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Regulation of nuclear pre-mRNA domain-containing protein 1B

Interacts with phosphorylated C-terminal heptapeptide repeat domain (CTD) of the largest RNA polymerase II subunit POLR2A, and participates in dephosphorylation of the CTD by RPAP2. Transcriptional regulator which enhances expression of CCND1. Promotes binding of RNA polymerase II to the CCDN1 promoter and to the termination region before the poly-A site but decreases its binding after the poly-A site. Prevents RNA polymerase II from reading through the 3' end termination site and may allow it to be recruited back to the promoter through promotion of the formation of a chromatin loop. Also enhances the transcription of a number of other cell cycle-related genes including CDK2, CDK4, CDK6 and cyclin-E but not CDKN1A, CDKN1B or cyclin-A. Promotes cell proliferation.

AlphaFold DB , UniProt , Accession Q9NQG5, Species HUMAN (Homo sapiens, Human), Gene RPRD1B, Length 326 aa.

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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	51.7	Low	87.5	Confident	207 Å²	207	76.7 Å²	76.7	100%	1.02	43%	0.429	S	S	*	.				0	127.8	0	-64.3	-175.2	-161.6	0	0	107.9	S3 H32	M1-S3 PolarHBondContact O-N 3.2Å; M1-H32 PolarHBondContact SD-CE1 3.49Å; M1-H32 PolarHBondContact SD-NE2 3.04Å; M1-H32 VanDerWaalsContact SD-NE2 3.45Å
2	S	64.5	Low	88.2	Confident	70 Å²	70	76.4 Å²	76.4	49%	0.49	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-57.2	133.5	175.7	-177.8	0	0	0	0	109.6	H33	S2-H33 PolarHBondContact O-CE1 3.21Å; S2-H33 PolarHBondContact O-NE2 2.96Å
3	S	84.3	Confident	88.9	Confident	95 Å²	95	70.6 Å²	70.6	66%	0.664	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-66.4	155.4	167.8	50.1	0	0	0	0	110.1	M1	M1-S3 PolarHBondContact O-N 3.2Å
4	F	92.2	Very high	89.3	Confident	35 Å²	35	70.6 Å²	70.6	15%	0.154	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-76.2	132.3	171.4	176	-99.6	0	0	0	109.9	L9 W29 H33 H36 P39 I40	F4-L9 HydrophobicContact CE2-CB 4.4Å; F4-L9 HydrophobicContact CE2-CD2 4.21Å; F4-W29 AromaticContact CD2-CH2 3.73Å; F4-W29 HydrophobicContact CD2-CH2 3.73Å; F4-W29 HydrophobicContact CD2-CZ3 4.16Å; F4-W29 HydrophobicContact CE2-CH2 4.27Å; F4-W29 HydrophobicContact CE2-CZ3 4.41Å; F4-H33 HydrophobicContact CB-CB 4.25Å; F4-H33 HydrophobicContact CD2-CB 4.16Å; F4-H33 HydrophobicContact CG-CB 4.45Å; F4-H36 HydrophobicContact CD1-CB 3.59Å; F4-H36 AromaticContact CD1-CD2 3.64Å; F4-H36 AromaticContact CD1-CG 3.35Å; F4-H36 AromaticContact CD1-ND1 3.71Å; F4-H36 HydrophobicContact CD2-CB 4.38Å; F4-H36 HydrophobicContact CE1-CB 3.59Å; F4-H36 AromaticContact CE1-CG 3.84Å; F4-H36 HydrophobicContact CE2-CB 4.4Å; F4-H36 HydrophobicContact CG-CB 4Å; F4-H36 AromaticContact CG-CD2 3.67Å; F4-H36 AromaticContact CG-CG 3.81Å; F4-H36 HydrophobicContact CZ-CB 4.02Å; F4-P39 HydrophobicContact CE1-CB 4.11Å; F4-P39 HydrophobicContact CZ-CB 4.22Å; F4-I40 HydrophobicContact CD2-CD1 4.35Å; F4-I40 HydrophobicContact CD2-CG1 4.21Å; F4-I40 HydrophobicContact CE2-CD1 3.94Å; F4-I40 HydrophobicContact CE2-CG1 3.34Å; F4-I40 HydrophobicContact CZ-CG1 3.64Å
5	S	94.7	Very high	89.7	Confident	52 Å²	52	74.1 Å²	74.1	36%	0.364	41%	0.407	S	S	.	.			trans	-146.5	150.7	164.8	71.3	0	0	0	0	109.3	S7 A8 L9	S5-S7 VanDerWaalsContact C-N 3.28Å; S5-S7 PolarHBondContact O-N 3.33Å; S5-A8 PolarHBondContact O-N 3.15Å; S5-A8 VanDerWaalsContact OG-CB 3.25Å; S5-A8 WeakPolarHBondContact OG-CB 3.36Å; S5-A8 PolarHBondContact OG-N 3.14Å; S5-A8 VanDerWaalsContact OG-N 3.15Å; S5-L9 PolarHBondContact O-N 3.21Å; S5-L9 VanDerWaalsContact O-N 3.12Å
6	E	95.4	Very high	90.1	Very high	83 Å²	83	69.8 Å²	69.8	39%	0.388	38%	0.384	S	S	.	.	H	α-helix	trans	-59.9	-40.1	177.5	-66.9	-164.7	-161.3	0	0	111.6	A8 L9 E10 V43 R46	E6-A8 VanDerWaalsContact C-N 3.35Å; E6-A8 PolarHBondContact O-N 2.73Å; E6-L9 WeakPolarHBondContact O-CB 3.18Å; E6-L9 PolarHBondContact O-N 3.11Å; E6-L9 VanDerWaalsContact O-N 3.11Å; E6-E10 WeakPolarHBondContact O-CG 3.37Å; E6-E10 PolarHBondContact O-N 2.9Å; E6-V43 HydrophobicContact CB-CG2 3.91Å; E6-V43 HydrophobicContact CG-CG2 3.64Å; E6-V43 WeakPolarHBondContact OE2-CG2 3.4Å; E6-R46 IonicContact OE2-CZ 3.81Å; E6-R46 IonicContact OE2-NH1 2.75Å; E6-R46 IonicContact OE2-NH2 3.77Å; E6-R46 PolarHBondContact OE2-NH2 2.95Å
7	S	95.2	Very high	90.2	Very high	82 Å²	82	68.8 Å²	68.8	57%	0.573	38%	0.383	S	S	*	.	H	α-helix	trans	-63.1	-38	177.7	-179.5	0	0	0	0	112.8	S5 L9 E10 K11	S5-S7 VanDerWaalsContact C-N 3.28Å; S5-S7 PolarHBondContact O-N 3.33Å; S7-L9 VanDerWaalsContact C-N 3.31Å; S7-L9 PolarHBondContact O-N 3.07Å; S7-E10 PolarHBondContact O-N 3.32Å; S7-K11 PolarHBondContact O-N 3.18Å
8	A	94.9	Very high	90.2	Very high	24 Å²	24	70.8 Å²	70.8	20%	0.198	39%	0.393	C	S	.	.	H	α-helix	trans	-65.7	-37.5	174.5	0	0	0	0	0	111.5	S5 E6 K12 W29	S5-A8 PolarHBondContact O-N 3.15Å; S5-A8 VanDerWaalsContact OG-CB 3.25Å; S5-A8 WeakPolarHBondContact OG-CB 3.36Å; S5-A8 PolarHBondContact OG-N 3.14Å; S5-A8 VanDerWaalsContact OG-N 3.15Å; E6-A8 VanDerWaalsContact C-N 3.35Å; E6-A8 PolarHBondContact O-N 2.73Å; A8-K12 WeakPolarHBondContact O-CB 3.44Å; A8-K12 VanDerWaalsContact O-CG 3.27Å; A8-K12 WeakPolarHBondContact O-CG 3.5Å; A8-K12 PolarHBondContact O-N 2.97Å; A8-K12 VanDerWaalsContact O-N 3.08Å; A8-W29 HydrophobicContact CB-CH2 4.48Å
9	L	97	Very high	90.3	Very high	1 Å²	1	69.9 Å²	69.9	1%	0.005	39%	0.392	C	S	.	.	H	α-helix	trans	-66.9	-46.3	174.6	176.5	54.9	0	0	0	111.8	F4 S5 E6 S7 K11 K12 L13 W29 L30 I40 V43	F4-L9 HydrophobicContact CE2-CB 4.4Å; F4-L9 HydrophobicContact CE2-CD2 4.21Å; S5-L9 PolarHBondContact O-N 3.21Å; S5-L9 VanDerWaalsContact O-N 3.12Å; E6-L9 WeakPolarHBondContact O-CB 3.18Å; E6-L9 PolarHBondContact O-N 3.11Å; E6-L9 VanDerWaalsContact O-N 3.11Å; S7-L9 VanDerWaalsContact C-N 3.31Å; S7-L9 PolarHBondContact O-N 3.07Å; L9-K11 VanDerWaalsContact C-N 3.31Å; L9-K11 PolarHBondContact O-N 3.39Å; L9-K12 PolarHBondContact O-N 3.41Å; L9-K12 VanDerWaalsContact O-N 3.15Å; L9-L13 HydrophobicContact CD1-CD1 3.89Å; L9-L13 HydrophobicContact CD1-CD2 4.47Å; L9-L13 HydrophobicContact CD1-CG 3.86Å; L9-L13 HydrophobicContact CG-CD1 3.85Å; L9-L13 HydrophobicContact CG-CG 4.3Å; L9-L13 WeakPolarHBondContact O-CB 3.41Å; L9-L13 WeakPolarHBondContact O-CG 3.44Å; L9-L13 PolarHBondContact O-N 3.18Å; L9-W29 HydrophobicContact CB-CZ3 4.32Å; L9-W29 HydrophobicContact CD1-CZ3 4.21Å; L9-L30 HydrophobicContact CD1-CD2 3.61Å; L9-L30 HydrophobicContact CD2-CD2 4.46Å; L9-I40 HydrophobicContact CD2-CB 4.2Å; L9-I40 HydrophobicContact CD2-CG1 4.1Å; L9-I40 HydrophobicContact CD2-CG2 4.17Å; L9-V43 HydrophobicContact CB-CG1 4.35Å; L9-V43 HydrophobicContact CD2-CB 3.69Å; L9-V43 HydrophobicContact CD2-CG1 3.74Å; L9-V43 HydrophobicContact CD2-CG2 4.3Å; L9-V43 HydrophobicContact CG-CB 4.32Å; L9-V43 HydrophobicContact CG-CG1 3.8Å
10	E	96.8	Very high	90.3	Very high	62 Å²	62	71.7 Å²	71.7	29%	0.29	40%	0.397	S	S	.	.	H	α-helix	trans	-57	-45.4	176.7	-73.5	176.3	171.5	0	0	111.4	E6 S7 K12 L13 S14 V43 R46 E47	E6-E10 WeakPolarHBondContact O-CG 3.37Å; E6-E10 PolarHBondContact O-N 2.9Å; S7-E10 PolarHBondContact O-N 3.32Å; E10-K12 PolarHBondContact O-N 3.44Å; E10-L13 PolarHBondContact O-N 3.33Å; E10-S14 WeakPolarHBondContact O-CB 3.37Å; E10-S14 PolarHBondContact O-N 3.46Å; E10-V43 HydrophobicContact CG-CG1 3.78Å; E10-R46 IonicContact OE1-CZ 2.74Å; E10-R46 IonicContact OE1-NE 2.79Å; E10-R46 IonicContact OE1-NH2 3.32Å; E10-R46 PolarHBondContact OE1-NH2 2.89Å; E10-E47 HydrophobicContact CG-CG 4.27Å
11	K	95.5	Very high	90.3	Very high	133 Å²	133	72.8 Å²	72.8	58%	0.578	40%	0.399	S	S	*	.	H	α-helix	trans	-59.4	-48.7	174.9	-174	177.6	178	-179.1	0	111.5	S7 L9 L13 S14 E15	S7-K11 PolarHBondContact O-N 3.18Å; L9-K11 VanDerWaalsContact C-N 3.31Å; L9-K11 PolarHBondContact O-N 3.39Å; K11-L13 VanDerWaalsContact C-N 3.33Å; K11-L13 PolarHBondContact O-N 2.91Å; K11-S14 WeakPolarHBondContact O-CB 3.41Å; K11-S14 PolarHBondContact O-N 3.26Å; K11-S14 VanDerWaalsContact O-N 3.1Å; K11-S14 PolarHBondContact O-OG 3.05Å; K11-E15 WeakPolarHBondContact CE-OE1 3.34Å; K11-E15 PolarHBondContact O-N 3.22Å; K11-E15 VanDerWaalsContact O-N 3.14Å
12	K	95.9	Very high	92.3	Very high	73 Å²	73	64.3 Å²	64.3	32%	0.317	36%	0.36	S	S	.	.	H	α-helix	trans	-61.6	-38.8	178.2	-74.2	172.3	179.4	-64.2	0	112.6	A8 L9 E10 E15 L16 L26 W29	A8-K12 WeakPolarHBondContact O-CB 3.44Å; A8-K12 VanDerWaalsContact O-CG 3.27Å; A8-K12 WeakPolarHBondContact O-CG 3.5Å; A8-K12 PolarHBondContact O-N 2.97Å; A8-K12 VanDerWaalsContact O-N 3.08Å; L9-K12 PolarHBondContact O-N 3.41Å; L9-K12 VanDerWaalsContact O-N 3.15Å; E10-K12 PolarHBondContact O-N 3.44Å; K12-E15 PolarHBondContact O-N 3.11Å; K12-L16 PolarHBondContact O-N 2.85Å; K12-L16 VanDerWaalsContact O-N 3.07Å; K12-L26 HydrophobicContact CB-CD1 3.68Å; K12-L26 HydrophobicContact CB-CD2 4.27Å; K12-L26 HydrophobicContact CD-CD1 3.8Å; K12-L26 HydrophobicContact CG-CD1 4.25Å; K12-W29 HydrophobicContact CD-CD2 3.85Å; K12-W29 HydrophobicContact CD-CE3 3.75Å; K12-W29 HydrophobicContact CD-CG 4.48Å; K12-W29 HydrophobicContact CD-CH2 4.24Å; K12-W29 HydrophobicContact CD-CZ2 4.33Å; K12-W29 HydrophobicContact CD-CZ3 3.96Å
13	L	97.1	Very high	93.8	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-68.4	-35.8	174	-71	170.6	0	0	0	111.4	L9 E10 K11 E15 L16 L26 V43 E47 R55 F59 L62	L9-L13 HydrophobicContact CD1-CD1 3.89Å; L9-L13 HydrophobicContact CD1-CD2 4.47Å; L9-L13 HydrophobicContact CD1-CG 3.86Å; L9-L13 HydrophobicContact CG-CD1 3.85Å; L9-L13 HydrophobicContact CG-CG 4.3Å; L9-L13 WeakPolarHBondContact O-CB 3.41Å; L9-L13 WeakPolarHBondContact O-CG 3.44Å; L9-L13 PolarHBondContact O-N 3.18Å; E10-L13 PolarHBondContact O-N 3.33Å; K11-L13 VanDerWaalsContact C-N 3.33Å; K11-L13 PolarHBondContact O-N 2.91Å; L13-E15 PolarHBondContact O-N 3.28Å; L13-L16 HydrophobicContact CD2-CD2 4.33Å; L13-L16 VanDerWaalsContact O-CB 3.3Å; L13-L16 WeakPolarHBondContact O-CB 3.35Å; L13-L16 PolarHBondContact O-N 3.29Å; L13-L26 HydrophobicContact CD2-CD2 3.92Å; L13-L26 HydrophobicContact CG-CD2 4.49Å; L13-V43 HydrophobicContact CD1-CG1 4.09Å; L13-E47 HydrophobicContact CD1-CB 3.97Å; L13-E47 HydrophobicContact CD1-CG 4.02Å; L13-R55 PolarHBondContact O-NH2 2.99Å; L13-F59 HydrophobicContact CB-CE1 4.28Å; L13-F59 HydrophobicContact CB-CZ 4.2Å; L13-F59 HydrophobicContact CD1-CE1 4.27Å; L13-F59 HydrophobicContact CD2-CD1 4.29Å; L13-F59 HydrophobicContact CD2-CE1 3.82Å; L13-F59 HydrophobicContact CD2-CZ 4.36Å; L13-F59 HydrophobicContact CG-CE1 4.35Å; L13-L62 HydrophobicContact CD2-CD2 3.63Å
14	S	95.1	Very high	94.4	Very high	70 Å²	70	58.6 Å²	58.6	49%	0.49	32%	0.316	S	S	.	.	H	α-helix	trans	-62.5	-32.2	175.3	83.3	0	0	0	0	112.3	E10 K11 R55	E10-S14 WeakPolarHBondContact O-CB 3.37Å; E10-S14 PolarHBondContact O-N 3.46Å; K11-S14 WeakPolarHBondContact O-CB 3.41Å; K11-S14 PolarHBondContact O-N 3.26Å; K11-S14 VanDerWaalsContact O-N 3.1Å; K11-S14 PolarHBondContact O-OG 3.05Å; S14-R55 VanDerWaalsContact O-CZ 3.32Å; S14-R55 PolarHBondContact O-NH1 3.38Å; S14-R55 PolarHBondContact O-NH2 2.6Å
15	E	94.7	Very high	94.5	Very high	123 Å²	123	60.5 Å²	60.5	58%	0.575	33%	0.33	S	S	*	.	H	α-helix	trans	-90.8	-8.7	179.6	-67	170.8	-172.5	0	0	113.5	K11 K12 L13 S17	K11-E15 WeakPolarHBondContact CE-OE1 3.34Å; K11-E15 PolarHBondContact O-N 3.22Å; K11-E15 VanDerWaalsContact O-N 3.14Å; K12-E15 PolarHBondContact O-N 3.11Å; L13-E15 PolarHBondContact O-N 3.28Å; E15-S17 PolarHBondContact O-N 3.49Å
16	L	95.9	Very high	94.6	Very high	5 Å²	5	58.5 Å²	58.5	3%	0.026	32%	0.316	C	S	.	.			trans	-59.3	122.6	-179.4	-179.7	65.6	0	0	0	111.3	K12 L13 V23 L26 R55 T58 F59 L62	K12-L16 PolarHBondContact O-N 2.85Å; K12-L16 VanDerWaalsContact O-N 3.07Å; L13-L16 HydrophobicContact CD2-CD2 4.33Å; L13-L16 VanDerWaalsContact O-CB 3.3Å; L13-L16 WeakPolarHBondContact O-CB 3.35Å; L13-L16 PolarHBondContact O-N 3.29Å; L16-V23 HydrophobicContact CD1-CG2 4.23Å; L16-L26 HydrophobicContact CB-CD2 4.49Å; L16-L26 HydrophobicContact CD1-CD2 4.11Å; L16-R55 PolarHBondContact O-NH2 2.73Å; L16-T58 HydrophobicContact CD1-CG2 4.34Å; L16-T58 HydrophobicContact CD2-CG2 3.97Å; L16-T58 HydrophobicContact CG-CG2 3.76Å; L16-F59 HydrophobicContact CD2-CD2 4.34Å; L16-L62 HydrophobicContact CD2-CB 4.2Å; L16-L62 HydrophobicContact CD2-CD2 3.94Å
17	S	93.2	Very high	94.6	Very high	53 Å²	53	54.6 Å²	54.6	37%	0.371	30%	0.297	S	S	.	.			trans	-113.2	165.2	178.3	73.5	0	0	0	0	111.3	E15 S19 S22 T58	E15-S17 PolarHBondContact O-N 3.49Å; S17-S19 PolarHBondContact O-N 3.35Å; S17-S19 VanDerWaalsContact O-N 3.09Å; S17-S19 PolarHBondContact OG-OG 2.83Å; S17-S19 VanDerWaalsContact OG-OG 3.06Å; S17-S22 PolarHBondContact N-OG 3.08Å; S17-S22 WeakPolarHBondContact OG-CB 3.06Å; S17-S22 PolarHBondContact OG-OG 3.34Å; S17-T58 WeakPolarHBondContact O-CG2 3.33Å
18	N	90.1	Very high	94.6	Very high	105 Å²	105	56.2 Å²	56.2	56%	0.561	30%	0.299	S	S	*	.	S	Bend	trans	-75.2	11.9	178.8	-157.5	49	0	0	0	113.8	T58 Y61	N18-T58 HydrophobicContact CB-CG2 4.47Å; N18-T58 PolarHBondContact OD1-OG1 3.06Å; N18-Y61 WeakPolarHBondContact OD1-CD2 3.35Å; N18-Y61 WeakPolarHBondContact OD1-CE2 3.37Å
19	S	91.7	Very high	94.7	Very high	54 Å²	54	56.8 Å²	56.8	38%	0.378	30%	0.296	S	S	.	.	S	Bend	trans	-82.4	142.7	175	72.9	0	0	0	0	110.5	S17 Q21 S22 V23	S17-S19 PolarHBondContact O-N 3.35Å; S17-S19 VanDerWaalsContact O-N 3.09Å; S17-S19 PolarHBondContact OG-OG 2.83Å; S17-S19 VanDerWaalsContact OG-OG 3.06Å; S19-Q21 VanDerWaalsContact C-N 3.26Å; S19-Q21 PolarHBondContact O-N 3.16Å; S19-S22 PolarHBondContact O-N 3.18Å; S19-S22 VanDerWaalsContact O-N 3.1Å; S19-S22 WeakPolarHBondContact OG-CB 3.02Å; S19-S22 PolarHBondContact OG-N 3.31Å; S19-V23 PolarHBondContact O-N 2.96Å; S19-V23 VanDerWaalsContact O-N 3.15Å
20	Q	89.8	Confident	94.6	Very high	106 Å²	106	56.9 Å²	56.9	50%	0.495	30%	0.296	S	S	.	.	H	α-helix	trans	-54.3	-44.5	178.8	-173.2	64	20.8	0	0	111.6	S22 V23 Q24	Q20-S22 VanDerWaalsContact C-N 3.35Å; Q20-S22 PolarHBondContact O-N 3.14Å; Q20-V23 PolarHBondContact O-N 3.04Å; Q20-Q24 HydrophobicContact CG-CG 4.39Å; Q20-Q24 WeakPolarHBondContact O-CB 3.29Å; Q20-Q24 WeakPolarHBondContact O-CG 3.43Å; Q20-Q24 PolarHBondContact O-N 2.78Å
21	Q	89.9	Confident	94.6	Very high	95 Å²	95	54.7 Å²	54.7	44%	0.444	29%	0.286	S	S	.	.	H	α-helix	trans	-59.5	-42.8	178.2	-174.7	62	37.9	0	0	112.6	S19 T25	S19-Q21 VanDerWaalsContact C-N 3.26Å; S19-Q21 PolarHBondContact O-N 3.16Å; Q21-T25 PolarHBondContact NE2-OG1 3.14Å; Q21-T25 VanDerWaalsContact O-CB 3.24Å; Q21-T25 WeakPolarHBondContact O-CB 3.45Å; Q21-T25 PolarHBondContact O-N 3.47Å; Q21-T25 PolarHBondContact O-OG1 3.22Å
22	S	95.1	Very high	94.5	Very high	29 Å²	29	53.3 Å²	53.3	20%	0.203	28%	0.282	C	S	.	.	H	α-helix	trans	-64.9	-43.8	-179.3	-175	0	0	0	0	111.1	S17 S19 Q20 L26	S17-S22 PolarHBondContact N-OG 3.08Å; S17-S22 WeakPolarHBondContact OG-CB 3.06Å; S17-S22 PolarHBondContact OG-OG 3.34Å; S19-S22 PolarHBondContact O-N 3.18Å; S19-S22 VanDerWaalsContact O-N 3.1Å; S19-S22 WeakPolarHBondContact OG-CB 3.02Å; S19-S22 PolarHBondContact OG-N 3.31Å; Q20-S22 VanDerWaalsContact C-N 3.35Å; Q20-S22 PolarHBondContact O-N 3.14Å; S22-L26 PolarHBondContact O-N 3.34Å
23	V	96.3	Very high	94.4	Very high	5 Å²	5	50.8 Å²	50.8	3%	0.03	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-50.1	176.7	178.6	0	0	0	0	111.2	L16 S19 Q20 L26 S27 T58 L62 D65	L16-V23 HydrophobicContact CD1-CG2 4.23Å; S19-V23 PolarHBondContact O-N 2.96Å; S19-V23 VanDerWaalsContact O-N 3.15Å; Q20-V23 PolarHBondContact O-N 3.04Å; V23-L26 PolarHBondContact O-N 3.21Å; V23-S27 VanDerWaalsContact O-CB 3.25Å; V23-S27 WeakPolarHBondContact O-CB 3.32Å; V23-S27 PolarHBondContact O-N 3.18Å; V23-T58 HydrophobicContact CG2-CG2 4.26Å; V23-L62 HydrophobicContact CG1-CB 4.33Å; V23-L62 HydrophobicContact CG1-CD1 4.41Å; V23-D65 HydrophobicContact CG1-CB 4.04Å
24	Q	95.1	Very high	94.2	Very high	39 Å²	39	54.9 Å²	54.9	18%	0.182	29%	0.287	C	S	.	.	H	α-helix	trans	-65.1	-43.4	-178.3	-74.9	177	-26.8	0	0	112.7	Q20 L26 S27 L28	Q20-Q24 HydrophobicContact CG-CG 4.39Å; Q20-Q24 WeakPolarHBondContact O-CB 3.29Å; Q20-Q24 WeakPolarHBondContact O-CG 3.43Å; Q20-Q24 PolarHBondContact O-N 2.78Å; Q24-L26 VanDerWaalsContact C-N 3.32Å; Q24-L26 PolarHBondContact O-N 3.5Å; Q24-S27 WeakPolarHBondContact O-CB 3.27Å; Q24-S27 PolarHBondContact O-N 2.92Å; Q24-L28 WeakPolarHBondContact O-CG 3.33Å; Q24-L28 PolarHBondContact O-N 3.03Å
25	T	94.4	Very high	94.2	Very high	75 Å²	75	60.9 Å²	60.9	46%	0.46	30%	0.304	S	S	.	.	H	α-helix	trans	-60.7	-44.5	179.7	-57	0	0	0	0	110.7	Q21 W29	Q21-T25 PolarHBondContact NE2-OG1 3.14Å; Q21-T25 VanDerWaalsContact O-CB 3.24Å; Q21-T25 WeakPolarHBondContact O-CB 3.45Å; Q21-T25 PolarHBondContact O-N 3.47Å; Q21-T25 PolarHBondContact O-OG1 3.22Å; T25-W29 PolarHBondContact O-N 3.15Å
26	L	97	Very high	94.2	Very high	11 Å²	11	58.6 Å²	58.6	6%	0.058	29%	0.293	C	S	.	.	H	α-helix	trans	-68.9	-43.4	176.6	-175.9	50.9	0	0	0	111.2	K12 L13 L16 S22 V23 Q24 L28 W29 L30 L62	K12-L26 HydrophobicContact CB-CD1 3.68Å; K12-L26 HydrophobicContact CB-CD2 4.27Å; K12-L26 HydrophobicContact CD-CD1 3.8Å; K12-L26 HydrophobicContact CG-CD1 4.25Å; L13-L26 HydrophobicContact CD2-CD2 3.92Å; L13-L26 HydrophobicContact CG-CD2 4.49Å; L16-L26 HydrophobicContact CB-CD2 4.49Å; L16-L26 HydrophobicContact CD1-CD2 4.11Å; S22-L26 PolarHBondContact O-N 3.34Å; V23-L26 PolarHBondContact O-N 3.21Å; Q24-L26 VanDerWaalsContact C-N 3.32Å; Q24-L26 PolarHBondContact O-N 3.5Å; L26-L28 PolarHBondContact O-N 2.91Å; L26-W29 HydrophobicContact CD1-CE3 4.05Å; L26-W29 WeakPolarHBondContact O-CB 3.4Å; L26-W29 PolarHBondContact O-N 3.31Å; L26-W29 VanDerWaalsContact O-N 3.11Å; L26-L30 HydrophobicContact CD1-CD2 4.43Å; L26-L30 HydrophobicContact CD1-CG 4.28Å; L26-L30 HydrophobicContact CG-CD1 4.32Å; L26-L30 HydrophobicContact CG-CG 4.42Å; L26-L30 WeakPolarHBondContact O-CG 3.37Å; L26-L30 PolarHBondContact O-N 3.29Å; L26-L62 HydrophobicContact CB-CD1 4.01Å; L26-L62 HydrophobicContact CD2-CD1 4.29Å; L26-L62 HydrophobicContact CD2-CD2 3.67Å; L26-L62 HydrophobicContact CG-CD1 3.97Å; L26-L62 HydrophobicContact CG-CD2 4.11Å
27	S	96.9	Very high	94.2	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-54.1	-48.9	176.8	176.7	0	0	0	0	112.4	V23 Q24 W29 L30 I31 D65 V66	V23-S27 VanDerWaalsContact O-CB 3.25Å; V23-S27 WeakPolarHBondContact O-CB 3.32Å; V23-S27 PolarHBondContact O-N 3.18Å; Q24-S27 WeakPolarHBondContact O-CB 3.27Å; Q24-S27 PolarHBondContact O-N 2.92Å; S27-W29 VanDerWaalsContact C-N 3.32Å; S27-W29 PolarHBondContact O-N 3.34Å; S27-L30 WeakPolarHBondContact O-CB 3.42Å; S27-L30 PolarHBondContact O-N 2.87Å; S27-L30 VanDerWaalsContact O-N 3.13Å; S27-I31 VanDerWaalsContact O-CG1 3.31Å; S27-I31 WeakPolarHBondContact O-CG1 3.32Å; S27-I31 PolarHBondContact O-N 2.96Å; S27-D65 WeakPolarHBondContact CB-OD1 3.37Å; S27-D65 PolarHBondContact OG-OD1 3.47Å; S27-V66 PolarHBondContact OG-N 3.09Å
28	L	94.9	Very high	94.4	Very high	117 Å²	117	57.4 Å²	57.4	61%	0.613	29%	0.29	S	S	*	.	H	α-helix	trans	-59.7	-41.5	176.6	-73.3	173.6	0	0	0	112.4	Q24 L26 I31 H32	Q24-L28 WeakPolarHBondContact O-CG 3.33Å; Q24-L28 PolarHBondContact O-N 3.03Å; L26-L28 PolarHBondContact O-N 2.91Å; L28-I31 PolarHBondContact O-N 3.21Å; L28-H32 WeakPolarHBondContact O-CB 3.38Å; L28-H32 PolarHBondContact O-N 3.35Å
29	W	95.4	Very high	94.7	Very high	35 Å²	35	55 Å²	55	13%	0.133	28%	0.279	C	S	.	.	H	α-helix	trans	-62.9	-41.3	175.9	-173.3	80.5	0	0	0	111.6	F4 A8 L9 K12 T25 L26 S27 H32 H33	F4-W29 AromaticContact CD2-CH2 3.73Å; F4-W29 HydrophobicContact CD2-CH2 3.73Å; F4-W29 HydrophobicContact CD2-CZ3 4.16Å; F4-W29 HydrophobicContact CE2-CH2 4.27Å; F4-W29 HydrophobicContact CE2-CZ3 4.41Å; A8-W29 HydrophobicContact CB-CH2 4.48Å; L9-W29 HydrophobicContact CB-CZ3 4.32Å; L9-W29 HydrophobicContact CD1-CZ3 4.21Å; K12-W29 HydrophobicContact CD-CD2 3.85Å; K12-W29 HydrophobicContact CD-CE3 3.75Å; K12-W29 HydrophobicContact CD-CG 4.48Å; K12-W29 HydrophobicContact CD-CH2 4.24Å; K12-W29 HydrophobicContact CD-CZ2 4.33Å; K12-W29 HydrophobicContact CD-CZ3 3.96Å; T25-W29 PolarHBondContact O-N 3.15Å; L26-W29 HydrophobicContact CD1-CE3 4.05Å; L26-W29 WeakPolarHBondContact O-CB 3.4Å; L26-W29 PolarHBondContact O-N 3.31Å; L26-W29 VanDerWaalsContact O-N 3.11Å; S27-W29 VanDerWaalsContact C-N 3.32Å; S27-W29 PolarHBondContact O-N 3.34Å; W29-H32 WeakPolarHBondContact O-CB 3.35Å; W29-H32 PolarHBondContact O-N 2.85Å; W29-H33 AromaticContact CD2-CD2 3.76Å; W29-H33 AromaticContact CE2-CD2 3.38Å; W29-H33 AromaticContact CE2-NE2 3.45Å; W29-H33 AromaticContact CZ2-CD2 3.59Å; W29-H33 AromaticContact CZ2-NE2 3.66Å; W29-H33 AromaticContact NE1-CD2 3.6Å; W29-H33 AromaticContact NE1-NE2 3.28Å; W29-H33 PolarHBondContact NE1-NE2 3.34Å; W29-H33 PolarHBondContact O-CD2 2.85Å; W29-H33 PolarHBondContact O-N 3.17Å
30	L	96.7	Very high	95	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-65.1	-45	175.4	-62.6	178.1	0	0	0	112	L9 L26 S27 H32 H33 R34 I40 L62 V66 F77	L9-L30 HydrophobicContact CD1-CD2 3.61Å; L9-L30 HydrophobicContact CD2-CD2 4.46Å; L26-L30 HydrophobicContact CD1-CD2 4.43Å; L26-L30 HydrophobicContact CD1-CG 4.28Å; L26-L30 HydrophobicContact CG-CD1 4.32Å; L26-L30 HydrophobicContact CG-CG 4.42Å; L26-L30 WeakPolarHBondContact O-CG 3.37Å; L26-L30 PolarHBondContact O-N 3.29Å; S27-L30 WeakPolarHBondContact O-CB 3.42Å; S27-L30 PolarHBondContact O-N 2.87Å; S27-L30 VanDerWaalsContact O-N 3.13Å; L30-H32 VanDerWaalsContact C-N 3.28Å; L30-H32 PolarHBondContact O-N 3.43Å; L30-H33 CarbonylContact O-C 3.25Å; L30-H33 VanDerWaalsContact O-C 3.25Å; L30-H33 WeakPolarHBondContact O-CA 3.49Å; L30-H33 PolarHBondContact O-N 3.47Å; L30-R34 PolarHBondContact O-N 3.25Å; L30-R34 VanDerWaalsContact O-N 3.17Å; L30-I40 HydrophobicContact CD1-CG2 4.24Å; L30-I40 HydrophobicContact CD2-CD1 4.09Å; L30-I40 HydrophobicContact CD2-CG1 4.18Å; L30-I40 HydrophobicContact CD2-CG2 3.71Å; L30-I40 HydrophobicContact CG-CG2 4.39Å; L30-L62 HydrophobicContact CD1-CD1 4.13Å; L30-L62 HydrophobicContact CD1-CD2 4.1Å; L30-L62 HydrophobicContact CD1-CG 4.25Å; L30-V66 HydrophobicContact CB-CG2 4.21Å; L30-V66 HydrophobicContact CD1-CG2 3.75Å; L30-F77 HydrophobicContact CB-CZ 4.21Å; L30-F77 WeakPolarHBondContact O-CZ 3.24Å
31	I	95.3	Very high	95.4	Very high	16 Å²	16	47.6 Å²	47.6	8%	0.082	24%	0.239	C	C	.	.	H	α-helix	trans	-62.2	-37.5	178.2	-66.9	167.2	0	0	0	111.2	S27 L28 H33 R34 V66 N69 K73	S27-I31 VanDerWaalsContact O-CG1 3.31Å; S27-I31 WeakPolarHBondContact O-CG1 3.32Å; S27-I31 PolarHBondContact O-N 2.96Å; L28-I31 PolarHBondContact O-N 3.21Å; I31-H33 VanDerWaalsContact C-N 3.28Å; I31-H33 PolarHBondContact O-N 3.12Å; I31-R34 WeakPolarHBondContact O-CB 3.47Å; I31-R34 PolarHBondContact O-N 2.99Å; I31-V66 HydrophobicContact CG1-CG1 4.37Å; I31-N69 HydrophobicContact CD1-CB 3.56Å; I31-K73 HydrophobicContact CG2-CG 4.3Å
32	H	93.5	Very high	95.8	Very high	105 Å²	105	46.1 Å²	46.1	49%	0.486	24%	0.239	S	C	.	.	H	α-helix	trans	-60.5	-39.8	173.2	-179.2	76.4	0	0	0	111.8	M1 L28 W29 L30 R34	M1-H32 PolarHBondContact SD-CE1 3.49Å; M1-H32 PolarHBondContact SD-NE2 3.04Å; M1-H32 VanDerWaalsContact SD-NE2 3.45Å; L28-H32 WeakPolarHBondContact O-CB 3.38Å; L28-H32 PolarHBondContact O-N 3.35Å; W29-H32 WeakPolarHBondContact O-CB 3.35Å; W29-H32 PolarHBondContact O-N 2.85Å; L30-H32 VanDerWaalsContact C-N 3.28Å; L30-H32 PolarHBondContact O-N 3.43Å; H32-R34 VanDerWaalsContact C-N 3.34Å; H32-R34 PolarHBondContact O-N 3.4Å
33	H	94	Very high	95.9	Very high	19 Å²	19	44.7 Å²	44.7	9%	0.088	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	25.8	177.7	-65.1	-63.7	0	0	0	114	S2 F4 W29 L30 I31 K35 H36 I40	S2-H33 PolarHBondContact O-CE1 3.21Å; S2-H33 PolarHBondContact O-NE2 2.96Å; F4-H33 HydrophobicContact CB-CB 4.25Å; F4-H33 HydrophobicContact CD2-CB 4.16Å; F4-H33 HydrophobicContact CG-CB 4.45Å; W29-H33 AromaticContact CD2-CD2 3.76Å; W29-H33 AromaticContact CE2-CD2 3.38Å; W29-H33 AromaticContact CE2-NE2 3.45Å; W29-H33 AromaticContact CZ2-CD2 3.59Å; W29-H33 AromaticContact CZ2-NE2 3.66Å; W29-H33 AromaticContact NE1-CD2 3.6Å; W29-H33 AromaticContact NE1-NE2 3.28Å; W29-H33 PolarHBondContact NE1-NE2 3.34Å; W29-H33 PolarHBondContact O-CD2 2.85Å; W29-H33 PolarHBondContact O-N 3.17Å; L30-H33 CarbonylContact O-C 3.25Å; L30-H33 VanDerWaalsContact O-C 3.25Å; L30-H33 WeakPolarHBondContact O-CA 3.49Å; L30-H33 PolarHBondContact O-N 3.47Å; I31-H33 VanDerWaalsContact C-N 3.28Å; I31-H33 PolarHBondContact O-N 3.12Å; H33-K35 PolarHBondContact O-N 3.41Å; H33-H36 PolarHBondContact O-N 3.3Å; H33-I40 HydrophobicContact CB-CD1 4.24Å
34	R	93.7	Very high	96	Very high	88 Å²	88	44.6 Å²	44.6	33%	0.332	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-53.5	-23	-176.8	69.4	175.1	-174.5	-92.4	3.8	116	L30 I31 H32 H36 A37 E76 F77	L30-R34 PolarHBondContact O-N 3.25Å; L30-R34 VanDerWaalsContact O-N 3.17Å; I31-R34 WeakPolarHBondContact O-CB 3.47Å; I31-R34 PolarHBondContact O-N 2.99Å; H32-R34 VanDerWaalsContact C-N 3.34Å; H32-R34 PolarHBondContact O-N 3.4Å; R34-H36 PolarHBondContact O-N 3.27Å; R34-H36 VanDerWaalsContact O-N 3.11Å; R34-A37 VanDerWaalsContact O-CB 3.28Å; R34-A37 WeakPolarHBondContact O-CB 3.38Å; R34-A37 PolarHBondContact O-N 3.48Å; R34-E76 IonicContact NE-OE1 3.62Å; R34-F77 HydrophobicContact CB-CD2 4.19Å; R34-F77 HydrophobicContact CB-CE2 3.61Å; R34-F77 HydrophobicContact CB-CZ 4.44Å
35	K	93.6	Very high	96.1	Very high	196 Å²	196	44.6 Å²	44.6	85%	0.852	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-58.1	-21.5	171.9	-66	-173.9	178.9	-177.4	0	112.8	H33	H33-K35 PolarHBondContact O-N 3.41Å
36	H	95.8	Very high	96.3	Very high	75 Å²	75	45 Å²	45	35%	0.347	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-106	25.3	177.1	-53.5	-76.2	0	0	0	112.3	F4 H33 R34 G38 P39 I40	F4-H36 HydrophobicContact CD1-CB 3.59Å; F4-H36 AromaticContact CD1-CD2 3.64Å; F4-H36 AromaticContact CD1-CG 3.35Å; F4-H36 AromaticContact CD1-ND1 3.71Å; F4-H36 HydrophobicContact CD2-CB 4.38Å; F4-H36 HydrophobicContact CE1-CB 3.59Å; F4-H36 AromaticContact CE1-CG 3.84Å; F4-H36 HydrophobicContact CE2-CB 4.4Å; F4-H36 HydrophobicContact CG-CB 4Å; F4-H36 AromaticContact CG-CD2 3.67Å; F4-H36 AromaticContact CG-CG 3.81Å; F4-H36 HydrophobicContact CZ-CB 4.02Å; H33-H36 PolarHBondContact O-N 3.3Å; R34-H36 PolarHBondContact O-N 3.27Å; R34-H36 VanDerWaalsContact O-N 3.11Å; H36-G38 VanDerWaalsContact C-N 3.31Å; H36-G38 PolarHBondContact O-N 3.42Å; H36-P39 VanDerWaalsContact O-CD 3.28Å; H36-P39 WeakPolarHBondContact O-CD 3.38Å; H36-I40 HydrophobicContact CB-CD1 4.2Å; H36-I40 HydrophobicContact CB-CG1 4.39Å; H36-I40 WeakPolarHBondContact O-CB 3.29Å; H36-I40 WeakPolarHBondContact O-CD1 3.34Å; H36-I40 WeakPolarHBondContact O-CG1 3.49Å; H36-I40 PolarHBondContact O-N 3.45Å
37	A	96.2	Very high	96.3	Very high	5 Å²	5	46 Å²	46	4%	0.041	23%	0.226	C	C	.	.	H	α-helix	trans	-52.3	-44.7	-177.6	0	0	0	0	0	113.2	R34 I40 V41 E76 F77 E80	R34-A37 VanDerWaalsContact O-CB 3.28Å; R34-A37 WeakPolarHBondContact O-CB 3.38Å; R34-A37 PolarHBondContact O-N 3.48Å; A37-I40 PolarHBondContact O-N 2.95Å; A37-V41 WeakPolarHBondContact O-CG2 3.25Å; A37-V41 PolarHBondContact O-N 2.86Å; A37-E76 HydrophobicContact CB-CB 4.02Å; A37-F77 HydrophobicContact CB-CD1 3.91Å; A37-F77 HydrophobicContact CB-CE1 3.84Å; A37-F77 HydrophobicContact CB-CG 4.3Å; A37-F77 HydrophobicContact CB-CZ 4.19Å; A37-E80 HydrophobicContact CB-CG 3.89Å
38	G	96.9	Very high	96.2	Very high	27 Å²	27	46 Å²	46	28%	0.278	23%	0.226	S	C	.	.	H	α-helix	trans	-58.5	-58.5	177.6	0	0	0	0	0	113	H36 I40 V41 S42	H36-G38 VanDerWaalsContact C-N 3.31Å; H36-G38 PolarHBondContact O-N 3.42Å; G38-I40 VanDerWaalsContact C-N 3.3Å; G38-I40 PolarHBondContact O-N 3.07Å; G38-V41 PolarHBondContact O-N 3.41Å; G38-S42 PolarHBondContact O-N 3.04Å
39	P	97	Very high	96.2	Very high	54 Å²	54	45.2 Å²	45.2	35%	0.351	22%	0.215	S	C	.	.	H	α-helix	trans	-54.7	-41.2	173.4	-29.1	34.6	0	0	0	113.9	F4 H36 V41 S42 V43	F4-P39 HydrophobicContact CE1-CB 4.11Å; F4-P39 HydrophobicContact CZ-CB 4.22Å; H36-P39 VanDerWaalsContact O-CD 3.28Å; H36-P39 WeakPolarHBondContact O-CD 3.38Å; P39-V41 PolarHBondContact O-N 3.35Å; P39-S42 PolarHBondContact O-N 2.76Å; P39-V43 VanDerWaalsContact O-CG2 3.29Å; P39-V43 WeakPolarHBondContact O-CG2 3.4Å; P39-V43 PolarHBondContact O-N 3Å
40	I	98.1	Very high	96.1	Very high	1 Å²	1	50 Å²	50	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-58.5	-50	177.2	-73.8	166.2	0	0	0	111.2	F4 L9 L30 H33 H36 A37 G38 S42 V43 W44 F77	F4-I40 HydrophobicContact CD2-CD1 4.35Å; F4-I40 HydrophobicContact CD2-CG1 4.21Å; F4-I40 HydrophobicContact CE2-CD1 3.94Å; F4-I40 HydrophobicContact CE2-CG1 3.34Å; F4-I40 HydrophobicContact CZ-CG1 3.64Å; L9-I40 HydrophobicContact CD2-CB 4.2Å; L9-I40 HydrophobicContact CD2-CG1 4.1Å; L9-I40 HydrophobicContact CD2-CG2 4.17Å; L30-I40 HydrophobicContact CD1-CG2 4.24Å; L30-I40 HydrophobicContact CD2-CD1 4.09Å; L30-I40 HydrophobicContact CD2-CG1 4.18Å; L30-I40 HydrophobicContact CD2-CG2 3.71Å; L30-I40 HydrophobicContact CG-CG2 4.39Å; H33-I40 HydrophobicContact CB-CD1 4.24Å; H36-I40 HydrophobicContact CB-CD1 4.2Å; H36-I40 HydrophobicContact CB-CG1 4.39Å; H36-I40 WeakPolarHBondContact O-CB 3.29Å; H36-I40 WeakPolarHBondContact O-CD1 3.34Å; H36-I40 WeakPolarHBondContact O-CG1 3.49Å; H36-I40 PolarHBondContact O-N 3.45Å; A37-I40 PolarHBondContact O-N 2.95Å; G38-I40 VanDerWaalsContact C-N 3.3Å; G38-I40 PolarHBondContact O-N 3.07Å; I40-S42 VanDerWaalsContact C-N 3.34Å; I40-V43 PolarHBondContact O-N 2.98Å; I40-W44 VanDerWaalsContact O-CB 3.3Å; I40-W44 WeakPolarHBondContact O-CB 3.43Å; I40-W44 PolarHBondContact O-N 3.29Å; I40-F77 HydrophobicContact CB-CE1 4.19Å; I40-F77 HydrophobicContact CD1-CE1 4.19Å; I40-F77 HydrophobicContact CD1-CZ 3.84Å; I40-F77 HydrophobicContact CG2-CE1 3.77Å; I40-F77 HydrophobicContact CG2-CZ 4.37Å
41	V	98	Very high	96	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.024	24%	0.242	C	C	.	.	H	α-helix	trans	-66.8	-38.2	-177.8	172.9	0	0	0	0	111	A37 G38 P39 W44 H45 F77 E80 F81 V84	A37-V41 WeakPolarHBondContact O-CG2 3.25Å; A37-V41 PolarHBondContact O-N 2.86Å; G38-V41 PolarHBondContact O-N 3.41Å; P39-V41 PolarHBondContact O-N 3.35Å; V41-W44 PolarHBondContact O-N 2.86Å; V41-H45 VanDerWaalsContact O-CB 3.31Å; V41-H45 WeakPolarHBondContact O-CB 3.34Å; V41-H45 PolarHBondContact O-N 3.45Å; V41-F77 HydrophobicContact CG2-CD1 4.28Å; V41-E80 HydrophobicContact CB-CB 4.17Å; V41-E80 HydrophobicContact CG2-CB 3.73Å; V41-F81 HydrophobicContact CG1-CD1 4.16Å; V41-F81 HydrophobicContact CG1-CE1 4.45Å; V41-F81 HydrophobicContact CG2-CD1 4.11Å; V41-F81 HydrophobicContact CG2-CD2 3.84Å; V41-F81 HydrophobicContact CG2-CE1 4.09Å; V41-F81 HydrophobicContact CG2-CE2 3.81Å; V41-F81 HydrophobicContact CG2-CG 3.99Å; V41-F81 HydrophobicContact CG2-CZ 3.93Å; V41-V84 HydrophobicContact CG1-CB 4.41Å; V41-V84 HydrophobicContact CG1-CG1 4.08Å; V41-V84 HydrophobicContact CG1-CG2 3.41Å; V41-V84 VanDerWaalsContact CG1-CG2 3.41Å
42	S	97.3	Very high	95.7	Very high	64 Å²	64	57.6 Å²	57.6	45%	0.448	27%	0.272	S	S	.	.	H	α-helix	trans	-60.6	-48	174.3	-179.6	0	0	0	0	112.5	G38 P39 I40 H45 R46	G38-S42 PolarHBondContact O-N 3.04Å; P39-S42 PolarHBondContact O-N 2.76Å; I40-S42 VanDerWaalsContact C-N 3.34Å; S42-H45 PolarHBondContact O-N 2.97Å; S42-R46 WeakPolarHBondContact O-CB 3.24Å; S42-R46 PolarHBondContact O-N 3.4Å
43	V	97.6	Very high	95.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.7	-44.8	176.2	175.9	0	0	0	0	110.9	E6 L9 E10 L13 P39 I40 H45 R46 E47	E6-V43 HydrophobicContact CB-CG2 3.91Å; E6-V43 HydrophobicContact CG-CG2 3.64Å; E6-V43 WeakPolarHBondContact OE2-CG2 3.4Å; L9-V43 HydrophobicContact CB-CG1 4.35Å; L9-V43 HydrophobicContact CD2-CB 3.69Å; L9-V43 HydrophobicContact CD2-CG1 3.74Å; L9-V43 HydrophobicContact CD2-CG2 4.3Å; L9-V43 HydrophobicContact CG-CB 4.32Å; L9-V43 HydrophobicContact CG-CG1 3.8Å; E10-V43 HydrophobicContact CG-CG1 3.78Å; L13-V43 HydrophobicContact CD1-CG1 4.09Å; P39-V43 VanDerWaalsContact O-CG2 3.29Å; P39-V43 WeakPolarHBondContact O-CG2 3.4Å; P39-V43 PolarHBondContact O-N 3Å; I40-V43 PolarHBondContact O-N 2.98Å; V43-H45 VanDerWaalsContact C-N 3.3Å; V43-H45 PolarHBondContact O-N 2.61Å; V43-R46 PolarHBondContact O-N 3.29Å; V43-E47 HydrophobicContact CG1-CG 4.19Å; V43-E47 WeakPolarHBondContact O-CB 3.3Å; V43-E47 WeakPolarHBondContact O-CG 3.42Å; V43-E47 PolarHBondContact O-N 3Å
44	W	98.4	Very high	95.1	Very high	3 Å²	3	59.1 Å²	59.1	1%	0.011	29%	0.287	C	S	.	.	H	α-helix	trans	-56.1	-45.5	176.9	170.9	90.9	0	0	0	111.6	I40 V41 E47 L48 F59 L60 A63 F81 V84 L85 A88	I40-W44 VanDerWaalsContact O-CB 3.3Å; I40-W44 WeakPolarHBondContact O-CB 3.43Å; I40-W44 PolarHBondContact O-N 3.29Å; V41-W44 PolarHBondContact O-N 2.86Å; W44-E47 PolarHBondContact O-N 2.66Å; W44-L48 HydrophobicContact CH2-CD2 3.69Å; W44-L48 HydrophobicContact CZ2-CD2 4Å; W44-L48 HydrophobicContact CZ3-CD2 4.12Å; W44-L48 VanDerWaalsContact O-CB 3.27Å; W44-L48 WeakPolarHBondContact O-CB 3.45Å; W44-L48 PolarHBondContact O-N 3.25Å; W44-F59 AromaticContact CD1-CD1 3.8Å; W44-F59 HydrophobicContact CG-CD1 4.49Å; W44-F59 HydrophobicContact CZ2-CB 4.39Å; W44-F59 AromaticContact NE1-CD1 3.74Å; W44-F59 PolarHBondContact NE1-O 3.41Å; W44-L60 HydrophobicContact CH2-CD2 4.06Å; W44-L60 HydrophobicContact CZ2-CD2 4.01Å; W44-A63 HydrophobicContact CH2-CB 4.32Å; W44-A63 HydrophobicContact CZ2-CB 3.69Å; W44-F81 AromaticContact CD2-CE1 3.72Å; W44-F81 HydrophobicContact CD2-CE1 3.72Å; W44-F81 AromaticContact CE2-CE1 4Å; W44-F81 HydrophobicContact CE3-CD1 4.25Å; W44-F81 AromaticContact CE3-CE1 3.72Å; W44-F81 HydrophobicContact CE3-CE1 3.72Å; W44-F81 HydrophobicContact CG-CE1 4.23Å; W44-F81 HydrophobicContact CH2-CE1 4.31Å; W44-F81 HydrophobicContact CZ2-CE1 4.3Å; W44-F81 HydrophobicContact CZ3-CD1 4.2Å; W44-F81 HydrophobicContact CZ3-CE1 4.03Å; W44-V84 HydrophobicContact CE3-CG2 4.34Å; W44-V84 HydrophobicContact CZ3-CG2 3.9Å; W44-L85 HydrophobicContact CH2-CD2 4.5Å; W44-A88 HydrophobicContact CH2-CB 3.73Å; W44-A88 HydrophobicContact CZ3-CB 4.01Å
45	H	97.9	Very high	95	Very high	38 Å²	38	58.2 Å²	58.2	18%	0.176	28%	0.284	C	S	.	.	H	α-helix	trans	-67.7	-42.1	-179.2	-176.1	-140.8	0	0	0	111.9	V41 S42 V43 L48 R49 V84 D87	V41-H45 VanDerWaalsContact O-CB 3.31Å; V41-H45 WeakPolarHBondContact O-CB 3.34Å; V41-H45 PolarHBondContact O-N 3.45Å; S42-H45 PolarHBondContact O-N 2.97Å; V43-H45 VanDerWaalsContact C-N 3.3Å; V43-H45 PolarHBondContact O-N 2.61Å; H45-L48 PolarHBondContact O-N 2.95Å; H45-R49 PolarHBondContact O-N 3.25Å; H45-V84 HydrophobicContact CB-CB 4.49Å; H45-V84 HydrophobicContact CB-CG1 4.45Å; H45-D87 IonicContact CD2-OD2 3.31Å; H45-D87 IonicContact CE1-OD2 3.81Å; H45-D87 PolarHBondContact CE1-OD2 3.3Å; H45-D87 IonicContact NE2-OD2 3.68Å; H45-D87 PolarHBondContact NE2-OD2 3.39Å
46	R	97.4	Very high	95	Very high	83 Å²	83	49 Å²	49	31%	0.313	24%	0.244	S	C	.	.	H	α-helix	trans	-59.1	-47.3	173.8	179.9	172.9	70.5	-137.8	10.7	111.9	E6 E10 S42 V43 R49 K50	E6-R46 IonicContact OE2-CZ 3.81Å; E6-R46 IonicContact OE2-NH1 2.75Å; E6-R46 IonicContact OE2-NH2 3.77Å; E6-R46 PolarHBondContact OE2-NH2 2.95Å; E10-R46 IonicContact OE1-CZ 2.74Å; E10-R46 IonicContact OE1-NE 2.79Å; E10-R46 IonicContact OE1-NH2 3.32Å; E10-R46 PolarHBondContact OE1-NH2 2.89Å; S42-R46 WeakPolarHBondContact O-CB 3.24Å; S42-R46 PolarHBondContact O-N 3.4Å; V43-R46 PolarHBondContact O-N 3.29Å; R46-R49 PolarHBondContact O-N 3.37Å; R46-K50 WeakPolarHBondContact O-CG 3.42Å; R46-K50 PolarHBondContact O-N 2.75Å
47	E	97	Very high	94.8	Very high	33 Å²	33	46.6 Å²	46.6	15%	0.154	23%	0.233	C	C	.	.	H	α-helix	trans	-74.2	-33	-178.6	-67	-50.7	118.4	0	0	112.6	E10 L13 V43 W44 R49 K50 A51 F59	E10-E47 HydrophobicContact CG-CG 4.27Å; L13-E47 HydrophobicContact CD1-CB 3.97Å; L13-E47 HydrophobicContact CD1-CG 4.02Å; V43-E47 HydrophobicContact CG1-CG 4.19Å; V43-E47 WeakPolarHBondContact O-CB 3.3Å; V43-E47 WeakPolarHBondContact O-CG 3.42Å; V43-E47 PolarHBondContact O-N 3Å; W44-E47 PolarHBondContact O-N 2.66Å; E47-R49 VanDerWaalsContact C-N 3.3Å; E47-R49 PolarHBondContact O-N 3.14Å; E47-K50 PolarHBondContact O-N 3.18Å; E47-K50 IonicContact OE1-NZ 2.73Å; E47-K50 PolarHBondContact OE1-NZ 2.79Å; E47-A51 WeakPolarHBondContact O-CB 3.1Å; E47-A51 PolarHBondContact O-N 3.2Å; E47-F59 HydrophobicContact CB-CE1 3.78Å; E47-F59 HydrophobicContact CB-CZ 4.11Å
48	L	96.4	Very high	94.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-56.7	-44.9	171.3	168.6	66.3	0	0	0	111.5	W44 H45 K50 A51 K56 F59 A88 V92	W44-L48 HydrophobicContact CH2-CD2 3.69Å; W44-L48 HydrophobicContact CZ2-CD2 4Å; W44-L48 HydrophobicContact CZ3-CD2 4.12Å; W44-L48 VanDerWaalsContact O-CB 3.27Å; W44-L48 WeakPolarHBondContact O-CB 3.45Å; W44-L48 PolarHBondContact O-N 3.25Å; H45-L48 PolarHBondContact O-N 2.95Å; L48-K50 VanDerWaalsContact C-N 3.32Å; L48-K50 PolarHBondContact O-N 3.06Å; L48-A51 PolarHBondContact O-N 3.17Å; L48-K56 HydrophobicContact CD1-CB 3.96Å; L48-K56 HydrophobicContact CD1-CG 4.18Å; L48-K56 PolarHBondContact O-NZ 2.89Å; L48-F59 HydrophobicContact CB-CB 4.42Å; L48-F59 HydrophobicContact CB-CD1 3.84Å; L48-F59 HydrophobicContact CB-CE1 4.39Å; L48-F59 HydrophobicContact CB-CG 4.26Å; L48-F59 HydrophobicContact CD1-CB 3.61Å; L48-F59 HydrophobicContact CD1-CD1 4.47Å; L48-F59 HydrophobicContact CD1-CG 4.04Å; L48-A88 HydrophobicContact CD2-CB 3.6Å; L48-V92 HydrophobicContact CD1-CG2 3.8Å; L48-V92 HydrophobicContact CD2-CG2 4.31Å; L48-V92 HydrophobicContact CG-CG2 4.46Å
49	R	94.4	Very high	94.7	Very high	101 Å²	101	45.6 Å²	45.6	38%	0.381	22%	0.221	S	C	.	.	H	α-helix	trans	-64.3	-37.6	178.8	-77.6	176.8	158.8	-96.4	5.7	111.9	H45 R46 E47 K56 D87	H45-R49 PolarHBondContact O-N 3.25Å; R46-R49 PolarHBondContact O-N 3.37Å; E47-R49 VanDerWaalsContact C-N 3.3Å; E47-R49 PolarHBondContact O-N 3.14Å; R49-K56 PolarHBondContact O-NZ 3.35Å; R49-D87 IonicContact CZ-OD1 2.71Å; R49-D87 IonicContact CZ-OD2 2.76Å; R49-D87 VanDerWaalsContact CZ-OD2 3.3Å; R49-D87 IonicContact NE-OD2 3.85Å; R49-D87 PolarHBondContact NE-OD2 3.41Å; R49-D87 VanDerWaalsContact NE-OD2 3.08Å; R49-D87 IonicContact NH2-OD1 3.81Å; R49-D87 PolarHBondContact NH2-OD1 3.3Å; R49-D87 IonicContact NH2-OD2 3.77Å; R49-D87 PolarHBondContact NH2-OD2 2.81Å
50	K	94.1	Very high	94.6	Very high	135 Å²	135	43 Å²	43	59%	0.587	20%	0.204	S	C	*	.	H	α-helix	trans	-76.9	-24.2	177	-64.6	174.6	-170.5	168	0	114.2	R46 E47 L48	R46-K50 WeakPolarHBondContact O-CG 3.42Å; R46-K50 PolarHBondContact O-N 2.75Å; E47-K50 PolarHBondContact O-N 3.18Å; E47-K50 IonicContact OE1-NZ 2.73Å; E47-K50 PolarHBondContact OE1-NZ 2.79Å; L48-K50 VanDerWaalsContact C-N 3.32Å; L48-K50 PolarHBondContact O-N 3.06Å
51	A	92.7	Very high	94.4	Very high	15 Å²	15	46.5 Å²	46.5	12%	0.124	22%	0.218	C	C	.	.	S	Bend	trans	-62.3	147.1	-174.9	0	0	0	0	0	112.2	E47 L48 R55 K56 F59	E47-A51 WeakPolarHBondContact O-CB 3.1Å; E47-A51 PolarHBondContact O-N 3.2Å; L48-A51 PolarHBondContact O-N 3.17Å; A51-R55 HydrophobicContact CB-CB 4.3Å; A51-K56 HydrophobicContact CB-CG 4.4Å; A51-K56 VanDerWaalsContact O-CE 3.23Å; A51-K56 WeakPolarHBondContact O-CE 3.17Å; A51-K56 PolarHBondContact O-NZ 2.83Å; A51-F59 HydrophobicContact CB-CD2 4.28Å; A51-F59 HydrophobicContact CB-CE2 3.74Å; A51-F59 HydrophobicContact CB-CZ 4.18Å
52	K	90.7	Very high	94.4	Very high	163 Å²	163	46.3 Å²	46.3	71%	0.709	22%	0.216	S	C	*	.			trans	-60.4	149.7	171.5	-64.6	-175.7	179.6	-178.2	0	110.6	N54 R55 K56	K52-N54 VanDerWaalsContact C-N 3.3Å; K52-N54 WeakPolarHBondContact CB-OD1 3.4Å; K52-N54 PolarHBondContact O-N 3.43Å; K52-R55 PolarHBondContact O-N 3.39Å; K52-K56 PolarHBondContact O-N 2.97Å
53	S	87.4	Confident	94.4	Very high	35 Å²	35	43.2 Å²	43.2	25%	0.245	20%	0.195	C	C	.	.	H	α-helix	trans	-43.8	-51.5	-179	169.4	0	0	0	0	113.1	R55 K56 E95 A96	S53-R55 PolarHBondContact O-N 3.37Å; S53-K56 PolarHBondContact O-N 3.22Å; S53-K56 VanDerWaalsContact O-N 3.16Å; S53-E95 WeakPolarHBondContact CB-O 3.49Å; S53-E95 PolarHBondContact OG-O 3.29Å; S53-A96 WeakPolarHBondContact OG-CA 3.18Å
54	N	87.2	Confident	94.3	Very high	121 Å²	121	44.5 Å²	44.5	65%	0.647	20%	0.202	S	C	*	.	H	α-helix	trans	-65.2	-10.7	-179.6	69.6	-20.2	0	0	0	116	K52	K52-N54 VanDerWaalsContact C-N 3.3Å; K52-N54 WeakPolarHBondContact CB-OD1 3.4Å; K52-N54 PolarHBondContact O-N 3.43Å
55	R	91.4	Very high	94.1	Very high	70 Å²	70	45.3 Å²	45.3	26%	0.264	21%	0.206	S	C	.	.	H	α-helix	trans	-101.9	-18.1	177.4	-64.8	-170.2	67.7	-165.2	-5.1	113.2	L13 S14 L16 A51 K52 S53 L57 T58 F59	L13-R55 PolarHBondContact O-NH2 2.99Å; S14-R55 VanDerWaalsContact O-CZ 3.32Å; S14-R55 PolarHBondContact O-NH1 3.38Å; S14-R55 PolarHBondContact O-NH2 2.6Å; L16-R55 PolarHBondContact O-NH2 2.73Å; A51-R55 HydrophobicContact CB-CB 4.3Å; K52-R55 PolarHBondContact O-N 3.39Å; S53-R55 PolarHBondContact O-N 3.37Å; R55-L57 VanDerWaalsContact C-N 3.3Å; R55-L57 PolarHBondContact O-N 3.01Å; R55-T58 VanDerWaalsContact O-CB 3.3Å; R55-T58 WeakPolarHBondContact O-CB 3.32Å; R55-T58 PolarHBondContact O-N 3.13Å; R55-F59 WeakPolarHBondContact O-CD2 3.46Å; R55-F59 PolarHBondContact O-N 3.44Å
56	K	92.9	Very high	94.1	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.009	20%	0.198	C	C	.	.	H	α-helix	trans	-61.8	-37.8	-173.3	-66.8	-177.4	-167.1	-72.9	0	112.9	L48 R49 A51 K52 S53 T58 F59 L60 H91 V92 E95	L48-K56 HydrophobicContact CD1-CB 3.96Å; L48-K56 HydrophobicContact CD1-CG 4.18Å; L48-K56 PolarHBondContact O-NZ 2.89Å; R49-K56 PolarHBondContact O-NZ 3.35Å; A51-K56 HydrophobicContact CB-CG 4.4Å; A51-K56 VanDerWaalsContact O-CE 3.23Å; A51-K56 WeakPolarHBondContact O-CE 3.17Å; A51-K56 PolarHBondContact O-NZ 2.83Å; K52-K56 PolarHBondContact O-N 2.97Å; S53-K56 PolarHBondContact O-N 3.22Å; S53-K56 VanDerWaalsContact O-N 3.16Å; K56-T58 VanDerWaalsContact C-N 3.29Å; K56-T58 PolarHBondContact O-N 3.16Å; K56-F59 WeakPolarHBondContact O-CB 3.2Å; K56-F59 PolarHBondContact O-N 2.79Å; K56-L60 PolarHBondContact O-N 2.92Å; K56-H91 PolarHBondContact NZ-NE2 3.44Å; K56-V92 HydrophobicContact CB-CG1 4.09Å; K56-V92 HydrophobicContact CB-CG2 3.9Å; K56-V92 HydrophobicContact CD-CG2 4.48Å; K56-E95 HydrophobicContact CD-CB 4.05Å; K56-E95 WeakPolarHBondContact CE-OE2 3.41Å; K56-E95 IonicContact NZ-OE2 3.95Å; K56-E95 PolarHBondContact NZ-OE2 3.47Å
57	L	92	Very high	94	Very high	24 Å²	24	39.5 Å²	39.5	13%	0.126	18%	0.183	C	C	.	.	H	α-helix	trans	-62.3	-38	175.8	-176.4	59.7	0	0	0	112	R55 F59 L60 Y61 P103 L104	R55-L57 VanDerWaalsContact C-N 3.3Å; R55-L57 PolarHBondContact O-N 3.01Å; L57-F59 VanDerWaalsContact C-N 3.29Å; L57-F59 PolarHBondContact O-N 2.94Å; L57-L60 WeakPolarHBondContact O-CB 3.43Å; L57-L60 PolarHBondContact O-N 3.18Å; L57-Y61 HydrophobicContact CD1-CE1 4Å; L57-Y61 HydrophobicContact CD2-CE2 4.19Å; L57-Y61 WeakPolarHBondContact CD2-OH 3.38Å; L57-Y61 HydrophobicContact CG-CE1 4.14Å; L57-Y61 HydrophobicContact CG-CE2 3.9Å; L57-Y61 PolarHBondContact O-N 3.36Å; L57-P103 HydrophobicContact CD1-CB 3.8Å; L57-P103 HydrophobicContact CD2-CB 3.74Å; L57-P103 HydrophobicContact CD2-CG 3.94Å; L57-P103 HydrophobicContact CG-CB 4.4Å; L57-L104 HydrophobicContact CD1-CD2 4.21Å
58	T	94.1	Very high	93.7	Very high	6 Å²	6	39.4 Å²	39.4	4%	0.037	18%	0.182	C	C	.	.	H	α-helix	trans	-62.8	-34.9	176.8	-52.2	0	0	0	0	112.4	L16 S17 N18 V23 R55 K56 L60 Y61 L62	L16-T58 HydrophobicContact CD1-CG2 4.34Å; L16-T58 HydrophobicContact CD2-CG2 3.97Å; L16-T58 HydrophobicContact CG-CG2 3.76Å; S17-T58 WeakPolarHBondContact O-CG2 3.33Å; N18-T58 HydrophobicContact CB-CG2 4.47Å; N18-T58 PolarHBondContact OD1-OG1 3.06Å; V23-T58 HydrophobicContact CG2-CG2 4.26Å; R55-T58 VanDerWaalsContact O-CB 3.3Å; R55-T58 WeakPolarHBondContact O-CB 3.32Å; R55-T58 PolarHBondContact O-N 3.13Å; K56-T58 VanDerWaalsContact C-N 3.29Å; K56-T58 PolarHBondContact O-N 3.16Å; T58-L60 VanDerWaalsContact C-N 3.29Å; T58-L60 PolarHBondContact O-N 2.76Å; T58-Y61 PolarHBondContact O-N 3.06Å; T58-L62 PolarHBondContact O-N 2.73Å
59	F	96.8	Very high	93.5	Very high	5 Å²	5	41.8 Å²	41.8	2%	0.022	20%	0.195	C	C	.	.	H	α-helix	trans	-63.6	-35.9	173.5	-84.7	-109.6	0	0	0	112.1	L13 L16 W44 E47 L48 A51 R55 K56 L57 L62 A63	L13-F59 HydrophobicContact CB-CE1 4.28Å; L13-F59 HydrophobicContact CB-CZ 4.2Å; L13-F59 HydrophobicContact CD1-CE1 4.27Å; L13-F59 HydrophobicContact CD2-CD1 4.29Å; L13-F59 HydrophobicContact CD2-CE1 3.82Å; L13-F59 HydrophobicContact CD2-CZ 4.36Å; L13-F59 HydrophobicContact CG-CE1 4.35Å; L16-F59 HydrophobicContact CD2-CD2 4.34Å; W44-F59 AromaticContact CD1-CD1 3.8Å; W44-F59 HydrophobicContact CG-CD1 4.49Å; W44-F59 HydrophobicContact CZ2-CB 4.39Å; W44-F59 AromaticContact NE1-CD1 3.74Å; W44-F59 PolarHBondContact NE1-O 3.41Å; E47-F59 HydrophobicContact CB-CE1 3.78Å; E47-F59 HydrophobicContact CB-CZ 4.11Å; L48-F59 HydrophobicContact CB-CB 4.42Å; L48-F59 HydrophobicContact CB-CD1 3.84Å; L48-F59 HydrophobicContact CB-CE1 4.39Å; L48-F59 HydrophobicContact CB-CG 4.26Å; L48-F59 HydrophobicContact CD1-CB 3.61Å; L48-F59 HydrophobicContact CD1-CD1 4.47Å; L48-F59 HydrophobicContact CD1-CG 4.04Å; A51-F59 HydrophobicContact CB-CD2 4.28Å; A51-F59 HydrophobicContact CB-CE2 3.74Å; A51-F59 HydrophobicContact CB-CZ 4.18Å; R55-F59 WeakPolarHBondContact O-CD2 3.46Å; R55-F59 PolarHBondContact O-N 3.44Å; K56-F59 WeakPolarHBondContact O-CB 3.2Å; K56-F59 PolarHBondContact O-N 2.79Å; L57-F59 VanDerWaalsContact C-N 3.29Å; L57-F59 PolarHBondContact O-N 2.94Å; F59-L62 WeakPolarHBondContact O-CB 3.42Å; F59-L62 PolarHBondContact O-N 3.1Å; F59-A63 PolarHBondContact O-N 2.88Å
60	L	94.9	Very high	93.4	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-73.2	-32.8	175.3	-66.6	175.2	0	0	0	112.3	W44 K56 L57 T58 L62 A63 N64 F89 V92 L104 L107	W44-L60 HydrophobicContact CH2-CD2 4.06Å; W44-L60 HydrophobicContact CZ2-CD2 4.01Å; K56-L60 PolarHBondContact O-N 2.92Å; L57-L60 WeakPolarHBondContact O-CB 3.43Å; L57-L60 PolarHBondContact O-N 3.18Å; T58-L60 VanDerWaalsContact C-N 3.29Å; T58-L60 PolarHBondContact O-N 2.76Å; L60-L62 VanDerWaalsContact C-N 3.31Å; L60-A63 PolarHBondContact O-N 2.87Å; L60-N64 VanDerWaalsContact O-CB 3.31Å; L60-N64 WeakPolarHBondContact O-CB 3.37Å; L60-N64 PolarHBondContact O-N 3.34Å; L60-F89 HydrophobicContact CD2-CE2 4.39Å; L60-V92 HydrophobicContact CD1-CB 4.05Å; L60-V92 HydrophobicContact CD1-CG1 3.95Å; L60-V92 HydrophobicContact CD1-CG2 3.88Å; L60-V92 HydrophobicContact CG-CG2 4.35Å; L60-L104 HydrophobicContact CD1-CD2 3.16Å; L60-L107 HydrophobicContact CB-CD2 4.26Å
61	Y	94.9	Very high	93	Very high	73 Å²	73	34.5 Å²	34.5	29%	0.286	17%	0.166	S	C	.	.	H	α-helix	trans	-62.5	-39.2	169.3	-64.8	-25.5	0	0	0	112.2	N18 L57 T58 N64 D65 L107	N18-Y61 WeakPolarHBondContact OD1-CD2 3.35Å; N18-Y61 WeakPolarHBondContact OD1-CE2 3.37Å; L57-Y61 HydrophobicContact CD1-CE1 4Å; L57-Y61 HydrophobicContact CD2-CE2 4.19Å; L57-Y61 WeakPolarHBondContact CD2-OH 3.38Å; L57-Y61 HydrophobicContact CG-CE1 4.14Å; L57-Y61 HydrophobicContact CG-CE2 3.9Å; L57-Y61 PolarHBondContact O-N 3.36Å; T58-Y61 PolarHBondContact O-N 3.06Å; Y61-N64 PolarHBondContact O-N 3.32Å; Y61-D65 PolarHBondContact O-N 2.78Å; Y61-L107 HydrophobicContact CD1-CD1 3.95Å; Y61-L107 HydrophobicContact CE1-CD1 4.17Å
62	L	97.5	Very high	92.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-48.4	171.3	179	66.9	0	0	0	112.3	L13 L16 V23 L26 L30 T58 F59 L60 N64 D65 V66	L13-L62 HydrophobicContact CD2-CD2 3.63Å; L16-L62 HydrophobicContact CD2-CB 4.2Å; L16-L62 HydrophobicContact CD2-CD2 3.94Å; V23-L62 HydrophobicContact CG1-CB 4.33Å; V23-L62 HydrophobicContact CG1-CD1 4.41Å; L26-L62 HydrophobicContact CB-CD1 4.01Å; L26-L62 HydrophobicContact CD2-CD1 4.29Å; L26-L62 HydrophobicContact CD2-CD2 3.67Å; L26-L62 HydrophobicContact CG-CD1 3.97Å; L26-L62 HydrophobicContact CG-CD2 4.11Å; L30-L62 HydrophobicContact CD1-CD1 4.13Å; L30-L62 HydrophobicContact CD1-CD2 4.1Å; L30-L62 HydrophobicContact CD1-CG 4.25Å; T58-L62 PolarHBondContact O-N 2.73Å; F59-L62 WeakPolarHBondContact O-CB 3.42Å; F59-L62 PolarHBondContact O-N 3.1Å; L60-L62 VanDerWaalsContact C-N 3.31Å; L62-N64 VanDerWaalsContact C-N 3.3Å; L62-N64 PolarHBondContact O-N 3.23Å; L62-D65 PolarHBondContact O-N 3.32Å; L62-V66 HydrophobicContact CD1-CG2 4.11Å; L62-V66 HydrophobicContact CG-CG2 4.38Å; L62-V66 VanDerWaalsContact O-CG2 3.27Å; L62-V66 WeakPolarHBondContact O-CG2 3.23Å; L62-V66 PolarHBondContact O-N 2.96Å
63	A	96.9	Very high	92.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.5	-44.5	177.5	0	0	0	0	0	111.4	W44 F59 L60 D65 V66 I67 F81	W44-A63 HydrophobicContact CH2-CB 4.32Å; W44-A63 HydrophobicContact CZ2-CB 3.69Å; F59-A63 PolarHBondContact O-N 2.88Å; L60-A63 PolarHBondContact O-N 2.87Å; A63-D65 PolarHBondContact O-N 3.49Å; A63-V66 PolarHBondContact O-N 3.07Å; A63-I67 WeakPolarHBondContact O-CB 3.43Å; A63-I67 WeakPolarHBondContact O-CD1 3.36Å; A63-I67 WeakPolarHBondContact O-CG1 3.42Å; A63-I67 PolarHBondContact O-N 2.83Å; A63-F81 HydrophobicContact CB-CD1 4.12Å; A63-F81 HydrophobicContact CB-CE1 3.64Å; A63-F81 HydrophobicContact CB-CZ 4.01Å
64	N	95.1	Very high	92.1	Very high	27 Å²	27	40.2 Å²	40.2	14%	0.144	18%	0.183	C	C	.	.	H	α-helix	trans	-57.2	-50.1	175.8	174.3	73.3	0	0	0	112.5	L60 Y61 L62 Q68 L107 W111	L60-N64 VanDerWaalsContact O-CB 3.31Å; L60-N64 WeakPolarHBondContact O-CB 3.37Å; L60-N64 PolarHBondContact O-N 3.34Å; Y61-N64 PolarHBondContact O-N 3.32Å; L62-N64 VanDerWaalsContact C-N 3.3Å; L62-N64 PolarHBondContact O-N 3.23Å; N64-Q68 WeakPolarHBondContact O-CB 3.3Å; N64-Q68 VanDerWaalsContact O-CG 3.32Å; N64-Q68 WeakPolarHBondContact O-CG 3.3Å; N64-Q68 PolarHBondContact O-N 3.32Å; N64-Q68 PolarHBondContact OD1-NE2 3.39Å; N64-L107 HydrophobicContact CB-CD1 3.86Å; N64-L107 HydrophobicContact CB-CD2 4.13Å; N64-L107 HydrophobicContact CB-CG 4.17Å; N64-W111 PolarHBondContact OD1-NE1 3.01Å
65	D	95.5	Very high	92.4	Very high	19 Å²	19	39 Å²	39	10%	0.102	18%	0.182	C	C	.	.	H	α-helix	trans	-63.5	-43.8	-179	-163.2	-81.6	0	0	0	111.3	V23 S27 Y61 L62 A63 N69	V23-D65 HydrophobicContact CG1-CB 4.04Å; S27-D65 WeakPolarHBondContact CB-OD1 3.37Å; S27-D65 PolarHBondContact OG-OD1 3.47Å; Y61-D65 PolarHBondContact O-N 2.78Å; L62-D65 PolarHBondContact O-N 3.32Å; A63-D65 PolarHBondContact O-N 3.49Å; D65-N69 VanDerWaalsContact CG-ND2 3.31Å; D65-N69 VanDerWaalsContact O-CB 3.26Å; D65-N69 WeakPolarHBondContact O-CB 3.2Å; D65-N69 PolarHBondContact O-N 2.84Å; D65-N69 PolarHBondContact O-ND2 3.12Å; D65-N69 PolarHBondContact OD1-ND2 3.43Å; D65-N69 PolarHBondContact OD2-ND2 3.03Å
66	V	96.6	Very high	92.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.5	-52.4	177.9	174	0	0	0	0	111.2	S27 L30 I31 L62 A63 Q68 N69 S70 F77 F81	S27-V66 PolarHBondContact OG-N 3.09Å; L30-V66 HydrophobicContact CB-CG2 4.21Å; L30-V66 HydrophobicContact CD1-CG2 3.75Å; I31-V66 HydrophobicContact CG1-CG1 4.37Å; L62-V66 HydrophobicContact CD1-CG2 4.11Å; L62-V66 HydrophobicContact CG-CG2 4.38Å; L62-V66 VanDerWaalsContact O-CG2 3.27Å; L62-V66 WeakPolarHBondContact O-CG2 3.23Å; L62-V66 PolarHBondContact O-N 2.96Å; A63-V66 PolarHBondContact O-N 3.07Å; V66-Q68 VanDerWaalsContact C-N 3.35Å; V66-Q68 PolarHBondContact O-N 3.49Å; V66-N69 PolarHBondContact O-N 2.81Å; V66-S70 WeakPolarHBondContact O-CB 3.47Å; V66-S70 PolarHBondContact O-N 3.15Å; V66-S70 PolarHBondContact O-OG 3.31Å; V66-F77 HydrophobicContact CG1-CB 4.07Å; V66-F77 HydrophobicContact CG1-CD1 3.66Å; V66-F77 HydrophobicContact CG1-CD2 3.79Å; V66-F77 HydrophobicContact CG1-CE1 3.98Å; V66-F77 HydrophobicContact CG1-CE2 4.09Å; V66-F77 HydrophobicContact CG1-CG 3.56Å; V66-F77 HydrophobicContact CG1-CZ 4.18Å; V66-F81 HydrophobicContact CB-CE2 4.24Å; V66-F81 HydrophobicContact CG1-CE2 3.84Å
67	I	95	Very high	92.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.4	-46.1	-176.9	-68	162.6	0	0	0	110.4	A63 S70 K71 F81 L85 W111 V116 Y117	A63-I67 WeakPolarHBondContact O-CB 3.43Å; A63-I67 WeakPolarHBondContact O-CD1 3.36Å; A63-I67 WeakPolarHBondContact O-CG1 3.42Å; A63-I67 PolarHBondContact O-N 2.83Å; I67-S70 PolarHBondContact O-OG 3.08Å; I67-K71 WeakPolarHBondContact O-CG 3.4Å; I67-F81 HydrophobicContact CD1-CB 3.7Å; I67-F81 HydrophobicContact CD1-CD1 4.4Å; I67-F81 HydrophobicContact CD1-CD2 3.89Å; I67-F81 HydrophobicContact CD1-CG 3.76Å; I67-F81 HydrophobicContact CG1-CB 4.06Å; I67-F81 HydrophobicContact CG1-CD2 3.48Å; I67-F81 VanDerWaalsContact CG1-CD2 3.48Å; I67-F81 HydrophobicContact CG1-CE2 4.12Å; I67-F81 HydrophobicContact CG1-CG 3.9Å; I67-L85 HydrophobicContact CD1-CD1 4.13Å; I67-W111 HydrophobicContact CD1-CH2 3.97Å; I67-W111 HydrophobicContact CD1-CZ2 3.78Å; I67-V116 HydrophobicContact CG2-CG1 3.39Å; I67-Y117 HydrophobicContact CD1-CE2 4.44Å; I67-Y117 HydrophobicContact CG2-CE2 4.47Å
68	Q	90.7	Very high	92.7	Very high	30 Å²	30	38.4 Å²	38.4	14%	0.14	18%	0.183	C	C	.	.	H	α-helix	trans	-71.3	-40.4	-176.6	-68.4	-161.5	49.2	0	0	112.7	N64 V66 I110 V116	N64-Q68 WeakPolarHBondContact O-CB 3.3Å; N64-Q68 VanDerWaalsContact O-CG 3.32Å; N64-Q68 WeakPolarHBondContact O-CG 3.3Å; N64-Q68 PolarHBondContact O-N 3.32Å; N64-Q68 PolarHBondContact OD1-NE2 3.39Å; V66-Q68 VanDerWaalsContact C-N 3.35Å; V66-Q68 PolarHBondContact O-N 3.49Å; Q68-I110 VanDerWaalsContact NE2-CG2 3.33Å; Q68-V116 HydrophobicContact CG-CG2 4.17Å
69	N	92.8	Very high	92.8	Very high	51 Å²	51	45.7 Å²	45.7	27%	0.273	21%	0.21	S	C	.	.	H	α-helix	trans	-81	-23.7	-179.3	-72.2	-45.7	0	0	0	112.9	I31 D65 V66 K182	I31-N69 HydrophobicContact CD1-CB 3.56Å; D65-N69 VanDerWaalsContact CG-ND2 3.31Å; D65-N69 VanDerWaalsContact O-CB 3.26Å; D65-N69 WeakPolarHBondContact O-CB 3.2Å; D65-N69 PolarHBondContact O-N 2.84Å; D65-N69 PolarHBondContact O-ND2 3.12Å; D65-N69 PolarHBondContact OD1-ND2 3.43Å; D65-N69 PolarHBondContact OD2-ND2 3.03Å; V66-N69 PolarHBondContact O-N 2.81Å; N69-K182 PolarHBondContact OD1-NZ 3.23Å; N69-K182 VanDerWaalsContact OD1-NZ 3.14Å
70	S	92.6	Very high	92.8	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.014	22%	0.219	C	C	.	.	H	α-helix	trans	-74.8	-25.8	176.6	70.8	0	0	0	0	113.6	V66 I67 R72 K73 G74 F77	V66-S70 WeakPolarHBondContact O-CB 3.47Å; V66-S70 PolarHBondContact O-N 3.15Å; V66-S70 PolarHBondContact O-OG 3.31Å; I67-S70 PolarHBondContact O-OG 3.08Å; S70-R72 PolarHBondContact O-N 3.15Å; S70-K73 WeakPolarHBondContact O-CA 3.27Å; S70-K73 WeakPolarHBondContact O-CB 3.49Å; S70-K73 PolarHBondContact O-N 2.91Å; S70-G74 PolarHBondContact O-N 3.15Å; S70-G74 VanDerWaalsContact O-O 3.08Å; S70-F77 WeakPolarHBondContact OG-CB 3.25Å
71	K	85.9	Confident	92.9	Very high	80 Å²	80	47.7 Å²	47.7	35%	0.348	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-36.8	-176.3	-74.2	-163.2	-176.3	-178.8	0	113.7	I67 K73 R114 S115	I67-K71 WeakPolarHBondContact O-CG 3.4Å; K71-K73 VanDerWaalsContact C-N 3.26Å; K71-K73 PolarHBondContact O-N 3.1Å; K71-R114 PolarHBondContact NZ-O 3.17Å; K71-S115 PolarHBondContact NZ-O 3.26Å
72	R	81.1	Confident	92.9	Very high	185 Å²	185	48.1 Å²	48.1	70%	0.698	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-17.8	179.2	-61.7	-179.5	179.6	179.3	-4.3	113.6	S70	S70-R72 PolarHBondContact O-N 3.15Å
73	K	84.1	Confident	92.8	Very high	133 Å²	133	52.6 Å²	52.6	58%	0.578	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-26.1	-179	-61.4	-61.9	-174.7	-175.2	0	112.7	I31 S70 K71	I31-K73 HydrophobicContact CG2-CG 4.3Å; S70-K73 WeakPolarHBondContact O-CA 3.27Å; S70-K73 WeakPolarHBondContact O-CB 3.49Å; S70-K73 PolarHBondContact O-N 2.91Å; K71-K73 VanDerWaalsContact C-N 3.26Å; K71-K73 PolarHBondContact O-N 3.1Å
74	G	86.5	Confident	92.8	Very high	15 Å²	15	53.5 Å²	53.5	16%	0.155	26%	0.261	C	S	.	.			trans	158.3	169.9	175.1	0	0	0	0	0	113.1	S70 E76	S70-G74 PolarHBondContact O-N 3.15Å; S70-G74 VanDerWaalsContact O-O 3.08Å; G74-E76 VanDerWaalsContact C-N 3.34Å; G74-E76 WeakPolarHBondContact CA-OE2 3.37Å
75	P	92	Very high	92.9	Very high	96 Å²	96	52.2 Å²	52.2	62%	0.623	25%	0.254	S	S	*	.	S	Bend	trans	-86.4	2.4	-175.2	36	-36.7	0	0	0	114.1	F77 T78 R79	P75-F77 PolarHBondContact O-N 3.39Å; P75-T78 PolarHBondContact O-N 3.41Å; P75-R79 PolarHBondContact O-N 3.28Å
76	E	94	Very high	92.8	Very high	61 Å²	61	53.3 Å²	53.3	29%	0.285	26%	0.261	S	S	.	.	H	α-helix	trans	-55.6	-55.1	-170.8	-57.9	95.1	133.4	0	0	111.1	R34 A37 G74 T78 R79 E80	R34-E76 IonicContact NE-OE1 3.62Å; A37-E76 HydrophobicContact CB-CB 4.02Å; G74-E76 VanDerWaalsContact C-N 3.34Å; G74-E76 WeakPolarHBondContact CA-OE2 3.37Å; E76-T78 PolarHBondContact O-N 3.44Å; E76-R79 PolarHBondContact O-N 3.44Å; E76-E80 VanDerWaalsContact O-CG 3.28Å; E76-E80 WeakPolarHBondContact O-CG 3.38Å; E76-E80 PolarHBondContact O-N 2.94Å
77	F	96.6	Very high	92.7	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63	-41.3	178.6	-81.1	-64.3	0	0	0	112.9	L30 R34 A37 I40 V41 V66 S70 P75 R79 E80 F81	L30-F77 HydrophobicContact CB-CZ 4.21Å; L30-F77 WeakPolarHBondContact O-CZ 3.24Å; R34-F77 HydrophobicContact CB-CD2 4.19Å; R34-F77 HydrophobicContact CB-CE2 3.61Å; R34-F77 HydrophobicContact CB-CZ 4.44Å; A37-F77 HydrophobicContact CB-CD1 3.91Å; A37-F77 HydrophobicContact CB-CE1 3.84Å; A37-F77 HydrophobicContact CB-CG 4.3Å; A37-F77 HydrophobicContact CB-CZ 4.19Å; I40-F77 HydrophobicContact CB-CE1 4.19Å; I40-F77 HydrophobicContact CD1-CE1 4.19Å; I40-F77 HydrophobicContact CD1-CZ 3.84Å; I40-F77 HydrophobicContact CG2-CE1 3.77Å; I40-F77 HydrophobicContact CG2-CZ 4.37Å; V41-F77 HydrophobicContact CG2-CD1 4.28Å; V66-F77 HydrophobicContact CG1-CB 4.07Å; V66-F77 HydrophobicContact CG1-CD1 3.66Å; V66-F77 HydrophobicContact CG1-CD2 3.79Å; V66-F77 HydrophobicContact CG1-CE1 3.98Å; V66-F77 HydrophobicContact CG1-CE2 4.09Å; V66-F77 HydrophobicContact CG1-CG 3.56Å; V66-F77 HydrophobicContact CG1-CZ 4.18Å; S70-F77 WeakPolarHBondContact OG-CB 3.25Å; P75-F77 PolarHBondContact O-N 3.39Å; F77-R79 VanDerWaalsContact C-N 3.28Å; F77-R79 PolarHBondContact O-N 3.29Å; F77-E80 PolarHBondContact O-N 3.25Å; F77-F81 HydrophobicContact CB-CD2 4.17Å; F77-F81 HydrophobicContact CB-CE2 4.4Å; F77-F81 HydrophobicContact CD1-CD2 4.14Å; F77-F81 AromaticContact CD1-CE2 3.73Å; F77-F81 HydrophobicContact CD1-CE2 3.73Å; F77-F81 HydrophobicContact CE1-CE2 4.48Å; F77-F81 HydrophobicContact CG-CE2 4.43Å; F77-F81 WeakPolarHBondContact O-CB 3.43Å; F77-F81 VanDerWaalsContact O-CD2 3.27Å; F77-F81 WeakPolarHBondContact O-CD2 3.31Å; F77-F81 PolarHBondContact O-N 2.67Å
78	T	94	Very high	92.7	Very high	22 Å²	22	56.2 Å²	56.2	14%	0.135	28%	0.277	C	S	.	.	H	α-helix	trans	-55.6	-46.5	177.5	-53.1	0	0	0	0	110.7	P75 E76 E82 Y117	P75-T78 PolarHBondContact O-N 3.41Å; E76-T78 PolarHBondContact O-N 3.44Å; T78-E82 WeakPolarHBondContact O-CB 3.44Å; T78-E82 PolarHBondContact O-N 3.25Å; T78-E82 VanDerWaalsContact O-N 3.13Å; T78-Y117 HydrophobicContact CG2-CD1 4.25Å; T78-Y117 HydrophobicContact CG2-CE1 3.53Å; T78-Y117 PolarHBondContact O-OH 2.85Å
79	R	94.6	Very high	92.8	Very high	159 Å²	159	54.8 Å²	54.8	60%	0.6	27%	0.27	S	S	*	.	H	α-helix	trans	-69.3	-45.6	179.3	-172	-173.3	69.3	-162.4	-0.6	112.7	P75 E76 F77 E82	P75-R79 PolarHBondContact O-N 3.28Å; E76-R79 PolarHBondContact O-N 3.44Å; F77-R79 VanDerWaalsContact C-N 3.28Å; F77-R79 PolarHBondContact O-N 3.29Å; R79-E82 WeakPolarHBondContact O-CB 3.35Å; R79-E82 PolarHBondContact O-N 3.38Å
80	E	96.8	Very high	92.7	Very high	47 Å²	47	54 Å²	54	22%	0.22	27%	0.269	C	S	.	.	H	α-helix	trans	-65.8	-43.1	-178.2	-62.6	-54	138.3	0	0	111	A37 V41 E76 F77 E82 S83	A37-E80 HydrophobicContact CB-CG 3.89Å; V41-E80 HydrophobicContact CB-CB 4.17Å; V41-E80 HydrophobicContact CG2-CB 3.73Å; E76-E80 VanDerWaalsContact O-CG 3.28Å; E76-E80 WeakPolarHBondContact O-CG 3.38Å; E76-E80 PolarHBondContact O-N 2.94Å; F77-E80 PolarHBondContact O-N 3.25Å; E80-E82 PolarHBondContact O-N 3.23Å; E80-S83 PolarHBondContact O-N 3.47Å; E80-S83 PolarHBondContact O-OG 3.21Å
81	F	97.6	Very high	92.7	Very high	1 Å²	1	54.3 Å²	54.3	0%	0.004	27%	0.27	C	S	.	.	H	α-helix	trans	-64.7	-39	176.4	-85.1	-71.1	0	0	0	112.4	V41 W44 A63 V66 I67 F77 S83 V84 L85	V41-F81 HydrophobicContact CG1-CD1 4.16Å; V41-F81 HydrophobicContact CG1-CE1 4.45Å; V41-F81 HydrophobicContact CG2-CD1 4.11Å; V41-F81 HydrophobicContact CG2-CD2 3.84Å; V41-F81 HydrophobicContact CG2-CE1 4.09Å; V41-F81 HydrophobicContact CG2-CE2 3.81Å; V41-F81 HydrophobicContact CG2-CG 3.99Å; V41-F81 HydrophobicContact CG2-CZ 3.93Å; W44-F81 AromaticContact CD2-CE1 3.72Å; W44-F81 HydrophobicContact CD2-CE1 3.72Å; W44-F81 AromaticContact CE2-CE1 4Å; W44-F81 HydrophobicContact CE3-CD1 4.25Å; W44-F81 AromaticContact CE3-CE1 3.72Å; W44-F81 HydrophobicContact CE3-CE1 3.72Å; W44-F81 HydrophobicContact CG-CE1 4.23Å; W44-F81 HydrophobicContact CH2-CE1 4.31Å; W44-F81 HydrophobicContact CZ2-CE1 4.3Å; W44-F81 HydrophobicContact CZ3-CD1 4.2Å; W44-F81 HydrophobicContact CZ3-CE1 4.03Å; A63-F81 HydrophobicContact CB-CD1 4.12Å; A63-F81 HydrophobicContact CB-CE1 3.64Å; A63-F81 HydrophobicContact CB-CZ 4.01Å; V66-F81 HydrophobicContact CB-CE2 4.24Å; V66-F81 HydrophobicContact CG1-CE2 3.84Å; I67-F81 HydrophobicContact CD1-CB 3.7Å; I67-F81 HydrophobicContact CD1-CD1 4.4Å; I67-F81 HydrophobicContact CD1-CD2 3.89Å; I67-F81 HydrophobicContact CD1-CG 3.76Å; I67-F81 HydrophobicContact CG1-CB 4.06Å; I67-F81 HydrophobicContact CG1-CD2 3.48Å; I67-F81 VanDerWaalsContact CG1-CD2 3.48Å; I67-F81 HydrophobicContact CG1-CE2 4.12Å; I67-F81 HydrophobicContact CG1-CG 3.9Å; F77-F81 HydrophobicContact CB-CD2 4.17Å; F77-F81 HydrophobicContact CB-CE2 4.4Å; F77-F81 HydrophobicContact CD1-CD2 4.14Å; F77-F81 AromaticContact CD1-CE2 3.73Å; F77-F81 HydrophobicContact CD1-CE2 3.73Å; F77-F81 HydrophobicContact CE1-CE2 4.48Å; F77-F81 HydrophobicContact CG-CE2 4.43Å; F77-F81 WeakPolarHBondContact O-CB 3.43Å; F77-F81 VanDerWaalsContact O-CD2 3.27Å; F77-F81 WeakPolarHBondContact O-CD2 3.31Å; F77-F81 PolarHBondContact O-N 2.67Å; F81-S83 PolarHBondContact O-N 2.91Å; F81-V84 HydrophobicContact CD1-CG2 4.33Å; F81-V84 WeakPolarHBondContact O-CG2 3.34Å; F81-V84 PolarHBondContact O-N 3.27Å; F81-L85 HydrophobicContact CB-CD1 3.95Å; F81-L85 HydrophobicContact CB-CG 4.14Å; F81-L85 WeakPolarHBondContact O-CG 3.22Å; F81-L85 PolarHBondContact O-N 3.21Å
82	E	95.4	Very high	93	Very high	82 Å²	82	50.5 Å²	50.5	38%	0.383	25%	0.253	S	S	.	.	H	α-helix	trans	-50	-38	178.7	-163.8	172	-179.9	0	0	112.2	T78 R79 E80 V84 Y117 F121	T78-E82 WeakPolarHBondContact O-CB 3.44Å; T78-E82 PolarHBondContact O-N 3.25Å; T78-E82 VanDerWaalsContact O-N 3.13Å; R79-E82 WeakPolarHBondContact O-CB 3.35Å; R79-E82 PolarHBondContact O-N 3.38Å; E80-E82 PolarHBondContact O-N 3.23Å; E82-V84 VanDerWaalsContact C-N 3.31Å; E82-V84 PolarHBondContact O-N 3.36Å; E82-Y117 HydrophobicContact CB-CE1 3.78Å; E82-Y117 HydrophobicContact CG-CD1 4.24Å; E82-Y117 HydrophobicContact CG-CE1 3.82Å; E82-Y117 PolarHBondContact N-OH 2.9Å; E82-F121 HydrophobicContact CB-CZ 4.34Å; E82-F121 HydrophobicContact CG-CD1 4.44Å; E82-F121 HydrophobicContact CG-CD2 4.27Å; E82-F121 HydrophobicContact CG-CE1 3.94Å; E82-F121 HydrophobicContact CG-CE2 3.78Å; E82-F121 HydrophobicContact CG-CZ 3.59Å; E82-F121 WeakPolarHBondContact O-CZ 3.35Å
83	S	95.5	Very high	93.3	Very high	95 Å²	95	42.5 Å²	42.5	66%	0.664	23%	0.227	S	C	*	.	H	α-helix	trans	-68.1	-21.1	180	75.2	0	0	0	0	115.6	E80 F81	E80-S83 PolarHBondContact O-N 3.47Å; E80-S83 PolarHBondContact O-OG 3.21Å; F81-S83 PolarHBondContact O-N 2.91Å
84	V	96.7	Very high	93.5	Very high	19 Å²	19	42.3 Å²	42.3	12%	0.115	22%	0.223	C	C	.	.	H	α-helix	trans	-116.9	-15.4	-176.1	-61.1	0	0	0	0	113.7	V41 W44 H45 F81 E82 V86 D87 A88	V41-V84 HydrophobicContact CG1-CB 4.41Å; V41-V84 HydrophobicContact CG1-CG1 4.08Å; V41-V84 HydrophobicContact CG1-CG2 3.41Å; V41-V84 VanDerWaalsContact CG1-CG2 3.41Å; W44-V84 HydrophobicContact CE3-CG2 4.34Å; W44-V84 HydrophobicContact CZ3-CG2 3.9Å; H45-V84 HydrophobicContact CB-CB 4.49Å; H45-V84 HydrophobicContact CB-CG1 4.45Å; F81-V84 HydrophobicContact CD1-CG2 4.33Å; F81-V84 WeakPolarHBondContact O-CG2 3.34Å; F81-V84 PolarHBondContact O-N 3.27Å; E82-V84 VanDerWaalsContact C-N 3.31Å; E82-V84 PolarHBondContact O-N 3.36Å; V84-V86 PolarHBondContact O-N 3.34Å; V84-D87 PolarHBondContact O-N 2.85Å; V84-A88 WeakPolarHBondContact O-CB 2.88Å; V84-A88 PolarHBondContact O-N 3.3Å
85	L	96.2	Very high	93.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.8	-38.1	-170.9	-80.7	169.8	0	0	0	113.2	W44 I67 F81 D87 A88 F89 W111 Y117 F121 L125	W44-L85 HydrophobicContact CH2-CD2 4.5Å; I67-L85 HydrophobicContact CD1-CD1 4.13Å; F81-L85 HydrophobicContact CB-CD1 3.95Å; F81-L85 HydrophobicContact CB-CG 4.14Å; F81-L85 WeakPolarHBondContact O-CG 3.22Å; F81-L85 PolarHBondContact O-N 3.21Å; L85-D87 VanDerWaalsContact C-N 3.32Å; L85-D87 PolarHBondContact O-N 3.35Å; L85-A88 PolarHBondContact O-N 3.39Å; L85-F89 HydrophobicContact CB-CD2 4.42Å; L85-F89 HydrophobicContact CD2-CD2 4.22Å; L85-F89 HydrophobicContact CD2-CE2 3.97Å; L85-F89 WeakPolarHBondContact O-CB 3.4Å; L85-F89 WeakPolarHBondContact O-CD2 3.46Å; L85-F89 PolarHBondContact O-N 3.06Å; L85-W111 HydrophobicContact CD1-CH2 3.54Å; L85-W111 HydrophobicContact CD1-CZ3 3.63Å; L85-W111 HydrophobicContact CD2-CH2 3.74Å; L85-W111 HydrophobicContact CD2-CZ3 4.34Å; L85-W111 HydrophobicContact CG-CH2 4.25Å; L85-Y117 HydrophobicContact CD1-CE2 3.68Å; L85-F121 HydrophobicContact CB-CZ 4.18Å; L85-F121 HydrophobicContact CD1-CE1 4.26Å; L85-L125 HydrophobicContact CB-CD2 3.99Å
86	V	94.2	Very high	92.3	Very high	42 Å²	42	41.3 Å²	41.3	26%	0.255	21%	0.208	S	C	.	.	H	α-helix	trans	-57.9	-47.8	178.3	178.9	0	0	0	0	111	V84 S90 F121 Q124 L125 S128	V84-V86 PolarHBondContact O-N 3.34Å; V86-S90 PolarHBondContact O-N 3.25Å; V86-S90 VanDerWaalsContact O-N 3.15Å; V86-F121 HydrophobicContact CG2-CE2 3.83Å; V86-F121 HydrophobicContact CG2-CZ 4.26Å; V86-Q124 HydrophobicContact CG2-CG 4.26Å; V86-L125 HydrophobicContact CB-CD2 4.34Å; V86-L125 HydrophobicContact CG2-CD2 3.87Å; V86-S128 PolarHBondContact O-OG 3.07Å
87	D	94.1	Very high	90.9	Very high	60 Å²	60	43.9 Å²	43.9	32%	0.321	22%	0.224	S	C	.	.	H	α-helix	trans	-67.5	-42.5	176.9	-179.2	75.9	0	0	0	111.9	H45 R49 V84 L85 S90 H91	H45-D87 IonicContact CD2-OD2 3.31Å; H45-D87 IonicContact CE1-OD2 3.81Å; H45-D87 PolarHBondContact CE1-OD2 3.3Å; H45-D87 IonicContact NE2-OD2 3.68Å; H45-D87 PolarHBondContact NE2-OD2 3.39Å; R49-D87 IonicContact CZ-OD1 2.71Å; R49-D87 IonicContact CZ-OD2 2.76Å; R49-D87 VanDerWaalsContact CZ-OD2 3.3Å; R49-D87 IonicContact NE-OD2 3.85Å; R49-D87 PolarHBondContact NE-OD2 3.41Å; R49-D87 VanDerWaalsContact NE-OD2 3.08Å; R49-D87 IonicContact NH2-OD1 3.81Å; R49-D87 PolarHBondContact NH2-OD1 3.3Å; R49-D87 IonicContact NH2-OD2 3.77Å; R49-D87 PolarHBondContact NH2-OD2 2.81Å; V84-D87 PolarHBondContact O-N 2.85Å; L85-D87 VanDerWaalsContact C-N 3.32Å; L85-D87 PolarHBondContact O-N 3.35Å; D87-S90 PolarHBondContact O-N 2.98Å; D87-H91 VanDerWaalsContact O-CB 3.23Å; D87-H91 WeakPolarHBondContact O-CB 3.01Å; D87-H91 PolarHBondContact O-N 3.1Å
88	A	94.8	Very high	89.4	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.4	-48	178.1	0	0	0	0	0	112.1	W44 L48 V84 L85 H91 V92	W44-A88 HydrophobicContact CH2-CB 3.73Å; W44-A88 HydrophobicContact CZ3-CB 4.01Å; L48-A88 HydrophobicContact CD2-CB 3.6Å; V84-A88 WeakPolarHBondContact O-CB 2.88Å; V84-A88 PolarHBondContact O-N 3.3Å; L85-A88 PolarHBondContact O-N 3.39Å; A88-H91 PolarHBondContact O-N 2.74Å; A88-V92 VanDerWaalsContact O-CG2 3.3Å; A88-V92 WeakPolarHBondContact O-CG2 3.46Å; A88-V92 PolarHBondContact O-N 3.04Å
89	F	93.5	Very high	88.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.5	-43.4	178.3	-90.8	-92.1	0	0	0	112.1	L60 L85 H91 V92 A93 L104 L107 L108 W111 L125 M129	L60-F89 HydrophobicContact CD2-CE2 4.39Å; L85-F89 HydrophobicContact CB-CD2 4.42Å; L85-F89 HydrophobicContact CD2-CD2 4.22Å; L85-F89 HydrophobicContact CD2-CE2 3.97Å; L85-F89 WeakPolarHBondContact O-CB 3.4Å; L85-F89 WeakPolarHBondContact O-CD2 3.46Å; L85-F89 PolarHBondContact O-N 3.06Å; F89-H91 PolarHBondContact O-N 2.98Å; F89-V92 PolarHBondContact O-N 3.32Å; F89-A93 VanDerWaalsContact O-CB 3.24Å; F89-A93 WeakPolarHBondContact O-CB 3.17Å; F89-A93 PolarHBondContact O-N 2.71Å; F89-L104 HydrophobicContact CD1-CB 4.49Å; F89-L104 HydrophobicContact CD1-CD2 4.01Å; F89-L104 HydrophobicContact CE1-CB 4.22Å; F89-L104 HydrophobicContact CE1-CD2 3.83Å; F89-L107 HydrophobicContact CZ-CD2 3.97Å; F89-L108 HydrophobicContact CE1-CD1 4.21Å; F89-L108 HydrophobicContact CE1-CD2 3.75Å; F89-L108 HydrophobicContact CE1-CG 3.87Å; F89-L108 HydrophobicContact CE2-CD2 4.19Å; F89-L108 HydrophobicContact CZ-CD2 3.55Å; F89-L108 HydrophobicContact CZ-CG 4.13Å; F89-W111 AromaticContact CE2-CH2 3.9Å; F89-W111 HydrophobicContact CE2-CH2 3.9Å; F89-W111 AromaticContact CE2-CZ3 3.84Å; F89-W111 HydrophobicContact CE2-CZ3 3.84Å; F89-W111 HydrophobicContact CZ-CH2 4.3Å; F89-W111 HydrophobicContact CZ-CZ3 4.2Å; F89-L125 HydrophobicContact CB-CD2 4.47Å; F89-L125 HydrophobicContact CD2-CD1 4.41Å; F89-L125 HydrophobicContact CD2-CD2 3.95Å; F89-L125 HydrophobicContact CE2-CD1 4.22Å; F89-L125 HydrophobicContact CG-CD2 4.39Å; F89-M129 HydrophobicContact CB-CG 4.25Å; F89-M129 HydrophobicContact CD1-CG 4.18Å; F89-M129 HydrophobicContact CD1-SD 3.65Å; F89-M129 HydrophobicContact CE1-SD 4.24Å
90	S	91.5	Very high	87.5	Confident	36 Å²	36	46.1 Å²	46.1	25%	0.252	26%	0.257	S	S	.	.	H	α-helix	trans	-61.1	-44.7	174.5	178.4	0	0	0	0	111.7	V86 D87 V92 A93 R94 S128 S132	V86-S90 PolarHBondContact O-N 3.25Å; V86-S90 VanDerWaalsContact O-N 3.15Å; D87-S90 PolarHBondContact O-N 2.98Å; S90-V92 PolarHBondContact O-N 2.76Å; S90-A93 PolarHBondContact O-N 2.93Å; S90-R94 WeakPolarHBondContact O-CB 3.26Å; S90-R94 PolarHBondContact O-N 3.31Å; S90-S128 WeakPolarHBondContact CB-O 3.37Å; S90-S132 PolarHBondContact OG-OG 3.03Å
91	H	91.8	Very high	86.8	Confident	7 Å²	7	47.1 Å²	47.1	3%	0.032	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-46	178.4	-173.3	86.7	0	0	0	112.2	K56 D87 A88 F89 R94 E95	K56-H91 PolarHBondContact NZ-NE2 3.44Å; D87-H91 VanDerWaalsContact O-CB 3.23Å; D87-H91 WeakPolarHBondContact O-CB 3.01Å; D87-H91 PolarHBondContact O-N 3.1Å; A88-H91 PolarHBondContact O-N 2.74Å; F89-H91 PolarHBondContact O-N 2.98Å; H91-R94 PolarHBondContact O-N 2.84Å; H91-E95 IonicContact CD2-OE2 2.74Å; H91-E95 IonicContact CE1-OE1 3.54Å; H91-E95 PolarHBondContact CE1-OE1 3.28Å; H91-E95 IonicContact CE1-OE2 3.9Å; H91-E95 PolarHBondContact CE1-OE2 3.2Å; H91-E95 IonicContact ND1-OE1 2.73Å; H91-E95 IonicContact NE2-OE1 2.72Å; H91-E95 PolarHBondContact NE2-OE1 3.19Å; H91-E95 IonicContact NE2-OE2 3.08Å; H91-E95 PolarHBondContact NE2-OE2 3.35Å; H91-E95 PolarHBondContact O-N 2.84Å
92	V	91.9	Very high	86.2	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-68.3	-40.6	177.6	179.8	0	0	0	0	111.4	L48 K56 L60 A88 F89 S90 R94 E95 A96 L104	L48-V92 HydrophobicContact CD1-CG2 3.8Å; L48-V92 HydrophobicContact CD2-CG2 4.31Å; L48-V92 HydrophobicContact CG-CG2 4.46Å; K56-V92 HydrophobicContact CB-CG1 4.09Å; K56-V92 HydrophobicContact CB-CG2 3.9Å; K56-V92 HydrophobicContact CD-CG2 4.48Å; L60-V92 HydrophobicContact CD1-CB 4.05Å; L60-V92 HydrophobicContact CD1-CG1 3.95Å; L60-V92 HydrophobicContact CD1-CG2 3.88Å; L60-V92 HydrophobicContact CG-CG2 4.35Å; A88-V92 VanDerWaalsContact O-CG2 3.3Å; A88-V92 WeakPolarHBondContact O-CG2 3.46Å; A88-V92 PolarHBondContact O-N 3.04Å; F89-V92 PolarHBondContact O-N 3.32Å; S90-V92 PolarHBondContact O-N 2.76Å; V92-R94 PolarHBondContact O-N 3.34Å; V92-E95 PolarHBondContact O-N 2.9Å; V92-A96 HydrophobicContact CG1-CB 3.92Å; V92-A96 WeakPolarHBondContact O-CB 3.27Å; V92-A96 PolarHBondContact O-N 3.4Å; V92-L104 HydrophobicContact CG1-CD1 4.3Å; V92-L104 HydrophobicContact CG1-CD2 4.33Å
93	A	88.3	Confident	85.9	Confident	18 Å²	18	52.9 Å²	52.9	15%	0.149	29%	0.288	C	S	.	.	H	α-helix	trans	-61.8	-31.9	176.7	0	0	0	0	0	112.9	F89 S90 L104 M129	F89-A93 VanDerWaalsContact O-CB 3.24Å; F89-A93 WeakPolarHBondContact O-CB 3.17Å; F89-A93 PolarHBondContact O-N 2.71Å; S90-A93 PolarHBondContact O-N 2.93Å; A93-L104 HydrophobicContact CB-CD1 4.5Å; A93-M129 HydrophobicContact CB-CB 3.96Å; A93-M129 HydrophobicContact CB-CG 4.05Å
94	R	86.5	Confident	85.6	Confident	129 Å²	129	48.4 Å²	48.4	49%	0.487	26%	0.256	S	S	.	.	H	α-helix	trans	-80.9	-39.4	178.1	-173.2	178.1	66	-168.9	-3.1	113.9	S90 H91 V92	S90-R94 WeakPolarHBondContact O-CB 3.26Å; S90-R94 PolarHBondContact O-N 3.31Å; H91-R94 PolarHBondContact O-N 2.84Å; V92-R94 PolarHBondContact O-N 3.34Å
95	E	81.9	Confident	85.3	Confident	77 Å²	77	52.1 Å²	52.1	36%	0.36	27%	0.272	S	S	.	.	H	α-helix	trans	-99.3	-16.8	-171.9	-68.8	-168.5	-178.9	0	0	114.6	S53 K56 H91 V92	S53-E95 WeakPolarHBondContact CB-O 3.49Å; S53-E95 PolarHBondContact OG-O 3.29Å; K56-E95 HydrophobicContact CD-CB 4.05Å; K56-E95 WeakPolarHBondContact CE-OE2 3.41Å; K56-E95 IonicContact NZ-OE2 3.95Å; K56-E95 PolarHBondContact NZ-OE2 3.47Å; H91-E95 IonicContact CD2-OE2 2.74Å; H91-E95 IonicContact CE1-OE1 3.54Å; H91-E95 PolarHBondContact CE1-OE1 3.28Å; H91-E95 IonicContact CE1-OE2 3.9Å; H91-E95 PolarHBondContact CE1-OE2 3.2Å; H91-E95 IonicContact ND1-OE1 2.73Å; H91-E95 IonicContact NE2-OE1 2.72Å; H91-E95 PolarHBondContact NE2-OE1 3.19Å; H91-E95 IonicContact NE2-OE2 3.08Å; H91-E95 PolarHBondContact NE2-OE2 3.35Å; H91-E95 PolarHBondContact O-N 2.84Å; V92-E95 PolarHBondContact O-N 2.9Å
96	A	71.9	Confident	85.1	Confident	13 Å²	13	60.7 Å²	60.7	11%	0.107	31%	0.305	C	S	.	.	S	Bend	trans	-87.7	154.1	178.9	0	0	0	0	0	111.6	S53 V92 C100	S53-A96 WeakPolarHBondContact OG-CA 3.18Å; V92-A96 HydrophobicContact CG1-CB 3.92Å; V92-A96 WeakPolarHBondContact O-CB 3.27Å; V92-A96 PolarHBondContact O-N 3.4Å; A96-C100 HydrophobicContact CB-CB 3.64Å; A96-C100 WeakPolarHBondContact CB-SG 3.45Å
97	D	66.1	Low	85	Confident	114 Å²	114	59.1 Å²	59.1	61%	0.61	30%	0.295	S	S	*	.			trans	-59.3	155.4	-179.1	-58.9	-39.1	0	0	0	111.1	G99 C100	D97-G99 PolarHBondContact O-N 2.89Å; D97-C100 WeakPolarHBondContact O-CB 3.38Å; D97-C100 PolarHBondContact O-N 3.47Å
98	E	65.1	Low	84.9	Confident	150 Å²	150	56.2 Å²	56.2	70%	0.701	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-50.2	-22.2	178.8	-80.5	-73.3	155.9	0	0	113.5	C100 K101	E98-C100 VanDerWaalsContact C-N 3.27Å; E98-C100 PolarHBondContact O-N 3.2Å; E98-K101 VanDerWaalsContact CD-NZ 3.35Å; E98-K101 IonicContact OE1-NZ 3.16Å; E98-K101 PolarHBondContact OE1-NZ 3.43Å; E98-K101 IonicContact OE2-NZ 2.93Å; E98-K101 PolarHBondContact OE2-NZ 3.4Å
99	G	69.8	Low	84.7	Confident	58 Å²	58	59.3 Å²	59.3	60%	0.598	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-69.8	-10.1	173.7	0	0	0	0	0	116.1	D97 P103	D97-G99 PolarHBondContact O-N 2.89Å; G99-P103 WeakPolarHBondContact O-CD 3.47Å
100	C	77.1	Confident	84.5	Confident	21 Å²	21	61.1 Å²	61.1	14%	0.142	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-84.4	-18.9	-175.6	-70.1	0	0	0	0	114.4	A96 D97 E98 K102 P103 L104	A96-C100 HydrophobicContact CB-CB 3.64Å; A96-C100 WeakPolarHBondContact CB-SG 3.45Å; D97-C100 WeakPolarHBondContact O-CB 3.38Å; D97-C100 PolarHBondContact O-N 3.47Å; E98-C100 VanDerWaalsContact C-N 3.27Å; E98-C100 PolarHBondContact O-N 3.2Å; C100-K102 PolarHBondContact O-N 3.21Å; C100-P103 VanDerWaalsContact O-CD 3.26Å; C100-P103 WeakPolarHBondContact O-CD 3.46Å; C100-L104 WeakPolarHBondContact O-CG 3.25Å; C100-L104 PolarHBondContact O-N 2.85Å; C100-L104 VanDerWaalsContact O-N 3.12Å
101	K	82.4	Confident	84.5	Confident	68 Å²	68	59.4 Å²	59.4	30%	0.296	29%	0.293	S	S	.	.	H	α-helix	trans	-59.1	-47.7	-179.5	-69.2	174.1	-175.2	153.4	0	112.6	E98 L104 E105	E98-K101 VanDerWaalsContact CD-NZ 3.35Å; E98-K101 IonicContact OE1-NZ 3.16Å; E98-K101 PolarHBondContact OE1-NZ 3.43Å; E98-K101 IonicContact OE2-NZ 2.93Å; E98-K101 PolarHBondContact OE2-NZ 3.4Å; K101-L104 WeakPolarHBondContact O-CB 3.4Å; K101-L104 PolarHBondContact O-N 2.75Å; K101-L104 VanDerWaalsContact O-N 3.13Å; K101-E105 WeakPolarHBondContact O-CG 3.4Å; K101-E105 PolarHBondContact O-N 3.41Å
102	K	85.8	Confident	84.5	Confident	171 Å²	171	63.8 Å²	63.8	74%	0.743	31%	0.314	S	S	*	.	H	α-helix	trans	-59.1	-48.6	178.9	-72	-178.4	-179.7	-177.9	0	113	C100 L104 E105 R106	C100-K102 PolarHBondContact O-N 3.21Å; K102-L104 VanDerWaalsContact C-N 3.33Å; K102-L104 PolarHBondContact O-N 3.37Å; K102-E105 PolarHBondContact O-N 2.7Å; K102-R106 WeakPolarHBondContact O-CB 3.48Å; K102-R106 PolarHBondContact O-N 3.11Å
103	P	88.3	Confident	84.3	Confident	33 Å²	33	71.1 Å²	71.1	21%	0.214	35%	0.348	C	S	.	.	H	α-helix	trans	-56.8	-39.9	171.5	-29.2	33.1	0	0	0	114.9	L57 G99 C100 R106 L107	L57-P103 HydrophobicContact CD1-CB 3.8Å; L57-P103 HydrophobicContact CD2-CB 3.74Å; L57-P103 HydrophobicContact CD2-CG 3.94Å; L57-P103 HydrophobicContact CG-CB 4.4Å; G99-P103 WeakPolarHBondContact O-CD 3.47Å; C100-P103 VanDerWaalsContact O-CD 3.26Å; C100-P103 WeakPolarHBondContact O-CD 3.46Å; P103-R106 PolarHBondContact O-N 3.41Å; P103-L107 PolarHBondContact O-N 3.26Å
104	L	90.5	Very high	84.3	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-67.4	-47.4	178.9	-66.9	175.1	0	0	0	111.6	L57 L60 F89 V92 A93 C100 K101 K102 R106 L107 L108 M129	L57-L104 HydrophobicContact CD1-CD2 4.21Å; L60-L104 HydrophobicContact CD1-CD2 3.16Å; F89-L104 HydrophobicContact CD1-CB 4.49Å; F89-L104 HydrophobicContact CD1-CD2 4.01Å; F89-L104 HydrophobicContact CE1-CB 4.22Å; F89-L104 HydrophobicContact CE1-CD2 3.83Å; V92-L104 HydrophobicContact CG1-CD1 4.3Å; V92-L104 HydrophobicContact CG1-CD2 4.33Å; A93-L104 HydrophobicContact CB-CD1 4.5Å; C100-L104 WeakPolarHBondContact O-CG 3.25Å; C100-L104 PolarHBondContact O-N 2.85Å; C100-L104 VanDerWaalsContact O-N 3.12Å; K101-L104 WeakPolarHBondContact O-CB 3.4Å; K101-L104 PolarHBondContact O-N 2.75Å; K101-L104 VanDerWaalsContact O-N 3.13Å; K102-L104 VanDerWaalsContact C-N 3.33Å; K102-L104 PolarHBondContact O-N 3.37Å; L104-R106 VanDerWaalsContact C-N 3.29Å; L104-R106 PolarHBondContact O-N 3Å; L104-L107 VanDerWaalsContact O-CB 3.29Å; L104-L107 WeakPolarHBondContact O-CB 3.06Å; L104-L107 PolarHBondContact O-N 3.07Å; L104-L108 WeakPolarHBondContact O-CG 3.43Å; L104-L108 PolarHBondContact O-N 3.44Å; L104-M129 HydrophobicContact CB-CE 3.4Å; L104-M129 VanDerWaalsContact CB-CE 3.4Å; L104-M129 HydrophobicContact CB-SD 3.89Å; L104-M129 HydrophobicContact CD1-CE 3.71Å; L104-M129 HydrophobicContact CD1-SD 4.22Å; L104-M129 HydrophobicContact CG-CE 4.2Å
105	E	90.2	Very high	84.4	Confident	97 Å²	97	74.7 Å²	74.7	45%	0.453	37%	0.373	S	S	.	.	H	α-helix	trans	-56.7	-44.1	174.5	-74	168	-169.6	0	0	111.3	K101 K102 L107 L108 N109 M129	K101-E105 WeakPolarHBondContact O-CG 3.4Å; K101-E105 PolarHBondContact O-N 3.41Å; K102-E105 PolarHBondContact O-N 2.7Å; E105-L107 VanDerWaalsContact C-N 3.3Å; E105-L107 PolarHBondContact O-N 3.37Å; E105-L108 PolarHBondContact O-N 3.05Å; E105-N109 PolarHBondContact O-N 3.38Å; E105-N109 PolarHBondContact O-ND2 3.24Å; E105-M129 HydrophobicContact CG-CE 4.49Å
106	R	91.3	Very high	84.7	Confident	180 Å²	180	71.5 Å²	71.5	68%	0.679	36%	0.358	S	S	*	.	H	α-helix	trans	-59.1	-41.8	174.8	-176.9	179.4	176.2	-166.8	-1.4	111.7	K102 P103 L104 N109 I110	K102-R106 WeakPolarHBondContact O-CB 3.48Å; K102-R106 PolarHBondContact O-N 3.11Å; P103-R106 PolarHBondContact O-N 3.41Å; L104-R106 VanDerWaalsContact C-N 3.29Å; L104-R106 PolarHBondContact O-N 3Å; R106-N109 PolarHBondContact O-N 2.99Å; R106-I110 HydrophobicContact CG-CD1 4.15Å; R106-I110 WeakPolarHBondContact O-CD1 3.3Å; R106-I110 VanDerWaalsContact O-CG1 3.26Å; R106-I110 WeakPolarHBondContact O-CG1 3.33Å; R106-I110 PolarHBondContact O-N 3.39Å
107	L	92	Very high	85.6	Confident	9 Å²	9	71.8 Å²	71.8	5%	0.047	36%	0.357	C	S	.	.	H	α-helix	trans	-61.8	-45	177.8	-146.2	83.1	0	0	0	111.4	L60 Y61 N64 F89 P103 L104 E105 I110 W111	L60-L107 HydrophobicContact CB-CD2 4.26Å; Y61-L107 HydrophobicContact CD1-CD1 3.95Å; Y61-L107 HydrophobicContact CE1-CD1 4.17Å; N64-L107 HydrophobicContact CB-CD1 3.86Å; N64-L107 HydrophobicContact CB-CD2 4.13Å; N64-L107 HydrophobicContact CB-CG 4.17Å; F89-L107 HydrophobicContact CZ-CD2 3.97Å; P103-L107 PolarHBondContact O-N 3.26Å; L104-L107 VanDerWaalsContact O-CB 3.29Å; L104-L107 WeakPolarHBondContact O-CB 3.06Å; L104-L107 PolarHBondContact O-N 3.07Å; E105-L107 VanDerWaalsContact C-N 3.3Å; E105-L107 PolarHBondContact O-N 3.37Å; L107-I110 PolarHBondContact O-N 3.38Å; L107-W111 HydrophobicContact CD2-CZ2 4.21Å; L107-W111 PolarHBondContact O-N 3.01Å
108	L	92.7	Very high	86.8	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-66.2	-39.3	178.6	-65.5	-179.4	0	0	0	112.2	F89 L104 E105 W111 Q112 I122 L125 K126 M129	F89-L108 HydrophobicContact CE1-CD1 4.21Å; F89-L108 HydrophobicContact CE1-CD2 3.75Å; F89-L108 HydrophobicContact CE1-CG 3.87Å; F89-L108 HydrophobicContact CE2-CD2 4.19Å; F89-L108 HydrophobicContact CZ-CD2 3.55Å; F89-L108 HydrophobicContact CZ-CG 4.13Å; L104-L108 WeakPolarHBondContact O-CG 3.43Å; L104-L108 PolarHBondContact O-N 3.44Å; E105-L108 PolarHBondContact O-N 3.05Å; L108-W111 HydrophobicContact CD2-CE3 4.09Å; L108-W111 HydrophobicContact CD2-CZ3 4.37Å; L108-W111 PolarHBondContact O-N 2.99Å; L108-Q112 WeakPolarHBondContact O-CB 3.34Å; L108-Q112 PolarHBondContact O-N 2.97Å; L108-I122 HydrophobicContact CB-CG2 4.3Å; L108-L125 HydrophobicContact CD1-CB 4.08Å; L108-L125 HydrophobicContact CD2-CB 3.76Å; L108-L125 HydrophobicContact CD2-CD1 3.55Å; L108-L125 HydrophobicContact CD2-CG 4.31Å; L108-K126 HydrophobicContact CD1-CG 3.6Å; L108-M129 HydrophobicContact CD1-SD 3.86Å
109	N	90.6	Very high	88	Confident	65 Å²	65	64.1 Å²	64.1	35%	0.348	35%	0.345	S	S	.	.	H	α-helix	trans	-63.1	-42.2	174.8	-67.5	-15.9	0	0	0	111.2	E105 R106 W111 Q112 E113	E105-N109 PolarHBondContact O-N 3.38Å; E105-N109 PolarHBondContact O-ND2 3.24Å; R106-N109 PolarHBondContact O-N 2.99Å; N109-W111 VanDerWaalsContact C-N 3.3Å; N109-W111 PolarHBondContact O-N 2.93Å; N109-Q112 PolarHBondContact O-N 3.47Å; N109-E113 WeakPolarHBondContact O-CB 3.49Å; N109-E113 VanDerWaalsContact O-CG 3.31Å; N109-E113 WeakPolarHBondContact O-CG 3.41Å; N109-E113 PolarHBondContact O-N 2.87Å
110	I	89.3	Confident	89	Confident	38 Å²	38	70 Å²	70	20%	0.195	36%	0.357	C	S	.	.	H	α-helix	trans	-60	-41.8	174.1	-68	163.4	0	0	0	110.9	Q68 R106 L107 Q112 R114	Q68-I110 VanDerWaalsContact NE2-CG2 3.33Å; R106-I110 HydrophobicContact CG-CD1 4.15Å; R106-I110 WeakPolarHBondContact O-CD1 3.3Å; R106-I110 VanDerWaalsContact O-CG1 3.26Å; R106-I110 WeakPolarHBondContact O-CG1 3.33Å; R106-I110 PolarHBondContact O-N 3.39Å; L107-I110 PolarHBondContact O-N 3.38Å; I110-Q112 VanDerWaalsContact C-N 3.33Å; I110-R114 WeakPolarHBondContact O-CB 3.31Å; I110-R114 WeakPolarHBondContact O-CG 3.43Å; I110-R114 PolarHBondContact O-N 3.11Å
111	W	91.9	Very high	89.8	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-34.6	177.7	-73.8	4.9	0	0	0	113	N64 I67 L85 F89 L107 L108 N109 S115 V116 Y117 I122 L125	N64-W111 PolarHBondContact OD1-NE1 3.01Å; I67-W111 HydrophobicContact CD1-CH2 3.97Å; I67-W111 HydrophobicContact CD1-CZ2 3.78Å; L85-W111 HydrophobicContact CD1-CH2 3.54Å; L85-W111 HydrophobicContact CD1-CZ3 3.63Å; L85-W111 HydrophobicContact CD2-CH2 3.74Å; L85-W111 HydrophobicContact CD2-CZ3 4.34Å; L85-W111 HydrophobicContact CG-CH2 4.25Å; F89-W111 AromaticContact CE2-CH2 3.9Å; F89-W111 HydrophobicContact CE2-CH2 3.9Å; F89-W111 AromaticContact CE2-CZ3 3.84Å; F89-W111 HydrophobicContact CE2-CZ3 3.84Å; F89-W111 HydrophobicContact CZ-CH2 4.3Å; F89-W111 HydrophobicContact CZ-CZ3 4.2Å; L107-W111 HydrophobicContact CD2-CZ2 4.21Å; L107-W111 PolarHBondContact O-N 3.01Å; L108-W111 HydrophobicContact CD2-CE3 4.09Å; L108-W111 HydrophobicContact CD2-CZ3 4.37Å; L108-W111 PolarHBondContact O-N 2.99Å; N109-W111 VanDerWaalsContact C-N 3.3Å; N109-W111 PolarHBondContact O-N 2.93Å; W111-S115 PolarHBondContact O-N 3.13Å; W111-V116 HydrophobicContact CB-CB 3.89Å; W111-V116 HydrophobicContact CB-CG2 4.23Å; W111-V116 HydrophobicContact CD2-CG1 4.43Å; W111-V116 HydrophobicContact CG-CB 3.94Å; W111-V116 HydrophobicContact CG-CG1 4.18Å; W111-V116 HydrophobicContact CG-CG2 4.18Å; W111-V116 PolarHBondContact O-N 3.17Å; W111-Y117 HydrophobicContact CD2-CD2 4.28Å; W111-Y117 HydrophobicContact CD2-CE2 4.46Å; W111-Y117 AromaticContact CE3-CD2 3.71Å; W111-Y117 HydrophobicContact CE3-CD2 3.71Å; W111-Y117 AromaticContact CE3-CE2 3.95Å; W111-Y117 HydrophobicContact CE3-CE2 3.95Å; W111-Y117 HydrophobicContact CH2-CE2 4.31Å; W111-Y117 HydrophobicContact CZ3-CD2 4.05Å; W111-Y117 AromaticContact CZ3-CE2 3.87Å; W111-Y117 HydrophobicContact CZ3-CE2 3.87Å; W111-I122 HydrophobicContact CB-CD1 3.68Å; W111-I122 HydrophobicContact CE3-CD1 4.09Å; W111-L125 HydrophobicContact CE3-CD1 4.07Å; W111-L125 HydrophobicContact CZ3-CD1 3.73Å
112	Q	90.7	Very high	90.3	Very high	99 Å²	99	66.8 Å²	66.8	46%	0.463	34%	0.341	S	S	.	.	H	α-helix	trans	-69.3	-48.4	174.8	-172.6	173.5	-9.9	0	0	111.4	L108 N109 I110 R114 S115 I122	L108-Q112 WeakPolarHBondContact O-CB 3.34Å; L108-Q112 PolarHBondContact O-N 2.97Å; N109-Q112 PolarHBondContact O-N 3.47Å; I110-Q112 VanDerWaalsContact C-N 3.33Å; Q112-R114 VanDerWaalsContact C-N 3.32Å; Q112-R114 PolarHBondContact O-N 3.44Å; Q112-S115 PolarHBondContact O-N 3.22Å; Q112-I122 HydrophobicContact CB-CG2 4.38Å
113	E	88.5	Confident	90.6	Very high	153 Å²	153	63.4 Å²	63.4	72%	0.715	33%	0.327	S	S	*	.	H	α-helix	trans	-61.1	-38.6	179	-73.5	170.3	-171.3	0	0	112.3	N109	N109-E113 WeakPolarHBondContact O-CB 3.49Å; N109-E113 VanDerWaalsContact O-CG 3.31Å; N109-E113 WeakPolarHBondContact O-CG 3.41Å; N109-E113 PolarHBondContact O-N 2.87Å
114	R	87.8	Confident	90.9	Very high	126 Å²	126	66.6 Å²	66.6	48%	0.475	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	10.1	-178.6	-63	-179.5	177.4	-169.4	-5.4	113.9	K71 I110 Q112 V116	K71-R114 PolarHBondContact NZ-O 3.17Å; I110-R114 WeakPolarHBondContact O-CB 3.31Å; I110-R114 WeakPolarHBondContact O-CG 3.43Å; I110-R114 PolarHBondContact O-N 3.11Å; Q112-R114 VanDerWaalsContact C-N 3.32Å; Q112-R114 PolarHBondContact O-N 3.44Å; R114-V116 HydrophobicContact CB-CG2 3.99Å; R114-V116 PolarHBondContact O-N 3.43Å; R114-V116 VanDerWaalsContact O-N 3.16Å
115	S	87.8	Confident	91	Very high	97 Å²	97	66.6 Å²	66.6	68%	0.678	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.5	49.5	-177.2	-59.9	0	0	0	0	112	K71 W111 Q112	K71-S115 PolarHBondContact NZ-O 3.26Å; W111-S115 PolarHBondContact O-N 3.13Å; Q112-S115 PolarHBondContact O-N 3.22Å
116	V	88.9	Confident	91	Very high	10 Å²	10	64.4 Å²	64.4	6%	0.061	33%	0.329	C	S	.	.	S	Bend	trans	-71.8	-45.5	176.3	-177.5	0	0	0	0	111.4	I67 Q68 W111 R114	I67-V116 HydrophobicContact CG2-CG1 3.39Å; Q68-V116 HydrophobicContact CG-CG2 4.17Å; W111-V116 HydrophobicContact CB-CB 3.89Å; W111-V116 HydrophobicContact CB-CG2 4.23Å; W111-V116 HydrophobicContact CD2-CG1 4.43Å; W111-V116 HydrophobicContact CG-CB 3.94Å; W111-V116 HydrophobicContact CG-CG1 4.18Å; W111-V116 HydrophobicContact CG-CG2 4.18Å; W111-V116 PolarHBondContact O-N 3.17Å; R114-V116 HydrophobicContact CB-CG2 3.99Å; R114-V116 PolarHBondContact O-N 3.43Å; R114-V116 VanDerWaalsContact O-N 3.16Å
117	Y	91.7	Very high	91	Very high	18 Å²	18	59.4 Å²	59.4	7%	0.071	32%	0.315	C	S	.	.	S	Bend	trans	-130.5	161.6	170.1	-67.1	-73.6	0	0	0	109.3	I67 T78 E82 L85 W111 F121	I67-Y117 HydrophobicContact CD1-CE2 4.44Å; I67-Y117 HydrophobicContact CG2-CE2 4.47Å; T78-Y117 HydrophobicContact CG2-CD1 4.25Å; T78-Y117 HydrophobicContact CG2-CE1 3.53Å; T78-Y117 PolarHBondContact O-OH 2.85Å; E82-Y117 HydrophobicContact CB-CE1 3.78Å; E82-Y117 HydrophobicContact CG-CD1 4.24Å; E82-Y117 HydrophobicContact CG-CE1 3.82Å; E82-Y117 PolarHBondContact N-OH 2.9Å; L85-Y117 HydrophobicContact CD1-CE2 3.68Å; W111-Y117 HydrophobicContact CD2-CD2 4.28Å; W111-Y117 HydrophobicContact CD2-CE2 4.46Å; W111-Y117 AromaticContact CE3-CD2 3.71Å; W111-Y117 HydrophobicContact CE3-CD2 3.71Å; W111-Y117 AromaticContact CE3-CE2 3.95Å; W111-Y117 HydrophobicContact CE3-CE2 3.95Å; W111-Y117 HydrophobicContact CH2-CE2 4.31Å; W111-Y117 HydrophobicContact CZ3-CD2 4.05Å; W111-Y117 AromaticContact CZ3-CE2 3.87Å; W111-Y117 HydrophobicContact CZ3-CE2 3.87Å; Y117-F121 AromaticContact CD1-CD1 3.79Å; Y117-F121 HydrophobicContact CD1-CD1 3.79Å; Y117-F121 HydrophobicContact CD1-CE1 4Å; Y117-F121 AromaticContact CD2-CD1 3.94Å; Y117-F121 HydrophobicContact CD2-CD1 3.94Å; Y117-F121 AromaticContact CD2-CE1 3.95Å; Y117-F121 HydrophobicContact CD2-CE1 3.95Å; Y117-F121 HydrophobicContact CE1-CD1 4.45Å; Y117-F121 HydrophobicContact CE1-CE1 4.21Å; Y117-F121 HydrophobicContact CE2-CE1 4.15Å; Y117-F121 AromaticContact CG-CD1 3.51Å; Y117-F121 HydrophobicContact CG-CD1 3.51Å; Y117-F121 AromaticContact CG-CE1 3.88Å; Y117-F121 HydrophobicContact CG-CE1 3.88Å
118	G	89.9	Confident	90.8	Very high	52 Å²	52	59.6 Å²	59.6	54%	0.536	32%	0.317	S	S	.	.			trans	-65	154.2	174.2	0	0	0	0	0	112.1	E120 F121 I122	G118-E120 VanDerWaalsContact C-N 3.25Å; G118-E120 PolarHBondContact O-N 2.95Å; G118-F121 PolarHBondContact O-N 3.4Å; G118-F121 VanDerWaalsContact O-N 3.11Å; G118-I122 PolarHBondContact O-N 2.92Å; G118-I122 VanDerWaalsContact O-N 3.13Å
119	G	90.2	Very high	90.5	Very high	52 Å²	52	60.5 Å²	60.5	54%	0.536	32%	0.322	S	S	.	.	H	α-helix	trans	-56.3	-35.7	-177.2	0	0	0	0	0	114.1	F121 I122 Q123	G119-F121 PolarHBondContact O-N 2.88Å; G119-I122 PolarHBondContact O-N 3.37Å; G119-Q123 WeakPolarHBondContact O-CB 3.49Å; G119-Q123 PolarHBondContact O-N 3.21Å
120	E	92.2	Very high	90	Very high	180 Å²	180	63.8 Å²	63.8	84%	0.841	34%	0.335	S	S	*	.	H	α-helix	trans	-60.6	-45	176.6	-65.2	-176.8	169.3	0	0	112.2	G118 Q123 Q124	G118-E120 VanDerWaalsContact C-N 3.25Å; G118-E120 PolarHBondContact O-N 2.95Å; E120-Q123 PolarHBondContact O-N 3.31Å; E120-Q124 PolarHBondContact O-N 2.97Å
121	F	93.9	Very high	88.8	Confident	22 Å²	22	67.3 Å²	67.3	10%	0.096	35%	0.354	C	S	.	.	H	α-helix	trans	-68.8	-40.4	178.4	-174.3	-109.4	0	0	0	111.6	E82 L85 V86 Y117 G118 G119 Q123 Q124 L125	E82-F121 HydrophobicContact CB-CZ 4.34Å; E82-F121 HydrophobicContact CG-CD1 4.44Å; E82-F121 HydrophobicContact CG-CD2 4.27Å; E82-F121 HydrophobicContact CG-CE1 3.94Å; E82-F121 HydrophobicContact CG-CE2 3.78Å; E82-F121 HydrophobicContact CG-CZ 3.59Å; E82-F121 WeakPolarHBondContact O-CZ 3.35Å; L85-F121 HydrophobicContact CB-CZ 4.18Å; L85-F121 HydrophobicContact CD1-CE1 4.26Å; V86-F121 HydrophobicContact CG2-CE2 3.83Å; V86-F121 HydrophobicContact CG2-CZ 4.26Å; Y117-F121 AromaticContact CD1-CD1 3.79Å; Y117-F121 HydrophobicContact CD1-CD1 3.79Å; Y117-F121 HydrophobicContact CD1-CE1 4Å; Y117-F121 AromaticContact CD2-CD1 3.94Å; Y117-F121 HydrophobicContact CD2-CD1 3.94Å; Y117-F121 AromaticContact CD2-CE1 3.95Å; Y117-F121 HydrophobicContact CD2-CE1 3.95Å; Y117-F121 HydrophobicContact CE1-CD1 4.45Å; Y117-F121 HydrophobicContact CE1-CE1 4.21Å; Y117-F121 HydrophobicContact CE2-CE1 4.15Å; Y117-F121 AromaticContact CG-CD1 3.51Å; Y117-F121 HydrophobicContact CG-CD1 3.51Å; Y117-F121 AromaticContact CG-CE1 3.88Å; Y117-F121 HydrophobicContact CG-CE1 3.88Å; G118-F121 PolarHBondContact O-N 3.4Å; G118-F121 VanDerWaalsContact O-N 3.11Å; G119-F121 PolarHBondContact O-N 2.88Å; F121-Q123 VanDerWaalsContact C-N 3.27Å; F121-Q123 PolarHBondContact O-N 3.45Å; F121-Q124 WeakPolarHBondContact O-CB 3.49Å; F121-Q124 PolarHBondContact O-N 3.42Å; F121-Q124 VanDerWaalsContact O-N 3.16Å; F121-L125 HydrophobicContact CD1-CD1 4.02Å; F121-L125 HydrophobicContact CD1-CG 4.37Å; F121-L125 HydrophobicContact CE1-CD1 3.7Å; F121-L125 HydrophobicContact CE1-CD2 4.33Å; F121-L125 HydrophobicContact CE1-CG 4.1Å; F121-L125 HydrophobicContact CZ-CD1 4.33Å; F121-L125 HydrophobicContact CZ-CD2 4.13Å; F121-L125 HydrophobicContact CZ-CG 4.32Å; F121-L125 WeakPolarHBondContact O-CG 3.4Å; F121-L125 PolarHBondContact O-N 3.2Å
122	I	93	Very high	87.1	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-59.6	-41.1	173.9	-61.7	-60.4	0	0	0	110.8	L108 W111 Q112 G118 G119 L125 K126	L108-I122 HydrophobicContact CB-CG2 4.3Å; W111-I122 HydrophobicContact CB-CD1 3.68Å; W111-I122 HydrophobicContact CE3-CD1 4.09Å; Q112-I122 HydrophobicContact CB-CG2 4.38Å; G118-I122 PolarHBondContact O-N 2.92Å; G118-I122 VanDerWaalsContact O-N 3.13Å; G119-I122 PolarHBondContact O-N 3.37Å; I122-L125 PolarHBondContact O-N 2.97Å; I122-K126 WeakPolarHBondContact O-CG 3.45Å; I122-K126 PolarHBondContact O-N 3.4Å
123	Q	91.8	Very high	85.1	Confident	99 Å²	99	73.2 Å²	73.2	46%	0.463	38%	0.382	S	S	.	.	H	α-helix	trans	-64.8	-39.9	176.1	-171	61.4	25.9	0	0	111.7	G119 E120 F121 L125 K126 L127	G119-Q123 WeakPolarHBondContact O-CB 3.49Å; G119-Q123 PolarHBondContact O-N 3.21Å; E120-Q123 PolarHBondContact O-N 3.31Å; F121-Q123 VanDerWaalsContact C-N 3.27Å; F121-Q123 PolarHBondContact O-N 3.45Å; Q123-L125 VanDerWaalsContact C-N 3.31Å; Q123-L125 PolarHBondContact O-N 3.36Å; Q123-K126 PolarHBondContact O-N 2.85Å; Q123-L127 HydrophobicContact CG-CD1 4.43Å; Q123-L127 WeakPolarHBondContact O-CG 3.39Å; Q123-L127 PolarHBondContact O-N 2.84Å
124	Q	93	Very high	82.8	Confident	101 Å²	101	69.9 Å²	69.9	47%	0.472	38%	0.375	S	S	.	.	H	α-helix	trans	-60.2	-39.8	174.5	-170.2	-178.6	13.1	0	0	112.2	V86 E120 F121 L127 S128	V86-Q124 HydrophobicContact CG2-CG 4.26Å; E120-Q124 PolarHBondContact O-N 2.97Å; F121-Q124 WeakPolarHBondContact O-CB 3.49Å; F121-Q124 PolarHBondContact O-N 3.42Å; F121-Q124 VanDerWaalsContact O-N 3.16Å; Q124-L127 PolarHBondContact O-N 3.28Å; Q124-S128 PolarHBondContact O-N 3.48Å
125	L	93.3	Very high	80.4	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-66.9	-37.9	174.8	-64.9	176.6	0	0	0	112.5	L85 V86 F89 L108 W111 F121 I122 Q123 S128 M129	L85-L125 HydrophobicContact CB-CD2 3.99Å; V86-L125 HydrophobicContact CB-CD2 4.34Å; V86-L125 HydrophobicContact CG2-CD2 3.87Å; F89-L125 HydrophobicContact CB-CD2 4.47Å; F89-L125 HydrophobicContact CD2-CD1 4.41Å; F89-L125 HydrophobicContact CD2-CD2 3.95Å; F89-L125 HydrophobicContact CE2-CD1 4.22Å; F89-L125 HydrophobicContact CG-CD2 4.39Å; L108-L125 HydrophobicContact CD1-CB 4.08Å; L108-L125 HydrophobicContact CD2-CB 3.76Å; L108-L125 HydrophobicContact CD2-CD1 3.55Å; L108-L125 HydrophobicContact CD2-CG 4.31Å; W111-L125 HydrophobicContact CE3-CD1 4.07Å; W111-L125 HydrophobicContact CZ3-CD1 3.73Å; F121-L125 HydrophobicContact CD1-CD1 4.02Å; F121-L125 HydrophobicContact CD1-CG 4.37Å; F121-L125 HydrophobicContact CE1-CD1 3.7Å; F121-L125 HydrophobicContact CE1-CD2 4.33Å; F121-L125 HydrophobicContact CE1-CG 4.1Å; F121-L125 HydrophobicContact CZ-CD1 4.33Å; F121-L125 HydrophobicContact CZ-CD2 4.13Å; F121-L125 HydrophobicContact CZ-CG 4.32Å; F121-L125 WeakPolarHBondContact O-CG 3.4Å; F121-L125 PolarHBondContact O-N 3.2Å; I122-L125 PolarHBondContact O-N 2.97Å; Q123-L125 VanDerWaalsContact C-N 3.31Å; Q123-L125 PolarHBondContact O-N 3.36Å; L125-S128 PolarHBondContact O-OG 3.16Å; L125-S128 VanDerWaalsContact O-OG 3.1Å; L125-M129 WeakPolarHBondContact O-CG 3.24Å; L125-M129 PolarHBondContact O-N 3.16Å
126	K	90.6	Very high	78.3	Confident	51 Å²	51	69.5 Å²	69.5	22%	0.222	39%	0.387	C	S	.	.	H	α-helix	trans	-62	-47.1	174.4	-71.9	-180	176.2	176.5	0	110.9	L108 I122 Q123 S128 M129 E130	L108-K126 HydrophobicContact CD1-CG 3.6Å; I122-K126 WeakPolarHBondContact O-CG 3.45Å; I122-K126 PolarHBondContact O-N 3.4Å; Q123-K126 PolarHBondContact O-N 2.85Å; K126-S128 PolarHBondContact O-N 2.92Å; K126-M129 WeakPolarHBondContact O-CB 3.45Å; K126-M129 PolarHBondContact O-N 3.45Å; K126-E130 PolarHBondContact O-N 3.44Å
127	L	90.3	Very high	76	Confident	74 Å²	74	75.1 Å²	75.1	39%	0.387	42%	0.424	S	S	.	.	H	α-helix	trans	-63.4	-39.1	179.1	-68.8	171.5	0	0	0	112.7	Q123 Q124 M129 E130 D131	Q123-L127 HydrophobicContact CG-CD1 4.43Å; Q123-L127 WeakPolarHBondContact O-CG 3.39Å; Q123-L127 PolarHBondContact O-N 2.84Å; Q124-L127 PolarHBondContact O-N 3.28Å; L127-M129 PolarHBondContact O-N 2.92Å; L127-E130 PolarHBondContact O-N 3.22Å; L127-D131 PolarHBondContact O-N 3.31Å
128	S	88.5	Confident	73.5	Confident	13 Å²	13	84.1 Å²	84.1	9%	0.091	46%	0.463	C	S	.	.	H	α-helix	trans	-64.4	-23	179.5	80.9	0	0	0	0	113.6	V86 S90 Q124 L125 K126 S132	V86-S128 PolarHBondContact O-OG 3.07Å; S90-S128 WeakPolarHBondContact CB-O 3.37Å; Q124-S128 PolarHBondContact O-N 3.48Å; L125-S128 PolarHBondContact O-OG 3.16Å; L125-S128 VanDerWaalsContact O-OG 3.1Å; K126-S128 PolarHBondContact O-N 2.92Å; S128-S132 PolarHBondContact O-OG 2.74Å; S128-S132 VanDerWaalsContact O-OG 3.12Å
129	M	86.7	Confident	70.8	Confident	20 Å²	20	86.2 Å²	86.2	10%	0.099	48%	0.476	C	S	.	.	H	α-helix	trans	-78.7	-27.6	172.4	-62.8	171	46.4	0	0	112.7	F89 A93 L104 E105 L108 L125 K126 L127	F89-M129 HydrophobicContact CB-CG 4.25Å; F89-M129 HydrophobicContact CD1-CG 4.18Å; F89-M129 HydrophobicContact CD1-SD 3.65Å; F89-M129 HydrophobicContact CE1-SD 4.24Å; A93-M129 HydrophobicContact CB-CB 3.96Å; A93-M129 HydrophobicContact CB-CG 4.05Å; L104-M129 HydrophobicContact CB-CE 3.4Å; L104-M129 VanDerWaalsContact CB-CE 3.4Å; L104-M129 HydrophobicContact CB-SD 3.89Å; L104-M129 HydrophobicContact CD1-CE 3.71Å; L104-M129 HydrophobicContact CD1-SD 4.22Å; L104-M129 HydrophobicContact CG-CE 4.2Å; E105-M129 HydrophobicContact CG-CE 4.49Å; L108-M129 HydrophobicContact CD1-SD 3.86Å; L125-M129 WeakPolarHBondContact O-CG 3.24Å; L125-M129 PolarHBondContact O-N 3.16Å; K126-M129 WeakPolarHBondContact O-CB 3.45Å; K126-M129 PolarHBondContact O-N 3.45Å; L127-M129 PolarHBondContact O-N 2.92Å
130	E	79.4	Confident	68.4	Low	134 Å²	134	90.5 Å²	90.5	63%	0.626	49%	0.492	S	S	*	.	H	α-helix	trans	-84.9	-40.1	-178.7	-67.4	179.6	172.3	0	0	112.4	K126 L127 S132	K126-E130 PolarHBondContact O-N 3.44Å; L127-E130 PolarHBondContact O-N 3.22Å; E130-S132 PolarHBondContact O-N 3.41Å
131	D	64.7	Low	65.7	Low	111 Å²	111	90.9 Å²	90.9	59%	0.594	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-66.7	-9.7	-178.5	-78.7	-26.5	0	0	0	113.9	L127 K133 S134	L127-D131 PolarHBondContact O-N 3.31Å; D131-K133 PolarHBondContact O-N 3.37Å; D131-S134 PolarHBondContact O-N 2.87Å; D131-S134 PolarHBondContact O-OG 3.49Å
132	S	56.5	Low	63	Low	30 Å²	30	99.3 Å²	99.3	21%	0.21	53%	0.533	C	S	.	.	G	3₁₀ helix	trans	-68.5	3.6	-178.2	-65.2	0	0	0	0	114.7	S90 S128 E130 S134	S90-S132 PolarHBondContact OG-OG 3.03Å; S128-S132 PolarHBondContact O-OG 2.74Å; S128-S132 VanDerWaalsContact O-OG 3.12Å; E130-S132 PolarHBondContact O-N 3.41Å; S132-S134 VanDerWaalsContact C-N 3.28Å
133	K	47.9	Very low	60.3	Low	193 Å²	193	107.8 Å²	107.8	84%	0.839	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-83.8	5	168.8	-70	-173.7	178.2	179.5	0	114.1	D131	D131-K133 PolarHBondContact O-N 3.37Å
134	S	39.8	Very low	57.6	Low	83 Å²	83	111.8 Å²	111.8	58%	0.58	59%	0.586	S	S	*	*	S	Bend	trans	-119.5	136.9	-179.4	-39.2	0	0	0	0	111.7	D131 S132	D131-S134 PolarHBondContact O-N 2.87Å; D131-S134 PolarHBondContact O-OG 3.49Å; S132-S134 VanDerWaalsContact C-N 3.28Å
135	P	38	Very low	54.7	Low	118 Å²	118	111.7 Å²	111.7	77%	0.766	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-70.6	142.7	177	28.2	-29.3	0	0	0	110.8
136	P	44	Very low	52.1	Low	98 Å²	98	119.4 Å²	119.4	64%	0.636	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-73.6	132.5	-169.5	28.5	-33	0	0	0	112.2
137	P	40.8	Very low	49.2	Very low	128 Å²	128	125.6 Å²	125.6	83%	0.831	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-79.7	146.6	162.8	32	-28.6	0	0	0	110.5
138	K	37.9	Very low	46.3	Very low	207 Å²	207	132.7 Å²	132.7	90%	0.9	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-68.8	152.9	-175.7	-69.3	175.9	176.6	177.1	0	112.9
139	A	35.1	Very low	43.5	Very low	96 Å²	96	137.5 Å²	137.5	79%	0.793	71%	0.714	S	S	*	*			trans	-44.5	141.8	179.4	0	0	0	0	0	116.9
140	T	38.8	Very low	40.7	Very low	142 Å²	142	145.4 Å²	145.4	87%	0.871	75%	0.748	S	S	*	*			trans	-156.2	122.1	137.4	31.1	0	0	0	0	109.6
141	E	35	Very low	38.7	Very low	187 Å²	187	146.8 Å²	146.8	87%	0.874	76%	0.755	S	S	*	*			trans	-57.1	138.5	163.7	-59.2	170.9	140.6	0	0	109.8
142	E	37.8	Very low	37.1	Very low	200 Å²	200	148 Å²	148	94%	0.935	76%	0.757	S	S	*	*			trans	-167.6	152.8	133.7	-108.7	175.9	-165.7	0	0	114.3
143	K	36.3	Very low	36.1	Very low	179 Å²	179	154 Å²	154	78%	0.778	79%	0.785	S	S	*	*			trans	-78	156.2	-162.2	-84	160.5	174.5	162.4	0	114.6
144	K	34.2	Very low	35.3	Very low	182 Å²	182	151.7 Å²	151.7	79%	0.791	78%	0.777	S	S	*	*			trans	85.3	119.4	135.8	-82.5	169.3	-178.6	-173.5	0	120.3
145	S	32.8	Very low	35.3	Very low	100 Å²	100	156.7 Å²	156.7	70%	0.699	79%	0.791	S	S	*	*				86.6	131.6	123.9	67.1	0	0	0	0	120.3
146	L	39.1	Very low	35.1	Very low	161 Å²	161	158.8 Å²	158.8	84%	0.843	79%	0.791	S	S	*	*			trans	142.3	94.8	133.5	-72.3	160.4	0	0	0	109.5
147	K	30.5	Very low	34.9	Very low	181 Å²	181	163.4 Å²	163.4	79%	0.787	80%	0.804	S	S	*	*				53.6	128.9	92.6	-92.5	-175	179.3	177.6	0	116.4
148	R	27.6	Very low	34.6	Very low	224 Å²	224	165.2 Å²	165.2	85%	0.845	81%	0.807	S	S	*	*			trans	80	147.7	149.8	-76.2	-176.9	179.9	172.9	-2	116.4
149	T	30.3	Very low	34.6	Very low	114 Å²	114	163.3 Å²	163.3	70%	0.699	81%	0.806	S	S	*	*			cis	-167.5	157.5	7.3	-100.9	0	0	0	0	109.6
150	F	28.2	Very low	34.5	Very low	185 Å²	185	166 Å²	166	81%	0.811	81%	0.807	S	S	*	*			trans	-57.5	130.5	168.6	-176.6	-92.3	0	0	0	115.2
151	Q	36.7	Very low	34.6	Very low	164 Å²	164	169.3 Å²	169.3	77%	0.766	81%	0.805	S	S	*	*			trans	-163.6	103.4	155.5	-147.4	153.2	11.8	0	0	108
152	Q	31.1	Very low	34.8	Very low	137 Å²	137	165.9 Å²	165.9	64%	0.64	80%	0.799	S	S	*	*				74.8	101	86	-160.4	179.7	36.9	0	0	112.9
153	I	35.8	Very low	34.7	Very low	155 Å²	155	159.9 Å²	159.9	80%	0.795	79%	0.791	S	S	*	*			trans	-138.3	109.8	149	-59.9	-178	0	0	0	106.8	E155	I153-E155 HydrophobicContact CG2-CG 4.44Å
154	Q	31.9	Very low	34.7	Very low	145 Å²	145	155.8 Å²	155.8	68%	0.678	79%	0.785	S	S	*	*			trans	-75	135.4	157.8	-82.1	169	-58.1	0	0	107.6
155	E	40.1	Very low	34.7	Very low	187 Å²	187	157.2 Å²	157.2	87%	0.874	79%	0.786	S	S	*	*			trans	-128.9	113.7	147.5	-79.8	-179.1	167.7	0	0	106.7	I153	I153-E155 HydrophobicContact CG2-CG 4.44Å
156	E	33.3	Very low	34.8	Very low	163 Å²	163	158.2 Å²	158.2	76%	0.762	79%	0.794	S	S	*	*			trans	-80.8	125.5	165.9	-64.7	174.6	165.3	0	0	107
157	E	40.5	Very low	35	Very low	194 Å²	194	154.3 Å²	154.3	91%	0.907	78%	0.778	S	S	*	*			trans	-140	122.6	149.5	-75.7	-165.5	162.1	0	0	108.8
158	D	34	Very low	35.2	Very low	166 Å²	166	155 Å²	155	89%	0.888	78%	0.784	S	S	*	*			trans	-57.2	128.9	174.6	-69.1	-56.9	0	0	0	111.6
159	D	37.2	Very low	35.6	Very low	167 Å²	167	150.6 Å²	150.6	89%	0.893	78%	0.777	S	S	*	*			trans	-144.6	110.9	152.6	-126.8	-27.4	0	0	0	110.7	Y161	D159-Y161 PolarHBondContact O-N 3.43Å
160	D	34.2	Very low	36.3	Very low	152 Å²	152	150.3 Å²	150.3	81%	0.813	78%	0.777	S	S	*	*			trans	-76.7	98.9	-176.6	-171.5	21.5	0	0	0	109.5
161	Y	40.9	Very low	37	Very low	213 Å²	213	144.4 Å²	144.4	84%	0.835	76%	0.759	S	S	*	*			trans	-150.3	117.8	163.6	-138.4	-91.4	0	0	0	112.2	D159 G163	D159-Y161 PolarHBondContact O-N 3.43Å; Y161-G163 VanDerWaalsContact C-N 3.28Å; Y161-G163 PolarHBondContact O-N 2.92Å
162	P	38.2	Very low	37.6	Very low	115 Å²	115	139.7 Å²	139.7	75%	0.747	75%	0.748	S	S	*	*			trans	-77.1	79.4	177.2	29.6	-30.8	0	0	0	110.7	S164	P162-S164 PolarHBondContact O-N 3.33Å
163	G	35.9	Very low	38.7	Very low	73 Å²	73	134.8 Å²	134.8	75%	0.753	73%	0.734	S	S	*	*			trans	-73.6	72.4	168.5	0	0	0	0	0	112	Y161 Y165	Y161-G163 VanDerWaalsContact C-N 3.28Å; Y161-G163 PolarHBondContact O-N 2.92Å; G163-Y165 PolarHBondContact O-N 3.5Å
164	S	37.3	Very low	39.8	Very low	93 Å²	93	131.5 Å²	131.5	65%	0.65	72%	0.723	S	S	*	*			trans	-58.1	120.5	177.3	-140.7	0	0	0	0	112.6	P162	P162-S164 PolarHBondContact O-N 3.33Å
165	Y	33.8	Very low	41.1	Very low	212 Å²	212	129.3 Å²	129.3	83%	0.831	72%	0.715	S	S	*	*			trans	63	89.7	158.5	-57.7	-81.1	0	0	0	119	G163	G163-Y165 PolarHBondContact O-N 3.5Å
166	S	34.4	Very low	42.8	Very low	122 Å²	122	122.4 Å²	122.4	85%	0.853	68%	0.684	S	S	*	*			trans	-87.8	122.6	143.8	-143.5	0	0	0	0	108
167	P	43	Very low	45.2	Very low	79 Å²	79	116.7 Å²	116.7	51%	0.513	66%	0.661	S	S	.	*			trans	-72.1	154.2	-161.1	20.8	-27.4	0	0	0	114.7	K275	P167-K275 VanDerWaalsContact CG-NZ 3.26Å
168	Q	35.5	Very low	47.4	Very low	196 Å²	196	112.3 Å²	112.3	92%	0.916	64%	0.64	S	S	*	*			trans	-40.7	145.7	173.9	-70.8	166.9	-47.9	0	0	114
169	D	34.6	Very low	49.9	Very low	131 Å²	131	109.4 Å²	109.4	70%	0.701	62%	0.621	S	S	*	*			trans	-55	120.2	-168	-168.2	3	0	0	0	116.3	S171	D169-S171 PolarHBondContact O-N 3Å; D169-S171 WeakPolarHBondContact OD1-CA 3.23Å; D169-S171 WeakPolarHBondContact OD1-CB 3.3Å; D169-S171 PolarHBondContact OD1-N 3.3Å; D169-S171 WeakPolarHBondContact OD2-CB 3.39Å
170	P	44.9	Very low	52.3	Low	108 Å²	108	102.1 Å²	102.1	70%	0.701	58%	0.582	S	S	*	*			trans	-84.3	23.9	168.7	33.9	-32.5	0	0	0	114.1	A172 G173 P174	P170-A172 PolarHBondContact O-N 2.86Å; P170-G173 PolarHBondContact O-N 3.08Å; P170-G173 VanDerWaalsContact O-N 3.1Å; P170-P174 VanDerWaalsContact O-CD 3.25Å; P170-P174 WeakPolarHBondContact O-CD 3.4Å
171	S	44.8	Very low	55	Low	61 Å²	61	98.9 Å²	98.9	43%	0.427	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-50.5	-22.6	-173.4	146	0	0	0	0	117.2	D169 P174	D169-S171 PolarHBondContact O-N 3Å; D169-S171 WeakPolarHBondContact OD1-CA 3.23Å; D169-S171 WeakPolarHBondContact OD1-CB 3.3Å; D169-S171 PolarHBondContact OD1-N 3.3Å; D169-S171 WeakPolarHBondContact OD2-CB 3.39Å; S171-P174 WeakPolarHBondContact O-CD 3.46Å
172	A	48.3	Very low	57.2	Low	65 Å²	65	91.4 Å²	91.4	54%	0.537	54%	0.536	S	S	.	.	H	α-helix	trans	-77.6	-29.4	177.9	0	0	0	0	0	114.2	P170 L175 L176	P170-A172 PolarHBondContact O-N 2.86Å; A172-L175 PolarHBondContact O-N 2.88Å; A172-L176 PolarHBondContact O-N 3.13Å
173	G	53.7	Low	59.6	Low	33 Å²	33	87 Å²	87	34%	0.34	51%	0.509	S	S	.	.	H	α-helix	trans	-64.1	-43.2	-176.9	0	0	0	0	0	114.7	P170 L175 T177	P170-G173 PolarHBondContact O-N 3.08Å; P170-G173 VanDerWaalsContact O-N 3.1Å; G173-L175 VanDerWaalsContact C-N 3.34Å; G173-L175 PolarHBondContact O-N 3.47Å; G173-T177 PolarHBondContact O-N 3.44Å; G173-T177 PolarHBondContact O-OG1 3.44Å
174	P	58.7	Low	62.1	Low	87 Å²	87	87.6 Å²	87.6	57%	0.565	50%	0.495	S	S	*	.	H	α-helix	trans	-60.7	-39.4	175.1	-25.4	34	0	0	0	113.3	P170 S171 T177 E178	P170-P174 VanDerWaalsContact O-CD 3.25Å; P170-P174 WeakPolarHBondContact O-CD 3.4Å; S171-P174 WeakPolarHBondContact O-CD 3.46Å; P174-T177 PolarHBondContact O-N 3.49Å; P174-E178 PolarHBondContact O-N 2.89Å
175	L	60.5	Low	64.5	Low	98 Å²	98	88.4 Å²	88.4	51%	0.513	49%	0.488	S	S	.	.	H	α-helix	trans	-67.5	-47.2	-177.7	-63.7	177	0	0	0	111.8	A172 G173 T177 E178 E179	A172-L175 PolarHBondContact O-N 2.88Å; G173-L175 VanDerWaalsContact C-N 3.34Å; G173-L175 PolarHBondContact O-N 3.47Å; L175-T177 PolarHBondContact O-N 3.12Å; L175-E178 PolarHBondContact O-N 3.4Å; L175-E179 WeakPolarHBondContact O-CG 3.22Å; L175-E179 PolarHBondContact O-N 2.87Å
176	L	75.2	Confident	66.9	Low	43 Å²	43	82.6 Å²	82.6	23%	0.225	47%	0.471	C	S	.	.	H	α-helix	trans	-60.7	-34.7	175.4	-77.3	159.5	0	0	0	112.3	A172 L180 Y261 N264	A172-L176 PolarHBondContact O-N 3.13Å; L176-L180 VanDerWaalsContact O-CB 3.3Å; L176-L180 WeakPolarHBondContact O-CB 3.31Å; L176-L180 PolarHBondContact O-N 2.99Å; L176-Y261 HydrophobicContact CB-CD2 4.16Å; L176-Y261 HydrophobicContact CB-CE2 4.31Å; L176-N264 VanDerWaalsContact CD1-ND2 3.3Å; L176-N264 WeakPolarHBondContact CD1-ND2 3.3Å
177	T	84.6	Confident	69.4	Low	43 Å²	43	78.2 Å²	78.2	26%	0.264	44%	0.438	S	S	.	.	H	α-helix	trans	-69.7	-45.3	178.4	-54.9	0	0	0	0	111.2	G173 P174 L175 L180 I181 Y261	G173-T177 PolarHBondContact O-N 3.44Å; G173-T177 PolarHBondContact O-OG1 3.44Å; P174-T177 PolarHBondContact O-N 3.49Å; L175-T177 PolarHBondContact O-N 3.12Å; T177-L180 PolarHBondContact O-N 3.4Å; T177-I181 HydrophobicContact CG2-CD1 3.92Å; T177-I181 WeakPolarHBondContact O-CB 3.36Å; T177-I181 WeakPolarHBondContact O-CD1 3.29Å; T177-I181 VanDerWaalsContact O-CG1 3.22Å; T177-I181 WeakPolarHBondContact O-CG1 3.44Å; T177-I181 PolarHBondContact O-N 3Å; T177-Y261 WeakPolarHBondContact OG1-CE2 3.29Å; T177-Y261 PolarHBondContact OG1-OH 3.4Å
178	E	85.9	Confident	71.1	Confident	101 Å²	101	81.9 Å²	81.9	47%	0.472	45%	0.449	S	S	.	.	H	α-helix	trans	-63.9	-42.3	177.3	-172.6	178	-171.8	0	0	111.7	P174 L175 I181 K182	P174-E178 PolarHBondContact O-N 2.89Å; L175-E178 PolarHBondContact O-N 3.4Å; E178-I181 PolarHBondContact O-N 3.5Å; E178-K182 PolarHBondContact O-N 3.38Å
179	E	85.6	Confident	73	Confident	106 Å²	106	76 Å²	76	50%	0.495	42%	0.424	S	S	.	.	H	α-helix	trans	-61.9	-44	176.2	-72.9	-175.5	177	0	0	112.2	L175 K182 A183 M257	L175-E179 WeakPolarHBondContact O-CG 3.22Å; L175-E179 PolarHBondContact O-N 2.87Å; E179-K182 PolarHBondContact O-N 3.49Å; E179-A183 PolarHBondContact O-N 3.05Å; E179-M257 HydrophobicContact CB-CE 3.98Å
180	L	89	Confident	75.3	Confident	14 Å²	14	70.6 Å²	70.6	7%	0.073	40%	0.397	C	S	.	.	H	α-helix	trans	-65.2	-42.2	177.5	-177.5	62.2	0	0	0	111.9	L176 T177 K182 A183 L184 L254 M257 L258 Y261	L176-L180 VanDerWaalsContact O-CB 3.3Å; L176-L180 WeakPolarHBondContact O-CB 3.31Å; L176-L180 PolarHBondContact O-N 2.99Å; T177-L180 PolarHBondContact O-N 3.4Å; L180-K182 VanDerWaalsContact C-N 3.32Å; L180-K182 PolarHBondContact O-N 3.06Å; L180-A183 PolarHBondContact O-N 3.39Å; L180-L184 HydrophobicContact CD1-CD1 4.39Å; L180-L184 HydrophobicContact CD1-CG 4.47Å; L180-L184 HydrophobicContact CG-CD1 4.06Å; L180-L184 WeakPolarHBondContact O-CB 3.31Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.21Å; L180-L184 PolarHBondContact O-N 3.4Å; L180-L254 HydrophobicContact CD1-CD1 3.64Å; L180-M257 HydrophobicContact CB-CE 4.45Å; L180-M257 HydrophobicContact CD1-CB 4.17Å; L180-L258 HydrophobicContact CD1-CD2 3.84Å; L180-L258 HydrophobicContact CD1-CG 4.13Å; L180-L258 HydrophobicContact CD2-CD2 4.12Å; L180-Y261 HydrophobicContact CD2-CD1 3.77Å; L180-Y261 HydrophobicContact CD2-CD2 3.83Å; L180-Y261 HydrophobicContact CD2-CE1 4.18Å; L180-Y261 HydrophobicContact CD2-CE2 4.25Å; L180-Y261 HydrophobicContact CD2-CG 3.58Å
181	I	89.3	Confident	76.9	Confident	83 Å²	83	65.6 Å²	65.6	43%	0.426	37%	0.365	S	S	.	.	H	α-helix	trans	-59.5	-45.7	175.4	-71	166.1	0	0	0	110.3	T177 E178 L184 Q185	T177-I181 HydrophobicContact CG2-CD1 3.92Å; T177-I181 WeakPolarHBondContact O-CB 3.36Å; T177-I181 WeakPolarHBondContact O-CD1 3.29Å; T177-I181 VanDerWaalsContact O-CG1 3.22Å; T177-I181 WeakPolarHBondContact O-CG1 3.44Å; T177-I181 PolarHBondContact O-N 3Å; E178-I181 PolarHBondContact O-N 3.5Å; I181-L184 PolarHBondContact O-N 3Å; I181-Q185 HydrophobicContact CG2-CG 4.41Å; I181-Q185 WeakPolarHBondContact O-CG 3.39Å; I181-Q185 PolarHBondContact O-N 3.32Å
182	K	87.7	Confident	78.6	Confident	56 Å²	56	64.6 Å²	64.6	24%	0.243	36%	0.358	C	S	.	.	H	α-helix	trans	-61.2	-47	178.4	-173.7	175.1	-177.7	170.2	0	111.5	N69 E178 E179 L180 L184 Q185 D186	N69-K182 PolarHBondContact OD1-NZ 3.23Å; N69-K182 VanDerWaalsContact OD1-NZ 3.14Å; E178-K182 PolarHBondContact O-N 3.38Å; E179-K182 PolarHBondContact O-N 3.49Å; L180-K182 VanDerWaalsContact C-N 3.32Å; L180-K182 PolarHBondContact O-N 3.06Å; K182-L184 VanDerWaalsContact C-N 3.29Å; K182-L184 PolarHBondContact O-N 2.87Å; K182-Q185 PolarHBondContact O-N 2.91Å; K182-D186 VanDerWaalsContact O-CG 3.28Å; K182-D186 PolarHBondContact O-N 3.26Å
183	A	88.6	Confident	80.3	Confident	24 Å²	24	63.9 Å²	63.9	20%	0.198	36%	0.356	C	S	.	.	H	α-helix	trans	-61.9	-36.3	178.8	0	0	0	0	0	112.7	E179 L180 L187 L254 M257	E179-A183 PolarHBondContact O-N 3.05Å; L180-A183 PolarHBondContact O-N 3.39Å; A183-L187 PolarHBondContact O-N 2.84Å; A183-L254 HydrophobicContact CB-CD1 3.84Å; A183-M257 HydrophobicContact CB-CE 4.04Å; A183-M257 HydrophobicContact CB-SD 3.97Å
184	L	89.3	Confident	81.8	Confident	85 Å²	85	64 Å²	64	45%	0.445	35%	0.35	S	S	.	.	H	α-helix	trans	-67.6	-42.6	174.5	-72.9	165.7	0	0	0	112.4	L180 I181 K182 L187 E188 L254	L180-L184 HydrophobicContact CD1-CD1 4.39Å; L180-L184 HydrophobicContact CD1-CG 4.47Å; L180-L184 HydrophobicContact CG-CD1 4.06Å; L180-L184 WeakPolarHBondContact O-CB 3.31Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.21Å; L180-L184 PolarHBondContact O-N 3.4Å; I181-L184 PolarHBondContact O-N 3Å; K182-L184 VanDerWaalsContact C-N 3.29Å; K182-L184 PolarHBondContact O-N 2.87Å; L184-L187 PolarHBondContact O-N 2.73Å; L184-E188 PolarHBondContact O-N 3.4Å; L184-L254 HydrophobicContact CD2-CD1 4.05Å; L184-L254 HydrophobicContact CD2-CD2 3.85Å; L184-L254 HydrophobicContact CG-CD1 4.1Å
185	Q	88	Confident	83.3	Confident	109 Å²	109	62.6 Å²	62.6	51%	0.509	35%	0.345	S	S	.	.	H	α-helix	trans	-65.4	-39.6	177.1	-74	174	-11.6	0	0	112.4	I181 K182 L187 E188 N189	I181-Q185 HydrophobicContact CG2-CG 4.41Å; I181-Q185 WeakPolarHBondContact O-CG 3.39Å; I181-Q185 PolarHBondContact O-N 3.32Å; K182-Q185 PolarHBondContact O-N 2.91Å; Q185-L187 VanDerWaalsContact C-N 3.29Å; Q185-L187 PolarHBondContact O-N 3.32Å; Q185-E188 PolarHBondContact O-N 2.9Å; Q185-N189 PolarHBondContact O-ND2 3.49Å
186	D	84.2	Confident	84.8	Confident	90 Å²	90	62.3 Å²	62.3	48%	0.481	35%	0.347	S	S	.	.	H	α-helix	trans	-64.9	-36.7	177.3	-69.8	-19.9	0	0	0	110.6	K182 N189	K182-D186 VanDerWaalsContact O-CG 3.28Å; K182-D186 PolarHBondContact O-N 3.26Å; D186-N189 PolarHBondContact O-N 2.95Å
187	L	85.7	Confident	85.6	Confident	30 Å²	30	61.4 Å²	61.4	16%	0.157	34%	0.344	C	S	.	.	H	α-helix	trans	-73	-25.4	178.5	-168.6	66.9	0	0	0	113.9	A183 L184 Q185 N189 A190 E247 R251 L254	A183-L187 PolarHBondContact O-N 2.84Å; L184-L187 PolarHBondContact O-N 2.73Å; Q185-L187 VanDerWaalsContact C-N 3.29Å; Q185-L187 PolarHBondContact O-N 3.32Å; L187-N189 PolarHBondContact O-N 3.4Å; L187-A190 HydrophobicContact CD1-CB 3.98Å; L187-A190 WeakPolarHBondContact O-CB 3.28Å; L187-A190 PolarHBondContact O-N 3.27Å; L187-A190 VanDerWaalsContact O-N 3.17Å; L187-E247 HydrophobicContact CD1-CG 4.07Å; L187-R251 HydrophobicContact CD1-CG 3.56Å; L187-R251 HydrophobicContact CD2-CG 3.96Å; L187-R251 HydrophobicContact CG-CG 4.42Å; L187-L254 HydrophobicContact CD2-CD2 3.43Å; L187-L254 VanDerWaalsContact CD2-CD2 3.43Å
188	E	80.1	Confident	86	Confident	157 Å²	157	64.1 Å²	64.1	73%	0.734	35%	0.349	S	S	*	.	H	α-helix	trans	-60.8	-27.3	175	-166.8	173.3	-170.5	0	0	111.9	L184 Q185	L184-E188 PolarHBondContact O-N 3.4Å; Q185-E188 PolarHBondContact O-N 2.9Å
189	N	74.7	Confident	86.4	Confident	73 Å²	73	66.2 Å²	66.2	39%	0.39	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	17	179.7	-61	-68	0	0	0	113.6	Q185 D186 L187	Q185-N189 PolarHBondContact O-ND2 3.49Å; D186-N189 PolarHBondContact O-N 2.95Å; L187-N189 PolarHBondContact O-N 3.4Å
190	A	82.6	Confident	86.8	Confident	16 Å²	16	67 Å²	67	13%	0.132	36%	0.361	C	S	.	.	S	Bend	trans	-70.7	170.7	-174.2	0	0	0	0	0	114	L187 S192 G193 E247	L187-A190 HydrophobicContact CD1-CB 3.98Å; L187-A190 WeakPolarHBondContact O-CB 3.28Å; L187-A190 PolarHBondContact O-N 3.27Å; L187-A190 VanDerWaalsContact O-N 3.17Å; A190-S192 PolarHBondContact O-N 3.4Å; A190-G193 WeakPolarHBondContact O-CA 3.49Å; A190-G193 PolarHBondContact O-N 2.91Å; A190-E247 HydrophobicContact CB-CB 4.26Å; A190-E247 HydrophobicContact CB-CG 3.66Å
191	A	77.9	Confident	87	Confident	4 Å²	4	68.1 Å²	68.1	3%	0.033	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-56	-36.7	-178.2	0	0	0	0	0	112.9	G193 D194 Y240 R243 E247	A191-G193 PolarHBondContact O-N 3.07Å; A191-D194 VanDerWaalsContact O-CB 3.25Å; A191-D194 WeakPolarHBondContact O-CB 3.41Å; A191-D194 PolarHBondContact O-N 3.38Å; A191-Y240 HydrophobicContact CB-CE2 4.48Å; A191-R243 HydrophobicContact CB-CB 3.73Å; A191-E247 WeakPolarHBondContact CB-OE2 3.31Å; A191-E247 PolarHBondContact N-OE2 3.2Å
192	S	81.8	Confident	87.3	Confident	40 Å²	40	68.4 Å²	68.4	28%	0.28	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-69.9	-11.3	174.7	-57.7	0	0	0	0	113.4	A190 R198 E247	A190-S192 PolarHBondContact O-N 3.4Å; S192-R198 PolarHBondContact O-NH1 2.96Å; S192-R198 PolarHBondContact O-NH2 3.34Å; S192-E247 WeakPolarHBondContact CB-OE1 3.49Å; S192-E247 WeakPolarHBondContact CB-OE2 3.48Å; S192-E247 PolarHBondContact N-OE2 3.18Å; S192-E247 PolarHBondContact OG-OE1 3.2Å; S192-E247 PolarHBondContact OG-OE2 3.47Å
193	G	82.3	Confident	87.6	Confident	49 Å²	49	69.9 Å²	69.9	51%	0.505	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-83.2	-19.7	167.3	0	0	0	0	0	112.8	A190 A191 A195	A190-G193 WeakPolarHBondContact O-CA 3.49Å; A190-G193 PolarHBondContact O-N 2.91Å; A191-G193 PolarHBondContact O-N 3.07Å; G193-A195 VanDerWaalsContact C-N 3.34Å; G193-A195 PolarHBondContact O-N 2.58Å
194	D	86	Confident	88	Confident	37 Å²	37	70.6 Å²	70.6	20%	0.198	40%	0.399	C	S	.	.			trans	-78.2	78.7	-172.5	-162.7	-22.4	0	0	0	111.9	A191 T196 V197 R198 R243	A191-D194 VanDerWaalsContact O-CB 3.25Å; A191-D194 WeakPolarHBondContact O-CB 3.41Å; A191-D194 PolarHBondContact O-N 3.38Å; D194-T196 PolarHBondContact O-N 3.44Å; D194-T196 PolarHBondContact OD1-N 3.26Å; D194-V197 PolarHBondContact O-N 2.94Å; D194-V197 PolarHBondContact OD1-N 3.14Å; D194-V197 VanDerWaalsContact OD1-N 3.12Å; D194-V197 VanDerWaalsContact OD2-CG2 3.29Å; D194-V197 WeakPolarHBondContact OD2-CG2 3.17Å; D194-R198 WeakPolarHBondContact O-CG 3.32Å; D194-R198 PolarHBondContact O-N 2.97Å; D194-R243 IonicContact OD2-CZ 3.6Å; D194-R243 IonicContact OD2-NH1 3.3Å; D194-R243 PolarHBondContact OD2-NH1 3.04Å; D194-R243 IonicContact OD2-NH2 3.22Å; D194-R243 PolarHBondContact OD2-NH2 3.17Å
195	A	90.6	Very high	88.2	Confident	57 Å²	57	69 Å²	69	47%	0.471	39%	0.393	S	S	.	.	H	α-helix	trans	-58.5	-33	177.4	0	0	0	0	0	112.6	G193 R198 Q199	G193-A195 VanDerWaalsContact C-N 3.34Å; G193-A195 PolarHBondContact O-N 2.58Å; A195-R198 PolarHBondContact O-N 3.44Å; A195-Q199 WeakPolarHBondContact O-CB 3.46Å; A195-Q199 PolarHBondContact O-N 3.39Å
196	T	91.4	Very high	88.5	Confident	91 Å²	91	68.9 Å²	68.9	56%	0.558	39%	0.393	S	S	*	.	H	α-helix	trans	-65.8	-49.7	-177.6	-54.5	0	0	0	0	111.3	D194 R198 Q199 K200	D194-T196 PolarHBondContact O-N 3.44Å; D194-T196 PolarHBondContact OD1-N 3.26Å; T196-R198 VanDerWaalsContact C-N 3.34Å; T196-Q199 PolarHBondContact O-N 2.95Å; T196-K200 WeakPolarHBondContact O-CG 3.4Å; T196-K200 PolarHBondContact O-N 2.83Å
197	V	91.3	Very high	88.9	Confident	25 Å²	25	68.8 Å²	68.8	15%	0.152	39%	0.389	C	S	.	.	H	α-helix	trans	-65.1	-41.3	178.8	173.7	0	0	0	0	110.7	D194 Q199 K200 I201 L236 Y240	D194-V197 PolarHBondContact O-N 2.94Å; D194-V197 PolarHBondContact OD1-N 3.14Å; D194-V197 VanDerWaalsContact OD1-N 3.12Å; D194-V197 VanDerWaalsContact OD2-CG2 3.29Å; D194-V197 WeakPolarHBondContact OD2-CG2 3.17Å; V197-Q199 VanDerWaalsContact C-N 3.34Å; V197-Q199 PolarHBondContact O-N 3.34Å; V197-K200 WeakPolarHBondContact O-CB 3.49Å; V197-K200 PolarHBondContact O-N 2.98Å; V197-I201 HydrophobicContact CG1-CD1 3.9Å; V197-I201 HydrophobicContact CG1-CG1 4.46Å; V197-I201 WeakPolarHBondContact O-CG1 3.27Å; V197-I201 PolarHBondContact O-N 3.22Å; V197-L236 HydrophobicContact CG1-CD1 4.06Å; V197-Y240 HydrophobicContact CB-CD2 4.35Å; V197-Y240 HydrophobicContact CG1-CD2 3.51Å; V197-Y240 HydrophobicContact CG1-CE2 4.24Å; V197-Y240 HydrophobicContact CG1-CG 4.13Å
198	R	93	Very high	89.2	Confident	100 Å²	100	68.8 Å²	68.8	38%	0.377	39%	0.391	S	S	.	.	H	α-helix	trans	-61.8	-40.5	175.8	-71.4	-172.8	-60.9	-151	-10.5	113	S192 D194 A195 T196 K200 I201 A202 Y240	S192-R198 PolarHBondContact O-NH1 2.96Å; S192-R198 PolarHBondContact O-NH2 3.34Å; D194-R198 WeakPolarHBondContact O-CG 3.32Å; D194-R198 PolarHBondContact O-N 2.97Å; A195-R198 PolarHBondContact O-N 3.44Å; T196-R198 VanDerWaalsContact C-N 3.34Å; R198-K200 VanDerWaalsContact C-N 3.34Å; R198-I201 PolarHBondContact O-N 3.46Å; R198-A202 VanDerWaalsContact O-CB 3.32Å; R198-A202 WeakPolarHBondContact O-CB 3.5Å; R198-A202 PolarHBondContact O-N 2.7Å; R198-Y240 WeakPolarHBondContact CD-OH 3.3Å; R198-Y240 HydrophobicContact CG-CE2 3.96Å; R198-Y240 WeakPolarHBondContact CG-OH 3.36Å
199	Q	94.8	Very high	89.8	Confident	145 Å²	145	68.8 Å²	68.8	68%	0.678	39%	0.391	S	S	*	.	H	α-helix	trans	-64.3	-40.9	176.4	-173.8	176.5	-4	0	0	111.1	A195 T196 V197 A202 S203	A195-Q199 WeakPolarHBondContact O-CB 3.46Å; A195-Q199 PolarHBondContact O-N 3.39Å; T196-Q199 PolarHBondContact O-N 2.95Å; V197-Q199 VanDerWaalsContact C-N 3.34Å; V197-Q199 PolarHBondContact O-N 3.34Å; Q199-A202 PolarHBondContact O-N 3.39Å; Q199-S203 WeakPolarHBondContact O-CB 3.22Å; Q199-S203 PolarHBondContact O-N 3.02Å; Q199-S203 PolarHBondContact O-OG 3.38Å
200	K	94	Very high	90.8	Very high	122 Å²	122	67.5 Å²	67.5	53%	0.53	38%	0.383	S	S	.	.	H	α-helix	trans	-60.2	-46.8	174.1	-73.2	-177.5	177.7	-174.6	0	112	T196 V197 R198 A202 S203 L204 L236	T196-K200 WeakPolarHBondContact O-CG 3.4Å; T196-K200 PolarHBondContact O-N 2.83Å; V197-K200 WeakPolarHBondContact O-CB 3.49Å; V197-K200 PolarHBondContact O-N 2.98Å; R198-K200 VanDerWaalsContact C-N 3.34Å; K200-A202 VanDerWaalsContact C-N 3.35Å; K200-A202 PolarHBondContact O-N 2.97Å; K200-S203 WeakPolarHBondContact CA-OG 3.5Å; K200-S203 PolarHBondContact O-N 3.13Å; K200-S203 PolarHBondContact O-OG 2.92Å; K200-L204 PolarHBondContact O-N 3.38Å; K200-L236 HydrophobicContact CB-CD2 4.06Å
201	I	94	Very high	91.3	Very high	38 Å²	38	72.3 Å²	72.3	20%	0.195	41%	0.411	C	S	.	.	H	α-helix	trans	-61.1	-44.4	176.4	-66.7	167.8	0	0	0	110.7	V197 R198 S203 L204 L236 L237 Y240	V197-I201 HydrophobicContact CG1-CD1 3.9Å; V197-I201 HydrophobicContact CG1-CG1 4.46Å; V197-I201 WeakPolarHBondContact O-CG1 3.27Å; V197-I201 PolarHBondContact O-N 3.22Å; R198-I201 PolarHBondContact O-N 3.46Å; I201-S203 PolarHBondContact O-N 3.39Å; I201-L204 HydrophobicContact CG2-CD1 4.44Å; I201-L204 WeakPolarHBondContact O-CB 3.26Å; I201-L204 WeakPolarHBondContact O-CG 3.36Å; I201-L204 PolarHBondContact O-N 3.47Å; I201-L236 HydrophobicContact CG1-CD2 3.76Å; I201-L236 HydrophobicContact CG1-CG 3.94Å; I201-L237 HydrophobicContact CD1-CD2 4.29Å; I201-L237 HydrophobicContact CG1-CD2 4.33Å; I201-L237 HydrophobicContact CG2-CD2 3.79Å; I201-Y240 HydrophobicContact CD1-CD1 3.64Å; I201-Y240 HydrophobicContact CD1-CD2 4.07Å; I201-Y240 HydrophobicContact CD1-CE1 4.27Å; I201-Y240 HydrophobicContact CD1-CG 3.52Å
202	A	94.9	Very high	92.1	Very high	88 Å²	88	75.3 Å²	75.3	73%	0.727	43%	0.432	S	S	*	.	H	α-helix	trans	-66.7	-25.6	178.4	0	0	0	0	0	113.3	R198 Q199 K200 L204	R198-A202 VanDerWaalsContact O-CB 3.32Å; R198-A202 WeakPolarHBondContact O-CB 3.5Å; R198-A202 PolarHBondContact O-N 2.7Å; Q199-A202 PolarHBondContact O-N 3.39Å; K200-A202 VanDerWaalsContact C-N 3.35Å; K200-A202 PolarHBondContact O-N 2.97Å; A202-L204 VanDerWaalsContact C-N 3.34Å
203	S	95.4	Very high	92.6	Very high	87 Å²	87	74.4 Å²	74.4	61%	0.608	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	2.4	176.8	66.7	0	0	0	0	114.3	Q199 K200 I201	Q199-S203 WeakPolarHBondContact O-CB 3.22Å; Q199-S203 PolarHBondContact O-N 3.02Å; Q199-S203 PolarHBondContact O-OG 3.38Å; K200-S203 WeakPolarHBondContact CA-OG 3.5Å; K200-S203 PolarHBondContact O-N 3.13Å; K200-S203 PolarHBondContact O-OG 2.92Å; I201-S203 PolarHBondContact O-N 3.39Å
204	L	95.2	Very high	93.1	Very high	40 Å²	40	76.3 Å²	76.3	21%	0.209	42%	0.422	C	S	.	.			trans	-61.8	134.8	177.5	-72.5	173.7	0	0	0	110.4	K200 I201 A202 V208 A233	K200-L204 PolarHBondContact O-N 3.38Å; I201-L204 HydrophobicContact CG2-CD1 4.44Å; I201-L204 WeakPolarHBondContact O-CB 3.26Å; I201-L204 WeakPolarHBondContact O-CG 3.36Å; I201-L204 PolarHBondContact O-N 3.47Å; A202-L204 VanDerWaalsContact C-N 3.34Å; L204-V208 HydrophobicContact CB-CG2 3.99Å; L204-A233 HydrophobicContact CD1-CB 3.95Å; L204-A233 HydrophobicContact CD2-CB 3.79Å
205	P	94.2	Very high	93.4	Very high	51 Å²	51	83 Å²	83	33%	0.331	45%	0.452	S	S	.	.			trans	-64.2	148	-178.5	24.2	-31.2	0	0	0	111.4	E207 V208 T229	P205-E207 WeakPolarHBondContact CB-OE2 3.44Å; P205-E207 PolarHBondContact O-N 3.05Å; P205-V208 HydrophobicContact CG-CG1 3.92Å; P205-V208 HydrophobicContact CG-CG2 4.35Å; P205-V208 WeakPolarHBondContact O-CG2 3.18Å; P205-V208 PolarHBondContact O-N 3.01Å; P205-V208 VanDerWaalsContact O-N 3.14Å; P205-T229 HydrophobicContact CG-CG2 4Å
206	Q	93.8	Very high	93.4	Very high	106 Å²	106	87.6 Å²	87.6	50%	0.495	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-62.2	-29.5	-177.5	-172.8	179.4	-17.1	0	0	111.8	V208 Q209 D210 L213	Q206-V208 PolarHBondContact O-N 2.83Å; Q206-V208 VanDerWaalsContact O-N 3.14Å; Q206-Q209 VanDerWaalsContact O-CG 3.29Å; Q206-Q209 WeakPolarHBondContact O-CG 3.27Å; Q206-Q209 PolarHBondContact O-N 3.23Å; Q206-D210 HydrophobicContact CG-CB 3.95Å; Q206-D210 PolarHBondContact NE2-OD2 2.97Å; Q206-D210 WeakPolarHBondContact O-CB 3.43Å; Q206-D210 PolarHBondContact O-N 3.38Å; Q206-L213 HydrophobicContact CB-CD1 3.98Å; Q206-L213 HydrophobicContact CG-CD1 3.74Å
207	E	92.5	Very high	93.4	Very high	89 Å²	89	85.9 Å²	85.9	42%	0.416	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-57.8	-24.3	177.9	-65.1	79.5	180	0	0	113.5	P205 L213 L226	P205-E207 WeakPolarHBondContact CB-OE2 3.44Å; P205-E207 PolarHBondContact O-N 3.05Å; E207-L213 HydrophobicContact CG-CB 4.35Å; E207-L213 HydrophobicContact CG-CD1 4.04Å; E207-L226 HydrophobicContact CB-CD1 3.71Å; E207-L226 HydrophobicContact CB-CD2 4.36Å
208	V	93.4	Very high	93.5	Very high	30 Å²	30	91 Å²	91	18%	0.182	48%	0.48	C	S	.	.	G	3₁₀ helix	trans	-82.9	-14.1	178	-61.7	0	0	0	0	113.8	L204 P205 Q206 L226 T229 V230 A233	L204-V208 HydrophobicContact CB-CG2 3.99Å; P205-V208 HydrophobicContact CG-CG1 3.92Å; P205-V208 HydrophobicContact CG-CG2 4.35Å; P205-V208 WeakPolarHBondContact O-CG2 3.18Å; P205-V208 PolarHBondContact O-N 3.01Å; P205-V208 VanDerWaalsContact O-N 3.14Å; Q206-V208 PolarHBondContact O-N 2.83Å; Q206-V208 VanDerWaalsContact O-N 3.14Å; V208-L226 HydrophobicContact CG1-CD1 3.96Å; V208-T229 HydrophobicContact CG1-CG2 3.78Å; V208-V230 HydrophobicContact CB-CG2 4Å; V208-V230 HydrophobicContact CG1-CG2 3.79Å; V208-A233 HydrophobicContact CG2-CB 4.31Å
209	Q	92.7	Very high	93.5	Very high	157 Å²	157	89.7 Å²	89.7	73%	0.734	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.8	-15.8	-175.8	61.4	176.5	-1.2	0	0	113.9	Q206	Q206-Q209 VanDerWaalsContact O-CG 3.29Å; Q206-Q209 WeakPolarHBondContact O-CG 3.27Å; Q206-Q209 PolarHBondContact O-N 3.23Å
210	D	94.2	Very high	93.5	Very high	45 Å²	45	90.4 Å²	90.4	24%	0.241	48%	0.481	C	S	.	.			trans	-113.6	104.1	-176.9	-170.8	-13.9	0	0	0	111.3	Q206 S212 L213	Q206-D210 HydrophobicContact CG-CB 3.95Å; Q206-D210 PolarHBondContact NE2-OD2 2.97Å; Q206-D210 WeakPolarHBondContact O-CB 3.43Å; Q206-D210 PolarHBondContact O-N 3.38Å; D210-S212 VanDerWaalsContact CG-OG 3.25Å; D210-S212 PolarHBondContact O-N 3.22Å; D210-S212 WeakPolarHBondContact OD1-CB 3.41Å; D210-S212 PolarHBondContact OD1-N 3.35Å; D210-S212 PolarHBondContact OD1-OG 3.07Å; D210-S212 PolarHBondContact OD2-OG 3.12Å; D210-L213 HydrophobicContact CB-CD1 3.99Å; D210-L213 HydrophobicContact CB-CG 4.14Å; D210-L213 PolarHBondContact O-N 2.73Å
211	V	94.5	Very high	93.6	Very high	117 Å²	117	91 Å²	91	71%	0.709	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-61.7	-24	-178.8	70.7	0	0	0	0	113.1	L213 L214	V211-L213 PolarHBondContact O-N 2.72Å; V211-L214 HydrophobicContact CG2-CD1 3.82Å; V211-L214 WeakPolarHBondContact O-CB 3.45Å; V211-L214 WeakPolarHBondContact O-CG 3.49Å; V211-L214 PolarHBondContact O-N 2.94Å
212	S	94.1	Very high	93.5	Very high	68 Å²	68	90 Å²	90	48%	0.476	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-68.2	-21.1	179.8	71.2	0	0	0	0	112.9	D210 L214	D210-S212 VanDerWaalsContact CG-OG 3.25Å; D210-S212 PolarHBondContact O-N 3.22Å; D210-S212 WeakPolarHBondContact OD1-CB 3.41Å; D210-S212 PolarHBondContact OD1-N 3.35Å; D210-S212 PolarHBondContact OD1-OG 3.07Å; D210-S212 PolarHBondContact OD2-OG 3.12Å; S212-L214 VanDerWaalsContact C-N 3.28Å; S212-L214 PolarHBondContact O-N 3.46Å
213	L	92.8	Very high	93.5	Very high	20 Å²	20	87.9 Å²	87.9	11%	0.105	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-78.7	-12.2	179.2	-62.3	178.7	0	0	0	113.1	Q206 E207 D210 V211 E215 K216	Q206-L213 HydrophobicContact CB-CD1 3.98Å; Q206-L213 HydrophobicContact CG-CD1 3.74Å; E207-L213 HydrophobicContact CG-CB 4.35Å; E207-L213 HydrophobicContact CG-CD1 4.04Å; D210-L213 HydrophobicContact CB-CD1 3.99Å; D210-L213 HydrophobicContact CB-CG 4.14Å; D210-L213 PolarHBondContact O-N 2.73Å; V211-L213 PolarHBondContact O-N 2.72Å; L213-E215 PolarHBondContact O-N 3.17Å; L213-K216 HydrophobicContact CD2-CD 4.17Å; L213-K216 WeakPolarHBondContact O-CB 3.35Å; L213-K216 PolarHBondContact O-N 3.25Å; L213-K216 VanDerWaalsContact O-N 3.14Å
214	L	92.7	Very high	93.5	Very high	89 Å²	89	88.2 Å²	88.2	47%	0.466	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-63.4	-29	179.1	-63.8	-177.1	0	0	0	112.7	V211 S212 K216 I217 L226	V211-L214 HydrophobicContact CG2-CD1 3.82Å; V211-L214 WeakPolarHBondContact O-CB 3.45Å; V211-L214 WeakPolarHBondContact O-CG 3.49Å; V211-L214 PolarHBondContact O-N 2.94Å; S212-L214 VanDerWaalsContact C-N 3.28Å; S212-L214 PolarHBondContact O-N 3.46Å; L214-K216 PolarHBondContact O-N 3.49Å; L214-K216 VanDerWaalsContact O-N 3.15Å; L214-I217 PolarHBondContact O-N 3.1Å; L214-I217 VanDerWaalsContact O-N 3.11Å; L214-L226 HydrophobicContact CD2-CD2 3.74Å
215	E	91.7	Very high	93.4	Very high	178 Å²	178	93.2 Å²	93.2	83%	0.832	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-61.6	-21	176.8	-63	-175.9	173.3	0	0	113.2	L213 I217	L213-E215 PolarHBondContact O-N 3.17Å; E215-I217 VanDerWaalsContact C-N 3.35Å
216	K	91.6	Very high	93.4	Very high	153 Å²	153	91.9 Å²	91.9	67%	0.665	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-81.7	-13.8	179.2	-61.2	178.7	-179.4	172.1	0	113.1	L213 L214 T218	L213-K216 HydrophobicContact CD2-CD 4.17Å; L213-K216 WeakPolarHBondContact O-CB 3.35Å; L213-K216 PolarHBondContact O-N 3.25Å; L213-K216 VanDerWaalsContact O-N 3.14Å; L214-K216 PolarHBondContact O-N 3.49Å; L214-K216 VanDerWaalsContact O-N 3.15Å; K216-T218 PolarHBondContact O-N 3.31Å
217	I	90.9	Very high	93.5	Very high	56 Å²	56	90 Å²	90	29%	0.287	46%	0.462	S	S	.	.			trans	-83.9	104.5	-178.9	-54.6	-61.2	0	0	0	108.7	L214 E215 A222 A223 L226	L214-I217 PolarHBondContact O-N 3.1Å; L214-I217 VanDerWaalsContact O-N 3.11Å; E215-I217 VanDerWaalsContact C-N 3.35Å; I217-A222 HydrophobicContact CG2-CB 4.06Å; I217-A223 HydrophobicContact CG2-CB 3.74Å; I217-L226 HydrophobicContact CD1-CD2 4.32Å; I217-L226 HydrophobicContact CG1-CD2 4.19Å
218	T	92.1	Very high	93.6	Very high	133 Å²	133	92.2 Å²	92.2	82%	0.816	47%	0.47	S	S	*	.			trans	-105.9	-7	-173.1	52.1	0	0	0	0	113.8	K216	K216-T218 PolarHBondContact O-N 3.31Å
219	D	94.5	Very high	93.7	Very high	72 Å²	72	93.1 Å²	93.1	39%	0.385	48%	0.476	S	S	.	.	S	Bend	trans	-128.4	148.5	179.1	72.9	93.6	0	0	0	112.1	E221 A222 A223	D219-E221 VanDerWaalsContact C-N 3.28Å; D219-E221 PolarHBondContact O-N 2.93Å; D219-E221 WeakPolarHBondContact OD1-CB 3.16Å; D219-E221 PolarHBondContact OD1-N 3.15Å; D219-A222 PolarHBondContact O-N 3.16Å; D219-A222 WeakPolarHBondContact OD1-CB 3.45Å; D219-A222 PolarHBondContact OD1-N 3.42Å; D219-A222 WeakPolarHBondContact OD2-CB 3.41Å; D219-A223 PolarHBondContact O-N 2.84Å
220	K	94.8	Very high	93.9	Very high	160 Å²	160	87.8 Å²	87.8	70%	0.696	45%	0.454	S	S	*	.	H	α-helix	trans	-64.2	-34	-177.6	-170.1	-174.5	-178.3	-148.4	0	112.2	A223 E224	K220-A223 PolarHBondContact O-N 2.97Å; K220-E224 WeakPolarHBondContact CE-OE1 3.36Å; K220-E224 IonicContact NZ-OE1 3.05Å; K220-E224 PolarHBondContact NZ-OE1 2.93Å; K220-E224 WeakPolarHBondContact O-CG 3.33Å; K220-E224 PolarHBondContact O-N 3.23Å
221	E	94.7	Very high	94	Very high	135 Å²	135	90.6 Å²	90.6	63%	0.631	47%	0.469	S	S	*	.	H	α-helix	trans	-70.2	-37.1	-177.2	-170.2	179.4	172.4	0	0	111.7	D219 R225	D219-E221 VanDerWaalsContact C-N 3.28Å; D219-E221 PolarHBondContact O-N 2.93Å; D219-E221 WeakPolarHBondContact OD1-CB 3.16Å; D219-E221 PolarHBondContact OD1-N 3.15Å; E221-R225 WeakPolarHBondContact O-CG 3.5Å; E221-R225 PolarHBondContact O-N 2.68Å; E221-R225 VanDerWaalsContact O-N 3.07Å; E221-R225 PolarHBondContact O-NE 3.43Å
222	A	93.2	Very high	94	Very high	15 Å²	15	91.6 Å²	91.6	12%	0.124	47%	0.466	C	S	.	.	H	α-helix	trans	-67.6	-40.5	171.2	0	0	0	0	0	111.8	I217 D219 R225 L226	I217-A222 HydrophobicContact CG2-CB 4.06Å; D219-A222 PolarHBondContact O-N 3.16Å; D219-A222 WeakPolarHBondContact OD1-CB 3.45Å; D219-A222 PolarHBondContact OD1-N 3.42Å; D219-A222 WeakPolarHBondContact OD2-CB 3.41Å; A222-R225 PolarHBondContact O-N 3.4Å; A222-L226 WeakPolarHBondContact O-CB 3.37Å; A222-L226 PolarHBondContact O-N 3.34Å
223	A	93.8	Very high	94.1	Very high	45 Å²	45	88.7 Å²	88.7	37%	0.372	45%	0.446	S	S	.	.	H	α-helix	trans	-62	-44.9	174.9	0	0	0	0	0	112.1	I217 D219 K220 R225 L226 S227	I217-A223 HydrophobicContact CG2-CB 3.74Å; D219-A223 PolarHBondContact O-N 2.84Å; K220-A223 PolarHBondContact O-N 2.97Å; A223-R225 VanDerWaalsContact C-N 3.34Å; A223-R225 PolarHBondContact O-N 3.05Å; A223-L226 PolarHBondContact O-N 2.9Å; A223-S227 WeakPolarHBondContact O-CB 3.27Å; A223-S227 PolarHBondContact O-N 3.04Å
224	E	95.4	Very high	94.2	Very high	94 Å²	94	91.2 Å²	91.2	44%	0.439	47%	0.465	S	S	.	.	H	α-helix	trans	-64.4	-36.8	176.5	-75	179	-169.8	0	0	112	K220 K228	K220-E224 WeakPolarHBondContact CE-OE1 3.36Å; K220-E224 IonicContact NZ-OE1 3.05Å; K220-E224 PolarHBondContact NZ-OE1 2.93Å; K220-E224 WeakPolarHBondContact O-CG 3.33Å; K220-E224 PolarHBondContact O-N 3.23Å; E224-K228 WeakPolarHBondContact O-CG 3.41Å; E224-K228 PolarHBondContact O-N 3.41Å
225	R	94	Very high	94.3	Very high	144 Å²	144	92.1 Å²	92.1	54%	0.543	47%	0.47	S	S	.	.	H	α-helix	trans	-64.3	-48.3	172.8	-79.3	-179.8	-78.6	144.9	-6.7	111.8	E221 A222 A223 S227 K228 T229	E221-R225 WeakPolarHBondContact O-CG 3.5Å; E221-R225 PolarHBondContact O-N 2.68Å; E221-R225 VanDerWaalsContact O-N 3.07Å; E221-R225 PolarHBondContact O-NE 3.43Å; A222-R225 PolarHBondContact O-N 3.4Å; A223-R225 VanDerWaalsContact C-N 3.34Å; A223-R225 PolarHBondContact O-N 3.05Å; R225-S227 VanDerWaalsContact C-N 3.35Å; R225-S227 PolarHBondContact O-N 3.32Å; R225-K228 PolarHBondContact O-N 3.23Å; R225-T229 PolarHBondContact O-N 3.33Å; R225-T229 VanDerWaalsContact O-N 3.16Å; R225-T229 PolarHBondContact O-OG1 3.39Å; R225-T229 VanDerWaalsContact O-OG1 3.11Å
226	L	94.5	Very high	94.4	Very high	24 Å²	24	85.4 Å²	85.4	13%	0.126	44%	0.439	C	S	.	.	H	α-helix	trans	-62.3	-42.6	177.7	-179.6	59.6	0	0	0	111.4	E207 V208 L214 I217 A222 A223 K228 T229 V230	E207-L226 HydrophobicContact CB-CD1 3.71Å; E207-L226 HydrophobicContact CB-CD2 4.36Å; V208-L226 HydrophobicContact CG1-CD1 3.96Å; L214-L226 HydrophobicContact CD2-CD2 3.74Å; I217-L226 HydrophobicContact CD1-CD2 4.32Å; I217-L226 HydrophobicContact CG1-CD2 4.19Å; A222-L226 WeakPolarHBondContact O-CB 3.37Å; A222-L226 PolarHBondContact O-N 3.34Å; A223-L226 PolarHBondContact O-N 2.9Å; L226-K228 VanDerWaalsContact C-N 3.3Å; L226-K228 PolarHBondContact O-N 3.25Å; L226-T229 CarbonylContact O-C 3.6Å; L226-T229 PolarHBondContact O-N 3.43Å; L226-T229 VanDerWaalsContact O-N 3.08Å; L226-V230 HydrophobicContact CD1-CG2 4.2Å; L226-V230 HydrophobicContact CG-CG2 4.26Å; L226-V230 WeakPolarHBondContact O-CG2 3.32Å; L226-V230 PolarHBondContact O-N 3.02Å
227	S	95.1	Very high	94.5	Very high	66 Å²	66	81.3 Å²	81.3	46%	0.462	42%	0.424	S	S	.	.	H	α-helix	trans	-54.9	-46	176.5	-172.7	0	0	0	0	111.6	A223 R225 T229 V230 D231	A223-S227 WeakPolarHBondContact O-CB 3.27Å; A223-S227 PolarHBondContact O-N 3.04Å; R225-S227 VanDerWaalsContact C-N 3.35Å; R225-S227 PolarHBondContact O-N 3.32Å; S227-T229 PolarHBondContact O-N 3.34Å; S227-V230 PolarHBondContact O-N 3.02Å; S227-D231 PolarHBondContact O-N 3.18Å
228	K	95.9	Very high	94.7	Very high	135 Å²	135	81.6 Å²	81.6	59%	0.587	44%	0.435	S	S	*	.	H	α-helix	trans	-61.6	-43.1	176	-71.3	175.3	-178	175.4	0	112	E224 R225 L226 V230 D231 E232	E224-K228 WeakPolarHBondContact O-CG 3.41Å; E224-K228 PolarHBondContact O-N 3.41Å; R225-K228 PolarHBondContact O-N 3.23Å; L226-K228 VanDerWaalsContact C-N 3.3Å; L226-K228 PolarHBondContact O-N 3.25Å; K228-V230 VanDerWaalsContact C-N 3.35Å; K228-D231 PolarHBondContact O-N 3.42Å; K228-E232 WeakPolarHBondContact O-CG 3.26Å; K228-E232 PolarHBondContact O-N 2.89Å
229	T	95	Very high	94.6	Very high	49 Å²	49	81 Å²	81	30%	0.301	42%	0.423	S	S	.	.	H	α-helix	trans	-65.3	-37.8	177.5	-47.9	0	0	0	0	112.1	P205 V208 R225 L226 S227 A233	P205-T229 HydrophobicContact CG-CG2 4Å; V208-T229 HydrophobicContact CG1-CG2 3.78Å; R225-T229 PolarHBondContact O-N 3.33Å; R225-T229 VanDerWaalsContact O-N 3.16Å; R225-T229 PolarHBondContact O-OG1 3.39Å; R225-T229 VanDerWaalsContact O-OG1 3.11Å; L226-T229 CarbonylContact O-C 3.6Å; L226-T229 PolarHBondContact O-N 3.43Å; L226-T229 VanDerWaalsContact O-N 3.08Å; S227-T229 PolarHBondContact O-N 3.34Å; T229-A233 VanDerWaalsContact O-CB 3.27Å; T229-A233 WeakPolarHBondContact O-CB 3.35Å; T229-A233 PolarHBondContact O-N 3.34Å
230	V	96.2	Very high	94.5	Very high	46 Å²	46	78.9 Å²	78.9	28%	0.279	41%	0.41	S	S	.	.	H	α-helix	trans	-63.6	-44.9	174.3	171.7	0	0	0	0	110.8	V208 L226 S227 K228 E232 A233 C234	V208-V230 HydrophobicContact CB-CG2 4Å; V208-V230 HydrophobicContact CG1-CG2 3.79Å; L226-V230 HydrophobicContact CD1-CG2 4.2Å; L226-V230 HydrophobicContact CG-CG2 4.26Å; L226-V230 WeakPolarHBondContact O-CG2 3.32Å; L226-V230 PolarHBondContact O-N 3.02Å; S227-V230 PolarHBondContact O-N 3.02Å; K228-V230 VanDerWaalsContact C-N 3.35Å; V230-E232 PolarHBondContact O-N 3.01Å; V230-A233 PolarHBondContact O-N 3.46Å; V230-C234 WeakPolarHBondContact O-CB 3.44Å; V230-C234 PolarHBondContact O-N 3.03Å; V230-C234 PolarHBondContact O-SG 2.85Å
231	D	96.3	Very high	94.5	Very high	104 Å²	104	75.7 Å²	75.7	56%	0.556	40%	0.4	S	S	*	.	H	α-helix	trans	-61.7	-44.5	178.4	-70.6	-27.6	0	0	0	111.5	S227 K228 C234 L235	S227-D231 PolarHBondContact O-N 3.18Å; K228-D231 PolarHBondContact O-N 3.42Å; D231-C234 PolarHBondContact O-N 3.21Å; D231-L235 PolarHBondContact O-N 3.42Å
232	E	94.6	Very high	94.3	Very high	138 Å²	138	71.4 Å²	71.4	65%	0.645	39%	0.392	S	S	*	.	H	α-helix	trans	-62.4	-43.6	175.1	-72.2	174.7	-166.3	0	0	112	K228 V230 L235 L236	K228-E232 WeakPolarHBondContact O-CG 3.26Å; K228-E232 PolarHBondContact O-N 2.89Å; V230-E232 PolarHBondContact O-N 3.01Å; E232-L235 PolarHBondContact O-N 2.83Å; E232-L236 WeakPolarHBondContact O-CB 3.31Å; E232-L236 PolarHBondContact O-N 2.99Å
233	A	95.8	Very high	94.2	Very high	7 Å²	7	75.4 Å²	75.4	6%	0.058	40%	0.404	C	S	.	.	H	α-helix	trans	-63.5	-42.4	177	0	0	0	0	0	112.1	L204 V208 T229 V230 L236 L237	L204-A233 HydrophobicContact CD1-CB 3.95Å; L204-A233 HydrophobicContact CD2-CB 3.79Å; V208-A233 HydrophobicContact CG2-CB 4.31Å; T229-A233 VanDerWaalsContact O-CB 3.27Å; T229-A233 WeakPolarHBondContact O-CB 3.35Å; T229-A233 PolarHBondContact O-N 3.34Å; V230-A233 PolarHBondContact O-N 3.46Å; A233-L236 PolarHBondContact O-N 3.11Å; A233-L237 WeakPolarHBondContact O-CB 3.37Å; A233-L237 WeakPolarHBondContact O-CG 3.11Å; A233-L237 PolarHBondContact O-N 2.78Å
234	C	95.2	Very high	94.1	Very high	73 Å²	73	75.6 Å²	75.6	49%	0.493	40%	0.399	S	S	.	.	H	α-helix	trans	-60.8	-46	176.7	-72.4	0	0	0	0	111.4	V230 D231 A238	V230-C234 WeakPolarHBondContact O-CB 3.44Å; V230-C234 PolarHBondContact O-N 3.03Å; V230-C234 PolarHBondContact O-SG 2.85Å; D231-C234 PolarHBondContact O-N 3.21Å; C234-A238 VanDerWaalsContact O-CB 3.3Å; C234-A238 WeakPolarHBondContact O-CB 3.28Å; C234-A238 PolarHBondContact O-N 2.8Å
235	L	94.6	Very high	93.9	Very high	108 Å²	108	73.9 Å²	73.9	57%	0.565	40%	0.4	S	S	*	.	H	α-helix	trans	-63.1	-46.8	178.1	-171.9	69.7	0	0	0	111.2	D231 E232 L237 A238 E239	D231-L235 PolarHBondContact O-N 3.42Å; E232-L235 PolarHBondContact O-N 2.83Å; L235-L237 PolarHBondContact O-N 3.02Å; L235-A238 PolarHBondContact O-N 2.83Å; L235-E239 WeakPolarHBondContact O-CG 3.43Å; L235-E239 PolarHBondContact O-N 3.47Å
236	L	93.9	Very high	93.6	Very high	37 Å²	37	69.5 Å²	69.5	19%	0.194	40%	0.395	C	S	.	.	H	α-helix	trans	-58.8	-46.4	178.7	-178.8	65.1	0	0	0	112.1	V197 K200 I201 E232 A233 Y240	V197-L236 HydrophobicContact CG1-CD1 4.06Å; K200-L236 HydrophobicContact CB-CD2 4.06Å; I201-L236 HydrophobicContact CG1-CD2 3.76Å; I201-L236 HydrophobicContact CG1-CG 3.94Å; E232-L236 WeakPolarHBondContact O-CB 3.31Å; E232-L236 PolarHBondContact O-N 2.99Å; A233-L236 PolarHBondContact O-N 3.11Å; L236-Y240 WeakPolarHBondContact O-CB 3.48Å; L236-Y240 PolarHBondContact O-N 3.19Å
237	L	94.8	Very high	93.4	Very high	66 Å²	66	68.6 Å²	68.6	35%	0.346	39%	0.39	S	S	.	.	H	α-helix	trans	-66.5	-40.9	178.4	-76.3	168.8	0	0	0	111.9	I201 A233 L235 Y240 N241	I201-L237 HydrophobicContact CD1-CD2 4.29Å; I201-L237 HydrophobicContact CG1-CD2 4.33Å; I201-L237 HydrophobicContact CG2-CD2 3.79Å; A233-L237 WeakPolarHBondContact O-CB 3.37Å; A233-L237 WeakPolarHBondContact O-CG 3.11Å; A233-L237 PolarHBondContact O-N 2.78Å; L235-L237 PolarHBondContact O-N 3.02Å; L237-Y240 PolarHBondContact O-N 3Å; L237-N241 VanDerWaalsContact O-CB 3.24Å; L237-N241 WeakPolarHBondContact O-CB 3.47Å; L237-N241 PolarHBondContact O-N 3.31Å; L237-N241 PolarHBondContact O-ND2 3.04Å
238	A	93.7	Very high	93.2	Very high	63 Å²	63	69.3 Å²	69.3	52%	0.521	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-45.2	177.4	0	0	0	0	0	111.8	C234 L235 G242	C234-A238 VanDerWaalsContact O-CB 3.3Å; C234-A238 WeakPolarHBondContact O-CB 3.28Å; C234-A238 PolarHBondContact O-N 2.8Å; L235-A238 PolarHBondContact O-N 2.83Å; A238-G242 PolarHBondContact O-N 3.32Å
239	E	90.3	Very high	92.9	Very high	119 Å²	119	66.8 Å²	66.8	56%	0.556	38%	0.379	S	S	*	.	H	α-helix	trans	-63	-45.8	175.9	-72.8	-176.3	172.3	0	0	111.8	L235 G242 R243	L235-E239 WeakPolarHBondContact O-CG 3.43Å; L235-E239 PolarHBondContact O-N 3.47Å; E239-G242 PolarHBondContact O-N 3.27Å; E239-R243 WeakPolarHBondContact O-CG 3.4Å; E239-R243 PolarHBondContact O-N 3.43Å
240	Y	93.6	Very high	92.6	Very high	29 Å²	29	68.8 Å²	68.8	11%	0.114	39%	0.388	C	S	.	.	H	α-helix	trans	-64.9	-44.7	179.2	-176.7	-102.6	0	0	0	112.1	A191 V197 R198 I201 L236 L237 G242 R243 L244	A191-Y240 HydrophobicContact CB-CE2 4.48Å; V197-Y240 HydrophobicContact CB-CD2 4.35Å; V197-Y240 HydrophobicContact CG1-CD2 3.51Å; V197-Y240 HydrophobicContact CG1-CE2 4.24Å; V197-Y240 HydrophobicContact CG1-CG 4.13Å; R198-Y240 WeakPolarHBondContact CD-OH 3.3Å; R198-Y240 HydrophobicContact CG-CE2 3.96Å; R198-Y240 WeakPolarHBondContact CG-OH 3.36Å; I201-Y240 HydrophobicContact CD1-CD1 3.64Å; I201-Y240 HydrophobicContact CD1-CD2 4.07Å; I201-Y240 HydrophobicContact CD1-CE1 4.27Å; I201-Y240 HydrophobicContact CD1-CG 3.52Å; L236-Y240 WeakPolarHBondContact O-CB 3.48Å; L236-Y240 PolarHBondContact O-N 3.19Å; L237-Y240 PolarHBondContact O-N 3Å; Y240-G242 VanDerWaalsContact C-N 3.32Å; Y240-G242 PolarHBondContact O-N 3.29Å; Y240-R243 PolarHBondContact O-N 3.02Å; Y240-L244 HydrophobicContact CE1-CD2 4.3Å; Y240-L244 WeakPolarHBondContact O-CB 3.35Å; Y240-L244 PolarHBondContact O-N 3.46Å
241	N	93.2	Very high	92.4	Very high	92 Å²	92	72 Å²	72	49%	0.492	40%	0.395	S	S	.	.	H	α-helix	trans	-63.2	-38.2	177	-72.3	-12.5	0	0	0	111.8	L237 L244 A245	L237-N241 VanDerWaalsContact O-CB 3.24Å; L237-N241 WeakPolarHBondContact O-CB 3.47Å; L237-N241 PolarHBondContact O-N 3.31Å; L237-N241 PolarHBondContact O-ND2 3.04Å; N241-L244 PolarHBondContact O-N 2.9Å; N241-A245 WeakPolarHBondContact O-CB 3.28Å; N241-A245 PolarHBondContact O-N 3.27Å
242	G	91.5	Very high	92.3	Very high	45 Å²	45	73.2 Å²	73.2	46%	0.464	39%	0.392	S	S	.	.	H	α-helix	trans	-61.9	-45.2	173.4	0	0	0	0	0	112.5	A238 E239 Y240 A245 A246	A238-G242 PolarHBondContact O-N 3.32Å; E239-G242 PolarHBondContact O-N 3.27Å; Y240-G242 VanDerWaalsContact C-N 3.32Å; Y240-G242 PolarHBondContact O-N 3.29Å; G242-A245 PolarHBondContact O-N 3.47Å; G242-A246 PolarHBondContact O-N 3.07Å; G242-A246 VanDerWaalsContact O-N 3.13Å
243	R	90.3	Very high	92	Very high	99 Å²	99	71.5 Å²	71.5	37%	0.374	38%	0.384	S	S	.	.	H	α-helix	trans	-64.1	-41.1	175	-72.1	177.3	61.6	-167.4	-2.5	112.3	A191 D194 E239 Y240 A246 E247	A191-R243 HydrophobicContact CB-CB 3.73Å; D194-R243 IonicContact OD2-CZ 3.6Å; D194-R243 IonicContact OD2-NH1 3.3Å; D194-R243 PolarHBondContact OD2-NH1 3.04Å; D194-R243 IonicContact OD2-NH2 3.22Å; D194-R243 PolarHBondContact OD2-NH2 3.17Å; E239-R243 WeakPolarHBondContact O-CG 3.4Å; E239-R243 PolarHBondContact O-N 3.43Å; Y240-R243 PolarHBondContact O-N 3.02Å; R243-A246 PolarHBondContact O-N 3.15Å; R243-E247 PolarHBondContact O-N 2.9Å
244	L	92.1	Very high	91.8	Very high	49 Å²	49	71.9 Å²	71.9	26%	0.257	38%	0.384	S	S	.	.	H	α-helix	trans	-66.4	-39.3	178.6	-172.2	63.8	0	0	0	111.4	Y240 N241 E247 L248	Y240-L244 HydrophobicContact CE1-CD2 4.3Å; Y240-L244 WeakPolarHBondContact O-CB 3.35Å; Y240-L244 PolarHBondContact O-N 3.46Å; N241-L244 PolarHBondContact O-N 2.9Å; L244-E247 PolarHBondContact O-N 3.35Å; L244-L248 WeakPolarHBondContact O-CG 3.34Å; L244-L248 PolarHBondContact O-N 2.98Å
245	A	91.6	Very high	91.7	Very high	58 Å²	58	70.8 Å²	70.8	48%	0.479	38%	0.381	S	S	.	.	H	α-helix	trans	-63.3	-40.6	174.9	0	0	0	0	0	112.4	N241 G242 L248 E249	N241-A245 WeakPolarHBondContact O-CB 3.28Å; N241-A245 PolarHBondContact O-N 3.27Å; G242-A245 PolarHBondContact O-N 3.47Å; A245-L248 PolarHBondContact O-N 3.43Å; A245-E249 PolarHBondContact O-N 3.04Å
246	A	87.9	Confident	91.5	Very high	52 Å²	52	72.1 Å²	72.1	43%	0.43	38%	0.378	S	S	.	.	H	α-helix	trans	-62.9	-47.3	173.6	0	0	0	0	0	111.4	G242 R243 L248 E249 D250	G242-A246 PolarHBondContact O-N 3.07Å; G242-A246 VanDerWaalsContact O-N 3.13Å; R243-A246 PolarHBondContact O-N 3.15Å; A246-L248 VanDerWaalsContact C-N 3.29Å; A246-L248 PolarHBondContact O-N 2.98Å; A246-E249 PolarHBondContact O-N 2.98Å; A246-D250 PolarHBondContact O-N 3.34Å
247	E	90.5	Very high	91.3	Very high	5 Å²	5	72 Å²	72	2%	0.023	38%	0.377	C	S	.	.	H	α-helix	trans	-56.6	-41.9	175.2	173.5	-178.1	171.8	0	0	112.1	L187 A190 A191 S192 R243 L244 E249 D250 R251	L187-E247 HydrophobicContact CD1-CG 4.07Å; A190-E247 HydrophobicContact CB-CB 4.26Å; A190-E247 HydrophobicContact CB-CG 3.66Å; A191-E247 WeakPolarHBondContact CB-OE2 3.31Å; A191-E247 PolarHBondContact N-OE2 3.2Å; S192-E247 WeakPolarHBondContact CB-OE1 3.49Å; S192-E247 WeakPolarHBondContact CB-OE2 3.48Å; S192-E247 PolarHBondContact N-OE2 3.18Å; S192-E247 PolarHBondContact OG-OE1 3.2Å; S192-E247 PolarHBondContact OG-OE2 3.47Å; R243-E247 PolarHBondContact O-N 2.9Å; L244-E247 PolarHBondContact O-N 3.35Å; E247-E249 VanDerWaalsContact C-N 3.27Å; E247-E249 PolarHBondContact O-N 2.94Å; E247-D250 PolarHBondContact O-N 3.46Å; E247-R251 HydrophobicContact CG-CG 4.31Å; E247-R251 WeakPolarHBondContact O-CB 3.39Å; E247-R251 VanDerWaalsContact O-CG 3.31Å; E247-R251 WeakPolarHBondContact O-CG 3.48Å; E247-R251 PolarHBondContact O-N 3.29Å; E247-R251 IonicContact OE1-CZ 3.22Å; E247-R251 IonicContact OE1-NE 3.04Å; E247-R251 PolarHBondContact OE1-NE 3.16Å; E247-R251 IonicContact OE1-NH2 3.38Å; E247-R251 PolarHBondContact OE1-NH2 3.38Å
248	L	90.8	Very high	91.2	Very high	81 Å²	81	72.2 Å²	72.2	42%	0.424	38%	0.379	S	S	.	.	H	α-helix	trans	-62.1	-36.3	178.2	-72.8	175.9	0	0	0	112	L244 A245 A246 R252	L244-L248 WeakPolarHBondContact O-CG 3.34Å; L244-L248 PolarHBondContact O-N 2.98Å; A245-L248 PolarHBondContact O-N 3.43Å; A246-L248 VanDerWaalsContact C-N 3.29Å; A246-L248 PolarHBondContact O-N 2.98Å; L248-R252 WeakPolarHBondContact O-CG 3.48Å; L248-R252 PolarHBondContact O-N 3.45Å; L248-R252 VanDerWaalsContact O-N 3.1Å
249	E	89.7	Confident	91.1	Very high	82 Å²	82	74.3 Å²	74.3	38%	0.383	39%	0.385	S	S	.	.	H	α-helix	trans	-70.8	-42.9	175.3	-169.5	53.7	-143.4	0	0	111.8	A245 A246 E247 R251 R252 Q253 R256	A245-E249 PolarHBondContact O-N 3.04Å; A246-E249 PolarHBondContact O-N 2.98Å; E247-E249 VanDerWaalsContact C-N 3.27Å; E247-E249 PolarHBondContact O-N 2.94Å; E249-R251 VanDerWaalsContact C-N 3.28Å; E249-R251 PolarHBondContact O-N 2.99Å; E249-R252 WeakPolarHBondContact O-CB 3.43Å; E249-R252 PolarHBondContact O-N 3.47Å; E249-R252 IonicContact OE2-CZ 2.76Å; E249-R252 IonicContact OE2-NH1 3.2Å; E249-R252 PolarHBondContact OE2-NH1 3.33Å; E249-Q253 PolarHBondContact O-N 3.19Å; E249-R256 IonicContact OE1-NH2 2.68Å
250	D	87.7	Confident	91	Very high	92 Å²	92	73.9 Å²	73.9	49%	0.492	38%	0.382	S	S	.	.	H	α-helix	trans	-58.8	-41.2	174.7	-64.5	-24.7	0	0	0	111	A246 E247 R252 Q253 L254	A246-D250 PolarHBondContact O-N 3.34Å; E247-D250 PolarHBondContact O-N 3.46Å; D250-R252 PolarHBondContact O-N 3.03Å; D250-Q253 PolarHBondContact O-N 3.42Å; D250-L254 WeakPolarHBondContact O-CB 3.4Å; D250-L254 PolarHBondContact O-N 3.22Å
251	R	93.3	Very high	90.9	Very high	113 Å²	113	74.9 Å²	74.9	43%	0.426	39%	0.386	S	S	.	.	H	α-helix	trans	-63.3	-38.7	174.1	-75	179.9	180	-80.4	-4.4	112.8	L187 E247 E249 A255	L187-R251 HydrophobicContact CD1-CG 3.56Å; L187-R251 HydrophobicContact CD2-CG 3.96Å; L187-R251 HydrophobicContact CG-CG 4.42Å; E247-R251 HydrophobicContact CG-CG 4.31Å; E247-R251 WeakPolarHBondContact O-CB 3.39Å; E247-R251 VanDerWaalsContact O-CG 3.31Å; E247-R251 WeakPolarHBondContact O-CG 3.48Å; E247-R251 PolarHBondContact O-N 3.29Å; E247-R251 IonicContact OE1-CZ 3.22Å; E247-R251 IonicContact OE1-NE 3.04Å; E247-R251 PolarHBondContact OE1-NE 3.16Å; E247-R251 IonicContact OE1-NH2 3.38Å; E247-R251 PolarHBondContact OE1-NH2 3.38Å; E249-R251 VanDerWaalsContact C-N 3.28Å; E249-R251 PolarHBondContact O-N 2.99Å; R251-A255 WeakPolarHBondContact O-CB 3.48Å; R251-A255 PolarHBondContact O-N 3.41Å
252	R	92.6	Very high	90.8	Very high	130 Å²	130	74 Å²	74	49%	0.491	38%	0.384	S	S	.	.	H	α-helix	trans	-66.4	-40.7	174.9	-72	177.2	-161.4	118.2	5.5	111.3	L248 E249 D250 A255 R256	L248-R252 WeakPolarHBondContact O-CG 3.48Å; L248-R252 PolarHBondContact O-N 3.45Å; L248-R252 VanDerWaalsContact O-N 3.1Å; E249-R252 WeakPolarHBondContact O-CB 3.43Å; E249-R252 PolarHBondContact O-N 3.47Å; E249-R252 IonicContact OE2-CZ 2.76Å; E249-R252 IonicContact OE2-NH1 3.2Å; E249-R252 PolarHBondContact OE2-NH1 3.33Å; D250-R252 PolarHBondContact O-N 3.03Å; R252-A255 PolarHBondContact O-N 3.13Å; R252-R256 PolarHBondContact O-N 3.26Å; R252-R256 VanDerWaalsContact O-N 3.16Å
253	Q	88.9	Confident	90.7	Very high	102 Å²	102	76.1 Å²	76.1	48%	0.477	38%	0.382	S	S	.	.	H	α-helix	trans	-63.8	-47.4	175.2	-178.5	172.9	-9.4	0	0	111.3	E249 D250 A255 R256 M257	E249-Q253 PolarHBondContact O-N 3.19Å; D250-Q253 PolarHBondContact O-N 3.42Å; Q253-A255 VanDerWaalsContact C-N 3.3Å; Q253-A255 PolarHBondContact O-N 2.69Å; Q253-R256 WeakPolarHBondContact O-CB 3.43Å; Q253-R256 PolarHBondContact O-N 3.39Å; Q253-R256 VanDerWaalsContact O-N 3.13Å; Q253-M257 HydrophobicContact CG-SD 4.29Å; Q253-M257 WeakPolarHBondContact O-CG 3.41Å; Q253-M257 PolarHBondContact O-N 2.91Å
254	L	91.8	Very high	90.6	Very high	14 Å²	14	74.1 Å²	74.1	7%	0.073	38%	0.379	C	S	.	.	H	α-helix	trans	-59.6	-41	176.4	-179.8	66.4	0	0	0	111.7	L180 A183 L184 L187 D250 R256 M257 L258	L180-L254 HydrophobicContact CD1-CD1 3.64Å; A183-L254 HydrophobicContact CB-CD1 3.84Å; L184-L254 HydrophobicContact CD2-CD1 4.05Å; L184-L254 HydrophobicContact CD2-CD2 3.85Å; L184-L254 HydrophobicContact CG-CD1 4.1Å; L187-L254 HydrophobicContact CD2-CD2 3.43Å; L187-L254 VanDerWaalsContact CD2-CD2 3.43Å; D250-L254 WeakPolarHBondContact O-CB 3.4Å; D250-L254 PolarHBondContact O-N 3.22Å; L254-R256 VanDerWaalsContact C-N 3.31Å; L254-R256 PolarHBondContact O-N 3.47Å; L254-M257 PolarHBondContact O-N 2.68Å; L254-L258 HydrophobicContact CD1-CG 4.37Å; L254-L258 HydrophobicContact CG-CD1 4.07Å; L254-L258 HydrophobicContact CG-CG 4.38Å; L254-L258 WeakPolarHBondContact O-CB 3.45Å; L254-L258 WeakPolarHBondContact O-CG 3.28Å; L254-L258 PolarHBondContact O-N 3.49Å
255	A	93.3	Very high	90.6	Very high	51 Å²	51	75.6 Å²	75.6	42%	0.421	38%	0.384	S	S	.	.	H	α-helix	trans	-59.4	-41.5	175.8	0	0	0	0	0	112.1	R251 R252 Q253 L258 V259	R251-A255 WeakPolarHBondContact O-CB 3.48Å; R251-A255 PolarHBondContact O-N 3.41Å; R252-A255 PolarHBondContact O-N 3.13Å; Q253-A255 VanDerWaalsContact C-N 3.3Å; Q253-A255 PolarHBondContact O-N 2.69Å; A255-L258 PolarHBondContact O-N 2.95Å; A255-V259 WeakPolarHBondContact O-CG2 3.46Å; A255-V259 PolarHBondContact O-N 3.4Å; A255-V259 VanDerWaalsContact O-N 3.16Å
256	R	90.8	Very high	90.6	Very high	135 Å²	135	78.7 Å²	78.7	51%	0.509	39%	0.387	S	S	.	.	H	α-helix	trans	-62.8	-47.1	173.5	-69.1	-175.9	-68.2	-95.2	5.6	111.5	E249 R252 Q253 L254 L258 V259 E260	E249-R256 IonicContact OE1-NH2 2.68Å; R252-R256 PolarHBondContact O-N 3.26Å; R252-R256 VanDerWaalsContact O-N 3.16Å; Q253-R256 WeakPolarHBondContact O-CB 3.43Å; Q253-R256 PolarHBondContact O-N 3.39Å; Q253-R256 VanDerWaalsContact O-N 3.13Å; L254-R256 VanDerWaalsContact C-N 3.31Å; L254-R256 PolarHBondContact O-N 3.47Å; R256-L258 VanDerWaalsContact C-N 3.31Å; R256-L258 PolarHBondContact O-N 3.16Å; R256-V259 PolarHBondContact O-N 3.23Å; R256-E260 PolarHBondContact O-N 3.29Å
257	M	89.5	Confident	90.7	Very high	35 Å²	35	80.1 Å²	80.1	17%	0.172	39%	0.388	C	S	.	.	H	α-helix	trans	-59.2	-40.7	177.7	-67.7	174.4	70.3	0	0	112.1	E179 L180 A183 Q253 L254 E260 Y261	E179-M257 HydrophobicContact CB-CE 3.98Å; L180-M257 HydrophobicContact CB-CE 4.45Å; L180-M257 HydrophobicContact CD1-CB 4.17Å; A183-M257 HydrophobicContact CB-CE 4.04Å; A183-M257 HydrophobicContact CB-SD 3.97Å; Q253-M257 HydrophobicContact CG-SD 4.29Å; Q253-M257 WeakPolarHBondContact O-CG 3.41Å; Q253-M257 PolarHBondContact O-N 2.91Å; L254-M257 PolarHBondContact O-N 2.68Å; M257-E260 PolarHBondContact O-N 3.21Å; M257-Y261 WeakPolarHBondContact O-CB 3.12Å; M257-Y261 PolarHBondContact O-N 2.82Å
258	L	92.3	Very high	90.7	Very high	71 Å²	71	82.7 Å²	82.7	37%	0.372	40%	0.403	S	S	.	.	H	α-helix	trans	-65.2	-40.4	178	-75.8	168.5	0	0	0	112.4	L180 L254 A255 R256 T262	L180-L258 HydrophobicContact CD1-CD2 3.84Å; L180-L258 HydrophobicContact CD1-CG 4.13Å; L180-L258 HydrophobicContact CD2-CD2 4.12Å; L254-L258 HydrophobicContact CD1-CG 4.37Å; L254-L258 HydrophobicContact CG-CD1 4.07Å; L254-L258 HydrophobicContact CG-CG 4.38Å; L254-L258 WeakPolarHBondContact O-CB 3.45Å; L254-L258 WeakPolarHBondContact O-CG 3.28Å; L254-L258 PolarHBondContact O-N 3.49Å; A255-L258 PolarHBondContact O-N 2.95Å; R256-L258 VanDerWaalsContact C-N 3.31Å; R256-L258 PolarHBondContact O-N 3.16Å; L258-T262 VanDerWaalsContact O-CB 3.27Å; L258-T262 WeakPolarHBondContact O-CB 3.25Å; L258-T262 PolarHBondContact O-N 3.44Å; L258-T262 PolarHBondContact O-OG1 3.4Å
259	V	91.9	Very high	90.8	Very high	107 Å²	107	83.6 Å²	83.6	65%	0.648	41%	0.408	S	S	*	.	H	α-helix	trans	-63.8	-48.5	176.5	171	0	0	0	0	110.5	A255 R256 T262 Q263	A255-V259 WeakPolarHBondContact O-CG2 3.46Å; A255-V259 PolarHBondContact O-N 3.4Å; A255-V259 VanDerWaalsContact O-N 3.16Å; R256-V259 PolarHBondContact O-N 3.23Å; V259-T262 PolarHBondContact O-N 2.95Å; V259-Q263 PolarHBondContact O-N 2.98Å
260	E	88	Confident	91	Very high	109 Å²	109	83.2 Å²	83.2	51%	0.509	42%	0.415	S	S	.	.	H	α-helix	trans	-62.2	-47.5	178.1	-174.2	175	-175.2	0	0	111.5	R256 M257 T262 Q263 N264	R256-E260 PolarHBondContact O-N 3.29Å; M257-E260 PolarHBondContact O-N 3.21Å; E260-T262 VanDerWaalsContact C-N 3.34Å; E260-T262 PolarHBondContact O-N 3.23Å; E260-Q263 PolarHBondContact O-N 3.38Å; E260-N264 PolarHBondContact O-N 3.4Å; E260-N264 PolarHBondContact O-OD1 3.43Å
261	Y	90.4	Very high	91.3	Very high	50 Å²	50	85.3 Å²	85.3	20%	0.196	42%	0.422	C	S	.	.	H	α-helix	trans	-59.8	-43.8	177.4	-167.7	-90.8	0	0	0	111.9	L176 T177 L180 M257 Q263 N264 Q265	L176-Y261 HydrophobicContact CB-CD2 4.16Å; L176-Y261 HydrophobicContact CB-CE2 4.31Å; T177-Y261 WeakPolarHBondContact OG1-CE2 3.29Å; T177-Y261 PolarHBondContact OG1-OH 3.4Å; L180-Y261 HydrophobicContact CD2-CD1 3.77Å; L180-Y261 HydrophobicContact CD2-CD2 3.83Å; L180-Y261 HydrophobicContact CD2-CE1 4.18Å; L180-Y261 HydrophobicContact CD2-CE2 4.25Å; L180-Y261 HydrophobicContact CD2-CG 3.58Å; M257-Y261 WeakPolarHBondContact O-CB 3.12Å; M257-Y261 PolarHBondContact O-N 2.82Å; Y261-Q263 VanDerWaalsContact C-N 3.33Å; Y261-Q263 PolarHBondContact O-N 3.08Å; Y261-N264 PolarHBondContact O-N 2.88Å; Y261-Q265 HydrophobicContact CD1-CG 3.75Å; Y261-Q265 HydrophobicContact CE1-CG 3.48Å; Y261-Q265 VanDerWaalsContact CE1-CG 3.48Å; Y261-Q265 WeakPolarHBondContact O-CB 3.3Å; Y261-Q265 VanDerWaalsContact O-CG 3.28Å; Y261-Q265 WeakPolarHBondContact O-CG 3.47Å; Y261-Q265 PolarHBondContact O-N 3.16Å; Y261-Q265 PolarHBondContact OH-NE2 3.37Å
262	T	91.3	Very high	91.2	Very high	73 Å²	73	86.4 Å²	86.4	45%	0.448	43%	0.429	S	S	.	.	H	α-helix	trans	-63.4	-40.2	178.1	-58.9	0	0	0	0	111.5	L258 V259 E260 Q265 K266	L258-T262 VanDerWaalsContact O-CB 3.27Å; L258-T262 WeakPolarHBondContact O-CB 3.25Å; L258-T262 PolarHBondContact O-N 3.44Å; L258-T262 PolarHBondContact O-OG1 3.4Å; V259-T262 PolarHBondContact O-N 2.95Å; E260-T262 VanDerWaalsContact C-N 3.34Å; E260-T262 PolarHBondContact O-N 3.23Å; T262-Q265 PolarHBondContact O-N 3.5Å; T262-K266 WeakPolarHBondContact O-CG 3.5Å; T262-K266 PolarHBondContact O-N 3.08Å; T262-K266 VanDerWaalsContact O-N 3.15Å
263	Q	90.1	Very high	91.4	Very high	91 Å²	91	85.8 Å²	85.8	43%	0.425	43%	0.432	S	S	.	.	H	α-helix	trans	-64.5	-47.2	176.4	-174.4	55.5	42.8	0	0	111	V259 E260 Y261 Q265 K266 D267	V259-Q263 PolarHBondContact O-N 2.98Å; E260-Q263 PolarHBondContact O-N 3.38Å; Y261-Q263 VanDerWaalsContact C-N 3.33Å; Y261-Q263 PolarHBondContact O-N 3.08Å; Q263-Q265 VanDerWaalsContact C-N 3.3Å; Q263-Q265 PolarHBondContact O-N 2.96Å; Q263-K266 WeakPolarHBondContact O-CB 3.48Å; Q263-K266 PolarHBondContact O-N 3.26Å; Q263-D267 PolarHBondContact NE2-OD1 3.25Å; Q263-D267 PolarHBondContact O-N 3.4Å
264	N	88.9	Confident	91.7	Very high	56 Å²	56	87.8 Å²	87.8	30%	0.299	44%	0.439	S	S	.	.	H	α-helix	trans	-61.6	-38.5	177.8	-68.4	15.1	0	0	0	112	L176 E260 Y261 K266 D267 V268	L176-N264 VanDerWaalsContact CD1-ND2 3.3Å; L176-N264 WeakPolarHBondContact CD1-ND2 3.3Å; E260-N264 PolarHBondContact O-N 3.4Å; E260-N264 PolarHBondContact O-OD1 3.43Å; Y261-N264 PolarHBondContact O-N 2.88Å; N264-K266 VanDerWaalsContact C-N 3.31Å; N264-K266 PolarHBondContact O-N 3.05Å; N264-D267 PolarHBondContact O-N 3.4Å; N264-V268 WeakPolarHBondContact O-CG2 3.13Å; N264-V268 PolarHBondContact O-N 2.88Å
265	Q	90.6	Very high	91.9	Very high	80 Å²	80	90.3 Å²	90.3	37%	0.374	45%	0.449	S	S	.	.	H	α-helix	trans	-65.5	-31.6	175.7	-72.1	-61.1	-47.9	0	0	112.8	Y261 T262 Q263 L269	Y261-Q265 HydrophobicContact CD1-CG 3.75Å; Y261-Q265 HydrophobicContact CE1-CG 3.48Å; Y261-Q265 VanDerWaalsContact CE1-CG 3.48Å; Y261-Q265 WeakPolarHBondContact O-CB 3.3Å; Y261-Q265 VanDerWaalsContact O-CG 3.28Å; Y261-Q265 WeakPolarHBondContact O-CG 3.47Å; Y261-Q265 PolarHBondContact O-N 3.16Å; Y261-Q265 PolarHBondContact OH-NE2 3.37Å; T262-Q265 PolarHBondContact O-N 3.5Å; Q263-Q265 VanDerWaalsContact C-N 3.3Å; Q263-Q265 PolarHBondContact O-N 2.96Å; Q265-L269 VanDerWaalsContact O-CB 3.31Å; Q265-L269 WeakPolarHBondContact O-CB 3.37Å; Q265-L269 PolarHBondContact O-N 3.4Å
266	K	93	Very high	92	Very high	123 Å²	123	92.5 Å²	92.5	54%	0.535	45%	0.454	S	S	.	.	H	α-helix	trans	-67	-41	173.1	-71.7	173.7	-179.7	176.3	0	111.8	T262 Q263 N264 L269 S270	T262-K266 WeakPolarHBondContact O-CG 3.5Å; T262-K266 PolarHBondContact O-N 3.08Å; T262-K266 VanDerWaalsContact O-N 3.15Å; Q263-K266 WeakPolarHBondContact O-CB 3.48Å; Q263-K266 PolarHBondContact O-N 3.26Å; N264-K266 VanDerWaalsContact C-N 3.31Å; N264-K266 PolarHBondContact O-N 3.05Å; K266-L269 WeakPolarHBondContact O-CB 3.45Å; K266-L269 PolarHBondContact O-N 3.32Å; K266-S270 PolarHBondContact O-N 2.91Å
267	D	90.1	Very high	92.3	Very high	82 Å²	82	90.3 Å²	90.3	44%	0.439	45%	0.449	S	S	.	.	H	α-helix	trans	-65.7	-45.3	177.8	-62	-24.6	0	0	0	110.5	Q263 N264 L269 S270 E271	Q263-D267 PolarHBondContact NE2-OD1 3.25Å; Q263-D267 PolarHBondContact O-N 3.4Å; N264-D267 PolarHBondContact O-N 3.4Å; D267-L269 VanDerWaalsContact C-N 3.33Å; D267-L269 PolarHBondContact O-N 3.04Å; D267-S270 WeakPolarHBondContact O-CB 3.4Å; D267-S270 PolarHBondContact O-N 3.3Å; D267-E271 PolarHBondContact O-N 3.21Å; D267-E271 VanDerWaalsContact O-N 3.08Å
268	V	89.8	Confident	92.6	Very high	59 Å²	59	93.3 Å²	93.3	36%	0.358	46%	0.463	S	S	.	.	H	α-helix	trans	-59.6	-41.8	173.4	173	0	0	0	0	111.5	N264 E271 K272	N264-V268 WeakPolarHBondContact O-CG2 3.13Å; N264-V268 PolarHBondContact O-N 2.88Å; V268-E271 PolarHBondContact O-N 3.35Å; V268-K272 HydrophobicContact CG1-CG 4.12Å; V268-K272 WeakPolarHBondContact O-CB 3.47Å; V268-K272 WeakPolarHBondContact O-CG 3.4Å; V268-K272 PolarHBondContact O-N 3.13Å
269	L	92.2	Very high	92.8	Very high	100 Å²	100	96.2 Å²	96.2	52%	0.524	47%	0.47	S	S	.	.	H	α-helix	trans	-59	-48.8	177.1	178.5	64.6	0	0	0	111.2	Q265 K266 D267 E271 K272 E273	Q265-L269 VanDerWaalsContact O-CB 3.31Å; Q265-L269 WeakPolarHBondContact O-CB 3.37Å; Q265-L269 PolarHBondContact O-N 3.4Å; K266-L269 WeakPolarHBondContact O-CB 3.45Å; K266-L269 PolarHBondContact O-N 3.32Å; D267-L269 VanDerWaalsContact C-N 3.33Å; D267-L269 PolarHBondContact O-N 3.04Å; L269-E271 VanDerWaalsContact C-N 3.34Å; L269-E271 PolarHBondContact O-N 2.96Å; L269-K272 PolarHBondContact O-N 3.11Å; L269-K272 VanDerWaalsContact O-N 3.16Å; L269-E273 HydrophobicContact CD1-CG 4.33Å; L269-E273 HydrophobicContact CG-CG 4.49Å; L269-E273 WeakPolarHBondContact O-CG 3.46Å; L269-E273 PolarHBondContact O-N 2.98Å
270	S	94.5	Very high	93	Very high	74 Å²	74	96.5 Å²	96.5	52%	0.517	46%	0.462	S	S	.	.	H	α-helix	trans	-57.5	-44.5	178	-179.9	0	0	0	0	112.3	K266 D267 K272 E273 K274	K266-S270 PolarHBondContact O-N 2.91Å; D267-S270 WeakPolarHBondContact O-CB 3.4Å; D267-S270 PolarHBondContact O-N 3.3Å; S270-K272 PolarHBondContact O-N 2.96Å; S270-E273 PolarHBondContact O-N 2.79Å; S270-K274 PolarHBondContact O-N 2.97Å
271	E	93.2	Very high	93.4	Very high	137 Å²	137	95.9 Å²	95.9	64%	0.64	46%	0.46	S	S	*	.	H	α-helix	trans	-63.3	-42.6	175.8	-70.8	-178.2	178.2	0	0	112.5	D267 V268 L269 K274 K275	D267-E271 PolarHBondContact O-N 3.21Å; D267-E271 VanDerWaalsContact O-N 3.08Å; V268-E271 PolarHBondContact O-N 3.35Å; L269-E271 VanDerWaalsContact C-N 3.34Å; L269-E271 PolarHBondContact O-N 2.96Å; E271-K274 PolarHBondContact O-N 3.49Å; E271-K275 WeakPolarHBondContact O-CB 3.18Å; E271-K275 PolarHBondContact O-N 3.37Å
272	K	92.6	Very high	93.7	Very high	135 Å²	135	99.4 Å²	99.4	59%	0.587	48%	0.476	S	S	*	.	H	α-helix	trans	-66.8	-38.4	179.2	-67	-74.7	-179	173.1	0	111.6	V268 L269 S270 K275 L276	V268-K272 HydrophobicContact CG1-CG 4.12Å; V268-K272 WeakPolarHBondContact O-CB 3.47Å; V268-K272 WeakPolarHBondContact O-CG 3.4Å; V268-K272 PolarHBondContact O-N 3.13Å; L269-K272 PolarHBondContact O-N 3.11Å; L269-K272 VanDerWaalsContact O-N 3.16Å; S270-K272 PolarHBondContact O-N 2.96Å; K272-K275 PolarHBondContact O-N 3.37Å; K272-L276 WeakPolarHBondContact O-CB 3.1Å; K272-L276 PolarHBondContact O-N 3.1Å
273	E	95.8	Very high	94	Very high	118 Å²	118	101.3 Å²	101.3	55%	0.551	48%	0.482	S	S	*	.	H	α-helix	trans	-62.7	-47.8	174.2	-74.6	179.4	155.4	0	0	111.5	L269 S270 K275 L276 E277	L269-E273 HydrophobicContact CD1-CG 4.33Å; L269-E273 HydrophobicContact CG-CG 4.49Å; L269-E273 WeakPolarHBondContact O-CG 3.46Å; L269-E273 PolarHBondContact O-N 2.98Å; S270-E273 PolarHBondContact O-N 2.79Å; E273-K275 VanDerWaalsContact C-N 3.32Å; E273-K275 PolarHBondContact O-N 2.91Å; E273-L276 WeakPolarHBondContact O-CB 3.42Å; E273-L276 PolarHBondContact O-N 3.26Å; E273-E277 PolarHBondContact O-N 3.47Å; E273-E277 VanDerWaalsContact O-N 3.08Å
274	K	96.5	Very high	94.3	Very high	143 Å²	143	99.8 Å²	99.8	62%	0.622	49%	0.486	S	S	*	.	H	α-helix	trans	-57.3	-46.3	174.7	-177.3	-177.4	174.4	-174.6	0	111.4	S270 E271 L276 E277 E278	S270-K274 PolarHBondContact O-N 2.97Å; E271-K274 PolarHBondContact O-N 3.49Å; K274-L276 VanDerWaalsContact C-N 3.35Å; K274-L276 PolarHBondContact O-N 3.21Å; K274-E277 WeakPolarHBondContact O-CB 3.42Å; K274-E277 PolarHBondContact O-N 2.94Å; K274-E278 WeakPolarHBondContact O-CG 2.97Å; K274-E278 PolarHBondContact O-N 2.84Å
275	K	94.9	Very high	94.7	Very high	67 Å²	67	103.6 Å²	103.6	29%	0.291	50%	0.496	S	S	.	.	H	α-helix	trans	-65.9	-36.4	180	-164.3	173	-174.2	174.4	0	112.6	P167 E271 K272 E273 E277 E278 Y279	P167-K275 VanDerWaalsContact CG-NZ 3.26Å; E271-K275 WeakPolarHBondContact O-CB 3.18Å; E271-K275 PolarHBondContact O-N 3.37Å; K272-K275 PolarHBondContact O-N 3.37Å; E273-K275 VanDerWaalsContact C-N 3.32Å; E273-K275 PolarHBondContact O-N 2.91Å; K275-E277 VanDerWaalsContact C-N 3.31Å; K275-E277 PolarHBondContact O-N 3.26Å; K275-E278 WeakPolarHBondContact O-CB 3.47Å; K275-E278 PolarHBondContact O-N 3.41Å; K275-Y279 HydrophobicContact CD-CE2 4.12Å; K275-Y279 WeakPolarHBondContact CE-OH 3.42Å; K275-Y279 HydrophobicContact CG-CD2 4.11Å; K275-Y279 HydrophobicContact CG-CE2 3.66Å; K275-Y279 WeakPolarHBondContact O-CD2 3.5Å; K275-Y279 PolarHBondContact O-N 3.25Å
276	L	95.1	Very high	95	Very high	97 Å²	97	104 Å²	104	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-61.4	-41.7	173.4	177.5	62.7	0	0	0	111.2	K272 E273 K274 Y279 K280	K272-L276 WeakPolarHBondContact O-CB 3.1Å; K272-L276 PolarHBondContact O-N 3.1Å; E273-L276 WeakPolarHBondContact O-CB 3.42Å; E273-L276 PolarHBondContact O-N 3.26Å; K274-L276 VanDerWaalsContact C-N 3.35Å; K274-L276 PolarHBondContact O-N 3.21Å; L276-Y279 PolarHBondContact O-N 3.03Å; L276-K280 WeakPolarHBondContact O-CG 3.5Å; L276-K280 PolarHBondContact O-N 3.19Å
277	E	96.9	Very high	95.1	Very high	90 Å²	90	100 Å²	100	42%	0.421	49%	0.489	S	S	.	.	H	α-helix	trans	-65.1	-40.5	177.4	-166.9	54	-144	0	0	111.9	E273 K274 K275 Y279 K280 Q281	E273-E277 PolarHBondContact O-N 3.47Å; E273-E277 VanDerWaalsContact O-N 3.08Å; K274-E277 WeakPolarHBondContact O-CB 3.42Å; K274-E277 PolarHBondContact O-N 2.94Å; K275-E277 VanDerWaalsContact C-N 3.31Å; K275-E277 PolarHBondContact O-N 3.26Å; E277-Y279 VanDerWaalsContact C-N 3.33Å; E277-Y279 PolarHBondContact O-N 3.36Å; E277-K280 PolarHBondContact O-N 3.46Å; E277-K280 IonicContact OE2-NZ 2.7Å; E277-Q281 WeakPolarHBondContact O-CG 3.4Å; E277-Q281 PolarHBondContact O-N 3.01Å
278	E	96.6	Very high	95.5	Very high	97 Å²	97	101.8 Å²	101.8	45%	0.453	50%	0.495	S	S	.	.	H	α-helix	trans	-58.6	-42.6	171.9	-68.4	171	-173.1	0	0	112.1	K274 K275 Q281 K282	K274-E278 WeakPolarHBondContact O-CG 2.97Å; K274-E278 PolarHBondContact O-N 2.84Å; K275-E278 WeakPolarHBondContact O-CB 3.47Å; K275-E278 PolarHBondContact O-N 3.41Å; E278-Q281 PolarHBondContact O-N 3.11Å; E278-K282 PolarHBondContact O-N 3.4Å
279	Y	95.8	Very high	95.8	Very high	132 Å²	132	103.6 Å²	103.6	52%	0.518	51%	0.506	S	S	.	.	H	α-helix	trans	-66.8	-37.6	175.9	-76.2	-58.9	0	0	0	112.8	K275 L276 E277 K282 L283	K275-Y279 HydrophobicContact CD-CE2 4.12Å; K275-Y279 WeakPolarHBondContact CE-OH 3.42Å; K275-Y279 HydrophobicContact CG-CD2 4.11Å; K275-Y279 HydrophobicContact CG-CE2 3.66Å; K275-Y279 WeakPolarHBondContact O-CD2 3.5Å; K275-Y279 PolarHBondContact O-N 3.25Å; L276-Y279 PolarHBondContact O-N 3.03Å; E277-Y279 VanDerWaalsContact C-N 3.33Å; E277-Y279 PolarHBondContact O-N 3.36Å; Y279-K282 PolarHBondContact O-N 3.07Å; Y279-L283 WeakPolarHBondContact O-CB 3.37Å; Y279-L283 PolarHBondContact O-N 3.49Å
280	K	97.1	Very high	96	Very high	113 Å²	113	106.7 Å²	106.7	49%	0.491	51%	0.511	S	S	.	.	H	α-helix	trans	-62.3	-43.5	173.3	-74.7	177.4	-178.1	171.1	0	111.5	L276 E277 K282 L283 A284	L276-K280 WeakPolarHBondContact O-CG 3.5Å; L276-K280 PolarHBondContact O-N 3.19Å; E277-K280 PolarHBondContact O-N 3.46Å; E277-K280 IonicContact OE2-NZ 2.7Å; K280-K282 VanDerWaalsContact C-N 3.33Å; K280-K282 PolarHBondContact O-N 2.96Å; K280-L283 WeakPolarHBondContact O-CB 3.41Å; K280-L283 PolarHBondContact O-N 3.43Å; K280-A284 PolarHBondContact O-N 3.43Å
281	Q	96.8	Very high	96	Very high	97 Å²	97	110.1 Å²	110.1	45%	0.453	52%	0.517	S	S	.	.	H	α-helix	trans	-62.4	-40.6	174.3	-67.8	174.9	19.4	0	0	111.7	E277 E278 A284 R285	E277-Q281 WeakPolarHBondContact O-CG 3.4Å; E277-Q281 PolarHBondContact O-N 3.01Å; E278-Q281 PolarHBondContact O-N 3.11Å; Q281-A284 WeakPolarHBondContact O-CB 3.43Å; Q281-A284 PolarHBondContact O-N 3.24Å; Q281-R285 WeakPolarHBondContact O-CG 3.48Å; Q281-R285 PolarHBondContact O-N 2.91Å
282	K	96.3	Very high	96.1	Very high	124 Å²	124	109.3 Å²	109.3	54%	0.539	51%	0.513	S	S	.	.	H	α-helix	trans	-62.7	-42.5	174.9	-166.7	172.7	-176.1	175.3	0	111.5	E278 Y279 K280 A284 R285 V286	E278-K282 PolarHBondContact O-N 3.4Å; Y279-K282 PolarHBondContact O-N 3.07Å; K280-K282 VanDerWaalsContact C-N 3.33Å; K280-K282 PolarHBondContact O-N 2.96Å; K282-A284 VanDerWaalsContact C-N 3.33Å; K282-A284 PolarHBondContact O-N 2.87Å; K282-R285 PolarHBondContact O-N 3.38Å; K282-V286 WeakPolarHBondContact O-CG2 3.41Å; K282-V286 PolarHBondContact O-N 3.48Å
283	L	96.2	Very high	96.2	Very high	112 Å²	112	107.8 Å²	107.8	59%	0.586	51%	0.511	S	S	*	.	H	α-helix	trans	-62.2	-39.8	175.2	179.1	62.5	0	0	0	111.9	Y279 K280 V286 T287	Y279-L283 WeakPolarHBondContact O-CB 3.37Å; Y279-L283 PolarHBondContact O-N 3.49Å; K280-L283 WeakPolarHBondContact O-CB 3.41Å; K280-L283 PolarHBondContact O-N 3.43Å; L283-V286 PolarHBondContact O-N 3.42Å; L283-T287 WeakPolarHBondContact O-CB 3.46Å; L283-T287 PolarHBondContact O-N 3.28Å; L283-T287 PolarHBondContact O-OG1 3.28Å
284	A	97.4	Very high	96.1	Very high	60 Å²	60	109.4 Å²	109.4	50%	0.496	52%	0.516	S	S	.	.	H	α-helix	trans	-61.6	-45.1	175.1	0	0	0	0	0	111.6	K280 Q281 K282 T287 Q288	K280-A284 PolarHBondContact O-N 3.43Å; Q281-A284 WeakPolarHBondContact O-CB 3.43Å; Q281-A284 PolarHBondContact O-N 3.24Å; K282-A284 VanDerWaalsContact C-N 3.33Å; K282-A284 PolarHBondContact O-N 2.87Å; A284-T287 WeakPolarHBondContact O-CB 3.5Å; A284-T287 PolarHBondContact O-N 3.06Å; A284-Q288 PolarHBondContact O-N 2.93Å
285	R	96.9	Very high	95.9	Very high	135 Å²	135	106.1 Å²	106.1	51%	0.509	51%	0.51	S	S	.	.	H	α-helix	trans	-60.5	-47	175.2	-69.4	-172.3	-67.9	-97.9	3.8	112.3	Q281 K282 T287 Q288 V289	Q281-R285 WeakPolarHBondContact O-CG 3.48Å; Q281-R285 PolarHBondContact O-N 2.91Å; K282-R285 PolarHBondContact O-N 3.38Å; R285-T287 VanDerWaalsContact C-N 3.29Å; R285-T287 PolarHBondContact O-N 3.48Å; R285-Q288 WeakPolarHBondContact O-CB 3.49Å; R285-Q288 PolarHBondContact O-N 3.46Å; R285-V289 WeakPolarHBondContact O-CG2 3.5Å; R285-V289 PolarHBondContact O-N 3.09Å
286	V	96.8	Very high	95.8	Very high	88 Å²	88	108 Å²	108	53%	0.533	52%	0.52	S	S	.	.	H	α-helix	trans	-61.6	-39.9	176.3	172.3	0	0	0	0	111.2	K282 L283 Q288 V289 R290	K282-V286 WeakPolarHBondContact O-CG2 3.41Å; K282-V286 PolarHBondContact O-N 3.48Å; L283-V286 PolarHBondContact O-N 3.42Å; V286-Q288 VanDerWaalsContact C-N 3.33Å; V286-Q288 PolarHBondContact O-N 2.98Å; V286-V289 PolarHBondContact O-N 2.91Å; V286-R290 WeakPolarHBondContact O-CB 3.38Å; V286-R290 PolarHBondContact O-N 3.21Å
287	T	96.6	Very high	95.6	Very high	39 Å²	39	108.6 Å²	108.6	24%	0.239	52%	0.523	C	S	.	.	H	α-helix	trans	-65.4	-37.6	177.4	-60.5	0	0	0	0	111.9	L283 A284 R285 K291	L283-T287 WeakPolarHBondContact O-CB 3.46Å; L283-T287 PolarHBondContact O-N 3.28Å; L283-T287 PolarHBondContact O-OG1 3.28Å; A284-T287 WeakPolarHBondContact O-CB 3.5Å; A284-T287 PolarHBondContact O-N 3.06Å; R285-T287 VanDerWaalsContact C-N 3.29Å; R285-T287 PolarHBondContact O-N 3.48Å; T287-K291 WeakPolarHBondContact O-CG 3.32Å; T287-K291 PolarHBondContact O-N 3.33Å; T287-K291 VanDerWaalsContact O-N 3.11Å
288	Q	96.6	Very high	95.2	Very high	121 Å²	121	111.8 Å²	111.8	57%	0.565	54%	0.538	S	S	*	.	H	α-helix	trans	-62.7	-52.7	173.2	-176.4	-179.8	8.3	0	0	110.8	A284 R285 V286 R290 K291 E292	A284-Q288 PolarHBondContact O-N 2.93Å; R285-Q288 WeakPolarHBondContact O-CB 3.49Å; R285-Q288 PolarHBondContact O-N 3.46Å; V286-Q288 VanDerWaalsContact C-N 3.33Å; V286-Q288 PolarHBondContact O-N 2.98Å; Q288-R290 VanDerWaalsContact C-N 3.25Å; Q288-R290 PolarHBondContact O-N 3.35Å; Q288-K291 WeakPolarHBondContact O-CB 3.46Å; Q288-K291 PolarHBondContact O-N 3.18Å; Q288-E292 WeakPolarHBondContact O-CG 3.22Å; Q288-E292 PolarHBondContact O-N 3.31Å
289	V	97.2	Very high	94.8	Very high	96 Å²	96	111.2 Å²	111.2	58%	0.582	55%	0.545	S	S	*	.	H	α-helix	trans	-56.3	-41.3	177.5	174.3	0	0	0	0	111.2	R285 V286 K291 E292 L293	R285-V289 WeakPolarHBondContact O-CG2 3.5Å; R285-V289 PolarHBondContact O-N 3.09Å; V286-V289 PolarHBondContact O-N 2.91Å; V289-K291 PolarHBondContact O-N 2.9Å; V289-E292 PolarHBondContact O-N 3.25Å; V289-L293 WeakPolarHBondContact O-CB 3.46Å; V289-L293 PolarHBondContact O-N 2.82Å
290	R	95.6	Very high	94.4	Very high	165 Å²	165	109.6 Å²	109.6	62%	0.623	54%	0.544	S	S	*	.	H	α-helix	trans	-61.1	-40.4	176.1	-174.7	-177	66.1	-179	-0.9	112.8	V286 Q288 K294	V286-R290 WeakPolarHBondContact O-CB 3.38Å; V286-R290 PolarHBondContact O-N 3.21Å; Q288-R290 VanDerWaalsContact C-N 3.25Å; Q288-R290 PolarHBondContact O-N 3.35Å; R290-K294 PolarHBondContact O-N 2.99Å
291	K	94.9	Very high	93.7	Very high	147 Å²	147	109.1 Å²	109.1	64%	0.639	55%	0.553	S	S	*	*	H	α-helix	trans	-66.3	-47.6	177.1	-74.2	177.6	-179.9	-179.2	0	110.8	T287 Q288 V289 K294 S295	T287-K291 WeakPolarHBondContact O-CG 3.32Å; T287-K291 PolarHBondContact O-N 3.33Å; T287-K291 VanDerWaalsContact O-N 3.11Å; Q288-K291 WeakPolarHBondContact O-CB 3.46Å; Q288-K291 PolarHBondContact O-N 3.18Å; V289-K291 PolarHBondContact O-N 2.9Å; K291-K294 PolarHBondContact O-N 2.99Å; K291-S295 PolarHBondContact O-N 2.61Å
292	E	95.4	Very high	93	Very high	119 Å²	119	109 Å²	109	56%	0.556	56%	0.555	S	S	*	*	H	α-helix	trans	-62.3	-44.1	178.2	-63.9	-58.7	156.4	0	0	111.5	Q288 V289 K294 S295 H296	Q288-E292 WeakPolarHBondContact O-CG 3.22Å; Q288-E292 PolarHBondContact O-N 3.31Å; V289-E292 PolarHBondContact O-N 3.25Å; E292-K294 VanDerWaalsContact C-N 3.31Å; E292-K294 PolarHBondContact O-N 3.23Å; E292-S295 WeakPolarHBondContact O-CB 3.38Å; E292-S295 PolarHBondContact O-N 3.41Å; E292-S295 VanDerWaalsContact O-N 3.09Å; E292-H296 WeakPolarHBondContact O-CB 3.42Å; E292-H296 PolarHBondContact O-N 2.81Å
293	L	94.9	Very high	92.1	Very high	104 Å²	104	109.3 Å²	109.3	55%	0.545	56%	0.562	S	S	.	*	H	α-helix	trans	-60.9	-38.9	178.2	-176.9	63	0	0	0	112.2	V289 S295 H296 I297	V289-L293 WeakPolarHBondContact O-CB 3.46Å; V289-L293 PolarHBondContact O-N 2.82Å; L293-S295 VanDerWaalsContact C-N 3.3Å; L293-S295 PolarHBondContact O-N 3.47Å; L293-H296 PolarHBondContact O-N 3.37Å; L293-I297 WeakPolarHBondContact O-CB 3.49Å; L293-I297 PolarHBondContact O-N 3.26Å
294	K	93.8	Very high	91.1	Very high	152 Å²	152	108.5 Å²	108.5	66%	0.661	57%	0.566	S	S	*	*	H	α-helix	trans	-66.5	-31.2	176.5	-170.7	177.4	-179.4	-178.9	0	112.7	R290 K291 E292 I297	R290-K294 PolarHBondContact O-N 2.99Å; K291-K294 PolarHBondContact O-N 2.99Å; E292-K294 VanDerWaalsContact C-N 3.31Å; E292-K294 PolarHBondContact O-N 3.23Å; K294-I297 WeakPolarHBondContact O-CG2 3.42Å
295	S	92.2	Very high	89.6	Confident	73 Å²	73	112.3 Å²	112.3	51%	0.51	58%	0.577	S	S	.	*	H	α-helix	trans	-74.2	-46.5	171.1	-173.6	0	0	0	0	110.7	K291 E292 L293 I297 Q298	K291-S295 PolarHBondContact O-N 2.61Å; E292-S295 WeakPolarHBondContact O-CB 3.38Å; E292-S295 PolarHBondContact O-N 3.41Å; E292-S295 VanDerWaalsContact O-N 3.09Å; L293-S295 VanDerWaalsContact C-N 3.3Å; L293-S295 PolarHBondContact O-N 3.47Å; S295-I297 PolarHBondContact O-N 3.49Å; S295-Q298 WeakPolarHBondContact O-CB 3.29Å; S295-Q298 PolarHBondContact O-N 2.84Å; S295-Q298 VanDerWaalsContact O-N 3.13Å
296	H	91.7	Very high	87.9	Confident	106 Å²	106	110.8 Å²	110.8	49%	0.491	58%	0.578	S	S	.	*	H	α-helix	trans	-61.8	-40.5	-176.8	-170.2	60.5	0	0	0	112.6	E292 L293 Q298 S299 L300	E292-H296 WeakPolarHBondContact O-CB 3.42Å; E292-H296 PolarHBondContact O-N 2.81Å; L293-H296 PolarHBondContact O-N 3.37Å; H296-Q298 PolarHBondContact O-N 3.39Å; H296-S299 WeakPolarHBondContact O-CB 3.46Å; H296-S299 PolarHBondContact O-N 2.99Å; H296-S299 PolarHBondContact O-OG 3.22Å; H296-L300 PolarHBondContact O-N 3.13Å
297	I	92.1	Very high	86.1	Confident	110 Å²	110	111.6 Å²	111.6	56%	0.564	59%	0.586	S	S	*	*	H	α-helix	trans	-61.9	-28.9	178.7	-159.3	171.3	0	0	0	112.7	L293 K294 S295 S299 L300	L293-I297 WeakPolarHBondContact O-CB 3.49Å; L293-I297 PolarHBondContact O-N 3.26Å; K294-I297 WeakPolarHBondContact O-CG2 3.42Å; S295-I297 PolarHBondContact O-N 3.49Å; I297-S299 VanDerWaalsContact C-N 3.29Å; I297-S299 PolarHBondContact O-N 2.97Å; I297-L300 PolarHBondContact O-N 2.64Å
298	Q	87.7	Confident	84.2	Confident	157 Å²	157	116 Å²	116	73%	0.734	61%	0.607	S	S	*	*	H	α-helix	trans	-74.4	-20.3	176.3	-64.3	-178.9	-20.3	0	0	112.9	S295 H296	S295-Q298 WeakPolarHBondContact O-CB 3.29Å; S295-Q298 PolarHBondContact O-N 2.84Å; S295-Q298 VanDerWaalsContact O-N 3.13Å; H296-Q298 PolarHBondContact O-N 3.39Å
299	S	88.4	Confident	82.3	Confident	86 Å²	86	115.4 Å²	115.4	60%	0.601	61%	0.612	S	S	*	*	H	α-helix	trans	-85.2	-11.1	175.9	71.4	0	0	0	0	113.5	H296 I297	H296-S299 WeakPolarHBondContact O-CB 3.46Å; H296-S299 PolarHBondContact O-N 2.99Å; H296-S299 PolarHBondContact O-OG 3.22Å; I297-S299 VanDerWaalsContact C-N 3.29Å; I297-S299 PolarHBondContact O-N 2.97Å
300	L	88.2	Confident	80.4	Confident	98 Å²	98	116.4 Å²	116.4	51%	0.513	62%	0.619	S	S	.	*	S	Bend	trans	-86.9	139.7	179.1	-63.9	175.9	0	0	0	110.3	H296 I297 D302	H296-L300 PolarHBondContact O-N 3.13Å; I297-L300 PolarHBondContact O-N 2.64Å; L300-D302 PolarHBondContact O-N 3.37Å
301	P	82	Confident	78.2	Confident	102 Å²	102	111.9 Å²	111.9	66%	0.662	62%	0.623	S	S	*	*			trans	-68.1	131.6	177.8	27.3	-32.8	0	0	0	110.8	L303	P301-L303 PolarHBondContact O-N 3.26Å
302	D	81.7	Confident	76.1	Confident	96 Å²	96	108.5 Å²	108.5	51%	0.513	63%	0.63	S	S	.	*			trans	-75.8	103.3	170.5	-171.8	-13.6	0	0	0	109.3	L300 S304 L305	L300-D302 PolarHBondContact O-N 3.37Å; D302-S304 PolarHBondContact O-N 2.97Å; D302-S304 VanDerWaalsContact O-N 3.11Å; D302-S304 VanDerWaalsContact OD1-CB 3.29Å; D302-S304 WeakPolarHBondContact OD1-CB 3.49Å; D302-S304 PolarHBondContact OD1-N 3.11Å; D302-S304 PolarHBondContact OD1-OG 3.06Å; D302-S304 PolarHBondContact OD2-OG 3.18Å; D302-L305 HydrophobicContact CB-CD1 4.11Å; D302-L305 HydrophobicContact CB-CG 4.23Å; D302-L305 PolarHBondContact O-N 3.46Å
303	L	77.6	Confident	74.2	Confident	129 Å²	129	109.5 Å²	109.5	68%	0.675	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-62.1	-17	-179.3	-62.6	174.1	0	0	0	112.8	P301 L305 L306	P301-L303 PolarHBondContact O-N 3.26Å; L303-L305 VanDerWaalsContact C-N 3.28Å; L303-L305 PolarHBondContact O-N 3.43Å; L303-L306 HydrophobicContact CD2-CD1 3.47Å; L303-L306 VanDerWaalsContact CD2-CD1 3.47Å; L303-L306 PolarHBondContact O-N 3.49Å
304	S	75.5	Confident	72.5	Confident	95 Å²	95	108.6 Å²	108.6	66%	0.664	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-74.1	-18.5	175.6	73.5	0	0	0	0	113.5	D302	D302-S304 PolarHBondContact O-N 2.97Å; D302-S304 VanDerWaalsContact O-N 3.11Å; D302-S304 VanDerWaalsContact OD1-CB 3.29Å; D302-S304 WeakPolarHBondContact OD1-CB 3.49Å; D302-S304 PolarHBondContact OD1-N 3.11Å; D302-S304 PolarHBondContact OD1-OG 3.06Å; D302-S304 PolarHBondContact OD2-OG 3.18Å
305	L	66	Low	71.1	Confident	140 Å²	140	107.2 Å²	107.2	73%	0.733	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-91.4	-8.2	176	-62	177.9	0	0	0	112.9	D302 L303	D302-L305 HydrophobicContact CB-CD1 4.11Å; D302-L305 HydrophobicContact CB-CG 4.23Å; D302-L305 PolarHBondContact O-N 3.46Å; L303-L305 VanDerWaalsContact C-N 3.28Å; L303-L305 PolarHBondContact O-N 3.43Å
306	L	61.2	Low	69.8	Low	103 Å²	103	111.4 Å²	111.4	54%	0.539	67%	0.668	S	S	.	*	S	Bend	trans	-68.6	131	174.7	-71.5	174.1	0	0	0	109	L303 N308	L303-L306 HydrophobicContact CD2-CD1 3.47Å; L303-L306 VanDerWaalsContact CD2-CD1 3.47Å; L303-L306 PolarHBondContact O-N 3.49Å; L306-N308 PolarHBondContact O-N 3.32Å
307	P	58.4	Low	68.4	Low	106 Å²	106	110.2 Å²	110.2	69%	0.688	67%	0.67	S	S	*	*			trans	-56.7	132	176.3	23.1	-31.1	0	0	0	108.6	V309	P307-V309 PolarHBondContact O-N 2.72Å
308	N	56.7	Low	67.5	Low	130 Å²	130	108.7 Å²	108.7	70%	0.695	67%	0.669	S	S	*	*			trans	-60.2	94.1	-176.1	-166.5	14.6	0	0	0	109.9	L306 T310 G311	L306-N308 PolarHBondContact O-N 3.32Å; N308-T310 PolarHBondContact ND2-OG1 3.14Å; N308-T310 VanDerWaalsContact ND2-OG1 3.14Å; N308-T310 PolarHBondContact O-N 3.24Å; N308-T310 PolarHBondContact OD1-OG1 2.78Å; N308-G311 PolarHBondContact O-N 3Å
309	V	56.8	Low	66.7	Low	109 Å²	109	104.6 Å²	104.6	66%	0.661	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	5.2	-177	-109.3	0	0	0	0	113.3	P307 G311 L313	P307-V309 PolarHBondContact O-N 2.72Å; V309-G311 VanDerWaalsContact C-N 3.25Å; V309-L313 HydrophobicContact CG1-CD1 3.88Å
310	T	56.8	Low	65.9	Low	118 Å²	118	102.5 Å²	102.5	72%	0.724	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-8.9	169.4	54.9	0	0	0	0	113.2	N308	N308-T310 PolarHBondContact ND2-OG1 3.14Å; N308-T310 VanDerWaalsContact ND2-OG1 3.14Å; N308-T310 PolarHBondContact O-N 3.24Å; N308-T310 PolarHBondContact OD1-OG1 2.78Å
311	G	50.5	Low	65.2	Low	69 Å²	69	102.9 Å²	102.9	71%	0.711	66%	0.656	S	S	*	*	S	Bend	trans	-97.7	80.5	176.1	0	0	0	0	0	114.2	N308 V309	N308-G311 PolarHBondContact O-N 3Å; V309-G311 VanDerWaalsContact C-N 3.25Å
312	G	51.1	Low	64.5	Low	76 Å²	76	104 Å²	104	78%	0.784	66%	0.656	S	S	*	*			trans	80	38.1	150.5	0	0	0	0	0	118.8	A314	G312-A314 PolarHBondContact O-N 3.34Å
313	L	55.3	Low	64	Low	141 Å²	141	107.5 Å²	107.5	74%	0.738	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-65.2	125	159	-73	174.5	0	0	0	109	V309	V309-L313 HydrophobicContact CG1-CD1 3.88Å
314	A	59.4	Low	63.2	Low	84 Å²	84	106 Å²	106	69%	0.694	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-53.7	143.5	173	0	0	0	0	0	109.7	G312 L316	G312-A314 PolarHBondContact O-N 3.34Å; A314-L316 PolarHBondContact O-N 3.24Å
315	P	63.9	Low	62.6	Low	123 Å²	123	107.7 Å²	107.7	80%	0.799	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-54.6	131.4	178.6	-16.2	27.5	0	0	0	108.9
316	L	64.9	Low	61.7	Low	162 Å²	162	112.6 Å²	112.6	85%	0.848	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-55.5	135.9	168.7	-74.7	164.6	0	0	0	108	A314 S318	A314-L316 PolarHBondContact O-N 3.24Å; L316-S318 PolarHBondContact O-N 3.4Å
317	P	62.8	Low	61.7	Low	80 Å²	80	113.1 Å²	113.1	52%	0.519	71%	0.709	S	S	.	*	P	Polyproline II helix	trans	-53.1	137.9	-179.7	18.1	-28.7	0	0	0	110	D321	P317-D321 HydrophobicContact CB-CB 3.84Å
318	S	72.2	Confident	61.9	Low	79 Å²	79	113.5 Å²	113.5	55%	0.552	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-63.1	154	177.4	179	0	0	0	0	109.1	L316 G320 D321	L316-S318 PolarHBondContact O-N 3.4Å; S318-G320 PolarHBondContact O-N 3.43Å; S318-D321 PolarHBondContact N-OD2 3.04Å; S318-D321 WeakPolarHBondContact O-CB 3.22Å; S318-D321 PolarHBondContact O-N 3.16Å
319	A	70.9	Confident	62.1	Low	70 Å²	70	112.6 Å²	112.6	58%	0.579	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.2	-24.6	173.9	0	0	0	0	0	112.6	F323	A319-F323 WeakPolarHBondContact O-CD2 3.44Å
320	G	72.1	Confident	62.5	Low	42 Å²	42	112.8 Å²	112.8	43%	0.433	71%	0.714	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.3	-29	172.7	0	0	0	0	0	115.3	S318 L322 F323 S324	S318-G320 PolarHBondContact O-N 3.43Å; G320-L322 VanDerWaalsContact C-N 3.26Å; G320-L322 PolarHBondContact O-N 2.83Å; G320-F323 PolarHBondContact O-N 2.96Å; G320-S324 PolarHBondContact O-OG 3.42Å
321	D	74.3	Confident	62.8	Low	106 Å²	106	112.4 Å²	112.4	57%	0.567	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-72.5	-22.1	178	-65.9	-34.2	0	0	0	111.8	P317 S318 F323	P317-D321 HydrophobicContact CB-CB 3.84Å; S318-D321 PolarHBondContact N-OD2 3.04Å; S318-D321 WeakPolarHBondContact O-CB 3.22Å; S318-D321 PolarHBondContact O-N 3.16Å; D321-F323 VanDerWaalsContact C-N 3.29Å; D321-F323 PolarHBondContact O-N 3.43Å
322	L	66.5	Low	63.6	Low	125 Å²	125	115.3 Å²	115.3	65%	0.654	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-75	-14.6	178.5	-68.5	172.4	0	0	0	113.8	G320	G320-L322 VanDerWaalsContact C-N 3.26Å; G320-L322 PolarHBondContact O-N 2.83Å
323	F	72	Confident	64.5	Low	171 Å²	171	118.1 Å²	118.1	75%	0.75	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-121.1	8.8	-175	-62.5	-72.7	0	0	0	114.2	A319 G320 D321 T325	A319-F323 WeakPolarHBondContact O-CD2 3.44Å; G320-F323 PolarHBondContact O-N 2.96Å; D321-F323 VanDerWaalsContact C-N 3.29Å; D321-F323 PolarHBondContact O-N 3.43Å; F323-T325 PolarHBondContact O-N 3.32Å
324	S	60.4	Low	65.2	Low	96 Å²	96	116.4 Å²	116.4	67%	0.671	71%	0.706	S	S	*	*			trans	-90.9	87.2	175.1	-58.4	0	0	0	0	109.5	G320	G320-S324 PolarHBondContact O-OG 3.42Å
325	T	62	Low	65.7	Low	131 Å²	131	119.1 Å²	119.1	80%	0.804	71%	0.707	S	S	*	*			trans	-82.5	137.2	158.6	51.2	0	0	0	0	108.2	F323	F323-T325 PolarHBondContact O-N 3.32Å
326	D	46.5	Very low	65.9	Low	244 Å²	244	118.7 Å²	118.7	100%	1.305	70%	0.698	S	S	*	*			trans	-37	0	172.5	-68.6	-46.4	0	0	0	114.5

Retrieved 326 of 326 residues in 504.3 ms (Link to these results)

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