB-CD1 4.2Å; D34-Y89 HydrophobicContact CB-CE1 3.64Å; D34-Y89 HydrophobicContact CB-CE2 4.18Å; D34-Y89 PolarHBondContact O-OH 2.9Å; D34-Y89 PolarHBondContact OD2-N 3.28Å; D34-Y89 VanDerWaalsContact OD2-N 3.12Å; D34-L90 HydrophobicContact CB-CB 3.85Å; D34-L90 WeakPolarHBondContact OD2-CA 3.44Å; D34-L90 WeakPolarHBondContact OD2-CB 3.42Å; D34-L90 PolarHBondContact OD2-N 3.2Å; D34-T91 PolarHBondContact OD2-N 3.34Å
35	D	96.4	Very high	95.8	Very high	6 Å²	6	51.5 Å²	51.5	3%	0.032	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-75.4	-28.3	169.6	-63	-28.7	0	0	0	112	L31 M32 R33 R58 R61 M62 Y89	L31-D35 WeakPolarHBondContact CA-OD2 3.46Å; L31-D35 HydrophobicContact CB-CB 4.26Å; L31-D35 HydrophobicContact CD2-CB 3.95Å; L31-D35 WeakPolarHBondContact CD2-OD2 3.29Å; M32-D35 PolarHBondContact N-OD2 3.32Å; M32-D35 VanDerWaalsContact O-CB 3.3Å; M32-D35 WeakPolarHBondContact O-CB 3.42Å; M32-D35 PolarHBondContact O-N 2.91Å; R33-D35 PolarHBondContact O-N 3.09Å; D35-R58 WeakPolarHBondContact OD1-CG 3.34Å; D35-R61 IonicContact OD1-CZ 3.99Å; D35-R61 IonicContact OD1-NH1 2.92Å; D35-R61 PolarHBondContact OD1-NH1 3.32Å; D35-R61 IonicContact OD1-NH2 3.62Å; D35-R61 IonicContact OD2-CZ 3.53Å; D35-R61 IonicContact OD2-NH1 3.86Å; D35-R61 PolarHBondContact OD2-NH1 2.72Å; D35-M62 HydrophobicContact CB-CE 3.95Å; D35-M62 WeakPolarHBondContact O-CE 3.45Å; D35-Y89 PolarHBondContact N-OH 3.34Å; D35-Y89 PolarHBondContact OD1-OH 2.94Å
36	T	95.4	Very high	96	Very high	74 Å²	74	50.6 Å²	50.6	45%	0.454	24%	0.244	S	C	.	.	S	Bend	trans	-89.2	-2.9	-170.3	66.9	0	0	0	0	113.8	F26 L31 R33	F26-T36 HydrophobicContact CB-CG2 3.81Å; F26-T36 HydrophobicContact CD1-CG2 4.28Å; F26-T36 HydrophobicContact CG-CG2 3.99Å; L31-T36 HydrophobicContact CD1-CG2 4.32Å; R33-T36 PolarHBondContact O-N 3.39Å; R33-T36 PolarHBondContact O-OG1 2.85Å
37	I	95.1	Very high	96	Very high	63 Å²	63	50 Å²	50	32%	0.323	24%	0.242	S	C	.	.	S	Bend	trans	-69	143.6	178.7	-162.6	168.2	0	0	0	110.6	D34 E39 V43 L90 L94	D34-I37 WeakPolarHBondContact O-CG2 3.47Å; I37-E39 PolarHBondContact O-N 2.98Å; I37-V43 HydrophobicContact CD1-CG2 4.02Å; I37-V43 HydrophobicContact CG1-CG2 4.34Å; I37-V43 HydrophobicContact CG2-CG1 3.99Å; I37-L90 HydrophobicContact CG2-CD2 4.07Å; I37-L94 HydrophobicContact CD1-CD2 3.7Å
38	Y	95.8	Very high	96.1	Very high	191 Å²	191	58.7 Å²	58.7	75%	0.749	27%	0.274	S	S	*	.			trans	-69	127.5	174.6	176.6	-104.2	0	0	0	110.6	D40	Y38-D40 HydrophobicContact CD1-CB 4.14Å; Y38-D40 HydrophobicContact CE1-CB 4.11Å; Y38-D40 PolarHBondContact O-N 3.06Å
39	E	94.1	Very high	96.2	Very high	78 Å²	78	57.6 Å²	57.6	36%	0.364	27%	0.268	S	S	.	.			trans	-81.5	78.5	-176.8	-64.2	-171.5	-175.9	0	0	112.5	I37 V43 K44 L47 R58	I37-E39 PolarHBondContact O-N 2.98Å; E39-V43 HydrophobicContact CB-CG1 4.33Å; E39-V43 HydrophobicContact CG-CG1 4.14Å; E39-K44 WeakPolarHBondContact O-CE 3.31Å; E39-L47 HydrophobicContact CG-CD1 4.19Å; E39-R58 IonicContact OE1-CZ 2.75Å; E39-R58 VanDerWaalsContact OE1-CZ 3.31Å; E39-R58 IonicContact OE1-NH1 2.61Å; E39-R58 PolarHBondContact OE1-NH1 3.33Å; E39-R58 IonicContact OE1-NH2 3.03Å; E39-R58 PolarHBondContact OE1-NH2 2.8Å
40	D	95.3	Very high	96.1	Very high	66 Å²	66	56.4 Å²	56.4	35%	0.353	26%	0.261	S	S	.	.			trans	-76.6	-173.2	168.2	69.6	15.4	0	0	0	112.7	Y38 D42 V43 K44	Y38-D40 HydrophobicContact CD1-CB 4.14Å; Y38-D40 HydrophobicContact CE1-CB 4.11Å; Y38-D40 PolarHBondContact O-N 3.06Å; D40-D42 VanDerWaalsContact C-N 3.34Å; D40-D42 PolarHBondContact O-N 3.27Å; D40-D42 PolarHBondContact OD1-N 3.33Å; D40-V43 WeakPolarHBondContact OD1-CB 3.43Å; D40-V43 VanDerWaalsContact OD1-CG2 3.28Å; D40-V43 WeakPolarHBondContact OD1-CG2 3.32Å; D40-V43 PolarHBondContact OD1-N 2.92Å; D40-K44 WeakPolarHBondContact O-CB 3.21Å; D40-K44 WeakPolarHBondContact O-CG 3.48Å; D40-K44 PolarHBondContact O-N 3.02Å
41	S	96.6	Very high	96.2	Very high	87 Å²	87	58.8 Å²	58.8	61%	0.608	28%	0.277	S	S	*	.	H	α-helix	trans	-62.6	-39.3	179.2	52.4	0	0	0	0	113.2	K44 E45	S41-K44 PolarHBondContact O-N 3.14Å; S41-E45 PolarHBondContact O-N 2.92Å; S41-E45 VanDerWaalsContact O-N 3.12Å
42	D	96.6	Very high	96.2	Very high	13 Å²	13	65.3 Å²	65.3	7%	0.07	31%	0.307	C	S	.	.	H	α-helix	trans	-72.1	-41.6	-176.6	-65.7	-5	0	0	0	109.6	D40 E45 A46 L94 V97 I98 R101	D40-D42 VanDerWaalsContact C-N 3.34Å; D40-D42 PolarHBondContact O-N 3.27Å; D40-D42 PolarHBondContact OD1-N 3.33Å; D42-E45 PolarHBondContact O-N 3.12Å; D42-A46 WeakPolarHBondContact O-CB 3.26Å; D42-A46 PolarHBondContact O-N 2.98Å; D42-L94 HydrophobicContact CB-CD1 4.07Å; D42-V97 HydrophobicContact CB-CG1 3.9Å; D42-I98 HydrophobicContact CB-CG1 4.42Å; D42-R101 IonicContact OD1-NE 3.55Å; D42-R101 PolarHBondContact OD1-NE 3.47Å; D42-R101 IonicContact OD2-CZ 2.75Å; D42-R101 IonicContact OD2-NE 3.71Å; D42-R101 PolarHBondContact OD2-NE 3.12Å; D42-R101 IonicContact OD2-NH2 2.72Å; D42-R101 PolarHBondContact OD2-NH2 3.09Å
43	V	96.4	Very high	96.3	Very high	2 Å²	2	68.8 Å²	68.8	1%	0.012	33%	0.326	C	S	.	.	H	α-helix	trans	-64.6	-41.3	175.1	172.5	0	0	0	0	111.3	I37 E39 D40 E45 A46 L47 L90 L94	I37-V43 HydrophobicContact CD1-CG2 4.02Å; I37-V43 HydrophobicContact CG1-CG2 4.34Å; I37-V43 HydrophobicContact CG2-CG1 3.99Å; E39-V43 HydrophobicContact CB-CG1 4.33Å; E39-V43 HydrophobicContact CG-CG1 4.14Å; D40-V43 WeakPolarHBondContact OD1-CB 3.43Å; D40-V43 VanDerWaalsContact OD1-CG2 3.28Å; D40-V43 WeakPolarHBondContact OD1-CG2 3.32Å; D40-V43 PolarHBondContact OD1-N 2.92Å; V43-E45 VanDerWaalsContact C-N 3.3Å; V43-E45 PolarHBondContact O-N 3.07Å; V43-A46 PolarHBondContact O-N 3.18Å; V43-L47 HydrophobicContact CG1-CD1 4.13Å; V43-L47 HydrophobicContact CG1-CG 4.34Å; V43-L47 WeakPolarHBondContact O-CB 3.28Å; V43-L47 VanDerWaalsContact O-CG 3.31Å; V43-L47 WeakPolarHBondContact O-CG 3.49Å; V43-L47 PolarHBondContact O-N 3.46Å; V43-L90 HydrophobicContact CG1-CD2 4.25Å; V43-L94 HydrophobicContact CG2-CD1 3.79Å; V43-L94 HydrophobicContact CG2-CD2 4.12Å
44	K	97	Very high	96.4	Very high	126 Å²	126	66.1 Å²	66.1	55%	0.548	32%	0.32	S	S	.	.	H	α-helix	trans	-60.6	-41	175	-77.2	172.9	-175	-179.5	0	112	E39 D40 S41 L47 R48	E39-K44 WeakPolarHBondContact O-CE 3.31Å; D40-K44 WeakPolarHBondContact O-CB 3.21Å; D40-K44 WeakPolarHBondContact O-CG 3.48Å; D40-K44 PolarHBondContact O-N 3.02Å; S41-K44 PolarHBondContact O-N 3.14Å; K44-L47 PolarHBondContact O-N 3.31Å; K44-R48 PolarHBondContact O-N 3.24Å; K44-R48 VanDerWaalsContact O-N 3.11Å
45	E	97	Very high	96.4	Very high	55 Å²	55	70.6 Å²	70.6	26%	0.257	34%	0.337	S	S	.	.	H	α-helix	trans	-67	-42.4	175.4	-174.4	171.9	-179.6	0	0	111.7	S41 D42 V43 L47 R48 R49 V97	S41-E45 PolarHBondContact O-N 2.92Å; S41-E45 VanDerWaalsContact O-N 3.12Å; D42-E45 PolarHBondContact O-N 3.12Å; V43-E45 VanDerWaalsContact C-N 3.3Å; V43-E45 PolarHBondContact O-N 3.07Å; E45-L47 VanDerWaalsContact C-N 3.34Å; E45-L47 PolarHBondContact O-N 3.18Å; E45-R48 WeakPolarHBondContact O-CB 3.47Å; E45-R48 PolarHBondContact O-N 3.42Å; E45-R48 VanDerWaalsContact O-N 3.16Å; E45-R49 WeakPolarHBondContact O-CG 3.45Å; E45-R49 PolarHBondContact O-N 3.45Å; E45-R49 IonicContact OE1-CZ 2.68Å; E45-R49 IonicContact OE1-NE 3.66Å; E45-R49 IonicContact OE1-NH2 3.98Å; E45-R49 PolarHBondContact OE1-NH2 3.27Å; E45-V97 HydrophobicContact CB-CG1 4.12Å; E45-V97 HydrophobicContact CB-CG2 4.19Å; E45-V97 HydrophobicContact CG-CG1 4.31Å; E45-V97 HydrophobicContact CG-CG2 3.89Å
46	A	97.6	Very high	96.4	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-61	-41.7	175.8	0	0	0	0	0	112.1	D42 V43 R48 R49 L50 L90 L94 V97	D42-A46 WeakPolarHBondContact O-CB 3.26Å; D42-A46 PolarHBondContact O-N 2.98Å; V43-A46 PolarHBondContact O-N 3.18Å; A46-R48 VanDerWaalsContact C-N 3.31Å; A46-R48 PolarHBondContact O-N 3.25Å; A46-R49 PolarHBondContact O-N 3.46Å; A46-L50 PolarHBondContact O-N 2.75Å; A46-L90 HydrophobicContact CB-CD1 3.71Å; A46-L90 HydrophobicContact CB-CG 4.48Å; A46-L94 HydrophobicContact CB-CB 4.13Å; A46-L94 HydrophobicContact CB-CD1 4.24Å; A46-V97 HydrophobicContact CB-CG2 4.34Å
47	L	96.6	Very high	96.5	Very high	12 Å²	12	75.2 Å²	75.2	6%	0.063	36%	0.359	C	S	.	.	H	α-helix	trans	-63.1	-35.8	175.1	-73.2	173	0	0	0	112.3	E39 V43 K44 E45 R49 L50 L90	E39-L47 HydrophobicContact CG-CD1 4.19Å; V43-L47 HydrophobicContact CG1-CD1 4.13Å; V43-L47 HydrophobicContact CG1-CG 4.34Å; V43-L47 WeakPolarHBondContact O-CB 3.28Å; V43-L47 VanDerWaalsContact O-CG 3.31Å; V43-L47 WeakPolarHBondContact O-CG 3.49Å; V43-L47 PolarHBondContact O-N 3.46Å; K44-L47 PolarHBondContact O-N 3.31Å; E45-L47 VanDerWaalsContact C-N 3.34Å; E45-L47 PolarHBondContact O-N 3.18Å; L47-R49 VanDerWaalsContact C-N 3.26Å; L47-R49 PolarHBondContact O-N 2.76Å; L47-L50 HydrophobicContact CD2-CD1 3.72Å; L47-L50 WeakPolarHBondContact O-CB 3.49Å; L47-L50 PolarHBondContact O-N 3.25Å; L47-L90 HydrophobicContact CD2-CD1 3.98Å; L47-L90 HydrophobicContact CD2-CD2 4.05Å; L47-L90 HydrophobicContact CG-CD1 4.31Å; L47-L90 HydrophobicContact CG-CD2 4.43Å
48	R	96.9	Very high	96.6	Very high	185 Å²	185	72.9 Å²	72.9	70%	0.698	35%	0.346	S	S	*	.	H	α-helix	trans	-65.8	-28.6	176	-168.5	-169.9	68.2	80.6	-1.7	112.5	K44 E45 A46 L50	K44-R48 PolarHBondContact O-N 3.24Å; K44-R48 VanDerWaalsContact O-N 3.11Å; E45-R48 WeakPolarHBondContact O-CB 3.47Å; E45-R48 PolarHBondContact O-N 3.42Å; E45-R48 VanDerWaalsContact O-N 3.16Å; A46-R48 VanDerWaalsContact C-N 3.31Å; A46-R48 PolarHBondContact O-N 3.25Å; R48-L50 VanDerWaalsContact C-N 3.34Å
49	R	96.9	Very high	96.6	Very high	59 Å²	59	65.6 Å²	65.6	22%	0.223	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-11.3	179.3	-64.1	-179.9	-170.6	-155.4	1.2	113.2	E45 A46 L47 Y93 E96 E100	E45-R49 WeakPolarHBondContact O-CG 3.45Å; E45-R49 PolarHBondContact O-N 3.45Å; E45-R49 IonicContact OE1-CZ 2.68Å; E45-R49 IonicContact OE1-NE 3.66Å; E45-R49 IonicContact OE1-NH2 3.98Å; E45-R49 PolarHBondContact OE1-NH2 3.27Å; A46-R49 PolarHBondContact O-N 3.46Å; L47-R49 VanDerWaalsContact C-N 3.26Å; L47-R49 PolarHBondContact O-N 2.76Å; R49-Y93 HydrophobicContact CB-CD1 3.96Å; R49-E96 VanDerWaalsContact NH1-CD 3.28Å; R49-E96 IonicContact NH1-OE1 3.34Å; R49-E96 IonicContact NH1-OE2 3.02Å; R49-E96 PolarHBondContact NH1-OE2 3.07Å; R49-E100 IonicContact CZ-OE1 3.75Å; R49-E100 IonicContact CZ-OE2 3.31Å; R49-E100 IonicContact NH1-OE1 3.47Å; R49-E100 PolarHBondContact NH1-OE1 3.47Å; R49-E100 IonicContact NH1-OE2 3.65Å; R49-E100 IonicContact NH2-OE1 2.79Å; R49-E100 PolarHBondContact NH2-OE1 3.07Å; R49-E100 IonicContact NH2-OE2 2.97Å; R49-E100 PolarHBondContact NH2-OE2 2.61Å
50	L	96.2	Very high	96.8	Very high	16 Å²	16	68 Å²	68	8%	0.084	33%	0.331	C	S	.	.	S	Bend	trans	-64.7	146.5	-178.4	-76.9	174.7	0	0	0	112.1	A46 L47 R48 V54 Y89 L90 Y93	A46-L50 PolarHBondContact O-N 2.75Å; L47-L50 HydrophobicContact CD2-CD1 3.72Å; L47-L50 WeakPolarHBondContact O-CB 3.49Å; L47-L50 PolarHBondContact O-N 3.25Å; R48-L50 VanDerWaalsContact C-N 3.34Å; L50-V54 HydrophobicContact CD2-CG1 4.24Å; L50-Y89 HydrophobicContact CD1-CD2 4.26Å; L50-Y89 HydrophobicContact CD1-CE2 4.09Å; L50-Y89 HydrophobicContact CD2-CD2 4.13Å; L50-L90 HydrophobicContact CD1-CD1 4.1Å; L50-L90 HydrophobicContact CD2-CD1 4.43Å; L50-L90 HydrophobicContact CG-CD1 4.25Å; L50-Y93 HydrophobicContact CD2-CD2 3.59Å; L50-Y93 HydrophobicContact CD2-CE2 3.51Å; L50-Y93 HydrophobicContact CD2-CG 4.47Å
51	P	97.4	Very high	96.9	Very high	52 Å²	52	66 Å²	66	34%	0.338	32%	0.319	S	S	.	.			trans	-56.5	142.1	165.8	-24.3	35	0	0	0	111.5	N53 V54 Y55	P51-N53 VanDerWaalsContact C-N 3.32Å; P51-N53 WeakPolarHBondContact CB-OD1 3.23Å; P51-N53 PolarHBondContact O-N 3.39Å; P51-V54 HydrophobicContact CB-CG2 4.19Å; P51-V54 HydrophobicContact CG-CG2 4.38Å; P51-V54 PolarHBondContact O-N 3.02Å; P51-V54 VanDerWaalsContact O-N 3.11Å; P51-Y55 PolarHBondContact O-N 2.85Å
52	E	96.6	Very high	96.9	Very high	153 Å²	153	63.7 Å²	63.7	72%	0.715	30%	0.298	S	S	*	.	H	α-helix	trans	-58.4	-41.1	-174	-174.5	-178.8	175.8	0	0	112.9	V54 Y55 N56	E52-V54 PolarHBondContact O-N 3.27Å; E52-Y55 PolarHBondContact O-N 3.04Å; E52-N56 WeakPolarHBondContact O-CB 3.48Å; E52-N56 PolarHBondContact O-N 3.3Å; E52-N56 PolarHBondContact O-ND2 3.49Å
53	N	97.1	Very high	97	Very high	104 Å²	104	69.8 Å²	69.8	56%	0.556	33%	0.325	S	S	*	.	H	α-helix	trans	-59.5	-46	176.6	61.6	-35.9	0	0	0	112.1	P51 Y55 N56 D57	P51-N53 VanDerWaalsContact C-N 3.32Å; P51-N53 WeakPolarHBondContact CB-OD1 3.23Å; P51-N53 PolarHBondContact O-N 3.39Å; N53-Y55 VanDerWaalsContact C-N 3.34Å; N53-Y55 PolarHBondContact O-N 3.14Å; N53-N56 PolarHBondContact O-N 3.16Å; N53-D57 VanDerWaalsContact O-CG 3.29Å; N53-D57 PolarHBondContact O-N 3.11Å
54	V	96.3	Very high	97.1	Very high	38 Å²	38	73.1 Å²	73.1	23%	0.23	34%	0.337	C	S	.	.	H	α-helix	trans	-66.2	-39.6	179.2	-179.2	0	0	0	0	110.9	L50 P51 E52 D57 R58 Y89	L50-V54 HydrophobicContact CD2-CG1 4.24Å; P51-V54 HydrophobicContact CB-CG2 4.19Å; P51-V54 HydrophobicContact CG-CG2 4.38Å; P51-V54 PolarHBondContact O-N 3.02Å; P51-V54 VanDerWaalsContact O-N 3.11Å; E52-V54 PolarHBondContact O-N 3.27Å; V54-D57 PolarHBondContact O-N 3.03Å; V54-R58 WeakPolarHBondContact O-CB 3.33Å; V54-R58 PolarHBondContact O-N 2.68Å; V54-Y89 HydrophobicContact CG1-CD2 3.79Å; V54-Y89 HydrophobicContact CG1-CE2 4.48Å; V54-Y89 HydrophobicContact CG1-CG 4.12Å
55	Y	96.9	Very high	97.1	Very high	103 Å²	103	67.4 Å²	67.4	40%	0.404	31%	0.313	S	S	.	.	H	α-helix	trans	-64.2	-41.9	175.8	-178	-92.3	0	0	0	112.1	P51 E52 N53 R58 T59	P51-Y55 PolarHBondContact O-N 2.85Å; E52-Y55 PolarHBondContact O-N 3.04Å; N53-Y55 VanDerWaalsContact C-N 3.34Å; N53-Y55 PolarHBondContact O-N 3.14Å; Y55-R58 WeakPolarHBondContact O-CB 3.48Å; Y55-R58 PolarHBondContact O-N 3.18Å; Y55-T59 WeakPolarHBondContact O-CB 3.5Å; Y55-T59 PolarHBondContact O-N 3.04Å; Y55-T59 PolarHBondContact O-OG1 3.19Å
56	N	97.7	Very high	97.1	Very high	83 Å²	83	70.7 Å²	70.7	44%	0.444	33%	0.327	S	S	.	.	H	α-helix	trans	-64.5	-42.7	175.9	-72.1	-23.1	0	0	0	111.5	E52 N53 R58 T59 F60	E52-N56 WeakPolarHBondContact O-CB 3.48Å; E52-N56 PolarHBondContact O-N 3.3Å; E52-N56 PolarHBondContact O-ND2 3.49Å; N53-N56 PolarHBondContact O-N 3.16Å; N56-R58 PolarHBondContact O-N 2.79Å; N56-T59 WeakPolarHBondContact O-CB 3.45Å; N56-T59 PolarHBondContact O-N 2.97Å; N56-T59 VanDerWaalsContact O-N 3.15Å; N56-F60 PolarHBondContact O-N 3.38Å
57	D	97	Very high	97.1	Very high	94 Å²	94	74.1 Å²	74.1	50%	0.503	35%	0.345	S	S	.	.	H	α-helix	trans	-62.1	-42.7	175.7	-71.4	-19.5	0	0	0	112	N53 V54 T59 F60 R61	N53-D57 VanDerWaalsContact O-CG 3.29Å; N53-D57 PolarHBondContact O-N 3.11Å; V54-D57 PolarHBondContact O-N 3.03Å; D57-T59 VanDerWaalsContact C-N 3.34Å; D57-F60 PolarHBondContact O-N 3.1Å; D57-R61 WeakPolarHBondContact O-CG 3.3Å; D57-R61 PolarHBondContact O-N 3.15Å; D57-R61 PolarHBondContact O-NE 3.31Å
58	R	96.5	Very high	97.1	Very high	14 Å²	14	74.5 Å²	74.5	5%	0.053	35%	0.347	C	S	.	.	H	α-helix	trans	-57.1	-48.4	171.2	173.9	178.5	-168.7	-96.8	-1	111	D35 E39 V54 Y55 N56 F60 R61 M62	D35-R58 WeakPolarHBondContact OD1-CG 3.34Å; E39-R58 IonicContact OE1-CZ 2.75Å; E39-R58 VanDerWaalsContact OE1-CZ 3.31Å; E39-R58 IonicContact OE1-NH1 2.61Å; E39-R58 PolarHBondContact OE1-NH1 3.33Å; E39-R58 IonicContact OE1-NH2 3.03Å; E39-R58 PolarHBondContact OE1-NH2 2.8Å; V54-R58 WeakPolarHBondContact O-CB 3.33Å; V54-R58 PolarHBondContact O-N 2.68Å; Y55-R58 WeakPolarHBondContact O-CB 3.48Å; Y55-R58 PolarHBondContact O-N 3.18Å; N56-R58 PolarHBondContact O-N 2.79Å; R58-F60 VanDerWaalsContact C-N 3.31Å; R58-F60 PolarHBondContact O-N 3.21Å; R58-R61 PolarHBondContact O-N 3.23Å; R58-M62 WeakPolarHBondContact O-CB 3.46Å; R58-M62 PolarHBondContact O-N 3.36Å
59	T	97.1	Very high	97.1	Very high	38 Å²	38	68.5 Å²	68.5	23%	0.233	33%	0.333	C	S	.	.	H	α-helix	trans	-63.8	-39.4	-176.9	-60.6	0	0	0	0	111.4	Y55 N56 D57 M62 K63	Y55-T59 WeakPolarHBondContact O-CB 3.5Å; Y55-T59 PolarHBondContact O-N 3.04Å; Y55-T59 PolarHBondContact O-OG1 3.19Å; N56-T59 WeakPolarHBondContact O-CB 3.45Å; N56-T59 PolarHBondContact O-N 2.97Å; N56-T59 VanDerWaalsContact O-N 3.15Å; D57-T59 VanDerWaalsContact C-N 3.34Å; T59-M62 PolarHBondContact O-N 2.75Å; T59-K63 HydrophobicContact CG2-CD 4.35Å; T59-K63 WeakPolarHBondContact O-CG 3.41Å; T59-K63 PolarHBondContact O-N 2.84Å
60	F	97.8	Very high	97.1	Very high	128 Å²	128	73.4 Å²	73.4	56%	0.561	36%	0.361	S	S	*	.	H	α-helix	trans	-63.2	-48.3	174	174.8	-102.4	0	0	0	112	N56 D57 R58 M62 K63 R64	N56-F60 PolarHBondContact O-N 3.38Å; D57-F60 PolarHBondContact O-N 3.1Å; R58-F60 VanDerWaalsContact C-N 3.31Å; R58-F60 PolarHBondContact O-N 3.21Å; F60-M62 VanDerWaalsContact C-N 3.3Å; F60-M62 PolarHBondContact O-N 3Å; F60-K63 PolarHBondContact O-N 3.48Å; F60-R64 WeakPolarHBondContact O-CB 3.38Å; F60-R64 PolarHBondContact O-N 3.39Å
61	R	97.4	Very high	97.2	Very high	25 Å²	25	77.9 Å²	77.9	9%	0.094	38%	0.38	C	S	.	.	H	α-helix	trans	-56.9	-44.3	175.8	-76.2	-178.3	-79.5	134.8	-10.2	111.9	L31 M32 D35 D57 R58 R64 A65	L31-R61 HydrophobicContact CD2-CB 4.4Å; M32-R61 PolarHBondContact SD-NH1 3.24Å; D35-R61 IonicContact OD1-CZ 3.99Å; D35-R61 IonicContact OD1-NH1 2.92Å; D35-R61 PolarHBondContact OD1-NH1 3.32Å; D35-R61 IonicContact OD1-NH2 3.62Å; D35-R61 IonicContact OD2-CZ 3.53Å; D35-R61 IonicContact OD2-NH1 3.86Å; D35-R61 PolarHBondContact OD2-NH1 2.72Å; D57-R61 WeakPolarHBondContact O-CG 3.3Å; D57-R61 PolarHBondContact O-N 3.15Å; D57-R61 PolarHBondContact O-NE 3.31Å; R58-R61 PolarHBondContact O-N 3.23Å; R61-R64 PolarHBondContact O-N 3.44Å; R61-A65 WeakPolarHBondContact O-CB 3.47Å; R61-A65 PolarHBondContact O-N 2.85Å
62	M	96.9	Very high	97.1	Very high	37 Å²	37	83.5 Å²	83.5	18%	0.182	40%	0.401	C	S	.	.	H	α-helix	trans	-63.9	-46.5	179	-166.2	64	70.4	0	0	112.2	D35 R58 T59 F60 R64 A65 F66	D35-M62 HydrophobicContact CB-CE 3.95Å; D35-M62 WeakPolarHBondContact O-CE 3.45Å; R58-M62 WeakPolarHBondContact O-CB 3.46Å; R58-M62 PolarHBondContact O-N 3.36Å; T59-M62 PolarHBondContact O-N 2.75Å; F60-M62 VanDerWaalsContact C-N 3.3Å; F60-M62 PolarHBondContact O-N 3Å; M62-R64 VanDerWaalsContact C-N 3.33Å; M62-R64 PolarHBondContact O-N 3.02Å; M62-A65 PolarHBondContact O-N 3.06Å; M62-F66 HydrophobicContact CG-CD2 3.93Å; M62-F66 HydrophobicContact CG-CE2 3.37Å; M62-F66 HydrophobicContact CG-CZ 3.96Å; M62-F66 WeakPolarHBondContact O-CD2 3.45Å; M62-F66 WeakPolarHBondContact O-CG 3.48Å; M62-F66 PolarHBondContact O-N 3.43Å; M62-F66 HydrophobicContact SD-CE2 3.93Å; M62-F66 HydrophobicContact SD-CZ 3.89Å
63	K	97.9	Very high	97.1	Very high	142 Å²	142	81.5 Å²	81.5	62%	0.617	39%	0.392	S	S	*	.	H	α-helix	trans	-58.9	-44	175.2	-75.2	174.6	178.1	177.4	0	111.9	T59 F60 F66 D67	T59-K63 HydrophobicContact CG2-CD 4.35Å; T59-K63 WeakPolarHBondContact O-CG 3.41Å; T59-K63 PolarHBondContact O-N 2.84Å; F60-K63 PolarHBondContact O-N 3.48Å; K63-F66 PolarHBondContact O-N 3.17Å; K63-D67 PolarHBondContact O-N 2.71Å
64	R	97.6	Very high	97.1	Very high	72 Å²	72	81.6 Å²	81.6	27%	0.272	39%	0.391	S	S	.	.	H	α-helix	trans	-61	-45.6	175.7	178.1	177.1	67.9	-169.6	-1.2	111.7	G30 F60 R61 M62 F66 D67 L68	G30-R64 PolarHBondContact O-NH2 3.48Å; F60-R64 WeakPolarHBondContact O-CB 3.38Å; F60-R64 PolarHBondContact O-N 3.39Å; R61-R64 PolarHBondContact O-N 3.44Å; M62-R64 VanDerWaalsContact C-N 3.33Å; M62-R64 PolarHBondContact O-N 3.02Å; R64-F66 VanDerWaalsContact C-N 3.34Å; R64-F66 PolarHBondContact O-N 3.39Å; R64-D67 PolarHBondContact O-N 3.36Å; R64-L68 HydrophobicContact CG-CD1 3.98Å; R64-L68 VanDerWaalsContact O-CG 3.31Å; R64-L68 WeakPolarHBondContact O-CG 3.36Å; R64-L68 PolarHBondContact O-N 3.45Å
65	A	97.4	Very high	97.1	Very high	5 Å²	5	80.3 Å²	80.3	4%	0.041	38%	0.383	C	S	.	.	H	α-helix	trans	-63	-40.5	178.5	0	0	0	0	0	112	L29 L31 R61 M62 S69	L29-A65 HydrophobicContact CB-CB 4.06Å; L31-A65 HydrophobicContact CD1-CB 3.95Å; L31-A65 HydrophobicContact CD2-CB 3.56Å; L31-A65 HydrophobicContact CG-CB 3.79Å; R61-A65 WeakPolarHBondContact O-CB 3.47Å; R61-A65 PolarHBondContact O-N 2.85Å; M62-A65 PolarHBondContact O-N 3.06Å; A65-S69 VanDerWaalsContact O-CB 3.26Å; A65-S69 WeakPolarHBondContact O-CB 3.34Å; A65-S69 PolarHBondContact O-N 3.13Å
66	F	97.4	Very high	97.1	Very high	125 Å²	125	78.6 Å²	78.6	55%	0.548	39%	0.385	S	S	.	.	H	α-helix	trans	-63.9	-44.9	174.1	-70.9	-46.4	0	0	0	112.4	M62 K63 R64 L68 S69 M70	M62-F66 HydrophobicContact CG-CD2 3.93Å; M62-F66 HydrophobicContact CG-CE2 3.37Å; M62-F66 HydrophobicContact CG-CZ 3.96Å; M62-F66 WeakPolarHBondContact O-CD2 3.45Å; M62-F66 WeakPolarHBondContact O-CG 3.48Å; M62-F66 PolarHBondContact O-N 3.43Å; M62-F66 HydrophobicContact SD-CE2 3.93Å; M62-F66 HydrophobicContact SD-CZ 3.89Å; K63-F66 PolarHBondContact O-N 3.17Å; R64-F66 VanDerWaalsContact C-N 3.34Å; R64-F66 PolarHBondContact O-N 3.39Å; F66-L68 PolarHBondContact O-N 3.49Å; F66-S69 PolarHBondContact O-N 2.84Å; F66-M70 WeakPolarHBondContact O-CB 3.29Å; F66-M70 VanDerWaalsContact O-CG 3.28Å; F66-M70 WeakPolarHBondContact O-CG 3.39Å; F66-M70 PolarHBondContact O-N 2.9Å
67	D	97.7	Very high	96.9	Very high	72 Å²	72	82.6 Å²	82.6	39%	0.385	40%	0.398	S	S	.	.	H	α-helix	trans	-59	-46.2	177	-179.3	54.6	0	0	0	112	K63 R64 M70 K71	K63-D67 PolarHBondContact O-N 2.71Å; R64-D67 PolarHBondContact O-N 3.36Å; D67-M70 PolarHBondContact O-N 3.24Å; D67-K71 WeakPolarHBondContact O-CG 3.5Å; D67-K71 PolarHBondContact O-N 2.99Å; D67-K71 VanDerWaalsContact O-N 3.09Å; D67-K71 WeakPolarHBondContact OD1-CE 3.46Å; D67-K71 IonicContact OD1-NZ 2.83Å; D67-K71 PolarHBondContact OD1-NZ 3.42Å; D67-K71 IonicContact OD2-NZ 2.73Å; D67-K71 PolarHBondContact OD2-NZ 3.48Å
68	L	97.4	Very high	96.8	Very high	20 Å²	20	84.1 Å²	84.1	11%	0.105	41%	0.406	C	S	.	.	H	α-helix	trans	-62.8	-42.8	175.8	-70.7	168.3	0	0	0	112	L29 R64 F66 K71 Q72 Q73 L75	L29-L68 HydrophobicContact CD2-CB 3.89Å; L29-L68 HydrophobicContact CD2-CD1 4.29Å; R64-L68 HydrophobicContact CG-CD1 3.98Å; R64-L68 VanDerWaalsContact O-CG 3.31Å; R64-L68 WeakPolarHBondContact O-CG 3.36Å; R64-L68 PolarHBondContact O-N 3.45Å; F66-L68 PolarHBondContact O-N 3.49Å; L68-K71 CarbonylContact O-C 3.54Å; L68-K71 PolarHBondContact O-N 3.3Å; L68-Q72 PolarHBondContact O-N 2.98Å; L68-Q73 HydrophobicContact CD2-CB 4.18Å; L68-Q73 PolarHBondContact O-N 3.18Å; L68-L75 HydrophobicContact CD1-CD1 3.7Å; L68-L75 HydrophobicContact CD1-CD2 4.48Å; L68-L75 HydrophobicContact CD1-CG 3.64Å
69	S	96.4	Very high	96.8	Very high	59 Å²	59	88.3 Å²	88.3	41%	0.413	43%	0.426	S	S	.	.	H	α-helix	trans	-62.8	-44.6	177.4	-175.9	0	0	0	0	111.5	A65 F66 K71 Q72	A65-S69 VanDerWaalsContact O-CB 3.26Å; A65-S69 WeakPolarHBondContact O-CB 3.34Å; A65-S69 PolarHBondContact O-N 3.13Å; F66-S69 PolarHBondContact O-N 2.84Å; S69-K71 VanDerWaalsContact C-N 3.26Å; S69-K71 PolarHBondContact O-N 3.12Å; S69-Q72 PolarHBondContact O-N 3.45Å; S69-Q72 PolarHBondContact O-NE2 3.09Å
70	M	97.2	Very high	96.7	Very high	161 Å²	161	89.3 Å²	89.3	79%	0.793	43%	0.426	S	S	*	.	H	α-helix	trans	-60.3	-37.8	176.2	-72.5	177	69.3	0	0	112	F66 D67 Q72	F66-M70 WeakPolarHBondContact O-CB 3.29Å; F66-M70 VanDerWaalsContact O-CG 3.28Å; F66-M70 WeakPolarHBondContact O-CG 3.39Å; F66-M70 PolarHBondContact O-N 2.9Å; D67-M70 PolarHBondContact O-N 3.24Å; M70-Q72 VanDerWaalsContact C-N 3.3Å
71	K	97.3	Very high	96.5	Very high	111 Å²	111	84.1 Å²	84.1	48%	0.483	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-6.5	178	-67.6	168.4	-178.8	165.2	0	113.8	D67 L68 S69 Q73	D67-K71 WeakPolarHBondContact O-CG 3.5Å; D67-K71 PolarHBondContact O-N 2.99Å; D67-K71 VanDerWaalsContact O-N 3.09Å; D67-K71 WeakPolarHBondContact OD1-CE 3.46Å; D67-K71 IonicContact OD1-NZ 2.83Å; D67-K71 PolarHBondContact OD1-NZ 3.42Å; D67-K71 IonicContact OD2-NZ 2.73Å; D67-K71 PolarHBondContact OD2-NZ 3.48Å; L68-K71 CarbonylContact O-C 3.54Å; L68-K71 PolarHBondContact O-N 3.3Å; S69-K71 VanDerWaalsContact C-N 3.26Å; S69-K71 PolarHBondContact O-N 3.12Å; K71-Q73 HydrophobicContact CB-CB 4.17Å; K71-Q73 HydrophobicContact CB-CG 3.95Å; K71-Q73 PolarHBondContact O-N 3.34Å
72	Q	96.4	Very high	96.4	Very high	169 Å²	169	88.4 Å²	88.4	79%	0.79	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	38.2	-169.9	-58.6	-67.4	-54.6	0	0	112	L68 S69 M70	L68-Q72 PolarHBondContact O-N 2.98Å; S69-Q72 PolarHBondContact O-N 3.45Å; S69-Q72 PolarHBondContact O-NE2 3.09Å; M70-Q72 VanDerWaalsContact C-N 3.3Å
73	Q	96.7	Very high	96.2	Very high	112 Å²	112	90.3 Å²	90.3	52%	0.523	43%	0.43	S	S	.	.			trans	-111.7	162.3	179.9	-72.6	179.3	-4.8	0	0	110.9	L68 K71	L68-Q73 HydrophobicContact CD2-CB 4.18Å; L68-Q73 PolarHBondContact O-N 3.18Å; K71-Q73 HydrophobicContact CB-CB 4.17Å; K71-Q73 HydrophobicContact CB-CG 3.95Å; K71-Q73 PolarHBondContact O-N 3.34Å
74	I	96.4	Very high	95.8	Very high	105 Å²	105	90.9 Å²	90.9	54%	0.538	44%	0.435	S	S	.	.			trans	-122.1	157.3	175.8	62	177.1	0	0	0	109.5	K28 W80	K28-I74 HydrophobicContact CB-CB 4.49Å; K28-I74 HydrophobicContact CB-CG2 4.44Å; I74-W80 HydrophobicContact CD1-CZ2 4.16Å
75	L	96.3	Very high	95.4	Very high	11 Å²	11	92.2 Å²	92.2	6%	0.058	44%	0.444	C	S	.	.			trans	-65.6	153.9	172.7	-83.2	142	0	0	0	111.5	K28 L29 G30 L68 Q79 W80	K28-L75 WeakPolarHBondContact O-CB 3.09Å; K28-L75 PolarHBondContact O-N 3.46Å; L29-L75 VanDerWaalsContact O-CD1 3.29Å; L29-L75 WeakPolarHBondContact O-CD1 3.27Å; G30-L75 VanDerWaalsContact N-CD1 3.3Å; L68-L75 HydrophobicContact CD1-CD1 3.7Å; L68-L75 HydrophobicContact CD1-CD2 4.48Å; L68-L75 HydrophobicContact CD1-CG 3.64Å; L75-Q79 HydrophobicContact CB-CB 4.42Å; L75-Q79 HydrophobicContact CD2-CB 4.05Å; L75-W80 PolarHBondContact O-NE1 3.41Å
76	P	96.9	Very high	95.1	Very high	68 Å²	68	93 Å²	93	44%	0.442	45%	0.448	S	S	.	.			trans	-51	142.5	161.8	-26.4	37.3	0	0	0	111.4	D78 Q79 W80	P76-D78 WeakPolarHBondContact CB-OD1 3.39Å; P76-D78 PolarHBondContact O-N 3.37Å; P76-Q79 HydrophobicContact CB-CG 4.41Å; P76-Q79 PolarHBondContact O-N 3.05Å; P76-W80 PolarHBondContact O-NE1 3.4Å
77	K	93.9	Very high	94.8	Very high	166 Å²	166	91.5 Å²	91.5	72%	0.722	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-63.1	-28.8	-169.9	-171.5	175.9	179.6	-178.8	0	113.7	Q79 W80	K77-Q79 PolarHBondContact O-N 3.42Å; K77-W80 HydrophobicContact CG-CD2 4.35Å; K77-W80 HydrophobicContact CG-CE3 4.36Å; K77-W80 HydrophobicContact CG-CZ3 4.45Å
78	D	95.2	Very high	94.6	Very high	126 Å²	126	91.2 Å²	91.2	67%	0.674	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-67.2	-22.9	174.4	58	-56.1	0	0	0	113.1	P76	P76-D78 WeakPolarHBondContact CB-OD1 3.39Å; P76-D78 PolarHBondContact O-N 3.37Å
79	Q	94.6	Very high	94.5	Very high	103 Å²	103	91.7 Å²	91.7	48%	0.481	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-98.3	5.3	-178.9	-58	-175	-1.4	0	0	113.5	L75 P76 K77	L75-Q79 HydrophobicContact CB-CB 4.42Å; L75-Q79 HydrophobicContact CD2-CB 4.05Å; P76-Q79 HydrophobicContact CB-CG 4.41Å; P76-Q79 PolarHBondContact O-N 3.05Å; K77-Q79 PolarHBondContact O-N 3.42Å
80	W	95.8	Very high	94.5	Very high	58 Å²	58	89 Å²	89	22%	0.22	43%	0.428	C	S	.	.	S	Bend	trans	-73.2	136.9	178.6	-68.1	8.1	0	0	0	111	N27 K28 I74 L75 P76 K77 K82	N27-W80 WeakPolarHBondContact O-CA 3.48Å; K28-W80 HydrophobicContact CB-CD2 4.43Å; K28-W80 HydrophobicContact CB-CZ2 4.26Å; K28-W80 HydrophobicContact CD-CH2 4.02Å; K28-W80 HydrophobicContact CD-CZ2 4.18Å; K28-W80 HydrophobicContact CD-CZ3 4.45Å; K28-W80 HydrophobicContact CG-CD2 4.06Å; K28-W80 HydrophobicContact CG-CE3 4.06Å; K28-W80 HydrophobicContact CG-CH2 3.82Å; K28-W80 HydrophobicContact CG-CZ2 3.8Å; K28-W80 HydrophobicContact CG-CZ3 3.94Å; I74-W80 HydrophobicContact CD1-CZ2 4.16Å; L75-W80 PolarHBondContact O-NE1 3.41Å; P76-W80 PolarHBondContact O-NE1 3.4Å; K77-W80 HydrophobicContact CG-CD2 4.35Å; K77-W80 HydrophobicContact CG-CE3 4.36Å; K77-W80 HydrophobicContact CG-CZ3 4.45Å; W80-K82 PolarHBondContact O-N 3.07Å; W80-K82 VanDerWaalsContact O-N 3.14Å
81	T	94.6	Very high	94.4	Very high	20 Å²	20	83 Å²	83	12%	0.123	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-59.3	118.3	175.8	-45.7	0	0	0	0	109.9	Y21 N27 G30 L31 D86	Y21-T81 WeakPolarHBondContact OH-CG2 3.41Å; N27-T81 WeakPolarHBondContact CB-O 3.47Å; N27-T81 PolarHBondContact O-N 2.93Å; G30-T81 WeakPolarHBondContact CA-OG1 3.47Å; L31-T81 WeakPolarHBondContact O-CB 3.36Å; L31-T81 PolarHBondContact O-OG1 3.34Å; T81-D86 HydrophobicContact CG2-CB 4.27Å
82	K	93.7	Very high	94.4	Very high	115 Å²	115	81.4 Å²	81.4	50%	0.5	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-78.9	147.9	177.1	-57.7	-176.5	-158.8	134.1	0	110.2	W80 E84 E85 D86	W80-K82 PolarHBondContact O-N 3.07Å; W80-K82 VanDerWaalsContact O-N 3.14Å; K82-E84 PolarHBondContact O-N 2.97Å; K82-E84 VanDerWaalsContact O-N 3.14Å; K82-E85 HydrophobicContact CB-CB 4.26Å; K82-E85 HydrophobicContact CB-CG 4.07Å; K82-E85 WeakPolarHBondContact CD-OE1 3.31Å; K82-E85 WeakPolarHBondContact CE-OE1 3.43Å; K82-E85 IonicContact NZ-OE1 3.36Å; K82-E85 PolarHBondContact NZ-OE1 3.36Å; K82-E85 IonicContact NZ-OE2 2.73Å; K82-E85 PolarHBondContact O-N 2.97Å; K82-D86 PolarHBondContact O-N 2.8Å
83	Y	92.3	Very high	94.4	Very high	76 Å²	76	76.8 Å²	76.8	30%	0.298	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-32.5	177.3	-178.1	-107	0	0	0	113.5	K18 Y21	K18-Y83 HydrophobicContact CB-CD1 4.19Å; K18-Y83 HydrophobicContact CB-CE1 4.36Å; K18-Y83 HydrophobicContact CB-CG 4.35Å; K18-Y83 HydrophobicContact CD-CD1 4.13Å; K18-Y83 HydrophobicContact CD-CG 4.46Å; K18-Y83 HydrophobicContact CG-CD1 4.06Å; K18-Y83 HydrophobicContact CG-CG 4.03Å; Y21-Y83 AromaticContact CD1-CD2 3.89Å; Y21-Y83 HydrophobicContact CD1-CD2 3.89Å; Y21-Y83 HydrophobicContact CD1-CG 4.49Å; Y21-Y83 AromaticContact CD2-CD2 3.65Å; Y21-Y83 HydrophobicContact CD2-CD2 3.65Å; Y21-Y83 HydrophobicContact CD2-CE2 4.12Å; Y21-Y83 HydrophobicContact CE1-CD2 4.43Å; Y21-Y83 HydrophobicContact CE2-CD2 4.19Å; Y21-Y83 AromaticContact CG-CD2 3.48Å; Y21-Y83 HydrophobicContact CG-CD2 3.48Å; Y21-Y83 VanDerWaalsContact CG-CD2 3.48Å; Y21-Y83 HydrophobicContact CG-CE2 4.16Å; Y21-Y83 HydrophobicContact CG-CG 4.46Å
84	E	90.8	Very high	94.4	Very high	155 Å²	155	72.6 Å²	72.6	72%	0.724	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-19	-178.9	-70	156.6	-142.7	0	0	112.9	K18 K82	K18-E84 IonicContact NZ-OE1 2.8Å; K18-E84 PolarHBondContact NZ-OE1 3.42Å; K82-E84 PolarHBondContact O-N 2.97Å; K82-E84 VanDerWaalsContact O-N 3.14Å
85	E	89.8	Confident	94.4	Very high	99 Å²	99	73.7 Å²	73.7	46%	0.463	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-11.2	179.4	-66.4	168.9	-179.3	0	0	112.1	K82 V87	K82-E85 HydrophobicContact CB-CB 4.26Å; K82-E85 HydrophobicContact CB-CG 4.07Å; K82-E85 WeakPolarHBondContact CD-OE1 3.31Å; K82-E85 WeakPolarHBondContact CE-OE1 3.43Å; K82-E85 IonicContact NZ-OE1 3.36Å; K82-E85 PolarHBondContact NZ-OE1 3.36Å; K82-E85 IonicContact NZ-OE2 2.73Å; K82-E85 PolarHBondContact O-N 2.97Å; E85-V87 PolarHBondContact O-N 3.44Å; E85-V87 VanDerWaalsContact O-N 3.07Å
86	D	90.8	Very high	94.4	Very high	23 Å²	23	76.5 Å²	76.5	12%	0.123	37%	0.374	C	S	.	.			trans	-75.6	96	-179.1	-171.5	32.9	0	0	0	111.2	Y21 M32 R33 T81 K82	Y21-D86 HydrophobicContact CE2-CB 4.19Å; Y21-D86 VanDerWaalsContact CE2-OD2 3.27Å; Y21-D86 WeakPolarHBondContact CE2-OD2 3.4Å; M32-D86 WeakPolarHBondContact CA-OD1 3.21Å; M32-D86 VanDerWaalsContact CB-OD1 3.23Å; M32-D86 WeakPolarHBondContact CB-OD1 3.41Å; R33-D86 WeakPolarHBondContact CB-OD2 3.32Å; R33-D86 PolarHBondContact N-OD1 2.97Å; R33-D86 PolarHBondContact N-OD2 3.17Å; T81-D86 HydrophobicContact CG2-CB 4.27Å; K82-D86 PolarHBondContact O-N 2.8Å
87	V	91.3	Very high	94.5	Very high	92 Å²	92	73.2 Å²	73.2	56%	0.558	35%	0.353	S	S	*	.			trans	-86.9	132.3	178.2	-177	0	0	0	0	111	M32 E85 Y89	M32-V87 HydrophobicContact CE-CB 3.93Å; M32-V87 WeakPolarHBondContact CE-O 3.27Å; E85-V87 PolarHBondContact O-N 3.44Å; E85-V87 VanDerWaalsContact O-N 3.07Å; V87-Y89 WeakPolarHBondContact O-CD1 3.48Å; V87-Y89 PolarHBondContact O-N 3.44Å
88	N	93.7	Very high	94.6	Very high	67 Å²	67	67.7 Å²	67.7	36%	0.358	33%	0.331	S	S	.	.			trans	-77.7	63.8	176.9	-60.9	-0.9	0	0	0	112.1	R33 D34 L90 P92	R33-N88 VanDerWaalsContact CZ-ND2 3.34Å; R33-N88 PolarHBondContact NE-OD1 2.99Å; R33-N88 PolarHBondContact NH1-ND2 3.42Å; R33-N88 VanDerWaalsContact NH1-ND2 3.1Å; R33-N88 PolarHBondContact NH1-OD1 2.95Å; R33-N88 VanDerWaalsContact NH2-CB 3.34Å; R33-N88 PolarHBondContact NH2-ND2 3.37Å; R33-N88 VanDerWaalsContact NH2-ND2 3.19Å; R33-N88 PolarHBondContact NH2-OD1 3.23Å; D34-N88 VanDerWaalsContact OD2-CA 3.29Å; D34-N88 WeakPolarHBondContact OD2-CA 3.46Å; N88-L90 VanDerWaalsContact C-N 3.31Å; N88-L90 PolarHBondContact O-N 3.5Å; N88-P92 WeakPolarHBondContact O-CD 3.45Å
89	Y	95.3	Very high	94.7	Very high	30 Å²	30	69.1 Å²	69.1	12%	0.118	33%	0.327	C	S	.	.	S	Bend	trans	-67.1	-25	-171	65.8	-96.1	0	0	0	114.6	M32 D34 D35 L50 V54 V87 Y93	M32-Y89 HydrophobicContact CB-CE1 4.12Å; M32-Y89 HydrophobicContact CE-CD1 4.44Å; M32-Y89 HydrophobicContact SD-CD1 4.03Å; M32-Y89 HydrophobicContact SD-CE1 4.02Å; D34-Y89 HydrophobicContact CB-CD1 4.2Å; D34-Y89 HydrophobicContact CB-CE1 3.64Å; D34-Y89 HydrophobicContact CB-CE2 4.18Å; D34-Y89 PolarHBondContact O-OH 2.9Å; D34-Y89 PolarHBondContact OD2-N 3.28Å; D34-Y89 VanDerWaalsContact OD2-N 3.12Å; D35-Y89 PolarHBondContact N-OH 3.34Å; D35-Y89 PolarHBondContact OD1-OH 2.94Å; L50-Y89 HydrophobicContact CD1-CD2 4.26Å; L50-Y89 HydrophobicContact CD1-CE2 4.09Å; L50-Y89 HydrophobicContact CD2-CD2 4.13Å; V54-Y89 HydrophobicContact CG1-CD2 3.79Å; V54-Y89 HydrophobicContact CG1-CE2 4.48Å; V54-Y89 HydrophobicContact CG1-CG 4.12Å; V87-Y89 WeakPolarHBondContact O-CD1 3.48Å; V87-Y89 PolarHBondContact O-N 3.44Å; Y89-Y93 WeakPolarHBondContact O-CD2 3.29Å; Y89-Y93 WeakPolarHBondContact O-CE2 3.42Å
90	L	95.9	Very high	94.8	Very high	2 Å²	2	67.1 Å²	67.1	1%	0.01	32%	0.318	C	S	.	.	S	Bend	trans	-94	-26.7	-177.1	-175	60.4	0	0	0	112.4	D34 I37 V43 A46 L47 L50 N88 P92 Y93 L94	D34-L90 HydrophobicContact CB-CB 3.85Å; D34-L90 WeakPolarHBondContact OD2-CA 3.44Å; D34-L90 WeakPolarHBondContact OD2-CB 3.42Å; D34-L90 PolarHBondContact OD2-N 3.2Å; I37-L90 HydrophobicContact CG2-CD2 4.07Å; V43-L90 HydrophobicContact CG1-CD2 4.25Å; A46-L90 HydrophobicContact CB-CD1 3.71Å; A46-L90 HydrophobicContact CB-CG 4.48Å; L47-L90 HydrophobicContact CD2-CD1 3.98Å; L47-L90 HydrophobicContact CD2-CD2 4.05Å; L47-L90 HydrophobicContact CG-CD1 4.31Å; L47-L90 HydrophobicContact CG-CD2 4.43Å; L50-L90 HydrophobicContact CD1-CD1 4.1Å; L50-L90 HydrophobicContact CD2-CD1 4.43Å; L50-L90 HydrophobicContact CG-CD1 4.25Å; N88-L90 VanDerWaalsContact C-N 3.31Å; N88-L90 PolarHBondContact O-N 3.5Å; L90-P92 VanDerWaalsContact C-CD 3.48Å; L90-Y93 PolarHBondContact O-N 3.49Å; L90-Y93 VanDerWaalsContact O-N 3.15Å; L90-L94 PolarHBondContact O-N 3.03Å
91	T	94.9	Very high	94.8	Very high	35 Å²	35	68.2 Å²	68.2	22%	0.215	32%	0.322	C	S	.	.	H	α-helix	trans	-52.2	-45.5	-174.5	-58.9	0	0	0	0	113.6	R33 D34 Y93 L94 E95	R33-T91 PolarHBondContact NH2-OG1 3.35Å; D34-T91 PolarHBondContact OD2-N 3.34Å; T91-Y93 PolarHBondContact O-N 3.04Å; T91-L94 PolarHBondContact O-N 2.95Å; T91-E95 HydrophobicContact CG2-CG 4.29Å; T91-E95 WeakPolarHBondContact CG2-OE1 3.28Å; T91-E95 WeakPolarHBondContact O-CG 3.28Å; T91-E95 PolarHBondContact O-N 3.38Å
92	P	96.3	Very high	94.9	Very high	78 Å²	78	72.4 Å²	72.4	51%	0.506	34%	0.338	S	S	.	.	H	α-helix	trans	-61.6	-40.5	-179.7	-23.4	34.6	0	0	0	113.5	N88 L90 E96	N88-P92 WeakPolarHBondContact O-CD 3.45Å; L90-P92 VanDerWaalsContact C-CD 3.48Å; P92-E96 PolarHBondContact O-N 3.28Å
93	Y	96.8	Very high	95.1	Very high	71 Å²	71	73.1 Å²	73.1	28%	0.278	34%	0.343	S	S	.	.	H	α-helix	trans	-71.7	-37.9	179	-58.5	-79.6	0	0	0	111.6	R49 L50 Y89 L90 T91 E96 V97	R49-Y93 HydrophobicContact CB-CD1 3.96Å; L50-Y93 HydrophobicContact CD2-CD2 3.59Å; L50-Y93 HydrophobicContact CD2-CE2 3.51Å; L50-Y93 HydrophobicContact CD2-CG 4.47Å; Y89-Y93 WeakPolarHBondContact O-CD2 3.29Å; Y89-Y93 WeakPolarHBondContact O-CE2 3.42Å; L90-Y93 PolarHBondContact O-N 3.49Å; L90-Y93 VanDerWaalsContact O-N 3.15Å; T91-Y93 PolarHBondContact O-N 3.04Å; Y93-E96 PolarHBondContact O-N 3.49Å; Y93-V97 WeakPolarHBondContact O-CG2 3.44Å; Y93-V97 PolarHBondContact O-N 2.79Å
94	L	96.3	Very high	95.3	Very high	24 Å²	24	76.3 Å²	76.3	13%	0.126	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-42	178	-176.8	60	0	0	0	111.7	I37 D42 V43 A46 L90 T91 E96 V97 I98	I37-L94 HydrophobicContact CD1-CD2 3.7Å; D42-L94 HydrophobicContact CB-CD1 4.07Å; V43-L94 HydrophobicContact CG2-CD1 3.79Å; V43-L94 HydrophobicContact CG2-CD2 4.12Å; A46-L94 HydrophobicContact CB-CB 4.13Å; A46-L94 HydrophobicContact CB-CD1 4.24Å; L90-L94 PolarHBondContact O-N 3.03Å; T91-L94 PolarHBondContact O-N 2.95Å; L94-E96 VanDerWaalsContact C-N 3.28Å; L94-E96 PolarHBondContact O-N 2.92Å; L94-V97 PolarHBondContact O-N 3.16Å; L94-I98 HydrophobicContact CD1-CD1 4.04Å; L94-I98 HydrophobicContact CD1-CG1 4.27Å; L94-I98 HydrophobicContact CG-CD1 3.85Å; L94-I98 HydrophobicContact CG-CG1 4.47Å; L94-I98 WeakPolarHBondContact O-CB 3.37Å; L94-I98 VanDerWaalsContact O-CG1 3.27Å; L94-I98 WeakPolarHBondContact O-CG1 3.27Å; L94-I98 PolarHBondContact O-N 3.34Å
95	E	96.9	Very high	95.5	Very high	129 Å²	129	72.3 Å²	72.3	60%	0.603	34%	0.336	S	S	*	.	H	α-helix	trans	-61.3	-38.1	175.1	-74.2	177	178.8	0	0	111.9	T91 R99	T91-E95 HydrophobicContact CG2-CG 4.29Å; T91-E95 WeakPolarHBondContact CG2-OE1 3.28Å; T91-E95 WeakPolarHBondContact O-CG 3.28Å; T91-E95 PolarHBondContact O-N 3.38Å; E95-R99 VanDerWaalsContact O-CB 3.29Å; E95-R99 WeakPolarHBondContact O-CB 3.46Å; E95-R99 PolarHBondContact O-N 3.44Å
96	E	97.3	Very high	95.8	Very high	69 Å²	69	73.5 Å²	73.5	32%	0.322	34%	0.342	S	S	.	.	H	α-helix	trans	-63.1	-50.6	175	-172.6	-177.8	-141.3	0	0	111.8	R49 P92 Y93 L94 I98 R99 E100	R49-E96 VanDerWaalsContact NH1-CD 3.28Å; R49-E96 IonicContact NH1-OE1 3.34Å; R49-E96 IonicContact NH1-OE2 3.02Å; R49-E96 PolarHBondContact NH1-OE2 3.07Å; P92-E96 PolarHBondContact O-N 3.28Å; Y93-E96 PolarHBondContact O-N 3.49Å; L94-E96 VanDerWaalsContact C-N 3.28Å; L94-E96 PolarHBondContact O-N 2.92Å; E96-I98 PolarHBondContact O-N 3.21Å; E96-R99 WeakPolarHBondContact O-CB 3.39Å; E96-R99 PolarHBondContact O-N 2.94Å; E96-R99 VanDerWaalsContact O-N 3.17Å; E96-E100 WeakPolarHBondContact O-CG 3.4Å; E96-E100 PolarHBondContact O-N 3.14Å
97	V	97.4	Very high	96.1	Very high	0 Å²	0	81.6 Å²	81.6	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-60.3	-44.8	178.7	172.4	0	0	0	0	111.4	D42 E45 A46 Y93 L94 R99 E100 R101	D42-V97 HydrophobicContact CB-CG1 3.9Å; E45-V97 HydrophobicContact CB-CG1 4.12Å; E45-V97 HydrophobicContact CB-CG2 4.19Å; E45-V97 HydrophobicContact CG-CG1 4.31Å; E45-V97 HydrophobicContact CG-CG2 3.89Å; A46-V97 HydrophobicContact CB-CG2 4.34Å; Y93-V97 WeakPolarHBondContact O-CG2 3.44Å; Y93-V97 PolarHBondContact O-N 2.79Å; L94-V97 PolarHBondContact O-N 3.16Å; V97-R99 VanDerWaalsContact C-N 3.3Å; V97-R99 PolarHBondContact O-N 2.93Å; V97-E100 PolarHBondContact O-N 2.99Å; V97-R101 PolarHBondContact O-N 3.02Å
98	I	96.8	Very high	96.2	Very high	50 Å²	50	84.6 Å²	84.6	26%	0.256	38%	0.38	S	S	.	.	H	α-helix	trans	-63	-39.2	178.2	-69.4	170.5	0	0	0	110.6	D42 L94 E96 R101 K102	D42-I98 HydrophobicContact CB-CG1 4.42Å; L94-I98 HydrophobicContact CD1-CD1 4.04Å; L94-I98 HydrophobicContact CD1-CG1 4.27Å; L94-I98 HydrophobicContact CG-CD1 3.85Å; L94-I98 HydrophobicContact CG-CG1 4.47Å; L94-I98 WeakPolarHBondContact O-CB 3.37Å; L94-I98 VanDerWaalsContact O-CG1 3.27Å; L94-I98 WeakPolarHBondContact O-CG1 3.27Å; L94-I98 PolarHBondContact O-N 3.34Å; E96-I98 PolarHBondContact O-N 3.21Å; I98-R101 PolarHBondContact O-N 2.79Å; I98-K102 HydrophobicContact CG2-CD 4.12Å; I98-K102 WeakPolarHBondContact O-CB 3.32Å; I98-K102 WeakPolarHBondContact O-CG 3.49Å; I98-K102 PolarHBondContact O-N 3.45Å
99	R	97.6	Very high	96.1	Very high	156 Å²	156	89 Å²	89	59%	0.589	40%	0.397	S	S	*	.	H	α-helix	trans	-63.8	-47.9	177.1	-179.3	178.1	62.4	-163.9	-2.9	111.3	E95 E96 V97 R101 K102 E103	E95-R99 VanDerWaalsContact O-CB 3.29Å; E95-R99 WeakPolarHBondContact O-CB 3.46Å; E95-R99 PolarHBondContact O-N 3.44Å; E96-R99 WeakPolarHBondContact O-CB 3.39Å; E96-R99 PolarHBondContact O-N 2.94Å; E96-R99 VanDerWaalsContact O-N 3.17Å; V97-R99 VanDerWaalsContact C-N 3.3Å; V97-R99 PolarHBondContact O-N 2.93Å; R99-R101 VanDerWaalsContact C-N 3.32Å; R99-R101 PolarHBondContact O-N 3.27Å; R99-K102 PolarHBondContact O-N 3.43Å; R99-E103 WeakPolarHBondContact O-CB 3.37Å; R99-E103 PolarHBondContact O-N 3.41Å
100	E	96.9	Very high	95.2	Very high	60 Å²	60	98.6 Å²	98.6	28%	0.28	44%	0.439	S	S	.	.	H	α-helix	trans	-61.8	-38.7	177	-70.4	173.2	-161.1	0	0	112.4	R49 E96 V97 R104	R49-E100 IonicContact CZ-OE1 3.75Å; R49-E100 IonicContact CZ-OE2 3.31Å; R49-E100 IonicContact NH1-OE1 3.47Å; R49-E100 PolarHBondContact NH1-OE1 3.47Å; R49-E100 IonicContact NH1-OE2 3.65Å; R49-E100 IonicContact NH2-OE1 2.79Å; R49-E100 PolarHBondContact NH2-OE1 3.07Å; R49-E100 IonicContact NH2-OE2 2.97Å; R49-E100 PolarHBondContact NH2-OE2 2.61Å; E96-E100 WeakPolarHBondContact O-CG 3.4Å; E96-E100 PolarHBondContact O-N 3.14Å; V97-E100 PolarHBondContact O-N 2.99Å; E100-R104 WeakPolarHBondContact O-CG 3.48Å; E100-R104 PolarHBondContact O-N 2.93Å
101	R	96.4	Very high	95.1	Very high	82 Å²	82	103.5 Å²	103.5	31%	0.309	46%	0.46	S	S	.	.	H	α-helix	trans	-63.4	-48.2	174.7	-179.8	173.9	61.2	90.1	-9.5	111.4	D42 V97 I98 R99 E103 R104 E105	D42-R101 IonicContact OD1-NE 3.55Å; D42-R101 PolarHBondContact OD1-NE 3.47Å; D42-R101 IonicContact OD2-CZ 2.75Å; D42-R101 IonicContact OD2-NE 3.71Å; D42-R101 PolarHBondContact OD2-NE 3.12Å; D42-R101 IonicContact OD2-NH2 2.72Å; D42-R101 PolarHBondContact OD2-NH2 3.09Å; V97-R101 PolarHBondContact O-N 3.02Å; I98-R101 PolarHBondContact O-N 2.79Å; R99-R101 VanDerWaalsContact C-N 3.32Å; R99-R101 PolarHBondContact O-N 3.27Å; R101-E103 VanDerWaalsContact C-N 3.33Å; R101-E103 PolarHBondContact O-N 3.38Å; R101-R104 PolarHBondContact O-N 2.9Å; R101-E105 HydrophobicContact CG-CG 4.48Å; R101-E105 WeakPolarHBondContact CG-OE1 3.5Å; R101-E105 IonicContact CZ-OE1 3.66Å; R101-E105 IonicContact NH1-OE1 2.74Å; R101-E105 PolarHBondContact NH1-OE1 2.93Å; R101-E105 IonicContact NH1-OE2 4Å; R101-E105 WeakPolarHBondContact O-CG 3.33Å; R101-E105 PolarHBondContact O-N 2.88Å
102	K	96.8	Very high	95.1	Very high	108 Å²	108	107.1 Å²	107.1	47%	0.47	47%	0.473	S	S	.	.	H	α-helix	trans	-61.1	-41.6	178.5	-75	176.2	179.7	179.1	0	112	I98 R99 E105 E106	I98-K102 HydrophobicContact CG2-CD 4.12Å; I98-K102 WeakPolarHBondContact O-CB 3.32Å; I98-K102 WeakPolarHBondContact O-CG 3.49Å; I98-K102 PolarHBondContact O-N 3.45Å; R99-K102 PolarHBondContact O-N 3.43Å; K102-E105 PolarHBondContact O-N 3.47Å; K102-E106 WeakPolarHBondContact O-CB 3.48Å; K102-E106 WeakPolarHBondContact O-CG 3.36Å; K102-E106 PolarHBondContact O-N 2.98Å
103	E	97.1	Very high	95.1	Very high	129 Å²	129	108.7 Å²	108.7	60%	0.603	47%	0.471	S	S	*	.	H	α-helix	trans	-60.7	-45.4	176	-176.2	176.7	-177.7	0	0	111.6	R99 R101 E105 E106 W107	R99-E103 WeakPolarHBondContact O-CB 3.37Å; R99-E103 PolarHBondContact O-N 3.41Å; R101-E103 VanDerWaalsContact C-N 3.33Å; R101-E103 PolarHBondContact O-N 3.38Å; E103-E105 PolarHBondContact O-N 3.25Å; E103-E106 PolarHBondContact O-N 3.26Å; E103-W107 WeakPolarHBondContact O-CB 3.16Å; E103-W107 PolarHBondContact O-N 2.74Å
104	R	95.8	Very high	95	Very high	143 Å²	143	110.9 Å²	110.9	54%	0.54	48%	0.483	S	S	.	.	H	α-helix	trans	-61.1	-43.2	174.2	-74.5	-175.5	-70.1	169.8	-5.2	112.2	E100 R101 W107 M108	E100-R104 WeakPolarHBondContact O-CG 3.48Å; E100-R104 PolarHBondContact O-N 2.93Å; R101-R104 PolarHBondContact O-N 2.9Å; R104-W107 PolarHBondContact O-N 3.23Å; R104-M108 WeakPolarHBondContact O-CB 3.43Å; R104-M108 WeakPolarHBondContact O-CG 3.17Å; R104-M108 PolarHBondContact O-N 3.31Å
105	E	96.1	Very high	94.9	Very high	71 Å²	71	116.3 Å²	116.3	33%	0.332	51%	0.505	S	S	.	.	H	α-helix	trans	-63.5	-40	177.2	-73.1	174.4	-162.4	0	0	112.3	R101 K102 E103 K109	R101-E105 HydrophobicContact CG-CG 4.48Å; R101-E105 WeakPolarHBondContact CG-OE1 3.5Å; R101-E105 IonicContact CZ-OE1 3.66Å; R101-E105 IonicContact NH1-OE1 2.74Å; R101-E105 PolarHBondContact NH1-OE1 2.93Å; R101-E105 IonicContact NH1-OE2 4Å; R101-E105 WeakPolarHBondContact O-CG 3.33Å; R101-E105 PolarHBondContact O-N 2.88Å; K102-E105 PolarHBondContact O-N 3.47Å; E103-E105 PolarHBondContact O-N 3.25Å; E105-K109 WeakPolarHBondContact O-CD 3.39Å; E105-K109 WeakPolarHBondContact O-CG 3.32Å; E105-K109 PolarHBondContact O-N 3.2Å
106	E	96.4	Very high	94.8	Very high	125 Å²	125	115.5 Å²	115.5	58%	0.584	50%	0.499	S	S	*	.	H	α-helix	trans	-68.9	-37.4	176.6	-74.7	176.9	-170.6	0	0	112.2	K102 E103	K102-E106 WeakPolarHBondContact O-CB 3.48Å; K102-E106 WeakPolarHBondContact O-CG 3.36Å; K102-E106 PolarHBondContact O-N 2.98Å; E103-E106 PolarHBondContact O-N 3.26Å
107	W	95.8	Very high	94.6	Very high	193 Å²	193	118.8 Å²	118.8	73%	0.731	51%	0.511	S	S	*	.	H	α-helix	trans	-64.1	-45.6	174.3	-177.6	-95.7	0	0	0	111.9	E103 R104 K109 K110	E103-W107 WeakPolarHBondContact O-CB 3.16Å; E103-W107 PolarHBondContact O-N 2.74Å; R104-W107 PolarHBondContact O-N 3.23Å; W107-K109 VanDerWaalsContact C-N 3.27Å; W107-K109 PolarHBondContact O-N 3.24Å; W107-K110 PolarHBondContact O-N 3.36Å
108	M	93.3	Very high	94.4	Very high	154 Å²	154	127.9 Å²	127.9	76%	0.759	55%	0.551	S	S	*	*	H	α-helix	trans	-73.3	-16.5	-178.2	-64.4	-69.2	-80.7	0	0	113.9	R104	R104-M108 WeakPolarHBondContact O-CB 3.43Å; R104-M108 WeakPolarHBondContact O-CG 3.17Å; R104-M108 PolarHBondContact O-N 3.31Å
109	K	92.6	Very high	94.2	Very high	161 Å²	161	134.4 Å²	134.4	70%	0.7	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-18.8	173.8	-76.5	166.6	-169.9	167.1	0	112.9	E105 W107	E105-K109 WeakPolarHBondContact O-CD 3.39Å; E105-K109 WeakPolarHBondContact O-CG 3.32Å; E105-K109 PolarHBondContact O-N 3.2Å; W107-K109 VanDerWaalsContact C-N 3.27Å; W107-K109 PolarHBondContact O-N 3.24Å
110	K	75.2	Confident	93.9	Very high	231 Å²	231	132.5 Å²	132.5	100%	1.004	57%	0.574	S	S	*	*			trans	-86.9	0	174.3	-73.5	-178.8	177.8	176.4	0	110.3	W107	W107-K110 PolarHBondContact O-N 3.36Å

Retrieved 110 of 110 residues in 22.8 ms (Link to these results)

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