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Mediator of RNA polymerase II transcription subunit 22

Component of the Mediator complex, a coactivator involved in the regulated transcription of nearly all RNA polymerase II-dependent genes. Mediator functions as a bridge to convey information from gene-specific regulatory proteins to the basal RNA polymerase II transcription machinery. Mediator is recruited to promoters by direct interactions with regulatory proteins and serves as a scaffold for the assembly of a functional preinitiation complex with RNA polymerase II and the general transcription factors.

AlphaFold DB , UniProt , Accession G4V5E8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 160 aa.

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(Predicted Aligned Error values between residue pairs)

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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	45	Very low	40.7	Very low	246 Å²	246	156.4 Å²	156.4	100%	1.212	84%	0.844	S	S	*	*				0	134	0	-75	-168.5	148.2	0	0	108.6
2	Q	38.2	Very low	40.8	Very low	197 Å²	197	157.2 Å²	157.2	92%	0.921	84%	0.838	S	S	*	*			trans	-58.5	130.7	-165.4	-77.3	161.9	-4.4	0	0	113.5	N4	Q2-N4 PolarHBondContact O-N 3.34Å
3	S	39.5	Very low	41.6	Very low	112 Å²	112	152.7 Å²	152.7	78%	0.783	82%	0.823	S	S	*	*			trans	-64.7	110.2	173.8	-56.2	0	0	0	0	110.3	Q5	S3-Q5 PolarHBondContact O-N 2.88Å
4	N	43.5	Very low	42.6	Very low	159 Å²	159	148.1 Å²	148.1	85%	0.85	80%	0.799	S	S	*	*			trans	-66.7	94.5	170.4	-114.8	-4.2	0	0	0	108.8	Q2 R6	Q2-N4 PolarHBondContact O-N 3.34Å; N4-R6 PolarHBondContact O-N 2.78Å
5	Q	42	Very low	43.9	Very low	184 Å²	184	143.3 Å²	143.3	86%	0.86	77%	0.768	S	S	*	*			trans	-67.9	81.2	165.1	-68.2	-172.6	8.9	0	0	108.1	S3 S7	S3-Q5 PolarHBondContact O-N 2.88Å; Q5-S7 PolarHBondContact O-N 3.37Å
6	R	37.3	Very low	45.6	Very low	222 Å²	222	138.8 Å²	138.8	84%	0.838	75%	0.748	S	S	*	*			trans	-68.6	93.8	160.2	-104.3	-177.5	177.2	179.7	-0.3	106.4	N4 T8	N4-R6 PolarHBondContact O-N 2.78Å; R6-T8 VanDerWaalsContact C-N 3.31Å; R6-T8 PolarHBondContact O-N 2.77Å
7	S	37.8	Very low	47	Very low	107 Å²	107	140.9 Å²	140.9	75%	0.748	74%	0.743	S	S	*	*			trans	-43.1	97	159.3	44.5	0	0	0	0	108.8	Q5 S9	Q5-S7 PolarHBondContact O-N 3.37Å; S7-S9 PolarHBondContact O-N 3.47Å
8	T	41.5	Very low	48.8	Very low	132 Å²	132	141.1 Å²	141.1	81%	0.81	74%	0.737	S	S	*	*			trans	-68.5	84.6	167	42.5	0	0	0	0	106	R6 S10	R6-T8 VanDerWaalsContact C-N 3.31Å; R6-T8 PolarHBondContact O-N 2.77Å; T8-S10 PolarHBondContact O-N 2.95Å
9	S	40.2	Very low	50.7	Low	96 Å²	96	140 Å²	140	67%	0.671	72%	0.722	S	S	*	*			trans	-41.8	113.2	166	45.5	0	0	0	0	107.5	S7 N11	S7-S9 PolarHBondContact O-N 3.47Å; S9-N11 PolarHBondContact O-N 3.5Å
10	S	41.2	Very low	52.5	Low	107 Å²	107	137.9 Å²	137.9	75%	0.748	71%	0.712	S	S	*	*			trans	-57.7	81.3	-177.1	52.2	0	0	0	0	110.2	T8 Q12	T8-S10 PolarHBondContact O-N 2.95Å; S10-Q12 PolarHBondContact O-N 2.87Å
11	N	42	Very low	54.4	Low	158 Å²	158	135.9 Å²	135.9	85%	0.845	71%	0.706	S	S	*	*			trans	-73.4	58.4	160.8	-88.9	-17.8	0	0	0	108	S9	S9-N11 PolarHBondContact O-N 3.5Å
12	Q	41.7	Very low	56.6	Low	166 Å²	166	127.3 Å²	127.3	78%	0.776	66%	0.663	S	S	*	*			trans	-59.3	140	164.7	-87.7	-154.2	-22.3	0	0	108	S10 N14	S10-Q12 PolarHBondContact O-N 2.87Å; Q12-N14 PolarHBondContact O-N 3.39Å
13	P	50.6	Low	59.3	Low	99 Å²	99	120.2 Å²	120.2	64%	0.643	63%	0.633	S	S	*	*			trans	-74	96.2	-158.3	29.6	-33.5	0	0	0	108.9	F15 P16	P13-F15 HydrophobicContact CB-CB 4.05Å; P13-F15 PolarHBondContact O-N 2.99Å; P13-P16 WeakPolarHBondContact O-CD 3.14Å
14	N	56.1	Low	62	Low	89 Å²	89	120.5 Å²	120.5	48%	0.476	62%	0.622	S	S	.	*			trans	-65.3	17.2	163.2	-152.9	18	0	0	0	111.8	Q12 R17 K18	Q12-N14 PolarHBondContact O-N 3.39Å; N14-R17 PolarHBondContact O-N 2.95Å; N14-R17 WeakPolarHBondContact OD1-CB 3.42Å; N14-R17 WeakPolarHBondContact OD1-CD 3.32Å; N14-K18 WeakPolarHBondContact O-CG 3.32Å; N14-K18 PolarHBondContact O-N 2.99Å
15	F	62.6	Low	64.5	Low	76 Å²	76	114.5 Å²	114.5	33%	0.333	60%	0.597	S	S	.	*	H	α-helix	trans	-64.1	-41.9	-176.6	-148.8	-91.3	0	0	0	112.7	P13 R17 K18 R19 R103	P13-F15 HydrophobicContact CB-CB 4.05Å; P13-F15 PolarHBondContact O-N 2.99Å; F15-R17 VanDerWaalsContact C-N 3.31Å; F15-R17 PolarHBondContact O-N 3.39Å; F15-K18 PolarHBondContact O-N 3.41Å; F15-R19 VanDerWaalsContact O-CB 3.25Å; F15-R19 WeakPolarHBondContact O-CB 3.3Å; F15-R19 PolarHBondContact O-N 3.39Å; F15-R103 VanDerWaalsContact CZ-NE 3.3Å
16	P	71.2	Confident	67.1	Low	71 Å²	71	106.5 Å²	106.5	46%	0.461	56%	0.56	S	S	.	*	H	α-helix	trans	-61.4	-42	174.1	-19.5	31.8	0	0	0	111.3	P13 R19 N20	P13-P16 WeakPolarHBondContact O-CD 3.14Å; P16-R19 PolarHBondContact O-N 3.19Å; P16-N20 WeakPolarHBondContact O-CB 3.3Å; P16-N20 PolarHBondContact O-N 3.44Å; P16-N20 PolarHBondContact O-ND2 2.7Å
17	R	68.9	Low	70	Confident	174 Å²	174	101.4 Å²	101.4	66%	0.657	54%	0.544	S	S	*	.	H	α-helix	trans	-65.7	-48.7	178.1	-166.2	175.4	176.5	169.7	-1.7	111.3	N14 F15 R19 N20 T21	N14-R17 PolarHBondContact O-N 2.95Å; N14-R17 WeakPolarHBondContact OD1-CB 3.42Å; N14-R17 WeakPolarHBondContact OD1-CD 3.32Å; F15-R17 VanDerWaalsContact C-N 3.31Å; F15-R17 PolarHBondContact O-N 3.39Å; R17-R19 VanDerWaalsContact C-N 3.35Å; R17-R19 PolarHBondContact O-N 2.94Å; R17-N20 PolarHBondContact O-N 2.98Å; R17-T21 PolarHBondContact O-N 3.32Å; R17-T21 PolarHBondContact O-OG1 3.42Å; R17-T21 VanDerWaalsContact O-OG1 3.06Å
18	K	79	Confident	72.9	Confident	145 Å²	145	100 Å²	100	63%	0.63	53%	0.534	S	S	*	.	H	α-helix	trans	-58.6	-43.5	175.5	-72.9	-176.7	179.7	-172.4	0	112.1	N14 F15 T21 H22	N14-K18 WeakPolarHBondContact O-CG 3.32Å; N14-K18 PolarHBondContact O-N 2.99Å; F15-K18 PolarHBondContact O-N 3.41Å; K18-T21 PolarHBondContact O-N 3.4Å; K18-H22 WeakPolarHBondContact O-CB 3.41Å; K18-H22 PolarHBondContact O-N 3.35Å
19	R	84.9	Confident	75.6	Confident	120 Å²	120	98.6 Å²	98.6	45%	0.453	51%	0.514	S	S	.	.	H	α-helix	trans	-57.5	-51.5	173	172.2	-172.8	-54.7	154.6	-4.6	110.7	F15 P16 R17 T21 H22 V23 F96	F15-R19 VanDerWaalsContact O-CB 3.25Å; F15-R19 WeakPolarHBondContact O-CB 3.3Å; F15-R19 PolarHBondContact O-N 3.39Å; P16-R19 PolarHBondContact O-N 3.19Å; R17-R19 VanDerWaalsContact C-N 3.35Å; R17-R19 PolarHBondContact O-N 2.94Å; R19-T21 VanDerWaalsContact C-N 3.35Å; R19-T21 PolarHBondContact O-N 3.06Å; R19-H22 PolarHBondContact O-N 3.2Å; R19-V23 HydrophobicContact CG-CG2 4.34Å; R19-V23 WeakPolarHBondContact O-CG2 3.48Å; R19-V23 PolarHBondContact O-N 3.24Å; R19-F96 HydrophobicContact CB-CZ 4.48Å; R19-F96 HydrophobicContact CG-CE1 4.5Å; R19-F96 HydrophobicContact CG-CZ 3.83Å
20	N	87.3	Confident	78.3	Confident	97 Å²	97	97.5 Å²	97.5	52%	0.519	50%	0.5	S	S	.	.	H	α-helix	trans	-61.2	-44.9	-178.1	-71.6	-15.8	0	0	0	111	P16 R17 H22 V23 Q24	P16-N20 WeakPolarHBondContact O-CB 3.3Å; P16-N20 PolarHBondContact O-N 3.44Å; P16-N20 PolarHBondContact O-ND2 2.7Å; R17-N20 PolarHBondContact O-N 2.98Å; N20-H22 VanDerWaalsContact C-N 3.33Å; N20-H22 PolarHBondContact O-N 3.5Å; N20-V23 PolarHBondContact O-N 2.93Å; N20-Q24 WeakPolarHBondContact O-CB 3.38Å; N20-Q24 VanDerWaalsContact O-CG 3.24Å; N20-Q24 WeakPolarHBondContact O-CG 3.36Å; N20-Q24 PolarHBondContact O-N 3.29Å
21	T	91.5	Very high	81.1	Confident	96 Å²	96	100.3 Å²	100.3	59%	0.589	50%	0.495	S	S	*	.	H	α-helix	trans	-58.4	-44.3	175.1	-57.9	0	0	0	0	111.8	R17 K18 R19 Q24 G25	R17-T21 PolarHBondContact O-N 3.32Å; R17-T21 PolarHBondContact O-OG1 3.42Å; R17-T21 VanDerWaalsContact O-OG1 3.06Å; K18-T21 PolarHBondContact O-N 3.4Å; R19-T21 VanDerWaalsContact C-N 3.35Å; R19-T21 PolarHBondContact O-N 3.06Å; T21-Q24 PolarHBondContact O-N 2.96Å; T21-G25 PolarHBondContact O-N 3.43Å
22	H	91.6	Very high	83.8	Confident	67 Å²	67	96.4 Å²	96.4	31%	0.31	48%	0.48	S	S	.	.	H	α-helix	trans	-63.4	-47	177.9	-174.7	65	0	0	0	111.9	K18 R19 N20 Q24 G25 L26 E92 F96	K18-H22 WeakPolarHBondContact O-CB 3.41Å; K18-H22 PolarHBondContact O-N 3.35Å; R19-H22 PolarHBondContact O-N 3.2Å; N20-H22 VanDerWaalsContact C-N 3.33Å; N20-H22 PolarHBondContact O-N 3.5Å; H22-Q24 VanDerWaalsContact C-N 3.3Å; H22-Q24 PolarHBondContact O-N 2.92Å; H22-G25 WeakPolarHBondContact O-CA 3.29Å; H22-G25 PolarHBondContact O-N 3.47Å; H22-G25 VanDerWaalsContact O-N 3.09Å; H22-L26 WeakPolarHBondContact O-CG 3.47Å; H22-L26 PolarHBondContact O-N 2.96Å; H22-E92 IonicContact CE1-OE1 3.35Å; H22-E92 PolarHBondContact CE1-OE1 2.94Å; H22-F96 AromaticContact CD2-CD2 3.53Å; H22-F96 AromaticContact CD2-CE2 3.89Å; H22-F96 AromaticContact CD2-CG 4Å; H22-F96 AromaticContact NE2-CD2 3.85Å
23	V	94.7	Very high	86.5	Confident	47 Å²	47	89.4 Å²	89.4	29%	0.285	45%	0.448	S	S	.	.	H	α-helix	trans	-60.7	-39.7	176.4	172.3	0	0	0	0	111.5	R19 N20 L26 K27	R19-V23 HydrophobicContact CG-CG2 4.34Å; R19-V23 WeakPolarHBondContact O-CG2 3.48Å; R19-V23 PolarHBondContact O-N 3.24Å; N20-V23 PolarHBondContact O-N 2.93Å; V23-L26 PolarHBondContact O-N 2.85Å; V23-K27 HydrophobicContact CG1-CD 4.44Å; V23-K27 WeakPolarHBondContact O-CG 3.48Å; V23-K27 PolarHBondContact O-N 2.99Å
24	Q	95.6	Very high	88.8	Confident	118 Å²	118	88.8 Å²	88.8	55%	0.551	44%	0.438	S	S	*	.	H	α-helix	trans	-65.3	-39.2	174.9	-69.1	-63	-8.1	0	0	111.9	N20 T21 H22 K27 S28	N20-Q24 WeakPolarHBondContact O-CB 3.38Å; N20-Q24 VanDerWaalsContact O-CG 3.24Å; N20-Q24 WeakPolarHBondContact O-CG 3.36Å; N20-Q24 PolarHBondContact O-N 3.29Å; T21-Q24 PolarHBondContact O-N 2.96Å; H22-Q24 VanDerWaalsContact C-N 3.3Å; H22-Q24 PolarHBondContact O-N 2.92Å; Q24-K27 PolarHBondContact O-N 3.35Å; Q24-S28 WeakPolarHBondContact O-CB 3.45Å; Q24-S28 PolarHBondContact O-N 3.07Å
25	G	96.9	Very high	90.8	Very high	33 Å²	33	88.8 Å²	88.8	34%	0.34	44%	0.438	S	S	.	.	H	α-helix	trans	-60	-45.2	173.3	0	0	0	0	0	112.7	T21 H22 S28 R29	T21-G25 PolarHBondContact O-N 3.43Å; H22-G25 WeakPolarHBondContact O-CA 3.29Å; H22-G25 PolarHBondContact O-N 3.47Å; H22-G25 VanDerWaalsContact O-N 3.09Å; G25-S28 PolarHBondContact O-N 3.25Å; G25-R29 WeakPolarHBondContact O-CG 3.41Å; G25-R29 PolarHBondContact O-N 3.25Å
26	L	97.3	Very high	92.5	Very high	16 Å²	16	87.3 Å²	87.3	8%	0.084	44%	0.437	C	S	.	.	H	α-helix	trans	-61.2	-45.5	175.6	-66.1	171.6	0	0	0	111.7	H22 V23 S28 R29 L30 L89 E92 I93	H22-L26 WeakPolarHBondContact O-CG 3.47Å; H22-L26 PolarHBondContact O-N 2.96Å; V23-L26 PolarHBondContact O-N 2.85Å; L26-S28 PolarHBondContact O-N 3.21Å; L26-R29 PolarHBondContact O-N 2.97Å; L26-L30 WeakPolarHBondContact O-CB 3.4Å; L26-L30 PolarHBondContact O-N 3.26Å; L26-L89 HydrophobicContact CD2-CD2 3.64Å; L26-E92 HydrophobicContact CD2-CB 4.44Å; L26-E92 HydrophobicContact CD2-CG 4.09Å; L26-I93 HydrophobicContact CD1-CG1 3.84Å
27	K	97.4	Very high	93.8	Very high	115 Å²	115	86 Å²	86	50%	0.5	43%	0.426	S	S	.	.	H	α-helix	trans	-60.6	-43.6	176	-75.5	-178.8	177.1	-174	0	112.3	V23 Q24 L30 R31	V23-K27 HydrophobicContact CG1-CD 4.44Å; V23-K27 WeakPolarHBondContact O-CG 3.48Å; V23-K27 PolarHBondContact O-N 2.99Å; Q24-K27 PolarHBondContact O-N 3.35Å; K27-L30 PolarHBondContact O-N 2.9Å; K27-R31 WeakPolarHBondContact O-CB 3.49Å; K27-R31 PolarHBondContact O-N 3.35Å
28	S	98.1	Very high	95.2	Very high	77 Å²	77	81.7 Å²	81.7	54%	0.538	42%	0.416	S	S	.	.	H	α-helix	trans	-62.3	-47	178.7	-171.9	0	0	0	0	111.4	Q24 G25 L26 L30 R31 S32	Q24-S28 WeakPolarHBondContact O-CB 3.45Å; Q24-S28 PolarHBondContact O-N 3.07Å; G25-S28 PolarHBondContact O-N 3.25Å; L26-S28 PolarHBondContact O-N 3.21Å; S28-L30 PolarHBondContact O-N 3.36Å; S28-R31 PolarHBondContact O-N 3.41Å; S28-S32 WeakPolarHBondContact O-CB 3.44Å; S28-S32 PolarHBondContact O-N 3.41Å
29	R	98.1	Very high	96.1	Very high	103 Å²	103	77.6 Å²	77.6	39%	0.389	41%	0.405	S	S	.	.	H	α-helix	trans	-63.7	-41.2	177.4	-73.2	168.5	61.5	-157.6	-5.8	111.6	G25 L26 S32 N33 L89 E92	G25-R29 WeakPolarHBondContact O-CG 3.41Å; G25-R29 PolarHBondContact O-N 3.25Å; L26-R29 PolarHBondContact O-N 2.97Å; R29-S32 PolarHBondContact O-N 3.24Å; R29-N33 PolarHBondContact O-N 2.93Å; R29-N33 PolarHBondContact O-ND2 3Å; R29-L89 HydrophobicContact CB-CD1 3.89Å; R29-L89 HydrophobicContact CB-CD2 3.86Å; R29-L89 HydrophobicContact CB-CG 4.45Å; R29-E92 IonicContact CZ-OE2 3.7Å; R29-E92 IonicContact NH1-OE1 3.22Å; R29-E92 PolarHBondContact NH1-OE1 3Å; R29-E92 IonicContact NH1-OE2 3.79Å; R29-E92 PolarHBondContact NH1-OE2 2.63Å; R29-E92 IonicContact NH2-OE2 2.9Å; R29-E92 PolarHBondContact NH2-OE2 3Å
30	L	98.5	Very high	96.8	Very high	73 Å²	73	72.5 Å²	72.5	38%	0.382	39%	0.387	S	S	.	.	H	α-helix	trans	-59.3	-50.5	175.2	177.8	61	0	0	0	111.1	L26 K27 S28 S32 N33 I34 I86 L89	L26-L30 WeakPolarHBondContact O-CB 3.4Å; L26-L30 PolarHBondContact O-N 3.26Å; K27-L30 PolarHBondContact O-N 2.9Å; S28-L30 PolarHBondContact O-N 3.36Å; L30-S32 VanDerWaalsContact C-N 3.32Å; L30-S32 PolarHBondContact O-N 3.17Å; L30-N33 PolarHBondContact O-N 2.93Å; L30-I34 HydrophobicContact CD1-CD1 3.86Å; L30-I34 HydrophobicContact CD1-CG1 4.21Å; L30-I34 HydrophobicContact CG-CD1 3.84Å; L30-I34 WeakPolarHBondContact O-CG1 3.39Å; L30-I34 PolarHBondContact O-N 3.14Å; L30-I86 HydrophobicContact CD1-CD1 4.44Å; L30-I86 HydrophobicContact CD1-CG1 4.21Å; L30-I86 HydrophobicContact CD1-CG2 4.42Å; L30-L89 HydrophobicContact CB-CD1 4.42Å
31	R	98.4	Very high	97.3	Very high	166 Å²	166	73.9 Å²	73.9	63%	0.626	39%	0.386	S	S	*	.	H	α-helix	trans	-59.3	-43.3	178.6	-169.6	-176.7	-60	162	1	111.9	K27 S28 N33 I34 N35	K27-R31 WeakPolarHBondContact O-CB 3.49Å; K27-R31 PolarHBondContact O-N 3.35Å; S28-R31 PolarHBondContact O-N 3.41Å; R31-N33 VanDerWaalsContact C-N 3.35Å; R31-N33 PolarHBondContact O-N 2.93Å; R31-I34 PolarHBondContact O-N 2.85Å; R31-N35 WeakPolarHBondContact O-CB 3.47Å; R31-N35 VanDerWaalsContact O-CG 3.23Å; R31-N35 PolarHBondContact O-N 3.38Å; R31-N35 PolarHBondContact O-OD1 2.7Å
32	S	98.6	Very high	97.6	Very high	76 Å²	76	74.5 Å²	74.5	53%	0.531	38%	0.382	S	S	.	.	H	α-helix	trans	-59.7	-43.9	177	-170.6	0	0	0	0	112.2	S28 R29 L30 S36	S28-S32 WeakPolarHBondContact O-CB 3.44Å; S28-S32 PolarHBondContact O-N 3.41Å; R29-S32 PolarHBondContact O-N 3.24Å; L30-S32 VanDerWaalsContact C-N 3.32Å; L30-S32 PolarHBondContact O-N 3.17Å; S32-S36 WeakPolarHBondContact O-CB 3.28Å; S32-S36 PolarHBondContact O-N 2.92Å
33	N	98.6	Very high	97.8	Very high	20 Å²	20	74.6 Å²	74.6	11%	0.107	38%	0.383	C	S	.	.	H	α-helix	trans	-69.9	-39.9	179.1	-74.4	-73.2	0	0	0	111.7	R29 L30 R31 S36 I37 A82 N85 I86	R29-N33 PolarHBondContact O-N 2.93Å; R29-N33 PolarHBondContact O-ND2 3Å; L30-N33 PolarHBondContact O-N 2.93Å; R31-N33 VanDerWaalsContact C-N 3.35Å; R31-N33 PolarHBondContact O-N 2.93Å; N33-S36 WeakPolarHBondContact O-CB 3.39Å; N33-S36 PolarHBondContact O-N 3.48Å; N33-I37 VanDerWaalsContact O-CG1 3.32Å; N33-I37 WeakPolarHBondContact O-CG1 3.48Å; N33-I37 PolarHBondContact O-N 3.22Å; N33-A82 HydrophobicContact CB-CB 4.33Å; N33-N85 WeakPolarHBondContact OD1-CB 3.44Å; N33-N85 PolarHBondContact OD1-ND2 3.48Å; N33-I86 HydrophobicContact CB-CD1 3.94Å; N33-I86 HydrophobicContact CB-CG1 3.75Å
34	I	98.6	Very high	97.9	Very high	85 Å²	85	74.1 Å²	74.1	44%	0.436	38%	0.379	S	S	.	.	H	α-helix	trans	-60.7	-46.4	174.6	-69.2	170.9	0	0	0	110.9	L30 R31 S36 I37 L38	L30-I34 HydrophobicContact CD1-CD1 3.86Å; L30-I34 HydrophobicContact CD1-CG1 4.21Å; L30-I34 HydrophobicContact CG-CD1 3.84Å; L30-I34 WeakPolarHBondContact O-CG1 3.39Å; L30-I34 PolarHBondContact O-N 3.14Å; R31-I34 PolarHBondContact O-N 2.85Å; I34-S36 VanDerWaalsContact C-N 3.29Å; I34-S36 PolarHBondContact O-N 2.87Å; I34-I37 PolarHBondContact O-N 3.21Å; I34-L38 WeakPolarHBondContact O-CB 3.37Å; I34-L38 PolarHBondContact O-N 2.98Å
35	N	98.6	Very high	97.8	Very high	90 Å²	90	72.2 Å²	72.2	48%	0.481	37%	0.372	S	S	.	.	H	α-helix	trans	-62.2	-38.5	177.7	-71.1	-5.8	0	0	0	111.8	R31 L38 S39	R31-N35 WeakPolarHBondContact O-CB 3.47Å; R31-N35 VanDerWaalsContact O-CG 3.23Å; R31-N35 PolarHBondContact O-N 3.38Å; R31-N35 PolarHBondContact O-OD1 2.7Å; N35-L38 PolarHBondContact O-N 3.37Å; N35-S39 VanDerWaalsContact O-CB 3.27Å; N35-S39 WeakPolarHBondContact O-CB 3.46Å; N35-S39 PolarHBondContact O-N 3.43Å
36	S	98.5	Very high	97.5	Very high	45 Å²	45	73.7 Å²	73.7	32%	0.315	38%	0.377	S	S	.	.	H	α-helix	trans	-62.7	-44.1	174.5	-173.3	0	0	0	0	111.6	S32 N33 I34 N40	S32-S36 WeakPolarHBondContact O-CB 3.28Å; S32-S36 PolarHBondContact O-N 2.92Å; N33-S36 WeakPolarHBondContact O-CB 3.39Å; N33-S36 PolarHBondContact O-N 3.48Å; I34-S36 VanDerWaalsContact C-N 3.29Å; I34-S36 PolarHBondContact O-N 2.87Å; S36-N40 WeakPolarHBondContact O-CB 3.44Å; S36-N40 PolarHBondContact O-N 3.31Å; S36-N40 VanDerWaalsContact O-N 3.08Å; S36-N40 PolarHBondContact O-ND2 3.39Å
37	I	98.8	Very high	97	Very high	42 Å²	42	77.6 Å²	77.6	22%	0.215	39%	0.391	C	S	.	.	H	α-helix	trans	-61.6	-51.4	176.9	-68.2	165.1	0	0	0	110.1	N33 I34 S39 N40 Y41 I79 A82 I86	N33-I37 VanDerWaalsContact O-CG1 3.32Å; N33-I37 WeakPolarHBondContact O-CG1 3.48Å; N33-I37 PolarHBondContact O-N 3.22Å; I34-I37 PolarHBondContact O-N 3.21Å; I37-S39 PolarHBondContact O-N 2.83Å; I37-N40 PolarHBondContact O-N 3.38Å; I37-Y41 VanDerWaalsContact O-CB 3.25Å; I37-Y41 WeakPolarHBondContact O-CB 3.41Å; I37-Y41 PolarHBondContact O-N 3.12Å; I37-I79 HydrophobicContact CG1-CG2 4.43Å; I37-I79 HydrophobicContact CG2-CG2 4.2Å; I37-A82 HydrophobicContact CD1-CB 4.01Å; I37-A82 HydrophobicContact CG1-CB 3.54Å; I37-I86 HydrophobicContact CD1-CD1 3.73Å
38	L	98.6	Very high	96.4	Very high	85 Å²	85	75.2 Å²	75.2	45%	0.445	39%	0.389	S	S	.	.	H	α-helix	trans	-58.2	-52.2	-178.6	179.4	62.2	0	0	0	111.3	I34 N35 N40 Y41 E42	I34-L38 WeakPolarHBondContact O-CB 3.37Å; I34-L38 PolarHBondContact O-N 2.98Å; N35-L38 PolarHBondContact O-N 3.37Å; L38-N40 PolarHBondContact O-N 2.96Å; L38-Y41 PolarHBondContact O-N 3.42Å; L38-Y41 VanDerWaalsContact O-N 3.16Å; L38-E42 HydrophobicContact CD1-CG 4.11Å; L38-E42 HydrophobicContact CG-CG 4.42Å; L38-E42 WeakPolarHBondContact O-CG 3.38Å; L38-E42 PolarHBondContact O-N 3.46Å
39	S	98.4	Very high	95.6	Very high	58 Å²	58	79.6 Å²	79.6	41%	0.406	40%	0.398	S	S	.	.	H	α-helix	trans	-61.1	-44.5	-178.5	175.8	0	0	0	0	112.3	N35 I37 Y41 E42 M43	N35-S39 VanDerWaalsContact O-CB 3.27Å; N35-S39 WeakPolarHBondContact O-CB 3.46Å; N35-S39 PolarHBondContact O-N 3.43Å; I37-S39 PolarHBondContact O-N 2.83Å; S39-Y41 VanDerWaalsContact C-N 3.31Å; S39-Y41 PolarHBondContact O-N 2.88Å; S39-E42 PolarHBondContact O-N 2.83Å; S39-M43 VanDerWaalsContact O-CG 3.31Å; S39-M43 WeakPolarHBondContact O-CG 3.43Å; S39-M43 PolarHBondContact O-N 3.07Å; S39-M43 VanDerWaalsContact O-N 3.11Å
40	N	98.4	Very high	94.3	Very high	14 Å²	14	81.7 Å²	81.7	8%	0.075	42%	0.415	C	S	.	.	H	α-helix	trans	-65.1	-38.2	177.1	-79.2	-80	0	0	0	111.6	S36 I37 L38 M43 I44 R75 N78 I79	S36-N40 WeakPolarHBondContact O-CB 3.44Å; S36-N40 PolarHBondContact O-N 3.31Å; S36-N40 VanDerWaalsContact O-N 3.08Å; S36-N40 PolarHBondContact O-ND2 3.39Å; I37-N40 PolarHBondContact O-N 3.38Å; L38-N40 PolarHBondContact O-N 2.96Å; N40-M43 PolarHBondContact O-N 3.15Å; N40-I44 WeakPolarHBondContact O-CG1 3.47Å; N40-I44 PolarHBondContact O-N 3.28Å; N40-I44 VanDerWaalsContact O-N 3.08Å; N40-R75 HydrophobicContact CB-CB 4.31Å; N40-N78 PolarHBondContact OD1-ND2 3.48Å; N40-I79 HydrophobicContact CB-CD1 4.02Å; N40-I79 HydrophobicContact CB-CG1 3.67Å
41	Y	98.4	Very high	93	Very high	125 Å²	125	81.7 Å²	81.7	49%	0.49	42%	0.416	S	S	.	.	H	α-helix	trans	-66.8	-45.5	178.3	-171.9	-109.4	0	0	0	112.3	I37 L38 S39 M43 I44 L45	I37-Y41 VanDerWaalsContact O-CB 3.25Å; I37-Y41 WeakPolarHBondContact O-CB 3.41Å; I37-Y41 PolarHBondContact O-N 3.12Å; L38-Y41 PolarHBondContact O-N 3.42Å; L38-Y41 VanDerWaalsContact O-N 3.16Å; S39-Y41 VanDerWaalsContact C-N 3.31Å; S39-Y41 PolarHBondContact O-N 2.88Å; Y41-M43 VanDerWaalsContact C-N 3.27Å; Y41-M43 PolarHBondContact O-N 2.72Å; Y41-I44 WeakPolarHBondContact O-CB 3.34Å; Y41-I44 PolarHBondContact O-N 2.87Å; Y41-L45 HydrophobicContact CD1-CD1 3.91Å; Y41-L45 HydrophobicContact CD1-CG 4.39Å; Y41-L45 HydrophobicContact CE1-CD1 3.48Å; Y41-L45 VanDerWaalsContact CE1-CD1 3.48Å; Y41-L45 HydrophobicContact CE1-CG 4.1Å; Y41-L45 WeakPolarHBondContact O-CG 3.35Å; Y41-L45 PolarHBondContact O-N 3.22Å
42	E	97.6	Very high	91.6	Very high	109 Å²	109	78.4 Å²	78.4	51%	0.509	42%	0.416	S	S	.	.	H	α-helix	trans	-58.5	-40.2	175.2	-73.8	175.5	155.3	0	0	111.8	L38 S39 L45 S46	L38-E42 HydrophobicContact CD1-CG 4.11Å; L38-E42 HydrophobicContact CG-CG 4.42Å; L38-E42 WeakPolarHBondContact O-CG 3.38Å; L38-E42 PolarHBondContact O-N 3.46Å; S39-E42 PolarHBondContact O-N 2.83Å; E42-L45 PolarHBondContact O-N 3.39Å; E42-S46 WeakPolarHBondContact O-CB 3.37Å; E42-S46 PolarHBondContact O-N 3.05Å
43	M	95.4	Very high	90.2	Very high	70 Å²	70	79.5 Å²	79.5	35%	0.345	42%	0.416	S	S	.	.	H	α-helix	trans	-67.5	-39.8	177.2	-68.8	-171.4	80.2	0	0	112.2	S39 N40 Y41 L45 S46 R47 R75	S39-M43 VanDerWaalsContact O-CG 3.31Å; S39-M43 WeakPolarHBondContact O-CG 3.43Å; S39-M43 PolarHBondContact O-N 3.07Å; S39-M43 VanDerWaalsContact O-N 3.11Å; N40-M43 PolarHBondContact O-N 3.15Å; Y41-M43 VanDerWaalsContact C-N 3.27Å; Y41-M43 PolarHBondContact O-N 2.72Å; M43-L45 VanDerWaalsContact C-N 3.34Å; M43-L45 PolarHBondContact O-N 3.01Å; M43-S46 WeakPolarHBondContact CA-OG 3.2Å; M43-S46 PolarHBondContact O-N 3.45Å; M43-S46 PolarHBondContact O-OG 3.43Å; M43-R47 WeakPolarHBondContact O-CG 3.38Å; M43-R47 PolarHBondContact O-N 2.98Å; M43-R75 VanDerWaalsContact CE-CZ 3.41Å; M43-R75 PolarHBondContact SD-NH1 3.45Å; M43-R75 PolarHBondContact SD-NH2 2.87Å
44	I	96.4	Very high	88.7	Confident	36 Å²	36	82.8 Å²	82.8	19%	0.185	43%	0.431	C	S	.	.	H	α-helix	trans	-57.4	-49.4	171.8	-68.5	166.7	0	0	0	110	N40 Y41 S46 R47 S48 F72 R75 I79	N40-I44 WeakPolarHBondContact O-CG1 3.47Å; N40-I44 PolarHBondContact O-N 3.28Å; N40-I44 VanDerWaalsContact O-N 3.08Å; Y41-I44 WeakPolarHBondContact O-CB 3.34Å; Y41-I44 PolarHBondContact O-N 2.87Å; I44-S46 VanDerWaalsContact C-N 3.32Å; I44-S46 PolarHBondContact O-N 3.07Å; I44-R47 PolarHBondContact O-N 3.06Å; I44-S48 PolarHBondContact O-N 3.41Å; I44-S48 PolarHBondContact O-OG 3.27Å; I44-F72 HydrophobicContact CB-CD1 4.29Å; I44-F72 HydrophobicContact CB-CE1 4.47Å; I44-F72 HydrophobicContact CG1-CD1 4.13Å; I44-F72 HydrophobicContact CG2-CD1 4.01Å; I44-F72 HydrophobicContact CG2-CE1 4.12Å; I44-F72 WeakPolarHBondContact O-CE1 3.3Å; I44-R75 HydrophobicContact CD1-CB 3.76Å; I44-R75 HydrophobicContact CG1-CB 3.7Å; I44-R75 HydrophobicContact CG1-CG 4.46Å; I44-I79 HydrophobicContact CD1-CD1 3.79Å
45	L	94.7	Very high	87	Confident	78 Å²	78	84 Å²	84	41%	0.408	44%	0.442	S	S	.	.	H	α-helix	trans	-64.7	-34.7	-179.6	-67.3	-177.8	0	0	0	113.2	Y41 E42 M43 R47 S48	Y41-L45 HydrophobicContact CD1-CD1 3.91Å; Y41-L45 HydrophobicContact CD1-CG 4.39Å; Y41-L45 HydrophobicContact CE1-CD1 3.48Å; Y41-L45 VanDerWaalsContact CE1-CD1 3.48Å; Y41-L45 HydrophobicContact CE1-CG 4.1Å; Y41-L45 WeakPolarHBondContact O-CG 3.35Å; Y41-L45 PolarHBondContact O-N 3.22Å; E42-L45 PolarHBondContact O-N 3.39Å; M43-L45 VanDerWaalsContact C-N 3.34Å; M43-L45 PolarHBondContact O-N 3.01Å; L45-R47 VanDerWaalsContact C-N 3.32Å; L45-R47 PolarHBondContact O-N 2.81Å; L45-S48 WeakPolarHBondContact CA-OG 3.35Å; L45-S48 PolarHBondContact O-OG 2.85Å
46	S	90.4	Very high	85.5	Confident	65 Å²	65	86.3 Å²	86.3	46%	0.455	45%	0.453	S	S	.	.	H	α-helix	trans	-64.5	-38.9	178.8	73.6	0	0	0	0	112	E42 M43 I44	E42-S46 WeakPolarHBondContact O-CB 3.37Å; E42-S46 PolarHBondContact O-N 3.05Å; M43-S46 WeakPolarHBondContact CA-OG 3.2Å; M43-S46 PolarHBondContact O-N 3.45Å; M43-S46 PolarHBondContact O-OG 3.43Å; I44-S46 VanDerWaalsContact C-N 3.32Å; I44-S46 PolarHBondContact O-N 3.07Å
47	R	85.8	Confident	83.9	Confident	97 Å²	97	91.4 Å²	91.4	37%	0.366	47%	0.469	S	S	.	.	H	α-helix	trans	-83.4	-23.1	-178.3	-69.6	-70.6	-165.1	155.9	3.8	113.2	M43 I44 L45 K49 D68 E71 F72	M43-R47 WeakPolarHBondContact O-CG 3.38Å; M43-R47 PolarHBondContact O-N 2.98Å; I44-R47 PolarHBondContact O-N 3.06Å; L45-R47 VanDerWaalsContact C-N 3.32Å; L45-R47 PolarHBondContact O-N 2.81Å; R47-K49 PolarHBondContact O-N 3.41Å; R47-D68 IonicContact CZ-OD1 3.19Å; R47-D68 IonicContact NE-OD1 3.78Å; R47-D68 IonicContact NH1-OD1 3.97Å; R47-D68 PolarHBondContact NH1-OD1 3.25Å; R47-E71 IonicContact CZ-OE2 3.31Å; R47-E71 IonicContact NE-OE1 3.08Å; R47-E71 IonicContact NE-OE2 3.52Å; R47-E71 IonicContact NH2-OE1 2.68Å; R47-E71 IonicContact NH2-OE2 3.22Å; R47-E71 PolarHBondContact NH2-OE2 2.95Å; R47-E71 VanDerWaalsContact NH2-OE2 3.08Å; R47-F72 HydrophobicContact CB-CE1 3.5Å; R47-F72 VanDerWaalsContact CB-CE1 3.5Å; R47-F72 HydrophobicContact CB-CZ 3.73Å; R47-F72 HydrophobicContact CG-CE1 4.5Å
48	S	86.4	Confident	82.3	Confident	66 Å²	66	92.1 Å²	92.1	46%	0.462	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-9.3	174.9	61.7	0	0	0	0	113.7	I44 L45 I50	I44-S48 PolarHBondContact O-N 3.41Å; I44-S48 PolarHBondContact O-OG 3.27Å; L45-S48 WeakPolarHBondContact CA-OG 3.35Å; L45-S48 PolarHBondContact O-OG 2.85Å; S48-I50 PolarHBondContact O-N 3.48Å
49	K	80.1	Confident	80.5	Confident	168 Å²	168	95.9 Å²	95.9	73%	0.73	51%	0.507	S	S	*	.			trans	-73.6	114.6	176.3	-68.1	179.7	-179.5	-179.5	0	109.2	R47 D51	R47-K49 PolarHBondContact O-N 3.41Å; K49-D51 PolarHBondContact O-N 2.91Å
50	I	71.6	Confident	79	Confident	147 Å²	147	95.4 Å²	95.4	75%	0.754	51%	0.511	S	S	*	.			trans	-78.3	116.8	175	-60.3	165	0	0	0	107.7	S48 P52	S48-I50 PolarHBondContact O-N 3.48Å; I50-P52 WeakPolarHBondContact O-CD 3.02Å
51	D	71	Confident	77.9	Confident	73 Å²	73	96.9 Å²	96.9	39%	0.39	52%	0.522	S	S	.	.			trans	-76.7	116	165	-175.4	-12.8	0	0	0	108	K49 N53 E54	K49-D51 PolarHBondContact O-N 2.91Å; D51-N53 PolarHBondContact O-N 2.84Å; D51-N53 WeakPolarHBondContact OD1-CB 3.37Å; D51-N53 PolarHBondContact OD1-N 3.32Å; D51-N53 PolarHBondContact OD1-ND2 2.8Å; D51-E54 HydrophobicContact CB-CB 4.47Å; D51-E54 HydrophobicContact CB-CG 4.11Å; D51-E54 PolarHBondContact O-N 2.94Å
52	P	68.2	Low	77	Confident	97 Å²	97	100.3 Å²	100.3	63%	0.63	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-23.6	179.4	22.9	-33	0	0	0	112.9	I50	I50-P52 WeakPolarHBondContact O-CD 3.02Å
53	N	70.2	Confident	76.3	Confident	100 Å²	100	98.3 Å²	98.3	54%	0.535	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-21.5	179.1	-57.4	-60.1	0	0	0	113.5	D51 V55	D51-N53 PolarHBondContact O-N 2.84Å; D51-N53 WeakPolarHBondContact OD1-CB 3.37Å; D51-N53 PolarHBondContact OD1-N 3.32Å; D51-N53 PolarHBondContact OD1-ND2 2.8Å; N53-V55 VanDerWaalsContact C-N 3.35Å
54	E	66.7	Low	75.7	Confident	89 Å²	89	97.5 Å²	97.5	42%	0.416	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-72.8	-28.6	180	-79.3	-159	162.3	0	0	112.9	D51 I56 K57	D51-E54 HydrophobicContact CB-CB 4.47Å; D51-E54 HydrophobicContact CB-CG 4.11Å; D51-E54 PolarHBondContact O-N 2.94Å; E54-I56 PolarHBondContact O-N 3.15Å; E54-I56 VanDerWaalsContact O-N 3.1Å; E54-K57 PolarHBondContact O-N 2.98Å
55	V	62.6	Low	75.1	Confident	109 Å²	109	99.3 Å²	99.3	66%	0.661	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-59.1	-27	178.7	-175.5	0	0	0	0	111.8	N53 K57	N53-V55 VanDerWaalsContact C-N 3.35Å; V55-K57 VanDerWaalsContact C-N 3.31Å; V55-K57 PolarHBondContact O-N 3.33Å
56	I	66.3	Low	74.8	Confident	140 Å²	140	98.2 Å²	98.2	72%	0.718	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-76.3	-17.4	-177.6	-53.9	174.6	0	0	0	111.8	E54 G58	E54-I56 PolarHBondContact O-N 3.15Å; E54-I56 VanDerWaalsContact O-N 3.1Å; I56-G58 PolarHBondContact O-N 3.11Å
57	K	65.7	Low	74.8	Confident	151 Å²	151	100.1 Å²	100.1	66%	0.657	55%	0.552	S	S	*	*	S	Bend	trans	-86	22.4	-165.9	-66.4	-176.9	-179.3	171	0	116.7	E54 V55	E54-K57 PolarHBondContact O-N 2.98Å; V55-K57 VanDerWaalsContact C-N 3.31Å; V55-K57 PolarHBondContact O-N 3.33Å
58	G	65	Low	75	Confident	58 Å²	58	96.6 Å²	96.6	60%	0.598	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	-126.2	168.5	0	0	0	0	0	114.8	I56 P61	I56-G58 PolarHBondContact O-N 3.11Å; G58-P61 WeakPolarHBondContact O-CD 3.43Å
59	L	60.2	Low	75.2	Confident	163 Å²	163	97.4 Å²	97.4	85%	0.853	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-20.5	-176.6	-99	79.8	0	0	0	114.6	P61 Y62	L59-P61 VanDerWaalsContact C-N 3.31Å; L59-Y62 PolarHBondContact O-N 3.3Å; L59-Y62 VanDerWaalsContact O-N 3.11Å
60	G	68.6	Low	75.9	Confident	48 Å²	48	96.5 Å²	96.5	50%	0.495	54%	0.539	S	S	.	.	H	α-helix	trans	-49.8	-39.4	177.8	0	0	0	0	0	115.5	Y62 Q64	G60-Y62 VanDerWaalsContact C-N 3.29Å; G60-Y62 PolarHBondContact O-N 3.24Å; G60-Q64 WeakPolarHBondContact O-CB 3.42Å; G60-Q64 PolarHBondContact O-N 2.91Å; G60-Q64 VanDerWaalsContact O-N 3.11Å
61	P	74.2	Confident	77.1	Confident	46 Å²	46	90.9 Å²	90.9	30%	0.299	51%	0.509	S	S	.	.	H	α-helix	trans	-59.1	-30.6	176.8	-25.2	35.7	0	0	0	114.8	G58 L59 C65	G58-P61 WeakPolarHBondContact O-CD 3.43Å; L59-P61 VanDerWaalsContact C-N 3.31Å; P61-C65 WeakPolarHBondContact O-CB 3.46Å; P61-C65 PolarHBondContact O-N 3.46Å
62	Y	79.4	Confident	78.3	Confident	196 Å²	196	90.2 Å²	90.2	77%	0.769	50%	0.503	S	S	*	.	H	α-helix	trans	-73.7	-47.3	-177.7	-171.3	-93.4	0	0	0	111.8	L59 G60 Q64 C65 A66	L59-Y62 PolarHBondContact O-N 3.3Å; L59-Y62 VanDerWaalsContact O-N 3.11Å; G60-Y62 VanDerWaalsContact C-N 3.29Å; G60-Y62 PolarHBondContact O-N 3.24Å; Y62-Q64 VanDerWaalsContact C-N 3.31Å; Y62-Q64 PolarHBondContact O-N 3.3Å; Y62-C65 PolarHBondContact O-N 2.97Å; Y62-A66 PolarHBondContact O-N 2.84Å
63	A	82.7	Confident	79.7	Confident	67 Å²	67	89.4 Å²	89.4	55%	0.554	50%	0.499	S	S	*	.	H	α-helix	trans	-62.8	-41.4	175.8	0	0	0	0	0	111.2	A66 Q67	A63-A66 PolarHBondContact O-N 3.11Å; A63-Q67 PolarHBondContact O-N 3.34Å
64	Q	83.8	Confident	81	Confident	53 Å²	53	87.5 Å²	87.5	25%	0.248	49%	0.491	C	S	.	.	H	α-helix	trans	-61.5	-46.1	175.2	-172.5	53.8	51	0	0	111.4	G60 Y62 A66 Q67 D68	G60-Q64 WeakPolarHBondContact O-CB 3.42Å; G60-Q64 PolarHBondContact O-N 2.91Å; G60-Q64 VanDerWaalsContact O-N 3.11Å; Y62-Q64 VanDerWaalsContact C-N 3.31Å; Y62-Q64 PolarHBondContact O-N 3.3Å; Q64-A66 VanDerWaalsContact C-N 3.34Å; Q64-A66 PolarHBondContact O-N 3.31Å; Q64-Q67 WeakPolarHBondContact O-CB 3.37Å; Q64-Q67 PolarHBondContact O-N 3.47Å; Q64-Q67 VanDerWaalsContact O-N 3.15Å; Q64-D68 PolarHBondContact NE2-OD1 3.13Å; Q64-D68 PolarHBondContact NE2-OD2 3.14Å; Q64-D68 PolarHBondContact O-N 2.84Å
65	C	84.4	Confident	82.5	Confident	74 Å²	74	85.2 Å²	85.2	50%	0.5	48%	0.479	S	S	.	.	H	α-helix	trans	-59.9	-41.7	176.9	-177.4	0	0	0	0	112.6	P61 Y62 D68 T69	P61-C65 WeakPolarHBondContact O-CB 3.46Å; P61-C65 PolarHBondContact O-N 3.46Å; Y62-C65 PolarHBondContact O-N 2.97Å; C65-D68 PolarHBondContact O-N 3.4Å; C65-T69 WeakPolarHBondContact O-CB 3.47Å; C65-T69 PolarHBondContact O-N 3.29Å; C65-T69 PolarHBondContact O-OG1 2.91Å
66	A	87.5	Confident	84.2	Confident	55 Å²	55	82.2 Å²	82.2	46%	0.455	47%	0.465	S	S	.	.	H	α-helix	trans	-63.5	-42.5	175.6	0	0	0	0	0	111.7	Y62 A63 Q64 T69 F70	Y62-A66 PolarHBondContact O-N 2.84Å; A63-A66 PolarHBondContact O-N 3.11Å; Q64-A66 VanDerWaalsContact C-N 3.34Å; Q64-A66 PolarHBondContact O-N 3.31Å; A66-T69 PolarHBondContact O-N 3.46Å; A66-F70 PolarHBondContact O-N 3.43Å; A66-F70 VanDerWaalsContact O-N 3.09Å
67	Q	89.6	Confident	85.8	Confident	106 Å²	106	78.2 Å²	78.2	50%	0.495	45%	0.453	S	S	.	.	H	α-helix	trans	-63.9	-47.2	176.4	-179.4	178.1	-12	0	0	111.9	A63 Q64 T69 F70 E71	A63-Q67 PolarHBondContact O-N 3.34Å; Q64-Q67 WeakPolarHBondContact O-CB 3.37Å; Q64-Q67 PolarHBondContact O-N 3.47Å; Q64-Q67 VanDerWaalsContact O-N 3.15Å; Q67-T69 VanDerWaalsContact C-N 3.31Å; Q67-T69 PolarHBondContact O-N 3.45Å; Q67-F70 PolarHBondContact O-N 2.92Å; Q67-E71 WeakPolarHBondContact O-CB 3.47Å; Q67-E71 PolarHBondContact O-N 3.06Å
68	D	90.1	Very high	87.3	Confident	22 Å²	22	74.3 Å²	74.3	12%	0.118	44%	0.44	C	S	.	.	H	α-helix	trans	-64.1	-38.9	179.3	-69.1	-36.5	0	0	0	110.9	R47 Q64 C65 F70 E71 F72	R47-D68 IonicContact CZ-OD1 3.19Å; R47-D68 IonicContact NE-OD1 3.78Å; R47-D68 IonicContact NH1-OD1 3.97Å; R47-D68 PolarHBondContact NH1-OD1 3.25Å; Q64-D68 PolarHBondContact NE2-OD1 3.13Å; Q64-D68 PolarHBondContact NE2-OD2 3.14Å; Q64-D68 PolarHBondContact O-N 2.84Å; C65-D68 PolarHBondContact O-N 3.4Å; D68-F70 PolarHBondContact O-N 3Å; D68-E71 PolarHBondContact O-N 2.88Å; D68-F72 HydrophobicContact CB-CE2 4.09Å; D68-F72 HydrophobicContact CB-CZ 4.37Å; D68-F72 WeakPolarHBondContact O-CB 3.38Å; D68-F72 WeakPolarHBondContact O-CD2 3.46Å; D68-F72 WeakPolarHBondContact O-CG 3.25Å; D68-F72 PolarHBondContact O-N 3.35Å
69	T	92.1	Very high	88.9	Confident	84 Å²	84	73.1 Å²	73.1	52%	0.515	42%	0.419	S	S	.	.	H	α-helix	trans	-59.5	-45.4	174.9	-60.6	0	0	0	0	111.7	C65 A66 Q67 F72 S73	C65-T69 WeakPolarHBondContact O-CB 3.47Å; C65-T69 PolarHBondContact O-N 3.29Å; C65-T69 PolarHBondContact O-OG1 2.91Å; A66-T69 PolarHBondContact O-N 3.46Å; Q67-T69 VanDerWaalsContact C-N 3.31Å; Q67-T69 PolarHBondContact O-N 3.45Å; T69-F72 PolarHBondContact O-N 2.88Å; T69-S73 PolarHBondContact O-N 3.36Å
70	F	94.6	Very high	90.8	Very high	149 Å²	149	69.3 Å²	69.3	65%	0.654	40%	0.402	S	S	*	.	H	α-helix	trans	-63.3	-45.2	175.7	179.4	-99.8	0	0	0	111.3	A66 Q67 D68 F72 S73 V74	A66-F70 PolarHBondContact O-N 3.43Å; A66-F70 VanDerWaalsContact O-N 3.09Å; Q67-F70 PolarHBondContact O-N 2.92Å; D68-F70 PolarHBondContact O-N 3Å; F70-F72 PolarHBondContact O-N 3.45Å; F70-S73 WeakPolarHBondContact O-CB 3.22Å; F70-S73 PolarHBondContact O-N 2.8Å; F70-V74 HydrophobicContact CD1-CG2 4.32Å; F70-V74 HydrophobicContact CE1-CG2 3.87Å; F70-V74 HydrophobicContact CE2-CG2 4.34Å; F70-V74 HydrophobicContact CZ-CG2 3.88Å; F70-V74 WeakPolarHBondContact O-CG2 3.38Å; F70-V74 PolarHBondContact O-N 2.97Å
71	E	95	Very high	92.2	Very high	29 Å²	29	71.8 Å²	71.8	14%	0.136	40%	0.401	C	S	.	.	H	α-helix	trans	-61.4	-42.7	178.5	-168.7	178.3	150.3	0	0	111.6	R47 Q67 D68 S73 V74 R75	R47-E71 IonicContact CZ-OE2 3.31Å; R47-E71 IonicContact NE-OE1 3.08Å; R47-E71 IonicContact NE-OE2 3.52Å; R47-E71 IonicContact NH2-OE1 2.68Å; R47-E71 IonicContact NH2-OE2 3.22Å; R47-E71 PolarHBondContact NH2-OE2 2.95Å; R47-E71 VanDerWaalsContact NH2-OE2 3.08Å; Q67-E71 WeakPolarHBondContact O-CB 3.47Å; Q67-E71 PolarHBondContact O-N 3.06Å; D68-E71 PolarHBondContact O-N 2.88Å; E71-S73 VanDerWaalsContact C-N 3.34Å; E71-S73 PolarHBondContact O-N 3.17Å; E71-V74 PolarHBondContact O-N 3.43Å; E71-R75 WeakPolarHBondContact O-CB 3.46Å; E71-R75 VanDerWaalsContact O-CG 3.24Å; E71-R75 WeakPolarHBondContact O-CG 3.44Å; E71-R75 PolarHBondContact O-N 3.2Å; E71-R75 IonicContact OE1-CZ 3.4Å; E71-R75 IonicContact OE1-NE 3.95Å; E71-R75 PolarHBondContact OE1-NE 3.45Å; E71-R75 IonicContact OE1-NH2 2.7Å; E71-R75 PolarHBondContact OE1-NH2 3.32Å
72	F	97.4	Very high	93.4	Very high	59 Å²	59	69.6 Å²	69.6	26%	0.259	39%	0.387	S	S	.	.	H	α-helix	trans	-58.6	-45	174	-67.3	-35.8	0	0	0	112.2	I44 R47 D68 T69 F70 V74 R75 A76	I44-F72 HydrophobicContact CB-CD1 4.29Å; I44-F72 HydrophobicContact CB-CE1 4.47Å; I44-F72 HydrophobicContact CG1-CD1 4.13Å; I44-F72 HydrophobicContact CG2-CD1 4.01Å; I44-F72 HydrophobicContact CG2-CE1 4.12Å; I44-F72 WeakPolarHBondContact O-CE1 3.3Å; R47-F72 HydrophobicContact CB-CE1 3.5Å; R47-F72 VanDerWaalsContact CB-CE1 3.5Å; R47-F72 HydrophobicContact CB-CZ 3.73Å; R47-F72 HydrophobicContact CG-CE1 4.5Å; D68-F72 HydrophobicContact CB-CE2 4.09Å; D68-F72 HydrophobicContact CB-CZ 4.37Å; D68-F72 WeakPolarHBondContact O-CB 3.38Å; D68-F72 WeakPolarHBondContact O-CD2 3.46Å; D68-F72 WeakPolarHBondContact O-CG 3.25Å; D68-F72 PolarHBondContact O-N 3.35Å; T69-F72 PolarHBondContact O-N 2.88Å; F70-F72 PolarHBondContact O-N 3.45Å; F72-V74 PolarHBondContact O-N 3.42Å; F72-R75 PolarHBondContact O-N 2.93Å; F72-A76 VanDerWaalsContact O-CB 3.31Å; F72-A76 WeakPolarHBondContact O-CB 3.33Å; F72-A76 PolarHBondContact O-N 2.89Å
73	S	97.5	Very high	94.3	Very high	79 Å²	79	63 Å²	63	55%	0.552	37%	0.369	S	S	*	.	H	α-helix	trans	-60.5	-47.2	179.3	-172.4	0	0	0	0	111.5	T69 F70 E71 R75 A76 A77	T69-S73 PolarHBondContact O-N 3.36Å; F70-S73 WeakPolarHBondContact O-CB 3.22Å; F70-S73 PolarHBondContact O-N 2.8Å; E71-S73 VanDerWaalsContact C-N 3.34Å; E71-S73 PolarHBondContact O-N 3.17Å; S73-R75 PolarHBondContact O-N 3.34Å; S73-A76 PolarHBondContact O-N 3.35Å; S73-A77 WeakPolarHBondContact O-CB 3.3Å; S73-A77 PolarHBondContact O-N 3.05Å
74	V	98.1	Very high	95	Very high	61 Å²	61	64.7 Å²	64.7	37%	0.37	37%	0.365	S	S	.	.	H	α-helix	trans	-61.9	-44.1	177.8	173.5	0	0	0	0	111.2	F70 E71 F72 A77 N78	F70-V74 HydrophobicContact CD1-CG2 4.32Å; F70-V74 HydrophobicContact CE1-CG2 3.87Å; F70-V74 HydrophobicContact CE2-CG2 4.34Å; F70-V74 HydrophobicContact CZ-CG2 3.88Å; F70-V74 WeakPolarHBondContact O-CG2 3.38Å; F70-V74 PolarHBondContact O-N 2.97Å; E71-V74 PolarHBondContact O-N 3.43Å; F72-V74 PolarHBondContact O-N 3.42Å; V74-A77 PolarHBondContact O-N 3.02Å; V74-N78 VanDerWaalsContact O-CG 3.3Å; V74-N78 PolarHBondContact O-N 3.26Å; V74-N78 PolarHBondContact O-ND2 3.33Å
75	R	97.9	Very high	95.7	Very high	41 Å²	41	63.7 Å²	63.7	16%	0.155	36%	0.362	C	S	.	.	H	α-helix	trans	-65.5	-42.6	179.1	-70.6	-178.7	-174.6	-55.1	-10.7	112.4	N40 M43 I44 E71 F72 S73 A77 N78 I79	N40-R75 HydrophobicContact CB-CB 4.31Å; M43-R75 VanDerWaalsContact CE-CZ 3.41Å; M43-R75 PolarHBondContact SD-NH1 3.45Å; M43-R75 PolarHBondContact SD-NH2 2.87Å; I44-R75 HydrophobicContact CD1-CB 3.76Å; I44-R75 HydrophobicContact CG1-CB 3.7Å; I44-R75 HydrophobicContact CG1-CG 4.46Å; E71-R75 WeakPolarHBondContact O-CB 3.46Å; E71-R75 VanDerWaalsContact O-CG 3.24Å; E71-R75 WeakPolarHBondContact O-CG 3.44Å; E71-R75 PolarHBondContact O-N 3.2Å; E71-R75 IonicContact OE1-CZ 3.4Å; E71-R75 IonicContact OE1-NE 3.95Å; E71-R75 PolarHBondContact OE1-NE 3.45Å; E71-R75 IonicContact OE1-NH2 2.7Å; E71-R75 PolarHBondContact OE1-NH2 3.32Å; F72-R75 PolarHBondContact O-N 2.93Å; S73-R75 PolarHBondContact O-N 3.34Å; R75-A77 VanDerWaalsContact C-N 3.32Å; R75-A77 PolarHBondContact O-N 2.9Å; R75-N78 WeakPolarHBondContact O-CB 3.43Å; R75-N78 PolarHBondContact O-N 2.94Å; R75-I79 WeakPolarHBondContact O-CG1 3.28Å; R75-I79 PolarHBondContact O-N 3.01Å
76	A	98.5	Very high	96.4	Very high	45 Å²	45	62 Å²	62	37%	0.372	35%	0.347	S	S	.	.	H	α-helix	trans	-60.4	-43.6	174.8	0	0	0	0	0	111.1	F72 S73 N78 I79 V80	F72-A76 VanDerWaalsContact O-CB 3.31Å; F72-A76 WeakPolarHBondContact O-CB 3.33Å; F72-A76 PolarHBondContact O-N 2.89Å; S73-A76 PolarHBondContact O-N 3.35Å; A76-N78 VanDerWaalsContact C-N 3.35Å; A76-N78 PolarHBondContact O-N 3.43Å; A76-I79 WeakPolarHBondContact O-CB 3.4Å; A76-I79 PolarHBondContact O-N 3.09Å; A76-V80 WeakPolarHBondContact O-CG2 3.24Å; A76-V80 PolarHBondContact O-N 2.89Å
77	A	98.6	Very high	96.9	Very high	57 Å²	57	63.8 Å²	63.8	47%	0.471	35%	0.353	S	S	.	.	H	α-helix	trans	-60.7	-42.1	175	0	0	0	0	0	112.3	S73 V74 R75 I79 V80 H81	S73-A77 WeakPolarHBondContact O-CB 3.3Å; S73-A77 PolarHBondContact O-N 3.05Å; V74-A77 PolarHBondContact O-N 3.02Å; R75-A77 VanDerWaalsContact C-N 3.32Å; R75-A77 PolarHBondContact O-N 2.9Å; A77-I79 VanDerWaalsContact C-N 3.32Å; A77-I79 PolarHBondContact O-N 3.33Å; A77-V80 PolarHBondContact O-N 3.37Å; A77-H81 WeakPolarHBondContact O-CB 3.49Å; A77-H81 PolarHBondContact O-N 2.98Å
78	N	98.6	Very high	97.3	Very high	69 Å²	69	65.6 Å²	65.6	37%	0.369	36%	0.355	S	S	.	.	H	α-helix	trans	-62.1	-37.9	175.6	-70.6	-24.3	0	0	0	112.7	N40 V74 R75 A76 A82	N40-N78 PolarHBondContact OD1-ND2 3.48Å; V74-N78 VanDerWaalsContact O-CG 3.3Å; V74-N78 PolarHBondContact O-N 3.26Å; V74-N78 PolarHBondContact O-ND2 3.33Å; R75-N78 WeakPolarHBondContact O-CB 3.43Å; R75-N78 PolarHBondContact O-N 2.94Å; A76-N78 VanDerWaalsContact C-N 3.35Å; A76-N78 PolarHBondContact O-N 3.43Å; N78-A82 WeakPolarHBondContact O-CB 3.42Å; N78-A82 PolarHBondContact O-N 2.98Å
79	I	98.8	Very high	97.7	Very high	32 Å²	32	64.8 Å²	64.8	16%	0.164	35%	0.351	C	S	.	.	H	α-helix	trans	-63.2	-48.7	174.7	-68.1	166	0	0	0	110	I37 N40 I44 R75 A76 A77 H81 A82 C83	I37-I79 HydrophobicContact CG1-CG2 4.43Å; I37-I79 HydrophobicContact CG2-CG2 4.2Å; N40-I79 HydrophobicContact CB-CD1 4.02Å; N40-I79 HydrophobicContact CB-CG1 3.67Å; I44-I79 HydrophobicContact CD1-CD1 3.79Å; R75-I79 WeakPolarHBondContact O-CG1 3.28Å; R75-I79 PolarHBondContact O-N 3.01Å; A76-I79 WeakPolarHBondContact O-CB 3.4Å; A76-I79 PolarHBondContact O-N 3.09Å; A77-I79 VanDerWaalsContact C-N 3.32Å; A77-I79 PolarHBondContact O-N 3.33Å; I79-H81 VanDerWaalsContact C-N 3.34Å; I79-H81 PolarHBondContact O-N 3.38Å; I79-A82 PolarHBondContact O-N 3.28Å; I79-C83 PolarHBondContact O-N 3.48Å; I79-C83 PolarHBondContact O-SG 3.31Å; I79-C83 VanDerWaalsContact O-SG 3.36Å
80	V	98.7	Very high	98	Very high	83 Å²	83	63.9 Å²	63.9	50%	0.503	35%	0.345	S	S	.	.	H	α-helix	trans	-58.4	-46.5	178	173.7	0	0	0	0	110.9	A76 A77 A82 C83 E84	A76-V80 WeakPolarHBondContact O-CG2 3.24Å; A76-V80 PolarHBondContact O-N 2.89Å; A77-V80 PolarHBondContact O-N 3.37Å; V80-A82 VanDerWaalsContact C-N 3.33Å; V80-A82 PolarHBondContact O-N 3.44Å; V80-C83 WeakPolarHBondContact O-CB 3.39Å; V80-C83 PolarHBondContact O-N 2.99Å; V80-C83 VanDerWaalsContact O-N 3.09Å; V80-E84 WeakPolarHBondContact O-CG 3.44Å; V80-E84 PolarHBondContact O-N 2.93Å
81	H	98.5	Very high	98.2	Very high	100 Å²	100	59.3 Å²	59.3	46%	0.463	33%	0.331	S	S	.	.	H	α-helix	trans	-60.6	-40.4	177.4	178.8	-104	0	0	0	112.6	A77 I79 C83 E84 N85	A77-H81 WeakPolarHBondContact O-CB 3.49Å; A77-H81 PolarHBondContact O-N 2.98Å; I79-H81 VanDerWaalsContact C-N 3.34Å; I79-H81 PolarHBondContact O-N 3.38Å; H81-C83 VanDerWaalsContact C-N 3.35Å; H81-E84 PolarHBondContact O-N 2.95Å; H81-N85 PolarHBondContact CE1-ND2 3.36Å; H81-N85 VanDerWaalsContact O-CG 3.23Å; H81-N85 PolarHBondContact O-N 2.99Å; H81-N85 PolarHBondContact O-ND2 2.93Å
82	A	98.7	Very high	98.3	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.008	34%	0.338	C	S	.	.	H	α-helix	trans	-65.5	-37	174.5	0	0	0	0	0	112.3	N33 I37 N78 I79 V80 N85 I86	N33-A82 HydrophobicContact CB-CB 4.33Å; I37-A82 HydrophobicContact CD1-CB 4.01Å; I37-A82 HydrophobicContact CG1-CB 3.54Å; N78-A82 WeakPolarHBondContact O-CB 3.42Å; N78-A82 PolarHBondContact O-N 2.98Å; I79-A82 PolarHBondContact O-N 3.28Å; V80-A82 VanDerWaalsContact C-N 3.33Å; V80-A82 PolarHBondContact O-N 3.44Å; A82-N85 WeakPolarHBondContact O-CB 3.37Å; A82-N85 PolarHBondContact O-N 3.26Å; A82-I86 WeakPolarHBondContact O-CG1 3.39Å; A82-I86 PolarHBondContact O-N 3.44Å; A82-I86 VanDerWaalsContact O-N 3.09Å
83	C	98.7	Very high	98.3	Very high	57 Å²	57	61.2 Å²	61.2	39%	0.385	34%	0.342	S	S	.	.	H	α-helix	trans	-63.9	-42.9	173	-69.7	0	0	0	0	112	I79 V80 H81 N85 I86 T87	I79-C83 PolarHBondContact O-N 3.48Å; I79-C83 PolarHBondContact O-SG 3.31Å; I79-C83 VanDerWaalsContact O-SG 3.36Å; V80-C83 WeakPolarHBondContact O-CB 3.39Å; V80-C83 PolarHBondContact O-N 2.99Å; V80-C83 VanDerWaalsContact O-N 3.09Å; H81-C83 VanDerWaalsContact C-N 3.35Å; C83-N85 VanDerWaalsContact C-N 3.3Å; C83-N85 PolarHBondContact O-N 3.39Å; C83-I86 WeakPolarHBondContact O-CB 3.48Å; C83-I86 PolarHBondContact O-N 3.03Å; C83-I86 VanDerWaalsContact O-N 3.11Å; C83-T87 PolarHBondContact O-N 2.7Å; C83-T87 PolarHBondContact O-OG1 3.19Å
84	E	98.5	Very high	98.3	Very high	103 Å²	103	63.5 Å²	63.5	48%	0.481	34%	0.343	S	S	.	.	H	α-helix	trans	-60.9	-39.7	174.9	-71	176.5	174	0	0	112.2	V80 H81 I86 T87 R88	V80-E84 WeakPolarHBondContact O-CG 3.44Å; V80-E84 PolarHBondContact O-N 2.93Å; H81-E84 PolarHBondContact O-N 2.95Å; E84-I86 VanDerWaalsContact C-N 3.3Å; E84-I86 PolarHBondContact O-N 3.29Å; E84-T87 PolarHBondContact O-N 3.33Å; E84-R88 PolarHBondContact O-N 2.97Å
85	N	98.5	Very high	98.2	Very high	32 Å²	32	66.7 Å²	66.7	17%	0.171	35%	0.353	C	S	.	.	H	α-helix	trans	-60.9	-40	173.5	-68.6	-22.3	0	0	0	112.2	N33 H81 A82 C83 R88 L89	N33-N85 WeakPolarHBondContact OD1-CB 3.44Å; N33-N85 PolarHBondContact OD1-ND2 3.48Å; H81-N85 PolarHBondContact CE1-ND2 3.36Å; H81-N85 VanDerWaalsContact O-CG 3.23Å; H81-N85 PolarHBondContact O-N 2.99Å; H81-N85 PolarHBondContact O-ND2 2.93Å; A82-N85 WeakPolarHBondContact O-CB 3.37Å; A82-N85 PolarHBondContact O-N 3.26Å; C83-N85 VanDerWaalsContact C-N 3.3Å; C83-N85 PolarHBondContact O-N 3.39Å; N85-R88 PolarHBondContact O-N 3.35Å; N85-R88 PolarHBondContact OD1-NH2 3.39Å; N85-L89 WeakPolarHBondContact O-CG 3.27Å; N85-L89 PolarHBondContact O-N 2.93Å
86	I	98.6	Very high	98	Very high	39 Å²	39	67.5 Å²	67.5	20%	0.2	36%	0.358	C	S	.	.	H	α-helix	trans	-65.9	-42.3	175.9	-67.7	168.3	0	0	0	110.5	L30 N33 I37 A82 C83 E84 R88 L89 V90	L30-I86 HydrophobicContact CD1-CD1 4.44Å; L30-I86 HydrophobicContact CD1-CG1 4.21Å; L30-I86 HydrophobicContact CD1-CG2 4.42Å; N33-I86 HydrophobicContact CB-CD1 3.94Å; N33-I86 HydrophobicContact CB-CG1 3.75Å; I37-I86 HydrophobicContact CD1-CD1 3.73Å; A82-I86 WeakPolarHBondContact O-CG1 3.39Å; A82-I86 PolarHBondContact O-N 3.44Å; A82-I86 VanDerWaalsContact O-N 3.09Å; C83-I86 WeakPolarHBondContact O-CB 3.48Å; C83-I86 PolarHBondContact O-N 3.03Å; C83-I86 VanDerWaalsContact O-N 3.11Å; E84-I86 VanDerWaalsContact C-N 3.3Å; E84-I86 PolarHBondContact O-N 3.29Å; I86-R88 VanDerWaalsContact C-N 3.3Å; I86-R88 PolarHBondContact O-N 3.47Å; I86-L89 WeakPolarHBondContact O-CB 3.41Å; I86-L89 PolarHBondContact O-N 3.5Å; I86-L89 VanDerWaalsContact O-N 3.11Å; I86-V90 WeakPolarHBondContact O-CG2 3.48Å; I86-V90 PolarHBondContact O-N 2.92Å
87	T	98.4	Very high	97.8	Very high	92 Å²	92	70 Å²	70	56%	0.564	37%	0.365	S	S	*	.	H	α-helix	trans	-58.3	-42.7	174.6	-59.9	0	0	0	0	111.6	C83 E84 V90 S91	C83-T87 PolarHBondContact O-N 2.7Å; C83-T87 PolarHBondContact O-OG1 3.19Å; E84-T87 PolarHBondContact O-N 3.33Å; T87-V90 PolarHBondContact O-N 3.25Å; T87-S91 PolarHBondContact O-N 3.49Å; T87-S91 VanDerWaalsContact O-N 3.14Å; T87-S91 PolarHBondContact O-OG 3.4Å
88	R	98.1	Very high	97.6	Very high	143 Å²	143	71.3 Å²	71.3	54%	0.54	36%	0.363	S	S	.	.	H	α-helix	trans	-62.7	-42.5	173.5	-73	-174.1	-80.3	177.2	-13.7	112.5	E84 N85 I86 V90 S91 E92	E84-R88 PolarHBondContact O-N 2.97Å; N85-R88 PolarHBondContact O-N 3.35Å; N85-R88 PolarHBondContact OD1-NH2 3.39Å; I86-R88 VanDerWaalsContact C-N 3.3Å; I86-R88 PolarHBondContact O-N 3.47Å; R88-V90 VanDerWaalsContact C-N 3.34Å; R88-V90 PolarHBondContact O-N 2.96Å; R88-S91 WeakPolarHBondContact O-CB 3.49Å; R88-S91 PolarHBondContact O-N 3.48Å; R88-E92 PolarHBondContact O-N 3.46Å
89	L	97.9	Very high	97.4	Very high	6 Å²	6	73.3 Å²	73.3	3%	0.031	37%	0.373	C	S	.	.	H	α-helix	trans	-59.5	-42.1	174.9	-79.5	167.1	0	0	0	112.4	L26 R29 L30 N85 I86 S91 E92 I93	L26-L89 HydrophobicContact CD2-CD2 3.64Å; R29-L89 HydrophobicContact CB-CD1 3.89Å; R29-L89 HydrophobicContact CB-CD2 3.86Å; R29-L89 HydrophobicContact CB-CG 4.45Å; L30-L89 HydrophobicContact CB-CD1 4.42Å; N85-L89 WeakPolarHBondContact O-CG 3.27Å; N85-L89 PolarHBondContact O-N 2.93Å; I86-L89 WeakPolarHBondContact O-CB 3.41Å; I86-L89 PolarHBondContact O-N 3.5Å; I86-L89 VanDerWaalsContact O-N 3.11Å; L89-S91 VanDerWaalsContact C-N 3.33Å; L89-S91 PolarHBondContact O-N 3.25Å; L89-E92 WeakPolarHBondContact O-CB 3.46Å; L89-E92 PolarHBondContact O-N 3.34Å; L89-I93 VanDerWaalsContact O-CG1 3.31Å; L89-I93 WeakPolarHBondContact O-CG1 3.43Å; L89-I93 PolarHBondContact O-N 3.47Å
90	V	98.1	Very high	97	Very high	64 Å²	64	73.3 Å²	73.3	39%	0.388	38%	0.381	S	S	.	.	H	α-helix	trans	-61.5	-43.7	176.6	170.5	0	0	0	0	110.7	I86 T87 R88 E92 I93 K94	I86-V90 WeakPolarHBondContact O-CG2 3.48Å; I86-V90 PolarHBondContact O-N 2.92Å; T87-V90 PolarHBondContact O-N 3.25Å; R88-V90 VanDerWaalsContact C-N 3.34Å; R88-V90 PolarHBondContact O-N 2.96Å; V90-E92 VanDerWaalsContact C-N 3.34Å; V90-E92 PolarHBondContact O-N 2.9Å; V90-I93 PolarHBondContact O-N 2.91Å; V90-K94 HydrophobicContact CG1-CD 4.41Å; V90-K94 WeakPolarHBondContact O-CG 3.41Å; V90-K94 PolarHBondContact O-N 3.35Å
91	S	98.2	Very high	96.8	Very high	54 Å²	54	74.1 Å²	74.1	38%	0.378	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-41	175.5	-65	0	0	0	0	112.3	T87 R88 L89 K94 Q95	T87-S91 PolarHBondContact O-N 3.49Å; T87-S91 VanDerWaalsContact O-N 3.14Å; T87-S91 PolarHBondContact O-OG 3.4Å; R88-S91 WeakPolarHBondContact O-CB 3.49Å; R88-S91 PolarHBondContact O-N 3.48Å; L89-S91 VanDerWaalsContact C-N 3.33Å; L89-S91 PolarHBondContact O-N 3.25Å; S91-K94 PolarHBondContact O-N 3.14Å; S91-Q95 WeakPolarHBondContact O-CG 3.35Å; S91-Q95 PolarHBondContact O-N 3.03Å
92	E	97.6	Very high	96.6	Very high	58 Å²	58	75.4 Å²	75.4	27%	0.271	39%	0.387	S	S	.	.	H	α-helix	trans	-63.1	-42.5	176.2	-168.4	175.8	164	0	0	111.8	H22 L26 R29 R88 L89 V90 K94 Q95 F96	H22-E92 IonicContact CE1-OE1 3.35Å; H22-E92 PolarHBondContact CE1-OE1 2.94Å; L26-E92 HydrophobicContact CD2-CB 4.44Å; L26-E92 HydrophobicContact CD2-CG 4.09Å; R29-E92 IonicContact CZ-OE2 3.7Å; R29-E92 IonicContact NH1-OE1 3.22Å; R29-E92 PolarHBondContact NH1-OE1 3Å; R29-E92 IonicContact NH1-OE2 3.79Å; R29-E92 PolarHBondContact NH1-OE2 2.63Å; R29-E92 IonicContact NH2-OE2 2.9Å; R29-E92 PolarHBondContact NH2-OE2 3Å; R88-E92 PolarHBondContact O-N 3.46Å; L89-E92 WeakPolarHBondContact O-CB 3.46Å; L89-E92 PolarHBondContact O-N 3.34Å; V90-E92 VanDerWaalsContact C-N 3.34Å; V90-E92 PolarHBondContact O-N 2.9Å; E92-K94 PolarHBondContact O-N 3.11Å; E92-Q95 PolarHBondContact O-N 2.94Å; E92-F96 WeakPolarHBondContact O-CB 3.48Å; E92-F96 PolarHBondContact O-N 3.34Å
93	I	97.2	Very high	96.3	Very high	69 Å²	69	82.1 Å²	82.1	35%	0.354	41%	0.412	S	S	.	.	H	α-helix	trans	-60.5	-45.6	174.3	-70.1	160.7	0	0	0	110.9	L26 L89 V90 Q95 F96 L97	L26-I93 HydrophobicContact CD1-CG1 3.84Å; L89-I93 VanDerWaalsContact O-CG1 3.31Å; L89-I93 WeakPolarHBondContact O-CG1 3.43Å; L89-I93 PolarHBondContact O-N 3.47Å; V90-I93 PolarHBondContact O-N 2.91Å; I93-Q95 PolarHBondContact O-N 3.36Å; I93-F96 WeakPolarHBondContact O-CB 3.39Å; I93-F96 PolarHBondContact O-N 3.46Å; I93-L97 HydrophobicContact CG2-CD1 4.08Å; I93-L97 HydrophobicContact CG2-CG 4.47Å; I93-L97 WeakPolarHBondContact O-CG 3.42Å; I93-L97 PolarHBondContact O-N 3.39Å
94	K	97.2	Very high	96.1	Very high	128 Å²	128	86.5 Å²	86.5	56%	0.557	42%	0.421	S	S	*	.	H	α-helix	trans	-59.1	-47.8	178.2	-73.7	175.2	178.4	-179.5	0	111.3	V90 S91 E92 F96 L97 I98	V90-K94 HydrophobicContact CG1-CD 4.41Å; V90-K94 WeakPolarHBondContact O-CG 3.41Å; V90-K94 PolarHBondContact O-N 3.35Å; S91-K94 PolarHBondContact O-N 3.14Å; E92-K94 PolarHBondContact O-N 3.11Å; K94-F96 VanDerWaalsContact C-N 3.33Å; K94-F96 PolarHBondContact O-N 3.02Å; K94-L97 PolarHBondContact O-N 2.78Å; K94-I98 VanDerWaalsContact O-CG1 3.27Å; K94-I98 WeakPolarHBondContact O-CG1 3.31Å; K94-I98 PolarHBondContact O-N 3.47Å
95	Q	96.2	Very high	96	Very high	127 Å²	127	85.5 Å²	85.5	59%	0.593	42%	0.418	S	S	*	.	H	α-helix	trans	-61.2	-42.6	177.3	-69.8	174.7	19.8	0	0	111.9	S91 E92 I93 L97 I98 L99	S91-Q95 WeakPolarHBondContact O-CG 3.35Å; S91-Q95 PolarHBondContact O-N 3.03Å; E92-Q95 PolarHBondContact O-N 2.94Å; I93-Q95 PolarHBondContact O-N 3.36Å; Q95-L97 VanDerWaalsContact C-N 3.34Å; Q95-L97 PolarHBondContact O-N 2.94Å; Q95-I98 PolarHBondContact O-N 3.36Å; Q95-L99 WeakPolarHBondContact O-CG 3.48Å; Q95-L99 PolarHBondContact O-N 3.2Å
96	F	94.5	Very high	95.9	Very high	58 Å²	58	87 Å²	87	25%	0.254	44%	0.435	S	S	.	.	H	α-helix	trans	-59.1	-43.6	177	177	-97.9	0	0	0	112.2	R19 H22 E92 I93 K94 G100	R19-F96 HydrophobicContact CB-CZ 4.48Å; R19-F96 HydrophobicContact CG-CE1 4.5Å; R19-F96 HydrophobicContact CG-CZ 3.83Å; H22-F96 AromaticContact CD2-CD2 3.53Å; H22-F96 AromaticContact CD2-CE2 3.89Å; H22-F96 AromaticContact CD2-CG 4Å; H22-F96 AromaticContact NE2-CD2 3.85Å; E92-F96 WeakPolarHBondContact O-CB 3.48Å; E92-F96 PolarHBondContact O-N 3.34Å; I93-F96 WeakPolarHBondContact O-CB 3.39Å; I93-F96 PolarHBondContact O-N 3.46Å; K94-F96 VanDerWaalsContact C-N 3.33Å; K94-F96 PolarHBondContact O-N 3.02Å; F96-G100 PolarHBondContact O-N 3.38Å
97	L	93.8	Very high	95.7	Very high	98 Å²	98	92.9 Å²	92.9	51%	0.513	46%	0.455	S	S	.	.	H	α-helix	trans	-66.2	-47.5	177.4	-68.8	173.1	0	0	0	111.9	I93 K94 Q95 L99 G100 D101	I93-L97 HydrophobicContact CG2-CD1 4.08Å; I93-L97 HydrophobicContact CG2-CG 4.47Å; I93-L97 WeakPolarHBondContact O-CG 3.42Å; I93-L97 PolarHBondContact O-N 3.39Å; K94-L97 PolarHBondContact O-N 2.78Å; Q95-L97 VanDerWaalsContact C-N 3.34Å; Q95-L97 PolarHBondContact O-N 2.94Å; L97-L99 VanDerWaalsContact C-N 3.31Å; L97-L99 PolarHBondContact O-N 3.02Å; L97-G100 CarbonylContact O-C 3.56Å; L97-G100 VanDerWaalsContact O-CA 3.3Å; L97-G100 WeakPolarHBondContact O-CA 3.38Å; L97-G100 PolarHBondContact O-N 3.11Å; L97-D101 PolarHBondContact O-N 3.45Å
98	I	95.7	Very high	95.7	Very high	85 Å²	85	90.5 Å²	90.5	44%	0.436	44%	0.44	S	S	.	.	H	α-helix	trans	-55.9	-46.3	178	-70.8	165.6	0	0	0	111	K94 Q95 G100 D101 F102	K94-I98 VanDerWaalsContact O-CG1 3.27Å; K94-I98 WeakPolarHBondContact O-CG1 3.31Å; K94-I98 PolarHBondContact O-N 3.47Å; Q95-I98 PolarHBondContact O-N 3.36Å; I98-G100 VanDerWaalsContact C-N 3.3Å; I98-G100 PolarHBondContact O-N 3.09Å; I98-D101 PolarHBondContact O-N 3.37Å; I98-F102 HydrophobicContact CG2-CD2 3.8Å; I98-F102 HydrophobicContact CG2-CE2 3.26Å; I98-F102 HydrophobicContact CG2-CZ 3.9Å; I98-F102 VanDerWaalsContact O-CD2 3.28Å; I98-F102 WeakPolarHBondContact O-CD2 3.18Å; I98-F102 PolarHBondContact O-N 3.41Å
99	L	92.8	Very high	95.7	Very high	110 Å²	110	87.9 Å²	87.9	58%	0.576	44%	0.44	S	S	*	.	H	α-helix	trans	-63.8	-36.9	175.6	-72.7	172	0	0	0	112.2	Q95 L97 R103	Q95-L99 WeakPolarHBondContact O-CG 3.48Å; Q95-L99 PolarHBondContact O-N 3.2Å; L97-L99 VanDerWaalsContact C-N 3.31Å; L97-L99 PolarHBondContact O-N 3.02Å; L99-R103 WeakPolarHBondContact O-CG 3.43Å; L99-R103 PolarHBondContact O-N 3.25Å; L99-R103 VanDerWaalsContact O-N 3.14Å
100	G	91.1	Very high	95.7	Very high	33 Å²	33	91 Å²	91	34%	0.34	46%	0.462	S	S	.	.	H	α-helix	trans	-57.6	-47.9	172.7	0	0	0	0	0	112.2	F96 L97 I98 R103 W104	F96-G100 PolarHBondContact O-N 3.38Å; L97-G100 CarbonylContact O-C 3.56Å; L97-G100 VanDerWaalsContact O-CA 3.3Å; L97-G100 WeakPolarHBondContact O-CA 3.38Å; L97-G100 PolarHBondContact O-N 3.11Å; I98-G100 VanDerWaalsContact C-N 3.3Å; I98-G100 PolarHBondContact O-N 3.09Å; G100-R103 PolarHBondContact O-N 2.94Å; G100-W104 PolarHBondContact O-N 3.27Å
101	D	94.4	Very high	95.6	Very high	99 Å²	99	92 Å²	92	53%	0.529	47%	0.465	S	S	.	.	H	α-helix	trans	-65.7	-43.2	-178.9	-66.8	-15.6	0	0	0	111.7	L97 I98 R103 W104 L105	L97-D101 PolarHBondContact O-N 3.45Å; I98-D101 PolarHBondContact O-N 3.37Å; D101-R103 VanDerWaalsContact C-N 3.31Å; D101-R103 PolarHBondContact O-N 3.36Å; D101-W104 WeakPolarHBondContact O-CB 3.37Å; D101-W104 PolarHBondContact O-N 3.37Å; D101-W104 VanDerWaalsContact O-N 3.13Å; D101-L105 WeakPolarHBondContact O-CB 3.43Å; D101-L105 WeakPolarHBondContact O-CG 3.49Å; D101-L105 PolarHBondContact O-N 3.35Å
102	F	95	Very high	95.6	Very high	128 Å²	128	93.2 Å²	93.2	56%	0.561	47%	0.467	S	S	*	.	H	α-helix	trans	-60.7	-39.8	175	-69.7	-42.8	0	0	0	112.7	I98 W104 L105 A106	I98-F102 HydrophobicContact CG2-CD2 3.8Å; I98-F102 HydrophobicContact CG2-CE2 3.26Å; I98-F102 HydrophobicContact CG2-CZ 3.9Å; I98-F102 VanDerWaalsContact O-CD2 3.28Å; I98-F102 WeakPolarHBondContact O-CD2 3.18Å; I98-F102 PolarHBondContact O-N 3.41Å; F102-W104 VanDerWaalsContact C-N 3.32Å; F102-L105 HydrophobicContact CD1-CD1 4.34Å; F102-L105 PolarHBondContact O-N 2.92Å; F102-A106 WeakPolarHBondContact O-CB 3.27Å; F102-A106 PolarHBondContact O-N 3.39Å
103	R	91.4	Very high	95.7	Very high	142 Å²	142	95.9 Å²	95.9	54%	0.536	48%	0.48	S	S	.	.	H	α-helix	trans	-66.8	-36.4	176.2	-68.3	173.2	82.3	108.3	10.4	111.7	F15 L99 G100 D101 R107	F15-R103 VanDerWaalsContact CZ-NE 3.3Å; L99-R103 WeakPolarHBondContact O-CG 3.43Å; L99-R103 PolarHBondContact O-N 3.25Å; L99-R103 VanDerWaalsContact O-N 3.14Å; G100-R103 PolarHBondContact O-N 2.94Å; D101-R103 VanDerWaalsContact C-N 3.31Å; D101-R103 PolarHBondContact O-N 3.36Å; R103-R107 PolarHBondContact O-N 3.26Å
104	W	93.9	Very high	95.7	Very high	149 Å²	149	98 Å²	98	56%	0.564	49%	0.488	S	S	*	.	H	α-helix	trans	-66.7	-48.7	174.3	176.6	87.6	0	0	0	111.2	G100 D101 F102 A106 R107 V108	G100-W104 PolarHBondContact O-N 3.27Å; D101-W104 WeakPolarHBondContact O-CB 3.37Å; D101-W104 PolarHBondContact O-N 3.37Å; D101-W104 VanDerWaalsContact O-N 3.13Å; F102-W104 VanDerWaalsContact C-N 3.32Å; W104-A106 VanDerWaalsContact C-N 3.35Å; W104-A106 PolarHBondContact O-N 3.04Å; W104-R107 WeakPolarHBondContact O-CB 3.46Å; W104-R107 PolarHBondContact O-N 2.91Å; W104-R107 VanDerWaalsContact O-N 3.11Å; W104-V108 HydrophobicContact CD2-CG2 3.96Å; W104-V108 HydrophobicContact CE3-CG2 4.37Å; W104-V108 HydrophobicContact CH2-CG2 4.08Å; W104-V108 HydrophobicContact CZ2-CG2 3.65Å; W104-V108 HydrophobicContact CZ3-CG2 4.41Å; W104-V108 WeakPolarHBondContact O-CG2 3.46Å; W104-V108 PolarHBondContact O-N 2.89Å
105	L	96.7	Very high	95.8	Very high	82 Å²	82	98.6 Å²	98.6	43%	0.429	49%	0.491	S	S	.	.	H	α-helix	trans	-55.7	-48.2	176.1	-77.3	170.3	0	0	0	111.4	D101 F102 R107 V108 T109	D101-L105 WeakPolarHBondContact O-CB 3.43Å; D101-L105 WeakPolarHBondContact O-CG 3.49Å; D101-L105 PolarHBondContact O-N 3.35Å; F102-L105 HydrophobicContact CD1-CD1 4.34Å; F102-L105 PolarHBondContact O-N 2.92Å; L105-R107 VanDerWaalsContact C-N 3.28Å; L105-R107 PolarHBondContact O-N 3.49Å; L105-V108 PolarHBondContact O-N 2.78Å; L105-V108 VanDerWaalsContact O-N 3.15Å; L105-T109 WeakPolarHBondContact O-CB 3.45Å; L105-T109 PolarHBondContact O-N 3.36Å; L105-T109 PolarHBondContact O-OG1 3.09Å; L105-T109 VanDerWaalsContact O-OG1 3.11Å
106	A	96.4	Very high	95.9	Very high	63 Å²	63	98.5 Å²	98.5	52%	0.521	49%	0.494	S	S	.	.	H	α-helix	trans	-57.5	-41.1	177.8	0	0	0	0	0	112.2	F102 W104 S110	F102-A106 WeakPolarHBondContact O-CB 3.27Å; F102-A106 PolarHBondContact O-N 3.39Å; W104-A106 VanDerWaalsContact C-N 3.35Å; W104-A106 PolarHBondContact O-N 3.04Å; A106-S110 WeakPolarHBondContact O-CB 3.43Å; A106-S110 PolarHBondContact O-N 2.95Å
107	R	96.1	Very high	96.1	Very high	163 Å²	163	100.3 Å²	100.3	62%	0.615	51%	0.506	S	S	*	.	H	α-helix	trans	-65.3	-46.4	176	-175.3	-175.5	-63.2	144.3	1	111.7	R103 W104 L105 S110 L111	R103-R107 PolarHBondContact O-N 3.26Å; W104-R107 WeakPolarHBondContact O-CB 3.46Å; W104-R107 PolarHBondContact O-N 2.91Å; W104-R107 VanDerWaalsContact O-N 3.11Å; L105-R107 VanDerWaalsContact C-N 3.28Å; L105-R107 PolarHBondContact O-N 3.49Å; R107-S110 PolarHBondContact O-N 3.19Å; R107-L111 HydrophobicContact CG-CD1 4.18Å; R107-L111 WeakPolarHBondContact O-CG 3.46Å; R107-L111 PolarHBondContact O-N 2.94Å
108	V	97	Very high	96.3	Very high	42 Å²	42	100.4 Å²	100.4	26%	0.255	51%	0.506	S	S	.	.	H	α-helix	trans	-62.6	-45.5	179.6	172.2	0	0	0	0	110.8	W104 L105 S110 L111 N112	W104-V108 HydrophobicContact CD2-CG2 3.96Å; W104-V108 HydrophobicContact CE3-CG2 4.37Å; W104-V108 HydrophobicContact CH2-CG2 4.08Å; W104-V108 HydrophobicContact CZ2-CG2 3.65Å; W104-V108 HydrophobicContact CZ3-CG2 4.41Å; W104-V108 WeakPolarHBondContact O-CG2 3.46Å; W104-V108 PolarHBondContact O-N 2.89Å; L105-V108 PolarHBondContact O-N 2.78Å; L105-V108 VanDerWaalsContact O-N 3.15Å; V108-S110 PolarHBondContact O-N 3.42Å; V108-L111 PolarHBondContact O-N 3.44Å; V108-N112 WeakPolarHBondContact O-CB 3.32Å; V108-N112 PolarHBondContact O-N 3.42Å
109	T	97.6	Very high	96.4	Very high	87 Å²	87	103.7 Å²	103.7	53%	0.534	51%	0.513	S	S	.	.	H	α-helix	trans	-60	-44.8	175.8	-61.5	0	0	0	0	111.4	L105 L111 N112 Q113	L105-T109 WeakPolarHBondContact O-CB 3.45Å; L105-T109 PolarHBondContact O-N 3.36Å; L105-T109 PolarHBondContact O-OG1 3.09Å; L105-T109 VanDerWaalsContact O-OG1 3.11Å; T109-L111 PolarHBondContact O-N 3.19Å; T109-N112 PolarHBondContact O-N 2.91Å; T109-Q113 WeakPolarHBondContact O-CB 3.36Å; T109-Q113 PolarHBondContact O-N 3.26Å
110	S	97.9	Very high	96.6	Very high	72 Å²	72	104.5 Å²	104.5	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-61.7	-43.4	177.6	-175.2	0	0	0	0	112.4	A106 R107 V108 Q113 E114	A106-S110 WeakPolarHBondContact O-CB 3.43Å; A106-S110 PolarHBondContact O-N 2.95Å; R107-S110 PolarHBondContact O-N 3.19Å; V108-S110 PolarHBondContact O-N 3.42Å; S110-Q113 PolarHBondContact O-N 3.23Å; S110-E114 PolarHBondContact O-N 2.97Å
111	L	97.7	Very high	97	Very high	86 Å²	86	107.4 Å²	107.4	45%	0.45	52%	0.519	S	S	.	.	H	α-helix	trans	-65.6	-40.3	176.8	-72.5	170.5	0	0	0	111.9	R107 V108 T109 E114 K115	R107-L111 HydrophobicContact CG-CD1 4.18Å; R107-L111 WeakPolarHBondContact O-CG 3.46Å; R107-L111 PolarHBondContact O-N 2.94Å; V108-L111 PolarHBondContact O-N 3.44Å; T109-L111 PolarHBondContact O-N 3.19Å; L111-E114 PolarHBondContact O-N 3Å; L111-K115 WeakPolarHBondContact O-CG 3.31Å; L111-K115 PolarHBondContact O-N 3.38Å
112	N	98.2	Very high	97.2	Very high	78 Å²	78	105.9 Å²	105.9	42%	0.417	51%	0.511	S	S	.	.	H	α-helix	trans	-67.4	-39	177	-75.3	-14.5	0	0	0	111.6	V108 T109 K115 L116	V108-N112 WeakPolarHBondContact O-CB 3.32Å; V108-N112 PolarHBondContact O-N 3.42Å; T109-N112 PolarHBondContact O-N 2.91Å; N112-K115 PolarHBondContact O-N 3.01Å; N112-L116 WeakPolarHBondContact O-CB 3.48Å; N112-L116 VanDerWaalsContact O-CG 3.3Å; N112-L116 WeakPolarHBondContact O-CG 3.47Å; N112-L116 PolarHBondContact O-N 3.01Å
113	Q	98.4	Very high	97.4	Very high	114 Å²	114	104.3 Å²	104.3	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-60.2	-45.7	174.3	-178.8	179.7	-11.9	0	0	111.3	T109 S110 K115 L116 L117	T109-Q113 WeakPolarHBondContact O-CB 3.36Å; T109-Q113 PolarHBondContact O-N 3.26Å; S110-Q113 PolarHBondContact O-N 3.23Å; Q113-K115 PolarHBondContact O-N 3.42Å; Q113-L116 PolarHBondContact O-N 3.42Å; Q113-L117 HydrophobicContact CG-CD1 4.41Å; Q113-L117 WeakPolarHBondContact O-CG 3.37Å; Q113-L117 PolarHBondContact O-N 3.42Å
114	E	98	Very high	97.7	Very high	114 Å²	114	100.2 Å²	100.2	53%	0.533	50%	0.497	S	S	.	.	H	α-helix	trans	-58.7	-47	175.7	-174.7	-179.2	-179.7	0	0	111.7	S110 L111 L116 L117 L118	S110-E114 PolarHBondContact O-N 2.97Å; L111-E114 PolarHBondContact O-N 3Å; E114-L116 VanDerWaalsContact C-N 3.34Å; E114-L116 PolarHBondContact O-N 3.08Å; E114-L117 PolarHBondContact O-N 3.11Å; E114-L118 WeakPolarHBondContact O-CG 3.25Å; E114-L118 PolarHBondContact O-N 3.5Å
115	K	98.1	Very high	97.9	Very high	141 Å²	141	101.1 Å²	101.1	61%	0.613	50%	0.5	S	S	*	.	H	α-helix	trans	-59.4	-42.8	176	-72.7	176.3	179.6	-179.9	0	112.7	L111 N112 Q113 L118 R119	L111-K115 WeakPolarHBondContact O-CG 3.31Å; L111-K115 PolarHBondContact O-N 3.38Å; N112-K115 PolarHBondContact O-N 3.01Å; Q113-K115 PolarHBondContact O-N 3.42Å; K115-L118 PolarHBondContact O-N 3.2Å; K115-R119 WeakPolarHBondContact O-CB 3.37Å; K115-R119 PolarHBondContact O-N 2.85Å
116	L	98.5	Very high	98	Very high	125 Å²	125	102 Å²	102	65%	0.654	51%	0.508	S	S	*	.	H	α-helix	trans	-65.6	-39.4	178.4	-73.9	171.6	0	0	0	111.7	N112 Q113 E114 R119 K120	N112-L116 WeakPolarHBondContact O-CB 3.48Å; N112-L116 VanDerWaalsContact O-CG 3.3Å; N112-L116 WeakPolarHBondContact O-CG 3.47Å; N112-L116 PolarHBondContact O-N 3.01Å; Q113-L116 PolarHBondContact O-N 3.42Å; E114-L116 VanDerWaalsContact C-N 3.34Å; E114-L116 PolarHBondContact O-N 3.08Å; L116-R119 PolarHBondContact O-N 3.16Å; L116-K120 WeakPolarHBondContact O-CB 3.24Å; L116-K120 PolarHBondContact O-N 3.46Å
117	L	98.5	Very high	98.1	Very high	96 Å²	96	103.7 Å²	103.7	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-63.8	-45.3	175.5	-73	174.7	0	0	0	111.8	Q113 E114 R119 K120 L121	Q113-L117 HydrophobicContact CG-CD1 4.41Å; Q113-L117 WeakPolarHBondContact O-CG 3.37Å; Q113-L117 PolarHBondContact O-N 3.42Å; E114-L117 PolarHBondContact O-N 3.11Å; L117-R119 VanDerWaalsContact C-N 3.34Å; L117-R119 PolarHBondContact O-N 2.93Å; L117-K120 PolarHBondContact O-N 2.68Å; L117-L121 WeakPolarHBondContact O-CG 3.47Å; L117-L121 PolarHBondContact O-N 3.04Å
118	L	98.2	Very high	98.2	Very high	99 Å²	99	99.9 Å²	99.9	52%	0.518	50%	0.498	S	S	.	.	H	α-helix	trans	-59.4	-46.6	174.8	-70.2	173.4	0	0	0	111.3	E114 K115 K120 L121 D122	E114-L118 WeakPolarHBondContact O-CG 3.25Å; E114-L118 PolarHBondContact O-N 3.5Å; K115-L118 PolarHBondContact O-N 3.2Å; L118-K120 VanDerWaalsContact C-N 3.31Å; L118-K120 PolarHBondContact O-N 3.45Å; L118-L121 PolarHBondContact O-N 3.5Å; L118-D122 PolarHBondContact O-N 3.48Å
119	R	98.2	Very high	98.2	Very high	155 Å²	155	106.1 Å²	106.1	59%	0.585	52%	0.517	S	S	*	.	H	α-helix	trans	-61.6	-40.5	178.1	-176.8	56.8	176.2	174.9	1.1	112.2	K115 L116 L117 D122 L123	K115-R119 WeakPolarHBondContact O-CB 3.37Å; K115-R119 PolarHBondContact O-N 2.85Å; L116-R119 PolarHBondContact O-N 3.16Å; L117-R119 VanDerWaalsContact C-N 3.34Å; L117-R119 PolarHBondContact O-N 2.93Å; R119-D122 PolarHBondContact O-N 3.32Å; R119-L123 HydrophobicContact CG-CD1 4.44Å; R119-L123 WeakPolarHBondContact O-CG 3.47Å; R119-L123 PolarHBondContact O-N 2.85Å
120	K	98.4	Very high	98.3	Very high	126 Å²	126	106.6 Å²	106.6	55%	0.548	52%	0.516	S	S	.	.	H	α-helix	trans	-60.6	-48.4	175.4	-177.6	-175	178.3	-175.1	0	110.9	L116 L117 L118 D122 L123 D124	L116-K120 WeakPolarHBondContact O-CB 3.24Å; L116-K120 PolarHBondContact O-N 3.46Å; L117-K120 PolarHBondContact O-N 2.68Å; L118-K120 VanDerWaalsContact C-N 3.31Å; L118-K120 PolarHBondContact O-N 3.45Å; K120-D122 VanDerWaalsContact C-N 3.26Å; K120-D122 PolarHBondContact O-N 2.96Å; K120-L123 PolarHBondContact O-N 3.38Å; K120-L123 VanDerWaalsContact O-N 3.15Å; K120-D124 WeakPolarHBondContact O-CB 3.31Å; K120-D124 PolarHBondContact O-N 3.32Å
121	L	98.5	Very high	98.3	Very high	95 Å²	95	108.6 Å²	108.6	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-58.4	-39	178.6	-71.3	172	0	0	0	112.2	L117 L118 D124 R125	L117-L121 WeakPolarHBondContact O-CG 3.47Å; L117-L121 PolarHBondContact O-N 3.04Å; L118-L121 PolarHBondContact O-N 3.5Å; L121-D124 PolarHBondContact O-N 3.38Å; L121-R125 VanDerWaalsContact O-CG 3.28Å; L121-R125 WeakPolarHBondContact O-CG 3.46Å; L121-R125 PolarHBondContact O-N 2.97Å
122	D	98.4	Very high	98.3	Very high	67 Å²	67	108.5 Å²	108.5	36%	0.358	51%	0.512	S	S	.	.	H	α-helix	trans	-67.5	-41.8	176.3	-71.8	-23.9	0	0	0	112.6	L118 R119 K120 R125 V126	L118-D122 PolarHBondContact O-N 3.48Å; R119-D122 PolarHBondContact O-N 3.32Å; K120-D122 VanDerWaalsContact C-N 3.26Å; K120-D122 PolarHBondContact O-N 2.96Å; D122-R125 PolarHBondContact O-N 3.06Å; D122-R125 IonicContact OD1-CZ 3.95Å; D122-R125 IonicContact OD1-NH1 2.93Å; D122-R125 PolarHBondContact OD1-NH1 3.44Å; D122-V126 WeakPolarHBondContact O-CG2 3.44Å; D122-V126 PolarHBondContact O-N 2.86Å; D122-V126 VanDerWaalsContact O-N 3.12Å
123	L	98.3	Very high	98.3	Very high	94 Å²	94	110.5 Å²	110.5	49%	0.492	52%	0.517	S	S	.	.	H	α-helix	trans	-63.7	-43.3	174.4	-70.8	173.9	0	0	0	111.4	R119 K120 R125 V126 N127	R119-L123 HydrophobicContact CG-CD1 4.44Å; R119-L123 WeakPolarHBondContact O-CG 3.47Å; R119-L123 PolarHBondContact O-N 2.85Å; K120-L123 PolarHBondContact O-N 3.38Å; K120-L123 VanDerWaalsContact O-N 3.15Å; L123-R125 VanDerWaalsContact C-N 3.32Å; L123-R125 PolarHBondContact O-N 2.73Å; L123-V126 PolarHBondContact O-N 3.32Å; L123-N127 WeakPolarHBondContact O-CB 3.48Å; L123-N127 PolarHBondContact O-N 2.9Å
124	D	98.6	Very high	98.3	Very high	57 Å²	57	109.8 Å²	109.8	31%	0.305	52%	0.516	S	S	.	.	H	α-helix	trans	-59.2	-44.8	176.8	-72.7	-22.3	0	0	0	110.2	K120 L121 V126 N127 H128	K120-D124 WeakPolarHBondContact O-CB 3.31Å; K120-D124 PolarHBondContact O-N 3.32Å; L121-D124 PolarHBondContact O-N 3.38Å; D124-V126 PolarHBondContact O-N 3.08Å; D124-N127 PolarHBondContact O-N 3.2Å; D124-H128 PolarHBondContact O-N 3.46Å; D124-H128 PolarHBondContact O-ND1 3.45Å
125	R	98.2	Very high	98.3	Very high	167 Å²	167	108.6 Å²	108.6	63%	0.63	52%	0.516	S	S	*	.	H	α-helix	trans	-57.5	-46.2	175.2	-74.1	168.2	-177.7	164.8	-5.4	112.8	L121 D122 L123 N127 H128 R129	L121-R125 VanDerWaalsContact O-CG 3.28Å; L121-R125 WeakPolarHBondContact O-CG 3.46Å; L121-R125 PolarHBondContact O-N 2.97Å; D122-R125 PolarHBondContact O-N 3.06Å; D122-R125 IonicContact OD1-CZ 3.95Å; D122-R125 IonicContact OD1-NH1 2.93Å; D122-R125 PolarHBondContact OD1-NH1 3.44Å; L123-R125 VanDerWaalsContact C-N 3.32Å; L123-R125 PolarHBondContact O-N 2.73Å; R125-N127 VanDerWaalsContact C-N 3.34Å; R125-H128 PolarHBondContact O-N 3.35Å; R125-R129 PolarHBondContact O-N 3.45Å; R125-R129 VanDerWaalsContact O-N 3.07Å
126	V	98.2	Very high	98.3	Very high	101 Å²	101	104 Å²	104	61%	0.612	51%	0.505	S	S	*	.	H	α-helix	trans	-63.6	-42.7	178.1	173.9	0	0	0	0	110.7	D122 L123 D124 R129 L130	D122-V126 WeakPolarHBondContact O-CG2 3.44Å; D122-V126 PolarHBondContact O-N 2.86Å; D122-V126 VanDerWaalsContact O-N 3.12Å; L123-V126 PolarHBondContact O-N 3.32Å; D124-V126 PolarHBondContact O-N 3.08Å; V126-R129 PolarHBondContact O-N 3.37Å; V126-L130 PolarHBondContact O-N 2.91Å
127	N	98.3	Very high	98.2	Very high	98 Å²	98	104.1 Å²	104.1	52%	0.524	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-44.8	178.5	-169.4	22	0	0	0	111.9	L123 D124 R125 R129 L130 R131	L123-N127 WeakPolarHBondContact O-CB 3.48Å; L123-N127 PolarHBondContact O-N 2.9Å; D124-N127 PolarHBondContact O-N 3.2Å; R125-N127 VanDerWaalsContact C-N 3.34Å; N127-R129 PolarHBondContact O-N 3.22Å; N127-L130 PolarHBondContact O-N 3.45Å; N127-R131 WeakPolarHBondContact O-CB 3.42Å; N127-R131 PolarHBondContact O-N 3.45Å
128	H	98.4	Very high	98.1	Very high	83 Å²	83	105.1 Å²	105.1	38%	0.384	51%	0.507	S	S	.	.	H	α-helix	trans	-59.6	-47.1	175.9	-76.3	70.6	0	0	0	111.1	D124 R125 L130 R131 D132	D124-H128 PolarHBondContact O-N 3.46Å; D124-H128 PolarHBondContact O-ND1 3.45Å; R125-H128 PolarHBondContact O-N 3.35Å; H128-L130 VanDerWaalsContact C-N 3.31Å; H128-L130 PolarHBondContact O-N 3.48Å; H128-R131 PolarHBondContact CD2-NH1 2.98Å; H128-R131 PolarHBondContact CD2-NH2 2.79Å; H128-R131 PolarHBondContact NE2-NH1 3.47Å; H128-R131 PolarHBondContact O-N 3.18Å; H128-D132 WeakPolarHBondContact O-CB 3.43Å; H128-D132 PolarHBondContact O-N 3.08Å
129	R	98.3	Very high	98	Very high	173 Å²	173	104.7 Å²	104.7	65%	0.653	50%	0.503	S	S	*	.	H	α-helix	trans	-60.2	-39.8	177.7	-174.7	-179.8	177.7	-168.5	-1.1	112.6	R125 V126 N127 K133	R125-R129 PolarHBondContact O-N 3.45Å; R125-R129 VanDerWaalsContact O-N 3.07Å; V126-R129 PolarHBondContact O-N 3.37Å; N127-R129 PolarHBondContact O-N 3.22Å; R129-K133 WeakPolarHBondContact O-CG 3.48Å; R129-K133 PolarHBondContact O-N 3.09Å
130	L	98.4	Very high	97.8	Very high	98 Å²	98	100.7 Å²	100.7	51%	0.513	49%	0.493	S	S	.	.	H	α-helix	trans	-65.8	-48.8	176.5	176.2	60.7	0	0	0	111	V126 N127 H128 D132 K133 L134	V126-L130 PolarHBondContact O-N 2.91Å; N127-L130 PolarHBondContact O-N 3.45Å; H128-L130 VanDerWaalsContact C-N 3.31Å; H128-L130 PolarHBondContact O-N 3.48Å; L130-D132 VanDerWaalsContact C-N 3.33Å; L130-D132 PolarHBondContact O-N 3.26Å; L130-K133 WeakPolarHBondContact O-CB 3.48Å; L130-K133 PolarHBondContact O-N 3.07Å; L130-L134 HydrophobicContact CD1-CD1 4.32Å; L130-L134 HydrophobicContact CD1-CG 4.29Å; L130-L134 HydrophobicContact CG-CD1 4.17Å; L130-L134 WeakPolarHBondContact O-CG 3.47Å; L130-L134 PolarHBondContact O-N 3.49Å
131	R	98.4	Very high	97.5	Very high	113 Å²	113	99.3 Å²	99.3	43%	0.426	49%	0.491	S	S	.	.	H	α-helix	trans	-55.6	-48.5	177.1	-179.5	-161.1	64.1	-145.3	-3.3	111.3	N127 H128 K133 L134 V135	N127-R131 WeakPolarHBondContact O-CB 3.42Å; N127-R131 PolarHBondContact O-N 3.45Å; H128-R131 PolarHBondContact CD2-NH1 2.98Å; H128-R131 PolarHBondContact CD2-NH2 2.79Å; H128-R131 PolarHBondContact NE2-NH1 3.47Å; H128-R131 PolarHBondContact O-N 3.18Å; R131-K133 VanDerWaalsContact C-N 3.28Å; R131-K133 PolarHBondContact O-N 3.39Å; R131-L134 PolarHBondContact O-N 2.91Å; R131-L134 VanDerWaalsContact O-N 3.14Å; R131-V135 HydrophobicContact CG-CG2 4.44Å; R131-V135 WeakPolarHBondContact O-CG2 3.43Å; R131-V135 PolarHBondContact O-N 3.49Å
132	D	98.4	Very high	97.2	Very high	85 Å²	85	101.1 Å²	101.1	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-63.6	-36.9	-177	-61.4	-14.4	0	0	0	111.3	H128 L130 A136	H128-D132 WeakPolarHBondContact O-CB 3.43Å; H128-D132 PolarHBondContact O-N 3.08Å; L130-D132 VanDerWaalsContact C-N 3.33Å; L130-D132 PolarHBondContact O-N 3.26Å; D132-A136 WeakPolarHBondContact O-CB 3.34Å; D132-A136 PolarHBondContact O-N 3.2Å
133	K	98	Very high	96.8	Very high	119 Å²	119	103.9 Å²	103.9	52%	0.517	51%	0.507	S	S	.	.	H	α-helix	trans	-63.7	-47.7	171.4	-76.1	-176.2	171.5	-160.5	0	112.4	R129 L130 R131 V135 A136 E137	R129-K133 WeakPolarHBondContact O-CG 3.48Å; R129-K133 PolarHBondContact O-N 3.09Å; L130-K133 WeakPolarHBondContact O-CB 3.48Å; L130-K133 PolarHBondContact O-N 3.07Å; R131-K133 VanDerWaalsContact C-N 3.28Å; R131-K133 PolarHBondContact O-N 3.39Å; K133-V135 VanDerWaalsContact C-N 3.3Å; K133-V135 PolarHBondContact O-N 3.31Å; K133-A136 PolarHBondContact O-N 3.02Å; K133-E137 WeakPolarHBondContact O-CG 3.46Å; K133-E137 PolarHBondContact O-N 3.3Å
134	L	98	Very high	96.4	Very high	99 Å²	99	107 Å²	107	52%	0.518	52%	0.52	S	S	.	.	H	α-helix	trans	-60.2	-42.3	179.4	-70.9	172.8	0	0	0	111.6	L130 R131 A136 E137 L138	L130-L134 HydrophobicContact CD1-CD1 4.32Å; L130-L134 HydrophobicContact CD1-CG 4.29Å; L130-L134 HydrophobicContact CG-CD1 4.17Å; L130-L134 WeakPolarHBondContact O-CG 3.47Å; L130-L134 PolarHBondContact O-N 3.49Å; R131-L134 PolarHBondContact O-N 2.91Å; R131-L134 VanDerWaalsContact O-N 3.14Å; L134-A136 VanDerWaalsContact C-N 3.35Å; L134-E137 PolarHBondContact O-N 3.46Å; L134-L138 WeakPolarHBondContact O-CB 3.14Å; L134-L138 VanDerWaalsContact O-CG 3.29Å; L134-L138 WeakPolarHBondContact O-CG 3.12Å; L134-L138 PolarHBondContact O-N 2.94Å
135	V	97.9	Very high	95.7	Very high	89 Å²	89	108.8 Å²	108.8	54%	0.539	53%	0.533	S	S	.	.	H	α-helix	trans	-62	-43.6	176.2	171.7	0	0	0	0	111	R131 K133 L138 H139	R131-V135 HydrophobicContact CG-CG2 4.44Å; R131-V135 WeakPolarHBondContact O-CG2 3.43Å; R131-V135 PolarHBondContact O-N 3.49Å; K133-V135 VanDerWaalsContact C-N 3.3Å; K133-V135 PolarHBondContact O-N 3.31Å; V135-L138 PolarHBondContact O-N 2.97Å; V135-H139 VanDerWaalsContact O-CB 3.32Å; V135-H139 WeakPolarHBondContact O-CB 3.4Å; V135-H139 PolarHBondContact O-N 3.22Å
136	A	97.5	Very high	94.7	Very high	45 Å²	45	104.5 Å²	104.5	37%	0.372	53%	0.529	S	S	.	.	H	α-helix	trans	-62.4	-46.9	177.4	0	0	0	0	0	112.2	D132 K133 L134 H139 N140	D132-A136 WeakPolarHBondContact O-CB 3.34Å; D132-A136 PolarHBondContact O-N 3.2Å; K133-A136 PolarHBondContact O-N 3.02Å; L134-A136 VanDerWaalsContact C-N 3.35Å; A136-H139 PolarHBondContact O-N 3.3Å; A136-N140 PolarHBondContact O-N 3.15Å; A136-N140 PolarHBondContact O-ND2 3Å; A136-N140 PolarHBondContact O-OD1 3.49Å
137	E	97.7	Very high	93.5	Very high	128 Å²	128	103.6 Å²	103.6	60%	0.598	53%	0.525	S	S	*	.	H	α-helix	trans	-63.7	-42.1	178.6	-65.6	-58.4	148.7	0	0	112.3	K133 L134 N140 L141	K133-E137 WeakPolarHBondContact O-CG 3.46Å; K133-E137 PolarHBondContact O-N 3.3Å; L134-E137 PolarHBondContact O-N 3.46Å; E137-N140 PolarHBondContact O-N 3.39Å; E137-L141 WeakPolarHBondContact O-CB 3.46Å; E137-L141 PolarHBondContact O-N 3.11Å
138	L	96.3	Very high	91.9	Very high	116 Å²	116	107 Å²	107	61%	0.607	54%	0.543	S	S	*	.	H	α-helix	trans	-64.2	-41.1	176.9	-74.3	172.5	0	0	0	112	L134 V135 L141 E142	L134-L138 WeakPolarHBondContact O-CB 3.14Å; L134-L138 VanDerWaalsContact O-CG 3.29Å; L134-L138 WeakPolarHBondContact O-CG 3.12Å; L134-L138 PolarHBondContact O-N 2.94Å; V135-L138 PolarHBondContact O-N 2.97Å; L138-L141 PolarHBondContact O-N 2.75Å; L138-E142 WeakPolarHBondContact O-CB 3.48Å; L138-E142 PolarHBondContact O-N 2.92Å
139	H	95.1	Very high	90.1	Very high	91 Å²	91	112 Å²	112	42%	0.421	56%	0.56	S	S	.	*	H	α-helix	trans	-67.3	-39.8	177.2	178.3	-94.3	0	0	0	112	V135 A136 L141 E142 Q143	V135-H139 VanDerWaalsContact O-CB 3.32Å; V135-H139 WeakPolarHBondContact O-CB 3.4Å; V135-H139 PolarHBondContact O-N 3.22Å; A136-H139 PolarHBondContact O-N 3.3Å; H139-L141 VanDerWaalsContact C-N 3.34Å; H139-E142 PolarHBondContact O-N 2.84Å; H139-Q143 PolarHBondContact CE1-NE2 3.27Å; H139-Q143 WeakPolarHBondContact O-CG 3.33Å; H139-Q143 PolarHBondContact O-N 3.48Å
140	N	94.5	Very high	88.1	Confident	71 Å²	71	108.7 Å²	108.7	38%	0.38	56%	0.56	S	S	.	*	H	α-helix	trans	-60.8	-45.4	173.9	-67.7	-14.8	0	0	0	110.9	A136 E137 E142 Q143 E144	A136-N140 PolarHBondContact O-N 3.15Å; A136-N140 PolarHBondContact O-ND2 3Å; A136-N140 PolarHBondContact O-OD1 3.49Å; E137-N140 PolarHBondContact O-N 3.39Å; N140-E142 VanDerWaalsContact C-N 3.33Å; N140-E142 PolarHBondContact O-N 3.02Å; N140-Q143 PolarHBondContact O-N 3.47Å; N140-E144 WeakPolarHBondContact O-CG 3.43Å; N140-E144 PolarHBondContact O-N 3.36Å
141	L	93.3	Very high	86.1	Confident	97 Å²	97	111.5 Å²	111.5	51%	0.508	58%	0.575	S	S	.	*	H	α-helix	trans	-62.4	-40	177.2	-173.4	66.8	0	0	0	112	E137 L138 H139 Q143 E144 T145	E137-L141 WeakPolarHBondContact O-CB 3.46Å; E137-L141 PolarHBondContact O-N 3.11Å; L138-L141 PolarHBondContact O-N 2.75Å; H139-L141 VanDerWaalsContact C-N 3.34Å; L141-Q143 VanDerWaalsContact C-N 3.35Å; L141-E144 PolarHBondContact O-N 3.11Å; L141-T145 HydrophobicContact CD1-CG2 4.31Å; L141-T145 HydrophobicContact CG-CG2 4.49Å; L141-T145 WeakPolarHBondContact O-CB 3.37Å; L141-T145 VanDerWaalsContact O-CG2 3.3Å; L141-T145 WeakPolarHBondContact O-CG2 3.1Å; L141-T145 PolarHBondContact O-N 3.32Å; L141-T145 PolarHBondContact O-OG1 2.95Å
142	E	92	Very high	83.8	Confident	133 Å²	133	112.9 Å²	112.9	62%	0.621	59%	0.59	S	S	*	*	H	α-helix	trans	-61.4	-42.6	174.3	-175.1	176.6	-164.6	0	0	111.4	L138 H139 N140 T145 S146	L138-E142 WeakPolarHBondContact O-CB 3.48Å; L138-E142 PolarHBondContact O-N 2.92Å; H139-E142 PolarHBondContact O-N 2.84Å; N140-E142 VanDerWaalsContact C-N 3.33Å; N140-E142 PolarHBondContact O-N 3.02Å; E142-T145 PolarHBondContact O-N 2.88Å; E142-T145 PolarHBondContact O-OG1 2.93Å; E142-S146 WeakPolarHBondContact O-CB 3.36Å; E142-S146 PolarHBondContact O-N 3.03Å
143	Q	90.2	Very high	81.7	Confident	124 Å²	124	112.9 Å²	112.9	58%	0.579	60%	0.602	S	S	*	*	H	α-helix	trans	-65.6	-41.4	176.5	-70.9	-166.8	-7.3	0	0	112.8	H139 N140 L141 T145 S146	H139-Q143 PolarHBondContact CE1-NE2 3.27Å; H139-Q143 WeakPolarHBondContact O-CG 3.33Å; H139-Q143 PolarHBondContact O-N 3.48Å; N140-Q143 PolarHBondContact O-N 3.47Å; L141-Q143 VanDerWaalsContact C-N 3.35Å; Q143-T145 VanDerWaalsContact C-N 3.3Å; Q143-T145 PolarHBondContact O-N 3.3Å; Q143-S146 PolarHBondContact O-N 3.44Å
144	E	88.6	Confident	79.4	Confident	160 Å²	160	117 Å²	117	75%	0.748	62%	0.62	S	S	*	*	H	α-helix	trans	-69.1	-28.8	178.6	-72.2	177.2	-172.2	0	0	112.9	N140 L141	N140-E144 WeakPolarHBondContact O-CG 3.43Å; N140-E144 PolarHBondContact O-N 3.36Å; L141-E144 PolarHBondContact O-N 3.11Å
145	T	84.6	Confident	77	Confident	95 Å²	95	120.8 Å²	120.8	58%	0.583	64%	0.635	S	S	*	*	H	α-helix	trans	-94.5	-13.7	179.7	55.3	0	0	0	0	113.4	L141 E142 Q143 P147	L141-T145 HydrophobicContact CD1-CG2 4.31Å; L141-T145 HydrophobicContact CG-CG2 4.49Å; L141-T145 WeakPolarHBondContact O-CB 3.37Å; L141-T145 VanDerWaalsContact O-CG2 3.3Å; L141-T145 WeakPolarHBondContact O-CG2 3.1Å; L141-T145 PolarHBondContact O-N 3.32Å; L141-T145 PolarHBondContact O-OG1 2.95Å; E142-T145 PolarHBondContact O-N 2.88Å; E142-T145 PolarHBondContact O-OG1 2.93Å; Q143-T145 VanDerWaalsContact C-N 3.3Å; Q143-T145 PolarHBondContact O-N 3.3Å; T145-P147 VanDerWaalsContact O-CD 3.3Å; T145-P147 WeakPolarHBondContact O-CD 3.36Å; T145-P147 VanDerWaalsContact O-N 3.17Å
146	S	76.8	Confident	74.7	Confident	77 Å²	77	126 Å²	126	54%	0.538	65%	0.651	S	S	.	*	S	Bend	trans	-63.7	115	178.2	-164.6	0	0	0	0	108.9	E142 Q143 D148	E142-S146 WeakPolarHBondContact O-CB 3.36Å; E142-S146 PolarHBondContact O-N 3.03Å; Q143-S146 PolarHBondContact O-N 3.44Å; S146-D148 PolarHBondContact O-N 3.05Å
147	P	72.4	Confident	72.5	Confident	82 Å²	82	130.5 Å²	130.5	53%	0.532	67%	0.674	S	S	.	*			trans	-72.8	130.3	-172.3	29.2	-34	0	0	0	110.3	T145 Y149	T145-P147 VanDerWaalsContact O-CD 3.3Å; T145-P147 WeakPolarHBondContact O-CD 3.36Å; T145-P147 VanDerWaalsContact O-N 3.17Å; P147-Y149 HydrophobicContact CB-CD2 3.46Å; P147-Y149 VanDerWaalsContact CB-CD2 3.46Å; P147-Y149 HydrophobicContact CB-CE2 3.53Å; P147-Y149 HydrophobicContact CG-CD2 3.84Å; P147-Y149 HydrophobicContact CG-CE2 4.12Å; P147-Y149 PolarHBondContact O-N 3.19Å
148	D	65	Low	70.1	Confident	169 Å²	169	132.4 Å²	132.4	90%	0.904	69%	0.686	S	S	*	*			trans	-64.1	28.4	175.9	-88.2	-25.4	0	0	0	114.1	S146 P150	S146-D148 PolarHBondContact O-N 3.05Å; D148-P150 WeakPolarHBondContact O-CD 3.04Å; D148-P150 VanDerWaalsContact O-N 3.15Å
149	Y	60.1	Low	67.5	Low	188 Å²	188	135.6 Å²	135.6	74%	0.737	70%	0.698	S	S	*	*			trans	-67.2	119.4	177.8	-69.9	-65.9	0	0	0	109.2	P147 I151	P147-Y149 HydrophobicContact CB-CD2 3.46Å; P147-Y149 VanDerWaalsContact CB-CD2 3.46Å; P147-Y149 HydrophobicContact CB-CE2 3.53Å; P147-Y149 HydrophobicContact CG-CD2 3.84Å; P147-Y149 HydrophobicContact CG-CE2 4.12Å; P147-Y149 PolarHBondContact O-N 3.19Å; Y149-I151 PolarHBondContact O-N 3.05Å
150	P	56.7	Low	65.1	Low	103 Å²	103	144 Å²	144	67%	0.669	74%	0.737	S	S	*	*			trans	-63.8	106.3	171.8	25.4	-31.3	0	0	0	108	D148 N152	D148-P150 WeakPolarHBondContact O-CD 3.04Å; D148-P150 VanDerWaalsContact O-N 3.15Å; P150-N152 PolarHBondContact O-N 3.1Å
151	I	56.6	Low	63.6	Low	158 Å²	158	147.6 Å²	147.6	81%	0.81	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	82.3	162.4	-52.3	172.3	0	0	0	105.2	Y149	Y149-I151 PolarHBondContact O-N 3.05Å
152	N	51	Low	62.1	Low	142 Å²	142	150.3 Å²	150.3	76%	0.759	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	171.6	13.2	158.5	-86.8	-27.6	0	0	0	115.7	P150 F154	P150-N152 PolarHBondContact O-N 3.1Å; N152-F154 VanDerWaalsContact C-N 3.31Å; N152-F154 PolarHBondContact O-N 3.44Å
153	A	52.9	Low	60.4	Low	85 Å²	85	151.2 Å²	151.2	70%	0.702	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	3.5	179.9	0	0	0	0	0	115.8
154	F	49.6	Very low	58.6	Low	204 Å²	204	152.8 Å²	152.8	90%	0.895	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	15.6	-171.9	-128.9	-86.4	0	0	0	116.9	N152	N152-F154 VanDerWaalsContact C-N 3.31Å; N152-F154 PolarHBondContact O-N 3.44Å
155	Q	48.9	Very low	56.8	Low	179 Å²	179	152.4 Å²	152.4	84%	0.836	79%	0.79	S	S	*	*	S	Bend	trans	-109.4	13.4	-179.9	-86.5	-169.9	-19.9	0	0	116.7
156	K	50.1	Low	54.9	Low	200 Å²	200	156.2 Å²	156.2	87%	0.87	80%	0.804	S	S	*	*	S	Bend	trans	-125.4	18.4	-176.7	-89.2	-167.7	179.2	-177.5	0	119.3
157	T	49.5	Very low	53.4	Low	138 Å²	138	161.9 Å²	161.9	85%	0.847	82%	0.823	S	S	*	*			trans	-129.9	42.7	177.1	-30.5	0	0	0	0	114.4
158	I	48.3	Very low	51.9	Low	168 Å²	168	168 Å²	168	86%	0.862	85%	0.846	S	S	*	*			trans	-122.8	63.9	155.7	-48.6	178.5	0	0	0	107.8
159	Q	42.4	Very low	50.8	Low	183 Å²	183	167.9 Å²	167.9	86%	0.855	84%	0.841	S	S	*	*			trans	-143.5	90	158.9	-78.8	-163.4	-5.1	0	0	107.5
160	Q	43.5	Very low	50	Low	267 Å²	267	166.1 Å²	166.1	100%	1.248	85%	0.85	S	S	*	*			trans	-175.8	0	147.3	-99.6	170.4	33.5	0	0	107.1

Retrieved 160 of 160 residues in 58.8 ms (Link to these results)

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