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Tetratricopeptide repeat protein 7A

Component of a complex required to localize phosphatidylinositol 4-kinase (PI4K) to the plasma membrane. The complex acts as a regulator of phosphatidylinositol 4-phosphate (PtdIns(4)P) synthesis. In the complex, plays a central role in bridging PI4KA to EFR3B and HYCC1, via direct interactions.

AlphaFold DB , UniProt , Accession F7I8X6, Species CALJA (Callithrix jacchus, White-tufted-ear marmoset), Gene TTC7A, Length 882 aa.

						>F7I8X6_CALJA|F7I8X6|TTC7A
MAAKGAHGSHLKVESELDRCRAEGHWDRMPELVRQLQTLSMPGSGGSKRASPSAAFASPDTDDFGKLLLAEALLEQCLKENHAKIKDSIPLLEKNEPKMSEAKNYLSSILNHGRLSPQYMCEAMLILGKLHYVEGSYRDAISMYARAGIDDMSMENKPLYQMRLLSEAFVIKGLSLERLPNSIASRFRLTEREEEVITCFERASWIAQVFLQELEKTTNNSTSRHLKGCHLLDYELTYFLEAALQSAYVKNLKKGNIVKGMRELREVLRTVETKATQNFKVMAAKHLAGVLLHSLSEECYWSPLSHPLPEFMGKEENSLATQALRKPHLYEGDNLYCPKDNIEEALLLLLISESMATRDVVLSRVPEQEEERTVSLQNAAAIYDLLSITLGRRGQYIMLSECLERAMKFAFGEFHLWYQVALSMVACGKSAYAVSLLRECVKLQPSDPTVPLMAAKVCIGSLHWLEEAERFAMMVISLGEEAGEFLPKGYLALGLTYSLQATDATLKSKQDELHRKALQTLERAQQLAPGDPQVILYVSLQLALVRQISSAMEQLQEALKVCRDDAHALHLLALLFSAQKHHQHALDVVNMAITEHPENFNLMFTKVKLEQVLKGPEEALVTCRQMLRLWQTLYSFSQLGDSGSPESFQTPQRNVCNSEIYRGGGLEKDGSLGEGLTMKKQSGMHLTLPDAHDADSGSRRASSIAASRLEEAMSELTMPSSVLKQGPMQLWTTLEQIWLQAAELFMEQQHLKEAGFCIQEAAGLFPTSHSVLYMRGRLAEVKGSLEEAKQLYKEALTVNPDGVCIMHSLGLMLSRLGHKSLAQKVLRDAVERQSTCHEAWQGLGEVLQAQGQNEAAVDCFLTALELEASSPVLPFSIIPREL
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.3	Very low	50.1	Low	222 Å²	222	93.6 Å²	93.6	100%	1.094	57%	0.566	S	S	*	*				0	-30.3	0	-68	-160.5	-157.7	0	0	113.5	A3 K4	M1-A3 PolarHBondContact O-N 3.42Å; M1-K4 PolarHBondContact O-N 3.16Å
2	A	38.8	Very low	52	Low	89 Å²	89	97.8 Å²	97.8	74%	0.736	57%	0.571	S	S	*	*	H	α-helix	trans	-62.1	-35.3	177.6	0	0	0	0	0	115.2	K4 G5 A6	A2-K4 VanDerWaalsContact C-N 3.34Å; A2-K4 PolarHBondContact O-N 2.95Å; A2-G5 PolarHBondContact O-N 3.5Å; A2-A6 PolarHBondContact O-N 3.15Å; A2-A6 VanDerWaalsContact O-N 3.16Å
3	A	39.3	Very low	53.9	Low	83 Å²	83	91.3 Å²	91.3	69%	0.686	53%	0.533	S	S	*	.	H	α-helix	trans	-67.1	-28.7	178.2	0	0	0	0	0	114.2	M1 H7	M1-A3 PolarHBondContact O-N 3.42Å; A3-H7 PolarHBondContact O-N 3.12Å
4	K	39.6	Very low	55.5	Low	183 Å²	183	89.3 Å²	89.3	80%	0.796	52%	0.516	S	S	*	.	H	α-helix	trans	-74.8	-27.6	173.6	-76.1	-172.3	175.5	-175	0	112.3	M1 A2 G8	M1-K4 PolarHBondContact O-N 3.16Å; A2-K4 VanDerWaalsContact C-N 3.34Å; A2-K4 PolarHBondContact O-N 2.95Å; K4-G8 PolarHBondContact O-N 3Å
5	G	46.4	Very low	57	Low	48 Å²	48	87.8 Å²	87.8	50%	0.495	51%	0.513	S	S	.	.	H	α-helix	trans	-72.6	-43.2	174.9	0	0	0	0	0	112.8	A2 G8 S9	A2-G5 PolarHBondContact O-N 3.5Å; G5-G8 PolarHBondContact O-N 3.29Å; G5-S9 PolarHBondContact O-N 3.35Å; G5-S9 PolarHBondContact O-OG 2.94Å
6	A	50.7	Low	58.4	Low	60 Å²	60	87.4 Å²	87.4	50%	0.496	50%	0.504	S	S	.	.	H	α-helix	trans	-67	-38.1	178.2	0	0	0	0	0	113.1	A2 S9 H10	A2-A6 PolarHBondContact O-N 3.15Å; A2-A6 VanDerWaalsContact O-N 3.16Å; A6-S9 WeakPolarHBondContact CA-OG 3.22Å; A6-S9 PolarHBondContact O-N 3.12Å; A6-S9 PolarHBondContact O-OG 3.16Å; A6-H10 WeakPolarHBondContact O-CB 3.41Å; A6-H10 PolarHBondContact O-N 3.1Å
7	H	52.9	Low	59.8	Low	133 Å²	133	82.4 Å²	82.4	62%	0.616	48%	0.475	S	S	*	.	H	α-helix	trans	-68.3	-36.6	174.9	-141.1	53.8	0	0	0	111.7	A3 H10 L11	A3-H7 PolarHBondContact O-N 3.12Å; H7-H10 PolarHBondContact O-N 3.01Å; H7-L11 WeakPolarHBondContact O-CD1 3.48Å; H7-L11 WeakPolarHBondContact O-CG 3.34Å; H7-L11 PolarHBondContact O-N 3.28Å; H7-L11 VanDerWaalsContact O-N 3.11Å
8	G	54.6	Low	61.2	Low	30 Å²	30	80.8 Å²	80.8	31%	0.309	47%	0.465	S	S	.	.	H	α-helix	trans	-70	-29.3	174.1	0	0	0	0	0	114.3	K4 G5 K12	K4-G8 PolarHBondContact O-N 3Å; G5-G8 PolarHBondContact O-N 3.29Å; G8-K12 VanDerWaalsContact O-CG 3.25Å; G8-K12 WeakPolarHBondContact O-CG 3.45Å; G8-K12 PolarHBondContact O-N 2.94Å
9	S	61.3	Low	62.3	Low	41 Å²	41	82.2 Å²	82.2	29%	0.287	46%	0.462	S	S	.	.	H	α-helix	trans	-77.4	-35.9	172.1	51.9	0	0	0	0	112.7	G5 A6 K12 V13	G5-S9 PolarHBondContact O-N 3.35Å; G5-S9 PolarHBondContact O-OG 2.94Å; A6-S9 WeakPolarHBondContact CA-OG 3.22Å; A6-S9 PolarHBondContact O-N 3.12Å; A6-S9 PolarHBondContact O-OG 3.16Å; S9-K12 PolarHBondContact O-N 3.09Å; S9-V13 WeakPolarHBondContact O-CG2 3.46Å; S9-V13 PolarHBondContact O-N 3.12Å; S9-V13 VanDerWaalsContact O-N 3.12Å
10	H	65.3	Low	63.4	Low	43 Å²	43	78.5 Å²	78.5	20%	0.199	44%	0.441	C	S	.	.	H	α-helix	trans	-62.3	-49.1	175.4	-166.5	-84.8	0	0	0	111.6	A6 H7 K12 V13 E14	A6-H10 WeakPolarHBondContact O-CB 3.41Å; A6-H10 PolarHBondContact O-N 3.1Å; H7-H10 PolarHBondContact O-N 3.01Å; H10-K12 PolarHBondContact O-N 2.91Å; H10-V13 PolarHBondContact O-N 3.41Å; H10-V13 VanDerWaalsContact O-N 3.15Å; H10-E14 VanDerWaalsContact CE1-CD 3.4Å; H10-E14 IonicContact CE1-OE1 2.91Å; H10-E14 PolarHBondContact CE1-OE1 3.04Å; H10-E14 IonicContact CE1-OE2 2.77Å; H10-E14 IonicContact ND1-OE1 3.54Å; H10-E14 PolarHBondContact ND1-OE1 3.25Å; H10-E14 IonicContact ND1-OE2 2.67Å; H10-E14 PolarHBondContact ND1-OE2 3.22Å; H10-E14 VanDerWaalsContact ND1-OE2 3.12Å; H10-E14 PolarHBondContact O-N 3.2Å
11	L	67.1	Low	64.4	Low	98 Å²	98	74.8 Å²	74.8	51%	0.513	42%	0.42	S	S	.	.	H	α-helix	trans	-61.4	-31.7	177.2	-72.8	164.3	0	0	0	112.9	H7 S15	H7-L11 WeakPolarHBondContact O-CD1 3.48Å; H7-L11 WeakPolarHBondContact O-CG 3.34Å; H7-L11 PolarHBondContact O-N 3.28Å; H7-L11 VanDerWaalsContact O-N 3.11Å; L11-S15 WeakPolarHBondContact O-CB 3.35Å; L11-S15 PolarHBondContact O-N 2.74Å; L11-S15 PolarHBondContact O-OG 3.02Å
12	K	72.4	Confident	66.7	Low	144 Å²	144	64.4 Å²	64.4	63%	0.626	37%	0.37	S	S	*	.	H	α-helix	trans	-67.3	-47.8	174.3	-78.7	175.3	-178.9	-172.4	0	111.4	G8 S9 H10 E14 S15 E16	G8-K12 VanDerWaalsContact O-CG 3.25Å; G8-K12 WeakPolarHBondContact O-CG 3.45Å; G8-K12 PolarHBondContact O-N 2.94Å; S9-K12 PolarHBondContact O-N 3.09Å; H10-K12 PolarHBondContact O-N 2.91Å; K12-E14 VanDerWaalsContact C-N 3.34Å; K12-E14 PolarHBondContact O-N 3.49Å; K12-S15 PolarHBondContact O-N 3.25Å; K12-S15 PolarHBondContact O-OG 3.18Å; K12-E16 WeakPolarHBondContact O-CG 3.44Å; K12-E16 PolarHBondContact O-N 2.71Å
13	V	76.6	Confident	68.8	Low	13 Å²	13	61.9 Å²	61.9	8%	0.079	34%	0.343	C	S	.	.	H	α-helix	trans	-63	-40.4	178	176.1	0	0	0	0	111	S9 H10 E16 L17 L36 L39	S9-V13 WeakPolarHBondContact O-CG2 3.46Å; S9-V13 PolarHBondContact O-N 3.12Å; S9-V13 VanDerWaalsContact O-N 3.12Å; H10-V13 PolarHBondContact O-N 3.41Å; H10-V13 VanDerWaalsContact O-N 3.15Å; V13-E16 PolarHBondContact O-N 3.29Å; V13-L17 HydrophobicContact CG1-CD1 4.24Å; V13-L17 WeakPolarHBondContact O-CB 3.45Å; V13-L17 WeakPolarHBondContact O-CG 3.31Å; V13-L17 PolarHBondContact O-N 3.14Å; V13-L36 HydrophobicContact CG1-CB 4.26Å; V13-L36 HydrophobicContact CG1-CD1 4.29Å; V13-L39 HydrophobicContact CG2-CD1 3.85Å
14	E	76.3	Confident	70.8	Confident	63 Å²	63	59.1 Å²	59.1	29%	0.294	32%	0.322	S	S	.	.	H	α-helix	trans	-62	-45	174.2	-72.6	173.8	144.2	0	0	112.2	H10 K12 E16 L17 D18 L36	H10-E14 VanDerWaalsContact CE1-CD 3.4Å; H10-E14 IonicContact CE1-OE1 2.91Å; H10-E14 PolarHBondContact CE1-OE1 3.04Å; H10-E14 IonicContact CE1-OE2 2.77Å; H10-E14 IonicContact ND1-OE1 3.54Å; H10-E14 PolarHBondContact ND1-OE1 3.25Å; H10-E14 IonicContact ND1-OE2 2.67Å; H10-E14 PolarHBondContact ND1-OE2 3.22Å; H10-E14 VanDerWaalsContact ND1-OE2 3.12Å; H10-E14 PolarHBondContact O-N 3.2Å; K12-E14 VanDerWaalsContact C-N 3.34Å; K12-E14 PolarHBondContact O-N 3.49Å; E14-E16 VanDerWaalsContact C-N 3.32Å; E14-E16 PolarHBondContact O-N 3.34Å; E14-L17 WeakPolarHBondContact O-CB 3.49Å; E14-L17 PolarHBondContact O-N 3.2Å; E14-D18 PolarHBondContact O-N 2.95Å; E14-L36 HydrophobicContact CG-CD1 4.24Å
15	S	78.1	Confident	72.9	Confident	67 Å²	67	53.6 Å²	53.6	47%	0.469	30%	0.299	S	S	.	.	H	α-helix	trans	-66.2	-32.2	175.9	68	0	0	0	0	113.5	L11 K12 R19	L11-S15 WeakPolarHBondContact O-CB 3.35Å; L11-S15 PolarHBondContact O-N 2.74Å; L11-S15 PolarHBondContact O-OG 3.02Å; K12-S15 PolarHBondContact O-N 3.25Å; K12-S15 PolarHBondContact O-OG 3.18Å; S15-R19 WeakPolarHBondContact O-CB 3.43Å; S15-R19 PolarHBondContact O-N 3.03Å; S15-R19 VanDerWaalsContact O-N 3.13Å
16	E	79.8	Confident	74.8	Confident	81 Å²	81	52.8 Å²	52.8	38%	0.379	28%	0.281	S	S	.	.	H	α-helix	trans	-71.9	-35.8	173.7	-76.9	-174.1	166.7	0	0	112.4	K12 V13 E14 R19 C20	K12-E16 WeakPolarHBondContact O-CG 3.44Å; K12-E16 PolarHBondContact O-N 2.71Å; V13-E16 PolarHBondContact O-N 3.29Å; E14-E16 VanDerWaalsContact C-N 3.32Å; E14-E16 PolarHBondContact O-N 3.34Å; E16-R19 PolarHBondContact O-N 3.32Å; E16-C20 WeakPolarHBondContact O-CB 3.41Å; E16-C20 PolarHBondContact O-N 2.95Å; E16-C20 PolarHBondContact O-SG 3.2Å
17	L	82.6	Confident	76.2	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-62.7	-49.8	172.4	-78.8	169.1	0	0	0	111.1	V13 E14 R19 C20 R21 M29 L32 L36 L68	V13-L17 HydrophobicContact CG1-CD1 4.24Å; V13-L17 WeakPolarHBondContact O-CB 3.45Å; V13-L17 WeakPolarHBondContact O-CG 3.31Å; V13-L17 PolarHBondContact O-N 3.14Å; E14-L17 WeakPolarHBondContact O-CB 3.49Å; E14-L17 PolarHBondContact O-N 3.2Å; L17-R19 VanDerWaalsContact C-N 3.25Å; L17-R19 PolarHBondContact O-N 3.37Å; L17-C20 PolarHBondContact O-N 3.31Å; L17-C20 VanDerWaalsContact O-N 3.12Å; L17-R21 WeakPolarHBondContact O-CG 3.44Å; L17-R21 PolarHBondContact O-N 2.75Å; L17-M29 HydrophobicContact CD2-SD 3.63Å; L17-L32 HydrophobicContact CD2-CB 3.48Å; L17-L32 VanDerWaalsContact CD2-CB 3.48Å; L17-L32 HydrophobicContact CD2-CD1 4.04Å; L17-L32 HydrophobicContact CD2-CG 4.41Å; L17-L32 HydrophobicContact CG-CB 4.17Å; L17-L36 HydrophobicContact CD1-CD1 3.69Å; L17-L68 HydrophobicContact CD1-CD1 4.05Å; L17-L68 HydrophobicContact CD2-CD1 4.12Å
18	D	83.6	Confident	77.6	Confident	54 Å²	54	56 Å²	56	29%	0.289	29%	0.285	S	S	.	.	H	α-helix	trans	-58.5	-39.7	177.8	-75.8	-11.4	0	0	0	111.8	E14 A22 Y160	E14-D18 PolarHBondContact O-N 2.95Å; D18-A22 WeakPolarHBondContact O-CB 3.36Å; D18-A22 PolarHBondContact O-N 3.18Å; D18-A22 VanDerWaalsContact O-N 3.13Å; D18-Y160 HydrophobicContact CB-CD1 4.23Å; D18-Y160 HydrophobicContact CB-CE1 4.02Å; D18-Y160 WeakPolarHBondContact OD1-CE1 3.31Å
19	R	82.3	Confident	78.9	Confident	108 Å²	108	54.6 Å²	54.6	41%	0.408	27%	0.27	S	S	.	.	H	α-helix	trans	-65.5	-46.6	174.2	-175.6	178.1	63.3	158.7	-3.5	111.9	S15 E16 L17 R21 A22 E23	S15-R19 WeakPolarHBondContact O-CB 3.43Å; S15-R19 PolarHBondContact O-N 3.03Å; S15-R19 VanDerWaalsContact O-N 3.13Å; E16-R19 PolarHBondContact O-N 3.32Å; L17-R19 VanDerWaalsContact C-N 3.25Å; L17-R19 PolarHBondContact O-N 3.37Å; R19-R21 VanDerWaalsContact C-N 3.31Å; R19-R21 PolarHBondContact O-N 3.29Å; R19-A22 PolarHBondContact O-N 2.88Å; R19-A22 VanDerWaalsContact O-N 3.14Å; R19-E23 VanDerWaalsContact CD-OE1 3.31Å; R19-E23 WeakPolarHBondContact CD-OE1 3.48Å; R19-E23 VanDerWaalsContact CG-CD 3.48Å; R19-E23 HydrophobicContact CG-CG 4.23Å; R19-E23 WeakPolarHBondContact CG-OE1 3.48Å; R19-E23 WeakPolarHBondContact O-CB 3.37Å; R19-E23 WeakPolarHBondContact O-CG 3.33Å; R19-E23 PolarHBondContact O-N 3.18Å
20	C	83.9	Confident	80	Confident	7 Å²	7	55 Å²	55	5%	0.047	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-37.6	178.8	-69.6	0	0	0	0	112.3	E16 L17 A22 G24 H25 M29 L32	E16-C20 WeakPolarHBondContact O-CB 3.41Å; E16-C20 PolarHBondContact O-N 2.95Å; E16-C20 PolarHBondContact O-SG 3.2Å; L17-C20 PolarHBondContact O-N 3.31Å; L17-C20 VanDerWaalsContact O-N 3.12Å; C20-A22 VanDerWaalsContact C-N 3.34Å; C20-G24 PolarHBondContact O-N 2.97Å; C20-H25 HydrophobicContact CB-CB 4.36Å; C20-H25 PolarHBondContact O-N 2.91Å; C20-M29 HydrophobicContact CB-CE 4.08Å; C20-L32 HydrophobicContact CB-CD1 4.31Å; C20-L32 VanDerWaalsContact SG-CD1 3.58Å
21	R	85.6	Confident	80.7	Confident	1 Å²	1	58.3 Å²	58.3	0%	0.004	29%	0.287	C	S	.	.	H	α-helix	trans	-67.7	-31.5	175.1	-67.2	176.7	81.1	-173.2	-1.2	113.1	L17 R19 W26 M29 L68 E71 E122 Y160 R163	L17-R21 WeakPolarHBondContact O-CG 3.44Å; L17-R21 PolarHBondContact O-N 2.75Å; R19-R21 VanDerWaalsContact C-N 3.31Å; R19-R21 PolarHBondContact O-N 3.29Å; R21-W26 HydrophobicContact CG-CZ3 4.5Å; R21-M29 HydrophobicContact CB-CE 4.38Å; R21-M29 HydrophobicContact CG-CE 3.5Å; R21-M29 VanDerWaalsContact CG-CE 3.5Å; R21-M29 HydrophobicContact CG-SD 4.24Å; R21-L68 HydrophobicContact CG-CD2 4.32Å; R21-E71 IonicContact CZ-OE2 3.17Å; R21-E71 IonicContact NE-OE2 2.72Å; R21-E71 PolarHBondContact NE-OE2 2.93Å; R21-E71 IonicContact NH2-OE1 3.78Å; R21-E71 IonicContact NH2-OE2 3.22Å; R21-E71 PolarHBondContact NH2-OE2 3.3Å; R21-E122 IonicContact CZ-OE2 3.42Å; R21-E122 IonicContact NH1-OE2 3Å; R21-E122 PolarHBondContact NH1-OE2 2.82Å; R21-E122 IonicContact NH2-OE2 2.99Å; R21-E122 PolarHBondContact NH2-OE2 3.49Å; R21-Y160 HydrophobicContact CB-CD1 4.19Å; R21-Y160 HydrophobicContact CB-CD2 4.45Å; R21-Y160 HydrophobicContact CB-CG 3.85Å; R21-Y160 VanDerWaalsContact CZ-CD2 3.45Å; R21-Y160 PolarHBondContact NH1-OH 2.89Å; R21-R163 PolarHBondContact O-NE 2.94Å; R21-R163 PolarHBondContact O-NH2 3.37Å; R21-R163 VanDerWaalsContact O-NH2 3.08Å
22	A	83.8	Confident	81.4	Confident	4 Å²	4	54.3 Å²	54.3	3%	0.033	27%	0.267	C	S	.	.	H	α-helix	trans	-78	-41.1	178.4	0	0	0	0	0	111.8	D18 R19 C20 G24 L159 L214	D18-A22 WeakPolarHBondContact O-CB 3.36Å; D18-A22 PolarHBondContact O-N 3.18Å; D18-A22 VanDerWaalsContact O-N 3.13Å; R19-A22 PolarHBondContact O-N 2.88Å; R19-A22 VanDerWaalsContact O-N 3.14Å; C20-A22 VanDerWaalsContact C-N 3.34Å; A22-G24 VanDerWaalsContact C-N 3.34Å; A22-L159 HydrophobicContact CB-CB 3.75Å; A22-L214 HydrophobicContact CB-CD1 4.28Å
23	E	82.5	Confident	81.8	Confident	37 Å²	37	47.7 Å²	47.7	17%	0.173	24%	0.238	C	C	.	.	H	α-helix	trans	-82.2	-9.9	179.8	-65.8	171	179.4	0	0	113.3	R19 H25 L214 Y234	R19-E23 VanDerWaalsContact CD-OE1 3.31Å; R19-E23 WeakPolarHBondContact CD-OE1 3.48Å; R19-E23 VanDerWaalsContact CG-CD 3.48Å; R19-E23 HydrophobicContact CG-CG 4.23Å; R19-E23 WeakPolarHBondContact CG-OE1 3.48Å; R19-E23 WeakPolarHBondContact O-CB 3.37Å; R19-E23 WeakPolarHBondContact O-CG 3.33Å; R19-E23 PolarHBondContact O-N 3.18Å; E23-H25 VanDerWaalsContact CB-ND1 3.35Å; E23-H25 WeakPolarHBondContact CB-ND1 3.33Å; E23-H25 IonicContact OE2-CE1 3.63Å; E23-H25 PolarHBondContact OE2-CE1 3.39Å; E23-H25 IonicContact OE2-ND1 3.82Å; E23-H25 PolarHBondContact OE2-ND1 2.91Å; E23-L214 HydrophobicContact CG-CD1 4.19Å; E23-Y234 WeakPolarHBondContact O-CD2 3.04Å; E23-Y234 WeakPolarHBondContact O-CE2 3.4Å
24	G	81.4	Confident	81.9	Confident	24 Å²	24	54 Å²	54	25%	0.247	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	25.4	179.5	0	0	0	0	0	114.3	C20 A22 W26	C20-G24 PolarHBondContact O-N 2.97Å; A22-G24 VanDerWaalsContact C-N 3.34Å; G24-W26 VanDerWaalsContact C-N 3.26Å; G24-W26 PolarHBondContact O-N 3.24Å; G24-W26 PolarHBondContact O-NE1 3.12Å
25	H	83.9	Confident	82	Confident	67 Å²	67	55.3 Å²	55.3	31%	0.31	27%	0.266	S	S	.	.			trans	-81.5	66.3	178.7	-70.1	126.3	0	0	0	111.8	C20 E23 D27 R28	C20-H25 HydrophobicContact CB-CB 4.36Å; C20-H25 PolarHBondContact O-N 2.91Å; E23-H25 VanDerWaalsContact CB-ND1 3.35Å; E23-H25 WeakPolarHBondContact CB-ND1 3.33Å; E23-H25 IonicContact OE2-CE1 3.63Å; E23-H25 PolarHBondContact OE2-CE1 3.39Å; E23-H25 IonicContact OE2-ND1 3.82Å; E23-H25 PolarHBondContact OE2-ND1 2.91Å; H25-D27 VanDerWaalsContact C-N 3.32Å; H25-D27 PolarHBondContact O-N 2.92Å; H25-R28 PolarHBondContact O-N 3.07Å
26	W	85.1	Confident	81.9	Confident	31 Å²	31	52.3 Å²	52.3	12%	0.117	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-65.7	-29.1	-172.2	-54.4	115.5	0	0	0	114.2	R21 G24 R28 M29 P30 E71 A72 E75 R163	R21-W26 HydrophobicContact CG-CZ3 4.5Å; G24-W26 VanDerWaalsContact C-N 3.26Å; G24-W26 PolarHBondContact O-N 3.24Å; G24-W26 PolarHBondContact O-NE1 3.12Å; W26-R28 PolarHBondContact O-N 3.27Å; W26-M29 HydrophobicContact CE3-CE 3.77Å; W26-M29 HydrophobicContact CZ3-CE 3.7Å; W26-M29 VanDerWaalsContact O-CB 3.28Å; W26-M29 WeakPolarHBondContact O-CB 3.5Å; W26-M29 PolarHBondContact O-N 2.91Å; W26-M29 VanDerWaalsContact O-N 3.14Å; W26-P30 WeakPolarHBondContact O-CD 3.39Å; W26-E71 HydrophobicContact CH2-CG 3.89Å; W26-E71 WeakPolarHBondContact CH2-OE1 3.42Å; W26-E71 HydrophobicContact CZ3-CB 4.42Å; W26-E71 HydrophobicContact CZ3-CG 3.86Å; W26-A72 HydrophobicContact CB-CB 4.38Å; W26-A72 HydrophobicContact CE3-CB 3.98Å; W26-E75 HydrophobicContact CD2-CB 3.83Å; W26-E75 HydrophobicContact CD2-CG 4.24Å; W26-E75 VanDerWaalsContact CE2-CB 3.47Å; W26-E75 HydrophobicContact CG-CB 4.02Å; W26-E75 HydrophobicContact CH2-CG 4.05Å; W26-E75 HydrophobicContact CZ2-CB 3.97Å; W26-E75 HydrophobicContact CZ2-CG 3.57Å; W26-R163 VanDerWaalsContact CH2-NH2 3.26Å
27	D	82	Confident	81.6	Confident	126 Å²	126	51.9 Å²	51.9	67%	0.674	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-64.3	-28.5	-179.9	-58.8	-46	0	0	0	113.1	H25	H25-D27 VanDerWaalsContact C-N 3.32Å; H25-D27 PolarHBondContact O-N 2.92Å
28	R	81.3	Confident	80.9	Confident	135 Å²	135	56.4 Å²	56.4	51%	0.509	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-85.8	-13.4	179.3	-67.1	-175.6	173.4	-176.3	-0.4	113	H25 W26 E31 L32	H25-R28 PolarHBondContact O-N 3.07Å; W26-R28 PolarHBondContact O-N 3.27Å; R28-E31 PolarHBondContact O-N 2.89Å; R28-L32 WeakPolarHBondContact O-CG 3.4Å; R28-L32 PolarHBondContact O-N 3.35Å
29	M	82.6	Confident	79.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.2	-45.9	-175	-157.5	66.9	67	0	0	113	L17 C20 R21 W26 E31 L32 V33 L68 A72	L17-M29 HydrophobicContact CD2-SD 3.63Å; C20-M29 HydrophobicContact CB-CE 4.08Å; R21-M29 HydrophobicContact CB-CE 4.38Å; R21-M29 HydrophobicContact CG-CE 3.5Å; R21-M29 VanDerWaalsContact CG-CE 3.5Å; R21-M29 HydrophobicContact CG-SD 4.24Å; W26-M29 HydrophobicContact CE3-CE 3.77Å; W26-M29 HydrophobicContact CZ3-CE 3.7Å; W26-M29 VanDerWaalsContact O-CB 3.28Å; W26-M29 WeakPolarHBondContact O-CB 3.5Å; W26-M29 PolarHBondContact O-N 2.91Å; W26-M29 VanDerWaalsContact O-N 3.14Å; M29-E31 VanDerWaalsContact C-N 3.28Å; M29-E31 PolarHBondContact O-N 3.41Å; M29-L32 PolarHBondContact O-N 3.44Å; M29-V33 HydrophobicContact CG-CG2 4.49Å; M29-V33 VanDerWaalsContact O-CG2 3.3Å; M29-V33 WeakPolarHBondContact O-CG2 3.46Å; M29-V33 PolarHBondContact O-N 3.29Å; M29-L68 HydrophobicContact CG-CB 4.32Å; M29-L68 HydrophobicContact SD-CB 4.48Å; M29-A72 HydrophobicContact CB-CB 3.87Å; M29-A72 HydrophobicContact CG-CB 4.05Å
30	P	83	Confident	78.6	Confident	51 Å²	51	54.4 Å²	54.4	33%	0.331	27%	0.271	S	S	.	.	H	α-helix	trans	-65.1	-30.7	-178.7	-22.1	35	0	0	0	113.6	W26 R34 L69	W26-P30 WeakPolarHBondContact O-CD 3.39Å; P30-R34 WeakPolarHBondContact O-CB 3.33Å; P30-R34 PolarHBondContact O-N 2.95Å; P30-L69 HydrophobicContact CB-CD2 4Å; P30-L69 HydrophobicContact CG-CD2 4.17Å
31	E	81.9	Confident	76.7	Confident	111 Å²	111	61 Å²	61	52%	0.519	30%	0.303	S	S	.	.	H	α-helix	trans	-72.8	-43.4	177.8	-63.2	-175.6	164.3	0	0	111.6	R28 M29 R34 Q35	R28-E31 PolarHBondContact O-N 2.89Å; M29-E31 VanDerWaalsContact C-N 3.28Å; M29-E31 PolarHBondContact O-N 3.41Å; E31-R34 WeakPolarHBondContact O-CB 3.31Å; E31-R34 PolarHBondContact O-N 2.94Å; E31-Q35 WeakPolarHBondContact O-CG 3.35Å; E31-Q35 PolarHBondContact O-N 3.46Å
32	L	79.8	Confident	74.5	Confident	15 Å²	15	65.6 Å²	65.6	8%	0.079	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-38.7	178	-68.3	173	0	0	0	112.3	L17 C20 R28 M29 R34 Q35 L36	L17-L32 HydrophobicContact CD2-CB 3.48Å; L17-L32 VanDerWaalsContact CD2-CB 3.48Å; L17-L32 HydrophobicContact CD2-CD1 4.04Å; L17-L32 HydrophobicContact CD2-CG 4.41Å; L17-L32 HydrophobicContact CG-CB 4.17Å; C20-L32 HydrophobicContact CB-CD1 4.31Å; C20-L32 VanDerWaalsContact SG-CD1 3.58Å; R28-L32 WeakPolarHBondContact O-CG 3.4Å; R28-L32 PolarHBondContact O-N 3.35Å; M29-L32 PolarHBondContact O-N 3.44Å; L32-R34 VanDerWaalsContact C-N 3.31Å; L32-R34 PolarHBondContact O-N 3.43Å; L32-Q35 WeakPolarHBondContact O-CB 3.42Å; L32-Q35 PolarHBondContact O-N 2.98Å; L32-L36 PolarHBondContact O-N 2.85Å
33	V	81.2	Confident	72.4	Confident	4 Å²	4	69.2 Å²	69.2	2%	0.024	37%	0.37	C	S	.	.	H	α-helix	trans	-61.9	-40.7	173.4	172.4	0	0	0	0	110.8	M29 Q35 L36 Q37 L68 L69	M29-V33 HydrophobicContact CG-CG2 4.49Å; M29-V33 VanDerWaalsContact O-CG2 3.3Å; M29-V33 WeakPolarHBondContact O-CG2 3.46Å; M29-V33 PolarHBondContact O-N 3.29Å; V33-Q35 VanDerWaalsContact C-N 3.34Å; V33-Q35 PolarHBondContact O-N 3.38Å; V33-L36 PolarHBondContact O-N 3.32Å; V33-Q37 WeakPolarHBondContact O-CG 3.38Å; V33-Q37 PolarHBondContact O-N 3.04Å; V33-L68 HydrophobicContact CG2-CB 3.84Å; V33-L68 HydrophobicContact CG2-CD1 3.93Å; V33-L69 HydrophobicContact CG1-CD1 4.36Å; V33-L69 HydrophobicContact CG1-CG 4.36Å
34	R	79.4	Confident	70.2	Confident	145 Å²	145	73.5 Å²	73.5	55%	0.547	40%	0.404	S	S	.	.	H	α-helix	trans	-63.9	-39.9	176.2	-147.4	-176	-61.8	122.9	-1.2	111.5	P30 E31 L32 Q37 T38	P30-R34 WeakPolarHBondContact O-CB 3.33Å; P30-R34 PolarHBondContact O-N 2.95Å; E31-R34 WeakPolarHBondContact O-CB 3.31Å; E31-R34 PolarHBondContact O-N 2.94Å; L32-R34 VanDerWaalsContact C-N 3.31Å; L32-R34 PolarHBondContact O-N 3.43Å; R34-Q37 PolarHBondContact O-N 3.34Å; R34-T38 WeakPolarHBondContact O-CG2 3.47Å; R34-T38 PolarHBondContact O-N 2.9Å; R34-T38 PolarHBondContact O-OG1 3.22Å
35	Q	78.1	Confident	67.8	Low	91 Å²	91	76 Å²	76	43%	0.425	43%	0.43	S	S	.	.	H	α-helix	trans	-64.5	-42.3	175.2	-70.4	175.5	13.6	0	0	112	E31 L32 V33 Q37 T38 L39	E31-Q35 WeakPolarHBondContact O-CG 3.35Å; E31-Q35 PolarHBondContact O-N 3.46Å; L32-Q35 WeakPolarHBondContact O-CB 3.42Å; L32-Q35 PolarHBondContact O-N 2.98Å; V33-Q35 VanDerWaalsContact C-N 3.34Å; V33-Q35 PolarHBondContact O-N 3.38Å; Q35-Q37 PolarHBondContact O-N 3.01Å; Q35-T38 WeakPolarHBondContact CA-OG1 3.41Å; Q35-T38 PolarHBondContact O-N 3.43Å; Q35-T38 PolarHBondContact O-OG1 2.99Å; Q35-L39 WeakPolarHBondContact O-CG 3.46Å; Q35-L39 PolarHBondContact O-N 3.21Å; Q35-L39 VanDerWaalsContact O-N 3.11Å
36	L	76.8	Confident	65.3	Low	4 Å²	4	76.7 Å²	76.7	2%	0.021	46%	0.455	C	S	.	.	H	α-helix	trans	-60.1	-46.1	175.5	-170.2	128.4	0	0	0	111.3	V13 E14 L17 L32 V33 T38 L39 S40	V13-L36 HydrophobicContact CG1-CB 4.26Å; V13-L36 HydrophobicContact CG1-CD1 4.29Å; E14-L36 HydrophobicContact CG-CD1 4.24Å; L17-L36 HydrophobicContact CD1-CD1 3.69Å; L32-L36 PolarHBondContact O-N 2.85Å; V33-L36 PolarHBondContact O-N 3.32Å; L36-T38 VanDerWaalsContact C-N 3.33Å; L36-T38 PolarHBondContact O-N 3Å; L36-L39 PolarHBondContact O-N 3.44Å; L36-S40 PolarHBondContact O-N 3.35Å; L36-S40 PolarHBondContact O-OG 3.34Å; L36-S40 VanDerWaalsContact O-OG 3.1Å
37	Q	71.9	Confident	62.5	Low	73 Å²	73	81.3 Å²	81.3	34%	0.341	49%	0.492	S	S	.	.	H	α-helix	trans	-61.8	-37	176.3	-71.1	173.4	-15.6	0	0	113	V33 R34 Q35	V33-Q37 WeakPolarHBondContact O-CG 3.38Å; V33-Q37 PolarHBondContact O-N 3.04Å; R34-Q37 PolarHBondContact O-N 3.34Å; Q35-Q37 PolarHBondContact O-N 3.01Å
38	T	69.1	Low	60.3	Low	97 Å²	97	84.4 Å²	84.4	60%	0.595	50%	0.5	S	S	*	.	H	α-helix	trans	-71.3	-28.7	177.2	58.2	0	0	0	0	113.7	R34 Q35 L36	R34-T38 WeakPolarHBondContact O-CG2 3.47Å; R34-T38 PolarHBondContact O-N 2.9Å; R34-T38 PolarHBondContact O-OG1 3.22Å; Q35-T38 WeakPolarHBondContact CA-OG1 3.41Å; Q35-T38 PolarHBondContact O-N 3.43Å; Q35-T38 PolarHBondContact O-OG1 2.99Å; L36-T38 VanDerWaalsContact C-N 3.33Å; L36-T38 PolarHBondContact O-N 3Å
39	L	62.9	Low	57.7	Low	82 Å²	82	89.7 Å²	89.7	43%	0.429	52%	0.52	S	S	.	.	H	α-helix	trans	-79.7	-18.7	179.6	-71.5	167.1	0	0	0	113	V13 Q35 L36	V13-L39 HydrophobicContact CG2-CD1 3.85Å; Q35-L39 WeakPolarHBondContact O-CG 3.46Å; Q35-L39 PolarHBondContact O-N 3.21Å; Q35-L39 VanDerWaalsContact O-N 3.11Å; L36-L39 PolarHBondContact O-N 3.44Å
40	S	54.6	Low	55.3	Low	37 Å²	37	94.6 Å²	94.6	26%	0.259	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.5	-2.7	-179.5	-54	0	0	0	0	115	L36	L36-S40 PolarHBondContact O-N 3.35Å; L36-S40 PolarHBondContact O-OG 3.34Å; L36-S40 VanDerWaalsContact O-OG 3.1Å
41	M	43.7	Very low	52.5	Low	146 Å²	146	97.2 Å²	97.2	72%	0.719	58%	0.579	S	S	*	*	S	Bend	trans	-88.2	125.1	179.9	-68.4	-64	-71.9	0	0	112.2	G43	M41-G43 PolarHBondContact O-N 2.86Å
42	P	40.5	Very low	50.3	Low	98 Å²	98	98.4 Å²	98.4	64%	0.636	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-71.4	128.9	172	-6.6	21.5	0	0	0	110.3	S44	P42-S44 PolarHBondContact O-N 2.97Å
43	G	38.5	Very low	47.9	Very low	79 Å²	79	102.6 Å²	102.6	81%	0.814	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-55.6	130.3	-179.1	0	0	0	0	0	113.7	M41	M41-G43 PolarHBondContact O-N 2.86Å
44	S	36.3	Very low	45.5	Very low	128 Å²	128	106.7 Å²	106.7	90%	0.895	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-73.8	123.3	171.8	73.5	0	0	0	0	110.7	P42	P42-S44 PolarHBondContact O-N 2.97Å
45	G	31.1	Very low	43.1	Very low	77 Å²	77	104.8 Å²	104.8	79%	0.794	68%	0.677	S	S	*	*			trans	-174.1	80.9	173.3	0	0	0	0	0	113.6
46	G	31.6	Very low	40.9	Very low	80 Å²	80	109.3 Å²	109.3	83%	0.825	70%	0.696	S	S	*	*			trans	38.4	114.1	153.2	0	0	0	0	0	121.9
47	S	26.8	Very low	38.9	Very low	128 Å²	128	112.8 Å²	112.8	90%	0.895	72%	0.724	S	S	*	*				157.8	148.3	114.4	-164.8	0	0	0	0	112.6
48	K	34.5	Very low	37.6	Very low	192 Å²	192	112.1 Å²	112.1	84%	0.835	73%	0.728	S	S	*	*			trans	-70.8	134.7	-168.2	-64.4	167.8	172	173.3	0	113.8
49	R	28.1	Very low	36.6	Very low	246 Å²	246	111.2 Å²	111.2	93%	0.928	72%	0.724	S	S	*	*				153.2	118.1	121.1	-88.6	179	170.3	171.5	-2.6	113
50	A	30.6	Very low	36.1	Very low	103 Å²	103	111.3 Å²	111.3	85%	0.851	73%	0.725	S	S	*	*			trans	46.1	100	143.5	0	0	0	0	0	121.2
51	S	25.3	Very low	36.5	Very low	105 Å²	105	111.2 Å²	111.2	73%	0.734	72%	0.723	S	S	*	*				-170.1	142	127.8	56.5	0	0	0	0	110.1	S53	S51-S53 PolarHBondContact O-N 3.29Å
52	P	35.3	Very low	37.8	Very low	136 Å²	136	107.8 Å²	107.8	88%	0.883	71%	0.707	S	S	*	*			trans	-95.6	83.3	-176.3	35.4	-28.3	0	0	0	110.7
53	S	30.2	Very low	39.7	Very low	104 Å²	104	103.4 Å²	103.4	73%	0.727	68%	0.678	S	S	*	*			trans	-166.3	81.6	166.3	62.1	0	0	0	0	111.7	S51	S51-S53 PolarHBondContact O-N 3.29Å
54	A	30.5	Very low	41.7	Very low	90 Å²	90	100.6 Å²	100.6	74%	0.744	64%	0.644	S	S	*	*			trans	168.7	80.9	152.7	0	0	0	0	0	109.6
55	A	28.1	Very low	43.9	Very low	104 Å²	104	94.5 Å²	94.5	86%	0.86	60%	0.601	S	S	*	*			trans	-93.1	89.9	159.3	0	0	0	0	0	107.5
56	F	32.6	Very low	46.5	Very low	187 Å²	187	92.9 Å²	92.9	82%	0.82	57%	0.572	S	S	*	*			trans	-126	74.3	168.6	-84.1	-79.2	0	0	0	108.5
57	A	35.6	Very low	49.2	Very low	76 Å²	76	89.1 Å²	89.1	63%	0.628	53%	0.533	S	S	*	.			trans	-100.7	113.3	143.3	0	0	0	0	0	103.8	P59	A57-P59 WeakPolarHBondContact O-CD 3.46Å
58	S	43.2	Very low	52	Low	59 Å²	59	83 Å²	83	41%	0.413	49%	0.491	S	S	.	.			trans	-81.2	108.9	-174.3	46.2	0	0	0	0	110.7	D60 T61	S58-D60 PolarHBondContact O-N 3.37Å; S58-T61 PolarHBondContact O-N 3.39Å; S58-T61 PolarHBondContact O-OG1 3.33Å
59	P	48.3	Very low	54.5	Low	79 Å²	79	76 Å²	76	51%	0.513	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-7.5	174.3	25.8	-34.4	0	0	0	114.1	A57 T61 D62	A57-P59 WeakPolarHBondContact O-CD 3.46Å; P59-T61 PolarHBondContact O-N 3.37Å; P59-D62 PolarHBondContact O-N 3.46Å
60	D	53.6	Low	57.4	Low	83 Å²	83	64.3 Å²	64.3	44%	0.444	42%	0.418	S	S	.	.	H	α-helix	trans	-64.5	-22.8	175.3	-57.2	-22.8	0	0	0	113.2	S58 F64	S58-D60 PolarHBondContact O-N 3.37Å; D60-F64 WeakPolarHBondContact O-CB 3.34Å; D60-F64 PolarHBondContact O-N 3.01Å
61	T	61.3	Low	60.3	Low	36 Å²	36	59.4 Å²	59.4	22%	0.221	38%	0.378	C	S	.	.	H	α-helix	trans	-74.3	-29.2	-178.3	50.4	0	0	0	0	113.5	S58 P59 G65	S58-T61 PolarHBondContact O-N 3.39Å; S58-T61 PolarHBondContact O-OG1 3.33Å; P59-T61 PolarHBondContact O-N 3.37Å; T61-G65 PolarHBondContact O-N 3.44Å; T61-G65 VanDerWaalsContact O-N 3.13Å
62	D	72.7	Confident	63.3	Low	74 Å²	74	54.7 Å²	54.7	40%	0.396	35%	0.345	S	S	.	.	H	α-helix	trans	-77.2	-44	-179.5	-172.6	43.9	0	0	0	111.9	P59 F64 G65 K66	P59-D62 PolarHBondContact O-N 3.46Å; D62-F64 VanDerWaalsContact C-N 3.34Å; D62-F64 PolarHBondContact O-N 2.98Å; D62-G65 PolarHBondContact O-N 2.97Å; D62-K66 WeakPolarHBondContact O-CG 3.35Å; D62-K66 PolarHBondContact O-N 2.81Å; D62-K66 VanDerWaalsContact OD2-CE 3.27Å; D62-K66 WeakPolarHBondContact OD2-CE 3.45Å; D62-K66 IonicContact OD2-NZ 2.77Å; D62-K66 PolarHBondContact OD2-NZ 3.21Å
63	D	79.3	Confident	65.8	Low	5 Å²	5	49.8 Å²	49.8	3%	0.027	31%	0.311	C	S	.	.	H	α-helix	trans	-70.5	-30.3	177.2	-74.1	-15.5	0	0	0	111.9	K66 L67 I109 H112 L115	D63-K66 PolarHBondContact O-N 3.24Å; D63-K66 IonicContact OD1-NZ 3.19Å; D63-K66 PolarHBondContact OD1-NZ 2.97Å; D63-L67 PolarHBondContact O-N 3.34Å; D63-L67 VanDerWaalsContact O-N 3.11Å; D63-I109 HydrophobicContact CB-CG1 4.5Å; D63-H112 IonicContact OD1-ND1 3.22Å; D63-H112 IonicContact OD2-ND1 2.97Å; D63-L115 HydrophobicContact CB-CD1 4.47Å; D63-L115 HydrophobicContact CB-CD2 3.95Å; D63-L115 HydrophobicContact CB-CG 4.12Å
64	F	81.5	Confident	68.6	Low	21 Å²	21	44.9 Å²	44.9	9%	0.092	28%	0.277	C	S	.	.	H	α-helix	trans	-69.3	-40.5	172.2	-178.3	-115.1	0	0	0	111.8	D60 D62 K66 L67 L68 L115 Y119	D60-F64 WeakPolarHBondContact O-CB 3.34Å; D60-F64 PolarHBondContact O-N 3.01Å; D62-F64 VanDerWaalsContact C-N 3.34Å; D62-F64 PolarHBondContact O-N 2.98Å; F64-K66 VanDerWaalsContact C-N 3.35Å; F64-K66 PolarHBondContact O-N 3Å; F64-L67 HydrophobicContact CD2-CD2 4.46Å; F64-L67 WeakPolarHBondContact O-CB 3.4Å; F64-L67 PolarHBondContact O-N 3.31Å; F64-L68 HydrophobicContact CD1-CD1 4.19Å; F64-L68 HydrophobicContact CE1-CD1 3.74Å; F64-L68 HydrophobicContact CZ-CD1 3.93Å; F64-L68 HydrophobicContact CZ-CD2 4.42Å; F64-L68 HydrophobicContact CZ-CG 4.35Å; F64-L68 WeakPolarHBondContact O-CG 3.28Å; F64-L68 PolarHBondContact O-N 3.08Å; F64-L115 HydrophobicContact CB-CD2 4.09Å; F64-Y119 HydrophobicContact CD2-CD1 4.1Å; F64-Y119 HydrophobicContact CD2-CD2 4.01Å; F64-Y119 HydrophobicContact CD2-CE1 4.17Å; F64-Y119 HydrophobicContact CD2-CE2 4.08Å; F64-Y119 HydrophobicContact CD2-CG 4.04Å; F64-Y119 AromaticContact CE2-CD1 3.67Å; F64-Y119 HydrophobicContact CE2-CD1 3.67Å; F64-Y119 HydrophobicContact CE2-CD2 4.19Å; F64-Y119 AromaticContact CE2-CE1 3.4Å; F64-Y119 HydrophobicContact CE2-CE1 3.4Å; F64-Y119 VanDerWaalsContact CE2-CE1 3.4Å; F64-Y119 AromaticContact CE2-CE2 3.95Å; F64-Y119 HydrophobicContact CE2-CE2 3.95Å; F64-Y119 HydrophobicContact CE2-CG 4.08Å; F64-Y119 AromaticContact CE2-CZ 3.54Å; F64-Y119 HydrophobicContact CZ-CE1 4.15Å
65	G	82.5	Confident	71.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.6	-41.6	173	0	0	0	0	0	112.8	T61 D62 L67 L68 L69	T61-G65 PolarHBondContact O-N 3.44Å; T61-G65 VanDerWaalsContact O-N 3.13Å; D62-G65 PolarHBondContact O-N 2.97Å; G65-L67 VanDerWaalsContact C-N 3.35Å; G65-L67 PolarHBondContact O-N 2.86Å; G65-L68 PolarHBondContact O-N 2.79Å; G65-L69 WeakPolarHBondContact O-CG 3.44Å; G65-L69 PolarHBondContact O-N 3.46Å; G65-L69 VanDerWaalsContact O-N 3.08Å
66	K	85.3	Confident	74.2	Confident	43 Å²	43	39.3 Å²	39.3	19%	0.187	22%	0.217	C	C	.	.	H	α-helix	trans	-63.8	-36.6	175.4	-70.6	170.9	-161.6	152	0	112.8	D62 D63 F64 L69 A70 Y105 I109	D62-K66 WeakPolarHBondContact O-CG 3.35Å; D62-K66 PolarHBondContact O-N 2.81Å; D62-K66 VanDerWaalsContact OD2-CE 3.27Å; D62-K66 WeakPolarHBondContact OD2-CE 3.45Å; D62-K66 IonicContact OD2-NZ 2.77Å; D62-K66 PolarHBondContact OD2-NZ 3.21Å; D63-K66 PolarHBondContact O-N 3.24Å; D63-K66 IonicContact OD1-NZ 3.19Å; D63-K66 PolarHBondContact OD1-NZ 2.97Å; F64-K66 VanDerWaalsContact C-N 3.35Å; F64-K66 PolarHBondContact O-N 3Å; K66-L69 PolarHBondContact O-N 3.39Å; K66-A70 WeakPolarHBondContact O-CB 3.21Å; K66-A70 PolarHBondContact O-N 3.05Å; K66-Y105 HydrophobicContact CB-CD1 4.2Å; K66-Y105 HydrophobicContact CB-CG 4.42Å; K66-Y105 HydrophobicContact CD-CD1 4.21Å; K66-Y105 HydrophobicContact CG-CD1 3.99Å; K66-Y105 HydrophobicContact CG-CE1 4.38Å; K66-I109 HydrophobicContact CB-CD1 3.97Å; K66-I109 HydrophobicContact CB-CG1 4.47Å
67	L	87.5	Confident	76.7	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60	-48.1	175.5	178.3	63.8	0	0	0	111.3	D63 F64 G65 A70 E71 L106 I109 L115 Y119 E122 A123 I126	D63-L67 PolarHBondContact O-N 3.34Å; D63-L67 VanDerWaalsContact O-N 3.11Å; F64-L67 HydrophobicContact CD2-CD2 4.46Å; F64-L67 WeakPolarHBondContact O-CB 3.4Å; F64-L67 PolarHBondContact O-N 3.31Å; G65-L67 VanDerWaalsContact C-N 3.35Å; G65-L67 PolarHBondContact O-N 2.86Å; L67-A70 PolarHBondContact O-N 3.27Å; L67-E71 PolarHBondContact O-N 2.98Å; L67-L106 HydrophobicContact CD1-CD2 3.88Å; L67-I109 HydrophobicContact CB-CD1 3.99Å; L67-L115 HydrophobicContact CD2-CD1 4.41Å; L67-Y119 HydrophobicContact CD2-CD1 4.4Å; L67-Y119 HydrophobicContact CD2-CG 4.49Å; L67-E122 HydrophobicContact CD2-CB 4.35Å; L67-A123 HydrophobicContact CD1-CB 3.7Å; L67-I126 HydrophobicContact CD1-CD1 3.93Å
68	L	87	Confident	79.1	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-65.6	-39.6	-179.6	-65.3	174.7	0	0	0	112.4	L17 R21 M29 V33 F64 G65 E71 A72	L17-L68 HydrophobicContact CD1-CD1 4.05Å; L17-L68 HydrophobicContact CD2-CD1 4.12Å; R21-L68 HydrophobicContact CG-CD2 4.32Å; M29-L68 HydrophobicContact CG-CB 4.32Å; M29-L68 HydrophobicContact SD-CB 4.48Å; V33-L68 HydrophobicContact CG2-CB 3.84Å; V33-L68 HydrophobicContact CG2-CD1 3.93Å; F64-L68 HydrophobicContact CD1-CD1 4.19Å; F64-L68 HydrophobicContact CE1-CD1 3.74Å; F64-L68 HydrophobicContact CZ-CD1 3.93Å; F64-L68 HydrophobicContact CZ-CD2 4.42Å; F64-L68 HydrophobicContact CZ-CG 4.35Å; F64-L68 WeakPolarHBondContact O-CG 3.28Å; F64-L68 PolarHBondContact O-N 3.08Å; G65-L68 PolarHBondContact O-N 2.79Å; L68-E71 PolarHBondContact O-N 3.42Å; L68-A72 PolarHBondContact O-N 2.65Å
69	L	87	Confident	81	Confident	44 Å²	44	31.9 Å²	31.9	23%	0.23	16%	0.164	C	C	.	.	H	α-helix	trans	-65.8	-40.1	174.5	-70.5	172.6	0	0	0	111.7	P30 V33 G65 K66 A72 L73	P30-L69 HydrophobicContact CB-CD2 4Å; P30-L69 HydrophobicContact CG-CD2 4.17Å; V33-L69 HydrophobicContact CG1-CD1 4.36Å; V33-L69 HydrophobicContact CG1-CG 4.36Å; G65-L69 WeakPolarHBondContact O-CG 3.44Å; G65-L69 PolarHBondContact O-N 3.46Å; G65-L69 VanDerWaalsContact O-N 3.08Å; K66-L69 PolarHBondContact O-N 3.39Å; L69-A72 PolarHBondContact O-N 3.31Å; L69-L73 WeakPolarHBondContact O-CB 3.49Å; L69-L73 VanDerWaalsContact O-CG 3.3Å; L69-L73 WeakPolarHBondContact O-CG 3.5Å; L69-L73 PolarHBondContact O-N 3.46Å
70	A	88.3	Confident	82.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.2	-41.3	176.1	0	0	0	0	0	112.2	K66 L67 L74 A102 L106	K66-A70 WeakPolarHBondContact O-CB 3.21Å; K66-A70 PolarHBondContact O-N 3.05Å; L67-A70 PolarHBondContact O-N 3.27Å; A70-L74 WeakPolarHBondContact O-CB 3.38Å; A70-L74 PolarHBondContact O-N 3.14Å; A70-L74 VanDerWaalsContact O-N 3.13Å; A70-A102 HydrophobicContact CB-CB 4.3Å; A70-L106 HydrophobicContact CB-CD1 4.32Å; A70-L106 HydrophobicContact CB-CD2 4Å; A70-L106 HydrophobicContact CB-CG 3.82Å
71	E	90.6	Very high	84	Confident	1 Å²	1	30 Å²	30	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-62	-48.1	174.4	-165.6	179.4	-179.3	0	0	111.3	R21 W26 L67 L68 L73 L74 E75 I126 R163	R21-E71 IonicContact CZ-OE2 3.17Å; R21-E71 IonicContact NE-OE2 2.72Å; R21-E71 PolarHBondContact NE-OE2 2.93Å; R21-E71 IonicContact NH2-OE1 3.78Å; R21-E71 IonicContact NH2-OE2 3.22Å; R21-E71 PolarHBondContact NH2-OE2 3.3Å; W26-E71 HydrophobicContact CH2-CG 3.89Å; W26-E71 WeakPolarHBondContact CH2-OE1 3.42Å; W26-E71 HydrophobicContact CZ3-CB 4.42Å; W26-E71 HydrophobicContact CZ3-CG 3.86Å; L67-E71 PolarHBondContact O-N 2.98Å; L68-E71 PolarHBondContact O-N 3.42Å; E71-L73 PolarHBondContact O-N 2.76Å; E71-L74 PolarHBondContact O-N 2.98Å; E71-E75 HydrophobicContact CG-CG 4.39Å; E71-E75 WeakPolarHBondContact O-CG 3.42Å; E71-E75 PolarHBondContact O-N 3.12Å; E71-I126 HydrophobicContact CB-CD1 3.88Å; E71-I126 HydrophobicContact CG-CD1 3.95Å; E71-I126 HydrophobicContact CG-CG1 4.41Å; E71-R163 IonicContact OE1-CZ 2.9Å; E71-R163 IonicContact OE1-NH2 3.02Å; E71-R163 PolarHBondContact OE1-NH2 3.08Å
72	A	88.3	Confident	84.9	Confident	6 Å²	6	32 Å²	32	5%	0.05	15%	0.152	C	C	.	.	H	α-helix	trans	-62.4	-43.6	-179.2	0	0	0	0	0	113	W26 M29 L68 L69 L74 E75 Q76	W26-A72 HydrophobicContact CB-CB 4.38Å; W26-A72 HydrophobicContact CE3-CB 3.98Å; M29-A72 HydrophobicContact CB-CB 3.87Å; M29-A72 HydrophobicContact CG-CB 4.05Å; L68-A72 PolarHBondContact O-N 2.65Å; L69-A72 PolarHBondContact O-N 3.31Å; A72-L74 VanDerWaalsContact C-N 3.33Å; A72-L74 PolarHBondContact O-N 3.42Å; A72-E75 PolarHBondContact O-N 3.01Å; A72-Q76 WeakPolarHBondContact O-CB 3.33Å; A72-Q76 PolarHBondContact O-N 3.38Å
73	L	88.5	Confident	85.1	Confident	32 Å²	32	31.6 Å²	31.6	17%	0.168	16%	0.16	C	C	.	.	H	α-helix	trans	-63.1	-40	177.1	-73.9	172.4	0	0	0	112	L69 E71 C77 K98 E101 A102 Y105	L69-L73 WeakPolarHBondContact O-CB 3.49Å; L69-L73 VanDerWaalsContact O-CG 3.3Å; L69-L73 WeakPolarHBondContact O-CG 3.5Å; L69-L73 PolarHBondContact O-N 3.46Å; E71-L73 PolarHBondContact O-N 2.76Å; L73-C77 WeakPolarHBondContact O-CB 3.45Å; L73-C77 PolarHBondContact O-N 3.22Å; L73-C77 VanDerWaalsContact O-N 3.1Å; L73-K98 HydrophobicContact CD2-CB 4.42Å; L73-K98 HydrophobicContact CD2-CG 4.32Å; L73-E101 HydrophobicContact CD1-CB 4.22Å; L73-E101 HydrophobicContact CD1-CG 4.19Å; L73-A102 HydrophobicContact CB-CB 4.26Å; L73-Y105 HydrophobicContact CD1-CD2 4.47Å; L73-Y105 HydrophobicContact CD1-CE2 4.16Å
74	L	88.3	Confident	85.1	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-67	-49.4	177.9	-177.6	62.2	0	0	0	111.2	A70 E71 A72 Q76 C77 L78 I126 K129 L130	A70-L74 WeakPolarHBondContact O-CB 3.38Å; A70-L74 PolarHBondContact O-N 3.14Å; A70-L74 VanDerWaalsContact O-N 3.13Å; E71-L74 PolarHBondContact O-N 2.98Å; A72-L74 VanDerWaalsContact C-N 3.33Å; A72-L74 PolarHBondContact O-N 3.42Å; L74-Q76 VanDerWaalsContact C-N 3.33Å; L74-Q76 PolarHBondContact O-N 3.38Å; L74-C77 WeakPolarHBondContact O-CB 3.28Å; L74-C77 PolarHBondContact O-N 3.02Å; L74-L78 HydrophobicContact CG-CD1 4.33Å; L74-L78 VanDerWaalsContact O-CG 3.31Å; L74-L78 WeakPolarHBondContact O-CG 3.45Å; L74-L78 PolarHBondContact O-N 3.39Å; L74-I126 HydrophobicContact CD2-CG2 3.75Å; L74-K129 HydrophobicContact CD2-CB 4.33Å; L74-K129 HydrophobicContact CD2-CD 4.03Å; L74-K129 HydrophobicContact CD2-CG 4.17Å; L74-L130 HydrophobicContact CD1-CB 4.33Å; L74-L130 HydrophobicContact CD1-CD1 4.42Å; L74-L130 HydrophobicContact CD1-CG 4.34Å; L74-L130 HydrophobicContact CD2-CB 4.18Å
75	E	88.9	Confident	85	Confident	13 Å²	13	35.2 Å²	35.2	6%	0.061	18%	0.176	C	C	.	.	H	α-helix	trans	-66.7	-33.9	-177.9	-64	-74.8	-174	0	0	112.3	W26 E71 A72 L78 K79 K129 R163	W26-E75 HydrophobicContact CD2-CB 3.83Å; W26-E75 HydrophobicContact CD2-CG 4.24Å; W26-E75 VanDerWaalsContact CE2-CB 3.47Å; W26-E75 HydrophobicContact CG-CB 4.02Å; W26-E75 HydrophobicContact CH2-CG 4.05Å; W26-E75 HydrophobicContact CZ2-CB 3.97Å; W26-E75 HydrophobicContact CZ2-CG 3.57Å; E71-E75 HydrophobicContact CG-CG 4.39Å; E71-E75 WeakPolarHBondContact O-CG 3.42Å; E71-E75 PolarHBondContact O-N 3.12Å; A72-E75 PolarHBondContact O-N 3.01Å; E75-L78 PolarHBondContact O-N 3.47Å; E75-K79 PolarHBondContact O-N 2.94Å; E75-K129 IonicContact OE1-NZ 2.84Å; E75-K129 PolarHBondContact OE1-NZ 2.98Å; E75-K129 IonicContact OE2-NZ 2.75Å; E75-R163 IonicContact OE1-NH1 3.89Å; E75-R163 PolarHBondContact OE1-NH1 3.44Å
76	Q	87.2	Confident	84.7	Confident	63 Å²	63	41.2 Å²	41.2	29%	0.294	20%	0.202	S	C	.	.	H	α-helix	trans	-65.9	-41.3	172	-168.5	179.5	16.5	0	0	112	A72 L74 L78 K79 E80	A72-Q76 WeakPolarHBondContact O-CB 3.33Å; A72-Q76 PolarHBondContact O-N 3.38Å; L74-Q76 VanDerWaalsContact C-N 3.33Å; L74-Q76 PolarHBondContact O-N 3.38Å; Q76-L78 VanDerWaalsContact C-N 3.31Å; Q76-L78 PolarHBondContact O-N 3.21Å; Q76-K79 PolarHBondContact O-N 3.34Å; Q76-E80 WeakPolarHBondContact O-CG 3.46Å; Q76-E80 PolarHBondContact O-N 3.41Å
77	C	85.7	Confident	84.3	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.007	22%	0.222	C	C	.	.	H	α-helix	trans	-61	-40.5	174.6	-177.9	0	0	0	0	111.7	L73 L74 E80 N81 K98	L73-C77 WeakPolarHBondContact O-CB 3.45Å; L73-C77 PolarHBondContact O-N 3.22Å; L73-C77 VanDerWaalsContact O-N 3.1Å; L74-C77 WeakPolarHBondContact O-CB 3.28Å; L74-C77 PolarHBondContact O-N 3.02Å; C77-E80 PolarHBondContact O-N 3.45Å; C77-N81 WeakPolarHBondContact O-CB 3.33Å; C77-N81 PolarHBondContact O-N 3.34Å; C77-N81 VanDerWaalsContact O-N 3.13Å; C77-N81 PolarHBondContact O-ND2 3.27Å; C77-K98 HydrophobicContact CB-CB 4.41Å
78	L	85.4	Confident	83.7	Confident	14 Å²	14	47.1 Å²	47.1	7%	0.073	24%	0.24	C	C	.	.	H	α-helix	trans	-65.3	-38.3	176.7	-65.5	172.3	0	0	0	112.2	L74 E75 Q76 N81 H82 I85 K129 V133 F239	L74-L78 HydrophobicContact CG-CD1 4.33Å; L74-L78 VanDerWaalsContact O-CG 3.31Å; L74-L78 WeakPolarHBondContact O-CG 3.45Å; L74-L78 PolarHBondContact O-N 3.39Å; E75-L78 PolarHBondContact O-N 3.47Å; Q76-L78 VanDerWaalsContact C-N 3.31Å; Q76-L78 PolarHBondContact O-N 3.21Å; L78-N81 PolarHBondContact O-N 3.31Å; L78-H82 PolarHBondContact O-N 2.94Å; L78-I85 HydrophobicContact CB-CD1 4.15Å; L78-I85 HydrophobicContact CD2-CD1 3.46Å; L78-I85 VanDerWaalsContact CD2-CD1 3.46Å; L78-I85 HydrophobicContact CD2-CG1 4.45Å; L78-I85 HydrophobicContact CG-CD1 4.41Å; L78-K129 HydrophobicContact CD1-CD 3.87Å; L78-V133 HydrophobicContact CD2-CG1 4.28Å; L78-V133 HydrophobicContact CD2-CG2 3.65Å; L78-F239 HydrophobicContact CD1-CE2 4.01Å; L78-F239 HydrophobicContact CD2-CE2 4.29Å
79	K	83.6	Confident	83.3	Confident	151 Å²	151	51.3 Å²	51.3	66%	0.657	26%	0.261	S	S	*	.	H	α-helix	trans	-65.6	-42.7	176.6	-168.2	174	-177.2	175.3	0	112.1	E75 Q76 N81	E75-K79 PolarHBondContact O-N 2.94Å; Q76-K79 PolarHBondContact O-N 3.34Å; K79-N81 VanDerWaalsContact C-N 3.32Å; K79-N81 PolarHBondContact O-N 2.88Å
80	E	84.4	Confident	83	Confident	108 Å²	108	52.1 Å²	52.1	51%	0.505	27%	0.269	S	S	.	.	H	α-helix	trans	-69.6	-27.7	179.4	-71.8	168.9	-176.4	0	0	113	Q76 C77 K98	Q76-E80 WeakPolarHBondContact O-CG 3.46Å; Q76-E80 PolarHBondContact O-N 3.41Å; C77-E80 PolarHBondContact O-N 3.45Å; E80-K98 IonicContact OE1-NZ 2.67Å; E80-K98 PolarHBondContact OE1-NZ 3.42Å; E80-K98 IonicContact OE2-NZ 2.79Å; E80-K98 PolarHBondContact OE2-NZ 2.86Å
81	N	81.9	Confident	82.6	Confident	14 Å²	14	52.7 Å²	52.7	8%	0.075	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	24.5	-176.1	-75.5	-66.4	0	0	0	114.2	C77 L78 K79 A83 K84 I85 L91 E96	C77-N81 WeakPolarHBondContact O-CB 3.33Å; C77-N81 PolarHBondContact O-N 3.34Å; C77-N81 VanDerWaalsContact O-N 3.13Å; C77-N81 PolarHBondContact O-ND2 3.27Å; L78-N81 PolarHBondContact O-N 3.31Å; K79-N81 VanDerWaalsContact C-N 3.32Å; K79-N81 PolarHBondContact O-N 2.88Å; N81-A83 PolarHBondContact O-N 3.48Å; N81-K84 PolarHBondContact O-N 3.46Å; N81-K84 VanDerWaalsContact O-N 3.15Å; N81-K84 PolarHBondContact OD1-NZ 3.34Å; N81-I85 HydrophobicContact CB-CD1 4.46Å; N81-I85 PolarHBondContact O-N 3.23Å; N81-L91 HydrophobicContact CB-CD1 3.87Å; N81-L91 HydrophobicContact CB-CD2 4.36Å; N81-E96 PolarHBondContact ND2-OE1 3.35Å
82	H	79.6	Confident	81.8	Confident	78 Å²	78	57.8 Å²	57.8	36%	0.361	30%	0.299	S	S	.	.	H	α-helix	trans	-50.5	-46.9	-173.4	-178.3	87.8	0	0	0	114.3	L78 K84 I85 K86	L78-H82 PolarHBondContact O-N 2.94Å; H82-K84 PolarHBondContact O-N 3.18Å; H82-I85 PolarHBondContact O-N 2.63Å; H82-K86 PolarHBondContact O-N 2.86Å
83	A	76.9	Confident	80.6	Confident	66 Å²	66	61.8 Å²	61.8	55%	0.545	32%	0.316	S	S	.	.	H	α-helix	trans	-61.1	-43.8	-179	0	0	0	0	0	112.8	N81 I85 K86 D87	N81-A83 PolarHBondContact O-N 3.48Å; A83-I85 VanDerWaalsContact C-N 3.3Å; A83-I85 PolarHBondContact O-N 3.03Å; A83-K86 WeakPolarHBondContact O-CB 3.49Å; A83-K86 PolarHBondContact O-N 2.81Å; A83-D87 PolarHBondContact O-N 2.95Å
84	K	79.8	Confident	79.4	Confident	89 Å²	89	69.8 Å²	69.8	39%	0.387	35%	0.35	S	S	.	.	H	α-helix	trans	-63.9	-36.4	179.6	-64.3	177.1	-171.2	157.6	0	112.1	N81 H82 D87 S88 I89 L91	N81-K84 PolarHBondContact O-N 3.46Å; N81-K84 VanDerWaalsContact O-N 3.15Å; N81-K84 PolarHBondContact OD1-NZ 3.34Å; H82-K84 PolarHBondContact O-N 3.18Å; K84-D87 CarbonylContact O-C 3.55Å; K84-D87 PolarHBondContact O-N 3.45Å; K84-S88 PolarHBondContact O-N 3.46Å; K84-I89 HydrophobicContact CB-CB 4.41Å; K84-I89 WeakPolarHBondContact O-CB 3.4Å; K84-I89 PolarHBondContact O-N 3.41Å; K84-L91 HydrophobicContact CB-CD2 4.38Å; K84-L91 HydrophobicContact CD-CD2 3.85Å
85	I	79.2	Confident	78.5	Confident	13 Å²	13	75.4 Å²	75.4	7%	0.067	38%	0.38	C	S	.	.	H	α-helix	trans	-69.8	-42	178.7	-63.1	158.5	0	0	0	110.2	L78 N81 H82 A83 D87 S88 Y238	L78-I85 HydrophobicContact CB-CD1 4.15Å; L78-I85 HydrophobicContact CD2-CD1 3.46Å; L78-I85 VanDerWaalsContact CD2-CD1 3.46Å; L78-I85 HydrophobicContact CD2-CG1 4.45Å; L78-I85 HydrophobicContact CG-CD1 4.41Å; N81-I85 HydrophobicContact CB-CD1 4.46Å; N81-I85 PolarHBondContact O-N 3.23Å; H82-I85 PolarHBondContact O-N 2.63Å; A83-I85 VanDerWaalsContact C-N 3.3Å; A83-I85 PolarHBondContact O-N 3.03Å; I85-D87 VanDerWaalsContact C-N 3.3Å; I85-D87 PolarHBondContact O-N 3.02Å; I85-S88 WeakPolarHBondContact O-CA 3.46Å; I85-S88 PolarHBondContact O-N 3.43Å; I85-Y238 HydrophobicContact CG2-CD1 3.5Å; I85-Y238 VanDerWaalsContact CG2-CD1 3.5Å; I85-Y238 HydrophobicContact CG2-CD2 4.42Å; I85-Y238 HydrophobicContact CG2-CE1 3.6Å; I85-Y238 HydrophobicContact CG2-CE2 4.5Å; I85-Y238 HydrophobicContact CG2-CG 3.93Å
86	K	76.1	Confident	78.2	Confident	127 Å²	127	76.3 Å²	76.3	55%	0.552	38%	0.384	S	S	*	.	H	α-helix	trans	-59.3	-42.5	174.6	-169.9	175.8	-178.5	173.4	0	111.6	H82 A83 S88 Y238	H82-K86 PolarHBondContact O-N 2.86Å; A83-K86 WeakPolarHBondContact O-CB 3.49Å; A83-K86 PolarHBondContact O-N 2.81Å; K86-S88 PolarHBondContact O-N 3.33Å; K86-Y238 HydrophobicContact CB-CE2 4.36Å
87	D	76.2	Confident	77.9	Confident	113 Å²	113	77.6 Å²	77.6	60%	0.604	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	5	175.7	-64.2	-22.9	0	0	0	113.6	A83 K84 I85 I89	A83-D87 PolarHBondContact O-N 2.95Å; K84-D87 CarbonylContact O-C 3.55Å; K84-D87 PolarHBondContact O-N 3.45Å; I85-D87 VanDerWaalsContact C-N 3.3Å; I85-D87 PolarHBondContact O-N 3.02Å; D87-I89 HydrophobicContact CB-CD1 4Å; D87-I89 HydrophobicContact CB-CG1 4.04Å; D87-I89 PolarHBondContact O-N 2.98Å
88	S	74.8	Confident	77.8	Confident	54 Å²	54	79.9 Å²	79.9	38%	0.378	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	26.2	177.8	-56.8	0	0	0	0	114.6	K84 I85 K86 P90 R178	K84-S88 PolarHBondContact O-N 3.46Å; I85-S88 WeakPolarHBondContact O-CA 3.46Å; I85-S88 PolarHBondContact O-N 3.43Å; K86-S88 PolarHBondContact O-N 3.33Å; S88-P90 WeakPolarHBondContact O-CD 3.46Å; S88-R178 VanDerWaalsContact CB-NH2 3.27Å; S88-R178 PolarHBondContact OG-NH2 2.86Å
89	I	79.6	Confident	77.8	Confident	89 Å²	89	79.2 Å²	79.2	46%	0.456	40%	0.404	S	S	.	.			trans	-83	120.2	178.4	-57	172.6	0	0	0	109	K84 D87	K84-I89 HydrophobicContact CB-CB 4.41Å; K84-I89 WeakPolarHBondContact O-CB 3.4Å; K84-I89 PolarHBondContact O-N 3.41Å; D87-I89 HydrophobicContact CB-CD1 4Å; D87-I89 HydrophobicContact CB-CG1 4.04Å; D87-I89 PolarHBondContact O-N 2.98Å
90	P	80	Confident	77.8	Confident	61 Å²	61	74 Å²	74	40%	0.396	39%	0.387	S	S	.	.			trans	-64.3	137.9	177.6	-21	33	0	0	0	112.4	S88	S88-P90 WeakPolarHBondContact O-CD 3.46Å
91	L	80	Confident	78	Confident	11 Å²	11	72.7 Å²	72.7	6%	0.058	38%	0.381	C	S	.	.			trans	-91.2	111.5	173.5	-60.3	177.7	0	0	0	109	N81 K84 M99 V133	N81-L91 HydrophobicContact CB-CD1 3.87Å; N81-L91 HydrophobicContact CB-CD2 4.36Å; K84-L91 HydrophobicContact CB-CD2 4.38Å; K84-L91 HydrophobicContact CD-CD2 3.85Å; L91-M99 HydrophobicContact CB-SD 4.31Å; L91-V133 HydrophobicContact CB-CG1 3.96Å; L91-V133 HydrophobicContact CD1-CG1 3.7Å; L91-V133 HydrophobicContact CG-CG1 4.03Å; L91-V133 PolarHBondContact N-O 3.49Å
92	L	73.9	Confident	78.2	Confident	109 Å²	109	72 Å²	72	57%	0.571	38%	0.377	S	S	*	.			trans	-78.2	135.5	179	-67.6	168.6	0	0	0	110.9	K94 N95	L92-K94 PolarHBondContact O-N 3.03Å; L92-N95 PolarHBondContact O-N 3.31Å
93	E	63.6	Low	78.6	Confident	89 Å²	89	70 Å²	70	42%	0.416	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-32.9	-179.4	-67.7	173.4	-147.7	0	0	114.7	N95 K103 E134	E93-N95 PolarHBondContact O-N 2.82Å; E93-K103 IonicContact OE1-NZ 3.58Å; E93-K103 PolarHBondContact OE1-NZ 3.47Å; E93-E134 HydrophobicContact CG-CG 3.98Å; E93-E134 VanDerWaalsContact CG-OE1 3.24Å; E93-E134 WeakPolarHBondContact CG-OE1 3.41Å
94	K	62.8	Low	79.2	Confident	201 Å²	201	72 Å²	72	87%	0.874	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-22	-178	-65.7	-177.1	-179.6	178.3	0	113.5	L92	L92-K94 PolarHBondContact O-N 3.03Å
95	N	68.8	Low	79.6	Confident	119 Å²	119	70.9 Å²	70.9	64%	0.636	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-13.9	-171.7	-63.8	-10.9	0	0	0	112.5	L92 E93	L92-N95 PolarHBondContact O-N 3.31Å; E93-N95 PolarHBondContact O-N 2.82Å
96	E	82.4	Confident	80	Confident	32 Å²	32	70.3 Å²	70.3	15%	0.15	36%	0.359	C	S	.	.			trans	-131.9	100.2	-173.2	-70.8	-64.6	171	0	0	111.6	N81 K98 M99 S100	N81-E96 PolarHBondContact ND2-OE1 3.35Å; E96-K98 PolarHBondContact O-N 3.43Å; E96-M99 HydrophobicContact CB-CB 4.09Å; E96-M99 PolarHBondContact O-N 3.1Å; E96-S100 PolarHBondContact O-N 3.08Å
97	P	81.3	Confident	80.5	Confident	91 Å²	91	66.2 Å²	66.2	59%	0.591	35%	0.347	S	S	*	.	H	α-helix	trans	-65.5	-36.4	-173.8	25.3	-33.2	0	0	0	112.6	M99 S100 E101	P97-M99 VanDerWaalsContact C-N 3.28Å; P97-M99 PolarHBondContact O-N 3.37Å; P97-S100 PolarHBondContact O-N 2.86Å; P97-S100 PolarHBondContact O-OG 3.44Å; P97-E101 PolarHBondContact O-N 2.86Å
98	K	83.4	Confident	81	Confident	49 Å²	49	62.6 Å²	62.6	21%	0.213	33%	0.331	C	S	.	.	H	α-helix	trans	-60.6	-37.5	178.8	-64.2	179.6	-177.5	173.3	0	112.4	L73 C77 E80 E96 A102	L73-K98 HydrophobicContact CD2-CB 4.42Å; L73-K98 HydrophobicContact CD2-CG 4.32Å; C77-K98 HydrophobicContact CB-CB 4.41Å; E80-K98 IonicContact OE1-NZ 2.67Å; E80-K98 PolarHBondContact OE1-NZ 3.42Å; E80-K98 IonicContact OE2-NZ 2.79Å; E80-K98 PolarHBondContact OE2-NZ 2.86Å; E96-K98 PolarHBondContact O-N 3.43Å; K98-A102 WeakPolarHBondContact O-CB 3.4Å; K98-A102 PolarHBondContact O-N 2.77Å
99	M	84.9	Confident	81.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-69.9	-43.2	177.8	-170.1	179	-170.4	0	0	111.4	L91 E96 P97 E101 A102 K103 L130 V133 E134	L91-M99 HydrophobicContact CB-SD 4.31Å; E96-M99 HydrophobicContact CB-CB 4.09Å; E96-M99 PolarHBondContact O-N 3.1Å; P97-M99 VanDerWaalsContact C-N 3.28Å; P97-M99 PolarHBondContact O-N 3.37Å; M99-E101 VanDerWaalsContact C-N 3.3Å; M99-E101 PolarHBondContact O-N 3.31Å; M99-A102 PolarHBondContact O-N 3.27Å; M99-K103 WeakPolarHBondContact O-CB 3.37Å; M99-K103 PolarHBondContact O-N 3.4Å; M99-L130 HydrophobicContact CE-CD2 3.88Å; M99-L130 HydrophobicContact CE-CG 3.76Å; M99-L130 WeakPolarHBondContact CE-O 3.25Å; M99-L130 HydrophobicContact CG-CD1 4.31Å; M99-L130 HydrophobicContact CG-CG 4.15Å; M99-V133 HydrophobicContact CE-CB 3.86Å; M99-V133 HydrophobicContact CE-CG1 3.78Å; M99-V133 HydrophobicContact SD-CG1 4.3Å; M99-E134 HydrophobicContact CE-CB 3.97Å; M99-E134 HydrophobicContact CE-CG 3.49Å; M99-E134 VanDerWaalsContact CE-CG 3.49Å; M99-E134 HydrophobicContact SD-CG 4.41Å
100	S	85.4	Confident	81.7	Confident	41 Å²	41	57.5 Å²	57.5	29%	0.287	30%	0.3	S	S	.	.	H	α-helix	trans	-61.8	-38.9	176.8	76	0	0	0	0	112.2	E96 P97 K103 N104	E96-S100 PolarHBondContact O-N 3.08Å; P97-S100 PolarHBondContact O-N 2.86Å; P97-S100 PolarHBondContact O-OG 3.44Å; S100-K103 PolarHBondContact O-N 3.2Å; S100-N104 VanDerWaalsContact O-CG 3.24Å; S100-N104 PolarHBondContact O-N 3.31Å; S100-N104 VanDerWaalsContact O-N 3.12Å; S100-N104 PolarHBondContact O-ND2 3.07Å
101	E	86.6	Confident	81.9	Confident	81 Å²	81	61.2 Å²	61.2	38%	0.379	32%	0.316	S	S	.	.	H	α-helix	trans	-69.1	-45.1	178.4	-162.3	-175.3	168.4	0	0	111.6	L73 P97 M99 K103 N104 Y105	L73-E101 HydrophobicContact CD1-CB 4.22Å; L73-E101 HydrophobicContact CD1-CG 4.19Å; P97-E101 PolarHBondContact O-N 2.86Å; M99-E101 VanDerWaalsContact C-N 3.3Å; M99-E101 PolarHBondContact O-N 3.31Å; E101-K103 VanDerWaalsContact C-N 3.32Å; E101-K103 PolarHBondContact O-N 3.28Å; E101-N104 PolarHBondContact O-N 3.4Å; E101-Y105 HydrophobicContact CG-CD2 4.23Å; E101-Y105 HydrophobicContact CG-CE2 3.54Å; E101-Y105 VanDerWaalsContact O-CD2 3.28Å; E101-Y105 WeakPolarHBondContact O-CD2 3.25Å; E101-Y105 PolarHBondContact O-N 3.28Å; E101-Y105 VanDerWaalsContact O-N 3.1Å; E101-Y105 WeakPolarHBondContact OE1-CE2 3.48Å; E101-Y105 PolarHBondContact OE1-OH 3.15Å
102	A	87.9	Confident	82	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-58.4	-42.5	174.6	0	0	0	0	0	112.2	A70 L73 K98 M99 N104 Y105 L106 L130	A70-A102 HydrophobicContact CB-CB 4.3Å; L73-A102 HydrophobicContact CB-CB 4.26Å; K98-A102 WeakPolarHBondContact O-CB 3.4Å; K98-A102 PolarHBondContact O-N 2.77Å; M99-A102 PolarHBondContact O-N 3.27Å; A102-N104 PolarHBondContact O-N 3.21Å; A102-Y105 PolarHBondContact O-N 2.93Å; A102-L106 VanDerWaalsContact O-CG 3.31Å; A102-L106 WeakPolarHBondContact O-CG 3.31Å; A102-L106 PolarHBondContact O-N 3.34Å; A102-L130 HydrophobicContact CB-CD1 4.1Å
103	K	88.2	Confident	82.2	Confident	36 Å²	36	61.7 Å²	61.7	16%	0.157	33%	0.328	C	S	.	.	H	α-helix	trans	-62.1	-41.3	176.9	-171.7	175.8	-168.3	154.3	0	112.5	E93 M99 S100 E101 L106 S107 L130 E134	E93-K103 IonicContact OE1-NZ 3.58Å; E93-K103 PolarHBondContact OE1-NZ 3.47Å; M99-K103 WeakPolarHBondContact O-CB 3.37Å; M99-K103 PolarHBondContact O-N 3.4Å; S100-K103 PolarHBondContact O-N 3.2Å; E101-K103 VanDerWaalsContact C-N 3.32Å; E101-K103 PolarHBondContact O-N 3.28Å; K103-L106 PolarHBondContact O-N 3.22Å; K103-S107 VanDerWaalsContact O-CB 3.25Å; K103-S107 WeakPolarHBondContact O-CB 3.49Å; K103-S107 PolarHBondContact O-N 2.92Å; K103-S107 PolarHBondContact O-OG 2.98Å; K103-L130 HydrophobicContact CB-CD1 3.9Å; K103-L130 HydrophobicContact CB-CD2 4.14Å; K103-L130 HydrophobicContact CD-CD2 4.09Å; K103-L130 HydrophobicContact CG-CD2 4.15Å; K103-E134 WeakPolarHBondContact CD-OE1 3.43Å; K103-E134 IonicContact NZ-OE1 3.97Å; K103-E134 PolarHBondContact NZ-OE1 3Å; K103-E134 IonicContact NZ-OE2 2.67Å; K103-E134 PolarHBondContact NZ-OE2 3.45Å
104	N	88.2	Confident	82.8	Confident	108 Å²	108	64.6 Å²	64.6	58%	0.578	34%	0.335	S	S	*	.	H	α-helix	trans	-63.9	-44.1	178.4	-72.4	-26.8	0	0	0	111.5	S100 E101 A102 S108	S100-N104 VanDerWaalsContact O-CG 3.24Å; S100-N104 PolarHBondContact O-N 3.31Å; S100-N104 VanDerWaalsContact O-N 3.12Å; S100-N104 PolarHBondContact O-ND2 3.07Å; E101-N104 PolarHBondContact O-N 3.4Å; A102-N104 PolarHBondContact O-N 3.21Å; N104-S108 WeakPolarHBondContact O-CB 3.27Å; N104-S108 PolarHBondContact O-N 3.49Å
105	Y	87.6	Confident	83.7	Confident	65 Å²	65	55.8 Å²	55.8	26%	0.255	30%	0.297	S	S	.	.	H	α-helix	trans	-61.4	-49.6	175.1	-69.1	-46.6	0	0	0	111.9	K66 L73 E101 A102 S107 S108 I109	K66-Y105 HydrophobicContact CB-CD1 4.2Å; K66-Y105 HydrophobicContact CB-CG 4.42Å; K66-Y105 HydrophobicContact CD-CD1 4.21Å; K66-Y105 HydrophobicContact CG-CD1 3.99Å; K66-Y105 HydrophobicContact CG-CE1 4.38Å; L73-Y105 HydrophobicContact CD1-CD2 4.47Å; L73-Y105 HydrophobicContact CD1-CE2 4.16Å; E101-Y105 HydrophobicContact CG-CD2 4.23Å; E101-Y105 HydrophobicContact CG-CE2 3.54Å; E101-Y105 VanDerWaalsContact O-CD2 3.28Å; E101-Y105 WeakPolarHBondContact O-CD2 3.25Å; E101-Y105 PolarHBondContact O-N 3.28Å; E101-Y105 VanDerWaalsContact O-N 3.1Å; E101-Y105 WeakPolarHBondContact OE1-CE2 3.48Å; E101-Y105 PolarHBondContact OE1-OH 3.15Å; A102-Y105 PolarHBondContact O-N 2.93Å; Y105-S107 PolarHBondContact O-N 3.44Å; Y105-S108 PolarHBondContact O-N 3.3Å; Y105-I109 WeakPolarHBondContact O-CD1 3.4Å; Y105-I109 WeakPolarHBondContact O-CG1 3.34Å; Y105-I109 PolarHBondContact O-N 3.26Å
106	L	87.9	Confident	84.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.8	-41.8	-179.4	-67.4	167.5	0	0	0	112.3	L67 A70 A102 K103 I109 L110 A123 I126 L127 L130	L67-L106 HydrophobicContact CD1-CD2 3.88Å; A70-L106 HydrophobicContact CB-CD1 4.32Å; A70-L106 HydrophobicContact CB-CD2 4Å; A70-L106 HydrophobicContact CB-CG 3.82Å; A102-L106 VanDerWaalsContact O-CG 3.31Å; A102-L106 WeakPolarHBondContact O-CG 3.31Å; A102-L106 PolarHBondContact O-N 3.34Å; K103-L106 PolarHBondContact O-N 3.22Å; L106-I109 PolarHBondContact O-N 2.94Å; L106-L110 WeakPolarHBondContact O-CG 3.47Å; L106-L110 PolarHBondContact O-N 2.68Å; L106-A123 HydrophobicContact CD2-CB 4.21Å; L106-I126 HydrophobicContact CD1-CB 4.32Å; L106-I126 HydrophobicContact CD1-CG2 3.71Å; L106-I126 HydrophobicContact CD2-CB 4.35Å; L106-I126 HydrophobicContact CD2-CG2 4.28Å; L106-L127 HydrophobicContact CB-CD1 4.25Å; L106-L127 HydrophobicContact CD1-CB 4.23Å; L106-L127 HydrophobicContact CD1-CD1 4.3Å; L106-L130 HydrophobicContact CD1-CD1 4.34Å
107	S	87.9	Confident	84.2	Confident	41 Å²	41	55.9 Å²	55.9	29%	0.287	31%	0.308	S	S	.	.	H	α-helix	trans	-65.6	-39.6	177.3	-57.6	0	0	0	0	111.5	K103 Y105 N111	K103-S107 VanDerWaalsContact O-CB 3.25Å; K103-S107 WeakPolarHBondContact O-CB 3.49Å; K103-S107 PolarHBondContact O-N 2.92Å; K103-S107 PolarHBondContact O-OG 2.98Å; Y105-S107 PolarHBondContact O-N 3.44Å; S107-N111 WeakPolarHBondContact O-CB 2.88Å; S107-N111 PolarHBondContact O-N 3.18Å; S107-N111 VanDerWaalsContact O-N 3.08Å; S107-N111 PolarHBondContact O-ND2 2.68Å; S107-N111 VanDerWaalsContact O-ND2 3.13Å
108	S	86.1	Confident	84.3	Confident	38 Å²	38	57.6 Å²	57.6	27%	0.266	31%	0.308	S	S	.	.	H	α-helix	trans	-62.4	-43	174.1	-173.6	0	0	0	0	111.8	N104 Y105 N111 H112	N104-S108 WeakPolarHBondContact O-CB 3.27Å; N104-S108 PolarHBondContact O-N 3.49Å; Y105-S108 PolarHBondContact O-N 3.3Å; S108-N111 PolarHBondContact O-N 2.93Å; S108-H112 PolarHBondContact O-CD2 3.33Å; S108-H112 PolarHBondContact O-N 3Å; S108-H112 PolarHBondContact O-ND1 3.26Å; S108-H112 PolarHBondContact OG-CE1 3.18Å
109	I	85.4	Confident	84.3	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-63	-47.9	179.4	-70	161.1	0	0	0	110.8	D63 K66 L67 Y105 L106 N111 H112 G113 L115 M120 A123	D63-I109 HydrophobicContact CB-CG1 4.5Å; K66-I109 HydrophobicContact CB-CD1 3.97Å; K66-I109 HydrophobicContact CB-CG1 4.47Å; L67-I109 HydrophobicContact CB-CD1 3.99Å; Y105-I109 WeakPolarHBondContact O-CD1 3.4Å; Y105-I109 WeakPolarHBondContact O-CG1 3.34Å; Y105-I109 PolarHBondContact O-N 3.26Å; L106-I109 PolarHBondContact O-N 2.94Å; I109-N111 VanDerWaalsContact C-N 3.29Å; I109-N111 PolarHBondContact O-N 3.43Å; I109-H112 PolarHBondContact O-N 3.37Å; I109-G113 PolarHBondContact O-N 2.92Å; I109-L115 HydrophobicContact CG2-CD1 3.43Å; I109-L115 VanDerWaalsContact CG2-CD1 3.43Å; I109-L115 HydrophobicContact CG2-CG 4.28Å; I109-M120 HydrophobicContact CG2-SD 4.28Å; I109-A123 HydrophobicContact CG2-CB 4.23Å
110	L	84	Confident	84.3	Confident	35 Å²	35	59.8 Å²	59.8	18%	0.183	32%	0.318	C	S	.	.	H	α-helix	trans	-65.2	-32.3	-180	-68.1	178.8	0	0	0	112.7	L106 M120 A123 M124 L127	L106-L110 WeakPolarHBondContact O-CG 3.47Å; L106-L110 PolarHBondContact O-N 2.68Å; L110-M120 HydrophobicContact CD2-CE 3.83Å; L110-A123 HydrophobicContact CD2-CB 4.16Å; L110-M124 HydrophobicContact CD1-CG 4.5Å; L110-M124 HydrophobicContact CD2-CG 3.75Å; L110-L127 HydrophobicContact CD1-CD2 3.35Å
111	N	84.4	Confident	84.3	Confident	139 Å²	139	59.1 Å²	59.1	74%	0.743	31%	0.313	S	S	*	.	H	α-helix	trans	-73.6	-33.7	175.6	-71.8	-22.8	0	0	0	112.8	S107 S108 I109	S107-N111 WeakPolarHBondContact O-CB 2.88Å; S107-N111 PolarHBondContact O-N 3.18Å; S107-N111 VanDerWaalsContact O-N 3.08Å; S107-N111 PolarHBondContact O-ND2 2.68Å; S107-N111 VanDerWaalsContact O-ND2 3.13Å; S108-N111 PolarHBondContact O-N 2.93Å; I109-N111 VanDerWaalsContact C-N 3.29Å; I109-N111 PolarHBondContact O-N 3.43Å
112	H	81.7	Confident	84.5	Confident	83 Å²	83	55.6 Å²	55.6	38%	0.384	30%	0.296	S	S	.	.	H	α-helix	trans	-75.7	-39.3	178.4	-66.5	166.8	0	0	0	112.5	D63 S108 I109 R114	D63-H112 IonicContact OD1-ND1 3.22Å; D63-H112 IonicContact OD2-ND1 2.97Å; S108-H112 PolarHBondContact O-CD2 3.33Å; S108-H112 PolarHBondContact O-N 3Å; S108-H112 PolarHBondContact O-ND1 3.26Å; S108-H112 PolarHBondContact OG-CE1 3.18Å; I109-H112 PolarHBondContact O-N 3.37Å; H112-R114 VanDerWaalsContact C-N 3.26Å; H112-R114 HydrophobicContact CB-CG 4.2Å; H112-R114 WeakPolarHBondContact O-CG 3.33Å; H112-R114 PolarHBondContact O-N 3.14Å
113	G	78.3	Confident	84.5	Confident	47 Å²	47	55.6 Å²	55.6	49%	0.485	30%	0.296	S	S	.	.			trans	63.7	25.8	176.3	0	0	0	0	0	114.9	I109	I109-G113 PolarHBondContact O-N 2.92Å
114	R	76.7	Confident	84.6	Confident	150 Å²	150	54.8 Å²	54.8	57%	0.566	29%	0.293	S	S	*	.			trans	-93.2	-15.4	-172.6	-63.4	177.7	-175	179.3	1.2	114.2	H112	H112-R114 VanDerWaalsContact C-N 3.26Å; H112-R114 HydrophobicContact CB-CG 4.2Å; H112-R114 WeakPolarHBondContact O-CG 3.33Å; H112-R114 PolarHBondContact O-N 3.14Å
115	L	80.7	Confident	84.8	Confident	16 Å²	16	50.4 Å²	50.4	8%	0.084	27%	0.27	C	S	.	.	S	Bend	trans	-75.8	160.2	-179.4	-68.6	178.3	0	0	0	112.3	D63 F64 L67 I109 M120	D63-L115 HydrophobicContact CB-CD1 4.47Å; D63-L115 HydrophobicContact CB-CD2 3.95Å; D63-L115 HydrophobicContact CB-CG 4.12Å; F64-L115 HydrophobicContact CB-CD2 4.09Å; L67-L115 HydrophobicContact CD2-CD1 4.41Å; I109-L115 HydrophobicContact CG2-CD1 3.43Å; I109-L115 VanDerWaalsContact CG2-CD1 3.43Å; I109-L115 HydrophobicContact CG2-CG 4.28Å; L115-M120 HydrophobicContact CB-CG 3.89Å; L115-M120 HydrophobicContact CB-SD 3.86Å; L115-M120 WeakPolarHBondContact O-CG 3.43Å
116	S	80.9	Confident	85	Confident	45 Å²	45	47.5 Å²	47.5	32%	0.315	26%	0.258	S	S	.	.			trans	-57.5	152.5	172.5	78.4	0	0	0	0	110.9	Q118 Y119 M120	S116-Q118 PolarHBondContact O-N 2.99Å; S116-Y119 PolarHBondContact O-N 3.41Å; S116-Y119 VanDerWaalsContact O-N 3.09Å; S116-Y119 WeakPolarHBondContact OG-CD2 3.26Å; S116-Y119 PolarHBondContact OG-N 2.8Å; S116-M120 WeakPolarHBondContact O-CG 3.45Å; S116-M120 PolarHBondContact O-N 3.27Å
117	P	81.4	Confident	85.1	Confident	107 Å²	107	47.9 Å²	47.9	70%	0.695	26%	0.26	S	S	*	.	H	α-helix	trans	-53.9	-32.5	178.8	-27.7	35.2	0	0	0	113.4	C121	P117-C121 PolarHBondContact O-N 3.13Å; P117-C121 PolarHBondContact O-SG 3.05Å
118	Q	81.9	Confident	85.3	Confident	128 Å²	128	45.9 Å²	45.9	60%	0.598	25%	0.247	S	C	*	.	H	α-helix	trans	-65.1	-50.4	177.4	-65.3	176.3	-6	0	0	111.8	S116 C121 E122	S116-Q118 PolarHBondContact O-N 2.99Å; Q118-C121 WeakPolarHBondContact O-CB 3.35Å; Q118-C121 PolarHBondContact O-N 3.08Å; Q118-E122 PolarHBondContact O-N 2.81Å
119	Y	84.1	Confident	85.6	Confident	60 Å²	60	44.3 Å²	44.3	24%	0.235	24%	0.235	C	C	.	.	H	α-helix	trans	-73.3	-27.8	179.4	-60.7	-48.8	0	0	0	112.9	F64 L67 S116 C121 E122 A123	F64-Y119 HydrophobicContact CD2-CD1 4.1Å; F64-Y119 HydrophobicContact CD2-CD2 4.01Å; F64-Y119 HydrophobicContact CD2-CE1 4.17Å; F64-Y119 HydrophobicContact CD2-CE2 4.08Å; F64-Y119 HydrophobicContact CD2-CG 4.04Å; F64-Y119 AromaticContact CE2-CD1 3.67Å; F64-Y119 HydrophobicContact CE2-CD1 3.67Å; F64-Y119 HydrophobicContact CE2-CD2 4.19Å; F64-Y119 AromaticContact CE2-CE1 3.4Å; F64-Y119 HydrophobicContact CE2-CE1 3.4Å; F64-Y119 VanDerWaalsContact CE2-CE1 3.4Å; F64-Y119 AromaticContact CE2-CE2 3.95Å; F64-Y119 HydrophobicContact CE2-CE2 3.95Å; F64-Y119 HydrophobicContact CE2-CG 4.08Å; F64-Y119 AromaticContact CE2-CZ 3.54Å; F64-Y119 HydrophobicContact CZ-CE1 4.15Å; L67-Y119 HydrophobicContact CD2-CD1 4.4Å; L67-Y119 HydrophobicContact CD2-CG 4.49Å; S116-Y119 PolarHBondContact O-N 3.41Å; S116-Y119 VanDerWaalsContact O-N 3.09Å; S116-Y119 WeakPolarHBondContact OG-CD2 3.26Å; S116-Y119 PolarHBondContact OG-N 2.8Å; Y119-C121 VanDerWaalsContact C-N 3.35Å; Y119-E122 PolarHBondContact O-N 3.28Å; Y119-A123 WeakPolarHBondContact O-CB 3.44Å; Y119-A123 PolarHBondContact O-N 3.37Å
120	M	85.1	Confident	85.8	Confident	35 Å²	35	44.3 Å²	44.3	17%	0.172	24%	0.235	C	C	.	.	H	α-helix	trans	-64.2	-40.8	169.1	-72	-63.4	-65.8	0	0	111.4	I109 L110 L115 S116 A123 M124	I109-M120 HydrophobicContact CG2-SD 4.28Å; L110-M120 HydrophobicContact CD2-CE 3.83Å; L115-M120 HydrophobicContact CB-CG 3.89Å; L115-M120 HydrophobicContact CB-SD 3.86Å; L115-M120 WeakPolarHBondContact O-CG 3.43Å; S116-M120 WeakPolarHBondContact O-CG 3.45Å; S116-M120 PolarHBondContact O-N 3.27Å; M120-A123 PolarHBondContact O-N 3Å; M120-M124 WeakPolarHBondContact O-CG 3.49Å; M120-M124 PolarHBondContact O-N 3.3Å; M120-M124 VanDerWaalsContact O-N 3.14Å
121	C	86.3	Confident	86.2	Confident	27 Å²	27	43.7 Å²	43.7	18%	0.182	23%	0.231	C	C	.	.	H	α-helix	trans	-62.2	-45.9	171.6	-70.9	0	0	0	0	111.5	P117 Q118 Y119 A123 M124 L125	P117-C121 PolarHBondContact O-N 3.13Å; P117-C121 PolarHBondContact O-SG 3.05Å; Q118-C121 WeakPolarHBondContact O-CB 3.35Å; Q118-C121 PolarHBondContact O-N 3.08Å; Y119-C121 VanDerWaalsContact C-N 3.35Å; C121-A123 VanDerWaalsContact C-N 3.33Å; C121-A123 PolarHBondContact O-N 3.47Å; C121-M124 HydrophobicContact CB-CE 4.45Å; C121-M124 WeakPolarHBondContact O-CB 3.36Å; C121-M124 PolarHBondContact O-N 3.43Å; C121-M124 VanDerWaalsContact O-N 3.1Å; C121-L125 WeakPolarHBondContact O-CG 3.31Å; C121-L125 PolarHBondContact O-N 3.02Å
122	E	88.8	Confident	86.4	Confident	6 Å²	6	37.4 Å²	37.4	3%	0.028	20%	0.197	C	C	.	.	H	α-helix	trans	-57	-44.8	176.1	-69.7	177.1	-155.9	0	0	112.4	R21 L67 Q118 Y119 M124 L125 I126 Y160 Q161	R21-E122 IonicContact CZ-OE2 3.42Å; R21-E122 IonicContact NH1-OE2 3Å; R21-E122 PolarHBondContact NH1-OE2 2.82Å; R21-E122 IonicContact NH2-OE2 2.99Å; R21-E122 PolarHBondContact NH2-OE2 3.49Å; L67-E122 HydrophobicContact CD2-CB 4.35Å; Q118-E122 PolarHBondContact O-N 2.81Å; Y119-E122 PolarHBondContact O-N 3.28Å; E122-M124 VanDerWaalsContact C-N 3.28Å; E122-M124 PolarHBondContact O-N 3.39Å; E122-L125 PolarHBondContact O-N 2.89Å; E122-L125 VanDerWaalsContact O-N 3.13Å; E122-I126 VanDerWaalsContact O-CG1 3.32Å; E122-I126 WeakPolarHBondContact O-CG1 3.43Å; E122-I126 PolarHBondContact O-N 2.91Å; E122-Y160 PolarHBondContact OE1-OH 2.97Å; E122-Q161 PolarHBondContact OE1-NE2 3.43Å
123	A	89	Confident	86.7	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-58.3	-40.1	175.9	0	0	0	0	0	112.1	L67 L106 I109 L110 Y119 M120 C121 L127	L67-A123 HydrophobicContact CD1-CB 3.7Å; L106-A123 HydrophobicContact CD2-CB 4.21Å; I109-A123 HydrophobicContact CG2-CB 4.23Å; L110-A123 HydrophobicContact CD2-CB 4.16Å; Y119-A123 WeakPolarHBondContact O-CB 3.44Å; Y119-A123 PolarHBondContact O-N 3.37Å; M120-A123 PolarHBondContact O-N 3Å; C121-A123 VanDerWaalsContact C-N 3.33Å; C121-A123 PolarHBondContact O-N 3.47Å; A123-L127 VanDerWaalsContact O-CB 3.27Å; A123-L127 WeakPolarHBondContact O-CB 3.43Å; A123-L127 PolarHBondContact O-N 3.18Å
124	M	90.6	Very high	87.2	Confident	20 Å²	20	32.4 Å²	32.4	10%	0.099	16%	0.162	C	C	.	.	H	α-helix	trans	-68.2	-37.6	175.4	-68.9	-174.6	-70.8	0	0	112.6	L110 M120 C121 E122 G128 R146 A147	L110-M124 HydrophobicContact CD1-CG 4.5Å; L110-M124 HydrophobicContact CD2-CG 3.75Å; M120-M124 WeakPolarHBondContact O-CG 3.49Å; M120-M124 PolarHBondContact O-N 3.3Å; M120-M124 VanDerWaalsContact O-N 3.14Å; C121-M124 HydrophobicContact CB-CE 4.45Å; C121-M124 WeakPolarHBondContact O-CB 3.36Å; C121-M124 PolarHBondContact O-N 3.43Å; C121-M124 VanDerWaalsContact O-N 3.1Å; E122-M124 VanDerWaalsContact C-N 3.28Å; E122-M124 PolarHBondContact O-N 3.39Å; M124-G128 PolarHBondContact O-N 3.27Å; M124-R146 HydrophobicContact SD-CB 4.02Å; M124-A147 HydrophobicContact CB-CB 4.04Å; M124-A147 HydrophobicContact CE-CB 4.12Å
125	L	91.3	Very high	87.6	Confident	16 Å²	16	26.3 Å²	26.3	8%	0.084	15%	0.146	C	C	.	.	H	α-helix	trans	-65.1	-44.6	176.6	-61.9	-175.5	0	0	0	111.9	C121 E122 G128 K129 Y144 A147 I149 L164 A168	C121-L125 WeakPolarHBondContact O-CG 3.31Å; C121-L125 PolarHBondContact O-N 3.02Å; E122-L125 PolarHBondContact O-N 2.89Å; E122-L125 VanDerWaalsContact O-N 3.13Å; L125-G128 PolarHBondContact O-N 2.95Å; L125-K129 PolarHBondContact O-N 3.42Å; L125-Y144 HydrophobicContact CB-CE1 4.49Å; L125-Y144 HydrophobicContact CD2-CD1 3.75Å; L125-Y144 HydrophobicContact CD2-CE1 3.98Å; L125-A147 HydrophobicContact CD2-CB 3.9Å; L125-I149 HydrophobicContact CD2-CG2 3.51Å; L125-L164 HydrophobicContact CD1-CB 4.27Å; L125-A168 HydrophobicContact CD2-CB 3.92Å
126	I	92.1	Very high	88	Confident	3 Å²	3	27.7 Å²	27.7	2%	0.015	16%	0.156	C	C	.	.	H	α-helix	trans	-66.9	-42.3	178.8	-61.9	163.6	0	0	0	109.9	L67 E71 L74 L106 E122 G128 K129 L130 L164	L67-I126 HydrophobicContact CD1-CD1 3.93Å; E71-I126 HydrophobicContact CB-CD1 3.88Å; E71-I126 HydrophobicContact CG-CD1 3.95Å; E71-I126 HydrophobicContact CG-CG1 4.41Å; L74-I126 HydrophobicContact CD2-CG2 3.75Å; L106-I126 HydrophobicContact CD1-CB 4.32Å; L106-I126 HydrophobicContact CD1-CG2 3.71Å; L106-I126 HydrophobicContact CD2-CB 4.35Å; L106-I126 HydrophobicContact CD2-CG2 4.28Å; E122-I126 VanDerWaalsContact O-CG1 3.32Å; E122-I126 WeakPolarHBondContact O-CG1 3.43Å; E122-I126 PolarHBondContact O-N 2.91Å; I126-G128 VanDerWaalsContact C-N 3.33Å; I126-G128 PolarHBondContact O-N 3.22Å; I126-K129 WeakPolarHBondContact O-CB 3.4Å; I126-K129 PolarHBondContact O-N 3.24Å; I126-L130 PolarHBondContact O-N 2.88Å; I126-L164 HydrophobicContact CG1-CD2 4.3Å
127	L	91	Very high	88.4	Confident	8 Å²	8	27.4 Å²	27.4	4%	0.042	15%	0.149	C	C	.	.	H	α-helix	trans	-64.6	-37.4	175.6	-174.5	62.6	0	0	0	112	L106 L110 A123 K129 L130 H131 M143	L106-L127 HydrophobicContact CB-CD1 4.25Å; L106-L127 HydrophobicContact CD1-CB 4.23Å; L106-L127 HydrophobicContact CD1-CD1 4.3Å; L110-L127 HydrophobicContact CD1-CD2 3.35Å; A123-L127 VanDerWaalsContact O-CB 3.27Å; A123-L127 WeakPolarHBondContact O-CB 3.43Å; A123-L127 PolarHBondContact O-N 3.18Å; L127-K129 VanDerWaalsContact C-N 3.33Å; L127-K129 PolarHBondContact O-N 3.33Å; L127-L130 HydrophobicContact CD1-CD2 4.47Å; L127-L130 WeakPolarHBondContact O-CB 3.37Å; L127-L130 PolarHBondContact O-N 3.47Å; L127-H131 PolarHBondContact O-CD2 2.89Å; L127-H131 PolarHBondContact O-N 3.24Å; L127-M143 HydrophobicContact CD2-CG 4.4Å; L127-M143 HydrophobicContact CD2-SD 4.13Å; L127-M143 HydrophobicContact CG-CG 4.44Å
128	G	90.9	Very high	88.8	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59.7	-42.6	172.1	0	0	0	0	0	112.5	M124 L125 I126 H131 Y132 A140 Y144	M124-G128 PolarHBondContact O-N 3.27Å; L125-G128 PolarHBondContact O-N 2.95Å; I126-G128 VanDerWaalsContact C-N 3.33Å; I126-G128 PolarHBondContact O-N 3.22Å; G128-H131 PolarHBondContact O-N 2.94Å; G128-Y132 PolarHBondContact O-N 2.88Å; G128-Y132 VanDerWaalsContact O-N 3.1Å; G128-A140 WeakPolarHBondContact O-CB 3.3Å; G128-Y144 VanDerWaalsContact C-OH 3.31Å
129	K	92.1	Very high	89.3	Confident	5 Å²	5	28.8 Å²	28.8	2%	0.022	14%	0.141	C	C	.	.	H	α-helix	trans	-62.3	-44	174.7	-179.8	-176.4	-67.8	-169.9	0	111.1	L74 E75 L78 L125 I126 L127 Y132 V133 Y144 E167 I171 F239	L74-K129 HydrophobicContact CD2-CB 4.33Å; L74-K129 HydrophobicContact CD2-CD 4.03Å; L74-K129 HydrophobicContact CD2-CG 4.17Å; E75-K129 IonicContact OE1-NZ 2.84Å; E75-K129 PolarHBondContact OE1-NZ 2.98Å; E75-K129 IonicContact OE2-NZ 2.75Å; L78-K129 HydrophobicContact CD1-CD 3.87Å; L125-K129 PolarHBondContact O-N 3.42Å; I126-K129 WeakPolarHBondContact O-CB 3.4Å; I126-K129 PolarHBondContact O-N 3.24Å; L127-K129 VanDerWaalsContact C-N 3.33Å; L127-K129 PolarHBondContact O-N 3.33Å; K129-Y132 WeakPolarHBondContact O-CB 3.36Å; K129-Y132 PolarHBondContact O-N 3.13Å; K129-V133 VanDerWaalsContact O-CG2 3.28Å; K129-V133 WeakPolarHBondContact O-CG2 3.45Å; K129-V133 PolarHBondContact O-N 3.45Å; K129-Y144 PolarHBondContact N-OH 3.28Å; K129-Y144 VanDerWaalsContact N-OH 3.09Å; K129-E167 IonicContact NZ-OE1 3.33Å; K129-E167 PolarHBondContact NZ-OE1 3.06Å; K129-E167 IonicContact NZ-OE2 3.55Å; K129-E167 PolarHBondContact NZ-OE2 2.94Å; K129-I171 HydrophobicContact CB-CD1 3.83Å; K129-I171 HydrophobicContact CD-CD1 4.36Å; K129-I171 HydrophobicContact CG-CD1 3.66Å; K129-F239 HydrophobicContact CD-CD2 4.48Å; K129-F239 HydrophobicContact CD-CE2 4.23Å; K129-F239 HydrophobicContact CG-CE2 4.24Å
130	L	91.2	Very high	89.6	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.5	-46.1	177.5	-171.3	153.4	0	0	0	111.6	L74 M99 A102 K103 L106 I126 L127 Y132 V133 E134	L74-L130 HydrophobicContact CD1-CB 4.33Å; L74-L130 HydrophobicContact CD1-CD1 4.42Å; L74-L130 HydrophobicContact CD1-CG 4.34Å; L74-L130 HydrophobicContact CD2-CB 4.18Å; M99-L130 HydrophobicContact CE-CD2 3.88Å; M99-L130 HydrophobicContact CE-CG 3.76Å; M99-L130 WeakPolarHBondContact CE-O 3.25Å; M99-L130 HydrophobicContact CG-CD1 4.31Å; M99-L130 HydrophobicContact CG-CG 4.15Å; A102-L130 HydrophobicContact CB-CD1 4.1Å; K103-L130 HydrophobicContact CB-CD1 3.9Å; K103-L130 HydrophobicContact CB-CD2 4.14Å; K103-L130 HydrophobicContact CD-CD2 4.09Å; K103-L130 HydrophobicContact CG-CD2 4.15Å; L106-L130 HydrophobicContact CD1-CD1 4.34Å; I126-L130 PolarHBondContact O-N 2.88Å; L127-L130 HydrophobicContact CD1-CD2 4.47Å; L127-L130 WeakPolarHBondContact O-CB 3.37Å; L127-L130 PolarHBondContact O-N 3.47Å; L130-Y132 VanDerWaalsContact C-N 3.32Å; L130-Y132 PolarHBondContact O-N 3.41Å; L130-V133 PolarHBondContact O-N 3.35Å; L130-E134 VanDerWaalsContact CD2-CD 3.5Å; L130-E134 WeakPolarHBondContact CD2-OE1 3.44Å; L130-E134 PolarHBondContact O-N 2.84Å
131	H	90.9	Very high	89.8	Confident	22 Å²	22	25.8 Å²	25.8	10%	0.102	13%	0.129	C	C	.	.	H	α-helix	trans	-63	-34.7	177	-75.3	-39.6	0	0	0	113.7	L127 G128 E134 G135 S136 D139 A140	L127-H131 PolarHBondContact O-CD2 2.89Å; L127-H131 PolarHBondContact O-N 3.24Å; G128-H131 PolarHBondContact O-N 2.94Å; H131-E134 IonicContact CE1-OE2 3.32Å; H131-E134 IonicContact ND1-OE2 2.92Å; H131-E134 PolarHBondContact ND1-OE2 3Å; H131-E134 WeakPolarHBondContact O-CB 3.24Å; H131-E134 PolarHBondContact O-N 2.66Å; H131-G135 PolarHBondContact O-N 3.48Å; H131-S136 CarbonylContact O-C 3.57Å; H131-S136 WeakPolarHBondContact O-CA 3.47Å; H131-S136 PolarHBondContact O-N 2.67Å; H131-D139 HydrophobicContact CB-CB 4.32Å; H131-A140 HydrophobicContact CB-CB 3.99Å
132	Y	90.1	Very high	90.1	Very high	8 Å²	8	27.2 Å²	27.2	3%	0.031	14%	0.14	C	C	.	.	H	α-helix	trans	-63.3	-44.3	173.9	173.6	-97.4	0	0	0	112.1	G128 K129 L130 E134 G135 Y137 I171 L174 S175 R178 F239	G128-Y132 PolarHBondContact O-N 2.88Å; G128-Y132 VanDerWaalsContact O-N 3.1Å; K129-Y132 WeakPolarHBondContact O-CB 3.36Å; K129-Y132 PolarHBondContact O-N 3.13Å; L130-Y132 VanDerWaalsContact C-N 3.32Å; L130-Y132 PolarHBondContact O-N 3.41Å; Y132-E134 VanDerWaalsContact C-N 3.28Å; Y132-E134 PolarHBondContact O-N 2.69Å; Y132-G135 PolarHBondContact O-N 3.12Å; Y132-Y137 AromaticContact CD2-CD1 3.71Å; Y132-Y137 HydrophobicContact CD2-CD1 3.71Å; Y132-Y137 AromaticContact CD2-CE1 3.81Å; Y132-Y137 HydrophobicContact CD2-CE1 3.81Å; Y132-Y137 HydrophobicContact CE2-CD1 4.08Å; Y132-Y137 AromaticContact CE2-CE1 3.9Å; Y132-Y137 HydrophobicContact CE2-CE1 3.9Å; Y132-I171 HydrophobicContact CD1-CG2 4.15Å; Y132-I171 HydrophobicContact CD2-CG2 3.74Å; Y132-I171 HydrophobicContact CG-CG2 3.49Å; Y132-I171 VanDerWaalsContact CG-CG2 3.49Å; Y132-L174 HydrophobicContact CE2-CB 3.73Å; Y132-L174 WeakPolarHBondContact OH-CD1 3.47Å; Y132-S175 VanDerWaalsContact CD2-OG 3.3Å; Y132-S175 WeakPolarHBondContact CD2-OG 3.13Å; Y132-R178 PolarHBondContact OH-NH1 3.16Å; Y132-R178 PolarHBondContact OH-NH2 3.38Å; Y132-F239 AromaticContact CD1-CE1 3.81Å; Y132-F239 HydrophobicContact CD1-CE1 3.81Å; Y132-F239 AromaticContact CD1-CZ 3.87Å; Y132-F239 HydrophobicContact CD1-CZ 3.87Å; Y132-F239 AromaticContact CE1-CE1 3.56Å; Y132-F239 HydrophobicContact CE1-CE1 3.56Å; Y132-F239 AromaticContact CE1-CZ 3.93Å; Y132-F239 HydrophobicContact CE1-CZ 3.93Å
133	V	87.9	Confident	90.2	Very high	10 Å²	10	27.8 Å²	27.8	6%	0.061	14%	0.143	C	C	.	.	H	α-helix	trans	-65.5	-35	179.1	175.3	0	0	0	0	111.1	L78 L91 M99 K129 L130 G135 F239	L78-V133 HydrophobicContact CD2-CG1 4.28Å; L78-V133 HydrophobicContact CD2-CG2 3.65Å; L91-V133 HydrophobicContact CB-CG1 3.96Å; L91-V133 HydrophobicContact CD1-CG1 3.7Å; L91-V133 HydrophobicContact CG-CG1 4.03Å; L91-V133 PolarHBondContact N-O 3.49Å; M99-V133 HydrophobicContact CE-CB 3.86Å; M99-V133 HydrophobicContact CE-CG1 3.78Å; M99-V133 HydrophobicContact SD-CG1 4.3Å; K129-V133 VanDerWaalsContact O-CG2 3.28Å; K129-V133 WeakPolarHBondContact O-CG2 3.45Å; K129-V133 PolarHBondContact O-N 3.45Å; L130-V133 PolarHBondContact O-N 3.35Å; V133-G135 PolarHBondContact O-N 3.31Å; V133-F239 HydrophobicContact CG2-CZ 4.35Å
134	E	87.7	Confident	90.3	Very high	15 Å²	15	27.9 Å²	27.9	7%	0.07	14%	0.143	C	C	.	.	H	α-helix	trans	-65.7	-19.3	172.4	-107.2	161.1	-155.9	0	0	113.4	E93 M99 K103 L130 H131 Y132	E93-E134 HydrophobicContact CG-CG 3.98Å; E93-E134 VanDerWaalsContact CG-OE1 3.24Å; E93-E134 WeakPolarHBondContact CG-OE1 3.41Å; M99-E134 HydrophobicContact CE-CB 3.97Å; M99-E134 HydrophobicContact CE-CG 3.49Å; M99-E134 VanDerWaalsContact CE-CG 3.49Å; M99-E134 HydrophobicContact SD-CG 4.41Å; K103-E134 WeakPolarHBondContact CD-OE1 3.43Å; K103-E134 IonicContact NZ-OE1 3.97Å; K103-E134 PolarHBondContact NZ-OE1 3Å; K103-E134 IonicContact NZ-OE2 2.67Å; K103-E134 PolarHBondContact NZ-OE2 3.45Å; L130-E134 VanDerWaalsContact CD2-CD 3.5Å; L130-E134 WeakPolarHBondContact CD2-OE1 3.44Å; L130-E134 PolarHBondContact O-N 2.84Å; H131-E134 IonicContact CE1-OE2 3.32Å; H131-E134 IonicContact ND1-OE2 2.92Å; H131-E134 PolarHBondContact ND1-OE2 3Å; H131-E134 WeakPolarHBondContact O-CB 3.24Å; H131-E134 PolarHBondContact O-N 2.66Å; Y132-E134 VanDerWaalsContact C-N 3.28Å; Y132-E134 PolarHBondContact O-N 2.69Å
135	G	85.2	Confident	90.2	Very high	22 Å²	22	30.3 Å²	30.3	23%	0.227	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	3.4	-171.9	0	0	0	0	0	114.4	H131 Y132 V133 Y137	H131-G135 PolarHBondContact O-N 3.48Å; Y132-G135 PolarHBondContact O-N 3.12Å; V133-G135 PolarHBondContact O-N 3.31Å; G135-Y137 VanDerWaalsContact C-N 3.32Å; G135-Y137 WeakPolarHBondContact O-CD2 3.45Å; G135-Y137 PolarHBondContact O-N 3.16Å; G135-Y137 VanDerWaalsContact O-N 3.09Å
136	S	89.5	Confident	90	Very high	44 Å²	44	37 Å²	37	31%	0.308	19%	0.19	S	C	.	.			trans	-85.3	66	178.5	-63.9	0	0	0	0	111.7	H131 R138 D139 A140	H131-S136 CarbonylContact O-C 3.57Å; H131-S136 WeakPolarHBondContact O-CA 3.47Å; H131-S136 PolarHBondContact O-N 2.67Å; S136-R138 VanDerWaalsContact C-N 3.3Å; S136-R138 PolarHBondContact O-N 3.34Å; S136-D139 PolarHBondContact O-N 3.09Å; S136-A140 PolarHBondContact O-N 2.95Å; S136-A140 VanDerWaalsContact O-N 3.15Å
137	Y	90.2	Very high	89.7	Confident	40 Å²	40	37.3 Å²	37.3	16%	0.157	19%	0.193	C	C	.	.	H	α-helix	trans	-60.4	-32.8	-172.6	-51.8	-52	0	0	0	114.5	Y132 G135 I141 R178	Y132-Y137 AromaticContact CD2-CD1 3.71Å; Y132-Y137 HydrophobicContact CD2-CD1 3.71Å; Y132-Y137 AromaticContact CD2-CE1 3.81Å; Y132-Y137 HydrophobicContact CD2-CE1 3.81Å; Y132-Y137 HydrophobicContact CE2-CD1 4.08Å; Y132-Y137 AromaticContact CE2-CE1 3.9Å; Y132-Y137 HydrophobicContact CE2-CE1 3.9Å; G135-Y137 VanDerWaalsContact C-N 3.32Å; G135-Y137 WeakPolarHBondContact O-CD2 3.45Å; G135-Y137 PolarHBondContact O-N 3.16Å; G135-Y137 VanDerWaalsContact O-N 3.09Å; Y137-I141 WeakPolarHBondContact O-CD1 3.4Å; Y137-I141 WeakPolarHBondContact O-CG1 3.43Å; Y137-I141 PolarHBondContact O-N 3.41Å; Y137-I141 VanDerWaalsContact O-N 3.16Å; Y137-R178 HydrophobicContact CD2-CB 3.72Å; Y137-R178 HydrophobicContact CE2-CB 3.7Å; Y137-R178 HydrophobicContact CE2-CG 4.39Å; Y137-R178 HydrophobicContact CG-CB 4.15Å; Y137-R178 PolarHBondContact OH-NH1 3.23Å
138	R	89.9	Confident	89.4	Confident	182 Å²	182	38.1 Å²	38.1	69%	0.687	20%	0.203	S	C	*	.	H	α-helix	trans	-67	-41.6	177.8	-70.4	-172.3	178.7	-168.9	-0.3	111.9	S136 I141 S142 L179	S136-R138 VanDerWaalsContact C-N 3.3Å; S136-R138 PolarHBondContact O-N 3.34Å; R138-I141 PolarHBondContact O-N 3.32Å; R138-S142 PolarHBondContact O-N 3.3Å; R138-L179 HydrophobicContact CB-CD2 4.47Å; R138-L179 HydrophobicContact CG-CD2 3.4Å; R138-L179 VanDerWaalsContact CG-CD2 3.4Å
139	D	90.4	Very high	89	Confident	81 Å²	81	38.2 Å²	38.2	43%	0.433	20%	0.204	S	C	.	.	H	α-helix	trans	-70.3	-38.2	-178.9	-60.4	-31.8	0	0	0	110.3	H131 S136 S142 M143	H131-D139 HydrophobicContact CB-CB 4.32Å; S136-D139 PolarHBondContact O-N 3.09Å; D139-S142 WeakPolarHBondContact O-CB 3.41Å; D139-S142 PolarHBondContact O-N 3.25Å; D139-M143 WeakPolarHBondContact O-CG 3.44Å; D139-M143 PolarHBondContact O-N 3.1Å
140	A	90.9	Very high	88.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.1	-50.7	172.3	0	0	0	0	0	112.2	G128 H131 S136 S142 M143 Y144	G128-A140 WeakPolarHBondContact O-CB 3.3Å; H131-A140 HydrophobicContact CB-CB 3.99Å; S136-A140 PolarHBondContact O-N 2.95Å; S136-A140 VanDerWaalsContact O-N 3.15Å; A140-S142 VanDerWaalsContact C-N 3.31Å; A140-S142 PolarHBondContact O-N 3.13Å; A140-M143 PolarHBondContact O-N 2.97Å; A140-Y144 HydrophobicContact CB-CE2 4.41Å; A140-Y144 WeakPolarHBondContact O-CD2 3.26Å; A140-Y144 PolarHBondContact O-N 3.05Å; A140-Y144 VanDerWaalsContact O-N 3.07Å
141	I	90	Very high	87.8	Confident	33 Å²	33	48.4 Å²	48.4	17%	0.169	26%	0.258	C	S	.	.	H	α-helix	trans	-61	-41.5	177.4	-66.4	160.4	0	0	0	111	Y137 R138 M143 Y144 A145 L176 L179	Y137-I141 WeakPolarHBondContact O-CD1 3.4Å; Y137-I141 WeakPolarHBondContact O-CG1 3.43Å; Y137-I141 PolarHBondContact O-N 3.41Å; Y137-I141 VanDerWaalsContact O-N 3.16Å; R138-I141 PolarHBondContact O-N 3.32Å; I141-M143 VanDerWaalsContact C-N 3.34Å; I141-M143 PolarHBondContact O-N 3.1Å; I141-Y144 PolarHBondContact O-N 3.15Å; I141-A145 WeakPolarHBondContact O-CB 3.34Å; I141-A145 PolarHBondContact O-N 2.67Å; I141-L176 HydrophobicContact CD1-CD2 3.81Å; I141-L176 HydrophobicContact CD1-CG 4.04Å; I141-L176 HydrophobicContact CG1-CG 4.48Å; I141-L179 HydrophobicContact CD1-CD1 3.62Å; I141-L179 HydrophobicContact CD1-CG 4.28Å
142	S	91.9	Very high	87	Confident	57 Å²	57	50.4 Å²	50.4	40%	0.399	27%	0.269	S	S	.	.	H	α-helix	trans	-61	-42.1	177	-175.3	0	0	0	0	112.1	R138 D139 A140 A145 R146	R138-S142 PolarHBondContact O-N 3.3Å; D139-S142 WeakPolarHBondContact O-CB 3.41Å; D139-S142 PolarHBondContact O-N 3.25Å; A140-S142 VanDerWaalsContact C-N 3.31Å; A140-S142 PolarHBondContact O-N 3.13Å; S142-A145 PolarHBondContact O-N 2.87Å; S142-R146 WeakPolarHBondContact O-CB 3.41Å; S142-R146 VanDerWaalsContact O-CG 3.27Å; S142-R146 WeakPolarHBondContact O-CG 3.41Å; S142-R146 PolarHBondContact O-N 3.44Å
143	M	90.8	Very high	86	Confident	18 Å²	18	53.8 Å²	53.8	9%	0.089	29%	0.293	C	S	.	.	H	α-helix	trans	-64.5	-41.9	176.7	-67.7	-49	105.9	0	0	111.9	L127 D139 A140 I141 R146 A147	L127-M143 HydrophobicContact CD2-CG 4.4Å; L127-M143 HydrophobicContact CD2-SD 4.13Å; L127-M143 HydrophobicContact CG-CG 4.44Å; D139-M143 WeakPolarHBondContact O-CG 3.44Å; D139-M143 PolarHBondContact O-N 3.1Å; A140-M143 PolarHBondContact O-N 2.97Å; I141-M143 VanDerWaalsContact C-N 3.34Å; I141-M143 PolarHBondContact O-N 3.1Å; M143-R146 PolarHBondContact O-N 2.92Å; M143-A147 WeakPolarHBondContact O-CB 3.37Å; M143-A147 PolarHBondContact O-N 3.19Å
144	Y	91.3	Very high	84.9	Confident	1 Å²	1	54.1 Å²	54.1	0%	0.004	30%	0.295	C	S	.	.	H	α-helix	trans	-67.4	-37.3	177	-66.2	-49.2	0	0	0	113.4	L125 G128 K129 A140 I141 A147 G148 I149 A168 I171 K172	L125-Y144 HydrophobicContact CB-CE1 4.49Å; L125-Y144 HydrophobicContact CD2-CD1 3.75Å; L125-Y144 HydrophobicContact CD2-CE1 3.98Å; G128-Y144 VanDerWaalsContact C-OH 3.31Å; K129-Y144 PolarHBondContact N-OH 3.28Å; K129-Y144 VanDerWaalsContact N-OH 3.09Å; A140-Y144 HydrophobicContact CB-CE2 4.41Å; A140-Y144 WeakPolarHBondContact O-CD2 3.26Å; A140-Y144 PolarHBondContact O-N 3.05Å; A140-Y144 VanDerWaalsContact O-N 3.07Å; I141-Y144 PolarHBondContact O-N 3.15Å; Y144-A147 PolarHBondContact O-N 3.25Å; Y144-G148 PolarHBondContact O-N 2.69Å; Y144-I149 HydrophobicContact CD1-CG2 4.3Å; Y144-A168 HydrophobicContact CD1-CB 3.8Å; Y144-A168 HydrophobicContact CE1-CB 3.42Å; Y144-A168 VanDerWaalsContact CE1-CB 3.42Å; Y144-I171 HydrophobicContact CE2-CB 4.03Å; Y144-I171 HydrophobicContact CE2-CG2 3.69Å; Y144-I171 WeakPolarHBondContact OH-CG2 3.26Å; Y144-K172 HydrophobicContact CD2-CB 4.08Å
145	A	88.2	Confident	83.7	Confident	71 Å²	71	60.7 Å²	60.7	59%	0.587	33%	0.326	S	S	*	.	H	α-helix	trans	-63.7	-41.8	173.4	0	0	0	0	0	111.5	I141 S142 A147 G148	I141-A145 WeakPolarHBondContact O-CB 3.34Å; I141-A145 PolarHBondContact O-N 2.67Å; S142-A145 PolarHBondContact O-N 2.87Å; A145-A147 VanDerWaalsContact C-N 3.33Å; A145-A147 PolarHBondContact O-N 3.07Å; A145-G148 PolarHBondContact O-N 2.88Å
146	R	87.6	Confident	82.7	Confident	157 Å²	157	67.7 Å²	67.7	59%	0.592	36%	0.358	S	S	*	.	H	α-helix	trans	-67.1	-32.3	175.8	-72.6	173.5	64.4	-172.5	-0.9	113.2	M124 S142 M143 G148	M124-R146 HydrophobicContact SD-CB 4.02Å; S142-R146 WeakPolarHBondContact O-CB 3.41Å; S142-R146 VanDerWaalsContact O-CG 3.27Å; S142-R146 WeakPolarHBondContact O-CG 3.41Å; S142-R146 PolarHBondContact O-N 3.44Å; M143-R146 PolarHBondContact O-N 2.92Å; R146-G148 PolarHBondContact O-N 3.17Å
147	A	86.4	Confident	82	Confident	9 Å²	9	67.6 Å²	67.6	7%	0.074	35%	0.352	C	S	.	.	H	α-helix	trans	-74.3	-12.4	176.1	0	0	0	0	0	113.5	M124 L125 M143 Y144 A145 I149	M124-A147 HydrophobicContact CB-CB 4.04Å; M124-A147 HydrophobicContact CE-CB 4.12Å; L125-A147 HydrophobicContact CD2-CB 3.9Å; M143-A147 WeakPolarHBondContact O-CB 3.37Å; M143-A147 PolarHBondContact O-N 3.19Å; Y144-A147 PolarHBondContact O-N 3.25Å; A145-A147 VanDerWaalsContact C-N 3.33Å; A145-A147 PolarHBondContact O-N 3.07Å; A147-I149 HydrophobicContact CB-CG2 4.22Å
148	G	84.4	Confident	81.6	Confident	25 Å²	25	67.6 Å²	67.6	26%	0.258	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	41.4	178.3	0	0	0	0	0	113	Y144 A145 R146 D150 D151 M152	Y144-G148 PolarHBondContact O-N 2.69Å; A145-G148 PolarHBondContact O-N 2.88Å; R146-G148 PolarHBondContact O-N 3.17Å; G148-D150 PolarHBondContact O-N 2.96Å; G148-D150 VanDerWaalsContact O-N 3.09Å; G148-D151 PolarHBondContact O-N 3.24Å; G148-D151 VanDerWaalsContact O-N 3.15Å; G148-M152 WeakPolarHBondContact O-CG 3.39Å
149	I	83.3	Confident	81.4	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.01	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-58.5	-26.8	-174.2	64.1	167.6	0	0	0	113.5	L125 Y144 A147 D151 L165 F169 K172	L125-I149 HydrophobicContact CD2-CG2 3.51Å; Y144-I149 HydrophobicContact CD1-CG2 4.3Å; A147-I149 HydrophobicContact CB-CG2 4.22Å; I149-D151 VanDerWaalsContact C-N 3.34Å; I149-L165 HydrophobicContact CB-CD1 4.15Å; I149-L165 HydrophobicContact CG2-CD1 4.37Å; I149-F169 HydrophobicContact CB-CE1 4.49Å; I149-F169 HydrophobicContact CB-CZ 4.27Å; I149-F169 HydrophobicContact CD1-CD1 3.71Å; I149-F169 HydrophobicContact CD1-CE1 3.66Å; I149-F169 HydrophobicContact CD1-CG 4.3Å; I149-F169 HydrophobicContact CD1-CZ 4.23Å; I149-F169 HydrophobicContact CG1-CE1 3.97Å; I149-F169 HydrophobicContact CG1-CZ 4.24Å; I149-F169 WeakPolarHBondContact O-CZ 3.37Å; I149-K172 HydrophobicContact CD1-CB 4.49Å; I149-K172 HydrophobicContact CD1-CD 3.75Å
150	D	79.1	Confident	81.2	Confident	69 Å²	69	56.8 Å²	56.8	37%	0.369	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-71.6	-29.1	-177.4	-68.3	-51.8	0	0	0	112.8	G148 K172 R202	G148-D150 PolarHBondContact O-N 2.96Å; G148-D150 VanDerWaalsContact O-N 3.09Å; D150-K172 IonicContact OD2-NZ 3.97Å; D150-K172 PolarHBondContact OD2-NZ 3.37Å; D150-R202 PolarHBondContact O-NH2 3.11Å; D150-R202 IonicContact OD1-NH1 2.88Å; D150-R202 PolarHBondContact OD1-NH1 3Å
151	D	77.7	Confident	81	Confident	150 Å²	150	58 Å²	58	80%	0.802	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-94.9	-2.4	-177.2	-62.8	-37.4	0	0	0	113.5	G148 I149 S153	G148-D151 PolarHBondContact O-N 3.24Å; G148-D151 VanDerWaalsContact O-N 3.15Å; I149-D151 VanDerWaalsContact C-N 3.34Å; D151-S153 PolarHBondContact O-N 3.34Å
152	M	75.1	Confident	80.8	Confident	64 Å²	64	57.1 Å²	57.1	32%	0.315	31%	0.313	S	S	.	.			trans	-75.8	114.3	-174.8	-78.7	-71.8	-96.6	0	0	112.2	G148 K157	G148-M152 WeakPolarHBondContact O-CG 3.39Å; M152-K157 VanDerWaalsContact CE-NZ 3.32Å
153	S	68.6	Low	80.8	Confident	79 Å²	79	54.5 Å²	54.5	55%	0.552	29%	0.294	S	S	*	.			trans	-70.3	151.6	175.6	68.7	0	0	0	0	112.6	D151 K157	D151-S153 PolarHBondContact O-N 3.34Å; S153-K157 VanDerWaalsContact O-CD 3.28Å; S153-K157 WeakPolarHBondContact O-CD 3.34Å; S153-K157 WeakPolarHBondContact O-CE 3.41Å; S153-K157 PolarHBondContact O-NZ 2.84Å
154	M	64.7	Low	80.7	Confident	18 Å²	18	53.9 Å²	53.9	9%	0.089	29%	0.291	C	S	.	.			trans	-102.4	-3.9	-177.5	-73.9	-64.4	-76.6	0	0	114.4	M162 L165 I206 L324	M154-M162 HydrophobicContact CE-CB 4.05Å; M154-M162 HydrophobicContact CE-CG 3.69Å; M154-M162 HydrophobicContact CE-SD 4.16Å; M154-L165 HydrophobicContact CG-CD2 4.5Å; M154-L165 HydrophobicContact SD-CD2 3.4Å; M154-L165 WeakPolarHBondContact SD-CD2 3.32Å; M154-I206 HydrophobicContact CE-CB 4.5Å; M154-I206 HydrophobicContact CE-CG1 4.17Å; M154-I206 HydrophobicContact CE-CG2 3.68Å; M154-L324 HydrophobicContact CB-CD2 3.98Å; M154-L324 HydrophobicContact CG-CD2 3.35Å
155	E	63.3	Low	80.7	Confident	153 Å²	153	54.2 Å²	54.2	72%	0.715	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	131.2	-178.6	-66.5	-176.1	171.4	0	0	111.2	K157	E155-K157 VanDerWaalsContact C-N 3.32Å; E155-K157 PolarHBondContact O-N 3.47Å
156	N	63.3	Low	80.8	Confident	169 Å²	169	50.9 Å²	50.9	90%	0.904	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	25.4	174	-57.1	-35.5	0	0	0	116.7
157	K	75.1	Confident	81.1	Confident	41 Å²	41	43.4 Å²	43.4	18%	0.178	24%	0.237	C	C	.	.			trans	-86.8	148.3	174.5	-73.6	-174.2	169.6	167.8	0	113.3	M152 S153 E155 M162	M152-K157 VanDerWaalsContact CE-NZ 3.32Å; S153-K157 VanDerWaalsContact O-CD 3.28Å; S153-K157 WeakPolarHBondContact O-CD 3.34Å; S153-K157 WeakPolarHBondContact O-CE 3.41Å; S153-K157 PolarHBondContact O-NZ 2.84Å; E155-K157 VanDerWaalsContact C-N 3.32Å; E155-K157 PolarHBondContact O-N 3.47Å; K157-M162 WeakPolarHBondContact O-CE 3.36Å
158	P	82.7	Confident	81.4	Confident	41 Å²	41	43 Å²	43	27%	0.266	23%	0.234	S	C	.	.			trans	-66.6	154	172.5	29.7	-36	0	0	0	111.8	Y160 Q161	P158-Y160 HydrophobicContact CB-CD1 3.87Å; P158-Y160 HydrophobicContact CB-CE1 3.48Å; P158-Y160 VanDerWaalsContact CB-CE1 3.48Å; P158-Y160 HydrophobicContact CG-CD1 4.12Å; P158-Y160 HydrophobicContact CG-CE1 3.42Å; P158-Y160 VanDerWaalsContact CG-CE1 3.42Å; P158-Y160 HydrophobicContact CG-CE2 4.48Å; P158-Y160 PolarHBondContact O-N 3.49Å; P158-Q161 HydrophobicContact CG-CB 4.28Å; P158-Q161 HydrophobicContact CG-CG 3.82Å; P158-Q161 PolarHBondContact O-N 3.48Å; P158-Q161 VanDerWaalsContact O-N 3.13Å
159	L	84.2	Confident	81.8	Confident	31 Å²	31	41.9 Å²	41.9	16%	0.162	22%	0.222	C	C	.	.	H	α-helix	trans	-58	-41.3	-171.9	-68.7	174.7	0	0	0	113.9	A22 Q161 M162 R163 F210 E213 T217	A22-L159 HydrophobicContact CB-CB 3.75Å; L159-Q161 VanDerWaalsContact C-N 3.26Å; L159-Q161 PolarHBondContact O-N 2.89Å; L159-M162 HydrophobicContact CD2-CE 3.76Å; L159-M162 HydrophobicContact CD2-SD 4.47Å; L159-M162 WeakPolarHBondContact O-CB 3.1Å; L159-M162 PolarHBondContact O-N 3.3Å; L159-M162 VanDerWaalsContact O-N 3.08Å; L159-R163 PolarHBondContact O-N 3.34Å; L159-F210 HydrophobicContact CB-CD2 4.47Å; L159-F210 HydrophobicContact CB-CE2 4.35Å; L159-F210 VanDerWaalsContact O-CD2 3.28Å; L159-F210 WeakPolarHBondContact O-CD2 3.5Å; L159-F210 WeakPolarHBondContact O-CE2 3.11Å; L159-E213 HydrophobicContact CD2-CB 3.48Å; L159-E213 VanDerWaalsContact CD2-CB 3.48Å; L159-T217 HydrophobicContact CD1-CG2 3.81Å; L159-T217 WeakPolarHBondContact CD1-OG1 3.44Å
160	Y	86.5	Confident	82.3	Confident	5 Å²	5	41.8 Å²	41.8	2%	0.02	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-30.1	-179.6	71	-93.7	0	0	0	112.8	D18 R21 E122 P158 M162 R163 L164	D18-Y160 HydrophobicContact CB-CD1 4.23Å; D18-Y160 HydrophobicContact CB-CE1 4.02Å; D18-Y160 WeakPolarHBondContact OD1-CE1 3.31Å; R21-Y160 HydrophobicContact CB-CD1 4.19Å; R21-Y160 HydrophobicContact CB-CD2 4.45Å; R21-Y160 HydrophobicContact CB-CG 3.85Å; R21-Y160 VanDerWaalsContact CZ-CD2 3.45Å; R21-Y160 PolarHBondContact NH1-OH 2.89Å; E122-Y160 PolarHBondContact OE1-OH 2.97Å; P158-Y160 HydrophobicContact CB-CD1 3.87Å; P158-Y160 HydrophobicContact CB-CE1 3.48Å; P158-Y160 VanDerWaalsContact CB-CE1 3.48Å; P158-Y160 HydrophobicContact CG-CD1 4.12Å; P158-Y160 HydrophobicContact CG-CE1 3.42Å; P158-Y160 VanDerWaalsContact CG-CE1 3.42Å; P158-Y160 HydrophobicContact CG-CE2 4.48Å; P158-Y160 PolarHBondContact O-N 3.49Å; Y160-M162 VanDerWaalsContact C-N 3.29Å; Y160-M162 PolarHBondContact O-N 3.2Å; Y160-R163 WeakPolarHBondContact O-CB 3.47Å; Y160-R163 PolarHBondContact O-N 3.08Å; Y160-L164 HydrophobicContact CD2-CD1 4.16Å; Y160-L164 WeakPolarHBondContact O-CG 3.43Å; Y160-L164 PolarHBondContact O-N 2.94Å
161	Q	86.8	Confident	83	Confident	26 Å²	26	38.5 Å²	38.5	12%	0.121	20%	0.204	C	C	.	.	H	α-helix	trans	-68.7	-31.3	175.9	-74.8	-177.2	-1.1	0	0	111.5	E122 P158 L159 L165	E122-Q161 PolarHBondContact OE1-NE2 3.43Å; P158-Q161 HydrophobicContact CG-CB 4.28Å; P158-Q161 HydrophobicContact CG-CG 3.82Å; P158-Q161 PolarHBondContact O-N 3.48Å; P158-Q161 VanDerWaalsContact O-N 3.13Å; L159-Q161 VanDerWaalsContact C-N 3.26Å; L159-Q161 PolarHBondContact O-N 2.89Å; Q161-L165 VanDerWaalsContact O-CB 3.26Å; Q161-L165 WeakPolarHBondContact O-CB 3.39Å; Q161-L165 PolarHBondContact O-N 3.14Å
162	M	86.9	Confident	83.7	Confident	13 Å²	13	32.1 Å²	32.1	6%	0.064	17%	0.169	C	C	.	.	H	α-helix	trans	-66.3	-42	173.6	-53.3	-173.5	-143.7	0	0	110.8	M154 K157 L159 Y160 L165 S166 I206 V209 F210	M154-M162 HydrophobicContact CE-CB 4.05Å; M154-M162 HydrophobicContact CE-CG 3.69Å; M154-M162 HydrophobicContact CE-SD 4.16Å; K157-M162 WeakPolarHBondContact O-CE 3.36Å; L159-M162 HydrophobicContact CD2-CE 3.76Å; L159-M162 HydrophobicContact CD2-SD 4.47Å; L159-M162 WeakPolarHBondContact O-CB 3.1Å; L159-M162 PolarHBondContact O-N 3.3Å; L159-M162 VanDerWaalsContact O-N 3.08Å; Y160-M162 VanDerWaalsContact C-N 3.29Å; Y160-M162 PolarHBondContact O-N 3.2Å; M162-L165 PolarHBondContact O-N 3.07Å; M162-S166 WeakPolarHBondContact O-CB 3.35Å; M162-S166 PolarHBondContact O-N 3.4Å; M162-I206 HydrophobicContact CB-CG2 4.18Å; M162-I206 WeakPolarHBondContact O-CG2 3.4Å; M162-V209 HydrophobicContact SD-CG1 4.38Å; M162-F210 HydrophobicContact CB-CB 4.03Å; M162-F210 HydrophobicContact CB-CD2 4.28Å
163	R	90.6	Very high	84.5	Confident	3 Å²	3	29 Å²	29	1%	0.011	15%	0.154	C	C	.	.	H	α-helix	trans	-58.3	-54.4	172.8	-179.6	179.5	61.4	74.3	3.4	111	R21 W26 E71 E75 L159 Y160 L165 S166 E167 F210 L240	R21-R163 PolarHBondContact O-NE 2.94Å; R21-R163 PolarHBondContact O-NH2 3.37Å; R21-R163 VanDerWaalsContact O-NH2 3.08Å; W26-R163 VanDerWaalsContact CH2-NH2 3.26Å; E71-R163 IonicContact OE1-CZ 2.9Å; E71-R163 IonicContact OE1-NH2 3.02Å; E71-R163 PolarHBondContact OE1-NH2 3.08Å; E75-R163 IonicContact OE1-NH1 3.89Å; E75-R163 PolarHBondContact OE1-NH1 3.44Å; L159-R163 PolarHBondContact O-N 3.34Å; Y160-R163 WeakPolarHBondContact O-CB 3.47Å; Y160-R163 PolarHBondContact O-N 3.08Å; R163-L165 VanDerWaalsContact C-N 3.27Å; R163-L165 PolarHBondContact O-N 3.43Å; R163-S166 PolarHBondContact O-N 2.63Å; R163-E167 HydrophobicContact CG-CG 4.39Å; R163-E167 IonicContact NH1-OE1 2.82Å; R163-E167 IonicContact NH1-OE2 2.73Å; R163-E167 PolarHBondContact NH1-OE2 3.29Å; R163-E167 WeakPolarHBondContact O-CB 3.26Å; R163-E167 VanDerWaalsContact O-CG 3.29Å; R163-E167 WeakPolarHBondContact O-CG 3.44Å; R163-E167 PolarHBondContact O-N 3.48Å; R163-F210 HydrophobicContact CB-CD1 4.3Å; R163-F210 HydrophobicContact CB-CD2 4.13Å; R163-F210 HydrophobicContact CB-CE1 4.04Å; R163-F210 HydrophobicContact CB-CE2 3.85Å; R163-F210 HydrophobicContact CB-CG 4.35Å; R163-F210 HydrophobicContact CB-CZ 3.81Å; R163-F210 HydrophobicContact CG-CE1 4.22Å; R163-F210 HydrophobicContact CG-CZ 4.21Å; R163-L240 HydrophobicContact CG-CD1 4.3Å; R163-L240 HydrophobicContact CG-CD2 4.37Å
164	L	90.1	Very high	85.5	Confident	5 Å²	5	26 Å²	26	3%	0.026	13%	0.131	C	C	.	.	H	α-helix	trans	-58.5	-38.3	-179.8	-72.3	176.3	0	0	0	112.6	L125 I126 Y160 A168	L125-L164 HydrophobicContact CD1-CB 4.27Å; I126-L164 HydrophobicContact CG1-CD2 4.3Å; Y160-L164 HydrophobicContact CD2-CD1 4.16Å; Y160-L164 WeakPolarHBondContact O-CG 3.43Å; Y160-L164 PolarHBondContact O-N 2.94Å; L164-A168 VanDerWaalsContact O-CB 3.24Å; L164-A168 WeakPolarHBondContact O-CB 3.21Å; L164-A168 PolarHBondContact O-N 3.38Å
165	L	90.4	Very high	86.8	Confident	8 Å²	8	25.1 Å²	25.1	4%	0.042	13%	0.127	C	C	.	.	H	α-helix	trans	-71	-42.3	178.6	-172.6	65	0	0	0	112.2	I149 M154 Q161 M162 R163 E167 A168 F169 I206	I149-L165 HydrophobicContact CB-CD1 4.15Å; I149-L165 HydrophobicContact CG2-CD1 4.37Å; M154-L165 HydrophobicContact CG-CD2 4.5Å; M154-L165 HydrophobicContact SD-CD2 3.4Å; M154-L165 WeakPolarHBondContact SD-CD2 3.32Å; Q161-L165 VanDerWaalsContact O-CB 3.26Å; Q161-L165 WeakPolarHBondContact O-CB 3.39Å; Q161-L165 PolarHBondContact O-N 3.14Å; M162-L165 PolarHBondContact O-N 3.07Å; R163-L165 VanDerWaalsContact C-N 3.27Å; R163-L165 PolarHBondContact O-N 3.43Å; L165-E167 VanDerWaalsContact C-N 3.35Å; L165-A168 PolarHBondContact O-N 3.02Å; L165-F169 HydrophobicContact CD1-CD2 4.1Å; L165-F169 HydrophobicContact CD1-CE2 3.66Å; L165-F169 HydrophobicContact CD1-CZ 4.45Å; L165-F169 HydrophobicContact CD2-CE2 4.16Å; L165-F169 HydrophobicContact CG-CD2 3.93Å; L165-F169 HydrophobicContact CG-CE2 3.69Å; L165-F169 VanDerWaalsContact O-CD2 3.24Å; L165-F169 WeakPolarHBondContact O-CD2 3.42Å; L165-F169 PolarHBondContact O-N 3.38Å; L165-I206 HydrophobicContact CD2-CD1 3.87Å; L165-I206 HydrophobicContact CG-CD1 4Å
166	S	91.1	Very high	88	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.8	-46.9	174	177.2	0	0	0	0	111.2	M162 R163 A168 F169 V170 A203 A207	M162-S166 WeakPolarHBondContact O-CB 3.35Å; M162-S166 PolarHBondContact O-N 3.4Å; R163-S166 PolarHBondContact O-N 2.63Å; S166-A168 VanDerWaalsContact C-N 3.33Å; S166-A168 PolarHBondContact O-N 2.87Å; S166-F169 PolarHBondContact O-N 3.2Å; S166-V170 PolarHBondContact O-N 3.27Å; S166-V170 VanDerWaalsContact O-N 3.07Å; S166-A203 PolarHBondContact OG-O 3.4Å; S166-A207 WeakPolarHBondContact OG-CB 3.39Å
167	E	93.2	Very high	89.1	Confident	0 Å²	0	14 Å²	14	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-63.2	-39.2	176.9	-66.9	174.1	145.3	0	0	111.5	K129 R163 L165 V170 I171 T237 F239 L240	K129-E167 IonicContact NZ-OE1 3.33Å; K129-E167 PolarHBondContact NZ-OE1 3.06Å; K129-E167 IonicContact NZ-OE2 3.55Å; K129-E167 PolarHBondContact NZ-OE2 2.94Å; R163-E167 HydrophobicContact CG-CG 4.39Å; R163-E167 IonicContact NH1-OE1 2.82Å; R163-E167 IonicContact NH1-OE2 2.73Å; R163-E167 PolarHBondContact NH1-OE2 3.29Å; R163-E167 WeakPolarHBondContact O-CB 3.26Å; R163-E167 VanDerWaalsContact O-CG 3.29Å; R163-E167 WeakPolarHBondContact O-CG 3.44Å; R163-E167 PolarHBondContact O-N 3.48Å; L165-E167 VanDerWaalsContact C-N 3.35Å; E167-V170 VanDerWaalsContact O-CG1 3.26Å; E167-V170 WeakPolarHBondContact O-CG1 3.14Å; E167-I171 HydrophobicContact CB-CD1 4.48Å; E167-I171 VanDerWaalsContact O-CB 3.29Å; E167-I171 WeakPolarHBondContact O-CB 3.48Å; E167-I171 VanDerWaalsContact O-CD1 3.25Å; E167-I171 WeakPolarHBondContact O-CD1 3.4Å; E167-I171 WeakPolarHBondContact O-CG1 3.4Å; E167-I171 PolarHBondContact O-N 3.39Å; E167-T237 PolarHBondContact OE1-OG1 3.01Å; E167-F239 HydrophobicContact CB-CB 4.27Å; E167-F239 HydrophobicContact CG-CB 3.81Å; E167-L240 HydrophobicContact CG-CD2 4.3Å; E167-L240 HydrophobicContact CG-CG 4.49Å
168	A	92.8	Very high	89.5	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.008	7%	0.074	C	C	.	.	H	α-helix	trans	-62.1	-44.6	175.5	0	0	0	0	0	112.6	L125 Y144 L164 L165 S166 I171 K172	L125-A168 HydrophobicContact CD2-CB 3.92Å; Y144-A168 HydrophobicContact CD1-CB 3.8Å; Y144-A168 HydrophobicContact CE1-CB 3.42Å; Y144-A168 VanDerWaalsContact CE1-CB 3.42Å; L164-A168 VanDerWaalsContact O-CB 3.24Å; L164-A168 WeakPolarHBondContact O-CB 3.21Å; L164-A168 PolarHBondContact O-N 3.38Å; L165-A168 PolarHBondContact O-N 3.02Å; S166-A168 VanDerWaalsContact C-N 3.33Å; S166-A168 PolarHBondContact O-N 2.87Å; A168-I171 PolarHBondContact O-N 2.94Å; A168-K172 WeakPolarHBondContact O-CB 3.38Å; A168-K172 PolarHBondContact O-N 3.29Å
169	F	93.3	Very high	89.5	Confident	2 Å²	2	15 Å²	15	1%	0.009	7%	0.07	C	C	.	.	H	α-helix	trans	-64.7	-44.7	178.1	-83.7	-64.5	0	0	0	112.4	I149 L165 S166 I171 K172 G173 R202 A203 I206	I149-F169 HydrophobicContact CB-CE1 4.49Å; I149-F169 HydrophobicContact CB-CZ 4.27Å; I149-F169 HydrophobicContact CD1-CD1 3.71Å; I149-F169 HydrophobicContact CD1-CE1 3.66Å; I149-F169 HydrophobicContact CD1-CG 4.3Å; I149-F169 HydrophobicContact CD1-CZ 4.23Å; I149-F169 HydrophobicContact CG1-CE1 3.97Å; I149-F169 HydrophobicContact CG1-CZ 4.24Å; I149-F169 WeakPolarHBondContact O-CZ 3.37Å; L165-F169 HydrophobicContact CD1-CD2 4.1Å; L165-F169 HydrophobicContact CD1-CE2 3.66Å; L165-F169 HydrophobicContact CD1-CZ 4.45Å; L165-F169 HydrophobicContact CD2-CE2 4.16Å; L165-F169 HydrophobicContact CG-CD2 3.93Å; L165-F169 HydrophobicContact CG-CE2 3.69Å; L165-F169 VanDerWaalsContact O-CD2 3.24Å; L165-F169 WeakPolarHBondContact O-CD2 3.42Å; L165-F169 PolarHBondContact O-N 3.38Å; S166-F169 PolarHBondContact O-N 3.2Å; F169-I171 PolarHBondContact O-N 3.35Å; F169-K172 PolarHBondContact O-N 3.16Å; F169-G173 PolarHBondContact O-N 3.26Å; F169-R202 HydrophobicContact CD1-CB 4.34Å; F169-R202 HydrophobicContact CD2-CB 4.33Å; F169-R202 HydrophobicContact CG-CB 4.26Å; F169-A203 HydrophobicContact CB-CB 3.78Å; F169-I206 HydrophobicContact CD2-CD1 3.73Å; F169-I206 HydrophobicContact CE2-CD1 3.8Å
170	V	93.6	Very high	89	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-66.6	-39	177.9	71.9	0	0	0	0	111.3	S166 E167 G173 L174 F200 A203 F239 A242 A243	S166-V170 PolarHBondContact O-N 3.27Å; S166-V170 VanDerWaalsContact O-N 3.07Å; E167-V170 VanDerWaalsContact O-CG1 3.26Å; E167-V170 WeakPolarHBondContact O-CG1 3.14Å; V170-G173 PolarHBondContact O-N 3.48Å; V170-L174 HydrophobicContact CG2-CD1 4.07Å; V170-L174 HydrophobicContact CG2-CG 4.3Å; V170-L174 VanDerWaalsContact O-CG 3.3Å; V170-L174 WeakPolarHBondContact O-CG 3.42Å; V170-L174 PolarHBondContact O-N 3.48Å; V170-F200 HydrophobicContact CG2-CD1 4.11Å; V170-F200 HydrophobicContact CG2-CE1 4.09Å; V170-A203 HydrophobicContact CB-CB 3.93Å; V170-F239 HydrophobicContact CG1-CB 4.21Å; V170-F239 HydrophobicContact CG1-CD1 4.4Å; V170-A242 HydrophobicContact CG2-CB 3.91Å; V170-A243 HydrophobicContact CB-CB 4.08Å; V170-A243 HydrophobicContact CG1-CB 4.3Å; V170-A243 HydrophobicContact CG2-CB 4.35Å
171	I	93.2	Very high	88.3	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-67.4	-39.6	178	-66.6	165.3	0	0	0	110.9	K129 Y132 Y144 E167 A168 F169 G173 L174 S175 F239	K129-I171 HydrophobicContact CB-CD1 3.83Å; K129-I171 HydrophobicContact CD-CD1 4.36Å; K129-I171 HydrophobicContact CG-CD1 3.66Å; Y132-I171 HydrophobicContact CD1-CG2 4.15Å; Y132-I171 HydrophobicContact CD2-CG2 3.74Å; Y132-I171 HydrophobicContact CG-CG2 3.49Å; Y132-I171 VanDerWaalsContact CG-CG2 3.49Å; Y144-I171 HydrophobicContact CE2-CB 4.03Å; Y144-I171 HydrophobicContact CE2-CG2 3.69Å; Y144-I171 WeakPolarHBondContact OH-CG2 3.26Å; E167-I171 HydrophobicContact CB-CD1 4.48Å; E167-I171 VanDerWaalsContact O-CB 3.29Å; E167-I171 WeakPolarHBondContact O-CB 3.48Å; E167-I171 VanDerWaalsContact O-CD1 3.25Å; E167-I171 WeakPolarHBondContact O-CD1 3.4Å; E167-I171 WeakPolarHBondContact O-CG1 3.4Å; E167-I171 PolarHBondContact O-N 3.39Å; A168-I171 PolarHBondContact O-N 2.94Å; F169-I171 PolarHBondContact O-N 3.35Å; I171-G173 VanDerWaalsContact C-N 3.33Å; I171-G173 PolarHBondContact O-N 3.24Å; I171-L174 PolarHBondContact O-N 3.29Å; I171-S175 VanDerWaalsContact O-CB 3.23Å; I171-S175 WeakPolarHBondContact O-CB 3.21Å; I171-S175 PolarHBondContact O-N 2.94Å; I171-S175 PolarHBondContact O-OG 3.42Å; I171-F239 HydrophobicContact CD1-CD1 3.92Å; I171-F239 HydrophobicContact CD1-CD2 4.46Å; I171-F239 HydrophobicContact CD1-CE1 3.88Å; I171-F239 HydrophobicContact CD1-CE2 4.42Å; I171-F239 HydrophobicContact CD1-CG 4.22Å; I171-F239 HydrophobicContact CD1-CZ 4.14Å; I171-F239 HydrophobicContact CG1-CD1 3.56Å; I171-F239 HydrophobicContact CG1-CE1 3.55Å; I171-F239 HydrophobicContact CG1-CG 4.29Å; I171-F239 HydrophobicContact CG1-CZ 4.28Å
172	K	92.6	Very high	86.9	Confident	15 Å²	15	26.6 Å²	26.6	7%	0.065	15%	0.146	C	C	.	.	H	α-helix	trans	-57	-48.4	171.5	-178.2	-177.7	171.8	-163.8	0	110.1	Y144 I149 D150 A168 F169 S175 L176 E195	Y144-K172 HydrophobicContact CD2-CB 4.08Å; I149-K172 HydrophobicContact CD1-CB 4.49Å; I149-K172 HydrophobicContact CD1-CD 3.75Å; D150-K172 IonicContact OD2-NZ 3.97Å; D150-K172 PolarHBondContact OD2-NZ 3.37Å; A168-K172 WeakPolarHBondContact O-CB 3.38Å; A168-K172 PolarHBondContact O-N 3.29Å; F169-K172 PolarHBondContact O-N 3.16Å; K172-S175 PolarHBondContact O-N 3Å; K172-L176 HydrophobicContact CG-CD1 4.12Å; K172-L176 WeakPolarHBondContact O-CB 3.46Å; K172-L176 VanDerWaalsContact O-CG 3.3Å; K172-L176 WeakPolarHBondContact O-CG 3.39Å; K172-L176 PolarHBondContact O-N 3.2Å; K172-E195 WeakPolarHBondContact CE-OE1 3.44Å; K172-E195 IonicContact NZ-OE1 3.13Å; K172-E195 PolarHBondContact NZ-OE1 3.13Å
173	G	91.1	Very high	85.4	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.9	-51.5	176.5	0	0	0	0	0	113.2	F169 V170 I171 S175 L176 E177	F169-G173 PolarHBondContact O-N 3.26Å; V170-G173 PolarHBondContact O-N 3.48Å; I171-G173 VanDerWaalsContact C-N 3.33Å; I171-G173 PolarHBondContact O-N 3.24Å; G173-S175 VanDerWaalsContact C-N 3.34Å; G173-S175 PolarHBondContact O-N 3.1Å; G173-L176 CarbonylContact O-C 3.52Å; G173-L176 WeakPolarHBondContact O-CB 3.47Å; G173-L176 PolarHBondContact O-N 3.45Å; G173-L176 VanDerWaalsContact O-N 3.15Å; G173-E177 PolarHBondContact O-N 3.44Å
174	L	90.9	Very high	83.9	Confident	15 Å²	15	36.2 Å²	36.2	8%	0.079	20%	0.2	C	C	.	.	H	α-helix	trans	-62.8	-38.9	178.8	-67.4	170.8	0	0	0	112.3	Y132 V170 I171 L176 E177 R178 F200 A242	Y132-L174 HydrophobicContact CE2-CB 3.73Å; Y132-L174 WeakPolarHBondContact OH-CD1 3.47Å; V170-L174 HydrophobicContact CG2-CD1 4.07Å; V170-L174 HydrophobicContact CG2-CG 4.3Å; V170-L174 VanDerWaalsContact O-CG 3.3Å; V170-L174 WeakPolarHBondContact O-CG 3.42Å; V170-L174 PolarHBondContact O-N 3.48Å; I171-L174 PolarHBondContact O-N 3.29Å; L174-L176 VanDerWaalsContact C-N 3.35Å; L174-E177 PolarHBondContact O-N 2.91Å; L174-R178 WeakPolarHBondContact O-CG 3.49Å; L174-R178 PolarHBondContact O-N 3.47Å; L174-F200 HydrophobicContact CD2-CE1 4.29Å; L174-F200 HydrophobicContact CD2-CZ 4.16Å; L174-F200 HydrophobicContact CG-CE1 4.17Å; L174-F200 HydrophobicContact CG-CZ 4.46Å; L174-A242 HydrophobicContact CD1-CB 4.45Å
175	S	90.5	Very high	82.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.3	-43.2	174.4	-59	0	0	0	0	111.1	Y132 I171 K172 G173 E177 R178 L179	Y132-S175 VanDerWaalsContact CD2-OG 3.3Å; Y132-S175 WeakPolarHBondContact CD2-OG 3.13Å; I171-S175 VanDerWaalsContact O-CB 3.23Å; I171-S175 WeakPolarHBondContact O-CB 3.21Å; I171-S175 PolarHBondContact O-N 2.94Å; I171-S175 PolarHBondContact O-OG 3.42Å; K172-S175 PolarHBondContact O-N 3Å; G173-S175 VanDerWaalsContact C-N 3.34Å; G173-S175 PolarHBondContact O-N 3.1Å; S175-E177 PolarHBondContact O-N 3.05Å; S175-R178 PolarHBondContact O-N 3.09Å; S175-L179 PolarHBondContact O-N 3.08Å
176	L	88.6	Confident	81.8	Confident	14 Å²	14	49.4 Å²	49.4	7%	0.073	26%	0.258	C	S	.	.	H	α-helix	trans	-67.3	-19.6	175.2	-76.8	173.1	0	0	0	113	I141 K172 G173 L174 R192 E195 V196	I141-L176 HydrophobicContact CD1-CD2 3.81Å; I141-L176 HydrophobicContact CD1-CG 4.04Å; I141-L176 HydrophobicContact CG1-CG 4.48Å; K172-L176 HydrophobicContact CG-CD1 4.12Å; K172-L176 WeakPolarHBondContact O-CB 3.46Å; K172-L176 VanDerWaalsContact O-CG 3.3Å; K172-L176 WeakPolarHBondContact O-CG 3.39Å; K172-L176 PolarHBondContact O-N 3.2Å; G173-L176 CarbonylContact O-C 3.52Å; G173-L176 WeakPolarHBondContact O-CB 3.47Å; G173-L176 PolarHBondContact O-N 3.45Å; G173-L176 VanDerWaalsContact O-N 3.15Å; L174-L176 VanDerWaalsContact C-N 3.35Å; L176-R192 PolarHBondContact O-NE 3.2Å; L176-R192 PolarHBondContact O-NH2 3.1Å; L176-E195 HydrophobicContact CD1-CG 4.1Å; L176-V196 HydrophobicContact CB-CG2 3.54Å; L176-V196 HydrophobicContact CD1-CG2 4.33Å
177	E	86.3	Confident	80.9	Confident	74 Å²	74	56.5 Å²	56.5	35%	0.346	29%	0.29	S	S	.	.	H	α-helix	trans	-80.2	-33.3	170	-68.2	-165.8	134.4	0	0	112.5	G173 L174 S175 V196 F200 K250	G173-E177 PolarHBondContact O-N 3.44Å; L174-E177 PolarHBondContact O-N 2.91Å; S175-E177 PolarHBondContact O-N 3.05Å; E177-V196 HydrophobicContact CG-CG1 3.74Å; E177-V196 HydrophobicContact CG-CG2 4.24Å; E177-F200 HydrophobicContact CG-CZ 4.45Å; E177-K250 VanDerWaalsContact OE1-CD 3.3Å; E177-K250 WeakPolarHBondContact OE1-CD 3.15Å; E177-K250 VanDerWaalsContact OE1-CE 3.24Å; E177-K250 WeakPolarHBondContact OE1-CE 3.46Å; E177-K250 IonicContact OE1-NZ 2.76Å; E177-K250 PolarHBondContact OE1-NZ 3Å
178	R	84.8	Confident	80	Confident	71 Å²	71	64.4 Å²	64.4	27%	0.268	32%	0.319	S	S	.	.	H	α-helix	trans	-84.9	-16.6	-171.8	-68.6	-179.5	-175.3	-167.8	1.7	114.9	S88 Y132 Y137 L174 S175	S88-R178 VanDerWaalsContact CB-NH2 3.27Å; S88-R178 PolarHBondContact OG-NH2 2.86Å; Y132-R178 PolarHBondContact OH-NH1 3.16Å; Y132-R178 PolarHBondContact OH-NH2 3.38Å; Y137-R178 HydrophobicContact CD2-CB 3.72Å; Y137-R178 HydrophobicContact CE2-CB 3.7Å; Y137-R178 HydrophobicContact CE2-CG 4.39Å; Y137-R178 HydrophobicContact CG-CB 4.15Å; Y137-R178 PolarHBondContact OH-NH1 3.23Å; L174-R178 WeakPolarHBondContact O-CG 3.49Å; L174-R178 PolarHBondContact O-N 3.47Å; S175-R178 PolarHBondContact O-N 3.09Å
179	L	83.1	Confident	79.3	Confident	33 Å²	33	66.6 Å²	66.6	17%	0.173	33%	0.331	C	S	.	.	S	Bend	trans	-68.4	138.1	174.8	-47.4	160.4	0	0	0	110.2	R138 I141 S175 N181 R192	R138-L179 HydrophobicContact CB-CD2 4.47Å; R138-L179 HydrophobicContact CG-CD2 3.4Å; R138-L179 VanDerWaalsContact CG-CD2 3.4Å; I141-L179 HydrophobicContact CD1-CD1 3.62Å; I141-L179 HydrophobicContact CD1-CG 4.28Å; S175-L179 PolarHBondContact O-N 3.08Å; L179-N181 PolarHBondContact O-N 3.16Å; L179-R192 PolarHBondContact O-NH2 3.29Å
180	P	73.5	Confident	78.6	Confident	98 Å²	98	69.3 Å²	69.3	64%	0.636	35%	0.347	S	S	*	.			trans	-58.5	138.3	177.4	24.3	-33.8	0	0	0	110.6	S182	P180-S182 PolarHBondContact O-N 3.2Å
181	N	70.2	Confident	78	Confident	116 Å²	116	74.5 Å²	74.5	62%	0.62	37%	0.372	S	S	*	.			trans	-64.6	101.6	169.7	-69.2	-20	0	0	0	107.6	L179 L189 R192	L179-N181 PolarHBondContact O-N 3.16Å; N181-L189 HydrophobicContact CB-CD2 4.08Å; N181-R192 PolarHBondContact OD1-NH1 3.22Å
182	S	59.3	Low	77.5	Confident	91 Å²	91	76.8 Å²	76.8	64%	0.636	38%	0.38	S	S	*	.			trans	-60.1	170	166.8	75.6	0	0	0	0	109.5	P180 A184	P180-S182 PolarHBondContact O-N 3.2Å; S182-A184 PolarHBondContact O-N 2.93Å
183	I	55.2	Low	77.1	Confident	189 Å²	189	79.3 Å²	79.3	97%	0.969	39%	0.393	S	S	*	.	S	Bend	trans	-66.5	61.8	176.5	-51.1	161.5	0	0	0	109.8
184	A	58.4	Low	76.7	Confident	29 Å²	29	84.4 Å²	84.4	24%	0.24	42%	0.416	C	S	.	.			trans	-93.8	144.4	-175.6	0	0	0	0	0	108.9	S182 R188	S182-A184 PolarHBondContact O-N 2.93Å; A184-R188 HydrophobicContact CB-CB 4.13Å
185	S	66.3	Low	76.5	Confident	66 Å²	66	87.3 Å²	87.3	46%	0.462	43%	0.43	S	S	.	.			trans	-58.1	150.2	173	56.6	0	0	0	0	110.6	F187 R188 L189	S185-F187 PolarHBondContact O-N 2.86Å; S185-R188 PolarHBondContact O-N 3.33Å; S185-L189 PolarHBondContact O-N 3.42Å
186	R	69.6	Low	76.4	Confident	223 Å²	223	87.5 Å²	87.5	84%	0.842	43%	0.431	S	S	*	.	H	α-helix	trans	-49.4	-35.7	177.8	-71.5	-176.3	-179	178.6	-0.4	112.7	L189 T190	R186-L189 PolarHBondContact O-N 2.94Å; R186-T190 PolarHBondContact O-N 2.82Å; R186-T190 VanDerWaalsContact O-N 3.11Å; R186-T190 PolarHBondContact O-OG1 2.9Å
187	F	72.3	Confident	76.4	Confident	150 Å²	150	87.3 Å²	87.3	66%	0.658	43%	0.43	S	S	*	.	H	α-helix	trans	-62.8	-39.6	177.1	-175	-94.2	0	0	0	114	S185 L189 T190 E191	S185-F187 PolarHBondContact O-N 2.86Å; F187-L189 VanDerWaalsContact C-N 3.3Å; F187-L189 PolarHBondContact O-N 3.41Å; F187-T190 WeakPolarHBondContact CA-OG1 3.43Å; F187-T190 PolarHBondContact O-N 3.29Å; F187-T190 PolarHBondContact O-OG1 3.2Å; F187-E191 WeakPolarHBondContact O-CB 3.35Å; F187-E191 PolarHBondContact O-N 3.4Å
188	R	75	Confident	76.4	Confident	165 Å²	165	87 Å²	87	62%	0.623	43%	0.433	S	S	*	.	H	α-helix	trans	-73.1	-25.4	177.2	-74.6	-175.5	177.8	169.8	0.4	112.7	A184 S185 R192	A184-R188 HydrophobicContact CB-CB 4.13Å; S185-R188 PolarHBondContact O-N 3.33Å; R188-R192 WeakPolarHBondContact O-CB 3.33Å; R188-R192 PolarHBondContact O-N 2.9Å
189	L	77.1	Confident	76.7	Confident	47 Å²	47	83.8 Å²	83.8	25%	0.246	42%	0.421	C	S	.	.	H	α-helix	trans	-72.4	-41.9	173.3	-65.7	172.4	0	0	0	110.6	N181 S185 R186 F187 R192 E193	N181-L189 HydrophobicContact CB-CD2 4.08Å; S185-L189 PolarHBondContact O-N 3.42Å; R186-L189 PolarHBondContact O-N 2.94Å; F187-L189 VanDerWaalsContact C-N 3.3Å; F187-L189 PolarHBondContact O-N 3.41Å; L189-R192 PolarHBondContact O-N 3.43Å; L189-E193 WeakPolarHBondContact O-CB 3.42Å; L189-E193 VanDerWaalsContact O-CG 3.3Å; L189-E193 WeakPolarHBondContact O-CG 3.45Å; L189-E193 PolarHBondContact O-N 3.45Å
190	T	78.9	Confident	77.1	Confident	59 Å²	59	82.2 Å²	82.2	36%	0.362	41%	0.413	S	S	.	.	H	α-helix	trans	-65.7	-42.5	176.3	50.9	0	0	0	0	112.3	R186 F187 R192 E193 E194	R186-T190 PolarHBondContact O-N 2.82Å; R186-T190 VanDerWaalsContact O-N 3.11Å; R186-T190 PolarHBondContact O-OG1 2.9Å; F187-T190 WeakPolarHBondContact CA-OG1 3.43Å; F187-T190 PolarHBondContact O-N 3.29Å; F187-T190 PolarHBondContact O-OG1 3.2Å; T190-R192 PolarHBondContact O-N 2.94Å; T190-E193 WeakPolarHBondContact O-CB 3.3Å; T190-E193 PolarHBondContact O-N 3.48Å; T190-E194 WeakPolarHBondContact O-CG 3.42Å; T190-E194 PolarHBondContact O-N 3.42Å
191	E	81.7	Confident	77.8	Confident	110 Å²	110	79.5 Å²	79.5	51%	0.514	39%	0.392	S	S	.	.	H	α-helix	trans	-61.5	-43.8	176.4	-175	179.3	-163.9	0	0	111.8	F187 E193 E194 E195	F187-E191 WeakPolarHBondContact O-CB 3.35Å; F187-E191 PolarHBondContact O-N 3.4Å; E191-E193 VanDerWaalsContact C-N 3.34Å; E191-E193 PolarHBondContact O-N 3.35Å; E191-E194 PolarHBondContact O-N 2.87Å; E191-E195 PolarHBondContact O-N 3.44Å
192	R	82.7	Confident	78.7	Confident	47 Å²	47	77.6 Å²	77.6	18%	0.177	38%	0.376	C	S	.	.	H	α-helix	trans	-64.9	-37.7	175.3	-175.4	-179.5	172.1	-166.1	-6.3	112.2	L176 L179 N181 R188 L189 T190 E195 V196	L176-R192 PolarHBondContact O-NE 3.2Å; L176-R192 PolarHBondContact O-NH2 3.1Å; L179-R192 PolarHBondContact O-NH2 3.29Å; N181-R192 PolarHBondContact OD1-NH1 3.22Å; R188-R192 WeakPolarHBondContact O-CB 3.33Å; R188-R192 PolarHBondContact O-N 2.9Å; L189-R192 PolarHBondContact O-N 3.43Å; T190-R192 PolarHBondContact O-N 2.94Å; R192-E195 PolarHBondContact O-N 2.9Å; R192-V196 VanDerWaalsContact O-CG2 3.27Å; R192-V196 WeakPolarHBondContact O-CG2 3.42Å; R192-V196 PolarHBondContact O-N 2.93Å
193	E	82.9	Confident	80.2	Confident	69 Å²	69	73.2 Å²	73.2	32%	0.322	35%	0.345	S	S	.	.	H	α-helix	trans	-65.5	-40.1	175.6	-78	176.9	-169.7	0	0	112.2	L189 T190 E191 V196 I197 K254	L189-E193 WeakPolarHBondContact O-CB 3.42Å; L189-E193 VanDerWaalsContact O-CG 3.3Å; L189-E193 WeakPolarHBondContact O-CG 3.45Å; L189-E193 PolarHBondContact O-N 3.45Å; T190-E193 WeakPolarHBondContact O-CB 3.3Å; T190-E193 PolarHBondContact O-N 3.48Å; E191-E193 VanDerWaalsContact C-N 3.34Å; E191-E193 PolarHBondContact O-N 3.35Å; E193-V196 PolarHBondContact O-N 3.31Å; E193-I197 WeakPolarHBondContact O-CG1 3.39Å; E193-I197 PolarHBondContact O-N 3.17Å; E193-K254 IonicContact OE2-NZ 2.87Å; E193-K254 PolarHBondContact OE2-NZ 3.06Å
194	E	84	Confident	81.9	Confident	106 Å²	106	64.8 Å²	64.8	50%	0.495	30%	0.303	S	S	.	.	H	α-helix	trans	-65.1	-41.3	174	-73.8	167.9	-164	0	0	111.4	T190 E191 V196 I197 T198	T190-E194 WeakPolarHBondContact O-CG 3.42Å; T190-E194 PolarHBondContact O-N 3.42Å; E191-E194 PolarHBondContact O-N 2.87Å; E194-V196 VanDerWaalsContact C-N 3.31Å; E194-V196 PolarHBondContact O-N 2.76Å; E194-I197 PolarHBondContact O-N 2.97Å; E194-T198 WeakPolarHBondContact O-CG2 3.34Å; E194-T198 PolarHBondContact O-N 3.17Å; E194-T198 PolarHBondContact O-OG1 3.4Å
195	E	86.7	Confident	83.3	Confident	77 Å²	77	65.4 Å²	65.4	36%	0.36	30%	0.299	S	S	.	.	H	α-helix	trans	-60.3	-41	173.3	-167.2	-175.5	178.7	0	0	111.6	K172 L176 E191 R192 T198 C199	K172-E195 WeakPolarHBondContact CE-OE1 3.44Å; K172-E195 IonicContact NZ-OE1 3.13Å; K172-E195 PolarHBondContact NZ-OE1 3.13Å; L176-E195 HydrophobicContact CD1-CG 4.1Å; E191-E195 PolarHBondContact O-N 3.44Å; R192-E195 PolarHBondContact O-N 2.9Å; E195-T198 WeakPolarHBondContact CA-OG1 3.48Å; E195-T198 PolarHBondContact O-OG1 2.91Å; E195-C199 WeakPolarHBondContact O-CB 3.38Å; E195-C199 PolarHBondContact O-N 3.37Å; E195-C199 PolarHBondContact O-SG 3.25Å
196	V	89.1	Confident	84.4	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.024	28%	0.278	C	S	.	.	H	α-helix	trans	-62	-47.2	175.9	167.3	0	0	0	0	111.2	L176 E177 R192 E193 E194 C199 F200	L176-V196 HydrophobicContact CB-CG2 3.54Å; L176-V196 HydrophobicContact CD1-CG2 4.33Å; E177-V196 HydrophobicContact CG-CG1 3.74Å; E177-V196 HydrophobicContact CG-CG2 4.24Å; R192-V196 VanDerWaalsContact O-CG2 3.27Å; R192-V196 WeakPolarHBondContact O-CG2 3.42Å; R192-V196 PolarHBondContact O-N 2.93Å; E193-V196 PolarHBondContact O-N 3.31Å; E194-V196 VanDerWaalsContact C-N 3.31Å; E194-V196 PolarHBondContact O-N 2.76Å; V196-C199 WeakPolarHBondContact O-CB 3.4Å; V196-C199 PolarHBondContact O-N 3.02Å; V196-F200 HydrophobicContact CG1-CD2 3.83Å; V196-F200 HydrophobicContact CG1-CE2 3.27Å; V196-F200 HydrophobicContact CG1-CZ 3.77Å; V196-F200 WeakPolarHBondContact O-CD2 3.46Å; V196-F200 WeakPolarHBondContact O-CG 3.31Å; V196-F200 PolarHBondContact O-N 2.9Å; V196-F200 VanDerWaalsContact O-N 3.07Å
197	I	86.6	Confident	85.4	Confident	10 Å²	10	51.8 Å²	51.8	5%	0.051	24%	0.238	C	C	.	.	H	α-helix	trans	-64.9	-44.7	-178.4	-66.2	163.9	0	0	0	110.7	E193 E194 C199 F200 E201 K250	E193-I197 WeakPolarHBondContact O-CG1 3.39Å; E193-I197 PolarHBondContact O-N 3.17Å; E194-I197 PolarHBondContact O-N 2.97Å; I197-C199 VanDerWaalsContact C-N 3.31Å; I197-C199 PolarHBondContact O-N 3.03Å; I197-F200 PolarHBondContact O-N 2.87Å; I197-F200 VanDerWaalsContact O-N 3.09Å; I197-E201 HydrophobicContact CG2-CG 4.29Å; I197-E201 WeakPolarHBondContact CG2-OE1 3.29Å; I197-E201 WeakPolarHBondContact O-CG 3.35Å; I197-E201 PolarHBondContact O-N 2.88Å; I197-K250 HydrophobicContact CG1-CG 4.24Å
198	T	87.9	Confident	86.2	Confident	67 Å²	67	45 Å²	45	41%	0.411	21%	0.208	S	C	.	.	H	α-helix	trans	-62.6	-36.8	177.1	53.3	0	0	0	0	112.3	E194 E195 R202	E194-T198 WeakPolarHBondContact O-CG2 3.34Å; E194-T198 PolarHBondContact O-N 3.17Å; E194-T198 PolarHBondContact O-OG1 3.4Å; E195-T198 WeakPolarHBondContact CA-OG1 3.48Å; E195-T198 PolarHBondContact O-OG1 2.91Å; T198-R202 WeakPolarHBondContact O-CG 3.47Å; T198-R202 PolarHBondContact O-N 3.05Å
199	C	90.4	Very high	86.9	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.02	18%	0.181	C	C	.	.	H	α-helix	trans	-60.6	-44.6	171.6	-70.9	0	0	0	0	111.6	E195 V196 I197 A203	E195-C199 WeakPolarHBondContact O-CB 3.38Å; E195-C199 PolarHBondContact O-N 3.37Å; E195-C199 PolarHBondContact O-SG 3.25Å; V196-C199 WeakPolarHBondContact O-CB 3.4Å; V196-C199 PolarHBondContact O-N 3.02Å; I197-C199 VanDerWaalsContact C-N 3.31Å; I197-C199 PolarHBondContact O-N 3.03Å; C199-A203 VanDerWaalsContact O-CB 3.32Å; C199-A203 WeakPolarHBondContact O-CB 3.35Å; C199-A203 PolarHBondContact O-N 3.33Å
200	F	91.8	Very high	87.5	Confident	1 Å²	1	35.3 Å²	35.3	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-68.2	-40.2	178.6	-63.8	-33.6	0	0	0	113.3	V170 L174 E177 V196 I197 A203 S204 A247	V170-F200 HydrophobicContact CG2-CD1 4.11Å; V170-F200 HydrophobicContact CG2-CE1 4.09Å; L174-F200 HydrophobicContact CD2-CE1 4.29Å; L174-F200 HydrophobicContact CD2-CZ 4.16Å; L174-F200 HydrophobicContact CG-CE1 4.17Å; L174-F200 HydrophobicContact CG-CZ 4.46Å; E177-F200 HydrophobicContact CG-CZ 4.45Å; V196-F200 HydrophobicContact CG1-CD2 3.83Å; V196-F200 HydrophobicContact CG1-CE2 3.27Å; V196-F200 HydrophobicContact CG1-CZ 3.77Å; V196-F200 WeakPolarHBondContact O-CD2 3.46Å; V196-F200 WeakPolarHBondContact O-CG 3.31Å; V196-F200 PolarHBondContact O-N 2.9Å; V196-F200 VanDerWaalsContact O-N 3.07Å; I197-F200 PolarHBondContact O-N 2.87Å; I197-F200 VanDerWaalsContact O-N 3.09Å; F200-A203 PolarHBondContact O-N 3.24Å; F200-S204 WeakPolarHBondContact O-CB 3.34Å; F200-S204 PolarHBondContact O-N 3.45Å; F200-A247 HydrophobicContact CB-CB 3.78Å
201	E	88.1	Confident	88	Confident	40 Å²	40	32.7 Å²	32.7	19%	0.187	15%	0.153	C	C	.	.	H	α-helix	trans	-60.2	-47.8	175.4	-72.6	171.1	-174.7	0	0	111.3	I197 A203 S204 W205 A247 K259	I197-E201 HydrophobicContact CG2-CG 4.29Å; I197-E201 WeakPolarHBondContact CG2-OE1 3.29Å; I197-E201 WeakPolarHBondContact O-CG 3.35Å; I197-E201 PolarHBondContact O-N 2.88Å; E201-A203 PolarHBondContact O-N 3.45Å; E201-S204 PolarHBondContact O-N 2.99Å; E201-W205 WeakPolarHBondContact O-CB 3.44Å; E201-W205 PolarHBondContact O-N 3.36Å; E201-A247 HydrophobicContact CG-CB 4.49Å; E201-K259 WeakPolarHBondContact OE1-CE 3.34Å; E201-K259 IonicContact OE1-NZ 2.96Å; E201-K259 PolarHBondContact OE1-NZ 3.43Å
202	R	88.3	Confident	88.3	Confident	76 Å²	76	28 Å²	28	29%	0.287	13%	0.131	S	C	.	.	H	α-helix	trans	-62.4	-42.2	176.1	-68.9	179	88.7	174.6	6.4	111.4	D150 F169 T198 W205 I206	D150-R202 PolarHBondContact O-NH2 3.11Å; D150-R202 IonicContact OD1-NH1 2.88Å; D150-R202 PolarHBondContact OD1-NH1 3Å; F169-R202 HydrophobicContact CD1-CB 4.34Å; F169-R202 HydrophobicContact CD2-CB 4.33Å; F169-R202 HydrophobicContact CG-CB 4.26Å; T198-R202 WeakPolarHBondContact O-CG 3.47Å; T198-R202 PolarHBondContact O-N 3.05Å; R202-W205 PolarHBondContact O-N 2.91Å; R202-I206 WeakPolarHBondContact O-CD1 3.48Å; R202-I206 VanDerWaalsContact O-CG1 3.23Å; R202-I206 WeakPolarHBondContact O-CG1 3.36Å; R202-I206 PolarHBondContact O-N 3.32Å; R202-I206 VanDerWaalsContact O-N 3.07Å
203	A	91.1	Very high	88.5	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.9	-47.5	177.9	0	0	0	0	0	112	S166 F169 V170 C199 F200 E201 I206 A207 A243	S166-A203 PolarHBondContact OG-O 3.4Å; F169-A203 HydrophobicContact CB-CB 3.78Å; V170-A203 HydrophobicContact CB-CB 3.93Å; C199-A203 VanDerWaalsContact O-CB 3.32Å; C199-A203 WeakPolarHBondContact O-CB 3.35Å; C199-A203 PolarHBondContact O-N 3.33Å; F200-A203 PolarHBondContact O-N 3.24Å; E201-A203 PolarHBondContact O-N 3.45Å; A203-I206 PolarHBondContact O-N 3.03Å; A203-A207 WeakPolarHBondContact O-CB 3.47Å; A203-A207 PolarHBondContact O-N 3.46Å; A203-A243 HydrophobicContact CB-CB 3.88Å
204	S	90.7	Very high	88.6	Confident	11 Å²	11	24.1 Å²	24.1	8%	0.077	12%	0.115	C	C	.	.	H	α-helix	trans	-60.4	-47.8	178.5	-174.8	0	0	0	0	111.4	F200 E201 I206 A207 Q208 A243	F200-S204 WeakPolarHBondContact O-CB 3.34Å; F200-S204 PolarHBondContact O-N 3.45Å; E201-S204 PolarHBondContact O-N 2.99Å; S204-I206 PolarHBondContact O-N 3.32Å; S204-A207 PolarHBondContact O-N 3.46Å; S204-Q208 VanDerWaalsContact O-CG 3.27Å; S204-Q208 WeakPolarHBondContact O-CG 3.39Å; S204-Q208 PolarHBondContact O-N 3.39Å; S204-Q208 PolarHBondContact O-NE2 3.48Å; S204-Q208 PolarHBondContact OG-NE2 3.32Å; S204-A243 WeakPolarHBondContact CA-O 3.37Å; S204-A243 VanDerWaalsContact CB-O 3.27Å; S204-A243 WeakPolarHBondContact CB-O 3.45Å; S204-A243 PolarHBondContact N-O 3.49Å
205	W	87.9	Confident	88.7	Confident	42 Å²	42	21.2 Å²	21.2	16%	0.159	10%	0.102	C	C	.	.	H	α-helix	trans	-59.6	-47.6	179.5	-171.1	-74.9	0	0	0	112.2	E201 R202 Q208 V209 E266 R325 K326 P327	E201-W205 WeakPolarHBondContact O-CB 3.44Å; E201-W205 PolarHBondContact O-N 3.36Å; R202-W205 PolarHBondContact O-N 2.91Å; W205-Q208 PolarHBondContact O-N 3.26Å; W205-V209 WeakPolarHBondContact O-CG2 3.4Å; W205-V209 PolarHBondContact O-N 3.49Å; W205-E266 WeakPolarHBondContact CZ3-OE1 3.47Å; W205-R325 PolarHBondContact NE1-O 3.19Å; W205-K326 HydrophobicContact CH2-CG 4.42Å; W205-K326 HydrophobicContact CZ2-CB 3.95Å; W205-K326 HydrophobicContact CZ2-CG 3.89Å; W205-P327 VanDerWaalsContact CE2-CD 3.42Å; W205-P327 VanDerWaalsContact CZ2-CD 3.46Å
206	I	88.9	Confident	88.5	Confident	3 Å²	3	21.2 Å²	21.2	2%	0.015	10%	0.101	C	C	.	.	H	α-helix	trans	-66.1	-40.1	179.5	-63.1	163.9	0	0	0	110.8	M154 M162 L165 F169 R202 A203 S204 Q208 V209 F210	M154-I206 HydrophobicContact CE-CB 4.5Å; M154-I206 HydrophobicContact CE-CG1 4.17Å; M154-I206 HydrophobicContact CE-CG2 3.68Å; M162-I206 HydrophobicContact CB-CG2 4.18Å; M162-I206 WeakPolarHBondContact O-CG2 3.4Å; L165-I206 HydrophobicContact CD2-CD1 3.87Å; L165-I206 HydrophobicContact CG-CD1 4Å; F169-I206 HydrophobicContact CD2-CD1 3.73Å; F169-I206 HydrophobicContact CE2-CD1 3.8Å; R202-I206 WeakPolarHBondContact O-CD1 3.48Å; R202-I206 VanDerWaalsContact O-CG1 3.23Å; R202-I206 WeakPolarHBondContact O-CG1 3.36Å; R202-I206 PolarHBondContact O-N 3.32Å; R202-I206 VanDerWaalsContact O-N 3.07Å; A203-I206 PolarHBondContact O-N 3.03Å; S204-I206 PolarHBondContact O-N 3.32Å; I206-Q208 PolarHBondContact O-N 3.45Å; I206-V209 PolarHBondContact O-N 2.89Å; I206-F210 WeakPolarHBondContact O-CB 3.29Å; I206-F210 PolarHBondContact O-N 3.26Å
207	A	90.6	Very high	88.1	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59	-45.6	177.5	0	0	0	0	0	111.6	S166 A203 S204 V209 F210 L211 L240 A243 L244	S166-A207 WeakPolarHBondContact OG-CB 3.39Å; A203-A207 WeakPolarHBondContact O-CB 3.47Å; A203-A207 PolarHBondContact O-N 3.46Å; S204-A207 PolarHBondContact O-N 3.46Å; A207-V209 PolarHBondContact O-N 3.11Å; A207-F210 PolarHBondContact O-N 3.23Å; A207-L211 VanDerWaalsContact O-CG 3.28Å; A207-L211 WeakPolarHBondContact O-CG 3.45Å; A207-L211 PolarHBondContact O-N 3.33Å; A207-L240 HydrophobicContact CB-CD2 4.27Å; A207-A243 HydrophobicContact CB-CB 4.25Å; A207-L244 HydrophobicContact CB-CD2 3.94Å; A207-L244 HydrophobicContact CB-CG 4.35Å
208	Q	89.9	Confident	87.5	Confident	9 Å²	9	26.2 Å²	26.2	4%	0.042	13%	0.132	C	C	.	.	H	α-helix	trans	-62.3	-44.5	179.8	-67	166.6	36.9	0	0	112	S204 W205 I206 Q212 L244 T270 P327	S204-Q208 VanDerWaalsContact O-CG 3.27Å; S204-Q208 WeakPolarHBondContact O-CG 3.39Å; S204-Q208 PolarHBondContact O-N 3.39Å; S204-Q208 PolarHBondContact O-NE2 3.48Å; S204-Q208 PolarHBondContact OG-NE2 3.32Å; W205-Q208 PolarHBondContact O-N 3.26Å; I206-Q208 PolarHBondContact O-N 3.45Å; Q208-Q212 WeakPolarHBondContact O-CG 3.29Å; Q208-Q212 PolarHBondContact O-N 3.39Å; Q208-L244 HydrophobicContact CG-CD2 3.69Å; Q208-T270 HydrophobicContact CG-CG2 4.4Å; Q208-P327 HydrophobicContact CB-CB 4.08Å
209	V	88.8	Confident	86.7	Confident	7 Å²	7	27 Å²	27	4%	0.042	13%	0.134	C	C	.	.	H	α-helix	trans	-63.7	-44.3	176.5	175.7	0	0	0	0	110.9	M162 W205 I206 A207 Q212 E213 R325 P327	M162-V209 HydrophobicContact SD-CG1 4.38Å; W205-V209 WeakPolarHBondContact O-CG2 3.4Å; W205-V209 PolarHBondContact O-N 3.49Å; I206-V209 PolarHBondContact O-N 2.89Å; A207-V209 PolarHBondContact O-N 3.11Å; V209-Q212 PolarHBondContact O-N 3.48Å; V209-E213 HydrophobicContact CG1-CG 4.33Å; V209-E213 VanDerWaalsContact O-CG 3.31Å; V209-E213 WeakPolarHBondContact O-CG 3.43Å; V209-E213 PolarHBondContact O-N 2.96Å; V209-R325 WeakPolarHBondContact CG2-O 3.45Å; V209-P327 HydrophobicContact CG2-CB 4.13Å
210	F	89.6	Confident	85.4	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.7	-51.1	177.8	163.8	-108.1	0	0	0	111.8	L159 M162 R163 I206 A207 Q212 E213 L214 Y234 L240	L159-F210 HydrophobicContact CB-CD2 4.47Å; L159-F210 HydrophobicContact CB-CE2 4.35Å; L159-F210 VanDerWaalsContact O-CD2 3.28Å; L159-F210 WeakPolarHBondContact O-CD2 3.5Å; L159-F210 WeakPolarHBondContact O-CE2 3.11Å; M162-F210 HydrophobicContact CB-CB 4.03Å; M162-F210 HydrophobicContact CB-CD2 4.28Å; R163-F210 HydrophobicContact CB-CD1 4.3Å; R163-F210 HydrophobicContact CB-CD2 4.13Å; R163-F210 HydrophobicContact CB-CE1 4.04Å; R163-F210 HydrophobicContact CB-CE2 3.85Å; R163-F210 HydrophobicContact CB-CG 4.35Å; R163-F210 HydrophobicContact CB-CZ 3.81Å; R163-F210 HydrophobicContact CG-CE1 4.22Å; R163-F210 HydrophobicContact CG-CZ 4.21Å; I206-F210 WeakPolarHBondContact O-CB 3.29Å; I206-F210 PolarHBondContact O-N 3.26Å; A207-F210 PolarHBondContact O-N 3.23Å; F210-Q212 VanDerWaalsContact C-N 3.34Å; F210-Q212 PolarHBondContact O-N 3.24Å; F210-E213 PolarHBondContact O-N 3.45Å; F210-L214 HydrophobicContact CE1-CD2 4.3Å; F210-L214 HydrophobicContact CZ-CD2 3.91Å; F210-L214 WeakPolarHBondContact O-CB 3.27Å; F210-L214 PolarHBondContact O-N 2.93Å; F210-Y234 HydrophobicContact CE1-CE1 4.47Å; F210-L240 HydrophobicContact CD1-CD1 4.37Å; F210-L240 HydrophobicContact CD1-CD2 4.43Å; F210-L240 HydrophobicContact CE1-CD1 3.91Å
211	L	89.6	Confident	83.6	Confident	5 Å²	5	34.8 Å²	34.8	3%	0.026	18%	0.178	C	C	.	.	H	α-helix	trans	-62.9	-39.9	-176.9	-67.6	169.1	0	0	0	112	A207 E215 Y234 L236 L244 A275 T276	A207-L211 VanDerWaalsContact O-CG 3.28Å; A207-L211 WeakPolarHBondContact O-CG 3.45Å; A207-L211 PolarHBondContact O-N 3.33Å; L211-E215 PolarHBondContact O-N 3.41Å; L211-E215 VanDerWaalsContact O-N 3.14Å; L211-Y234 HydrophobicContact CD2-CD1 4.42Å; L211-Y234 HydrophobicContact CD2-CE1 3.98Å; L211-L236 HydrophobicContact CD1-CD1 3.99Å; L211-L236 HydrophobicContact CD2-CD1 4.24Å; L211-L244 HydrophobicContact CD1-CD1 4.27Å; L211-A275 HydrophobicContact CD2-CB 4.17Å; L211-T276 HydrophobicContact CD1-CG2 3.59Å
212	Q	88.9	Confident	81.8	Confident	11 Å²	11	37.1 Å²	37.1	5%	0.051	20%	0.196	C	C	.	.	H	α-helix	trans	-66.4	-42.7	176.8	-72.6	-178.7	-11.8	0	0	112.6	Q208 V209 F210 E215 K216 V271 T273 H328	Q208-Q212 WeakPolarHBondContact O-CG 3.29Å; Q208-Q212 PolarHBondContact O-N 3.39Å; V209-Q212 PolarHBondContact O-N 3.48Å; F210-Q212 VanDerWaalsContact C-N 3.34Å; F210-Q212 PolarHBondContact O-N 3.24Å; Q212-E215 PolarHBondContact O-N 3.47Å; Q212-K216 WeakPolarHBondContact O-CG 3.4Å; Q212-K216 PolarHBondContact O-N 3.37Å; Q212-K216 VanDerWaalsContact O-N 3.13Å; Q212-V271 PolarHBondContact NE2-O 2.55Å; Q212-T273 HydrophobicContact CB-CG2 4.48Å; Q212-T273 HydrophobicContact CG-CG2 3.91Å; Q212-H328 PolarHBondContact NE2-O 2.96Å; Q212-H328 PolarHBondContact OE1-ND1 2.96Å; Q212-H328 VanDerWaalsContact OE1-ND1 3.14Å
213	E	85.9	Confident	79.6	Confident	26 Å²	26	38.3 Å²	38.3	12%	0.121	22%	0.216	C	C	.	.	H	α-helix	trans	-73.9	-30.6	-180	-62.8	-72.1	120.4	0	0	111.9	L159 V209 F210 K216 T217 R325 H328	L159-E213 HydrophobicContact CD2-CB 3.48Å; L159-E213 VanDerWaalsContact CD2-CB 3.48Å; V209-E213 HydrophobicContact CG1-CG 4.33Å; V209-E213 VanDerWaalsContact O-CG 3.31Å; V209-E213 WeakPolarHBondContact O-CG 3.43Å; V209-E213 PolarHBondContact O-N 2.96Å; F210-E213 PolarHBondContact O-N 3.45Å; E213-K216 PolarHBondContact O-N 3.01Å; E213-K216 WeakPolarHBondContact OE1-CD 3.39Å; E213-K216 IonicContact OE1-NZ 2.84Å; E213-K216 PolarHBondContact OE1-NZ 3.27Å; E213-T217 WeakPolarHBondContact O-CG2 3.08Å; E213-T217 PolarHBondContact O-N 2.98Å; E213-T217 PolarHBondContact O-OG1 3.12Å; E213-R325 IonicContact OE1-CZ 3.3Å; E213-R325 IonicContact OE1-NH1 3.12Å; E213-R325 IonicContact OE1-NH2 3.73Å; E213-R325 PolarHBondContact OE1-NH2 3.38Å; E213-R325 IonicContact OE2-CZ 3.84Å; E213-R325 VanDerWaalsContact OE2-CZ 3.26Å; E213-R325 IonicContact OE2-NH1 2.69Å; E213-R325 PolarHBondContact OE2-NH1 3.49Å; E213-R325 IonicContact OE2-NH2 3.71Å; E213-R325 PolarHBondContact OE2-NH2 3.2Å; E213-H328 IonicContact OE1-CE1 3.26Å
214	L	86.3	Confident	77.3	Confident	8 Å²	8	48.4 Å²	48.4	4%	0.042	25%	0.254	C	S	.	.	H	α-helix	trans	-61.6	-44.6	171.2	-175.6	67.9	0	0	0	111.5	A22 E23 F210 T217 T218 Y234	A22-L214 HydrophobicContact CB-CD1 4.28Å; E23-L214 HydrophobicContact CG-CD1 4.19Å; F210-L214 HydrophobicContact CE1-CD2 4.3Å; F210-L214 HydrophobicContact CZ-CD2 3.91Å; F210-L214 WeakPolarHBondContact O-CB 3.27Å; F210-L214 PolarHBondContact O-N 2.93Å; L214-T217 WeakPolarHBondContact CA-OG1 3.49Å; L214-T217 PolarHBondContact O-N 3.44Å; L214-T217 PolarHBondContact O-OG1 3.31Å; L214-T218 WeakPolarHBondContact O-CB 3.42Å; L214-T218 PolarHBondContact O-N 3.4Å; L214-T218 PolarHBondContact O-OG1 3.27Å; L214-Y234 HydrophobicContact CD2-CD1 3.96Å; L214-Y234 HydrophobicContact CD2-CD2 3.76Å; L214-Y234 HydrophobicContact CD2-CE1 4.01Å; L214-Y234 HydrophobicContact CD2-CE2 3.8Å; L214-Y234 HydrophobicContact CD2-CG 3.84Å
215	E	84.9	Confident	74.6	Confident	46 Å²	46	56 Å²	56	22%	0.215	29%	0.287	C	S	.	.	H	α-helix	trans	-67.2	-40.8	178	-172.2	172.2	-129.3	0	0	112.2	L211 Q212 T217 T218 N219 T273 K274	L211-E215 PolarHBondContact O-N 3.41Å; L211-E215 VanDerWaalsContact O-N 3.14Å; Q212-E215 PolarHBondContact O-N 3.47Å; E215-T217 VanDerWaalsContact C-N 3.35Å; E215-T217 PolarHBondContact O-N 2.91Å; E215-T218 PolarHBondContact O-N 3.46Å; E215-N219 WeakPolarHBondContact O-CB 3.49Å; E215-N219 VanDerWaalsContact O-CG 3.32Å; E215-N219 PolarHBondContact O-N 2.91Å; E215-N219 PolarHBondContact O-ND2 3.32Å; E215-T273 HydrophobicContact CB-CG2 4.47Å; E215-T273 VanDerWaalsContact OE2-CA 3.28Å; E215-T273 WeakPolarHBondContact OE2-CA 3.38Å; E215-T273 VanDerWaalsContact OE2-CB 3.28Å; E215-T273 WeakPolarHBondContact OE2-CB 3.19Å; E215-T273 WeakPolarHBondContact OE2-CG2 3.12Å; E215-K274 PolarHBondContact OE1-N 2.91Å
216	K	84.1	Confident	71.9	Confident	77 Å²	77	61.5 Å²	61.5	34%	0.335	32%	0.319	S	S	.	.	H	α-helix	trans	-59.6	-43.3	175.1	-72.7	174.1	-170.8	175.8	0	112.4	Q212 E213 N220 H328	Q212-K216 WeakPolarHBondContact O-CG 3.4Å; Q212-K216 PolarHBondContact O-N 3.37Å; Q212-K216 VanDerWaalsContact O-N 3.13Å; E213-K216 PolarHBondContact O-N 3.01Å; E213-K216 WeakPolarHBondContact OE1-CD 3.39Å; E213-K216 IonicContact OE1-NZ 2.84Å; E213-K216 PolarHBondContact OE1-NZ 3.27Å; K216-N220 WeakPolarHBondContact O-CB 3.4Å; K216-N220 VanDerWaalsContact O-CG 3.3Å; K216-N220 PolarHBondContact O-N 3.19Å; K216-N220 VanDerWaalsContact O-N 3.16Å; K216-N220 PolarHBondContact O-ND2 3.31Å; K216-H328 PolarHBondContact NZ-CE1 3.38Å; K216-H328 PolarHBondContact NZ-ND1 3.14Å; K216-H328 PolarHBondContact NZ-NE2 3.42Å; K216-H328 VanDerWaalsContact NZ-NE2 3.12Å
217	T	79.2	Confident	69.3	Low	65 Å²	65	70.6 Å²	70.6	40%	0.399	36%	0.359	S	S	.	.	H	α-helix	trans	-69.8	-39.6	179.1	49	0	0	0	0	112	L159 E213 L214 E215 N220 S221	L159-T217 HydrophobicContact CD1-CG2 3.81Å; L159-T217 WeakPolarHBondContact CD1-OG1 3.44Å; E213-T217 WeakPolarHBondContact O-CG2 3.08Å; E213-T217 PolarHBondContact O-N 2.98Å; E213-T217 PolarHBondContact O-OG1 3.12Å; L214-T217 WeakPolarHBondContact CA-OG1 3.49Å; L214-T217 PolarHBondContact O-N 3.44Å; L214-T217 PolarHBondContact O-OG1 3.31Å; E215-T217 VanDerWaalsContact C-N 3.35Å; E215-T217 PolarHBondContact O-N 2.91Å; T217-N220 PolarHBondContact O-N 3.49Å; T217-S221 PolarHBondContact O-N 3.13Å
218	T	74.1	Confident	66.3	Low	54 Å²	54	74.5 Å²	74.5	33%	0.331	40%	0.399	S	S	.	.	H	α-helix	trans	-60.2	-50.4	174.8	-54.6	0	0	0	0	111.1	L214 E215 N220 S221 T222	L214-T218 WeakPolarHBondContact O-CB 3.42Å; L214-T218 PolarHBondContact O-N 3.4Å; L214-T218 PolarHBondContact O-OG1 3.27Å; E215-T218 PolarHBondContact O-N 3.46Å; T218-N220 PolarHBondContact O-N 3.22Å; T218-S221 PolarHBondContact O-N 3.22Å; T218-S221 PolarHBondContact O-OG 3.2Å; T218-T222 PolarHBondContact O-N 2.91Å; T218-T222 PolarHBondContact O-OG1 2.73Å
219	N	71.8	Confident	63.2	Low	84 Å²	84	79.1 Å²	79.1	45%	0.449	43%	0.431	S	S	.	.	H	α-helix	trans	-63.8	-35.6	-179.1	-73.1	-23.4	0	0	0	113.5	E215 T222	E215-N219 WeakPolarHBondContact O-CB 3.49Å; E215-N219 VanDerWaalsContact O-CG 3.32Å; E215-N219 PolarHBondContact O-N 2.91Å; E215-N219 PolarHBondContact O-ND2 3.32Å; N219-T222 WeakPolarHBondContact CA-OG1 3.47Å; N219-T222 PolarHBondContact O-OG1 3.26Å
220	N	62.7	Low	60.3	Low	117 Å²	117	87.4 Å²	87.4	63%	0.626	47%	0.469	S	S	*	.	H	α-helix	trans	-71.9	-29.7	177.2	-76.6	-20.6	0	0	0	113	K216 T217 T218	K216-N220 WeakPolarHBondContact O-CB 3.4Å; K216-N220 VanDerWaalsContact O-CG 3.3Å; K216-N220 PolarHBondContact O-N 3.19Å; K216-N220 VanDerWaalsContact O-N 3.16Å; K216-N220 PolarHBondContact O-ND2 3.31Å; T217-N220 PolarHBondContact O-N 3.49Å; T218-N220 PolarHBondContact O-N 3.22Å
221	S	54.9	Low	57.7	Low	49 Å²	49	93.9 Å²	93.9	34%	0.343	50%	0.503	S	S	.	.	H	α-helix	trans	-73.2	-33.5	178.4	76.9	0	0	0	0	112.7	T217 T218 S223 R224	T217-S221 PolarHBondContact O-N 3.13Å; T218-S221 PolarHBondContact O-N 3.22Å; T218-S221 PolarHBondContact O-OG 3.2Å; S221-S223 VanDerWaalsContact C-N 3.26Å; S221-S223 PolarHBondContact O-N 3.4Å; S221-R224 PolarHBondContact O-N 3.46Å
222	T	49.4	Very low	55.7	Low	90 Å²	90	100.7 Å²	100.7	55%	0.552	54%	0.539	S	S	*	.	H	α-helix	trans	-69.4	-18.4	176.9	38.3	0	0	0	0	114	T218 N219 R224	T218-T222 PolarHBondContact O-N 2.91Å; T218-T222 PolarHBondContact O-OG1 2.73Å; N219-T222 WeakPolarHBondContact CA-OG1 3.47Å; N219-T222 PolarHBondContact O-OG1 3.26Å; T222-R224 PolarHBondContact O-N 3.02Å
223	S	42.6	Very low	54.2	Low	100 Å²	100	106 Å²	106	70%	0.699	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-11.7	175.5	119.4	0	0	0	0	113.4	S221	S221-S223 VanDerWaalsContact C-N 3.26Å; S221-S223 PolarHBondContact O-N 3.4Å
224	R	42.5	Very low	53.5	Low	213 Å²	213	107.1 Å²	107.1	80%	0.804	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	-7.9	-173.8	-68.6	-174.1	-171	171.7	4.1	115.6	S221 T222	S221-R224 PolarHBondContact O-N 3.46Å; T222-R224 PolarHBondContact O-N 3.02Å
225	H	33.4	Very low	53	Low	169 Å²	169	113.7 Å²	113.7	78%	0.782	60%	0.601	S	S	*	*			trans	-131.5	112.5	176.3	-80	-70.9	0	0	0	112.1
226	L	32.7	Very low	52.9	Low	158 Å²	158	112.8 Å²	112.8	83%	0.827	60%	0.598	S	S	*	*			trans	-70.1	133.7	171.7	-108.5	100.3	0	0	0	111.4
227	K	32.8	Very low	53	Low	195 Å²	195	111 Å²	111	85%	0.848	59%	0.593	S	S	*	*	S	Bend	trans	51.5	102.6	151.4	-66.5	-178.1	178	-179.5	0	117.1
228	G	27.2	Very low	53.4	Low	82 Å²	82	109.6 Å²	109.6	85%	0.845	58%	0.581	S	S	*	*			trans	156.5	7.5	156.3	0	0	0	0	0	119.2
229	C	26	Very low	54.2	Low	105 Å²	105	107.2 Å²	107.2	71%	0.709	57%	0.566	S	S	*	*			trans	-121.7	117.4	173.9	-137.2	0	0	0	0	108.7	L231	C229-L231 PolarHBondContact O-N 3Å
230	H	28.5	Very low	55.1	Low	181 Å²	181	103.2 Å²	103.2	84%	0.838	54%	0.544	S	S	*	.			trans	-55.2	128.8	172.4	-75.3	-89.9	0	0	0	108.9	L232	H230-L232 PolarHBondContact O-N 3.37Å; H230-L232 VanDerWaalsContact O-N 3.16Å
231	L	35.1	Very low	56.4	Low	137 Å²	137	100.5 Å²	100.5	72%	0.717	53%	0.528	S	S	*	.			trans	-61.9	113	173.2	-80	109.1	0	0	0	108.1	C229	C229-L231 PolarHBondContact O-N 3Å
232	L	45.8	Very low	58	Low	148 Å²	148	98.3 Å²	98.3	78%	0.775	51%	0.513	S	S	*	.			trans	-93.3	116	161.6	-83.3	150.2	0	0	0	106	H230 Y234	H230-L232 PolarHBondContact O-N 3.37Å; H230-L232 VanDerWaalsContact O-N 3.16Å; L232-Y234 PolarHBondContact O-N 3.13Å
233	D	59.3	Low	60.1	Low	122 Å²	122	94 Å²	94	65%	0.652	49%	0.487	S	S	*	.			trans	-62	132.9	175.5	-69.4	-43.4	0	0	0	109.3	E235	D233-E235 PolarHBondContact O-N 3.11Å; D233-E235 VanDerWaalsContact O-N 3.12Å
234	Y	69.9	Low	62.4	Low	50 Å²	50	89.4 Å²	89.4	20%	0.196	45%	0.454	C	S	.	.			trans	-68.2	109.9	175.1	-178.9	-89.9	0	0	0	108.8	E23 F210 L211 L214 L232 L240 A275	E23-Y234 WeakPolarHBondContact O-CD2 3.04Å; E23-Y234 WeakPolarHBondContact O-CE2 3.4Å; F210-Y234 HydrophobicContact CE1-CE1 4.47Å; L211-Y234 HydrophobicContact CD2-CD1 4.42Å; L211-Y234 HydrophobicContact CD2-CE1 3.98Å; L214-Y234 HydrophobicContact CD2-CD1 3.96Å; L214-Y234 HydrophobicContact CD2-CD2 3.76Å; L214-Y234 HydrophobicContact CD2-CE1 4.01Å; L214-Y234 HydrophobicContact CD2-CE2 3.8Å; L214-Y234 HydrophobicContact CD2-CG 3.84Å; L232-Y234 PolarHBondContact O-N 3.13Å; Y234-L240 HydrophobicContact CE1-CD1 4.41Å; Y234-L240 WeakPolarHBondContact OH-CD1 3.43Å; Y234-A275 HydrophobicContact CD1-CB 3.96Å
235	E	76.6	Confident	64.8	Low	146 Å²	146	81.9 Å²	81.9	68%	0.682	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-80.3	134.1	178.8	-167.9	178.1	-174.5	0	0	110.6	D233 T237	D233-E235 PolarHBondContact O-N 3.11Å; D233-E235 VanDerWaalsContact O-N 3.12Å; E235-T237 PolarHBondContact O-N 3.26Å
236	L	82.8	Confident	67.5	Low	27 Å²	27	74.7 Å²	74.7	14%	0.141	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-67.8	121.4	-179.8	-167.5	68.8	0	0	0	110	L211 L240 E241 L244 F279	L211-L236 HydrophobicContact CD1-CD1 3.99Å; L211-L236 HydrophobicContact CD2-CD1 4.24Å; L236-L240 HydrophobicContact CD1-CB 3.67Å; L236-L240 HydrophobicContact CD1-CD1 4.42Å; L236-L240 HydrophobicContact CG-CB 4.21Å; L236-E241 HydrophobicContact CD2-CB 3.74Å; L236-E241 HydrophobicContact CD2-CG 4.02Å; L236-E241 HydrophobicContact CG-CB 4.18Å; L236-L244 HydrophobicContact CD2-CD1 4.27Å; L236-F279 HydrophobicContact CD2-CB 4.44Å
237	T	85.8	Confident	70.1	Confident	40 Å²	40	67.3 Å²	67.3	25%	0.245	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-71.2	154.1	177.3	66.5	0	0	0	0	111.1	E167 E235 F239 L240 E241	E167-T237 PolarHBondContact OE1-OG1 3.01Å; E235-T237 PolarHBondContact O-N 3.26Å; T237-F239 VanDerWaalsContact C-N 3.26Å; T237-F239 PolarHBondContact O-N 2.93Å; T237-L240 PolarHBondContact O-N 3.44Å; T237-L240 WeakPolarHBondContact OG1-CD1 3.22Å; T237-L240 VanDerWaalsContact OG1-CG 3.3Å; T237-L240 WeakPolarHBondContact OG1-CG 3.47Å; T237-E241 PolarHBondContact O-N 3.13Å
238	Y	87.5	Confident	72.9	Confident	34 Å²	34	58.4 Å²	58.4	13%	0.133	32%	0.32	C	S	.	.	H	α-helix	trans	-50.5	-44.4	179.7	169.3	-97.8	0	0	0	113.1	I85 K86 E241 A242	I85-Y238 HydrophobicContact CG2-CD1 3.5Å; I85-Y238 VanDerWaalsContact CG2-CD1 3.5Å; I85-Y238 HydrophobicContact CG2-CD2 4.42Å; I85-Y238 HydrophobicContact CG2-CE1 3.6Å; I85-Y238 HydrophobicContact CG2-CE2 4.5Å; I85-Y238 HydrophobicContact CG2-CG 3.93Å; K86-Y238 HydrophobicContact CB-CE2 4.36Å; Y238-E241 PolarHBondContact O-N 3.47Å; Y238-A242 VanDerWaalsContact O-CB 3.27Å; Y238-A242 WeakPolarHBondContact O-CB 3.27Å; Y238-A242 PolarHBondContact O-N 3.45Å
239	F	90.6	Very high	75.9	Confident	4 Å²	4	56.6 Å²	56.6	2%	0.018	29%	0.292	C	S	.	.	H	α-helix	trans	-71.5	-33.4	-178.6	-66.6	-66.2	0	0	0	112.6	L78 K129 Y132 V133 E167 V170 I171 T237 A242 A243	L78-F239 HydrophobicContact CD1-CE2 4.01Å; L78-F239 HydrophobicContact CD2-CE2 4.29Å; K129-F239 HydrophobicContact CD-CD2 4.48Å; K129-F239 HydrophobicContact CD-CE2 4.23Å; K129-F239 HydrophobicContact CG-CE2 4.24Å; Y132-F239 AromaticContact CD1-CE1 3.81Å; Y132-F239 HydrophobicContact CD1-CE1 3.81Å; Y132-F239 AromaticContact CD1-CZ 3.87Å; Y132-F239 HydrophobicContact CD1-CZ 3.87Å; Y132-F239 AromaticContact CE1-CE1 3.56Å; Y132-F239 HydrophobicContact CE1-CE1 3.56Å; Y132-F239 AromaticContact CE1-CZ 3.93Å; Y132-F239 HydrophobicContact CE1-CZ 3.93Å; V133-F239 HydrophobicContact CG2-CZ 4.35Å; E167-F239 HydrophobicContact CB-CB 4.27Å; E167-F239 HydrophobicContact CG-CB 3.81Å; V170-F239 HydrophobicContact CG1-CB 4.21Å; V170-F239 HydrophobicContact CG1-CD1 4.4Å; I171-F239 HydrophobicContact CD1-CD1 3.92Å; I171-F239 HydrophobicContact CD1-CD2 4.46Å; I171-F239 HydrophobicContact CD1-CE1 3.88Å; I171-F239 HydrophobicContact CD1-CE2 4.42Å; I171-F239 HydrophobicContact CD1-CG 4.22Å; I171-F239 HydrophobicContact CD1-CZ 4.14Å; I171-F239 HydrophobicContact CG1-CD1 3.56Å; I171-F239 HydrophobicContact CG1-CE1 3.55Å; I171-F239 HydrophobicContact CG1-CG 4.29Å; I171-F239 HydrophobicContact CG1-CZ 4.28Å; T237-F239 VanDerWaalsContact C-N 3.26Å; T237-F239 PolarHBondContact O-N 2.93Å; F239-A242 PolarHBondContact O-N 3.43Å; F239-A243 VanDerWaalsContact O-CB 3.3Å; F239-A243 WeakPolarHBondContact O-CB 3.26Å; F239-A243 PolarHBondContact O-N 2.91Å
240	L	90.1	Very high	78.9	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-70.2	-39.4	173.5	-69.6	174.7	0	0	0	111.5	R163 E167 A207 F210 Y234 L236 T237 A243 L244	R163-L240 HydrophobicContact CG-CD1 4.3Å; R163-L240 HydrophobicContact CG-CD2 4.37Å; E167-L240 HydrophobicContact CG-CD2 4.3Å; E167-L240 HydrophobicContact CG-CG 4.49Å; A207-L240 HydrophobicContact CB-CD2 4.27Å; F210-L240 HydrophobicContact CD1-CD1 4.37Å; F210-L240 HydrophobicContact CD1-CD2 4.43Å; F210-L240 HydrophobicContact CE1-CD1 3.91Å; Y234-L240 HydrophobicContact CE1-CD1 4.41Å; Y234-L240 WeakPolarHBondContact OH-CD1 3.43Å; L236-L240 HydrophobicContact CD1-CB 3.67Å; L236-L240 HydrophobicContact CD1-CD1 4.42Å; L236-L240 HydrophobicContact CG-CB 4.21Å; T237-L240 PolarHBondContact O-N 3.44Å; T237-L240 WeakPolarHBondContact OG1-CD1 3.22Å; T237-L240 VanDerWaalsContact OG1-CG 3.3Å; T237-L240 WeakPolarHBondContact OG1-CG 3.47Å; L240-A243 WeakPolarHBondContact O-CB 3.5Å; L240-A243 PolarHBondContact O-N 3.22Å; L240-L244 WeakPolarHBondContact O-CG 3.5Å; L240-L244 PolarHBondContact O-N 3.03Å; L240-L244 VanDerWaalsContact O-N 3.13Å
241	E	89.9	Confident	81.7	Confident	60 Å²	60	45.8 Å²	45.8	28%	0.28	23%	0.231	S	C	.	.	H	α-helix	trans	-62.2	-46.4	171.9	-167	-171.9	164.1	0	0	111.1	L236 T237 Y238 A243 L244 Q245 F279	L236-E241 HydrophobicContact CD2-CB 3.74Å; L236-E241 HydrophobicContact CD2-CG 4.02Å; L236-E241 HydrophobicContact CG-CB 4.18Å; T237-E241 PolarHBondContact O-N 3.13Å; Y238-E241 PolarHBondContact O-N 3.47Å; E241-A243 VanDerWaalsContact C-N 3.3Å; E241-A243 PolarHBondContact O-N 2.99Å; E241-L244 PolarHBondContact O-N 3.25Å; E241-Q245 WeakPolarHBondContact O-CG 3.4Å; E241-Q245 PolarHBondContact O-N 3.42Å; E241-Q245 VanDerWaalsContact O-N 3.1Å; E241-F279 HydrophobicContact CG-CD2 4.02Å; E241-F279 HydrophobicContact CG-CE2 4.25Å
242	A	90	Very high	84.2	Confident	3 Å²	3	41.6 Å²	41.6	3%	0.025	21%	0.209	C	C	.	.	H	α-helix	trans	-58	-40.9	173.6	0	0	0	0	0	111.8	V170 L174 Y238 F239 L244 Q245 S246	V170-A242 HydrophobicContact CG2-CB 3.91Å; L174-A242 HydrophobicContact CD1-CB 4.45Å; Y238-A242 VanDerWaalsContact O-CB 3.27Å; Y238-A242 WeakPolarHBondContact O-CB 3.27Å; Y238-A242 PolarHBondContact O-N 3.45Å; F239-A242 PolarHBondContact O-N 3.43Å; A242-L244 VanDerWaalsContact C-N 3.32Å; A242-L244 PolarHBondContact O-N 2.92Å; A242-Q245 PolarHBondContact O-N 3.21Å; A242-S246 VanDerWaalsContact O-CB 3.23Å; A242-S246 WeakPolarHBondContact O-CB 3.36Å; A242-S246 PolarHBondContact O-N 3.47Å; A242-S246 PolarHBondContact O-OG 3.4Å
243	A	92	Very high	86.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.3	-40.2	178.9	0	0	0	0	0	111.6	V170 A203 S204 A207 F239 L240 E241	V170-A243 HydrophobicContact CB-CB 4.08Å; V170-A243 HydrophobicContact CG1-CB 4.3Å; V170-A243 HydrophobicContact CG2-CB 4.35Å; A203-A243 HydrophobicContact CB-CB 3.88Å; S204-A243 WeakPolarHBondContact CA-O 3.37Å; S204-A243 VanDerWaalsContact CB-O 3.27Å; S204-A243 WeakPolarHBondContact CB-O 3.45Å; S204-A243 PolarHBondContact N-O 3.49Å; A207-A243 HydrophobicContact CB-CB 4.25Å; F239-A243 VanDerWaalsContact O-CB 3.3Å; F239-A243 WeakPolarHBondContact O-CB 3.26Å; F239-A243 PolarHBondContact O-N 2.91Å; L240-A243 WeakPolarHBondContact O-CB 3.5Å; L240-A243 PolarHBondContact O-N 3.22Å; E241-A243 VanDerWaalsContact C-N 3.3Å; E241-A243 PolarHBondContact O-N 2.99Å
244	L	91.5	Very high	87.3	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-72.4	-32.8	178.4	-65	174.3	0	0	0	113	A207 Q208 L211 L236 L240 E241 A242 Y248 F279	A207-L244 HydrophobicContact CB-CD2 3.94Å; A207-L244 HydrophobicContact CB-CG 4.35Å; Q208-L244 HydrophobicContact CG-CD2 3.69Å; L211-L244 HydrophobicContact CD1-CD1 4.27Å; L236-L244 HydrophobicContact CD2-CD1 4.27Å; L240-L244 WeakPolarHBondContact O-CG 3.5Å; L240-L244 PolarHBondContact O-N 3.03Å; L240-L244 VanDerWaalsContact O-N 3.13Å; E241-L244 PolarHBondContact O-N 3.25Å; A242-L244 VanDerWaalsContact C-N 3.32Å; A242-L244 PolarHBondContact O-N 2.92Å; L244-Y248 WeakPolarHBondContact O-CE1 3.26Å; L244-F279 HydrophobicContact CB-CD1 4.46Å; L244-F279 HydrophobicContact CB-CE1 3.8Å; L244-F279 HydrophobicContact CB-CE2 3.9Å; L244-F279 HydrophobicContact CB-CZ 3.45Å; L244-F279 VanDerWaalsContact CB-CZ 3.45Å; L244-F279 HydrophobicContact CD1-CD1 4.16Å; L244-F279 HydrophobicContact CD1-CE1 4.29Å; L244-F279 HydrophobicContact CD1-CG 4.33Å
245	Q	92.3	Very high	87.9	Confident	56 Å²	56	42.3 Å²	42.3	26%	0.262	22%	0.216	S	C	.	.	H	α-helix	trans	-96.3	-30.4	-174	70.2	-170.2	-39.4	0	0	116.8	E241 A242 A247 Y248 V249 F279	E241-Q245 WeakPolarHBondContact O-CG 3.4Å; E241-Q245 PolarHBondContact O-N 3.42Å; E241-Q245 VanDerWaalsContact O-N 3.1Å; A242-Q245 PolarHBondContact O-N 3.21Å; Q245-A247 VanDerWaalsContact C-N 3.32Å; Q245-A247 PolarHBondContact O-N 3.4Å; Q245-Y248 HydrophobicContact CB-CE1 3.94Å; Q245-Y248 WeakPolarHBondContact CB-OH 3.43Å; Q245-Y248 PolarHBondContact O-N 2.85Å; Q245-V249 HydrophobicContact CB-CG2 4.32Å; Q245-V249 WeakPolarHBondContact O-CB 3.36Å; Q245-V249 VanDerWaalsContact O-CG2 3.29Å; Q245-V249 WeakPolarHBondContact O-CG2 3.42Å; Q245-V249 PolarHBondContact O-N 3.44Å; Q245-V249 VanDerWaalsContact O-N 3.11Å; Q245-F279 HydrophobicContact CB-CE2 3.99Å; Q245-F279 HydrophobicContact CB-CZ 4.11Å
246	S	90.9	Very high	88.3	Confident	17 Å²	17	38.7 Å²	38.7	12%	0.119	20%	0.202	C	C	.	.	H	α-helix	trans	-64.8	-33.7	-163.6	-61.3	0	0	0	0	113.5	A242 K250	A242-S246 VanDerWaalsContact O-CB 3.23Å; A242-S246 WeakPolarHBondContact O-CB 3.36Å; A242-S246 PolarHBondContact O-N 3.47Å; A242-S246 PolarHBondContact O-OG 3.4Å; S246-K250 WeakPolarHBondContact O-CB 3.49Å; S246-K250 PolarHBondContact O-N 3.42Å
247	A	88.6	Confident	88.4	Confident	4 Å²	4	40 Å²	40	3%	0.033	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-59.3	178.8	0	0	0	0	0	111.4	F200 E201 Q245 V249 K250 N251	F200-A247 HydrophobicContact CB-CB 3.78Å; E201-A247 HydrophobicContact CG-CB 4.49Å; Q245-A247 VanDerWaalsContact C-N 3.32Å; Q245-A247 PolarHBondContact O-N 3.4Å; A247-V249 PolarHBondContact O-N 3.23Å; A247-K250 PolarHBondContact O-N 2.89Å; A247-N251 PolarHBondContact O-N 3.27Å; A247-N251 VanDerWaalsContact O-N 3.09Å; A247-N251 PolarHBondContact O-ND2 2.86Å
248	Y	90.2	Very high	88.4	Confident	7 Å²	7	39 Å²	39	3%	0.027	20%	0.202	C	C	.	.	H	α-helix	trans	-69.4	-37.8	-175.2	70.2	-107.9	0	0	0	111.9	L244 Q245 K250 N251 L252 G260 E263 L264 F279	L244-Y248 WeakPolarHBondContact O-CE1 3.26Å; Q245-Y248 HydrophobicContact CB-CE1 3.94Å; Q245-Y248 WeakPolarHBondContact CB-OH 3.43Å; Q245-Y248 PolarHBondContact O-N 2.85Å; Y248-K250 VanDerWaalsContact C-N 3.27Å; Y248-K250 PolarHBondContact O-N 2.66Å; Y248-N251 PolarHBondContact O-N 2.68Å; Y248-L252 HydrophobicContact CD2-CD1 4.24Å; Y248-L252 WeakPolarHBondContact O-CB 3.33Å; Y248-L252 VanDerWaalsContact O-CG 3.25Å; Y248-L252 WeakPolarHBondContact O-CG 3.27Å; Y248-L252 PolarHBondContact O-N 3.25Å; Y248-G260 WeakPolarHBondContact CB-O 3.2Å; Y248-E263 WeakPolarHBondContact CA-OE2 3.4Å; Y248-E263 PolarHBondContact N-OE2 2.67Å; Y248-L264 HydrophobicContact CD1-CD2 4.02Å; Y248-L264 HydrophobicContact CD1-CG 4.01Å; Y248-L264 HydrophobicContact CD2-CD1 3.9Å; Y248-L264 HydrophobicContact CD2-CD2 3.85Å; Y248-L264 HydrophobicContact CD2-CG 3.71Å; Y248-L264 HydrophobicContact CE1-CD2 3.93Å; Y248-L264 HydrophobicContact CE1-CG 4.43Å; Y248-L264 HydrophobicContact CE2-CD1 4.49Å; Y248-L264 HydrophobicContact CE2-CD2 3.83Å; Y248-L264 HydrophobicContact CE2-CG 4.24Å; Y248-L264 HydrophobicContact CG-CD1 4.22Å; Y248-L264 HydrophobicContact CG-CD2 3.99Å; Y248-L264 HydrophobicContact CG-CG 3.63Å; Y248-F279 HydrophobicContact CE1-CZ 4.13Å
249	V	90.4	Very high	88.2	Confident	44 Å²	44	40.3 Å²	40.3	27%	0.267	21%	0.208	S	C	.	.	H	α-helix	trans	-60.8	-40.6	177.2	172.1	0	0	0	0	110.5	Q245 A247 K253	Q245-V249 HydrophobicContact CB-CG2 4.32Å; Q245-V249 WeakPolarHBondContact O-CB 3.36Å; Q245-V249 VanDerWaalsContact O-CG2 3.29Å; Q245-V249 WeakPolarHBondContact O-CG2 3.42Å; Q245-V249 PolarHBondContact O-N 3.44Å; Q245-V249 VanDerWaalsContact O-N 3.11Å; A247-V249 PolarHBondContact O-N 3.23Å; V249-K253 HydrophobicContact CG1-CD 4.06Å; V249-K253 HydrophobicContact CG1-CG 4.5Å; V249-K253 WeakPolarHBondContact O-CB 3.33Å; V249-K253 VanDerWaalsContact O-CG 3.31Å; V249-K253 WeakPolarHBondContact O-CG 3.42Å; V249-K253 PolarHBondContact O-N 2.9Å
250	K	88.8	Confident	88	Confident	58 Å²	58	40.1 Å²	40.1	25%	0.252	21%	0.207	S	C	.	.	H	α-helix	trans	-66.4	-45.9	178.5	-174.9	62.1	169.3	-155	0	111.8	E177 I197 S246 A247 Y248 K253 K254	E177-K250 VanDerWaalsContact OE1-CD 3.3Å; E177-K250 WeakPolarHBondContact OE1-CD 3.15Å; E177-K250 VanDerWaalsContact OE1-CE 3.24Å; E177-K250 WeakPolarHBondContact OE1-CE 3.46Å; E177-K250 IonicContact OE1-NZ 2.76Å; E177-K250 PolarHBondContact OE1-NZ 3Å; I197-K250 HydrophobicContact CG1-CG 4.24Å; S246-K250 WeakPolarHBondContact O-CB 3.49Å; S246-K250 PolarHBondContact O-N 3.42Å; A247-K250 PolarHBondContact O-N 2.89Å; Y248-K250 VanDerWaalsContact C-N 3.27Å; Y248-K250 PolarHBondContact O-N 2.66Å; K250-K253 PolarHBondContact O-N 2.98Å; K250-K254 WeakPolarHBondContact O-CB 3.28Å; K250-K254 PolarHBondContact O-N 3.33Å
251	N	87.7	Confident	87.9	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.011	21%	0.207	C	C	.	.	H	α-helix	trans	-63.4	-42.1	178.7	-77.6	-49.6	0	0	0	112.3	A247 Y248 K254 G255 N256 K259 E263	A247-N251 PolarHBondContact O-N 3.27Å; A247-N251 VanDerWaalsContact O-N 3.09Å; A247-N251 PolarHBondContact O-ND2 2.86Å; Y248-N251 PolarHBondContact O-N 2.68Å; N251-K254 PolarHBondContact O-N 2.9Å; N251-G255 PolarHBondContact O-N 3.04Å; N251-N256 PolarHBondContact O-N 3.3Å; N251-K259 HydrophobicContact CB-CB 4.47Å; N251-E263 PolarHBondContact ND2-OE1 2.87Å; N251-E263 PolarHBondContact ND2-OE2 2.68Å
252	L	87.7	Confident	87.7	Confident	49 Å²	49	41 Å²	41	26%	0.257	21%	0.208	S	C	.	.	H	α-helix	trans	-63.8	-44.6	175.4	-68	177	0	0	0	112	Y248 K254 G255 L264 V290	Y248-L252 HydrophobicContact CD2-CD1 4.24Å; Y248-L252 WeakPolarHBondContact O-CB 3.33Å; Y248-L252 VanDerWaalsContact O-CG 3.25Å; Y248-L252 WeakPolarHBondContact O-CG 3.27Å; Y248-L252 PolarHBondContact O-N 3.25Å; L252-K254 PolarHBondContact O-N 3.21Å; L252-G255 PolarHBondContact O-N 2.98Å; L252-L264 HydrophobicContact CD1-CD1 3.92Å; L252-V290 HydrophobicContact CD1-CG2 4.1Å; L252-V290 HydrophobicContact CD2-CG1 4.39Å; L252-V290 HydrophobicContact CD2-CG2 4.33Å
253	K	86.9	Confident	87.6	Confident	174 Å²	174	41.7 Å²	41.7	76%	0.757	21%	0.211	S	C	*	.	H	α-helix	trans	-62.2	-29.6	176	-76.9	178.1	179.8	177.6	0	113.4	V249 K250 G255	V249-K253 HydrophobicContact CG1-CD 4.06Å; V249-K253 HydrophobicContact CG1-CG 4.5Å; V249-K253 WeakPolarHBondContact O-CB 3.33Å; V249-K253 VanDerWaalsContact O-CG 3.31Å; V249-K253 WeakPolarHBondContact O-CG 3.42Å; V249-K253 PolarHBondContact O-N 2.9Å; K250-K253 PolarHBondContact O-N 2.98Å; K253-G255 VanDerWaalsContact C-N 3.26Å
254	K	83.6	Confident	87.5	Confident	108 Å²	108	41.7 Å²	41.7	47%	0.47	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-11.2	175.9	-172.9	166.6	176.4	165.2	0	112.8	E193 K250 N251 L252 N256	E193-K254 IonicContact OE2-NZ 2.87Å; E193-K254 PolarHBondContact OE2-NZ 3.06Å; K250-K254 WeakPolarHBondContact O-CB 3.28Å; K250-K254 PolarHBondContact O-N 3.33Å; N251-K254 PolarHBondContact O-N 2.9Å; L252-K254 PolarHBondContact O-N 3.21Å; K254-N256 VanDerWaalsContact C-N 3.34Å
255	G	81.8	Confident	87.5	Confident	53 Å²	53	42 Å²	42	55%	0.546	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	83	7.3	-173.1	0	0	0	0	0	113.9	N251 L252 K253 I257	N251-G255 PolarHBondContact O-N 3.04Å; L252-G255 PolarHBondContact O-N 2.98Å; K253-G255 VanDerWaalsContact C-N 3.26Å; G255-I257 VanDerWaalsContact C-N 3.27Å; G255-I257 PolarHBondContact O-N 3.5Å
256	N	85.1	Confident	87.3	Confident	70 Å²	70	42.6 Å²	42.6	37%	0.374	21%	0.214	S	C	.	.			trans	-84.4	74.3	172.1	-169.9	-8.9	0	0	0	109.9	N251 K254 V258 K259 G260	N251-N256 PolarHBondContact O-N 3.3Å; K254-N256 VanDerWaalsContact C-N 3.34Å; N256-V258 VanDerWaalsContact C-N 3.32Å; N256-V258 PolarHBondContact O-N 3.33Å; N256-K259 HydrophobicContact CB-CB 4.49Å; N256-K259 WeakPolarHBondContact ND2-CB 3.45Å; N256-K259 PolarHBondContact O-N 2.97Å; N256-K259 WeakPolarHBondContact OD1-CB 3.14Å; N256-K259 PolarHBondContact OD1-N 3.11Å; N256-G260 PolarHBondContact O-N 3.44Å; N256-G260 VanDerWaalsContact O-N 3.11Å
257	I	85.2	Confident	87.2	Confident	54 Å²	54	42 Å²	42	28%	0.277	21%	0.21	S	C	.	.	H	α-helix	trans	-61.4	-40.9	-174.5	-60.8	162	0	0	0	110.9	G255 K259 G260 M261 V290	G255-I257 VanDerWaalsContact C-N 3.27Å; G255-I257 PolarHBondContact O-N 3.5Å; I257-K259 PolarHBondContact O-N 3.45Å; I257-G260 PolarHBondContact O-N 3.11Å; I257-M261 HydrophobicContact CG2-CG 4.17Å; I257-M261 HydrophobicContact CG2-SD 3.82Å; I257-M261 WeakPolarHBondContact O-CB 3.26Å; I257-M261 VanDerWaalsContact O-CG 3.3Å; I257-M261 WeakPolarHBondContact O-CG 3.42Å; I257-M261 PolarHBondContact O-N 3.32Å; I257-V290 HydrophobicContact CG2-CG1 3.96Å
258	V	84.6	Confident	87.4	Confident	18 Å²	18	43.2 Å²	43.2	11%	0.109	22%	0.216	C	C	.	.	H	α-helix	trans	-63.7	-46.1	-176.8	176.8	0	0	0	0	111.9	N256 R262 W301 P307 F311	N256-V258 VanDerWaalsContact C-N 3.32Å; N256-V258 PolarHBondContact O-N 3.33Å; V258-R262 WeakPolarHBondContact O-CB 3.31Å; V258-R262 PolarHBondContact O-N 2.95Å; V258-W301 HydrophobicContact CB-CH2 4.2Å; V258-W301 HydrophobicContact CG1-CH2 3.9Å; V258-W301 HydrophobicContact CG1-CZ2 4.03Å; V258-W301 HydrophobicContact CG2-CH2 4.12Å; V258-W301 HydrophobicContact CG2-CZ3 4.29Å; V258-P307 HydrophobicContact CG1-CB 3.88Å; V258-P307 HydrophobicContact CG1-CG 4.09Å; V258-F311 HydrophobicContact CG2-CB 3.98Å; V258-F311 HydrophobicContact CG2-CD1 4.38Å; V258-F311 HydrophobicContact CG2-CG 4.16Å
259	K	83.3	Confident	87.4	Confident	62 Å²	62	46.7 Å²	46.7	27%	0.27	23%	0.229	S	C	.	.	H	α-helix	trans	-67.5	-44.7	177.7	-169.9	173.2	177.8	177.6	0	111.6	E201 N251 N256 I257 M261 R262 E263	E201-K259 WeakPolarHBondContact OE1-CE 3.34Å; E201-K259 IonicContact OE1-NZ 2.96Å; E201-K259 PolarHBondContact OE1-NZ 3.43Å; N251-K259 HydrophobicContact CB-CB 4.47Å; N256-K259 HydrophobicContact CB-CB 4.49Å; N256-K259 WeakPolarHBondContact ND2-CB 3.45Å; N256-K259 PolarHBondContact O-N 2.97Å; N256-K259 WeakPolarHBondContact OD1-CB 3.14Å; N256-K259 PolarHBondContact OD1-N 3.11Å; I257-K259 PolarHBondContact O-N 3.45Å; K259-M261 VanDerWaalsContact C-N 3.33Å; K259-M261 PolarHBondContact O-N 3.21Å; K259-R262 WeakPolarHBondContact O-CB 3.41Å; K259-R262 PolarHBondContact O-N 2.88Å; K259-E263 VanDerWaalsContact CE-OE1 3.23Å; K259-E263 WeakPolarHBondContact CE-OE1 3.24Å; K259-E263 WeakPolarHBondContact O-CG 3.44Å; K259-E263 PolarHBondContact O-N 3.21Å; K259-E263 VanDerWaalsContact O-N 3.08Å
260	G	87.3	Confident	87.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.8	-39.9	177.4	0	0	0	0	0	113	Y248 N256 I257 L264	Y248-G260 WeakPolarHBondContact CB-O 3.2Å; N256-G260 PolarHBondContact O-N 3.44Å; N256-G260 VanDerWaalsContact O-N 3.11Å; I257-G260 PolarHBondContact O-N 3.11Å; G260-L264 WeakPolarHBondContact O-CB 3.3Å; G260-L264 PolarHBondContact O-N 3.06Å
261	M	87.8	Confident	87.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67.7	-40.1	175	-77.6	-176.6	64.8	0	0	113.3	I257 K259 E263 L264 R265 L287 V290 L291 L295 W301	I257-M261 HydrophobicContact CG2-CG 4.17Å; I257-M261 HydrophobicContact CG2-SD 3.82Å; I257-M261 WeakPolarHBondContact O-CB 3.26Å; I257-M261 VanDerWaalsContact O-CG 3.3Å; I257-M261 WeakPolarHBondContact O-CG 3.42Å; I257-M261 PolarHBondContact O-N 3.32Å; K259-M261 VanDerWaalsContact C-N 3.33Å; K259-M261 PolarHBondContact O-N 3.21Å; M261-E263 VanDerWaalsContact C-N 3.3Å; M261-E263 PolarHBondContact O-N 3.27Å; M261-L264 PolarHBondContact O-N 3.08Å; M261-R265 WeakPolarHBondContact O-CB 3.37Å; M261-R265 WeakPolarHBondContact O-CG 3.37Å; M261-R265 PolarHBondContact O-N 3.4Å; M261-L287 HydrophobicContact CB-CD1 4.39Å; M261-L287 HydrophobicContact CE-CD1 4.08Å; M261-L287 HydrophobicContact CG-CD1 4.04Å; M261-V290 HydrophobicContact CG-CG1 3.73Å; M261-V290 HydrophobicContact SD-CG1 3.83Å; M261-L291 HydrophobicContact CE-CD2 3.41Å; M261-L291 VanDerWaalsContact CE-CD2 3.41Å; M261-L291 HydrophobicContact CE-CG 4.04Å; M261-L295 HydrophobicContact CE-CD1 3.36Å; M261-L295 HydrophobicContact SD-CD1 3.26Å; M261-L295 WeakPolarHBondContact SD-CD1 3.38Å; M261-L295 HydrophobicContact SD-CG 4.15Å; M261-W301 HydrophobicContact CB-CH2 4.19Å; M261-W301 HydrophobicContact CB-CZ2 4.36Å; M261-W301 HydrophobicContact CE-CH2 4.18Å; M261-W301 HydrophobicContact SD-CH2 4.07Å
262	R	86.8	Confident	87.4	Confident	80 Å²	80	46.9 Å²	46.9	30%	0.302	23%	0.232	S	C	.	.	H	α-helix	trans	-57.8	-47.2	176.1	-172.7	-174.2	-57.4	-172.6	6.1	110.5	V258 K259 R265 E266 E316	V258-R262 WeakPolarHBondContact O-CB 3.31Å; V258-R262 PolarHBondContact O-N 2.95Å; K259-R262 WeakPolarHBondContact O-CB 3.41Å; K259-R262 PolarHBondContact O-N 2.88Å; R262-R265 PolarHBondContact O-N 3.37Å; R262-E266 WeakPolarHBondContact O-CB 3.39Å; R262-E266 PolarHBondContact O-N 3.31Å; R262-E316 IonicContact CZ-OE2 2.81Å; R262-E316 VanDerWaalsContact CZ-OE2 3.32Å; R262-E316 IonicContact NH1-OE2 3.71Å; R262-E316 PolarHBondContact NH1-OE2 2.99Å; R262-E316 VanDerWaalsContact NH2-CD 3.33Å; R262-E316 IonicContact NH2-OE1 2.79Å; R262-E316 PolarHBondContact NH2-OE1 3.48Å; R262-E316 VanDerWaalsContact NH2-OE1 3.17Å; R262-E316 IonicContact NH2-OE2 3.07Å; R262-E316 PolarHBondContact NH2-OE2 3.31Å
263	E	86.7	Confident	87.4	Confident	16 Å²	16	44.8 Å²	44.8	8%	0.075	22%	0.221	C	C	.	.	H	α-helix	trans	-64.8	-42.3	178	-69.8	167.5	-179.6	0	0	112.1	Y248 N251 K259 M261 R265 E266 V267	Y248-E263 WeakPolarHBondContact CA-OE2 3.4Å; Y248-E263 PolarHBondContact N-OE2 2.67Å; N251-E263 PolarHBondContact ND2-OE1 2.87Å; N251-E263 PolarHBondContact ND2-OE2 2.68Å; K259-E263 VanDerWaalsContact CE-OE1 3.23Å; K259-E263 WeakPolarHBondContact CE-OE1 3.24Å; K259-E263 WeakPolarHBondContact O-CG 3.44Å; K259-E263 PolarHBondContact O-N 3.21Å; K259-E263 VanDerWaalsContact O-N 3.08Å; M261-E263 VanDerWaalsContact C-N 3.3Å; M261-E263 PolarHBondContact O-N 3.27Å; E263-R265 PolarHBondContact O-N 3.33Å; E263-E266 WeakPolarHBondContact O-CB 3.47Å; E263-E266 PolarHBondContact O-N 3.48Å; E263-V267 WeakPolarHBondContact O-CG2 3.3Å; E263-V267 PolarHBondContact O-N 3.03Å
264	L	90.2	Very high	87.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.9	-47	173.4	-89.9	158.5	0	0	0	112.1	Y248 L252 G260 M261 E266 V267 L268 A283 L287	Y248-L264 HydrophobicContact CD1-CD2 4.02Å; Y248-L264 HydrophobicContact CD1-CG 4.01Å; Y248-L264 HydrophobicContact CD2-CD1 3.9Å; Y248-L264 HydrophobicContact CD2-CD2 3.85Å; Y248-L264 HydrophobicContact CD2-CG 3.71Å; Y248-L264 HydrophobicContact CE1-CD2 3.93Å; Y248-L264 HydrophobicContact CE1-CG 4.43Å; Y248-L264 HydrophobicContact CE2-CD1 4.49Å; Y248-L264 HydrophobicContact CE2-CD2 3.83Å; Y248-L264 HydrophobicContact CE2-CG 4.24Å; Y248-L264 HydrophobicContact CG-CD1 4.22Å; Y248-L264 HydrophobicContact CG-CD2 3.99Å; Y248-L264 HydrophobicContact CG-CG 3.63Å; L252-L264 HydrophobicContact CD1-CD1 3.92Å; G260-L264 WeakPolarHBondContact O-CB 3.3Å; G260-L264 PolarHBondContact O-N 3.06Å; M261-L264 PolarHBondContact O-N 3.08Å; L264-E266 VanDerWaalsContact C-N 3.32Å; L264-E266 PolarHBondContact O-N 3.21Å; L264-V267 PolarHBondContact O-N 2.63Å; L264-L268 WeakPolarHBondContact O-CB 3.42Å; L264-L268 WeakPolarHBondContact O-CG 3.49Å; L264-L268 PolarHBondContact O-N 3.07Å; L264-A283 HydrophobicContact CD2-CB 4.16Å; L264-L287 HydrophobicContact CB-CB 4.48Å; L264-L287 HydrophobicContact CB-CD1 4.13Å; L264-L287 HydrophobicContact CB-CD2 4.43Å; L264-L287 HydrophobicContact CD1-CB 4.47Å; L264-L287 HydrophobicContact CD1-CD1 4.29Å
265	R	91	Very high	87.2	Confident	11 Å²	11	37.6 Å²	37.6	4%	0.042	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-40.5	177.1	-75.9	174.3	172.9	172.8	2.6	111.4	M261 R262 E263 L268 R269 L287 W301 E344	M261-R265 WeakPolarHBondContact O-CB 3.37Å; M261-R265 WeakPolarHBondContact O-CG 3.37Å; M261-R265 PolarHBondContact O-N 3.4Å; R262-R265 PolarHBondContact O-N 3.37Å; E263-R265 PolarHBondContact O-N 3.33Å; R265-L268 PolarHBondContact O-N 3.46Å; R265-R269 VanDerWaalsContact O-CB 3.26Å; R265-R269 WeakPolarHBondContact O-CB 3.21Å; R265-R269 WeakPolarHBondContact O-CG 3.45Å; R265-R269 PolarHBondContact O-N 2.73Å; R265-L287 HydrophobicContact CG-CD2 3.79Å; R265-W301 VanDerWaalsContact CZ-O 3.29Å; R265-W301 VanDerWaalsContact NH1-CD1 3.35Å; R265-W301 PolarHBondContact NH1-O 3.49Å; R265-W301 PolarHBondContact NH2-O 3.07Å; R265-E344 IonicContact CZ-OE1 3.9Å; R265-E344 IonicContact CZ-OE2 3.7Å; R265-E344 IonicContact NE-OE1 2.77Å; R265-E344 PolarHBondContact NE-OE1 2.83Å; R265-E344 IonicContact NE-OE2 3.95Å; R265-E344 PolarHBondContact NE-OE2 3.01Å; R265-E344 IonicContact NH2-OE1 2.79Å; R265-E344 IonicContact NH2-OE2 3.05Å; R265-E344 PolarHBondContact NH2-OE2 3.38Å
266	E	88	Confident	87.4	Confident	67 Å²	67	35.6 Å²	35.6	31%	0.313	17%	0.171	S	C	.	.	H	α-helix	trans	-60.6	-48.6	177.5	-173.4	174.5	176.1	0	0	111.5	W205 R262 E263 L264 L268 R269 T270	W205-E266 WeakPolarHBondContact CZ3-OE1 3.47Å; R262-E266 WeakPolarHBondContact O-CB 3.39Å; R262-E266 PolarHBondContact O-N 3.31Å; E263-E266 WeakPolarHBondContact O-CB 3.47Å; E263-E266 PolarHBondContact O-N 3.48Å; L264-E266 VanDerWaalsContact C-N 3.32Å; L264-E266 PolarHBondContact O-N 3.21Å; E266-L268 VanDerWaalsContact C-N 3.32Å; E266-L268 PolarHBondContact O-N 3.33Å; E266-R269 PolarHBondContact O-N 2.99Å; E266-T270 VanDerWaalsContact O-CG2 3.23Å; E266-T270 WeakPolarHBondContact O-CG2 3.28Å; E266-T270 PolarHBondContact O-N 3.05Å
267	V	89.9	Confident	87.4	Confident	5 Å²	5	35.6 Å²	35.6	3%	0.03	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-41.5	177.2	178.1	0	0	0	0	111.4	E263 L264 T270 F279 K280	E263-V267 WeakPolarHBondContact O-CG2 3.3Å; E263-V267 PolarHBondContact O-N 3.03Å; L264-V267 PolarHBondContact O-N 2.63Å; V267-T270 PolarHBondContact O-OG1 3.36Å; V267-F279 HydrophobicContact CG1-CD1 4.42Å; V267-F279 HydrophobicContact CG1-CE1 3.75Å; V267-K280 WeakPolarHBondContact O-CE 3.32Å
268	L	91.5	Very high	87.3	Confident	30 Å²	30	37.9 Å²	37.9	16%	0.157	18%	0.182	C	C	.	.	H	α-helix	trans	-71.8	-33.3	179.8	-71.8	168.7	0	0	0	113.5	L264 R265 E266 T270 K280 A283 A284 L287 L348	L264-L268 WeakPolarHBondContact O-CB 3.42Å; L264-L268 WeakPolarHBondContact O-CG 3.49Å; L264-L268 PolarHBondContact O-N 3.07Å; R265-L268 PolarHBondContact O-N 3.46Å; E266-L268 VanDerWaalsContact C-N 3.32Å; E266-L268 PolarHBondContact O-N 3.33Å; L268-T270 VanDerWaalsContact C-N 3.25Å; L268-T270 PolarHBondContact O-N 2.96Å; L268-K280 HydrophobicContact CD2-CB 4.18Å; L268-K280 HydrophobicContact CD2-CG 4.33Å; L268-K280 WeakPolarHBondContact CD2-O 3.45Å; L268-A283 HydrophobicContact CD2-CB 4.04Å; L268-A283 HydrophobicContact CG-CB 4.44Å; L268-A284 HydrophobicContact CD1-CB 4.43Å; L268-A284 HydrophobicContact CD2-CB 4.01Å; L268-L287 HydrophobicContact CD1-CB 4.18Å; L268-L287 HydrophobicContact CD1-CD2 3.56Å; L268-L348 HydrophobicContact CD1-CD2 3.86Å
269	R	90.6	Very high	87.4	Confident	79 Å²	79	37.9 Å²	37.9	30%	0.298	18%	0.18	S	C	.	.	H	α-helix	trans	-73	-16.2	178.7	-77.6	179.3	64.5	-163.6	-8.3	113.8	R265 E266 P303 L304 L329 Y330	R265-R269 VanDerWaalsContact O-CB 3.26Å; R265-R269 WeakPolarHBondContact O-CB 3.21Å; R265-R269 WeakPolarHBondContact O-CG 3.45Å; R265-R269 PolarHBondContact O-N 2.73Å; E266-R269 PolarHBondContact O-N 2.99Å; R269-P303 PolarHBondContact NH1-O 3.34Å; R269-P303 VanDerWaalsContact NH1-O 3.12Å; R269-L304 VanDerWaalsContact NH2-CD2 3.27Å; R269-L329 HydrophobicContact CB-CD2 4.46Å; R269-L329 WeakPolarHBondContact O-CA 3.46Å; R269-Y330 VanDerWaalsContact O-CD2 3.26Å; R269-Y330 WeakPolarHBondContact O-CD2 3.37Å; R269-Y330 PolarHBondContact O-N 3.49Å
270	T	90.4	Very high	87.6	Confident	5 Å²	5	35.6 Å²	35.6	3%	0.031	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-65.2	147.2	174.3	65.8	0	0	0	0	110.7	Q208 E266 V267 L268 E272 K280 P327 H328 L329 Y330	Q208-T270 HydrophobicContact CG-CG2 4.4Å; E266-T270 VanDerWaalsContact O-CG2 3.23Å; E266-T270 WeakPolarHBondContact O-CG2 3.28Å; E266-T270 PolarHBondContact O-N 3.05Å; V267-T270 PolarHBondContact O-OG1 3.36Å; L268-T270 VanDerWaalsContact C-N 3.25Å; L268-T270 PolarHBondContact O-N 2.96Å; T270-E272 PolarHBondContact O-N 3.01Å; T270-K280 PolarHBondContact O-NZ 2.94Å; T270-K280 WeakPolarHBondContact OG1-CE 3.41Å; T270-K280 PolarHBondContact OG1-NZ 3.45Å; T270-P327 HydrophobicContact CG2-CB 4.18Å; T270-P327 HydrophobicContact CG2-CG 4.3Å; T270-H328 WeakPolarHBondContact CA-O 3.49Å; T270-L329 HydrophobicContact CG2-CD2 3.73Å; T270-Y330 WeakPolarHBondContact O-CE2 3.37Å
271	V	88.8	Confident	87.6	Confident	54 Å²	54	36.2 Å²	36.2	33%	0.327	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-60.3	128.3	175.2	178.1	0	0	0	0	109.4	Q212 K280 H328 Y330	Q212-V271 PolarHBondContact NE2-O 2.55Å; V271-K280 PolarHBondContact O-NZ 3.14Å; V271-H328 HydrophobicContact CG2-CB 4.18Å; V271-H328 PolarHBondContact N-O 3.05Å; V271-Y330 HydrophobicContact CG1-CE1 4.47Å; V271-Y330 HydrophobicContact CG2-CD1 4.34Å; V271-Y330 HydrophobicContact CG2-CE1 4.39Å
272	E	87.7	Confident	87.5	Confident	49 Å²	49	39 Å²	39	23%	0.229	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-62	137.3	177.2	-173.8	-176.9	175	0	0	112.2	T270 Q277 K280 Y330 M355	T270-E272 PolarHBondContact O-N 3.01Å; E272-Q277 HydrophobicContact CG-CG 4.04Å; E272-Q277 WeakPolarHBondContact OE1-CB 3.27Å; E272-Q277 VanDerWaalsContact OE1-CD 3.3Å; E272-Q277 WeakPolarHBondContact OE1-CG 3.24Å; E272-Q277 PolarHBondContact OE1-NE2 3.33Å; E272-K280 HydrophobicContact CB-CD 4.48Å; E272-K280 HydrophobicContact CG-CD 4.45Å; E272-Y330 WeakPolarHBondContact CB-OH 3.41Å; E272-Y330 PolarHBondContact N-OH 2.83Å; E272-M355 WeakPolarHBondContact OE1-CE 3.46Å; E272-M355 WeakPolarHBondContact OE2-CE 3.17Å
273	T	87.3	Confident	87.6	Confident	5 Å²	5	35.2 Å²	35.2	3%	0.031	17%	0.173	C	C	.	.			trans	-118.7	156.9	169.6	69.3	0	0	0	0	109.3	Q212 E215 A275 T276 Q277	Q212-T273 HydrophobicContact CB-CG2 4.48Å; Q212-T273 HydrophobicContact CG-CG2 3.91Å; E215-T273 HydrophobicContact CB-CG2 4.47Å; E215-T273 VanDerWaalsContact OE2-CA 3.28Å; E215-T273 WeakPolarHBondContact OE2-CA 3.38Å; E215-T273 VanDerWaalsContact OE2-CB 3.28Å; E215-T273 WeakPolarHBondContact OE2-CB 3.19Å; E215-T273 WeakPolarHBondContact OE2-CG2 3.12Å; T273-A275 PolarHBondContact O-N 3.22Å; T273-A275 VanDerWaalsContact O-N 3.14Å; T273-T276 PolarHBondContact N-OG1 3.22Å; T273-T276 PolarHBondContact O-N 2.96Å; T273-T276 PolarHBondContact O-OG1 3.43Å; T273-T276 VanDerWaalsContact OG1-CG2 3.3Å; T273-T276 WeakPolarHBondContact OG1-CG2 3.4Å; T273-T276 PolarHBondContact OG1-N 3.16Å; T273-T276 PolarHBondContact OG1-OG1 3.23Å; T273-Q277 WeakPolarHBondContact O-CG 3.43Å; T273-Q277 PolarHBondContact O-N 3.38Å
274	K	83.1	Confident	87.9	Confident	110 Å²	110	34.5 Å²	34.5	48%	0.478	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-51.8	-36.2	176.9	-70.9	179.8	-178.8	-175.2	0	114.3	E215 T276 Q277	E215-K274 PolarHBondContact OE1-N 2.91Å; K274-T276 VanDerWaalsContact C-N 3.31Å; K274-T276 PolarHBondContact O-N 3.2Å; K274-Q277 WeakPolarHBondContact O-CG 3.42Å
275	A	83.1	Confident	88	Confident	22 Å²	22	35.7 Å²	35.7	18%	0.182	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-73.6	-22.6	178.9	0	0	0	0	0	113.3	L211 Y234 T273	L211-A275 HydrophobicContact CD2-CB 4.17Å; Y234-A275 HydrophobicContact CD1-CB 3.96Å; T273-A275 PolarHBondContact O-N 3.22Å; T273-A275 VanDerWaalsContact O-N 3.14Å
276	T	86.7	Confident	88	Confident	10 Å²	10	39 Å²	39	6%	0.061	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-96.7	-6.4	-175.2	56.6	0	0	0	0	114.5	L211 T273 K274 F279 K280	L211-T276 HydrophobicContact CD1-CG2 3.59Å; T273-T276 PolarHBondContact N-OG1 3.22Å; T273-T276 PolarHBondContact O-N 2.96Å; T273-T276 PolarHBondContact O-OG1 3.43Å; T273-T276 VanDerWaalsContact OG1-CG2 3.3Å; T273-T276 WeakPolarHBondContact OG1-CG2 3.4Å; T273-T276 PolarHBondContact OG1-N 3.16Å; T273-T276 PolarHBondContact OG1-OG1 3.23Å; K274-T276 VanDerWaalsContact C-N 3.31Å; K274-T276 PolarHBondContact O-N 3.2Å; T276-F279 PolarHBondContact O-N 2.96Å; T276-K280 WeakPolarHBondContact O-CB 3.48Å; T276-K280 WeakPolarHBondContact O-CG 3.44Å; T276-K280 PolarHBondContact O-N 2.96Å
277	Q	85.2	Confident	88.2	Confident	71 Å²	71	35.9 Å²	35.9	33%	0.332	18%	0.177	S	C	.	.	H	α-helix	trans	-59.4	-56.5	-171.2	-48.6	-164.9	-70.8	0	0	111.3	E272 T273 K274 F279 K280 V281	E272-Q277 HydrophobicContact CG-CG 4.04Å; E272-Q277 WeakPolarHBondContact OE1-CB 3.27Å; E272-Q277 VanDerWaalsContact OE1-CD 3.3Å; E272-Q277 WeakPolarHBondContact OE1-CG 3.24Å; E272-Q277 PolarHBondContact OE1-NE2 3.33Å; T273-Q277 WeakPolarHBondContact O-CG 3.43Å; T273-Q277 PolarHBondContact O-N 3.38Å; K274-Q277 WeakPolarHBondContact O-CG 3.42Å; Q277-F279 VanDerWaalsContact C-N 3.28Å; Q277-F279 PolarHBondContact O-N 2.9Å; Q277-K280 PolarHBondContact O-N 3.09Å; Q277-V281 WeakPolarHBondContact O-CG2 3.47Å; Q277-V281 PolarHBondContact O-N 3.31Å
278	N	82.7	Confident	88.3	Confident	102 Å²	102	35.7 Å²	35.7	55%	0.545	18%	0.175	S	C	.	.	H	α-helix	trans	-60.8	-38.5	-178.6	-67.3	1.7	0	0	0	112.2	M282 D359	N278-M282 PolarHBondContact O-N 3.3Å; N278-D359 PolarHBondContact OD1-OD2 2.98Å
279	F	86.8	Confident	88.3	Confident	18 Å²	18	35.3 Å²	35.3	8%	0.079	18%	0.179	C	C	.	.	H	α-helix	trans	-63.1	-45.7	174.8	-179.9	-89.1	0	0	0	111.6	L236 E241 L244 Q245 Y248 V267 T276 Q277 V281 M282 A283	L236-F279 HydrophobicContact CD2-CB 4.44Å; E241-F279 HydrophobicContact CG-CD2 4.02Å; E241-F279 HydrophobicContact CG-CE2 4.25Å; L244-F279 HydrophobicContact CB-CD1 4.46Å; L244-F279 HydrophobicContact CB-CE1 3.8Å; L244-F279 HydrophobicContact CB-CE2 3.9Å; L244-F279 HydrophobicContact CB-CZ 3.45Å; L244-F279 VanDerWaalsContact CB-CZ 3.45Å; L244-F279 HydrophobicContact CD1-CD1 4.16Å; L244-F279 HydrophobicContact CD1-CE1 4.29Å; L244-F279 HydrophobicContact CD1-CG 4.33Å; Q245-F279 HydrophobicContact CB-CE2 3.99Å; Q245-F279 HydrophobicContact CB-CZ 4.11Å; Y248-F279 HydrophobicContact CE1-CZ 4.13Å; V267-F279 HydrophobicContact CG1-CD1 4.42Å; V267-F279 HydrophobicContact CG1-CE1 3.75Å; T276-F279 PolarHBondContact O-N 2.96Å; Q277-F279 VanDerWaalsContact C-N 3.28Å; Q277-F279 PolarHBondContact O-N 2.9Å; F279-V281 VanDerWaalsContact C-N 3.35Å; F279-V281 PolarHBondContact O-N 3.17Å; F279-M282 PolarHBondContact O-N 3.36Å; F279-A283 HydrophobicContact CD1-CB 4.47Å; F279-A283 HydrophobicContact CE1-CB 4.12Å; F279-A283 WeakPolarHBondContact O-CB 3.34Å; F279-A283 PolarHBondContact O-N 2.94Å
280	K	88.8	Confident	88.3	Confident	13 Å²	13	32.5 Å²	32.5	6%	0.057	17%	0.17	C	C	.	.	H	α-helix	trans	-66.7	-33.4	-179.1	-76	-175.1	176.8	-174.1	0	112.7	V267 L268 T270 V271 E272 T276 Q277 A283 A284	V267-K280 WeakPolarHBondContact O-CE 3.32Å; L268-K280 HydrophobicContact CD2-CB 4.18Å; L268-K280 HydrophobicContact CD2-CG 4.33Å; L268-K280 WeakPolarHBondContact CD2-O 3.45Å; T270-K280 PolarHBondContact O-NZ 2.94Å; T270-K280 WeakPolarHBondContact OG1-CE 3.41Å; T270-K280 PolarHBondContact OG1-NZ 3.45Å; V271-K280 PolarHBondContact O-NZ 3.14Å; E272-K280 HydrophobicContact CB-CD 4.48Å; E272-K280 HydrophobicContact CG-CD 4.45Å; T276-K280 WeakPolarHBondContact O-CB 3.48Å; T276-K280 WeakPolarHBondContact O-CG 3.44Å; T276-K280 PolarHBondContact O-N 2.96Å; Q277-K280 PolarHBondContact O-N 3.09Å; K280-A283 PolarHBondContact O-N 3.22Å; K280-A284 WeakPolarHBondContact O-CB 3.48Å; K280-A284 PolarHBondContact O-N 3.02Å
281	V	85.8	Confident	88.3	Confident	13 Å²	13	32.3 Å²	32.3	8%	0.079	17%	0.169	C	C	.	.	H	α-helix	trans	-56.9	-50.8	170.2	174.4	0	0	0	0	110.8	Q277 F279 A284 K285 S352 M355	Q277-V281 WeakPolarHBondContact O-CG2 3.47Å; Q277-V281 PolarHBondContact O-N 3.31Å; F279-V281 VanDerWaalsContact C-N 3.35Å; F279-V281 PolarHBondContact O-N 3.17Å; V281-A284 PolarHBondContact O-N 3.38Å; V281-K285 PolarHBondContact O-N 3.36Å; V281-S352 PolarHBondContact O-OG 3.03Å; V281-M355 HydrophobicContact CG2-CB 3.29Å; V281-M355 HydrophobicContact CG2-CG 3.9Å; V281-M355 HydrophobicContact CG2-SD 3.31Å; V281-M355 WeakPolarHBondContact CG2-SD 3.24Å
282	M	86	Confident	88.3	Confident	58 Å²	58	30.5 Å²	30.5	29%	0.286	16%	0.157	S	C	.	.	H	α-helix	trans	-67.9	-40.1	-178.7	-66.2	-59.5	-66.4	0	0	111.9	N278 F279 K285 H286	N278-M282 PolarHBondContact O-N 3.3Å; F279-M282 PolarHBondContact O-N 3.36Å; M282-K285 PolarHBondContact O-N 3.49Å; M282-H286 WeakPolarHBondContact O-CB 3.38Å; M282-H286 PolarHBondContact O-CD2 3.27Å; M282-H286 PolarHBondContact O-N 3.29Å; M282-H286 PolarHBondContact O-ND1 3.25Å
283	A	90.4	Very high	88.2	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-63.9	-40.3	175.3	0	0	0	0	0	112.3	L264 L268 F279 K280 H286 L287	L264-A283 HydrophobicContact CD2-CB 4.16Å; L268-A283 HydrophobicContact CD2-CB 4.04Å; L268-A283 HydrophobicContact CG-CB 4.44Å; F279-A283 HydrophobicContact CD1-CB 4.47Å; F279-A283 HydrophobicContact CE1-CB 4.12Å; F279-A283 WeakPolarHBondContact O-CB 3.34Å; F279-A283 PolarHBondContact O-N 2.94Å; K280-A283 PolarHBondContact O-N 3.22Å; A283-H286 PolarHBondContact O-N 3.4Å; A283-L287 WeakPolarHBondContact O-CB 3.29Å; A283-L287 PolarHBondContact O-N 3.06Å
284	A	92.6	Very high	87.9	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-65.3	-44.9	176.2	0	0	0	0	0	111.4	L268 K280 V281 H286 L287 A288 L348 S352	L268-A284 HydrophobicContact CD1-CB 4.43Å; L268-A284 HydrophobicContact CD2-CB 4.01Å; K280-A284 WeakPolarHBondContact O-CB 3.48Å; K280-A284 PolarHBondContact O-N 3.02Å; V281-A284 PolarHBondContact O-N 3.38Å; A284-H286 VanDerWaalsContact C-N 3.34Å; A284-H286 PolarHBondContact O-N 3.36Å; A284-L287 PolarHBondContact O-N 2.83Å; A284-A288 WeakPolarHBondContact O-CB 3.45Å; A284-A288 PolarHBondContact O-N 2.85Å; A284-L348 HydrophobicContact CB-CB 4.22Å; A284-L348 HydrophobicContact CB-CD2 3.93Å; A284-S352 WeakPolarHBondContact CB-OG 3.43Å
285	K	91	Very high	87.7	Confident	26 Å²	26	34.4 Å²	34.4	11%	0.113	18%	0.183	C	C	.	.	H	α-helix	trans	-56.6	-46.3	171.8	-172.3	-169.2	76.6	172.2	0	111.6	V281 M282 A288 G289 N378 A381 I382 L385	V281-K285 PolarHBondContact O-N 3.36Å; M282-K285 PolarHBondContact O-N 3.49Å; K285-A288 PolarHBondContact O-N 3.47Å; K285-G289 PolarHBondContact O-N 3.47Å; K285-N378 PolarHBondContact NZ-OD1 2.75Å; K285-A381 HydrophobicContact CD-CB 4.43Å; K285-I382 HydrophobicContact CD-CG1 3.98Å; K285-I382 HydrophobicContact CG-CG1 4.1Å; K285-L385 HydrophobicContact CG-CD1 3.97Å
286	H	90.6	Very high	87.5	Confident	81 Å²	81	36.1 Å²	36.1	38%	0.375	19%	0.194	S	C	.	.	H	α-helix	trans	-63.3	-45	178.8	-68.7	166.7	0	0	0	112	M282 A283 A284 G289 V290	M282-H286 WeakPolarHBondContact O-CB 3.38Å; M282-H286 PolarHBondContact O-CD2 3.27Å; M282-H286 PolarHBondContact O-N 3.29Å; M282-H286 PolarHBondContact O-ND1 3.25Å; A283-H286 PolarHBondContact O-N 3.4Å; A284-H286 VanDerWaalsContact C-N 3.34Å; A284-H286 PolarHBondContact O-N 3.36Å; H286-G289 PolarHBondContact O-N 3.37Å; H286-V290 WeakPolarHBondContact O-CG2 3.23Å; H286-V290 PolarHBondContact O-N 3.04Å
287	L	92.8	Very high	87	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-63.3	-42.1	177.2	-179.5	60.3	0	0	0	111.5	M261 L264 R265 L268 A283 A284 G289 V290 L291 L348	M261-L287 HydrophobicContact CB-CD1 4.39Å; M261-L287 HydrophobicContact CE-CD1 4.08Å; M261-L287 HydrophobicContact CG-CD1 4.04Å; L264-L287 HydrophobicContact CB-CB 4.48Å; L264-L287 HydrophobicContact CB-CD1 4.13Å; L264-L287 HydrophobicContact CB-CD2 4.43Å; L264-L287 HydrophobicContact CD1-CB 4.47Å; L264-L287 HydrophobicContact CD1-CD1 4.29Å; R265-L287 HydrophobicContact CG-CD2 3.79Å; L268-L287 HydrophobicContact CD1-CB 4.18Å; L268-L287 HydrophobicContact CD1-CD2 3.56Å; A283-L287 WeakPolarHBondContact O-CB 3.29Å; A283-L287 PolarHBondContact O-N 3.06Å; A284-L287 PolarHBondContact O-N 2.83Å; L287-G289 VanDerWaalsContact C-N 3.33Å; L287-G289 PolarHBondContact O-N 2.91Å; L287-V290 PolarHBondContact O-N 2.93Å; L287-L291 HydrophobicContact CD1-CD1 4.46Å; L287-L291 HydrophobicContact CD1-CG 4.41Å; L287-L291 HydrophobicContact CG-CD1 4.06Å; L287-L291 WeakPolarHBondContact O-CB 3.48Å; L287-L291 VanDerWaalsContact O-CG 3.32Å; L287-L291 WeakPolarHBondContact O-CG 3.3Å; L287-L291 PolarHBondContact O-N 2.69Å; L287-L348 HydrophobicContact CB-CD1 3.91Å; L287-L348 HydrophobicContact CD2-CD1 3.6Å; L287-L348 HydrophobicContact CD2-CD2 4.36Å; L287-L348 HydrophobicContact CG-CD1 3.6Å
288	A	93.2	Very high	86.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.2	-43.3	173.6	0	0	0	0	0	112	A284 K285 V290 L291 L292 A345 L348 L349	A284-A288 WeakPolarHBondContact O-CB 3.45Å; A284-A288 PolarHBondContact O-N 2.85Å; K285-A288 PolarHBondContact O-N 3.47Å; A288-V290 PolarHBondContact O-N 3.32Å; A288-L291 PolarHBondContact O-N 2.89Å; A288-L292 WeakPolarHBondContact O-CD1 3.43Å; A288-L292 VanDerWaalsContact O-CG 3.25Å; A288-L292 WeakPolarHBondContact O-CG 3.49Å; A288-L292 PolarHBondContact O-N 2.72Å; A288-A345 HydrophobicContact CB-CB 4.32Å; A288-L348 HydrophobicContact CB-CB 4.2Å; A288-L348 HydrophobicContact CB-CD1 4.45Å; A288-L349 HydrophobicContact CB-CD1 4.31Å; A288-L349 HydrophobicContact CB-CD2 3.83Å; A288-L349 HydrophobicContact CB-CG 3.75Å
289	G	90.8	Very high	86.3	Confident	22 Å²	22	42.5 Å²	42.5	23%	0.227	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-43.4	174.2	0	0	0	0	0	113	K285 H286 L287 L292 H293	K285-G289 PolarHBondContact O-N 3.47Å; H286-G289 PolarHBondContact O-N 3.37Å; L287-G289 VanDerWaalsContact C-N 3.33Å; L287-G289 PolarHBondContact O-N 2.91Å; G289-L292 PolarHBondContact O-N 2.99Å; G289-H293 WeakPolarHBondContact O-CB 3.36Å; G289-H293 PolarHBondContact O-N 3.2Å
290	V	90.3	Very high	86.2	Confident	21 Å²	21	42.9 Å²	42.9	13%	0.127	22%	0.224	C	C	.	.	H	α-helix	trans	-63.1	-44.9	176.2	174.3	0	0	0	0	111	L252 I257 M261 H286 L287 A288 L292 S294	L252-V290 HydrophobicContact CD1-CG2 4.1Å; L252-V290 HydrophobicContact CD2-CG1 4.39Å; L252-V290 HydrophobicContact CD2-CG2 4.33Å; I257-V290 HydrophobicContact CG2-CG1 3.96Å; M261-V290 HydrophobicContact CG-CG1 3.73Å; M261-V290 HydrophobicContact SD-CG1 3.83Å; H286-V290 WeakPolarHBondContact O-CG2 3.23Å; H286-V290 PolarHBondContact O-N 3.04Å; L287-V290 PolarHBondContact O-N 2.93Å; A288-V290 PolarHBondContact O-N 3.32Å; V290-L292 VanDerWaalsContact C-N 3.32Å; V290-L292 PolarHBondContact O-N 3.47Å; V290-S294 WeakPolarHBondContact O-CA 3.19Å; V290-S294 VanDerWaalsContact O-CB 3.23Å; V290-S294 WeakPolarHBondContact O-CB 3.39Å; V290-S294 PolarHBondContact O-N 3.38Å; V290-S294 PolarHBondContact O-OG 2.95Å
291	L	90.4	Very high	86.2	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.7	-40.1	178.3	-75.9	163.5	0	0	0	112.6	M261 L287 A288 L295 Y300 N341 E344 A345 L348	M261-L291 HydrophobicContact CE-CD2 3.41Å; M261-L291 VanDerWaalsContact CE-CD2 3.41Å; M261-L291 HydrophobicContact CE-CG 4.04Å; L287-L291 HydrophobicContact CD1-CD1 4.46Å; L287-L291 HydrophobicContact CD1-CG 4.41Å; L287-L291 HydrophobicContact CG-CD1 4.06Å; L287-L291 WeakPolarHBondContact O-CB 3.48Å; L287-L291 VanDerWaalsContact O-CG 3.32Å; L287-L291 WeakPolarHBondContact O-CG 3.3Å; L287-L291 PolarHBondContact O-N 2.69Å; A288-L291 PolarHBondContact O-N 2.89Å; L291-L295 HydrophobicContact CD2-CD1 3.99Å; L291-Y300 HydrophobicContact CD2-CD2 4.27Å; L291-Y300 HydrophobicContact CD2-CE2 4.21Å; L291-N341 HydrophobicContact CD2-CB 4.46Å; L291-E344 HydrophobicContact CD1-CB 3.9Å; L291-E344 HydrophobicContact CD1-CG 3.69Å; L291-E344 WeakPolarHBondContact CD2-OE2 3.48Å; L291-A345 HydrophobicContact CB-CB 4.44Å; L291-A345 HydrophobicContact CD1-CB 4.45Å; L291-L348 HydrophobicContact CD1-CD1 3.79Å
292	L	88.9	Confident	86.2	Confident	16 Å²	16	43.8 Å²	43.8	8%	0.084	23%	0.231	C	C	.	.	H	α-helix	trans	-82	-32.1	-175.1	-66.3	164.9	0	0	0	113.8	A288 G289 V290 A345 L385 T389 R392	A288-L292 WeakPolarHBondContact O-CD1 3.43Å; A288-L292 VanDerWaalsContact O-CG 3.25Å; A288-L292 WeakPolarHBondContact O-CG 3.49Å; A288-L292 PolarHBondContact O-N 2.72Å; G289-L292 PolarHBondContact O-N 2.99Å; V290-L292 VanDerWaalsContact C-N 3.32Å; V290-L292 PolarHBondContact O-N 3.47Å; L292-A345 HydrophobicContact CD1-CB 4.19Å; L292-A345 HydrophobicContact CD2-CB 4Å; L292-A345 HydrophobicContact CG-CB 3.97Å; L292-L385 HydrophobicContact CD1-CB 4.43Å; L292-L385 HydrophobicContact CD1-CD2 4.06Å; L292-T389 HydrophobicContact CD1-CG2 3.43Å; L292-T389 VanDerWaalsContact CD1-CG2 3.43Å; L292-T389 HydrophobicContact CD2-CG2 3.45Å; L292-T389 VanDerWaalsContact CD2-CG2 3.45Å; L292-T389 HydrophobicContact CG-CG2 3.98Å; L292-R392 PolarHBondContact O-NH1 3.16Å
293	H	86.5	Confident	86.2	Confident	171 Å²	171	42 Å²	42	79%	0.792	22%	0.223	S	C	*	.	H	α-helix	trans	-95.6	-36	-176	-172.9	73.5	0	0	0	113.4	G289	G289-H293 WeakPolarHBondContact O-CB 3.36Å; G289-H293 PolarHBondContact O-N 3.2Å
294	S	79.8	Confident	85.8	Confident	51 Å²	51	47.5 Å²	47.5	36%	0.357	25%	0.252	S	S	.	.	H	α-helix	trans	-109.2	-8.6	-163	-46.6	0	0	0	0	114.5	V290	V290-S294 WeakPolarHBondContact O-CA 3.19Å; V290-S294 VanDerWaalsContact O-CB 3.23Å; V290-S294 WeakPolarHBondContact O-CB 3.39Å; V290-S294 PolarHBondContact O-N 3.38Å; V290-S294 PolarHBondContact O-OG 2.95Å
295	L	79.7	Confident	85.1	Confident	24 Å²	24	50.2 Å²	50.2	13%	0.126	27%	0.271	C	S	.	.			trans	-125	137.5	-178.4	-79	170.6	0	0	0	112.2	M261 L291 C299 W301	M261-L295 HydrophobicContact CE-CD1 3.36Å; M261-L295 HydrophobicContact SD-CD1 3.26Å; M261-L295 WeakPolarHBondContact SD-CD1 3.38Å; M261-L295 HydrophobicContact SD-CG 4.15Å; L291-L295 HydrophobicContact CD2-CD1 3.99Å; L295-C299 HydrophobicContact CD2-CB 3.86Å; L295-W301 HydrophobicContact CD1-CZ3 4.45Å
296	S	78.1	Confident	84.1	Confident	59 Å²	59	56.7 Å²	56.7	41%	0.413	30%	0.301	S	S	.	.			trans	-81.8	162.4	163	63.2	0	0	0	0	110.5	E298 C299	S296-E298 PolarHBondContact O-N 3.35Å; S296-C299 PolarHBondContact O-N 3.33Å; S296-C299 PolarHBondContact OG-SG 3.14Å
297	E	75.7	Confident	83.1	Confident	106 Å²	106	53.3 Å²	53.3	50%	0.495	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-60.4	-33.7	177.6	-64.5	-175.3	177.2	0	0	112.1	C299 Y300 R393	E297-C299 VanDerWaalsContact C-N 3.34Å; E297-C299 PolarHBondContact O-N 3.26Å; E297-Y300 WeakPolarHBondContact O-CB 3.33Å; E297-Y300 PolarHBondContact O-N 3.37Å; E297-R393 IonicContact OE1-NH1 3.98Å
298	E	75.6	Confident	81.7	Confident	178 Å²	178	56.7 Å²	56.7	83%	0.832	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-71.4	-25.9	-179.4	-61.4	-176.5	170.2	0	0	113.6	S296	S296-E298 PolarHBondContact O-N 3.35Å
299	C	78.8	Confident	80	Confident	33 Å²	33	61.8 Å²	61.8	22%	0.223	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-92.1	2.4	-179.2	-60.6	0	0	0	0	113	L295 S296 E297 F311	L295-C299 HydrophobicContact CD2-CB 3.86Å; S296-C299 PolarHBondContact O-N 3.33Å; S296-C299 PolarHBondContact OG-SG 3.14Å; E297-C299 VanDerWaalsContact C-N 3.34Å; E297-C299 PolarHBondContact O-N 3.26Å; C299-F311 HydrophobicContact CB-CE2 4.25Å; C299-F311 HydrophobicContact CB-CZ 4.2Å
300	Y	85.2	Confident	78.4	Confident	25 Å²	25	69.1 Å²	69.1	10%	0.098	37%	0.366	C	S	.	.			trans	-73.3	143.2	-179.1	178.8	-94.1	0	0	0	112	L291 E297 P338 K339 D340 N341 E344	L291-Y300 HydrophobicContact CD2-CD2 4.27Å; L291-Y300 HydrophobicContact CD2-CE2 4.21Å; E297-Y300 WeakPolarHBondContact O-CB 3.33Å; E297-Y300 PolarHBondContact O-N 3.37Å; Y300-P338 PolarHBondContact OH-O 2.99Å; Y300-K339 WeakPolarHBondContact CD1-O 3.44Å; Y300-K339 WeakPolarHBondContact CE1-O 3.33Å; Y300-D340 VanDerWaalsContact CE2-C 3.47Å; Y300-D340 WeakPolarHBondContact CE2-O 3.3Å; Y300-D340 VanDerWaalsContact CZ-C 3.44Å; Y300-D340 VanDerWaalsContact CZ-O 3.3Å; Y300-D340 PolarHBondContact OH-O 3.46Å; Y300-N341 HydrophobicContact CD2-CB 3.77Å; Y300-N341 HydrophobicContact CE2-CB 4.37Å; Y300-N341 HydrophobicContact CG-CB 4.37Å; Y300-E344 HydrophobicContact CE2-CB 4.21Å; Y300-E344 WeakPolarHBondContact CE2-OE2 3.36Å; Y300-E344 PolarHBondContact OH-OE2 3.5Å
301	W	87.2	Confident	76.8	Confident	15 Å²	15	72.3 Å²	72.3	6%	0.057	38%	0.378	C	S	.	.			trans	-135.4	146.7	167.1	72.7	101	0	0	0	110.4	V258 M261 R265 L295 P307	V258-W301 HydrophobicContact CB-CH2 4.2Å; V258-W301 HydrophobicContact CG1-CH2 3.9Å; V258-W301 HydrophobicContact CG1-CZ2 4.03Å; V258-W301 HydrophobicContact CG2-CH2 4.12Å; V258-W301 HydrophobicContact CG2-CZ3 4.29Å; M261-W301 HydrophobicContact CB-CH2 4.19Å; M261-W301 HydrophobicContact CB-CZ2 4.36Å; M261-W301 HydrophobicContact CE-CH2 4.18Å; M261-W301 HydrophobicContact SD-CH2 4.07Å; R265-W301 VanDerWaalsContact CZ-O 3.29Å; R265-W301 VanDerWaalsContact NH1-CD1 3.35Å; R265-W301 PolarHBondContact NH1-O 3.49Å; R265-W301 PolarHBondContact NH2-O 3.07Å; L295-W301 HydrophobicContact CD1-CZ3 4.45Å; W301-P307 HydrophobicContact CD2-CB 3.98Å; W301-P307 HydrophobicContact CE3-CB 4.46Å; W301-P307 HydrophobicContact CG-CB 4.25Å; W301-P307 HydrophobicContact CZ2-CB 4.39Å
302	S	86.2	Confident	75.1	Confident	31 Å²	31	76 Å²	76	22%	0.217	40%	0.396	C	S	.	.			trans	-62.4	146.5	-179.5	179.5	0	0	0	0	111.4	L304 S305 C337	S302-L304 PolarHBondContact O-N 3.43Å; S302-S305 WeakPolarHBondContact CB-OG 3.42Å; S302-S305 PolarHBondContact N-OG 3.36Å; S302-S305 PolarHBondContact O-N 3.5Å; S302-S305 PolarHBondContact O-OG 3.42Å; S302-C337 PolarHBondContact OG-SG 3.37Å
303	P	85.4	Confident	73.4	Confident	21 Å²	21	77.6 Å²	77.6	14%	0.136	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-20.4	176.9	-26.8	35.4	0	0	0	115.2	R269	R269-P303 PolarHBondContact NH1-O 3.34Å; R269-P303 VanDerWaalsContact NH1-O 3.12Å
304	L	82.2	Confident	71.4	Confident	116 Å²	116	80.2 Å²	80.2	61%	0.607	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-11.1	176.9	-60.2	-178.8	0	0	0	113.3	R269 S302 C337	R269-L304 VanDerWaalsContact NH2-CD2 3.27Å; S302-L304 PolarHBondContact O-N 3.43Å; L304-C337 HydrophobicContact CD1-CB 4.22Å
305	S	77.9	Confident	69.6	Low	58 Å²	58	85 Å²	85	41%	0.406	44%	0.442	S	S	.	.	S	Bend	trans	-96.9	162.2	179.7	70.2	0	0	0	0	112.1	S302	S302-S305 WeakPolarHBondContact CB-OG 3.42Å; S302-S305 PolarHBondContact N-OG 3.36Å; S302-S305 PolarHBondContact O-N 3.5Å; S302-S305 PolarHBondContact O-OG 3.42Å
306	H	70.9	Confident	67.8	Low	161 Å²	161	87.2 Å²	87.2	75%	0.745	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-74.6	149.5	169	-64.9	-68.9	0	0	0	110.5
307	P	68.9	Low	65.8	Low	10 Å²	10	92.6 Å²	92.6	7%	0.065	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-64.6	160.3	172.2	22.3	-24.3	0	0	0	111.1	V258 W301 M312	V258-P307 HydrophobicContact CG1-CB 3.88Å; V258-P307 HydrophobicContact CG1-CG 4.09Å; W301-P307 HydrophobicContact CD2-CB 3.98Å; W301-P307 HydrophobicContact CE3-CB 4.46Å; W301-P307 HydrophobicContact CG-CB 4.25Å; W301-P307 HydrophobicContact CZ2-CB 4.39Å; P307-M312 HydrophobicContact CG-CG 4.42Å; P307-M312 HydrophobicContact CG-SD 4.1Å
308	L	63.9	Low	64.1	Low	72 Å²	72	92 Å²	92	38%	0.377	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-61.2	142.9	-178.2	-66.9	162.7	0	0	0	111	E310 F311	L308-E310 PolarHBondContact O-N 3.36Å; L308-F311 HydrophobicContact CB-CD2 4.02Å; L308-F311 HydrophobicContact CB-CE2 4.41Å; L308-F311 HydrophobicContact CD1-CE2 4.24Å; L308-F311 PolarHBondContact O-N 2.89Å
309	P	58.1	Low	62.5	Low	107 Å²	107	89.1 Å²	89.1	70%	0.695	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-55.1	-27.6	-177.5	-27	34.6	0	0	0	114.8	F311 M312	P309-F311 VanDerWaalsContact C-N 3.27Å; P309-F311 PolarHBondContact O-N 3.32Å; P309-M312 PolarHBondContact O-N 3.3Å
310	E	57	Low	60.6	Low	177 Å²	177	91.9 Å²	91.9	83%	0.827	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-67.3	-25.7	179.6	-64.2	179.9	173.3	0	0	113.4	L308	L308-E310 PolarHBondContact O-N 3.36Å
311	F	56.7	Low	58.7	Low	88 Å²	88	92.9 Å²	92.9	39%	0.386	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-95.8	-4.8	176.2	-60.2	-68.6	0	0	0	113.1	V258 C299 L308 P309 G313	V258-F311 HydrophobicContact CG2-CB 3.98Å; V258-F311 HydrophobicContact CG2-CD1 4.38Å; V258-F311 HydrophobicContact CG2-CG 4.16Å; C299-F311 HydrophobicContact CB-CE2 4.25Å; C299-F311 HydrophobicContact CB-CZ 4.2Å; L308-F311 HydrophobicContact CB-CD2 4.02Å; L308-F311 HydrophobicContact CB-CE2 4.41Å; L308-F311 HydrophobicContact CD1-CE2 4.24Å; L308-F311 PolarHBondContact O-N 2.89Å; P309-F311 VanDerWaalsContact C-N 3.27Å; P309-F311 PolarHBondContact O-N 3.32Å; F311-G313 PolarHBondContact O-N 2.99Å
312	M	54.8	Low	56.6	Low	77 Å²	77	101.5 Å²	101.5	38%	0.379	55%	0.548	S	S	.	.			trans	-86.2	112.5	177.6	-57.3	-129.5	-43.4	0	0	109.5	P307 P309 E316	P307-M312 HydrophobicContact CG-CG 4.42Å; P307-M312 HydrophobicContact CG-SD 4.1Å; P309-M312 PolarHBondContact O-N 3.3Å; M312-E316 HydrophobicContact CB-CG 4.32Å; M312-E316 HydrophobicContact CE-CB 4.06Å; M312-E316 HydrophobicContact SD-CB 4.38Å; M312-E316 HydrophobicContact SD-CG 4.34Å
313	G	52.1	Low	54.6	Low	50 Å²	50	103.9 Å²	103.9	52%	0.515	57%	0.57	S	S	.	*			trans	-59.9	155.3	165.2	0	0	0	0	0	110.6	F311 E315 E316	F311-G313 PolarHBondContact O-N 2.99Å; G313-E315 PolarHBondContact O-N 3.28Å; G313-E316 PolarHBondContact O-N 2.96Å
314	K	44.7	Very low	53.3	Low	225 Å²	225	104.6 Å²	104.6	98%	0.978	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	4.2	-179.9	-74.2	-175.3	175.8	179.5	0	115.4
315	E	42.2	Very low	52.6	Low	153 Å²	153	105.3 Å²	105.3	72%	0.715	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.5	7.9	-168.8	-66.6	178.6	170.1	0	0	113.7	G313 N317	G313-E315 PolarHBondContact O-N 3.28Å; E315-N317 PolarHBondContact O-N 3.36Å
316	E	42.8	Very low	52.5	Low	69 Å²	69	109.9 Å²	109.9	32%	0.322	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71	5.9	-176	-74.9	-148.5	-162.7	0	0	115.8	R262 M312 G313	R262-E316 IonicContact CZ-OE2 2.81Å; R262-E316 VanDerWaalsContact CZ-OE2 3.32Å; R262-E316 IonicContact NH1-OE2 3.71Å; R262-E316 PolarHBondContact NH1-OE2 2.99Å; R262-E316 VanDerWaalsContact NH2-CD 3.33Å; R262-E316 IonicContact NH2-OE1 2.79Å; R262-E316 PolarHBondContact NH2-OE1 3.48Å; R262-E316 VanDerWaalsContact NH2-OE1 3.17Å; R262-E316 IonicContact NH2-OE2 3.07Å; R262-E316 PolarHBondContact NH2-OE2 3.31Å; M312-E316 HydrophobicContact CB-CG 4.32Å; M312-E316 HydrophobicContact CE-CB 4.06Å; M312-E316 HydrophobicContact SD-CB 4.38Å; M312-E316 HydrophobicContact SD-CG 4.34Å; G313-E316 PolarHBondContact O-N 2.96Å
317	N	36.2	Very low	53	Low	173 Å²	173	102.7 Å²	102.7	93%	0.925	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	20.3	-179.9	-105.2	-0.1	0	0	0	115.1	E315	E315-N317 PolarHBondContact O-N 3.36Å
318	S	39.4	Very low	53.8	Low	94 Å²	94	106.2 Å²	106.2	66%	0.657	56%	0.562	S	S	*	*			trans	-139.6	44.4	-175.5	61.5	0	0	0	0	115.9	A320	S318-A320 PolarHBondContact O-N 2.89Å; S318-A320 VanDerWaalsContact O-N 3.07Å
319	L	42.3	Very low	54.9	Low	117 Å²	117	105.1 Å²	105.1	61%	0.613	56%	0.557	S	S	*	*			trans	-79.3	79.5	146.8	-106.7	134.6	0	0	0	108.1	T321	L319-T321 WeakPolarHBondContact CD2-OG1 3.1Å; L319-T321 PolarHBondContact O-N 3.43Å; L319-T321 PolarHBondContact O-OG1 3.2Å
320	A	38.6	Very low	56.2	Low	90 Å²	90	105.2 Å²	105.2	74%	0.744	54%	0.544	S	S	*	.			trans	-69.1	67	167.6	0	0	0	0	0	109.8	S318 Q322	S318-A320 PolarHBondContact O-N 2.89Å; S318-A320 VanDerWaalsContact O-N 3.07Å; A320-Q322 VanDerWaalsContact C-N 3.26Å; A320-Q322 PolarHBondContact O-N 3.42Å
321	T	44.4	Very low	57.4	Low	46 Å²	46	104.3 Å²	104.3	28%	0.282	54%	0.54	S	S	.	.			trans	-95.3	42.3	171.5	-7.4	0	0	0	0	110.1	L319 A323 L324	L319-T321 WeakPolarHBondContact CD2-OG1 3.1Å; L319-T321 PolarHBondContact O-N 3.43Å; L319-T321 PolarHBondContact O-OG1 3.2Å; T321-A323 PolarHBondContact O-N 3.43Å; T321-L324 HydrophobicContact CG2-CB 4.32Å; T321-L324 HydrophobicContact CG2-CD1 3.82Å
322	Q	43	Very low	58.6	Low	196 Å²	196	102.3 Å²	102.3	92%	0.916	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	1.8	-176.4	-77.8	-172.8	-7.9	0	0	114.4	A320	A320-Q322 VanDerWaalsContact C-N 3.26Å; A320-Q322 PolarHBondContact O-N 3.42Å
323	A	45.9	Very low	59.6	Low	81 Å²	81	106.9 Å²	106.9	67%	0.669	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.5	17.6	-172	0	0	0	0	0	116	T321	T321-A323 PolarHBondContact O-N 3.43Å
324	L	58.2	Low	61.3	Low	37 Å²	37	112.5 Å²	112.5	19%	0.194	59%	0.588	C	S	.	*	S	Bend	trans	-119.7	133.5	-178.1	-73.5	159.8	0	0	0	111.7	M154 T321 K326	M154-L324 HydrophobicContact CB-CD2 3.98Å; M154-L324 HydrophobicContact CG-CD2 3.35Å; T321-L324 HydrophobicContact CG2-CB 4.32Å; T321-L324 HydrophobicContact CG2-CD1 3.82Å; L324-K326 PolarHBondContact O-N 2.98Å
325	R	67.3	Low	63.3	Low	130 Å²	130	106.4 Å²	106.4	49%	0.491	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-56.6	128.4	172.9	-172.1	175.4	-176.3	-162.9	-5.8	109	W205 V209 E213	W205-R325 PolarHBondContact NE1-O 3.19Å; V209-R325 WeakPolarHBondContact CG2-O 3.45Å; E213-R325 IonicContact OE1-CZ 3.3Å; E213-R325 IonicContact OE1-NH1 3.12Å; E213-R325 IonicContact OE1-NH2 3.73Å; E213-R325 PolarHBondContact OE1-NH2 3.38Å; E213-R325 IonicContact OE2-CZ 3.84Å; E213-R325 VanDerWaalsContact OE2-CZ 3.26Å; E213-R325 IonicContact OE2-NH1 2.69Å; E213-R325 PolarHBondContact OE2-NH1 3.49Å; E213-R325 IonicContact OE2-NH2 3.71Å; E213-R325 PolarHBondContact OE2-NH2 3.2Å
326	K	74.2	Confident	65.6	Low	155 Å²	155	105.6 Å²	105.6	67%	0.674	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-81	142.2	-176	-52	-162	172.5	179.2	0	111.9	W205 L324	W205-K326 HydrophobicContact CH2-CG 4.42Å; W205-K326 HydrophobicContact CZ2-CB 3.95Å; W205-K326 HydrophobicContact CZ2-CG 3.89Å; L324-K326 PolarHBondContact O-N 2.98Å
327	P	82.5	Confident	67.8	Low	10 Å²	10	104 Å²	104	7%	0.065	55%	0.553	C	S	.	*	P	Polyproline II helix	trans	-64.7	150.4	168.6	28.9	-33.7	0	0	0	110	W205 Q208 V209 T270	W205-P327 VanDerWaalsContact CE2-CD 3.42Å; W205-P327 VanDerWaalsContact CZ2-CD 3.46Å; Q208-P327 HydrophobicContact CB-CB 4.08Å; V209-P327 HydrophobicContact CG2-CB 4.13Å; T270-P327 HydrophobicContact CG2-CB 4.18Å; T270-P327 HydrophobicContact CG2-CG 4.3Å
328	H	85.3	Confident	70.4	Confident	83 Å²	83	96 Å²	96	38%	0.384	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-76	127	176.5	-59.8	67.1	0	0	0	108.3	Q212 E213 K216 T270 V271	Q212-H328 PolarHBondContact NE2-O 2.96Å; Q212-H328 PolarHBondContact OE1-ND1 2.96Å; Q212-H328 VanDerWaalsContact OE1-ND1 3.14Å; E213-H328 IonicContact OE1-CE1 3.26Å; K216-H328 PolarHBondContact NZ-CE1 3.38Å; K216-H328 PolarHBondContact NZ-ND1 3.14Å; K216-H328 PolarHBondContact NZ-NE2 3.42Å; K216-H328 VanDerWaalsContact NZ-NE2 3.12Å; T270-H328 WeakPolarHBondContact CA-O 3.49Å; V271-H328 HydrophobicContact CG2-CB 4.18Å; V271-H328 PolarHBondContact N-O 3.05Å
329	L	87.1	Confident	72.7	Confident	49 Å²	49	99.1 Å²	99.1	26%	0.257	51%	0.512	S	S	.	.	B	Isolated β-bridge	trans	-103.3	159.6	178.6	-54.9	-178.7	0	0	0	110.2	R269 T270 E331	R269-L329 HydrophobicContact CB-CD2 4.46Å; R269-L329 WeakPolarHBondContact O-CA 3.46Å; T270-L329 HydrophobicContact CG2-CD2 3.73Å; L329-E331 HydrophobicContact CB-CG 4.27Å; L329-E331 PolarHBondContact O-N 2.7Å
330	Y	86.4	Confident	74.9	Confident	109 Å²	109	95.3 Å²	95.3	43%	0.427	49%	0.493	S	S	.	.			trans	-66.9	111.5	165.3	-66.9	-73	0	0	0	109.4	R269 T270 V271 E272	R269-Y330 VanDerWaalsContact O-CD2 3.26Å; R269-Y330 WeakPolarHBondContact O-CD2 3.37Å; R269-Y330 PolarHBondContact O-N 3.49Å; T270-Y330 WeakPolarHBondContact O-CE2 3.37Å; V271-Y330 HydrophobicContact CG1-CE1 4.47Å; V271-Y330 HydrophobicContact CG2-CD1 4.34Å; V271-Y330 HydrophobicContact CG2-CE1 4.39Å; E272-Y330 WeakPolarHBondContact CB-OH 3.41Å; E272-Y330 PolarHBondContact N-OH 2.83Å
331	E	82	Confident	77.4	Confident	159 Å²	159	91 Å²	91	74%	0.743	46%	0.457	S	S	*	.			trans	-128.5	136.5	-178.1	-66.8	180	178.6	0	0	110.2	L329	L329-E331 HydrophobicContact CB-CG 4.27Å; L329-E331 PolarHBondContact O-N 2.7Å
332	G	80.2	Confident	79.5	Confident	46 Å²	46	89.3 Å²	89.3	47%	0.474	45%	0.446	S	S	.	.			trans	164.4	137.6	177.4	0	0	0	0	0	112.2	N334 L335	G332-N334 PolarHBondContact O-N 2.91Å; G332-N334 VanDerWaalsContact O-N 3.17Å; G332-L335 WeakPolarHBondContact O-CB 3.5Å; G332-L335 WeakPolarHBondContact O-CG 3.06Å; G332-L335 PolarHBondContact O-N 2.9Å; G332-L335 VanDerWaalsContact O-N 3.17Å
333	D	77.6	Confident	81.8	Confident	173 Å²	173	83 Å²	83	93%	0.925	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-20.6	-173.9	-60.8	-25.3	0	0	0	113.7
334	N	87.1	Confident	84.1	Confident	167 Å²	167	79.5 Å²	79.5	89%	0.893	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	8.4	-179.4	-64.4	-28.3	0	0	0	113.5	G332	G332-N334 PolarHBondContact O-N 2.91Å; G332-N334 VanDerWaalsContact O-N 3.17Å
335	L	86.9	Confident	85.8	Confident	98 Å²	98	77.7 Å²	77.7	51%	0.513	38%	0.377	S	S	.	.	S	Bend	trans	-75.3	137.5	176.9	-65.5	177.9	0	0	0	110.5	G332 C337	G332-L335 WeakPolarHBondContact O-CB 3.5Å; G332-L335 WeakPolarHBondContact O-CG 3.06Å; G332-L335 PolarHBondContact O-N 2.9Å; G332-L335 VanDerWaalsContact O-N 3.17Å; L335-C337 PolarHBondContact O-N 3.35Å
336	Y	90.5	Very high	87	Confident	136 Å²	136	73.3 Å²	73.3	53%	0.533	36%	0.363	S	S	.	.			trans	-68.3	131.9	175.1	176.7	-104.6	0	0	0	110.5	P338 E343 L347	Y336-P338 HydrophobicContact CE1-CG 4.07Å; Y336-E343 PolarHBondContact OH-OE2 3.05Å; Y336-L347 HydrophobicContact CD1-CD2 4.09Å; Y336-L347 HydrophobicContact CE1-CD2 4.29Å
337	C	88.6	Confident	88	Confident	34 Å²	34	68.8 Å²	68.8	23%	0.23	35%	0.346	C	S	.	.			trans	-124.1	120.2	176.8	-170.3	0	0	0	0	109.5	S302 L304 L335	S302-C337 PolarHBondContact OG-SG 3.37Å; L304-C337 HydrophobicContact CD1-CB 4.22Å; L335-C337 PolarHBondContact O-N 3.35Å
338	P	91.6	Very high	88.5	Confident	6 Å²	6	69 Å²	69	4%	0.039	35%	0.346	C	S	.	.			trans	-61.1	136.1	179.8	-25.7	35.3	0	0	0	113.4	Y300 Y336 E343 E344 L347	Y300-P338 PolarHBondContact OH-O 2.99Å; Y336-P338 HydrophobicContact CE1-CG 4.07Å; P338-E343 HydrophobicContact CB-CB 4.1Å; P338-E344 HydrophobicContact CB-CB 3.61Å; P338-E344 HydrophobicContact CB-CG 4.23Å; P338-E344 HydrophobicContact CG-CB 3.96Å; P338-E344 HydrophobicContact CG-CG 4.13Å; P338-L347 HydrophobicContact CG-CD2 3.75Å
339	K	87.6	Confident	88.9	Confident	160 Å²	160	65 Å²	65	70%	0.696	33%	0.328	S	S	*	.			trans	-100.7	-20.4	-178.2	-63.4	-177.2	-179	177.3	0	113.7	Y300 E343	Y300-K339 WeakPolarHBondContact CD1-O 3.44Å; Y300-K339 WeakPolarHBondContact CE1-O 3.33Å; K339-E343 WeakPolarHBondContact CB-OE2 3.31Å; K339-E343 PolarHBondContact N-OE2 3.16Å
340	D	88	Confident	89.1	Confident	37 Å²	37	65.4 Å²	65.4	20%	0.198	33%	0.33	C	S	.	.	S	Bend	trans	-134.3	171.5	175.9	73.8	33.7	0	0	0	112.2	Y300 I342 E343 E344 R393	Y300-D340 VanDerWaalsContact CE2-C 3.47Å; Y300-D340 WeakPolarHBondContact CE2-O 3.3Å; Y300-D340 VanDerWaalsContact CZ-C 3.44Å; Y300-D340 VanDerWaalsContact CZ-O 3.3Å; Y300-D340 PolarHBondContact OH-O 3.46Å; D340-I342 VanDerWaalsContact C-N 3.29Å; D340-I342 PolarHBondContact O-N 2.95Å; D340-I342 WeakPolarHBondContact OD1-CA 3.27Å; D340-I342 PolarHBondContact OD1-N 3.28Å; D340-E343 WeakPolarHBondContact OD1-CB 3.48Å; D340-E343 WeakPolarHBondContact OD1-CG 3.46Å; D340-E343 PolarHBondContact OD1-N 3.46Å; D340-E344 PolarHBondContact O-N 2.73Å; D340-E344 VanDerWaalsContact O-N 3.12Å; D340-R393 IonicContact OD1-NH2 2.73Å; D340-R393 IonicContact OD2-CZ 3.82Å; D340-R393 IonicContact OD2-NH2 3.61Å; D340-R393 PolarHBondContact OD2-NH2 2.82Å
341	N	89.8	Confident	89.3	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.9	-32	-179.6	58.6	-20.6	0	0	0	113.2	L291 Y300 A345	L291-N341 HydrophobicContact CD2-CB 4.46Å; Y300-N341 HydrophobicContact CD2-CB 3.77Å; Y300-N341 HydrophobicContact CE2-CB 4.37Å; Y300-N341 HydrophobicContact CG-CB 4.37Å; N341-A345 VanDerWaalsContact O-CB 3.22Å; N341-A345 WeakPolarHBondContact O-CB 3.46Å; N341-A345 PolarHBondContact O-N 2.91Å
342	I	90.3	Very high	89.6	Confident	10 Å²	10	55.7 Å²	55.7	5%	0.051	29%	0.29	C	S	.	.	H	α-helix	trans	-79.8	-40.9	-176.5	-67	165.4	0	0	0	110.5	D340 A345 L346 R393	D340-I342 VanDerWaalsContact C-N 3.29Å; D340-I342 PolarHBondContact O-N 2.95Å; D340-I342 WeakPolarHBondContact OD1-CA 3.27Å; D340-I342 PolarHBondContact OD1-N 3.28Å; I342-A345 PolarHBondContact O-N 3.27Å; I342-L346 WeakPolarHBondContact O-CB 3.3Å; I342-L346 PolarHBondContact O-N 3.47Å; I342-R393 HydrophobicContact CD1-CG 4.02Å; I342-R393 VanDerWaalsContact CD1-CZ 3.49Å; I342-R393 HydrophobicContact CG2-CG 3.76Å
343	E	91.4	Very high	89.9	Confident	62 Å²	62	53.6 Å²	53.6	29%	0.29	27%	0.268	S	S	.	.	H	α-helix	trans	-58.8	-46.7	171.5	-76	-175.2	177.8	0	0	110.6	Y336 P338 K339 D340 L346 L347	Y336-E343 PolarHBondContact OH-OE2 3.05Å; P338-E343 HydrophobicContact CB-CB 4.1Å; K339-E343 WeakPolarHBondContact CB-OE2 3.31Å; K339-E343 PolarHBondContact N-OE2 3.16Å; D340-E343 WeakPolarHBondContact OD1-CB 3.48Å; D340-E343 WeakPolarHBondContact OD1-CG 3.46Å; D340-E343 PolarHBondContact OD1-N 3.46Å; E343-L346 PolarHBondContact O-N 3.19Å; E343-L347 WeakPolarHBondContact O-CB 3.48Å; E343-L347 PolarHBondContact O-N 3.25Å
344	E	93.6	Very high	90.2	Very high	8 Å²	8	47.7 Å²	47.7	4%	0.037	24%	0.24	C	C	.	.	H	α-helix	trans	-66.1	-47	178.2	-169	179.7	-173.2	0	0	110.5	R265 L291 Y300 P338 D340 L346 L347 L348	R265-E344 IonicContact CZ-OE1 3.9Å; R265-E344 IonicContact CZ-OE2 3.7Å; R265-E344 IonicContact NE-OE1 2.77Å; R265-E344 PolarHBondContact NE-OE1 2.83Å; R265-E344 IonicContact NE-OE2 3.95Å; R265-E344 PolarHBondContact NE-OE2 3.01Å; R265-E344 IonicContact NH2-OE1 2.79Å; R265-E344 IonicContact NH2-OE2 3.05Å; R265-E344 PolarHBondContact NH2-OE2 3.38Å; L291-E344 HydrophobicContact CD1-CB 3.9Å; L291-E344 HydrophobicContact CD1-CG 3.69Å; L291-E344 WeakPolarHBondContact CD2-OE2 3.48Å; Y300-E344 HydrophobicContact CE2-CB 4.21Å; Y300-E344 WeakPolarHBondContact CE2-OE2 3.36Å; Y300-E344 PolarHBondContact OH-OE2 3.5Å; P338-E344 HydrophobicContact CB-CB 3.61Å; P338-E344 HydrophobicContact CB-CG 4.23Å; P338-E344 HydrophobicContact CG-CB 3.96Å; P338-E344 HydrophobicContact CG-CG 4.13Å; D340-E344 PolarHBondContact O-N 2.73Å; D340-E344 VanDerWaalsContact O-N 3.12Å; E344-L346 VanDerWaalsContact C-N 3.34Å; E344-L346 PolarHBondContact O-N 3.29Å; E344-L347 PolarHBondContact O-N 3.41Å; E344-L348 HydrophobicContact CG-CD1 3.93Å; E344-L348 HydrophobicContact CG-CG 4.38Å; E344-L348 WeakPolarHBondContact O-CB 3.32Å; E344-L348 WeakPolarHBondContact O-CG 2.96Å; E344-L348 PolarHBondContact O-N 3.38Å
345	A	93.6	Very high	89.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.2	-43	177.3	0	0	0	0	0	111.9	A288 L291 L292 N341 I342 L348 L349 T389	A288-A345 HydrophobicContact CB-CB 4.32Å; L291-A345 HydrophobicContact CB-CB 4.44Å; L291-A345 HydrophobicContact CD1-CB 4.45Å; L292-A345 HydrophobicContact CD1-CB 4.19Å; L292-A345 HydrophobicContact CD2-CB 4Å; L292-A345 HydrophobicContact CG-CB 3.97Å; N341-A345 VanDerWaalsContact O-CB 3.22Å; N341-A345 WeakPolarHBondContact O-CB 3.46Å; N341-A345 PolarHBondContact O-N 2.91Å; I342-A345 PolarHBondContact O-N 3.27Å; A345-L348 PolarHBondContact O-N 3.33Å; A345-L349 WeakPolarHBondContact O-CB 3.35Å; A345-L349 WeakPolarHBondContact O-CD1 3.12Å; A345-L349 WeakPolarHBondContact O-CG 3.3Å; A345-L349 PolarHBondContact O-N 3.32Å; A345-T389 HydrophobicContact CB-CG2 3.77Å
346	L	93.6	Very high	89	Confident	37 Å²	37	37.3 Å²	37.3	19%	0.194	19%	0.187	C	C	.	.	H	α-helix	trans	-63.4	-46.6	178	-178	62.1	0	0	0	111.3	I342 E343 E344 L348 L349 L350 L386 L390 M398	I342-L346 WeakPolarHBondContact O-CB 3.3Å; I342-L346 PolarHBondContact O-N 3.47Å; E343-L346 PolarHBondContact O-N 3.19Å; E344-L346 VanDerWaalsContact C-N 3.34Å; E344-L346 PolarHBondContact O-N 3.29Å; L346-L348 VanDerWaalsContact C-N 3.35Å; L346-L348 PolarHBondContact O-N 2.91Å; L346-L349 PolarHBondContact O-N 3.1Å; L346-L350 HydrophobicContact CD1-CD1 4.17Å; L346-L350 HydrophobicContact CD1-CG 4.17Å; L346-L350 HydrophobicContact CG-CD1 4.01Å; L346-L350 HydrophobicContact CG-CG 4.42Å; L346-L350 WeakPolarHBondContact O-CB 3.49Å; L346-L350 VanDerWaalsContact O-CG 3.25Å; L346-L350 WeakPolarHBondContact O-CG 3.5Å; L346-L350 PolarHBondContact O-N 3.39Å; L346-L386 HydrophobicContact CD1-CD2 3.87Å; L346-L390 HydrophobicContact CD1-CD2 3.95Å; L346-L390 HydrophobicContact CD1-CG 4.3Å; L346-L390 HydrophobicContact CD2-CD2 4.3Å; L346-M398 HydrophobicContact CD1-CE 4.12Å; L346-M398 HydrophobicContact CD2-CE 4.22Å
347	L	94	Very high	87.9	Confident	61 Å²	61	33.2 Å²	33.2	32%	0.319	18%	0.176	S	C	.	.	H	α-helix	trans	-57.4	-48.7	176.4	177.6	63.7	0	0	0	111.2	Y336 P338 E343 E344 L349 L350 I351	Y336-L347 HydrophobicContact CD1-CD2 4.09Å; Y336-L347 HydrophobicContact CE1-CD2 4.29Å; P338-L347 HydrophobicContact CG-CD2 3.75Å; E343-L347 WeakPolarHBondContact O-CB 3.48Å; E343-L347 PolarHBondContact O-N 3.25Å; E344-L347 PolarHBondContact O-N 3.41Å; L347-L349 PolarHBondContact O-N 3.38Å; L347-L350 PolarHBondContact O-N 3.03Å; L347-I351 HydrophobicContact CD1-CD1 4.16Å; L347-I351 HydrophobicContact CG-CD1 4.04Å; L347-I351 VanDerWaalsContact O-CG1 3.26Å; L347-I351 WeakPolarHBondContact O-CG1 3.49Å; L347-I351 PolarHBondContact O-N 3.2Å
348	L	94.2	Very high	86.9	Confident	13 Å²	13	40 Å²	40	7%	0.068	20%	0.197	C	C	.	.	H	α-helix	trans	-63	-41.1	-179.9	-69.1	170.5	0	0	0	112.5	L268 A284 L287 A288 L291 E344 A345 L346 S352	L268-L348 HydrophobicContact CD1-CD2 3.86Å; A284-L348 HydrophobicContact CB-CB 4.22Å; A284-L348 HydrophobicContact CB-CD2 3.93Å; L287-L348 HydrophobicContact CB-CD1 3.91Å; L287-L348 HydrophobicContact CD2-CD1 3.6Å; L287-L348 HydrophobicContact CD2-CD2 4.36Å; L287-L348 HydrophobicContact CG-CD1 3.6Å; A288-L348 HydrophobicContact CB-CB 4.2Å; A288-L348 HydrophobicContact CB-CD1 4.45Å; L291-L348 HydrophobicContact CD1-CD1 3.79Å; E344-L348 HydrophobicContact CG-CD1 3.93Å; E344-L348 HydrophobicContact CG-CG 4.38Å; E344-L348 WeakPolarHBondContact O-CB 3.32Å; E344-L348 WeakPolarHBondContact O-CG 2.96Å; E344-L348 PolarHBondContact O-N 3.38Å; A345-L348 PolarHBondContact O-N 3.33Å; L346-L348 VanDerWaalsContact C-N 3.35Å; L346-L348 PolarHBondContact O-N 2.91Å; L348-S352 WeakPolarHBondContact O-CB 3.1Å; L348-S352 PolarHBondContact O-N 2.97Å; L348-S352 PolarHBondContact O-OG 3.04Å
349	L	93.3	Very high	85.2	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-70.7	-38.1	178.7	-69.2	168.4	0	0	0	112	A288 A345 L346 L347 S352 E353 I382 L385 L386 T389	A288-L349 HydrophobicContact CB-CD1 4.31Å; A288-L349 HydrophobicContact CB-CD2 3.83Å; A288-L349 HydrophobicContact CB-CG 3.75Å; A345-L349 WeakPolarHBondContact O-CB 3.35Å; A345-L349 WeakPolarHBondContact O-CD1 3.12Å; A345-L349 WeakPolarHBondContact O-CG 3.3Å; A345-L349 PolarHBondContact O-N 3.32Å; L346-L349 PolarHBondContact O-N 3.1Å; L347-L349 PolarHBondContact O-N 3.38Å; L349-S352 PolarHBondContact O-N 2.73Å; L349-E353 VanDerWaalsContact O-CB 3.3Å; L349-E353 WeakPolarHBondContact O-CB 3.3Å; L349-E353 PolarHBondContact O-N 3.37Å; L349-I382 HydrophobicContact CD2-CG2 4.17Å; L349-L385 HydrophobicContact CD1-CB 3.77Å; L349-L385 HydrophobicContact CD2-CB 3.65Å; L349-L385 HydrophobicContact CD2-CD1 3.92Å; L349-L385 HydrophobicContact CD2-CG 4.46Å; L349-L385 HydrophobicContact CG-CB 4.38Å; L349-L386 HydrophobicContact CB-CD2 3.52Å; L349-L386 HydrophobicContact CB-CG 3.87Å; L349-L386 HydrophobicContact CD1-CD2 3.92Å; L349-L386 HydrophobicContact CD1-CG 4.09Å; L349-L386 HydrophobicContact CG-CD2 4.36Å; L349-L386 HydrophobicContact CG-CG 4.5Å; L349-T389 HydrophobicContact CD1-CG2 3.77Å
350	L	91.3	Very high	83.6	Confident	57 Å²	57	36.6 Å²	36.6	30%	0.298	19%	0.187	S	C	.	.	H	α-helix	trans	-65.5	-39.5	174.4	-71.1	174	0	0	0	111.9	L346 L347 E353 S354 M398	L346-L350 HydrophobicContact CD1-CD1 4.17Å; L346-L350 HydrophobicContact CD1-CG 4.17Å; L346-L350 HydrophobicContact CG-CD1 4.01Å; L346-L350 HydrophobicContact CG-CG 4.42Å; L346-L350 WeakPolarHBondContact O-CB 3.49Å; L346-L350 VanDerWaalsContact O-CG 3.25Å; L346-L350 WeakPolarHBondContact O-CG 3.5Å; L346-L350 PolarHBondContact O-N 3.39Å; L347-L350 PolarHBondContact O-N 3.03Å; L350-E353 PolarHBondContact O-N 3.47Å; L350-S354 WeakPolarHBondContact O-CB 3.3Å; L350-S354 PolarHBondContact O-N 3.23Å; L350-S354 PolarHBondContact O-OG 3.44Å; L350-M398 HydrophobicContact CD1-CE 4.26Å; L350-M398 HydrophobicContact CD2-CE 4.49Å
351	I	89.7	Confident	81.9	Confident	64 Å²	64	38.4 Å²	38.4	33%	0.328	20%	0.199	S	C	.	.	H	α-helix	trans	-59.3	-50.5	171.6	-68.9	165.2	0	0	0	109.4	L347 E353 S354 M355	L347-I351 HydrophobicContact CD1-CD1 4.16Å; L347-I351 HydrophobicContact CG-CD1 4.04Å; L347-I351 VanDerWaalsContact O-CG1 3.26Å; L347-I351 WeakPolarHBondContact O-CG1 3.49Å; L347-I351 PolarHBondContact O-N 3.2Å; I351-E353 VanDerWaalsContact C-N 3.34Å; I351-E353 PolarHBondContact O-N 3.34Å; I351-S354 PolarHBondContact O-N 3.44Å; I351-S354 PolarHBondContact O-OG 3.22Å; I351-M355 HydrophobicContact CG2-CE 3.93Å; I351-M355 HydrophobicContact CG2-SD 4.18Å; I351-M355 WeakPolarHBondContact O-CG 3.47Å; I351-M355 PolarHBondContact O-N 3.38Å
352	S	88.3	Confident	80	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.4	-42.2	-179.5	-56.4	0	0	0	0	112.2	V281 A284 L348 L349 M355 A356	V281-S352 PolarHBondContact O-OG 3.03Å; A284-S352 WeakPolarHBondContact CB-OG 3.43Å; L348-S352 WeakPolarHBondContact O-CB 3.1Å; L348-S352 PolarHBondContact O-N 2.97Å; L348-S352 PolarHBondContact O-OG 3.04Å; L349-S352 PolarHBondContact O-N 2.73Å; S352-M355 PolarHBondContact O-N 3.31Å; S352-A356 VanDerWaalsContact O-CB 3.26Å; S352-A356 WeakPolarHBondContact O-CB 3.38Å; S352-A356 PolarHBondContact O-N 2.97Å
353	E	87.1	Confident	77.8	Confident	3 Å²	3	46 Å²	46	1%	0.014	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-47.1	177.2	-171.6	-160.7	-170.1	0	0	111.7	L349 L350 I351 M355 A356 T357 I382 Y383 R405	L349-E353 VanDerWaalsContact O-CB 3.3Å; L349-E353 WeakPolarHBondContact O-CB 3.3Å; L349-E353 PolarHBondContact O-N 3.37Å; L350-E353 PolarHBondContact O-N 3.47Å; I351-E353 VanDerWaalsContact C-N 3.34Å; I351-E353 PolarHBondContact O-N 3.34Å; E353-M355 PolarHBondContact O-N 2.92Å; E353-A356 PolarHBondContact O-N 3.29Å; E353-T357 HydrophobicContact CG-CG2 4.47Å; E353-T357 WeakPolarHBondContact O-CB 3.27Å; E353-T357 WeakPolarHBondContact O-CG2 3.38Å; E353-T357 PolarHBondContact O-N 3.46Å; E353-T357 PolarHBondContact O-OG1 3.41Å; E353-I382 HydrophobicContact CB-CG2 4.24Å; E353-Y383 HydrophobicContact CG-CE1 4.11Å; E353-Y383 WeakPolarHBondContact CG-OH 3.43Å; E353-Y383 WeakPolarHBondContact OE1-CE1 3.47Å; E353-Y383 VanDerWaalsContact OE1-CZ 3.27Å; E353-Y383 PolarHBondContact OE1-OH 2.97Å; E353-R405 VanDerWaalsContact CD-CZ 3.46Å; E353-R405 VanDerWaalsContact CD-NH2 3.34Å; E353-R405 IonicContact OE1-CZ 2.6Å; E353-R405 IonicContact OE1-NE 2.7Å; E353-R405 IonicContact OE1-NH1 2.87Å; E353-R405 PolarHBondContact OE1-NH1 3.35Å; E353-R405 IonicContact OE1-NH2 3.06Å; E353-R405 PolarHBondContact OE1-NH2 2.98Å; E353-R405 IonicContact OE2-CZ 3.15Å; E353-R405 IonicContact OE2-NH1 2.75Å; E353-R405 PolarHBondContact OE2-NH1 3.19Å; E353-R405 IonicContact OE2-NH2 2.67Å; E353-R405 PolarHBondContact OE2-NH2 3.5Å
354	S	83.8	Confident	76	Confident	49 Å²	49	46.7 Å²	46.7	34%	0.343	25%	0.247	S	C	.	.	H	α-helix	trans	-62.3	-26.8	-178.1	76.9	0	0	0	0	113.4	L350 I351 T357 R358	L350-S354 WeakPolarHBondContact O-CB 3.3Å; L350-S354 PolarHBondContact O-N 3.23Å; L350-S354 PolarHBondContact O-OG 3.44Å; I351-S354 PolarHBondContact O-N 3.44Å; I351-S354 PolarHBondContact O-OG 3.22Å; S354-T357 PolarHBondContact O-OG1 3.41Å; S354-R358 WeakPolarHBondContact O-CG 3.48Å; S354-R358 PolarHBondContact O-NE 3.48Å
355	M	75.9	Confident	74	Confident	29 Å²	29	50.3 Å²	50.3	14%	0.143	27%	0.27	C	S	.	.	H	α-helix	trans	-90.4	-43.1	178.2	-66.8	-179.6	177.7	0	0	111.1	E272 V281 I351 S352 E353 T357 R358	E272-M355 WeakPolarHBondContact OE1-CE 3.46Å; E272-M355 WeakPolarHBondContact OE2-CE 3.17Å; V281-M355 HydrophobicContact CG2-CB 3.29Å; V281-M355 HydrophobicContact CG2-CG 3.9Å; V281-M355 HydrophobicContact CG2-SD 3.31Å; V281-M355 WeakPolarHBondContact CG2-SD 3.24Å; I351-M355 HydrophobicContact CG2-CE 3.93Å; I351-M355 HydrophobicContact CG2-SD 4.18Å; I351-M355 WeakPolarHBondContact O-CG 3.47Å; I351-M355 PolarHBondContact O-N 3.38Å; S352-M355 PolarHBondContact O-N 3.31Å; E353-M355 PolarHBondContact O-N 2.92Å; M355-T357 VanDerWaalsContact C-N 3.28Å; M355-T357 PolarHBondContact O-N 3.25Å; M355-R358 WeakPolarHBondContact O-CB 3.5Å; M355-R358 PolarHBondContact O-N 2.99Å
356	A	71.7	Confident	72.1	Confident	17 Å²	17	55.8 Å²	55.8	14%	0.14	31%	0.305	C	S	.	.	H	α-helix	trans	-58.7	-39.6	176.2	0	0	0	0	0	112.1	S352 E353 R358 D359 V360 I382	S352-A356 VanDerWaalsContact O-CB 3.26Å; S352-A356 WeakPolarHBondContact O-CB 3.38Å; S352-A356 PolarHBondContact O-N 2.97Å; E353-A356 PolarHBondContact O-N 3.29Å; A356-R358 PolarHBondContact O-N 3.22Å; A356-D359 PolarHBondContact O-N 3.17Å; A356-D359 VanDerWaalsContact O-N 3.16Å; A356-V360 VanDerWaalsContact O-CG2 3.24Å; A356-V360 WeakPolarHBondContact O-CG2 3.5Å; A356-V360 PolarHBondContact O-N 3.45Å; A356-V360 VanDerWaalsContact O-N 3.09Å; A356-I382 HydrophobicContact CB-CD1 4.12Å
357	T	68.9	Low	70.4	Confident	51 Å²	51	62.5 Å²	62.5	31%	0.313	34%	0.336	S	S	.	.	H	α-helix	trans	-64.4	-19.5	176.9	47.8	0	0	0	0	114.4	E353 S354 M355 F409	E353-T357 HydrophobicContact CG-CG2 4.47Å; E353-T357 WeakPolarHBondContact O-CB 3.27Å; E353-T357 WeakPolarHBondContact O-CG2 3.38Å; E353-T357 PolarHBondContact O-N 3.46Å; E353-T357 PolarHBondContact O-OG1 3.41Å; S354-T357 PolarHBondContact O-OG1 3.41Å; M355-T357 VanDerWaalsContact C-N 3.28Å; M355-T357 PolarHBondContact O-N 3.25Å; T357-F409 HydrophobicContact CG2-CE2 3.81Å; T357-F409 HydrophobicContact CG2-CZ 3.88Å
358	R	67	Low	68.6	Low	177 Å²	177	63.5 Å²	63.5	67%	0.668	34%	0.338	S	S	*	.	H	α-helix	trans	-79.9	-33	174.7	-63.2	174.1	-176.1	-178.1	0.4	112.2	S354 M355 A356	S354-R358 WeakPolarHBondContact O-CG 3.48Å; S354-R358 PolarHBondContact O-NE 3.48Å; M355-R358 WeakPolarHBondContact O-CB 3.5Å; M355-R358 PolarHBondContact O-N 2.99Å; A356-R358 PolarHBondContact O-N 3.22Å
359	D	57	Low	67	Low	68 Å²	68	69.5 Å²	69.5	36%	0.364	37%	0.366	S	S	.	.	H	α-helix	trans	-88.2	-23.5	-176.7	-81.4	-9.5	0	0	0	114	N278 A356 V361 R364	N278-D359 PolarHBondContact OD1-OD2 2.98Å; A356-D359 PolarHBondContact O-N 3.17Å; A356-D359 VanDerWaalsContact O-N 3.16Å; D359-V361 PolarHBondContact O-N 2.85Å; D359-R364 PolarHBondContact O-NH2 3.18Å; D359-R364 VanDerWaalsContact O-NH2 3.17Å
360	V	53.8	Low	65.7	Low	25 Å²	25	77.3 Å²	77.3	15%	0.152	40%	0.403	C	S	.	.			trans	-75.5	67.8	175.6	-176.1	0	0	0	0	109.4	A356 L362 F409	A356-V360 VanDerWaalsContact O-CG2 3.24Å; A356-V360 WeakPolarHBondContact O-CG2 3.5Å; A356-V360 PolarHBondContact O-N 3.45Å; A356-V360 VanDerWaalsContact O-N 3.09Å; V360-L362 PolarHBondContact O-N 3.29Å; V360-F409 HydrophobicContact CB-CD1 4.06Å; V360-F409 HydrophobicContact CB-CE1 4.16Å; V360-F409 HydrophobicContact CG1-CB 4.15Å; V360-F409 HydrophobicContact CG1-CD1 3.37Å; V360-F409 HydrophobicContact CG1-CE1 3.97Å; V360-F409 HydrophobicContact CG1-CG 3.91Å
361	V	51.4	Low	64.3	Low	75 Å²	75	79 Å²	79	46%	0.455	41%	0.409	S	S	.	.			trans	-74.9	104.5	167.4	176.5	0	0	0	0	107.2	D359 S363 R364	D359-V361 PolarHBondContact O-N 2.85Å; V361-S363 WeakPolarHBondContact CG1-OG 3.48Å; V361-S363 PolarHBondContact O-N 3.09Å; V361-R364 PolarHBondContact O-N 3.44Å
362	L	50.8	Low	63.2	Low	74 Å²	74	80.7 Å²	80.7	39%	0.387	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-5.3	174.4	-77.3	158.6	0	0	0	114.3	V360 K408 F409 F411	V360-L362 PolarHBondContact O-N 3.29Å; L362-K408 WeakPolarHBondContact CD1-O 3.27Å; L362-F409 HydrophobicContact CD1-CD1 4.11Å; L362-F409 HydrophobicContact CG-CD1 4.27Å; L362-F411 HydrophobicContact CD2-CE2 4.01Å
363	S	43.7	Very low	62.4	Low	97 Å²	97	83.8 Å²	83.8	68%	0.678	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	38.1	-178.1	72.5	0	0	0	0	114	V361	V361-S363 WeakPolarHBondContact CG1-OG 3.48Å; V361-S363 PolarHBondContact O-N 3.09Å
364	R	53.2	Low	61.7	Low	75 Å²	75	87.2 Å²	87.2	28%	0.283	45%	0.451	S	S	.	.			trans	-74.6	142.8	164.9	-67	-169.9	-170.3	-168	6.1	110.1	D359 V361 E371	D359-R364 PolarHBondContact O-NH2 3.18Å; D359-R364 VanDerWaalsContact O-NH2 3.17Å; V361-R364 PolarHBondContact O-N 3.44Å; R364-E371 IonicContact NH1-OE2 2.97Å; R364-E371 PolarHBondContact NH1-OE2 3Å
365	V	51.3	Low	61.2	Low	85 Å²	85	86.5 Å²	86.5	52%	0.515	45%	0.446	S	S	.	.			trans	-61.1	145.1	-179.8	-170	0	0	0	0	108.9	E367 Q368	V365-E367 HydrophobicContact CG1-CG 4.44Å; V365-E367 PolarHBondContact O-N 3.49Å; V365-Q368 PolarHBondContact O-N 3.42Å
366	P	55	Low	61	Low	115 Å²	115	87.9 Å²	87.9	75%	0.747	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-53.4	-15.2	179.5	12.8	-28	0	0	0	115.7	Q368	P366-Q368 PolarHBondContact O-N 3.16Å
367	E	56.3	Low	61.4	Low	178 Å²	178	93.4 Å²	93.4	83%	0.832	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-72.3	-10.5	174.9	-64.4	168.7	176.5	0	0	113.9	V365	V365-E367 HydrophobicContact CG1-CG 4.44Å; V365-E367 PolarHBondContact O-N 3.49Å
368	Q	56.5	Low	61.8	Low	81 Å²	81	93.1 Å²	93.1	38%	0.379	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-114.9	32.5	179.6	-66.8	-177.3	-35.1	0	0	113.3	V365 P366 E370 E371 R372	V365-Q368 PolarHBondContact O-N 3.42Å; P366-Q368 PolarHBondContact O-N 3.16Å; Q368-E370 VanDerWaalsContact C-N 3.33Å; Q368-E370 PolarHBondContact O-N 2.85Å; Q368-E371 PolarHBondContact O-N 3.01Å; Q368-R372 PolarHBondContact O-N 3.07Å
369	E	61.8	Low	62.4	Low	140 Å²	140	85.3 Å²	85.3	65%	0.654	45%	0.446	S	S	*	.	H	α-helix	trans	-59.6	-40.1	-177.2	-169.2	169.3	-168.7	0	0	112.8	E371 R372 T373	E369-E371 PolarHBondContact O-N 3.33Å; E369-R372 WeakPolarHBondContact O-CB 3.46Å; E369-R372 PolarHBondContact O-N 3.03Å; E369-T373 WeakPolarHBondContact O-CG2 3.47Å; E369-T373 PolarHBondContact O-N 3.49Å
370	E	64.9	Low	63.6	Low	163 Å²	163	83.8 Å²	83.8	76%	0.762	44%	0.443	S	S	*	.	H	α-helix	trans	-61.5	-46.7	178.2	-67.3	-177.9	175.4	0	0	112.2	Q368 R372 T373 V374	Q368-E370 VanDerWaalsContact C-N 3.33Å; Q368-E370 PolarHBondContact O-N 2.85Å; E370-R372 VanDerWaalsContact C-N 3.27Å; E370-R372 PolarHBondContact O-N 3.5Å; E370-T373 PolarHBondContact O-N 3.42Å; E370-T373 PolarHBondContact O-OG1 3.38Å; E370-V374 WeakPolarHBondContact O-CG2 3.44Å; E370-V374 PolarHBondContact O-N 3.31Å; E370-V374 VanDerWaalsContact O-N 3.08Å
371	E	62.6	Low	65.2	Low	94 Å²	94	84.1 Å²	84.1	44%	0.439	45%	0.449	S	S	.	.	H	α-helix	trans	-61.8	-37.9	176.9	-65.9	-179.2	-177.2	0	0	111.9	R364 Q368 E369 V374 S375	R364-E371 IonicContact NH1-OE2 2.97Å; R364-E371 PolarHBondContact NH1-OE2 3Å; Q368-E371 PolarHBondContact O-N 3.01Å; E369-E371 PolarHBondContact O-N 3.33Å; E371-V374 PolarHBondContact O-N 3.48Å; E371-S375 WeakPolarHBondContact O-CB 3.35Å; E371-S375 PolarHBondContact O-N 3.36Å; E371-S375 PolarHBondContact O-OG 2.98Å
372	R	66.9	Low	67	Low	99 Å²	99	80.7 Å²	80.7	37%	0.374	43%	0.428	S	S	.	.	H	α-helix	trans	-63.3	-42.8	176.4	-176.6	-179.2	177.8	156.6	1.6	111.6	Q368 E369 E370 S375 L376	Q368-R372 PolarHBondContact O-N 3.07Å; E369-R372 WeakPolarHBondContact O-CB 3.46Å; E369-R372 PolarHBondContact O-N 3.03Å; E370-R372 VanDerWaalsContact C-N 3.27Å; E370-R372 PolarHBondContact O-N 3.5Å; R372-S375 PolarHBondContact O-N 3.29Å; R372-L376 HydrophobicContact CG-CD1 4.19Å; R372-L376 WeakPolarHBondContact O-CB 3.34Å; R372-L376 WeakPolarHBondContact O-CG 3.41Å; R372-L376 PolarHBondContact O-N 3.4Å
373	T	71.1	Confident	68.8	Low	65 Å²	65	77.6 Å²	77.6	40%	0.399	41%	0.411	S	S	.	.	H	α-helix	trans	-63.9	-42.3	177.1	63.1	0	0	0	0	111.9	E369 E370 L376 Q377	E369-T373 WeakPolarHBondContact O-CG2 3.47Å; E369-T373 PolarHBondContact O-N 3.49Å; E370-T373 PolarHBondContact O-N 3.42Å; E370-T373 PolarHBondContact O-OG1 3.38Å; T373-L376 PolarHBondContact O-N 3.05Å; T373-Q377 WeakPolarHBondContact O-CB 3.46Å; T373-Q377 VanDerWaalsContact O-CG 3.31Å; T373-Q377 WeakPolarHBondContact O-CG 3.36Å; T373-Q377 PolarHBondContact O-N 3.39Å
374	V	72.9	Confident	71.1	Confident	74 Å²	74	75.5 Å²	75.5	45%	0.448	39%	0.393	S	S	.	.	H	α-helix	trans	-65.9	-41.6	178	174.5	0	0	0	0	111.3	E370 E371 Q377 N378	E370-V374 WeakPolarHBondContact O-CG2 3.44Å; E370-V374 PolarHBondContact O-N 3.31Å; E370-V374 VanDerWaalsContact O-N 3.08Å; E371-V374 PolarHBondContact O-N 3.48Å; V374-Q377 PolarHBondContact O-N 3.15Å; V374-N378 WeakPolarHBondContact O-CB 3.35Å; V374-N378 PolarHBondContact O-N 2.97Å; V374-N378 PolarHBondContact O-ND2 3.14Å; V374-N378 VanDerWaalsContact O-ND2 3.12Å
375	S	71.4	Confident	73	Confident	35 Å²	35	73.6 Å²	73.6	25%	0.245	39%	0.388	C	S	.	.	H	α-helix	trans	-63.6	-41.3	175	-67.9	0	0	0	0	112.3	E371 R372 N378 A379	E371-S375 WeakPolarHBondContact O-CB 3.35Å; E371-S375 PolarHBondContact O-N 3.36Å; E371-S375 PolarHBondContact O-OG 2.98Å; R372-S375 PolarHBondContact O-N 3.29Å; S375-N378 PolarHBondContact O-N 3.5Å; S375-A379 WeakPolarHBondContact O-CB 3.34Å; S375-A379 PolarHBondContact O-N 3.36Å
376	L	73.1	Confident	75	Confident	57 Å²	57	69.6 Å²	69.6	30%	0.298	36%	0.363	S	S	.	.	H	α-helix	trans	-64.7	-44.8	175.8	-80.9	167.7	0	0	0	112.1	R372 T373 N378 A379 A380 F409	R372-L376 HydrophobicContact CG-CD1 4.19Å; R372-L376 WeakPolarHBondContact O-CB 3.34Å; R372-L376 WeakPolarHBondContact O-CG 3.41Å; R372-L376 PolarHBondContact O-N 3.4Å; T373-L376 PolarHBondContact O-N 3.05Å; L376-N378 VanDerWaalsContact C-N 3.32Å; L376-N378 PolarHBondContact O-N 3.11Å; L376-A379 PolarHBondContact O-N 2.98Å; L376-A380 WeakPolarHBondContact O-CB 3.4Å; L376-A380 PolarHBondContact O-N 2.87Å; L376-F409 HydrophobicContact CD2-CB 4.39Å
377	Q	78.8	Confident	76.8	Confident	134 Å²	134	65 Å²	65	63%	0.626	33%	0.334	S	S	*	.	H	α-helix	trans	-61	-40.8	176.2	-75	175.5	-1.9	0	0	112	T373 V374 A381	T373-Q377 WeakPolarHBondContact O-CB 3.46Å; T373-Q377 VanDerWaalsContact O-CG 3.31Å; T373-Q377 WeakPolarHBondContact O-CG 3.36Å; T373-Q377 PolarHBondContact O-N 3.39Å; V374-Q377 PolarHBondContact O-N 3.15Å; Q377-A381 WeakPolarHBondContact O-CB 3.48Å; Q377-A381 PolarHBondContact O-N 3.32Å
378	N	77.6	Confident	78.5	Confident	45 Å²	45	60.4 Å²	60.4	24%	0.241	31%	0.314	C	S	.	.	H	α-helix	trans	-66.5	-41.4	176.2	-79.9	-43.4	0	0	0	112.5	K285 V374 S375 L376 A381 I382	K285-N378 PolarHBondContact NZ-OD1 2.75Å; V374-N378 WeakPolarHBondContact O-CB 3.35Å; V374-N378 PolarHBondContact O-N 2.97Å; V374-N378 PolarHBondContact O-ND2 3.14Å; V374-N378 VanDerWaalsContact O-ND2 3.12Å; S375-N378 PolarHBondContact O-N 3.5Å; L376-N378 VanDerWaalsContact C-N 3.32Å; L376-N378 PolarHBondContact O-N 3.11Å; N378-A381 PolarHBondContact O-N 3.14Å; N378-I382 WeakPolarHBondContact O-CG1 3.45Å; N378-I382 PolarHBondContact O-N 2.91Å
379	A	79.6	Confident	80.2	Confident	12 Å²	12	56.6 Å²	56.6	10%	0.099	30%	0.296	C	S	.	.	H	α-helix	trans	-64.4	-45.2	175.3	0	0	0	0	0	111.6	S375 L376 A381 I382 Y383	S375-A379 WeakPolarHBondContact O-CB 3.34Å; S375-A379 PolarHBondContact O-N 3.36Å; L376-A379 PolarHBondContact O-N 2.98Å; A379-A381 VanDerWaalsContact C-N 3.34Å; A379-A381 PolarHBondContact O-N 3.32Å; A379-I382 WeakPolarHBondContact O-CB 3.42Å; A379-I382 PolarHBondContact O-N 3.33Å; A379-I382 VanDerWaalsContact O-N 3.13Å; A379-Y383 WeakPolarHBondContact O-CD2 3.41Å; A379-Y383 PolarHBondContact O-N 2.83Å; A379-Y383 VanDerWaalsContact O-N 3.1Å
380	A	83.4	Confident	81.6	Confident	36 Å²	36	50.2 Å²	50.2	30%	0.298	27%	0.267	S	S	.	.	H	α-helix	trans	-57.5	-46.3	176	0	0	0	0	0	111.4	L376 I382 Y383 D384	L376-A380 WeakPolarHBondContact O-CB 3.4Å; L376-A380 PolarHBondContact O-N 2.87Å; A380-I382 VanDerWaalsContact C-N 3.28Å; A380-I382 PolarHBondContact O-N 3.37Å; A380-Y383 CarbonylContact O-C 3.53Å; A380-Y383 PolarHBondContact O-N 3.44Å; A380-D384 VanDerWaalsContact O-CG 3.31Å; A380-D384 PolarHBondContact O-N 3.01Å
381	A	86.7	Confident	82.8	Confident	32 Å²	32	43.5 Å²	43.5	26%	0.264	24%	0.241	S	C	.	.	H	α-helix	trans	-60.7	-34.1	177	0	0	0	0	0	113.3	K285 Q377 N378 A379 L385	K285-A381 HydrophobicContact CD-CB 4.43Å; Q377-A381 WeakPolarHBondContact O-CB 3.48Å; Q377-A381 PolarHBondContact O-N 3.32Å; N378-A381 PolarHBondContact O-N 3.14Å; A379-A381 VanDerWaalsContact C-N 3.34Å; A379-A381 PolarHBondContact O-N 3.32Å; A381-L385 VanDerWaalsContact O-CG 3.29Å; A381-L385 WeakPolarHBondContact O-CG 3.46Å; A381-L385 PolarHBondContact O-N 2.87Å; A381-L385 VanDerWaalsContact O-N 3.1Å
382	I	89	Confident	83.9	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-65.9	-45.2	173.9	-66.8	162.7	0	0	0	110.1	K285 L349 E353 A356 N378 A379 A380 L385 L386	K285-I382 HydrophobicContact CD-CG1 3.98Å; K285-I382 HydrophobicContact CG-CG1 4.1Å; L349-I382 HydrophobicContact CD2-CG2 4.17Å; E353-I382 HydrophobicContact CB-CG2 4.24Å; A356-I382 HydrophobicContact CB-CD1 4.12Å; N378-I382 WeakPolarHBondContact O-CG1 3.45Å; N378-I382 PolarHBondContact O-N 2.91Å; A379-I382 WeakPolarHBondContact O-CB 3.42Å; A379-I382 PolarHBondContact O-N 3.33Å; A379-I382 VanDerWaalsContact O-N 3.13Å; A380-I382 VanDerWaalsContact C-N 3.28Å; A380-I382 PolarHBondContact O-N 3.37Å; I382-L385 PolarHBondContact O-N 3.38Å; I382-L386 HydrophobicContact CG2-CD1 4.19Å; I382-L386 WeakPolarHBondContact O-CG 3.43Å; I382-L386 PolarHBondContact O-N 3.19Å
383	Y	90.1	Very high	84.9	Confident	8 Å²	8	46 Å²	46	3%	0.031	25%	0.247	C	C	.	.	H	α-helix	trans	-68.6	-31.5	178.5	-74.7	-65.3	0	0	0	113.6	E353 A379 A380 L386 S387 C402 L403 A406	E353-Y383 HydrophobicContact CG-CE1 4.11Å; E353-Y383 WeakPolarHBondContact CG-OH 3.43Å; E353-Y383 WeakPolarHBondContact OE1-CE1 3.47Å; E353-Y383 VanDerWaalsContact OE1-CZ 3.27Å; E353-Y383 PolarHBondContact OE1-OH 2.97Å; A379-Y383 WeakPolarHBondContact O-CD2 3.41Å; A379-Y383 PolarHBondContact O-N 2.83Å; A379-Y383 VanDerWaalsContact O-N 3.1Å; A380-Y383 CarbonylContact O-C 3.53Å; A380-Y383 PolarHBondContact O-N 3.44Å; Y383-L386 HydrophobicContact CD1-CD1 3.9Å; Y383-L386 HydrophobicContact CE1-CD1 4.17Å; Y383-L386 PolarHBondContact O-N 3.16Å; Y383-S387 WeakPolarHBondContact O-CB 3.35Å; Y383-S387 PolarHBondContact O-N 2.59Å; Y383-S387 PolarHBondContact O-OG 2.97Å; Y383-C402 HydrophobicContact CE1-CB 4.47Å; Y383-C402 WeakPolarHBondContact CE1-O 3.45Å; Y383-L403 HydrophobicContact CD1-CD2 4.26Å; Y383-L403 HydrophobicContact CG-CD2 4.44Å; Y383-A406 HydrophobicContact CD1-CB 3.84Å; Y383-A406 HydrophobicContact CD2-CB 3.44Å; Y383-A406 VanDerWaalsContact CD2-CB 3.44Å; Y383-A406 HydrophobicContact CE1-CB 3.71Å; Y383-A406 HydrophobicContact CE2-CB 3.29Å; Y383-A406 HydrophobicContact CG-CB 3.72Å; Y383-A406 VanDerWaalsContact CZ-CB 3.43Å
384	D	91.4	Very high	85.6	Confident	54 Å²	54	44.6 Å²	44.6	29%	0.289	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-45	172	-69.3	-25.3	0	0	0	110.7	A380 L386 S387 I388 H415	A380-D384 VanDerWaalsContact O-CG 3.31Å; A380-D384 PolarHBondContact O-N 3.01Å; D384-L386 VanDerWaalsContact C-N 3.32Å; D384-L386 PolarHBondContact O-N 2.82Å; D384-S387 WeakPolarHBondContact O-CB 3.48Å; D384-S387 PolarHBondContact O-N 3.43Å; D384-S387 VanDerWaalsContact O-N 3.17Å; D384-I388 WeakPolarHBondContact O-CG1 3.43Å; D384-I388 PolarHBondContact O-N 2.7Å; D384-H415 IonicContact OD1-CD2 3.92Å; D384-H415 IonicContact OD1-CE1 3.68Å; D384-H415 IonicContact OD1-NE2 3.34Å; D384-H415 PolarHBondContact OD1-NE2 3.15Å; D384-H415 IonicContact OD2-NE2 4Å
385	L	92.8	Very high	86.4	Confident	35 Å²	35	46 Å²	46	18%	0.183	25%	0.247	C	C	.	.	H	α-helix	trans	-64.8	-36.4	174.6	-69	171.4	0	0	0	112	K285 L292 L349 A381 I382 S387 I388 T389	K285-L385 HydrophobicContact CG-CD1 3.97Å; L292-L385 HydrophobicContact CD1-CB 4.43Å; L292-L385 HydrophobicContact CD1-CD2 4.06Å; L349-L385 HydrophobicContact CD1-CB 3.77Å; L349-L385 HydrophobicContact CD2-CB 3.65Å; L349-L385 HydrophobicContact CD2-CD1 3.92Å; L349-L385 HydrophobicContact CD2-CG 4.46Å; L349-L385 HydrophobicContact CG-CB 4.38Å; A381-L385 VanDerWaalsContact O-CG 3.29Å; A381-L385 WeakPolarHBondContact O-CG 3.46Å; A381-L385 PolarHBondContact O-N 2.87Å; A381-L385 VanDerWaalsContact O-N 3.1Å; I382-L385 PolarHBondContact O-N 3.38Å; L385-S387 VanDerWaalsContact C-N 3.32Å; L385-I388 HydrophobicContact CD2-CD1 4.49Å; L385-I388 PolarHBondContact O-N 3.49Å; L385-T389 WeakPolarHBondContact O-CG2 3.45Å; L385-T389 PolarHBondContact O-N 3.22Å; L385-T389 PolarHBondContact O-OG1 3Å
386	L	92.6	Very high	87.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64	-37.7	172.4	-77.4	170.6	0	0	0	112	L346 L349 I382 Y383 D384 I388 T389 L390	L346-L386 HydrophobicContact CD1-CD2 3.87Å; L349-L386 HydrophobicContact CB-CD2 3.52Å; L349-L386 HydrophobicContact CB-CG 3.87Å; L349-L386 HydrophobicContact CD1-CD2 3.92Å; L349-L386 HydrophobicContact CD1-CG 4.09Å; L349-L386 HydrophobicContact CG-CD2 4.36Å; L349-L386 HydrophobicContact CG-CG 4.5Å; I382-L386 HydrophobicContact CG2-CD1 4.19Å; I382-L386 WeakPolarHBondContact O-CG 3.43Å; I382-L386 PolarHBondContact O-N 3.19Å; Y383-L386 HydrophobicContact CD1-CD1 3.9Å; Y383-L386 HydrophobicContact CE1-CD1 4.17Å; Y383-L386 PolarHBondContact O-N 3.16Å; D384-L386 VanDerWaalsContact C-N 3.32Å; D384-L386 PolarHBondContact O-N 2.82Å; L386-I388 VanDerWaalsContact C-N 3.32Å; L386-T389 VanDerWaalsContact CA-OG1 3.31Å; L386-T389 WeakPolarHBondContact CA-OG1 3.35Å; L386-T389 PolarHBondContact O-N 3.49Å; L386-T389 PolarHBondContact O-OG1 2.92Å; L386-L390 WeakPolarHBondContact O-CB 3.22Å; L386-L390 WeakPolarHBondContact O-CG 3.28Å; L386-L390 PolarHBondContact O-N 3.25Å
387	S	92.8	Very high	88.3	Confident	18 Å²	18	50.6 Å²	50.6	13%	0.126	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-40.4	174.6	-55.9	0	0	0	0	111.4	Y383 D384 L385 G391	Y383-S387 WeakPolarHBondContact O-CB 3.35Å; Y383-S387 PolarHBondContact O-N 2.59Å; Y383-S387 PolarHBondContact O-OG 2.97Å; D384-S387 WeakPolarHBondContact O-CB 3.48Å; D384-S387 PolarHBondContact O-N 3.43Å; D384-S387 VanDerWaalsContact O-N 3.17Å; L385-S387 VanDerWaalsContact C-N 3.32Å; S387-G391 WeakPolarHBondContact O-CA 3.25Å; S387-G391 PolarHBondContact O-N 3.45Å
388	I	92.7	Very high	88.8	Confident	83 Å²	83	47.3 Å²	47.3	43%	0.426	25%	0.247	S	C	.	.	H	α-helix	trans	-68.2	-46.3	175.9	-64.6	164.9	0	0	0	111.4	D384 L385 L386 R392	D384-I388 WeakPolarHBondContact O-CG1 3.43Å; D384-I388 PolarHBondContact O-N 2.7Å; L385-I388 HydrophobicContact CD2-CD1 4.49Å; L385-I388 PolarHBondContact O-N 3.49Å; L386-I388 VanDerWaalsContact C-N 3.32Å; I388-R392 WeakPolarHBondContact O-CB 3.47Å; I388-R392 VanDerWaalsContact O-CG 3.25Å; I388-R392 WeakPolarHBondContact O-CG 3.46Å; I388-R392 PolarHBondContact O-N 2.94Å; I388-R392 VanDerWaalsContact O-N 3.11Å
389	T	91.7	Very high	89.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.3	-52.5	-178.8	47.4	0	0	0	0	112	L292 A345 L349 L385 L386	L292-T389 HydrophobicContact CD1-CG2 3.43Å; L292-T389 VanDerWaalsContact CD1-CG2 3.43Å; L292-T389 HydrophobicContact CD2-CG2 3.45Å; L292-T389 VanDerWaalsContact CD2-CG2 3.45Å; L292-T389 HydrophobicContact CG-CG2 3.98Å; A345-T389 HydrophobicContact CB-CG2 3.77Å; L349-T389 HydrophobicContact CD1-CG2 3.77Å; L385-T389 WeakPolarHBondContact O-CG2 3.45Å; L385-T389 PolarHBondContact O-N 3.22Å; L385-T389 PolarHBondContact O-OG1 3Å; L386-T389 VanDerWaalsContact CA-OG1 3.31Å; L386-T389 WeakPolarHBondContact CA-OG1 3.35Å; L386-T389 PolarHBondContact O-N 3.49Å; L386-T389 PolarHBondContact O-OG1 2.92Å
390	L	92	Very high	90.1	Very high	6 Å²	6	45.1 Å²	45.1	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-73.5	-35.4	-176.2	-65.5	171.9	0	0	0	111.4	L346 L386 R392 R393 G394 Q395 M398 L399	L346-L390 HydrophobicContact CD1-CD2 3.95Å; L346-L390 HydrophobicContact CD1-CG 4.3Å; L346-L390 HydrophobicContact CD2-CD2 4.3Å; L386-L390 WeakPolarHBondContact O-CB 3.22Å; L386-L390 WeakPolarHBondContact O-CG 3.28Å; L386-L390 PolarHBondContact O-N 3.25Å; L390-R392 PolarHBondContact O-N 3.37Å; L390-R393 PolarHBondContact O-N 3.22Å; L390-G394 PolarHBondContact O-N 2.95Å; L390-G394 VanDerWaalsContact O-N 3.14Å; L390-Q395 HydrophobicContact CB-CB 4.41Å; L390-Q395 HydrophobicContact CD2-CB 4.11Å; L390-Q395 PolarHBondContact O-N 2.88Å; L390-M398 HydrophobicContact CD1-CB 4.46Å; L390-M398 HydrophobicContact CD1-CG 4.12Å; L390-M398 HydrophobicContact CD1-SD 4.5Å; L390-M398 HydrophobicContact CD2-CG 4.31Å; L390-M398 HydrophobicContact CD2-SD 3.79Å; L390-L399 HydrophobicContact CB-CB 3.96Å; L390-L399 HydrophobicContact CB-CD1 4.42Å; L390-L399 HydrophobicContact CD1-CB 3.97Å; L390-L399 HydrophobicContact CD1-CD1 4.13Å
391	G	90.5	Very high	90.5	Very high	22 Å²	22	48.2 Å²	48.2	23%	0.227	24%	0.242	C	C	.	.	H	α-helix	trans	-60.8	-42.3	174.6	0	0	0	0	0	112.8	S387 R393 G394	S387-G391 WeakPolarHBondContact O-CA 3.25Å; S387-G391 PolarHBondContact O-N 3.45Å; G391-R393 VanDerWaalsContact C-N 3.25Å; G391-R393 PolarHBondContact O-N 3.39Å; G391-G394 PolarHBondContact O-N 3.26Å
392	R	85.8	Confident	90.6	Very high	138 Å²	138	46.9 Å²	46.9	52%	0.521	23%	0.23	S	C	.	.	H	α-helix	trans	-63.6	-27.2	177.3	-75.3	178.3	73.7	157.2	2.6	113.9	L292 I388 L390	L292-R392 PolarHBondContact O-NH1 3.16Å; I388-R392 WeakPolarHBondContact O-CB 3.47Å; I388-R392 VanDerWaalsContact O-CG 3.25Å; I388-R392 WeakPolarHBondContact O-CG 3.46Å; I388-R392 PolarHBondContact O-N 2.94Å; I388-R392 VanDerWaalsContact O-N 3.11Å; L390-R392 PolarHBondContact O-N 3.37Å
393	R	86.1	Confident	90.6	Very high	109 Å²	109	46.7 Å²	46.7	41%	0.411	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	0.7	174.2	-69.8	-68.5	-164.2	-150.4	1.7	113.1	E297 D340 I342 L390 G391 Q395	E297-R393 IonicContact OE1-NH1 3.98Å; D340-R393 IonicContact OD1-NH2 2.73Å; D340-R393 IonicContact OD2-CZ 3.82Å; D340-R393 IonicContact OD2-NH2 3.61Å; D340-R393 PolarHBondContact OD2-NH2 2.82Å; I342-R393 HydrophobicContact CD1-CG 4.02Å; I342-R393 VanDerWaalsContact CD1-CZ 3.49Å; I342-R393 HydrophobicContact CG2-CG 3.76Å; L390-R393 PolarHBondContact O-N 3.22Å; G391-R393 VanDerWaalsContact C-N 3.25Å; G391-R393 PolarHBondContact O-N 3.39Å; R393-Q395 HydrophobicContact CB-CG 3.89Å; R393-Q395 PolarHBondContact O-N 3.44Å
394	G	87.1	Confident	90.6	Very high	35 Å²	35	49.7 Å²	49.7	36%	0.361	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	19.3	-175.3	0	0	0	0	0	114.3	L390 G391 Y396	L390-G394 PolarHBondContact O-N 2.95Å; L390-G394 VanDerWaalsContact O-N 3.14Å; G391-G394 PolarHBondContact O-N 3.26Å; G394-Y396 VanDerWaalsContact C-N 3.27Å; G394-Y396 VanDerWaalsContact O-CD2 3.25Å; G394-Y396 WeakPolarHBondContact O-CD2 3.32Å; G394-Y396 PolarHBondContact O-N 3.49Å
395	Q	90.4	Very high	90.3	Very high	103 Å²	103	51.5 Å²	51.5	48%	0.481	25%	0.247	S	C	.	.			trans	-86.8	62	-175.2	-67.4	-63.2	-26.1	0	0	111.5	L390 R393 I397 L399	L390-Q395 HydrophobicContact CB-CB 4.41Å; L390-Q395 HydrophobicContact CD2-CB 4.11Å; L390-Q395 PolarHBondContact O-N 2.88Å; R393-Q395 HydrophobicContact CB-CG 3.89Å; R393-Q395 PolarHBondContact O-N 3.44Å; Q395-I397 VanDerWaalsContact C-N 3.34Å; Q395-I397 PolarHBondContact O-N 3.19Å; Q395-L399 WeakPolarHBondContact O-CB 3.45Å; Q395-L399 PolarHBondContact O-N 2.99Å; Q395-L399 VanDerWaalsContact O-N 3.13Å
396	Y	91.2	Very high	89.7	Confident	91 Å²	91	50 Å²	50	36%	0.357	24%	0.239	S	C	.	.	H	α-helix	trans	-70.9	-26.3	-173.4	-54.2	-64.7	0	0	0	113.9	G394 L399 S400 A426	G394-Y396 VanDerWaalsContact C-N 3.27Å; G394-Y396 VanDerWaalsContact O-CD2 3.25Å; G394-Y396 WeakPolarHBondContact O-CD2 3.32Å; G394-Y396 PolarHBondContact O-N 3.49Å; Y396-L399 PolarHBondContact O-N 3.24Å; Y396-S400 WeakPolarHBondContact O-CB 3.42Å; Y396-S400 PolarHBondContact O-N 3.4Å; Y396-A426 HydrophobicContact CD1-CB 3.6Å; Y396-A426 HydrophobicContact CD2-CB 3.85Å; Y396-A426 HydrophobicContact CE1-CB 4.05Å; Y396-A426 HydrophobicContact CE2-CB 4.27Å; Y396-A426 HydrophobicContact CG-CB 3.49Å; Y396-A426 VanDerWaalsContact CG-CB 3.49Å
397	I	91.3	Very high	89.1	Confident	98 Å²	98	51.7 Å²	51.7	50%	0.503	25%	0.247	S	C	.	.	H	α-helix	trans	-62.8	-56.1	176.5	-61.4	166	0	0	0	109.5	Q395 L399 S400 E401 C427	Q395-I397 VanDerWaalsContact C-N 3.34Å; Q395-I397 PolarHBondContact O-N 3.19Å; I397-L399 VanDerWaalsContact C-N 3.28Å; I397-L399 PolarHBondContact O-N 3Å; I397-S400 PolarHBondContact O-N 3.06Å; I397-S400 PolarHBondContact O-OG 3.42Å; I397-E401 PolarHBondContact O-N 2.88Å; I397-C427 VanDerWaalsContact CG1-SG 3.58Å
398	M	90.7	Very high	88.4	Confident	64 Å²	64	57.5 Å²	57.5	32%	0.315	27%	0.27	S	S	.	.	H	α-helix	trans	-61.6	-38.2	178	-175.4	178.5	176.7	0	0	111.6	L346 L350 L390 S400 E401 C402	L346-M398 HydrophobicContact CD1-CE 4.12Å; L346-M398 HydrophobicContact CD2-CE 4.22Å; L350-M398 HydrophobicContact CD1-CE 4.26Å; L350-M398 HydrophobicContact CD2-CE 4.49Å; L390-M398 HydrophobicContact CD1-CB 4.46Å; L390-M398 HydrophobicContact CD1-CG 4.12Å; L390-M398 HydrophobicContact CD1-SD 4.5Å; L390-M398 HydrophobicContact CD2-CG 4.31Å; L390-M398 HydrophobicContact CD2-SD 3.79Å; M398-S400 VanDerWaalsContact C-N 3.34Å; M398-S400 PolarHBondContact O-N 3.12Å; M398-E401 PolarHBondContact O-N 3.4Å; M398-C402 PolarHBondContact O-N 3Å; M398-C402 PolarHBondContact O-SG 3.13Å
399	L	93	Very high	87.4	Confident	11 Å²	11	55.1 Å²	55.1	6%	0.058	26%	0.257	C	S	.	.	H	α-helix	trans	-60.9	-45.1	176.5	178.5	56	0	0	0	111.7	L390 Q395 Y396 I397 E401 C402 L403	L390-L399 HydrophobicContact CB-CB 3.96Å; L390-L399 HydrophobicContact CB-CD1 4.42Å; L390-L399 HydrophobicContact CD1-CB 3.97Å; L390-L399 HydrophobicContact CD1-CD1 4.13Å; Q395-L399 WeakPolarHBondContact O-CB 3.45Å; Q395-L399 PolarHBondContact O-N 2.99Å; Q395-L399 VanDerWaalsContact O-N 3.13Å; Y396-L399 PolarHBondContact O-N 3.24Å; I397-L399 VanDerWaalsContact C-N 3.28Å; I397-L399 PolarHBondContact O-N 3Å; L399-E401 VanDerWaalsContact C-N 3.29Å; L399-E401 PolarHBondContact O-N 3.18Å; L399-C402 PolarHBondContact O-N 3.09Å; L399-C402 VanDerWaalsContact O-N 3.14Å; L399-L403 HydrophobicContact CD1-CD1 3.84Å; L399-L403 HydrophobicContact CD1-CG 3.93Å; L399-L403 HydrophobicContact CG-CD1 3.91Å; L399-L403 HydrophobicContact CG-CG 4.41Å; L399-L403 WeakPolarHBondContact O-CG 3.33Å; L399-L403 PolarHBondContact O-N 2.99Å
400	S	91.8	Very high	86.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.6	-40.6	179.6	77.9	0	0	0	0	112	Y396 I397 M398 L403 E404 S423	Y396-S400 WeakPolarHBondContact O-CB 3.42Å; Y396-S400 PolarHBondContact O-N 3.4Å; I397-S400 PolarHBondContact O-N 3.06Å; I397-S400 PolarHBondContact O-OG 3.42Å; M398-S400 VanDerWaalsContact C-N 3.34Å; M398-S400 PolarHBondContact O-N 3.12Å; S400-L403 PolarHBondContact O-N 3.42Å; S400-E404 WeakPolarHBondContact O-CB 3.2Å; S400-E404 WeakPolarHBondContact O-CG 3.39Å; S400-E404 PolarHBondContact O-N 3.41Å; S400-S423 WeakPolarHBondContact CA-OG 3.37Å
401	E	90.7	Very high	85.1	Confident	102 Å²	102	62.9 Å²	62.9	48%	0.477	29%	0.293	S	S	.	.	H	α-helix	trans	-68.4	-36.3	176.2	-65.7	176.8	179.2	0	0	112.5	I397 M398 L399 R405	I397-E401 PolarHBondContact O-N 2.88Å; M398-E401 PolarHBondContact O-N 3.4Å; L399-E401 VanDerWaalsContact C-N 3.29Å; L399-E401 PolarHBondContact O-N 3.18Å; E401-R405 WeakPolarHBondContact O-CG 3.47Å; E401-R405 PolarHBondContact O-N 3.3Å
402	C	89.9	Confident	84.2	Confident	3 Å²	3	64.1 Å²	64.1	2%	0.02	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-46.8	174.8	-64.5	0	0	0	0	111.2	Y383 M398 L399 E404 R405 A406	Y383-C402 HydrophobicContact CE1-CB 4.47Å; Y383-C402 WeakPolarHBondContact CE1-O 3.45Å; M398-C402 PolarHBondContact O-N 3Å; M398-C402 PolarHBondContact O-SG 3.13Å; L399-C402 PolarHBondContact O-N 3.09Å; L399-C402 VanDerWaalsContact O-N 3.14Å; C402-E404 PolarHBondContact O-N 3.2Å; C402-R405 WeakPolarHBondContact O-CB 3.44Å; C402-R405 PolarHBondContact O-N 3.16Å; C402-R405 VanDerWaalsContact O-N 3.16Å; C402-R405 PolarHBondContact SG-NH2 2.93Å; C402-A406 PolarHBondContact O-N 3.45Å
403	L	89.4	Confident	84.1	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-69.4	-32.2	-180	-68	174.5	0	0	0	112.6	Y383 L399 S400 R405 A406 M407 L416 Q419 V420	Y383-L403 HydrophobicContact CD1-CD2 4.26Å; Y383-L403 HydrophobicContact CG-CD2 4.44Å; L399-L403 HydrophobicContact CD1-CD1 3.84Å; L399-L403 HydrophobicContact CD1-CG 3.93Å; L399-L403 HydrophobicContact CG-CD1 3.91Å; L399-L403 HydrophobicContact CG-CG 4.41Å; L399-L403 WeakPolarHBondContact O-CG 3.33Å; L399-L403 PolarHBondContact O-N 2.99Å; S400-L403 PolarHBondContact O-N 3.42Å; L403-R405 VanDerWaalsContact C-N 3.28Å; L403-R405 PolarHBondContact O-N 3.23Å; L403-A406 VanDerWaalsContact O-CB 3.25Å; L403-A406 WeakPolarHBondContact O-CB 3.41Å; L403-A406 PolarHBondContact O-N 2.82Å; L403-A406 VanDerWaalsContact O-N 3.12Å; L403-M407 WeakPolarHBondContact O-CG 3.46Å; L403-M407 PolarHBondContact O-N 3.43Å; L403-L416 HydrophobicContact CD2-CD1 4.06Å; L403-Q419 HydrophobicContact CD1-CB 4.12Å; L403-V420 HydrophobicContact CB-CB 4.39Å; L403-V420 HydrophobicContact CB-CG2 3.65Å
404	E	88.2	Confident	84.2	Confident	70 Å²	70	60.3 Å²	60.3	33%	0.327	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-34.5	170.3	-81.1	-175.4	162.6	0	0	112.7	S400 C402 A406 M407 V420 M424 Y432	S400-E404 WeakPolarHBondContact O-CB 3.2Å; S400-E404 WeakPolarHBondContact O-CG 3.39Å; S400-E404 PolarHBondContact O-N 3.41Å; C402-E404 PolarHBondContact O-N 3.2Å; E404-A406 VanDerWaalsContact C-N 3.33Å; E404-M407 WeakPolarHBondContact O-CB 3.48Å; E404-M407 PolarHBondContact O-N 3.49Å; E404-V420 HydrophobicContact CG-CG1 4.43Å; E404-M424 VanDerWaalsContact CD-CE 3.42Å; E404-M424 HydrophobicContact CG-CE 3.58Å; E404-M424 WeakPolarHBondContact OE1-CE 3.46Å; E404-Y432 WeakPolarHBondContact OE1-CE1 3.39Å
405	R	85	Confident	84.3	Confident	93 Å²	93	62.5 Å²	62.5	35%	0.351	30%	0.298	S	S	.	.	H	α-helix	trans	-67.3	-37.6	173	-69.1	-177.5	-69.3	135.2	-0.4	111.2	E353 E401 C402 L403 M407 K408 F409	E353-R405 VanDerWaalsContact CD-CZ 3.46Å; E353-R405 VanDerWaalsContact CD-NH2 3.34Å; E353-R405 IonicContact OE1-CZ 2.6Å; E353-R405 IonicContact OE1-NE 2.7Å; E353-R405 IonicContact OE1-NH1 2.87Å; E353-R405 PolarHBondContact OE1-NH1 3.35Å; E353-R405 IonicContact OE1-NH2 3.06Å; E353-R405 PolarHBondContact OE1-NH2 2.98Å; E353-R405 IonicContact OE2-CZ 3.15Å; E353-R405 IonicContact OE2-NH1 2.75Å; E353-R405 PolarHBondContact OE2-NH1 3.19Å; E353-R405 IonicContact OE2-NH2 2.67Å; E353-R405 PolarHBondContact OE2-NH2 3.5Å; E401-R405 WeakPolarHBondContact O-CG 3.47Å; E401-R405 PolarHBondContact O-N 3.3Å; C402-R405 WeakPolarHBondContact O-CB 3.44Å; C402-R405 PolarHBondContact O-N 3.16Å; C402-R405 VanDerWaalsContact O-N 3.16Å; C402-R405 PolarHBondContact SG-NH2 2.93Å; L403-R405 VanDerWaalsContact C-N 3.28Å; L403-R405 PolarHBondContact O-N 3.23Å; R405-M407 VanDerWaalsContact C-N 3.3Å; R405-M407 PolarHBondContact O-N 3.19Å; R405-K408 WeakPolarHBondContact O-CB 3.44Å; R405-K408 PolarHBondContact O-N 2.91Å; R405-F409 WeakPolarHBondContact O-CE2 3.48Å
406	A	81.8	Confident	84.1	Confident	3 Å²	3	58.4 Å²	58.4	3%	0.025	28%	0.28	C	S	.	.	H	α-helix	trans	-62.1	-36.1	175.8	0	0	0	0	0	112.7	Y383 C402 L403 E404 K408 F409 L416	Y383-A406 HydrophobicContact CD1-CB 3.84Å; Y383-A406 HydrophobicContact CD2-CB 3.44Å; Y383-A406 VanDerWaalsContact CD2-CB 3.44Å; Y383-A406 HydrophobicContact CE1-CB 3.71Å; Y383-A406 HydrophobicContact CE2-CB 3.29Å; Y383-A406 HydrophobicContact CG-CB 3.72Å; Y383-A406 VanDerWaalsContact CZ-CB 3.43Å; C402-A406 PolarHBondContact O-N 3.45Å; L403-A406 VanDerWaalsContact O-CB 3.25Å; L403-A406 WeakPolarHBondContact O-CB 3.41Å; L403-A406 PolarHBondContact O-N 2.82Å; L403-A406 VanDerWaalsContact O-N 3.12Å; E404-A406 VanDerWaalsContact C-N 3.33Å; A406-K408 PolarHBondContact O-N 3.35Å; A406-K408 VanDerWaalsContact O-N 3.09Å; A406-F409 WeakPolarHBondContact O-CD2 3.49Å; A406-F409 PolarHBondContact O-N 3.24Å; A406-L416 HydrophobicContact CB-CD1 3.88Å; A406-L416 HydrophobicContact CB-CD2 3.72Å; A406-L416 HydrophobicContact CB-CG 4.33Å
407	M	79.9	Confident	84.1	Confident	35 Å²	35	56.7 Å²	56.7	17%	0.172	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-58.8	-23.9	-179.4	-75.6	-75.4	-73.1	0	0	114	L403 E404 R405 F409 A410 L416 W417 V420	L403-M407 WeakPolarHBondContact O-CG 3.46Å; L403-M407 PolarHBondContact O-N 3.43Å; E404-M407 WeakPolarHBondContact O-CB 3.48Å; E404-M407 PolarHBondContact O-N 3.49Å; R405-M407 VanDerWaalsContact C-N 3.3Å; R405-M407 PolarHBondContact O-N 3.19Å; M407-F409 PolarHBondContact O-N 2.67Å; M407-F409 VanDerWaalsContact O-N 3.1Å; M407-A410 PolarHBondContact O-N 3.46Å; M407-L416 HydrophobicContact SD-CD2 4.29Å; M407-L416 HydrophobicContact SD-CG 4.42Å; M407-W417 HydrophobicContact CE-CD2 3.49Å; M407-W417 VanDerWaalsContact CE-CD2 3.49Å; M407-W417 HydrophobicContact CE-CE3 3.8Å; M407-W417 HydrophobicContact CE-CG 4.02Å; M407-W417 HydrophobicContact CE-CH2 3.8Å; M407-W417 HydrophobicContact CE-CZ2 3.47Å; M407-W417 VanDerWaalsContact CE-CZ2 3.47Å; M407-W417 HydrophobicContact CE-CZ3 3.93Å; M407-W417 HydrophobicContact SD-CD2 4.19Å; M407-W417 HydrophobicContact SD-CG 4.08Å; M407-V420 HydrophobicContact CG-CG2 3.54Å; M407-V420 HydrophobicContact SD-CG2 3.84Å
408	K	77.1	Confident	84.2	Confident	140 Å²	140	54 Å²	54	61%	0.609	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-59.9	-21.6	175.1	-64	178.8	-177.6	176	0	112.8	L362 R405 A406	L362-K408 WeakPolarHBondContact CD1-O 3.27Å; R405-K408 WeakPolarHBondContact O-CB 3.44Å; R405-K408 PolarHBondContact O-N 2.91Å; A406-K408 PolarHBondContact O-N 3.35Å; A406-K408 VanDerWaalsContact O-N 3.09Å
409	F	71.8	Confident	84.2	Confident	34 Å²	34	53.3 Å²	53.3	15%	0.149	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-108.5	-12.1	-174.4	-48.8	-72.4	0	0	0	113.6	T357 V360 L362 L376 R405 A406 M407	T357-F409 HydrophobicContact CG2-CE2 3.81Å; T357-F409 HydrophobicContact CG2-CZ 3.88Å; V360-F409 HydrophobicContact CB-CD1 4.06Å; V360-F409 HydrophobicContact CB-CE1 4.16Å; V360-F409 HydrophobicContact CG1-CB 4.15Å; V360-F409 HydrophobicContact CG1-CD1 3.37Å; V360-F409 HydrophobicContact CG1-CE1 3.97Å; V360-F409 HydrophobicContact CG1-CG 3.91Å; L362-F409 HydrophobicContact CD1-CD1 4.11Å; L362-F409 HydrophobicContact CG-CD1 4.27Å; L376-F409 HydrophobicContact CD2-CB 4.39Å; R405-F409 WeakPolarHBondContact O-CE2 3.48Å; A406-F409 WeakPolarHBondContact O-CD2 3.49Å; A406-F409 PolarHBondContact O-N 3.24Å; M407-F409 PolarHBondContact O-N 2.67Å; M407-F409 VanDerWaalsContact O-N 3.1Å
410	A	66.8	Low	84.2	Confident	11 Å²	11	52.9 Å²	52.9	9%	0.091	25%	0.25	C	S	.	.			trans	-111	102.4	-172.8	0	0	0	0	0	111.9	M407 E413 L416 W417	M407-A410 PolarHBondContact O-N 3.46Å; A410-E413 HydrophobicContact CB-CB 4.35Å; A410-L416 HydrophobicContact CB-CB 4.26Å; A410-L416 HydrophobicContact CB-CD2 3.28Å; A410-L416 HydrophobicContact CB-CG 4.39Å; A410-W417 PolarHBondContact O-NE1 3.21Å
411	F	69.1	Low	84.2	Confident	158 Å²	158	52.9 Å²	52.9	69%	0.693	25%	0.25	S	S	*	.	S	Bend	trans	-102.3	112.8	174.4	-65.3	-83.2	0	0	0	109.3	L362 E413	L362-F411 HydrophobicContact CD2-CE2 4.01Å; F411-E413 VanDerWaalsContact C-N 3.33Å; F411-E413 PolarHBondContact O-N 3.48Å
412	G	71.9	Confident	84.4	Confident	48 Å²	48	50.2 Å²	50.2	50%	0.495	24%	0.239	S	C	.	.	S	Bend	trans	78.5	6.4	174.8	0	0	0	0	0	116.3	F414	G412-F414 PolarHBondContact O-N 3.39Å
413	E	82.9	Confident	84.6	Confident	124 Å²	124	50.3 Å²	50.3	58%	0.579	24%	0.24	S	C	*	.			trans	-84.3	108.1	177.6	-74	-65.7	161.2	0	0	111.6	A410 F411 H415 L416 W417	A410-E413 HydrophobicContact CB-CB 4.35Å; F411-E413 VanDerWaalsContact C-N 3.33Å; F411-E413 PolarHBondContact O-N 3.48Å; E413-H415 PolarHBondContact O-N 3.34Å; E413-L416 PolarHBondContact O-N 3.28Å; E413-W417 PolarHBondContact O-N 3.01Å
414	F	88.7	Confident	84.7	Confident	43 Å²	43	50.2 Å²	50.2	19%	0.189	24%	0.239	C	C	.	.	H	α-helix	trans	-55.8	-44.9	-175.8	173.7	-97.1	0	0	0	113.5	G412 L416 W417 Y418 C440 L443 Q444 V450	G412-F414 PolarHBondContact O-N 3.39Å; F414-L416 PolarHBondContact O-N 3.15Å; F414-W417 PolarHBondContact O-N 3.49Å; F414-Y418 HydrophobicContact CE1-CD1 4.36Å; F414-Y418 HydrophobicContact CE1-CG 4.29Å; F414-Y418 HydrophobicContact CZ-CD1 4.43Å; F414-Y418 HydrophobicContact CZ-CD2 4.35Å; F414-Y418 HydrophobicContact CZ-CG 4.08Å; F414-Y418 WeakPolarHBondContact O-CB 3.27Å; F414-Y418 PolarHBondContact O-N 2.95Å; F414-C440 HydrophobicContact CD2-CB 4.41Å; F414-C440 HydrophobicContact CE2-CB 4.02Å; F414-L443 HydrophobicContact CB-CB 4.48Å; F414-L443 HydrophobicContact CD2-CB 4.15Å; F414-Q444 VanDerWaalsContact CD1-OE1 3.25Å; F414-Q444 HydrophobicContact CD2-CB 3.73Å; F414-Q444 VanDerWaalsContact CE1-OE1 3.22Å; F414-Q444 HydrophobicContact CE2-CB 3.7Å; F414-Q444 HydrophobicContact CG-CB 4.36Å; F414-Q444 HydrophobicContact CZ-CB 4.33Å; F414-V450 HydrophobicContact CE2-CG2 3.98Å; F414-V450 HydrophobicContact CZ-CG2 3.83Å
415	H	88.4	Confident	84.9	Confident	80 Å²	80	48.9 Å²	48.9	37%	0.37	24%	0.236	S	C	.	.	H	α-helix	trans	-54.7	-51.6	-175.1	175	63.1	0	0	0	112.1	D384 E413 Y418 Q419	D384-H415 IonicContact OD1-CD2 3.92Å; D384-H415 IonicContact OD1-CE1 3.68Å; D384-H415 IonicContact OD1-NE2 3.34Å; D384-H415 PolarHBondContact OD1-NE2 3.15Å; D384-H415 IonicContact OD2-NE2 4Å; E413-H415 PolarHBondContact O-N 3.34Å; H415-Y418 PolarHBondContact O-N 2.9Å; H415-Q419 WeakPolarHBondContact O-CG 3.45Å; H415-Q419 PolarHBondContact O-N 2.78Å
416	L	87.4	Confident	85.1	Confident	17 Å²	17	46.9 Å²	46.9	9%	0.089	24%	0.239	C	C	.	.	H	α-helix	trans	-68.6	-41.8	-177.4	-167.7	72.3	0	0	0	112.1	L403 A406 M407 A410 E413 F414 Y418 Q419 V420	L403-L416 HydrophobicContact CD2-CD1 4.06Å; A406-L416 HydrophobicContact CB-CD1 3.88Å; A406-L416 HydrophobicContact CB-CD2 3.72Å; A406-L416 HydrophobicContact CB-CG 4.33Å; M407-L416 HydrophobicContact SD-CD2 4.29Å; M407-L416 HydrophobicContact SD-CG 4.42Å; A410-L416 HydrophobicContact CB-CB 4.26Å; A410-L416 HydrophobicContact CB-CD2 3.28Å; A410-L416 HydrophobicContact CB-CG 4.39Å; E413-L416 PolarHBondContact O-N 3.28Å; F414-L416 PolarHBondContact O-N 3.15Å; L416-Y418 VanDerWaalsContact C-N 3.25Å; L416-Y418 PolarHBondContact O-N 3.44Å; L416-Q419 PolarHBondContact O-N 2.91Å; L416-V420 HydrophobicContact CG-CG2 4.45Å; L416-V420 WeakPolarHBondContact O-CG2 3.47Å; L416-V420 PolarHBondContact O-N 3.15Å
417	W	90.4	Very high	85.4	Confident	56 Å²	56	48.1 Å²	48.1	21%	0.212	25%	0.247	C	C	.	.	H	α-helix	trans	-57.8	-42.4	175.9	-82.5	71.8	0	0	0	111.2	M407 A410 E413 F414 A421 L436 E439 C440 L443	M407-W417 HydrophobicContact CE-CD2 3.49Å; M407-W417 VanDerWaalsContact CE-CD2 3.49Å; M407-W417 HydrophobicContact CE-CE3 3.8Å; M407-W417 HydrophobicContact CE-CG 4.02Å; M407-W417 HydrophobicContact CE-CH2 3.8Å; M407-W417 HydrophobicContact CE-CZ2 3.47Å; M407-W417 VanDerWaalsContact CE-CZ2 3.47Å; M407-W417 HydrophobicContact CE-CZ3 3.93Å; M407-W417 HydrophobicContact SD-CD2 4.19Å; M407-W417 HydrophobicContact SD-CG 4.08Å; A410-W417 PolarHBondContact O-NE1 3.21Å; E413-W417 PolarHBondContact O-N 3.01Å; F414-W417 PolarHBondContact O-N 3.49Å; W417-A421 WeakPolarHBondContact O-CB 3.31Å; W417-A421 PolarHBondContact O-N 2.92Å; W417-L436 HydrophobicContact CE3-CD2 4.12Å; W417-L436 HydrophobicContact CZ3-CD2 3.97Å; W417-E439 HydrophobicContact CE3-CB 3.69Å; W417-E439 HydrophobicContact CE3-CG 4.39Å; W417-E439 HydrophobicContact CH2-CB 4.29Å; W417-E439 HydrophobicContact CH2-CG 4.28Å; W417-E439 HydrophobicContact CZ3-CB 3.45Å; W417-E439 VanDerWaalsContact CZ3-CB 3.45Å; W417-E439 HydrophobicContact CZ3-CG 3.65Å; W417-C440 VanDerWaalsContact C-SG 3.57Å; W417-L443 HydrophobicContact CB-CD1 4.3Å; W417-L443 HydrophobicContact CD2-CD1 4.43Å; W417-L443 HydrophobicContact CG-CD1 4.07Å
418	Y	92.4	Very high	85.6	Confident	40 Å²	40	49 Å²	49	16%	0.157	27%	0.265	C	S	.	.	H	α-helix	trans	-69.1	-42.4	178.3	-169	-124.3	0	0	0	112.4	F414 H415 L416 V420 A421 L422 L437 V450	F414-Y418 HydrophobicContact CE1-CD1 4.36Å; F414-Y418 HydrophobicContact CE1-CG 4.29Å; F414-Y418 HydrophobicContact CZ-CD1 4.43Å; F414-Y418 HydrophobicContact CZ-CD2 4.35Å; F414-Y418 HydrophobicContact CZ-CG 4.08Å; F414-Y418 WeakPolarHBondContact O-CB 3.27Å; F414-Y418 PolarHBondContact O-N 2.95Å; H415-Y418 PolarHBondContact O-N 2.9Å; L416-Y418 VanDerWaalsContact C-N 3.25Å; L416-Y418 PolarHBondContact O-N 3.44Å; Y418-V420 VanDerWaalsContact C-N 3.35Å; Y418-V420 PolarHBondContact O-N 3.34Å; Y418-A421 WeakPolarHBondContact O-CB 3.45Å; Y418-A421 PolarHBondContact O-N 3.06Å; Y418-L422 HydrophobicContact CD1-CD1 3.95Å; Y418-L422 HydrophobicContact CD1-CG 4.46Å; Y418-L422 HydrophobicContact CD2-CG 4.5Å; Y418-L422 HydrophobicContact CE1-CD1 3.63Å; Y418-L422 HydrophobicContact CE1-CG 4.22Å; Y418-L422 HydrophobicContact CE2-CD2 4.2Å; Y418-L422 HydrophobicContact CE2-CG 4.25Å; Y418-L422 WeakPolarHBondContact O-CG 3.49Å; Y418-L422 PolarHBondContact O-N 3.41Å; Y418-L437 HydrophobicContact CD2-CD2 4.32Å; Y418-L437 HydrophobicContact CE2-CD2 4.18Å; Y418-V450 HydrophobicContact CD2-CG2 4.24Å; Y418-V450 HydrophobicContact CE2-CG1 4.45Å; Y418-V450 HydrophobicContact CE2-CG2 3.94Å
419	Q	92.2	Very high	86.2	Confident	51 Å²	51	46.5 Å²	46.5	24%	0.238	25%	0.254	C	S	.	.	H	α-helix	trans	-60.9	-41.9	174.7	-67.5	-54.5	-35.1	0	0	112.3	L403 H415 L416 L422 S423	L403-Q419 HydrophobicContact CD1-CB 4.12Å; H415-Q419 WeakPolarHBondContact O-CG 3.45Å; H415-Q419 PolarHBondContact O-N 2.78Å; L416-Q419 PolarHBondContact O-N 2.91Å; Q419-L422 PolarHBondContact O-N 3Å; Q419-S423 WeakPolarHBondContact O-CB 3Å; Q419-S423 PolarHBondContact O-N 3.02Å; Q419-S423 PolarHBondContact O-OG 3.22Å
420	V	92.1	Very high	87.1	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-62.2	-47	175.4	-175.5	0	0	0	0	109.5	L403 E404 M407 L416 Y418 L422 S423 M424 L436	L403-V420 HydrophobicContact CB-CB 4.39Å; L403-V420 HydrophobicContact CB-CG2 3.65Å; E404-V420 HydrophobicContact CG-CG1 4.43Å; M407-V420 HydrophobicContact CG-CG2 3.54Å; M407-V420 HydrophobicContact SD-CG2 3.84Å; L416-V420 HydrophobicContact CG-CG2 4.45Å; L416-V420 WeakPolarHBondContact O-CG2 3.47Å; L416-V420 PolarHBondContact O-N 3.15Å; Y418-V420 VanDerWaalsContact C-N 3.35Å; Y418-V420 PolarHBondContact O-N 3.34Å; V420-L422 PolarHBondContact O-N 3.26Å; V420-S423 PolarHBondContact O-N 2.81Å; V420-S423 PolarHBondContact O-OG 2.98Å; V420-M424 HydrophobicContact CG1-CE 4.26Å; V420-M424 HydrophobicContact CG1-CG 4.38Å; V420-M424 VanDerWaalsContact O-CG 3.27Å; V420-M424 WeakPolarHBondContact O-CG 3.37Å; V420-M424 PolarHBondContact O-N 3.41Å; V420-L436 HydrophobicContact CB-CD1 4.32Å; V420-L436 HydrophobicContact CG1-CD1 3.66Å
421	A	92.9	Very high	88.3	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-57.3	-48.1	178	0	0	0	0	0	112.2	W417 Y418 S423 M424 V425 L436 L437	W417-A421 WeakPolarHBondContact O-CB 3.31Å; W417-A421 PolarHBondContact O-N 2.92Å; Y418-A421 WeakPolarHBondContact O-CB 3.45Å; Y418-A421 PolarHBondContact O-N 3.06Å; A421-S423 PolarHBondContact O-N 3.02Å; A421-M424 WeakPolarHBondContact O-CB 3.48Å; A421-M424 PolarHBondContact O-N 3.35Å; A421-V425 WeakPolarHBondContact O-CG2 3.39Å; A421-V425 PolarHBondContact O-N 3.21Å; A421-L436 HydrophobicContact CB-CB 3.84Å; A421-L437 HydrophobicContact CB-CD2 3.75Å; A421-L437 HydrophobicContact CB-CG 3.98Å
422	L	93.5	Very high	89.4	Confident	47 Å²	47	44.8 Å²	44.8	25%	0.246	25%	0.252	C	S	.	.	H	α-helix	trans	-62	-42.5	177.2	-68.9	178.3	0	0	0	112.3	Y418 Q419 V420 M424 V425 A426 M453	Y418-L422 HydrophobicContact CD1-CD1 3.95Å; Y418-L422 HydrophobicContact CD1-CG 4.46Å; Y418-L422 HydrophobicContact CD2-CG 4.5Å; Y418-L422 HydrophobicContact CE1-CD1 3.63Å; Y418-L422 HydrophobicContact CE1-CG 4.22Å; Y418-L422 HydrophobicContact CE2-CD2 4.2Å; Y418-L422 HydrophobicContact CE2-CG 4.25Å; Y418-L422 WeakPolarHBondContact O-CG 3.49Å; Y418-L422 PolarHBondContact O-N 3.41Å; Q419-L422 PolarHBondContact O-N 3Å; V420-L422 PolarHBondContact O-N 3.26Å; L422-M424 VanDerWaalsContact C-N 3.28Å; L422-M424 PolarHBondContact O-N 3.23Å; L422-V425 PolarHBondContact O-N 2.95Å; L422-A426 PolarHBondContact O-N 2.95Å; L422-M453 HydrophobicContact CD2-CE 4.11Å
423	S	93.7	Very high	90.4	Very high	4 Å²	4	42.5 Å²	42.5	3%	0.028	23%	0.229	C	C	.	.	H	α-helix	trans	-62.3	-36.1	176	76.8	0	0	0	0	112.2	S400 Q419 V420 A421 A426 C427	S400-S423 WeakPolarHBondContact CA-OG 3.37Å; Q419-S423 WeakPolarHBondContact O-CB 3Å; Q419-S423 PolarHBondContact O-N 3.02Å; Q419-S423 PolarHBondContact O-OG 3.22Å; V420-S423 PolarHBondContact O-N 2.81Å; V420-S423 PolarHBondContact O-OG 2.98Å; A421-S423 PolarHBondContact O-N 3.02Å; S423-A426 PolarHBondContact O-N 3.04Å; S423-C427 VanDerWaalsContact O-CB 3.22Å; S423-C427 WeakPolarHBondContact O-CB 3.42Å; S423-C427 PolarHBondContact O-N 3.34Å
424	M	92.8	Very high	91	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-70.7	-37.8	176.6	-69.1	-65.3	171.4	0	0	112.2	E404 V420 A421 L422 C427 G428 K429 Y432 A433 L436	E404-M424 VanDerWaalsContact CD-CE 3.42Å; E404-M424 HydrophobicContact CG-CE 3.58Å; E404-M424 WeakPolarHBondContact OE1-CE 3.46Å; V420-M424 HydrophobicContact CG1-CE 4.26Å; V420-M424 HydrophobicContact CG1-CG 4.38Å; V420-M424 VanDerWaalsContact O-CG 3.27Å; V420-M424 WeakPolarHBondContact O-CG 3.37Å; V420-M424 PolarHBondContact O-N 3.41Å; A421-M424 WeakPolarHBondContact O-CB 3.48Å; A421-M424 PolarHBondContact O-N 3.35Å; L422-M424 VanDerWaalsContact C-N 3.28Å; L422-M424 PolarHBondContact O-N 3.23Å; M424-C427 PolarHBondContact O-N 3.42Å; M424-G428 PolarHBondContact O-N 3.06Å; M424-K429 PolarHBondContact O-N 2.85Å; M424-K429 HydrophobicContact SD-CB 4.15Å; M424-K429 HydrophobicContact SD-CD 3.75Å; M424-Y432 HydrophobicContact CE-CD1 3.97Å; M424-Y432 HydrophobicContact CE-CE1 3.86Å; M424-Y432 HydrophobicContact CG-CD1 3.98Å; M424-Y432 HydrophobicContact CG-CE1 4.45Å; M424-Y432 HydrophobicContact SD-CD1 3.8Å; M424-Y432 HydrophobicContact SD-CE1 4.31Å; M424-A433 HydrophobicContact CB-CB 3.77Å; M424-L436 HydrophobicContact CG-CD1 3.95Å
425	V	91.3	Very high	91.2	Very high	41 Å²	41	36.7 Å²	36.7	25%	0.248	21%	0.207	C	C	.	.	H	α-helix	trans	-59.9	-50.4	170.9	175.5	0	0	0	0	109.9	A421 L422 C427 G428 A433 L437 V457	A421-V425 WeakPolarHBondContact O-CG2 3.39Å; A421-V425 PolarHBondContact O-N 3.21Å; L422-V425 PolarHBondContact O-N 2.95Å; V425-C427 VanDerWaalsContact C-N 3.31Å; V425-C427 PolarHBondContact O-N 3.42Å; V425-G428 PolarHBondContact O-N 3.35Å; V425-A433 HydrophobicContact CB-CB 4.5Å; V425-A433 HydrophobicContact CG2-CB 3.57Å; V425-L437 HydrophobicContact CG2-CD1 4.48Å; V425-V457 HydrophobicContact CB-CG2 4.49Å; V425-V457 HydrophobicContact CG1-CG2 3.91Å; V425-V457 HydrophobicContact CG2-CG2 3.73Å
426	A	89.9	Confident	91.5	Very high	51 Å²	51	33.2 Å²	33.2	42%	0.421	19%	0.191	S	C	.	.	H	α-helix	trans	-65.7	-31.4	-179	0	0	0	0	0	113.2	Y396 L422 S423 G428	Y396-A426 HydrophobicContact CD1-CB 3.6Å; Y396-A426 HydrophobicContact CD2-CB 3.85Å; Y396-A426 HydrophobicContact CE1-CB 4.05Å; Y396-A426 HydrophobicContact CE2-CB 4.27Å; Y396-A426 HydrophobicContact CG-CB 3.49Å; Y396-A426 VanDerWaalsContact CG-CB 3.49Å; L422-A426 PolarHBondContact O-N 2.95Å; S423-A426 PolarHBondContact O-N 3.04Å; A426-G428 PolarHBondContact O-N 3.47Å
427	C	87.9	Confident	91.8	Very high	30 Å²	30	32.4 Å²	32.4	20%	0.203	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-14.3	173.1	-177.2	0	0	0	0	113.2	I397 S423 M424 V425 K429	I397-C427 VanDerWaalsContact CG1-SG 3.58Å; S423-C427 VanDerWaalsContact O-CB 3.22Å; S423-C427 WeakPolarHBondContact O-CB 3.42Å; S423-C427 PolarHBondContact O-N 3.34Å; M424-C427 PolarHBondContact O-N 3.42Å; V425-C427 VanDerWaalsContact C-N 3.31Å; V425-C427 PolarHBondContact O-N 3.42Å; C427-K429 VanDerWaalsContact C-N 3.32Å
428	G	85	Confident	91.9	Very high	52 Å²	52	34.1 Å²	34.1	54%	0.536	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.5	4	-174.6	0	0	0	0	0	114.6	M424 V425 A426 S430	M424-G428 PolarHBondContact O-N 3.06Å; V425-G428 PolarHBondContact O-N 3.35Å; A426-G428 PolarHBondContact O-N 3.47Å; G428-S430 PolarHBondContact O-N 2.88Å; G428-S430 PolarHBondContact O-OG 2.73Å
429	K	88.9	Confident	92	Very high	88 Å²	88	35.7 Å²	35.7	38%	0.383	20%	0.202	S	C	.	.			trans	-76.9	60.7	173.9	-70.3	178.2	-177.2	170	0	110.8	M424 C427 A431 Y432 A433	M424-K429 PolarHBondContact O-N 2.85Å; M424-K429 HydrophobicContact SD-CB 4.15Å; M424-K429 HydrophobicContact SD-CD 3.75Å; C427-K429 VanDerWaalsContact C-N 3.32Å; K429-A431 PolarHBondContact O-N 3.4Å; K429-Y432 PolarHBondContact O-N 3.37Å; K429-A433 PolarHBondContact O-N 3.18Å
430	S	90.3	Very high	92	Very high	15 Å²	15	33.2 Å²	33.2	11%	0.105	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-42.4	-164.2	-56.3	0	0	0	0	113	G428 Y432 A433 V434 S461	G428-S430 PolarHBondContact O-N 2.88Å; G428-S430 PolarHBondContact O-OG 2.73Å; S430-Y432 PolarHBondContact O-N 3.21Å; S430-A433 WeakPolarHBondContact O-CB 3.5Å; S430-A433 PolarHBondContact O-N 3.37Å; S430-V434 WeakPolarHBondContact O-CG2 3.37Å; S430-V434 PolarHBondContact O-N 2.76Å; S430-V434 VanDerWaalsContact O-N 3.07Å; S430-S461 WeakPolarHBondContact CB-OG 2.97Å; S430-S461 PolarHBondContact OG-OG 2.65Å
431	A	92.4	Very high	92.1	Very high	45 Å²	45	33.8 Å²	33.8	37%	0.372	19%	0.194	S	C	.	.	H	α-helix	trans	-64.3	-42	-178.3	0	0	0	0	0	112.5	K429 V434 S435 L462 W464	K429-A431 PolarHBondContact O-N 3.4Å; A431-V434 PolarHBondContact O-N 3.42Å; A431-S435 PolarHBondContact O-N 3.08Å; A431-L462 HydrophobicContact CB-CD2 4.05Å; A431-W464 HydrophobicContact CB-CH2 3.74Å; A431-W464 HydrophobicContact CB-CZ2 4.2Å
432	Y	92.2	Very high	92.1	Very high	107 Å²	107	40.4 Å²	40.4	42%	0.42	22%	0.223	S	C	.	.	H	α-helix	trans	-70.7	-39.1	177.4	-171.3	-128.7	0	0	0	111	E404 M424 K429 S430 V434 S435 L436	E404-Y432 WeakPolarHBondContact OE1-CE1 3.39Å; M424-Y432 HydrophobicContact CE-CD1 3.97Å; M424-Y432 HydrophobicContact CE-CE1 3.86Å; M424-Y432 HydrophobicContact CG-CD1 3.98Å; M424-Y432 HydrophobicContact CG-CE1 4.45Å; M424-Y432 HydrophobicContact SD-CD1 3.8Å; M424-Y432 HydrophobicContact SD-CE1 4.31Å; K429-Y432 PolarHBondContact O-N 3.37Å; S430-Y432 PolarHBondContact O-N 3.21Å; Y432-V434 VanDerWaalsContact C-N 3.31Å; Y432-V434 PolarHBondContact O-N 3.47Å; Y432-S435 WeakPolarHBondContact CD2-OG 3.5Å; Y432-S435 PolarHBondContact O-N 2.93Å; Y432-S435 VanDerWaalsContact O-N 3.07Å; Y432-S435 PolarHBondContact O-OG 2.99Å; Y432-L436 HydrophobicContact CD1-CD1 4.11Å; Y432-L436 HydrophobicContact CE1-CD1 3.9Å; Y432-L436 HydrophobicContact CE1-CG 4.43Å; Y432-L436 PolarHBondContact O-N 3.46Å; Y432-L436 VanDerWaalsContact O-N 3.08Å
433	A	93.9	Very high	92	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-55.4	-44.3	173.9	0	0	0	0	0	112.5	M424 V425 K429 S430 S435 L436 L437	M424-A433 HydrophobicContact CB-CB 3.77Å; V425-A433 HydrophobicContact CB-CB 4.5Å; V425-A433 HydrophobicContact CG2-CB 3.57Å; K429-A433 PolarHBondContact O-N 3.18Å; S430-A433 WeakPolarHBondContact O-CB 3.5Å; S430-A433 PolarHBondContact O-N 3.37Å; A433-S435 VanDerWaalsContact C-N 3.33Å; A433-S435 PolarHBondContact O-N 3.12Å; A433-L436 PolarHBondContact O-N 3.39Å; A433-L437 VanDerWaalsContact O-CG 3.3Å; A433-L437 WeakPolarHBondContact O-CG 3.46Å; A433-L437 PolarHBondContact O-N 3.33Å
434	V	94.8	Very high	91.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.2	-41.1	176.1	173.9	0	0	0	0	111.7	S430 A431 Y432 L436 L437 R438 V457 L462 W464 F471	S430-V434 WeakPolarHBondContact O-CG2 3.37Å; S430-V434 PolarHBondContact O-N 2.76Å; S430-V434 VanDerWaalsContact O-N 3.07Å; A431-V434 PolarHBondContact O-N 3.42Å; Y432-V434 VanDerWaalsContact C-N 3.31Å; Y432-V434 PolarHBondContact O-N 3.47Å; V434-L436 PolarHBondContact O-N 3.36Å; V434-L437 PolarHBondContact O-N 3.34Å; V434-R438 WeakPolarHBondContact O-CG 3.33Å; V434-R438 PolarHBondContact O-N 2.9Å; V434-V457 HydrophobicContact CG2-CB 4.16Å; V434-V457 HydrophobicContact CG2-CG1 3.79Å; V434-L462 HydrophobicContact CG2-CD1 3.75Å; V434-W464 HydrophobicContact CB-CZ3 4.41Å; V434-W464 HydrophobicContact CG1-CZ3 4.34Å; V434-F471 HydrophobicContact CG1-CE2 3.95Å; V434-F471 HydrophobicContact CG1-CZ 4.18Å
435	S	93.6	Very high	91.7	Very high	45 Å²	45	49.1 Å²	49.1	32%	0.315	27%	0.272	S	S	.	.	H	α-helix	trans	-63.2	-39.4	176.2	60.4	0	0	0	0	113.2	A431 Y432 A433 R438 E439	A431-S435 PolarHBondContact O-N 3.08Å; Y432-S435 WeakPolarHBondContact CD2-OG 3.5Å; Y432-S435 PolarHBondContact O-N 2.93Å; Y432-S435 VanDerWaalsContact O-N 3.07Å; Y432-S435 PolarHBondContact O-OG 2.99Å; A433-S435 VanDerWaalsContact C-N 3.33Å; A433-S435 PolarHBondContact O-N 3.12Å; S435-R438 PolarHBondContact O-N 3.43Å; S435-E439 PolarHBondContact O-N 2.99Å
436	L	92.9	Very high	91.6	Very high	8 Å²	8	50.4 Å²	50.4	4%	0.042	28%	0.283	C	S	.	.	H	α-helix	trans	-68.4	-43.7	175.4	-66.5	170.7	0	0	0	111.7	W417 V420 A421 M424 Y432 A433 V434 R438 E439 C440	W417-L436 HydrophobicContact CE3-CD2 4.12Å; W417-L436 HydrophobicContact CZ3-CD2 3.97Å; V420-L436 HydrophobicContact CB-CD1 4.32Å; V420-L436 HydrophobicContact CG1-CD1 3.66Å; A421-L436 HydrophobicContact CB-CB 3.84Å; M424-L436 HydrophobicContact CG-CD1 3.95Å; Y432-L436 HydrophobicContact CD1-CD1 4.11Å; Y432-L436 HydrophobicContact CE1-CD1 3.9Å; Y432-L436 HydrophobicContact CE1-CG 4.43Å; Y432-L436 PolarHBondContact O-N 3.46Å; Y432-L436 VanDerWaalsContact O-N 3.08Å; A433-L436 PolarHBondContact O-N 3.39Å; V434-L436 PolarHBondContact O-N 3.36Å; L436-R438 VanDerWaalsContact C-N 3.26Å; L436-R438 PolarHBondContact O-N 3.42Å; L436-E439 PolarHBondContact O-N 3.27Å; L436-C440 PolarHBondContact O-N 3.42Å; L436-C440 PolarHBondContact O-SG 3.28Å; L436-C440 VanDerWaalsContact O-SG 3.32Å
437	L	94.4	Very high	91.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-36.3	176.6	-70	169.8	0	0	0	111.8	Y418 A421 V425 A433 V434 E439 C440 V441 V450 M453 A454	Y418-L437 HydrophobicContact CD2-CD2 4.32Å; Y418-L437 HydrophobicContact CE2-CD2 4.18Å; A421-L437 HydrophobicContact CB-CD2 3.75Å; A421-L437 HydrophobicContact CB-CG 3.98Å; V425-L437 HydrophobicContact CG2-CD1 4.48Å; A433-L437 VanDerWaalsContact O-CG 3.3Å; A433-L437 WeakPolarHBondContact O-CG 3.46Å; A433-L437 PolarHBondContact O-N 3.33Å; V434-L437 PolarHBondContact O-N 3.34Å; L437-E439 VanDerWaalsContact C-N 3.3Å; L437-E439 PolarHBondContact O-N 2.84Å; L437-C440 WeakPolarHBondContact O-CB 3.28Å; L437-C440 PolarHBondContact O-N 3.47Å; L437-V441 VanDerWaalsContact O-CG2 3.29Å; L437-V441 WeakPolarHBondContact O-CG2 3.44Å; L437-V441 PolarHBondContact O-N 3.06Å; L437-V450 HydrophobicContact CB-CG1 4.41Å; L437-V450 HydrophobicContact CD2-CG1 3.84Å; L437-M453 HydrophobicContact CD1-CB 4.45Å; L437-M453 HydrophobicContact CD1-CG 4.16Å; L437-A454 HydrophobicContact CB-CB 4.03Å; L437-A454 HydrophobicContact CD1-CB 3.9Å
438	R	93.8	Very high	91.9	Very high	92 Å²	92	48.5 Å²	48.5	35%	0.347	26%	0.264	S	S	.	.	H	α-helix	trans	-58.3	-41.7	172.7	-75	179.4	-173.5	157.9	3.5	112.5	V434 S435 L436 K442 E467 F471	V434-R438 WeakPolarHBondContact O-CG 3.33Å; V434-R438 PolarHBondContact O-N 2.9Å; S435-R438 PolarHBondContact O-N 3.43Å; L436-R438 VanDerWaalsContact C-N 3.26Å; L436-R438 PolarHBondContact O-N 3.42Å; R438-K442 WeakPolarHBondContact O-CG 3.46Å; R438-K442 PolarHBondContact O-N 2.74Å; R438-E467 IonicContact CZ-OE2 3.37Å; R438-E467 IonicContact NE-OE2 2.69Å; R438-E467 IonicContact NH2-OE1 3.84Å; R438-E467 IonicContact NH2-OE2 3.72Å; R438-E467 PolarHBondContact NH2-OE2 3.05Å; R438-F471 HydrophobicContact CG-CE1 4.01Å; R438-F471 HydrophobicContact CG-CZ 3.58Å
439	E	92.6	Very high	92.3	Very high	72 Å²	72	47.8 Å²	47.8	34%	0.336	25%	0.249	S	C	.	.	H	α-helix	trans	-70.4	-39.9	176.4	-60.5	-50.9	136.2	0	0	111.1	W417 S435 L436 L437 V441 K442 L443	W417-E439 HydrophobicContact CE3-CB 3.69Å; W417-E439 HydrophobicContact CE3-CG 4.39Å; W417-E439 HydrophobicContact CH2-CB 4.29Å; W417-E439 HydrophobicContact CH2-CG 4.28Å; W417-E439 HydrophobicContact CZ3-CB 3.45Å; W417-E439 VanDerWaalsContact CZ3-CB 3.45Å; W417-E439 HydrophobicContact CZ3-CG 3.65Å; S435-E439 PolarHBondContact O-N 2.99Å; L436-E439 PolarHBondContact O-N 3.27Å; L437-E439 VanDerWaalsContact C-N 3.3Å; L437-E439 PolarHBondContact O-N 2.84Å; E439-V441 VanDerWaalsContact C-N 3.29Å; E439-V441 PolarHBondContact O-N 2.85Å; E439-K442 WeakPolarHBondContact O-CB 3.47Å; E439-K442 PolarHBondContact O-N 3Å; E439-K442 IonicContact OE1-NZ 2.66Å; E439-K442 PolarHBondContact OE1-NZ 2.99Å; E439-K442 WeakPolarHBondContact OE2-CD 3.18Å; E439-K442 IonicContact OE2-NZ 2.84Å; E439-K442 PolarHBondContact OE2-NZ 3.18Å; E439-L443 WeakPolarHBondContact O-CG 3.46Å; E439-L443 PolarHBondContact O-N 3.15Å
440	C	93.5	Very high	92.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.6	-40.6	173.8	-62.8	0	0	0	0	112.4	F414 W417 L436 L437 K442 L443 Q444 V450	F414-C440 HydrophobicContact CD2-CB 4.41Å; F414-C440 HydrophobicContact CE2-CB 4.02Å; W417-C440 VanDerWaalsContact C-SG 3.57Å; L436-C440 PolarHBondContact O-N 3.42Å; L436-C440 PolarHBondContact O-SG 3.28Å; L436-C440 VanDerWaalsContact O-SG 3.32Å; L437-C440 WeakPolarHBondContact O-CB 3.28Å; L437-C440 PolarHBondContact O-N 3.47Å; C440-K442 VanDerWaalsContact C-N 3.29Å; C440-K442 PolarHBondContact O-N 3.26Å; C440-L443 PolarHBondContact O-N 3.34Å; C440-Q444 PolarHBondContact O-N 2.93Å; C440-V450 HydrophobicContact CB-CG1 3.59Å
441	V	94.3	Very high	92.8	Very high	13 Å²	13	43.1 Å²	43.1	8%	0.079	23%	0.227	C	C	.	.	H	α-helix	trans	-62.9	-34.8	175.5	173.8	0	0	0	0	111.9	L437 E439 Q444 P445 V450 P451 M474	L437-V441 VanDerWaalsContact O-CG2 3.29Å; L437-V441 WeakPolarHBondContact O-CG2 3.44Å; L437-V441 PolarHBondContact O-N 3.06Å; E439-V441 VanDerWaalsContact C-N 3.29Å; E439-V441 PolarHBondContact O-N 2.85Å; V441-Q444 CarbonylContact O-C 3.59Å; V441-P445 VanDerWaalsContact O-CA 3.29Å; V441-P445 WeakPolarHBondContact O-CA 3.49Å; V441-V450 HydrophobicContact CG2-CB 4.01Å; V441-V450 HydrophobicContact CG2-CG1 3.6Å; V441-P451 HydrophobicContact CG2-CB 4.16Å; V441-P451 HydrophobicContact CG2-CG 4.49Å; V441-M474 HydrophobicContact CG1-CE 3.3Å; V441-M474 HydrophobicContact CG1-SD 4.37Å
442	K	92.5	Very high	93	Very high	139 Å²	139	41.9 Å²	41.9	60%	0.604	22%	0.215	S	C	*	.	H	α-helix	trans	-70.4	-35.4	174.8	-64.2	177.9	-159.2	161.4	0	112.2	R438 E439 C440	R438-K442 WeakPolarHBondContact O-CG 3.46Å; R438-K442 PolarHBondContact O-N 2.74Å; E439-K442 WeakPolarHBondContact O-CB 3.47Å; E439-K442 PolarHBondContact O-N 3Å; E439-K442 IonicContact OE1-NZ 2.66Å; E439-K442 PolarHBondContact OE1-NZ 2.99Å; E439-K442 WeakPolarHBondContact OE2-CD 3.18Å; E439-K442 IonicContact OE2-NZ 2.84Å; E439-K442 PolarHBondContact OE2-NZ 3.18Å; C440-K442 VanDerWaalsContact C-N 3.29Å; C440-K442 PolarHBondContact O-N 3.26Å
443	L	91.1	Very high	93.1	Very high	72 Å²	72	39.4 Å²	39.4	38%	0.377	21%	0.207	S	C	.	.	H	α-helix	trans	-70.9	-39.8	179.1	-66.4	176.2	0	0	0	111.7	F414 W417 E439 C440	F414-L443 HydrophobicContact CB-CB 4.48Å; F414-L443 HydrophobicContact CD2-CB 4.15Å; W417-L443 HydrophobicContact CB-CD1 4.3Å; W417-L443 HydrophobicContact CD2-CD1 4.43Å; W417-L443 HydrophobicContact CG-CD1 4.07Å; E439-L443 WeakPolarHBondContact O-CG 3.46Å; E439-L443 PolarHBondContact O-N 3.15Å; C440-L443 PolarHBondContact O-N 3.34Å
444	Q	90.8	Very high	93.2	Very high	70 Å²	70	39.4 Å²	39.4	33%	0.327	21%	0.207	S	C	.	.			trans	-133.6	80.5	-179.9	-165.5	173	-21.6	0	0	111.3	F414 C440 V441 S446 D447	F414-Q444 VanDerWaalsContact CD1-OE1 3.25Å; F414-Q444 HydrophobicContact CD2-CB 3.73Å; F414-Q444 VanDerWaalsContact CE1-OE1 3.22Å; F414-Q444 HydrophobicContact CE2-CB 3.7Å; F414-Q444 HydrophobicContact CG-CB 4.36Å; F414-Q444 HydrophobicContact CZ-CB 4.33Å; C440-Q444 PolarHBondContact O-N 2.93Å; V441-Q444 CarbonylContact O-C 3.59Å; Q444-S446 VanDerWaalsContact C-N 3.27Å; Q444-S446 PolarHBondContact O-N 3.27Å; Q444-D447 HydrophobicContact CG-CB 4.02Å; Q444-D447 PolarHBondContact O-N 3.4Å
445	P	89.6	Confident	93.2	Very high	91 Å²	91	39.4 Å²	39.4	59%	0.591	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-17.4	-173.7	28.4	-35.6	0	0	0	114.2	V441 D447	V441-P445 VanDerWaalsContact O-CA 3.29Å; V441-P445 WeakPolarHBondContact O-CA 3.49Å; P445-D447 VanDerWaalsContact C-N 3.32Å
446	S	89	Confident	93.3	Very high	68 Å²	68	42 Å²	42	48%	0.476	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-9.6	179.7	62.2	0	0	0	0	113.6	Q444 P448	Q444-S446 VanDerWaalsContact C-N 3.27Å; Q444-S446 PolarHBondContact O-N 3.27Å; S446-P448 WeakPolarHBondContact O-CD 3.25Å
447	D	90.6	Very high	93.3	Very high	30 Å²	30	42.2 Å²	42.2	16%	0.16	22%	0.215	C	C	.	.			trans	-90.4	113.6	-177.5	-174.1	-8.4	0	0	0	110.9	Q444 P445 T449 V450 P451	Q444-D447 HydrophobicContact CG-CB 4.02Å; Q444-D447 PolarHBondContact O-N 3.4Å; P445-D447 VanDerWaalsContact C-N 3.32Å; D447-T449 VanDerWaalsContact C-N 3.27Å; D447-T449 PolarHBondContact O-N 2.99Å; D447-T449 VanDerWaalsContact OD1-CB 3.3Å; D447-T449 WeakPolarHBondContact OD1-CB 3.4Å; D447-T449 WeakPolarHBondContact OD1-CG2 3.42Å; D447-T449 PolarHBondContact OD1-N 3.16Å; D447-T449 PolarHBondContact OD1-OG1 3.46Å; D447-T449 PolarHBondContact OD2-OG1 3.1Å; D447-T449 VanDerWaalsContact OD2-OG1 3.06Å; D447-V450 HydrophobicContact CB-CG2 4.39Å; D447-P451 WeakPolarHBondContact O-CD 3.41Å
448	P	93.8	Very high	93.4	Very high	11 Å²	11	42.2 Å²	42.2	7%	0.071	22%	0.215	C	C	.	.	S	Bend	trans	-72.7	-16.7	178.6	30.9	-36.5	0	0	0	113.4	S446 P451 L452 V475 L478 A482 F485	S446-P448 WeakPolarHBondContact O-CD 3.25Å; P448-P451 WeakPolarHBondContact O-CD 3.35Å; P448-P451 WeakPolarHBondContact O-CG 3.24Å; P448-L452 VanDerWaalsContact O-CB 3.26Å; P448-L452 WeakPolarHBondContact O-CB 3.17Å; P448-L452 PolarHBondContact O-N 3.14Å; P448-V475 HydrophobicContact CB-CG1 4.18Å; P448-L478 HydrophobicContact CB-CD1 3.82Å; P448-A482 HydrophobicContact CB-CB 4.29Å; P448-F485 HydrophobicContact CB-CB 3.9Å; P448-F485 HydrophobicContact CB-CG 4.33Å; P448-F485 HydrophobicContact CG-CB 3.91Å; P448-F485 HydrophobicContact CG-CD2 3.67Å; P448-F485 HydrophobicContact CG-CE2 4.45Å; P448-F485 HydrophobicContact CG-CG 3.92Å
449	T	93.6	Very high	93.4	Very high	37 Å²	37	38.1 Å²	38.1	23%	0.227	20%	0.199	C	C	.	.	H	α-helix	trans	-72.1	-37.6	-173.3	67.4	0	0	0	0	112.7	D447 L452 M453 F485	D447-T449 VanDerWaalsContact C-N 3.27Å; D447-T449 PolarHBondContact O-N 2.99Å; D447-T449 VanDerWaalsContact OD1-CB 3.3Å; D447-T449 WeakPolarHBondContact OD1-CB 3.4Å; D447-T449 WeakPolarHBondContact OD1-CG2 3.42Å; D447-T449 PolarHBondContact OD1-N 3.16Å; D447-T449 PolarHBondContact OD1-OG1 3.46Å; D447-T449 PolarHBondContact OD2-OG1 3.1Å; D447-T449 VanDerWaalsContact OD2-OG1 3.06Å; T449-L452 PolarHBondContact O-N 3.37Å; T449-M453 WeakPolarHBondContact O-CB 3.17Å; T449-M453 PolarHBondContact O-N 2.97Å; T449-F485 HydrophobicContact CG2-CD1 4.37Å; T449-F485 HydrophobicContact CG2-CE1 3.8Å; T449-F485 HydrophobicContact CG2-CE2 4.08Å; T449-F485 HydrophobicContact CG2-CZ 3.64Å
450	V	94.6	Very high	93.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.7	-53.7	-179.7	-170.8	0	0	0	0	112.1	F414 Y418 L437 C440 V441 D447 L452 M453 A454	F414-V450 HydrophobicContact CE2-CG2 3.98Å; F414-V450 HydrophobicContact CZ-CG2 3.83Å; Y418-V450 HydrophobicContact CD2-CG2 4.24Å; Y418-V450 HydrophobicContact CE2-CG1 4.45Å; Y418-V450 HydrophobicContact CE2-CG2 3.94Å; L437-V450 HydrophobicContact CB-CG1 4.41Å; L437-V450 HydrophobicContact CD2-CG1 3.84Å; C440-V450 HydrophobicContact CB-CG1 3.59Å; V441-V450 HydrophobicContact CG2-CB 4.01Å; V441-V450 HydrophobicContact CG2-CG1 3.6Å; D447-V450 HydrophobicContact CB-CG2 4.39Å; V450-L452 VanDerWaalsContact C-N 3.29Å; V450-L452 PolarHBondContact O-N 2.94Å; V450-M453 PolarHBondContact O-N 3.03Å; V450-A454 PolarHBondContact O-N 3.13Å
451	P	95.7	Very high	92.5	Very high	5 Å²	5	40.6 Å²	40.6	3%	0.032	23%	0.229	C	C	.	.	H	α-helix	trans	-65.3	-32.8	176.1	25.4	-31.7	0	0	0	111.9	V441 D447 P448 A454 A455 F471 M474 V475	V441-P451 HydrophobicContact CG2-CB 4.16Å; V441-P451 HydrophobicContact CG2-CG 4.49Å; D447-P451 WeakPolarHBondContact O-CD 3.41Å; P448-P451 WeakPolarHBondContact O-CD 3.35Å; P448-P451 WeakPolarHBondContact O-CG 3.24Å; P451-A454 PolarHBondContact O-N 3.37Å; P451-A455 PolarHBondContact O-N 2.87Å; P451-F471 HydrophobicContact CB-CB 4.38Å; P451-F471 HydrophobicContact CB-CD1 4.18Å; P451-F471 WeakPolarHBondContact O-CB 3.39Å; P451-M474 HydrophobicContact CB-CB 4.37Å; P451-V475 HydrophobicContact CB-CG2 4.03Å; P451-V475 HydrophobicContact CG-CG2 3.72Å
452	L	95.3	Very high	92.2	Very high	20 Å²	20	41.7 Å²	41.7	11%	0.105	24%	0.235	C	C	.	.	H	α-helix	trans	-64.8	-41	175.2	-172.6	65	0	0	0	112.3	P448 T449 V450 A454 A455 K456 V475 F485 K488 A492 L882	P448-L452 VanDerWaalsContact O-CB 3.26Å; P448-L452 WeakPolarHBondContact O-CB 3.17Å; P448-L452 PolarHBondContact O-N 3.14Å; T449-L452 PolarHBondContact O-N 3.37Å; V450-L452 VanDerWaalsContact C-N 3.29Å; V450-L452 PolarHBondContact O-N 2.94Å; L452-A454 VanDerWaalsContact C-N 3.33Å; L452-A454 PolarHBondContact O-N 3.33Å; L452-A455 PolarHBondContact O-N 2.88Å; L452-K456 PolarHBondContact O-N 3.34Å; L452-V475 HydrophobicContact CB-CG2 4.19Å; L452-F485 HydrophobicContact CD2-CD1 4.03Å; L452-K488 HydrophobicContact CD1-CB 4.2Å; L452-K488 HydrophobicContact CD2-CB 3.77Å; L452-K488 HydrophobicContact CD2-CD 4.05Å; L452-A492 HydrophobicContact CD1-CB 4.08Å; L452-L882 HydrophobicContact CD1-CD1 4.35Å; L452-L882 HydrophobicContact CD1-CD2 4.26Å
453	M	94.6	Very high	92.3	Very high	54 Å²	54	38.9 Å²	38.9	27%	0.266	22%	0.224	S	C	.	.	H	α-helix	trans	-63	-40.2	173.4	-172.7	63.6	76.3	0	0	111.3	L422 L437 T449 V450 K456 V457	L422-M453 HydrophobicContact CD2-CE 4.11Å; L437-M453 HydrophobicContact CD1-CB 4.45Å; L437-M453 HydrophobicContact CD1-CG 4.16Å; T449-M453 WeakPolarHBondContact O-CB 3.17Å; T449-M453 PolarHBondContact O-N 2.97Å; V450-M453 PolarHBondContact O-N 3.03Å; M453-K456 WeakPolarHBondContact O-CB 3.39Å; M453-K456 PolarHBondContact O-N 3.48Å; M453-K456 HydrophobicContact SD-CD 4.37Å; M453-V457 WeakPolarHBondContact O-CG2 3.2Å; M453-V457 PolarHBondContact O-N 3.42Å; M453-V457 VanDerWaalsContact O-N 3.11Å
454	A	95.2	Very high	92.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.7	-43.4	175.6	0	0	0	0	0	111.7	L437 V450 P451 L452 K456 V457 C458 F471	L437-A454 HydrophobicContact CB-CB 4.03Å; L437-A454 HydrophobicContact CD1-CB 3.9Å; V450-A454 PolarHBondContact O-N 3.13Å; P451-A454 PolarHBondContact O-N 3.37Å; L452-A454 VanDerWaalsContact C-N 3.33Å; L452-A454 PolarHBondContact O-N 3.33Å; A454-K456 VanDerWaalsContact C-N 3.34Å; A454-K456 PolarHBondContact O-N 3.47Å; A454-V457 PolarHBondContact O-N 3.28Å; A454-C458 WeakPolarHBondContact O-CB 3.41Å; A454-C458 PolarHBondContact O-N 3.05Å; A454-C458 PolarHBondContact O-SG 3.09Å; A454-F471 HydrophobicContact CB-CD1 3.92Å; A454-F471 HydrophobicContact CB-CD2 3.65Å; A454-F471 HydrophobicContact CB-CE1 3.91Å; A454-F471 HydrophobicContact CB-CE2 3.65Å; A454-F471 HydrophobicContact CB-CG 3.8Å; A454-F471 HydrophobicContact CB-CZ 3.77Å
455	A	95.9	Very high	92.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.8	-44.2	174.5	0	0	0	0	0	111.6	P451 L452 V457 C458 I459 F471 A492 L882	P451-A455 PolarHBondContact O-N 2.87Å; L452-A455 PolarHBondContact O-N 2.88Å; A455-V457 PolarHBondContact O-N 3.49Å; A455-C458 PolarHBondContact O-N 3.3Å; A455-I459 WeakPolarHBondContact O-CB 3.49Å; A455-I459 VanDerWaalsContact O-CG1 3.29Å; A455-I459 WeakPolarHBondContact O-CG1 3.12Å; A455-I459 PolarHBondContact O-N 3.01Å; A455-F471 HydrophobicContact CB-CB 3.95Å; A455-A492 HydrophobicContact CB-CB 4.39Å; A455-L882 HydrophobicContact CB-CD1 4.17Å
456	K	95.1	Very high	93	Very high	101 Å²	101	39.9 Å²	39.9	44%	0.439	21%	0.214	S	C	.	.	H	α-helix	trans	-56.9	-48.1	176	175.1	174.4	176.8	137.9	0	112.7	L452 M453 A454 C458 I459 G460 L882	L452-K456 PolarHBondContact O-N 3.34Å; M453-K456 WeakPolarHBondContact O-CB 3.39Å; M453-K456 PolarHBondContact O-N 3.48Å; M453-K456 HydrophobicContact SD-CD 4.37Å; A454-K456 VanDerWaalsContact C-N 3.34Å; A454-K456 PolarHBondContact O-N 3.47Å; K456-C458 VanDerWaalsContact C-N 3.33Å; K456-C458 PolarHBondContact O-N 3.42Å; K456-I459 PolarHBondContact O-N 3.16Å; K456-G460 PolarHBondContact O-N 3.31Å; K456-L882 HydrophobicContact CB-CB 3.79Å; K456-L882 HydrophobicContact CB-CD1 4.12Å; K456-L882 HydrophobicContact CD-CB 4.32Å; K456-L882 WeakPolarHBondContact CD-O 3.32Å; K456-L882 WeakPolarHBondContact CE-O 3.34Å; K456-L882 HydrophobicContact CG-CB 3.88Å; K456-L882 PolarHBondContact NZ-O 3.2Å
457	V	94.2	Very high	93.3	Very high	11 Å²	11	38.3 Å²	38.3	7%	0.067	20%	0.2	C	C	.	.	H	α-helix	trans	-65.9	-37.7	179.4	178.7	0	0	0	0	111.3	V425 V434 M453 A454 A455 L462	V425-V457 HydrophobicContact CB-CG2 4.49Å; V425-V457 HydrophobicContact CG1-CG2 3.91Å; V425-V457 HydrophobicContact CG2-CG2 3.73Å; V434-V457 HydrophobicContact CG2-CB 4.16Å; V434-V457 HydrophobicContact CG2-CG1 3.79Å; M453-V457 WeakPolarHBondContact O-CG2 3.2Å; M453-V457 PolarHBondContact O-N 3.42Å; M453-V457 VanDerWaalsContact O-N 3.11Å; A454-V457 PolarHBondContact O-N 3.28Å; A455-V457 PolarHBondContact O-N 3.49Å; V457-L462 HydrophobicContact CG1-CD1 3.99Å
458	C	95.3	Very high	93.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-67.6	-38.3	176.1	-71.9	0	0	0	0	113.2	A454 A455 K456 H463 W464 A468	A454-C458 WeakPolarHBondContact O-CB 3.41Å; A454-C458 PolarHBondContact O-N 3.05Å; A454-C458 PolarHBondContact O-SG 3.09Å; A455-C458 PolarHBondContact O-N 3.3Å; K456-C458 VanDerWaalsContact C-N 3.33Å; K456-C458 PolarHBondContact O-N 3.42Å; C458-H463 CarbonylContact O-C 3.17Å; C458-H463 WeakPolarHBondContact O-CA 3.47Å; C458-H463 PolarHBondContact O-N 2.65Å; C458-W464 HydrophobicContact CB-CB 4.23Å; C458-W464 PolarHBondContact O-N 3.17Å; C458-A468 HydrophobicContact CB-CB 3.73Å
459	I	94.3	Very high	93.8	Very high	6 Å²	6	38.5 Å²	38.5	3%	0.031	20%	0.198	C	C	.	.	H	α-helix	trans	-70.8	-37.4	178.1	-73.4	175	0	0	0	112	A455 K456 A468 A492 L495 T496 L499 R880 L882	A455-I459 WeakPolarHBondContact O-CB 3.49Å; A455-I459 VanDerWaalsContact O-CG1 3.29Å; A455-I459 WeakPolarHBondContact O-CG1 3.12Å; A455-I459 PolarHBondContact O-N 3.01Å; K456-I459 PolarHBondContact O-N 3.16Å; I459-A468 HydrophobicContact CD1-CB 4.38Å; I459-A468 HydrophobicContact CG1-CB 3.68Å; I459-A492 WeakPolarHBondContact CD1-O 3.42Å; I459-L495 HydrophobicContact CD1-CB 4.22Å; I459-T496 WeakPolarHBondContact CD1-OG1 3.19Å; I459-L499 HydrophobicContact CG2-CD1 3.69Å; I459-R880 VanDerWaalsContact CG2-O 3.27Å; I459-R880 WeakPolarHBondContact CG2-O 3.37Å; I459-L882 HydrophobicContact CD1-CD1 3.62Å; I459-L882 HydrophobicContact CD1-CG 4.22Å
460	G	88.8	Confident	93.9	Very high	30 Å²	30	43 Å²	43	31%	0.309	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-113.8	-177.7	0	0	0	0	0	113.5	K456 L462 H463	K456-G460 PolarHBondContact O-N 3.31Å; G460-L462 VanDerWaalsContact C-N 3.33Å; G460-L462 PolarHBondContact O-N 2.98Å; G460-H463 PolarHBondContact O-N 3.21Å
461	S	78.3	Confident	94	Very high	94 Å²	94	43.3 Å²	43.3	66%	0.657	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-26.8	-167.8	58.8	0	0	0	0	115.4	S430	S430-S461 WeakPolarHBondContact CB-OG 2.97Å; S430-S461 PolarHBondContact OG-OG 2.65Å
462	L	88.7	Confident	94.1	Very high	37 Å²	37	43.1 Å²	43.1	19%	0.194	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-26.8	-176.1	-69.5	178.2	0	0	0	113.9	A431 V434 V457 G460 W464	A431-L462 HydrophobicContact CB-CD2 4.05Å; V434-L462 HydrophobicContact CG2-CD1 3.75Å; V457-L462 HydrophobicContact CG1-CD1 3.99Å; G460-L462 VanDerWaalsContact C-N 3.33Å; G460-L462 PolarHBondContact O-N 2.98Å; L462-W464 HydrophobicContact CB-CB 4.43Å; L462-W464 HydrophobicContact CB-CD2 4.16Å; L462-W464 HydrophobicContact CB-CG 3.99Å; L462-W464 HydrophobicContact CD1-CD2 4.09Å; L462-W464 HydrophobicContact CD1-CE3 3.89Å; L462-W464 HydrophobicContact CD1-CH2 4.46Å; L462-W464 HydrophobicContact CD1-CZ3 4.09Å; L462-W464 HydrophobicContact CD2-CZ2 4.46Å; L462-W464 PolarHBondContact O-N 2.81Å
463	H	93.3	Very high	94.1	Very high	80 Å²	80	46.2 Å²	46.2	37%	0.37	23%	0.226	S	C	.	.			trans	54.1	35.7	-174	-154.8	63	0	0	0	113.7	C458 G460 L465 D503	C458-H463 CarbonylContact O-C 3.17Å; C458-H463 WeakPolarHBondContact O-CA 3.47Å; C458-H463 PolarHBondContact O-N 2.65Å; G460-H463 PolarHBondContact O-N 3.21Å; H463-L465 VanDerWaalsContact C-N 3.33Å; H463-L465 PolarHBondContact O-N 3.07Å; H463-L465 VanDerWaalsContact O-N 3.16Å; H463-D503 IonicContact CD2-OD2 3.41Å; H463-D503 IonicContact CE1-OD1 3.45Å; H463-D503 IonicContact CE1-OD2 2.65Å; H463-D503 IonicContact NE2-OD1 3.62Å; H463-D503 PolarHBondContact NE2-OD1 3.12Å; H463-D503 IonicContact NE2-OD2 2.66Å; H463-D503 PolarHBondContact NE2-OD2 3.1Å
464	W	95.7	Very high	94.2	Very high	106 Å²	106	47.3 Å²	47.3	40%	0.402	23%	0.232	S	C	.	.			trans	-89.2	68.2	178.6	-71.4	-0.2	0	0	0	110.9	A431 V434 C458 L462 E466 E467 A468	A431-W464 HydrophobicContact CB-CH2 3.74Å; A431-W464 HydrophobicContact CB-CZ2 4.2Å; V434-W464 HydrophobicContact CB-CZ3 4.41Å; V434-W464 HydrophobicContact CG1-CZ3 4.34Å; C458-W464 HydrophobicContact CB-CB 4.23Å; C458-W464 PolarHBondContact O-N 3.17Å; L462-W464 HydrophobicContact CB-CB 4.43Å; L462-W464 HydrophobicContact CB-CD2 4.16Å; L462-W464 HydrophobicContact CB-CG 3.99Å; L462-W464 HydrophobicContact CD1-CD2 4.09Å; L462-W464 HydrophobicContact CD1-CE3 3.89Å; L462-W464 HydrophobicContact CD1-CH2 4.46Å; L462-W464 HydrophobicContact CD1-CZ3 4.09Å; L462-W464 HydrophobicContact CD2-CZ2 4.46Å; L462-W464 PolarHBondContact O-N 2.81Å; W464-E466 VanDerWaalsContact C-N 3.34Å; W464-E466 PolarHBondContact O-N 2.79Å; W464-E467 HydrophobicContact CB-CB 4.27Å; W464-E467 PolarHBondContact O-N 3.25Å; W464-E467 VanDerWaalsContact O-N 3.12Å; W464-A468 PolarHBondContact O-N 3.37Å
465	L	96.2	Very high	94.2	Very high	11 Å²	11	47.3 Å²	47.3	6%	0.058	23%	0.232	C	C	.	.	H	α-helix	trans	-63.9	-33.4	-169.1	-55.2	-178.2	0	0	0	113.9	H463 E467 A468 E469 T496 L499 Q500 D503	H463-L465 VanDerWaalsContact C-N 3.33Å; H463-L465 PolarHBondContact O-N 3.07Å; H463-L465 VanDerWaalsContact O-N 3.16Å; L465-E467 VanDerWaalsContact C-N 3.32Å; L465-E467 PolarHBondContact O-N 3.17Å; L465-A468 PolarHBondContact O-N 3.48Å; L465-E469 PolarHBondContact O-N 3.05Å; L465-T496 HydrophobicContact CB-CG2 4.14Å; L465-T496 WeakPolarHBondContact O-CG2 3.28Å; L465-L499 HydrophobicContact CD1-CB 3.77Å; L465-L499 HydrophobicContact CD2-CB 3.8Å; L465-L499 HydrophobicContact CD2-CD1 3.94Å; L465-L499 HydrophobicContact CG-CB 4.47Å; L465-Q500 HydrophobicContact CB-CG 3.72Å; L465-Q500 HydrophobicContact CD1-CB 4.32Å; L465-Q500 HydrophobicContact CD1-CG 3.69Å; L465-Q500 HydrophobicContact CG-CG 4.35Å; L465-D503 WeakPolarHBondContact CD1-OD2 3.15Å
466	E	95.6	Very high	94.2	Very high	137 Å²	137	48.9 Å²	48.9	64%	0.64	24%	0.24	S	C	*	.	H	α-helix	trans	-66.5	-34.9	176.1	-64.7	-172.9	177.9	0	0	112.4	W464 R470	W464-E466 VanDerWaalsContact C-N 3.34Å; W464-E466 PolarHBondContact O-N 2.79Å; E466-R470 WeakPolarHBondContact O-CG 3.48Å; E466-R470 PolarHBondContact O-N 3.45Å
467	E	95.4	Very high	94.2	Very high	35 Å²	35	48.7 Å²	48.7	16%	0.164	25%	0.251	C	S	.	.	H	α-helix	trans	-76	-39	176.8	-69.3	-65.5	137.3	0	0	111.2	R438 W464 L465 E469 R470 F471	R438-E467 IonicContact CZ-OE2 3.37Å; R438-E467 IonicContact NE-OE2 2.69Å; R438-E467 IonicContact NH2-OE1 3.84Å; R438-E467 IonicContact NH2-OE2 3.72Å; R438-E467 PolarHBondContact NH2-OE2 3.05Å; W464-E467 HydrophobicContact CB-CB 4.27Å; W464-E467 PolarHBondContact O-N 3.25Å; W464-E467 VanDerWaalsContact O-N 3.12Å; L465-E467 VanDerWaalsContact C-N 3.32Å; L465-E467 PolarHBondContact O-N 3.17Å; E467-E469 VanDerWaalsContact C-N 3.27Å; E467-E469 PolarHBondContact O-N 3.29Å; E467-R470 WeakPolarHBondContact O-CB 3.29Å; E467-R470 PolarHBondContact O-N 3.07Å; E467-R470 IonicContact OE1-CZ 3.41Å; E467-R470 IonicContact OE1-NE 3.89Å; E467-R470 IonicContact OE1-NH1 2.65Å; E467-R470 PolarHBondContact OE1-NH1 3.07Å; E467-F471 HydrophobicContact CB-CE2 4.36Å; E467-F471 WeakPolarHBondContact O-CD2 3.35Å; E467-F471 PolarHBondContact O-N 3.15Å
468	A	96.4	Very high	94.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-56.6	-43.2	172.2	0	0	0	0	0	111.7	C458 I459 W464 L465 R470 F471 A472 T496	C458-A468 HydrophobicContact CB-CB 3.73Å; I459-A468 HydrophobicContact CD1-CB 4.38Å; I459-A468 HydrophobicContact CG1-CB 3.68Å; W464-A468 PolarHBondContact O-N 3.37Å; L465-A468 PolarHBondContact O-N 3.48Å; A468-R470 PolarHBondContact O-N 2.85Å; A468-F471 PolarHBondContact O-N 3.39Å; A468-A472 VanDerWaalsContact O-CB 3.31Å; A468-A472 WeakPolarHBondContact O-CB 3.25Å; A468-A472 PolarHBondContact O-N 2.94Å; A468-T496 HydrophobicContact CB-CG2 4.04Å
469	E	97.2	Very high	93.9	Very high	44 Å²	44	51 Å²	51	21%	0.206	27%	0.27	C	S	.	.	H	α-helix	trans	-58.9	-46.5	176.2	-173.9	176.4	175.2	0	0	111.3	L465 E467 A472 M473 L493 T496 Y497 Q500	L465-E469 PolarHBondContact O-N 3.05Å; E467-E469 VanDerWaalsContact C-N 3.27Å; E467-E469 PolarHBondContact O-N 3.29Å; E469-A472 PolarHBondContact O-N 2.77Å; E469-M473 HydrophobicContact CG-CE 3.95Å; E469-M473 WeakPolarHBondContact O-CB 3.47Å; E469-M473 WeakPolarHBondContact O-CG 3.34Å; E469-M473 PolarHBondContact O-N 2.85Å; E469-L493 HydrophobicContact CG-CD1 3.77Å; E469-T496 HydrophobicContact CB-CG2 4.05Å; E469-Y497 HydrophobicContact CG-CE1 4.26Å; E469-Y497 WeakPolarHBondContact OE1-CE1 3.36Å; E469-Y497 PolarHBondContact OE1-OH 3.05Å; E469-Q500 PolarHBondContact OE2-NE2 2.96Å; E469-Q500 VanDerWaalsContact OE2-NE2 3.12Å
470	R	96.8	Very high	93.5	Very high	131 Å²	131	59.9 Å²	59.9	49%	0.494	31%	0.311	S	S	.	.	H	α-helix	trans	-59.8	-49.9	177.5	-69.1	171.7	-169.6	176.3	2	111.5	E466 E467 A468 M473 M474	E466-R470 WeakPolarHBondContact O-CG 3.48Å; E466-R470 PolarHBondContact O-N 3.45Å; E467-R470 WeakPolarHBondContact O-CB 3.29Å; E467-R470 PolarHBondContact O-N 3.07Å; E467-R470 IonicContact OE1-CZ 3.41Å; E467-R470 IonicContact OE1-NE 3.89Å; E467-R470 IonicContact OE1-NH1 2.65Å; E467-R470 PolarHBondContact OE1-NH1 3.07Å; A468-R470 PolarHBondContact O-N 2.85Å; R470-M473 PolarHBondContact O-N 2.84Å; R470-M474 WeakPolarHBondContact O-CG 3.31Å; R470-M474 PolarHBondContact O-N 3.47Å
471	F	96.6	Very high	93.4	Very high	8 Å²	8	65.3 Å²	65.3	4%	0.035	33%	0.328	C	S	.	.	H	α-helix	trans	-64.8	-40.3	-179.9	-70.7	-57.3	0	0	0	112.8	V434 R438 P451 A454 A455 E467 A468 M473 M474 V475	V434-F471 HydrophobicContact CG1-CE2 3.95Å; V434-F471 HydrophobicContact CG1-CZ 4.18Å; R438-F471 HydrophobicContact CG-CE1 4.01Å; R438-F471 HydrophobicContact CG-CZ 3.58Å; P451-F471 HydrophobicContact CB-CB 4.38Å; P451-F471 HydrophobicContact CB-CD1 4.18Å; P451-F471 WeakPolarHBondContact O-CB 3.39Å; A454-F471 HydrophobicContact CB-CD1 3.92Å; A454-F471 HydrophobicContact CB-CD2 3.65Å; A454-F471 HydrophobicContact CB-CE1 3.91Å; A454-F471 HydrophobicContact CB-CE2 3.65Å; A454-F471 HydrophobicContact CB-CG 3.8Å; A454-F471 HydrophobicContact CB-CZ 3.77Å; A455-F471 HydrophobicContact CB-CB 3.95Å; E467-F471 HydrophobicContact CB-CE2 4.36Å; E467-F471 WeakPolarHBondContact O-CD2 3.35Å; E467-F471 PolarHBondContact O-N 3.15Å; A468-F471 PolarHBondContact O-N 3.39Å; F471-M473 VanDerWaalsContact C-N 3.34Å; F471-M473 PolarHBondContact O-N 3.2Å; F471-M474 HydrophobicContact CD1-SD 4.15Å; F471-M474 WeakPolarHBondContact O-CB 3.41Å; F471-M474 PolarHBondContact O-N 3.08Å; F471-V475 PolarHBondContact O-N 3.07Å
472	A	96.8	Very high	93.8	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-62.9	-41.7	175.3	0	0	0	0	0	111.5	A468 E469 M474 V475 I476 A492 L493	A468-A472 VanDerWaalsContact O-CB 3.31Å; A468-A472 WeakPolarHBondContact O-CB 3.25Å; A468-A472 PolarHBondContact O-N 2.94Å; E469-A472 PolarHBondContact O-N 2.77Å; A472-M474 VanDerWaalsContact C-N 3.31Å; A472-M474 PolarHBondContact O-N 2.93Å; A472-V475 PolarHBondContact O-N 3.21Å; A472-I476 WeakPolarHBondContact O-CG1 3.47Å; A472-I476 PolarHBondContact O-N 2.9Å; A472-A492 HydrophobicContact CB-CB 3.83Å; A472-L493 HydrophobicContact CB-CB 3.93Å; A472-L493 HydrophobicContact CB-CD1 4.38Å
473	M	96.4	Very high	93.8	Very high	85 Å²	85	61.5 Å²	61.5	42%	0.419	31%	0.313	S	S	.	.	H	α-helix	trans	-63.5	-34.6	173.6	-75	-170.6	-63.6	0	0	112.8	E469 R470 F471 I476 S477 L493	E469-M473 HydrophobicContact CG-CE 3.95Å; E469-M473 WeakPolarHBondContact O-CB 3.47Å; E469-M473 WeakPolarHBondContact O-CG 3.34Å; E469-M473 PolarHBondContact O-N 2.85Å; R470-M473 PolarHBondContact O-N 2.84Å; F471-M473 VanDerWaalsContact C-N 3.34Å; F471-M473 PolarHBondContact O-N 3.2Å; M473-I476 PolarHBondContact O-N 3.5Å; M473-S477 WeakPolarHBondContact O-CB 3.36Å; M473-S477 PolarHBondContact O-N 3.01Å; M473-L493 HydrophobicContact CG-CD1 4.48Å
474	M	95.6	Very high	93.6	Very high	77 Å²	77	66 Å²	66	38%	0.379	33%	0.334	S	S	.	.	H	α-helix	trans	-60.9	-45.8	173.7	-68.2	179.6	75.1	0	0	111.3	V441 P451 R470 F471 A472 I476 S477 L478	V441-M474 HydrophobicContact CG1-CE 3.3Å; V441-M474 HydrophobicContact CG1-SD 4.37Å; P451-M474 HydrophobicContact CB-CB 4.37Å; R470-M474 WeakPolarHBondContact O-CG 3.31Å; R470-M474 PolarHBondContact O-N 3.47Å; F471-M474 HydrophobicContact CD1-SD 4.15Å; F471-M474 WeakPolarHBondContact O-CB 3.41Å; F471-M474 PolarHBondContact O-N 3.08Å; A472-M474 VanDerWaalsContact C-N 3.31Å; A472-M474 PolarHBondContact O-N 2.93Å; M474-I476 VanDerWaalsContact C-N 3.33Å; M474-I476 PolarHBondContact O-N 2.93Å; M474-S477 PolarHBondContact O-N 3.03Å; M474-S477 PolarHBondContact O-OG 3.05Å; M474-L478 PolarHBondContact O-N 3.49Å
475	V	95.3	Very high	93.5	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-59.4	-45.3	175.5	178.9	0	0	0	0	111	P448 P451 L452 F471 A472 S477 L478	P448-V475 HydrophobicContact CB-CG1 4.18Å; P451-V475 HydrophobicContact CB-CG2 4.03Å; P451-V475 HydrophobicContact CG-CG2 3.72Å; L452-V475 HydrophobicContact CB-CG2 4.19Å; F471-V475 PolarHBondContact O-N 3.07Å; A472-V475 PolarHBondContact O-N 3.21Å; V475-S477 VanDerWaalsContact C-N 3.29Å; V475-S477 PolarHBondContact O-N 3.33Å; V475-L478 WeakPolarHBondContact O-CB 3.42Å; V475-L478 PolarHBondContact O-N 2.97Å
476	I	95.6	Very high	93.5	Very high	33 Å²	33	65.1 Å²	65.1	17%	0.169	33%	0.334	C	S	.	.	H	α-helix	trans	-64.6	-35.6	179.5	-65.5	164.3	0	0	0	111.2	A472 M473 M474 L478 G479 Y490 L493	A472-I476 WeakPolarHBondContact O-CG1 3.47Å; A472-I476 PolarHBondContact O-N 2.9Å; M473-I476 PolarHBondContact O-N 3.5Å; M474-I476 VanDerWaalsContact C-N 3.33Å; M474-I476 PolarHBondContact O-N 2.93Å; I476-L478 PolarHBondContact O-N 3.18Å; I476-G479 PolarHBondContact O-N 3.13Å; I476-G479 VanDerWaalsContact O-N 3.1Å; I476-Y490 HydrophobicContact CD1-CD1 3.8Å; I476-Y490 HydrophobicContact CD1-CE1 3.94Å; I476-Y490 HydrophobicContact CD1-CG 4.16Å; I476-Y490 HydrophobicContact CG1-CD1 4.32Å; I476-Y490 HydrophobicContact CG1-CD2 4.29Å; I476-Y490 HydrophobicContact CG1-CE1 4.31Å; I476-Y490 HydrophobicContact CG1-CE2 4.3Å; I476-Y490 HydrophobicContact CG1-CG 4.3Å; I476-Y490 HydrophobicContact CG2-CE1 4.11Å; I476-Y490 HydrophobicContact CG2-CE2 4.17Å; I476-L493 HydrophobicContact CD1-CB 4.15Å; I476-L493 HydrophobicContact CD1-CD2 3.6Å
477	S	95.2	Very high	93.5	Very high	97 Å²	97	59.2 Å²	59.2	68%	0.678	31%	0.307	S	S	*	.	H	α-helix	trans	-66.7	-20.5	-179.3	74.3	0	0	0	0	114.1	M473 M474 V475 G479	M473-S477 WeakPolarHBondContact O-CB 3.36Å; M473-S477 PolarHBondContact O-N 3.01Å; M474-S477 PolarHBondContact O-N 3.03Å; M474-S477 PolarHBondContact O-OG 3.05Å; V475-S477 VanDerWaalsContact C-N 3.29Å; V475-S477 PolarHBondContact O-N 3.33Å; S477-G479 PolarHBondContact O-N 3.1Å
478	L	92.4	Very high	93.4	Very high	33 Å²	33	61.3 Å²	61.3	17%	0.173	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-20.3	173.6	-65.1	172.1	0	0	0	112.6	P448 M474 V475 I476 E480 E481 A482	P448-L478 HydrophobicContact CB-CD1 3.82Å; M474-L478 PolarHBondContact O-N 3.49Å; V475-L478 WeakPolarHBondContact O-CB 3.42Å; V475-L478 PolarHBondContact O-N 2.97Å; I476-L478 PolarHBondContact O-N 3.18Å; L478-E480 PolarHBondContact O-N 3.23Å; L478-E481 HydrophobicContact CB-CB 4.38Å; L478-E481 WeakPolarHBondContact O-CB 3.45Å; L478-E481 PolarHBondContact O-N 3.29Å; L478-E481 VanDerWaalsContact O-N 3.16Å; L478-A482 HydrophobicContact CB-CB 4.08Å
479	G	91.9	Very high	93.4	Very high	28 Å²	28	61.3 Å²	61.3	29%	0.289	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	59.3	-122.4	175.5	0	0	0	0	0	113	I476 S477 E481 A482	I476-G479 PolarHBondContact O-N 3.13Å; I476-G479 VanDerWaalsContact O-N 3.1Å; S477-G479 PolarHBondContact O-N 3.1Å; G479-E481 VanDerWaalsContact C-N 3.26Å; G479-E481 PolarHBondContact O-N 3.32Å; G479-A482 PolarHBondContact O-N 3.17Å
480	E	86.1	Confident	93.5	Very high	192 Å²	192	61.6 Å²	61.6	90%	0.897	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-64.7	-28	-179.7	-66	-174	174	0	0	112.9	L478 A482 G483	L478-E480 PolarHBondContact O-N 3.23Å; E480-A482 PolarHBondContact O-N 3Å; E480-G483 PolarHBondContact O-N 2.92Å; E480-G483 VanDerWaalsContact O-N 3.13Å
481	E	86.4	Confident	93.5	Very high	144 Å²	144	55.4 Å²	55.4	67%	0.673	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-65.2	-24.3	179.2	-61.9	-176.3	175.6	0	0	112.3	L478 G479 G483	L478-E481 HydrophobicContact CB-CB 4.38Å; L478-E481 WeakPolarHBondContact O-CB 3.45Å; L478-E481 PolarHBondContact O-N 3.29Å; L478-E481 VanDerWaalsContact O-N 3.16Å; G479-E481 VanDerWaalsContact C-N 3.26Å; G479-E481 PolarHBondContact O-N 3.32Å; E481-G483 VanDerWaalsContact C-N 3.3Å; E481-G483 PolarHBondContact O-N 3.46Å
482	A	86	Confident	93.5	Very high	2 Å²	2	55 Å²	55	2%	0.017	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-73.6	-19.2	177.3	0	0	0	0	0	113.5	P448 L478 G479 E480 E484 F485 L486	P448-A482 HydrophobicContact CB-CB 4.29Å; L478-A482 HydrophobicContact CB-CB 4.08Å; G479-A482 PolarHBondContact O-N 3.17Å; E480-A482 PolarHBondContact O-N 3Å; A482-E484 PolarHBondContact O-N 3.49Å; A482-F485 WeakPolarHBondContact O-CB 3.47Å; A482-F485 PolarHBondContact O-N 3.45Å; A482-L486 HydrophobicContact CB-CB 4Å; A482-L486 HydrophobicContact CB-CD1 4.43Å
483	G	89.6	Confident	93.5	Very high	49 Å²	49	55.6 Å²	55.6	51%	0.505	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	48.7	-122.6	179.2	0	0	0	0	0	113.5	E480 E481 F485 L486	E480-G483 PolarHBondContact O-N 2.92Å; E480-G483 VanDerWaalsContact O-N 3.13Å; E481-G483 VanDerWaalsContact C-N 3.3Å; E481-G483 PolarHBondContact O-N 3.46Å; G483-F485 PolarHBondContact O-N 3.11Å; G483-L486 WeakPolarHBondContact O-CB 3.26Å; G483-L486 PolarHBondContact O-N 2.91Å
484	E	89.6	Confident	93.6	Very high	173 Å²	173	51.6 Å²	51.6	81%	0.808	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-65.7	-14.3	179.6	-61.6	-176.7	173.7	0	0	114.3	A482 P487	A482-E484 PolarHBondContact O-N 3.49Å; E484-P487 WeakPolarHBondContact O-CD 3.49Å
485	F	93.1	Very high	93.7	Very high	69 Å²	69	48 Å²	48	30%	0.303	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-87.7	-12.7	178	-60.8	-83	0	0	0	113.1	P448 T449 L452 A482 G483 K488 G489	P448-F485 HydrophobicContact CB-CB 3.9Å; P448-F485 HydrophobicContact CB-CG 4.33Å; P448-F485 HydrophobicContact CG-CB 3.91Å; P448-F485 HydrophobicContact CG-CD2 3.67Å; P448-F485 HydrophobicContact CG-CE2 4.45Å; P448-F485 HydrophobicContact CG-CG 3.92Å; T449-F485 HydrophobicContact CG2-CD1 4.37Å; T449-F485 HydrophobicContact CG2-CE1 3.8Å; T449-F485 HydrophobicContact CG2-CE2 4.08Å; T449-F485 HydrophobicContact CG2-CZ 3.64Å; L452-F485 HydrophobicContact CD2-CD1 4.03Å; A482-F485 WeakPolarHBondContact O-CB 3.47Å; A482-F485 PolarHBondContact O-N 3.45Å; G483-F485 PolarHBondContact O-N 3.11Å; F485-K488 HydrophobicContact CD1-CD 4.29Å; F485-K488 CarbonylContact O-C 3.57Å; F485-K488 WeakPolarHBondContact O-CA 3.3Å; F485-K488 WeakPolarHBondContact O-CB 3.37Å; F485-K488 PolarHBondContact O-N 2.88Å; F485-K488 VanDerWaalsContact O-N 3.11Å; F485-G489 PolarHBondContact O-N 2.94Å
486	L	95	Very high	93.8	Very high	31 Å²	31	48 Å²	48	16%	0.162	26%	0.256	C	S	.	.	H	α-helix	trans	-60.1	-46.9	178.9	-175.7	65.4	0	0	0	113	A482 G483 K488 G489 Y490 L527	A482-L486 HydrophobicContact CB-CB 4Å; A482-L486 HydrophobicContact CB-CD1 4.43Å; G483-L486 WeakPolarHBondContact O-CB 3.26Å; G483-L486 PolarHBondContact O-N 2.91Å; L486-K488 PolarHBondContact O-N 3.28Å; L486-G489 PolarHBondContact O-N 2.91Å; L486-G489 VanDerWaalsContact O-N 3.16Å; L486-Y490 HydrophobicContact CD1-CD2 4.38Å; L486-Y490 HydrophobicContact CD1-CE2 3.98Å; L486-Y490 HydrophobicContact CG-CD2 4.33Å; L486-Y490 HydrophobicContact CG-CE2 4.11Å; L486-Y490 WeakPolarHBondContact O-CD2 3.25Å; L486-Y490 PolarHBondContact O-N 3.14Å; L486-L527 HydrophobicContact CD2-CD1 4.07Å; L486-L527 HydrophobicContact CG-CD1 4.05Å
487	P	95.3	Very high	93.9	Very high	13 Å²	13	47.7 Å²	47.7	8%	0.084	25%	0.253	C	S	.	.	H	α-helix	trans	-57.9	-37.2	172.7	-18.6	28.7	0	0	0	112.4	E484 Y490 L491 L527 A528	E484-P487 WeakPolarHBondContact O-CD 3.49Å; P487-Y490 PolarHBondContact O-N 3.31Å; P487-L491 WeakPolarHBondContact O-CB 3.41Å; P487-L491 PolarHBondContact O-N 3Å; P487-L527 HydrophobicContact CB-CB 4.24Å; P487-L527 HydrophobicContact CG-CB 3.83Å; P487-A528 HydrophobicContact CB-CB 3.69Å; P487-A528 HydrophobicContact CG-CB 3.76Å
488	K	95.2	Very high	94	Very high	79 Å²	79	43.2 Å²	43.2	34%	0.343	22%	0.222	S	C	.	.	H	α-helix	trans	-68.4	-32.5	177.8	-62.7	-174.6	177.2	-179.8	0	112.7	L452 F485 L486 L491 A492	L452-K488 HydrophobicContact CD1-CB 4.2Å; L452-K488 HydrophobicContact CD2-CB 3.77Å; L452-K488 HydrophobicContact CD2-CD 4.05Å; F485-K488 HydrophobicContact CD1-CD 4.29Å; F485-K488 CarbonylContact O-C 3.57Å; F485-K488 WeakPolarHBondContact O-CA 3.3Å; F485-K488 WeakPolarHBondContact O-CB 3.37Å; F485-K488 PolarHBondContact O-N 2.88Å; F485-K488 VanDerWaalsContact O-N 3.11Å; L486-K488 PolarHBondContact O-N 3.28Å; K488-L491 PolarHBondContact O-N 3.47Å; K488-A492 WeakPolarHBondContact O-CB 3.4Å; K488-A492 PolarHBondContact O-N 3Å
489	G	96.2	Very high	94.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-45.1	170.7	0	0	0	0	0	112.5	F485 L486 A492 L493	F485-G489 PolarHBondContact O-N 2.94Å; L486-G489 PolarHBondContact O-N 2.91Å; L486-G489 VanDerWaalsContact O-N 3.16Å; G489-A492 WeakPolarHBondContact O-CB 3.37Å; G489-A492 PolarHBondContact O-N 3.31Å; G489-L493 PolarHBondContact O-N 3.25Å
490	Y	97.5	Very high	94.3	Very high	50 Å²	50	42.7 Å²	42.7	20%	0.196	21%	0.211	C	C	.	.	H	α-helix	trans	-66.5	-37	173.7	-78.4	-73	0	0	0	112.7	I476 L486 P487 L493 G494 R523 L527	I476-Y490 HydrophobicContact CD1-CD1 3.8Å; I476-Y490 HydrophobicContact CD1-CE1 3.94Å; I476-Y490 HydrophobicContact CD1-CG 4.16Å; I476-Y490 HydrophobicContact CG1-CD1 4.32Å; I476-Y490 HydrophobicContact CG1-CD2 4.29Å; I476-Y490 HydrophobicContact CG1-CE1 4.31Å; I476-Y490 HydrophobicContact CG1-CE2 4.3Å; I476-Y490 HydrophobicContact CG1-CG 4.3Å; I476-Y490 HydrophobicContact CG2-CE1 4.11Å; I476-Y490 HydrophobicContact CG2-CE2 4.17Å; L486-Y490 HydrophobicContact CD1-CD2 4.38Å; L486-Y490 HydrophobicContact CD1-CE2 3.98Å; L486-Y490 HydrophobicContact CG-CD2 4.33Å; L486-Y490 HydrophobicContact CG-CE2 4.11Å; L486-Y490 WeakPolarHBondContact O-CD2 3.25Å; L486-Y490 PolarHBondContact O-N 3.14Å; P487-Y490 PolarHBondContact O-N 3.31Å; Y490-L493 PolarHBondContact O-N 3Å; Y490-G494 PolarHBondContact O-N 3.21Å; Y490-R523 HydrophobicContact CD1-CB 4.28Å; Y490-R523 HydrophobicContact CD1-CG 3.97Å; Y490-R523 HydrophobicContact CD2-CG 4.27Å; Y490-R523 HydrophobicContact CE1-CG 3.83Å; Y490-R523 HydrophobicContact CE2-CG 4.13Å; Y490-R523 HydrophobicContact CG-CG 4.19Å; Y490-L527 HydrophobicContact CD2-CD1 3.63Å; Y490-L527 HydrophobicContact CE2-CD1 3.72Å
491	L	97	Very high	94.7	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-60.3	-49.7	173.2	178.5	61.5	0	0	0	111.1	P487 K488 L493 G494 L495 L521 Q533 V534 Y537 L882	P487-L491 WeakPolarHBondContact O-CB 3.41Å; P487-L491 PolarHBondContact O-N 3Å; K488-L491 PolarHBondContact O-N 3.47Å; L491-L493 VanDerWaalsContact C-N 3.3Å; L491-L493 PolarHBondContact O-N 2.95Å; L491-G494 PolarHBondContact O-N 3.42Å; L491-L495 HydrophobicContact CD1-CD1 4.27Å; L491-L495 HydrophobicContact CD1-CG 4.26Å; L491-L495 HydrophobicContact CG-CD1 4.16Å; L491-L495 WeakPolarHBondContact O-CG 3.42Å; L491-L495 PolarHBondContact O-N 2.82Å; L491-L521 HydrophobicContact CD1-CD2 3.62Å; L491-Q533 HydrophobicContact CD2-CG 4.14Å; L491-V534 HydrophobicContact CD2-CG2 4.13Å; L491-Y537 HydrophobicContact CD1-CD2 3.81Å; L491-Y537 HydrophobicContact CD1-CG 4.3Å; L491-L882 HydrophobicContact CD2-CD2 4.34Å; L491-L882 HydrophobicContact CG-CD2 4.38Å
492	A	97.1	Very high	94.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-54.9	-46.1	176.3	0	0	0	0	0	112.1	L452 A455 I459 A472 K488 G489 T496 L882	L452-A492 HydrophobicContact CD1-CB 4.08Å; A455-A492 HydrophobicContact CB-CB 4.39Å; I459-A492 WeakPolarHBondContact CD1-O 3.42Å; A472-A492 HydrophobicContact CB-CB 3.83Å; K488-A492 WeakPolarHBondContact O-CB 3.4Å; K488-A492 PolarHBondContact O-N 3Å; G489-A492 WeakPolarHBondContact O-CB 3.37Å; G489-A492 PolarHBondContact O-N 3.31Å; A492-T496 WeakPolarHBondContact O-CB 3.35Å; A492-T496 PolarHBondContact O-N 3.13Å; A492-T496 PolarHBondContact O-OG1 3.42Å; A492-L882 HydrophobicContact CB-CD1 3.45Å; A492-L882 VanDerWaalsContact CB-CD1 3.45Å; A492-L882 HydrophobicContact CB-CD2 4.02Å; A492-L882 HydrophobicContact CB-CG 4.19Å
493	L	97.8	Very high	95.1	Very high	12 Å²	12	34 Å²	34	6%	0.063	18%	0.178	C	C	.	.	H	α-helix	trans	-64.6	-43.3	178.1	-174.4	60.2	0	0	0	111.7	E469 A472 M473 I476 G489 Y490 L491 T496 Y497 T520	E469-L493 HydrophobicContact CG-CD1 3.77Å; A472-L493 HydrophobicContact CB-CB 3.93Å; A472-L493 HydrophobicContact CB-CD1 4.38Å; M473-L493 HydrophobicContact CG-CD1 4.48Å; I476-L493 HydrophobicContact CD1-CB 4.15Å; I476-L493 HydrophobicContact CD1-CD2 3.6Å; G489-L493 PolarHBondContact O-N 3.25Å; Y490-L493 PolarHBondContact O-N 3Å; L491-L493 VanDerWaalsContact C-N 3.3Å; L491-L493 PolarHBondContact O-N 2.95Å; L493-T496 WeakPolarHBondContact O-CB 3.39Å; L493-T496 PolarHBondContact O-N 2.83Å; L493-Y497 HydrophobicContact CD1-CD2 4.26Å; L493-Y497 HydrophobicContact CD1-CE1 4.34Å; L493-Y497 HydrophobicContact CD1-CE2 3.66Å; L493-Y497 HydrophobicContact CD2-CE2 4Å; L493-Y497 HydrophobicContact CG-CD2 4.03Å; L493-Y497 HydrophobicContact CG-CE2 3.59Å; L493-Y497 PolarHBondContact O-N 3.1Å; L493-T520 HydrophobicContact CD2-CG2 3.89Å; L493-T520 HydrophobicContact CG-CG2 4.19Å
494	G	97.4	Very high	95.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65	-41.1	178.8	0	0	0	0	0	113.7	Y490 L491 T496 Y497 S498 T520	Y490-G494 PolarHBondContact O-N 3.21Å; L491-G494 PolarHBondContact O-N 3.42Å; G494-T496 VanDerWaalsContact C-N 3.34Å; G494-Y497 PolarHBondContact O-N 3.3Å; G494-S498 WeakPolarHBondContact O-CB 3.44Å; G494-S498 PolarHBondContact O-N 3.1Å; G494-T520 WeakPolarHBondContact CA-OG1 3.46Å
495	L	97.3	Very high	95	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.016	14%	0.141	C	C	.	.	H	α-helix	trans	-62.5	-42.5	172.5	-69	174.3	0	0	0	111.4	I459 L491 S498 L499 Y537 R880 L882	I459-L495 HydrophobicContact CD1-CB 4.22Å; L491-L495 HydrophobicContact CD1-CD1 4.27Å; L491-L495 HydrophobicContact CD1-CG 4.26Å; L491-L495 HydrophobicContact CG-CD1 4.16Å; L491-L495 WeakPolarHBondContact O-CG 3.42Å; L491-L495 PolarHBondContact O-N 2.82Å; L495-S498 WeakPolarHBondContact O-CB 3.37Å; L495-S498 PolarHBondContact O-N 3.29Å; L495-L499 WeakPolarHBondContact O-CG 3.47Å; L495-L499 PolarHBondContact O-N 3.34Å; L495-Y537 HydrophobicContact CD1-CD2 4.38Å; L495-Y537 HydrophobicContact CD1-CE2 4.18Å; L495-Y537 HydrophobicContact CD2-CD1 3.55Å; L495-Y537 HydrophobicContact CD2-CD2 4.02Å; L495-Y537 HydrophobicContact CD2-CE1 3.83Å; L495-Y537 HydrophobicContact CD2-CE2 4.21Å; L495-Y537 HydrophobicContact CD2-CG 3.65Å; L495-R880 HydrophobicContact CD2-CB 4.03Å; L495-R880 HydrophobicContact CD2-CG 4.37Å; L495-L882 HydrophobicContact CD1-CD2 4.44Å; L495-L882 HydrophobicContact CD1-CG 4.04Å
496	T	97.6	Very high	94.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.5	-49.5	176.2	-57.4	0	0	0	0	111.2	I459 L465 A468 E469 A492 L493 G494 S498 L499 Q500	I459-T496 WeakPolarHBondContact CD1-OG1 3.19Å; L465-T496 HydrophobicContact CB-CG2 4.14Å; L465-T496 WeakPolarHBondContact O-CG2 3.28Å; A468-T496 HydrophobicContact CB-CG2 4.04Å; E469-T496 HydrophobicContact CB-CG2 4.05Å; A492-T496 WeakPolarHBondContact O-CB 3.35Å; A492-T496 PolarHBondContact O-N 3.13Å; A492-T496 PolarHBondContact O-OG1 3.42Å; L493-T496 WeakPolarHBondContact O-CB 3.39Å; L493-T496 PolarHBondContact O-N 2.83Å; G494-T496 VanDerWaalsContact C-N 3.34Å; T496-S498 VanDerWaalsContact C-N 3.32Å; T496-S498 PolarHBondContact O-N 3.37Å; T496-L499 PolarHBondContact O-N 3.03Å; T496-Q500 HydrophobicContact CG2-CG 4.42Å; T496-Q500 WeakPolarHBondContact O-CB 3.47Å; T496-Q500 VanDerWaalsContact O-CG 3.31Å; T496-Q500 WeakPolarHBondContact O-CG 3.43Å; T496-Q500 PolarHBondContact O-N 2.96Å
497	Y	98.1	Very high	94.3	Very high	26 Å²	26	32.5 Å²	32.5	10%	0.102	17%	0.166	C	C	.	.	H	α-helix	trans	-64	-35.9	176.6	-71.6	-35.7	0	0	0	113	E469 L493 G494 Q500 A501 L513 K516 T520	E469-Y497 HydrophobicContact CG-CE1 4.26Å; E469-Y497 WeakPolarHBondContact OE1-CE1 3.36Å; E469-Y497 PolarHBondContact OE1-OH 3.05Å; L493-Y497 HydrophobicContact CD1-CD2 4.26Å; L493-Y497 HydrophobicContact CD1-CE1 4.34Å; L493-Y497 HydrophobicContact CD1-CE2 3.66Å; L493-Y497 HydrophobicContact CD2-CE2 4Å; L493-Y497 HydrophobicContact CG-CD2 4.03Å; L493-Y497 HydrophobicContact CG-CE2 3.59Å; L493-Y497 PolarHBondContact O-N 3.1Å; G494-Y497 PolarHBondContact O-N 3.3Å; Y497-Q500 PolarHBondContact O-N 3.28Å; Y497-A501 WeakPolarHBondContact O-CB 3.25Å; Y497-A501 PolarHBondContact O-N 3.46Å; Y497-L513 HydrophobicContact CD1-CD2 4.01Å; Y497-K516 HydrophobicContact CD2-CB 3.82Å; Y497-K516 HydrophobicContact CE2-CB 4.17Å; Y497-K516 HydrophobicContact CG-CB 4.16Å; Y497-T520 HydrophobicContact CD2-CG2 4.18Å; Y497-T520 HydrophobicContact CE2-CG2 4.12Å
498	S	96.8	Very high	94	Very high	3 Å²	3	36 Å²	36	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-61.2	-45.5	174.5	-173.9	0	0	0	0	111.6	G494 L495 T496 A501 T502 Q541 R880	G494-S498 WeakPolarHBondContact O-CB 3.44Å; G494-S498 PolarHBondContact O-N 3.1Å; L495-S498 WeakPolarHBondContact O-CB 3.37Å; L495-S498 PolarHBondContact O-N 3.29Å; T496-S498 VanDerWaalsContact C-N 3.32Å; T496-S498 PolarHBondContact O-N 3.37Å; S498-A501 WeakPolarHBondContact O-CB 3.39Å; S498-A501 PolarHBondContact O-N 2.79Å; S498-T502 PolarHBondContact O-N 3.48Å; S498-T502 PolarHBondContact O-OG1 2.77Å; S498-Q541 PolarHBondContact OG-OE1 3.48Å; S498-R880 PolarHBondContact O-NH1 2.91Å; S498-R880 WeakPolarHBondContact OG-CD 3.48Å; S498-R880 PolarHBondContact OG-NH1 3.44Å
499	L	95.8	Very high	93.9	Very high	18 Å²	18	37.9 Å²	37.9	9%	0.094	20%	0.199	C	C	.	.	H	α-helix	trans	-67.3	-44.8	177.5	-73.7	162.4	0	0	0	111.6	I459 L465 L495 T496 A501 T502 D503 R880	I459-L499 HydrophobicContact CG2-CD1 3.69Å; L465-L499 HydrophobicContact CD1-CB 3.77Å; L465-L499 HydrophobicContact CD2-CB 3.8Å; L465-L499 HydrophobicContact CD2-CD1 3.94Å; L465-L499 HydrophobicContact CG-CB 4.47Å; L495-L499 WeakPolarHBondContact O-CG 3.47Å; L495-L499 PolarHBondContact O-N 3.34Å; T496-L499 PolarHBondContact O-N 3.03Å; L499-A501 PolarHBondContact O-N 3.4Å; L499-T502 WeakPolarHBondContact O-CA 3.46Å; L499-T502 WeakPolarHBondContact O-CB 3.44Å; L499-T502 PolarHBondContact O-N 3.26Å; L499-D503 PolarHBondContact O-N 3.46Å; L499-D503 VanDerWaalsContact O-N 3.09Å; L499-R880 HydrophobicContact CD1-CB 4.42Å; L499-R880 HydrophobicContact CD2-CB 4.32Å; L499-R880 VanDerWaalsContact CD2-CZ 3.49Å; L499-R880 HydrophobicContact CG-CB 4.31Å
500	Q	95.6	Very high	93.7	Very high	31 Å²	31	38.7 Å²	38.7	15%	0.145	20%	0.203	C	C	.	.	H	α-helix	trans	-59.1	-33.3	174.9	-71.4	179.2	-2.5	0	0	111.6	L465 E469 T496 Y497 T502 D503 A504 L513	L465-Q500 HydrophobicContact CB-CG 3.72Å; L465-Q500 HydrophobicContact CD1-CB 4.32Å; L465-Q500 HydrophobicContact CD1-CG 3.69Å; L465-Q500 HydrophobicContact CG-CG 4.35Å; E469-Q500 PolarHBondContact OE2-NE2 2.96Å; E469-Q500 VanDerWaalsContact OE2-NE2 3.12Å; T496-Q500 HydrophobicContact CG2-CG 4.42Å; T496-Q500 WeakPolarHBondContact O-CB 3.47Å; T496-Q500 VanDerWaalsContact O-CG 3.31Å; T496-Q500 WeakPolarHBondContact O-CG 3.43Å; T496-Q500 PolarHBondContact O-N 2.96Å; Y497-Q500 PolarHBondContact O-N 3.28Å; Q500-T502 VanDerWaalsContact C-N 3.34Å; Q500-D503 PolarHBondContact O-N 3.2Å; Q500-A504 WeakPolarHBondContact O-CB 3.46Å; Q500-A504 PolarHBondContact O-N 2.85Å; Q500-L513 HydrophobicContact CB-CD1 3.99Å; Q500-L513 HydrophobicContact CB-CD2 4.31Å
501	A	94.1	Very high	93.4	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-67.2	-34.6	174.8	0	0	0	0	0	112.1	Y497 S498 L499 Q510 L513 H514	Y497-A501 WeakPolarHBondContact O-CB 3.25Å; Y497-A501 PolarHBondContact O-N 3.46Å; S498-A501 WeakPolarHBondContact O-CB 3.39Å; S498-A501 PolarHBondContact O-N 2.79Å; L499-A501 PolarHBondContact O-N 3.4Å; A501-Q510 WeakPolarHBondContact O-CG 3.45Å; A501-L513 HydrophobicContact CB-CB 3.6Å; A501-H514 VanDerWaalsContact CB-CE1 3.41Å; A501-H514 WeakPolarHBondContact CB-CE1 3.46Å; A501-H514 WeakPolarHBondContact CB-ND1 3.47Å
502	T	90.9	Very high	93.4	Very high	71 Å²	71	43.6 Å²	43.6	44%	0.436	23%	0.23	S	C	.	.	H	α-helix	trans	-68.5	-37.8	174.4	-54	0	0	0	0	112	S498 L499 Q500 R880	S498-T502 PolarHBondContact O-N 3.48Å; S498-T502 PolarHBondContact O-OG1 2.77Å; L499-T502 WeakPolarHBondContact O-CA 3.46Å; L499-T502 WeakPolarHBondContact O-CB 3.44Å; L499-T502 PolarHBondContact O-N 3.26Å; Q500-T502 VanDerWaalsContact C-N 3.34Å; T502-R880 PolarHBondContact OG1-NH1 3.36Å; T502-R880 PolarHBondContact OG1-NH2 3.39Å
503	D	90.4	Very high	93.4	Very high	85 Å²	85	44.1 Å²	44.1	46%	0.455	23%	0.233	S	C	.	.	H	α-helix	trans	-78.9	-19.9	179.5	-67.8	-4.1	0	0	0	113.7	H463 L465 L499 Q500 T505	H463-D503 IonicContact CD2-OD2 3.41Å; H463-D503 IonicContact CE1-OD1 3.45Å; H463-D503 IonicContact CE1-OD2 2.65Å; H463-D503 IonicContact NE2-OD1 3.62Å; H463-D503 PolarHBondContact NE2-OD1 3.12Å; H463-D503 IonicContact NE2-OD2 2.66Å; H463-D503 PolarHBondContact NE2-OD2 3.1Å; L465-D503 WeakPolarHBondContact CD1-OD2 3.15Å; L499-D503 PolarHBondContact O-N 3.46Å; L499-D503 VanDerWaalsContact O-N 3.09Å; Q500-D503 PolarHBondContact O-N 3.2Å; D503-T505 PolarHBondContact O-N 2.98Å
504	A	91	Very high	93.2	Very high	10 Å²	10	45.2 Å²	45.2	8%	0.083	24%	0.237	C	C	.	.			trans	-65.1	131.2	-177.1	0	0	0	0	0	110.7	Q500 K509 Q510 L513	Q500-A504 WeakPolarHBondContact O-CB 3.46Å; Q500-A504 PolarHBondContact O-N 2.85Å; A504-K509 HydrophobicContact CB-CB 4.36Å; A504-K509 HydrophobicContact CB-CD 4.29Å; A504-K509 HydrophobicContact CB-CG 4.21Å; A504-Q510 HydrophobicContact CB-CG 3.77Å; A504-Q510 WeakPolarHBondContact O-CG 3.31Å; A504-Q510 PolarHBondContact O-NE2 3.06Å; A504-L513 HydrophobicContact CB-CD1 4.06Å
505	T	85.2	Confident	93.2	Very high	74 Å²	74	51.1 Å²	51.1	45%	0.454	26%	0.26	S	S	.	.	S	Bend	trans	-85.2	-23.7	-177.4	56.8	0	0	0	0	114	D503	D503-T505 PolarHBondContact O-N 2.98Å
506	L	87.4	Confident	93.2	Very high	103 Å²	103	54.7 Å²	54.7	54%	0.539	28%	0.275	S	S	.	.	S	Bend	trans	-101.5	126.7	-177.3	-64.5	174.3	0	0	0	110.3	S508 K509 Q510	L506-S508 VanDerWaalsContact C-N 3.27Å; L506-S508 PolarHBondContact O-N 3.35Å; L506-K509 HydrophobicContact CB-CB 4.27Å; L506-K509 WeakPolarHBondContact O-CB 3.22Å; L506-K509 PolarHBondContact O-N 3.5Å; L506-Q510 WeakPolarHBondContact O-CG 3.42Å; L506-Q510 PolarHBondContact O-N 3.38Å
507	K	86.1	Confident	93.2	Very high	102 Å²	102	54.7 Å²	54.7	44%	0.443	28%	0.275	S	S	.	.	H	α-helix	trans	-51.2	-42.8	177.7	-174.2	177.9	-179.5	178.2	0	113.5	K509 Q510 D511	K507-K509 VanDerWaalsContact C-N 3.28Å; K507-K509 PolarHBondContact O-N 2.89Å; K507-Q510 WeakPolarHBondContact O-CB 3.35Å; K507-Q510 PolarHBondContact O-N 3.35Å; K507-D511 VanDerWaalsContact O-CG 3.3Å; K507-D511 PolarHBondContact O-N 2.78Å
508	S	90.3	Very high	93.1	Very high	87 Å²	87	54.6 Å²	54.6	61%	0.608	28%	0.276	S	S	*	.	H	α-helix	trans	-60.3	-38.1	178.7	56.1	0	0	0	0	112.9	L506 E512	L506-S508 VanDerWaalsContact C-N 3.27Å; L506-S508 PolarHBondContact O-N 3.35Å; S508-E512 PolarHBondContact O-N 3.47Å; S508-E512 VanDerWaalsContact O-N 3.14Å
509	K	92.2	Very high	93.1	Very high	118 Å²	118	59.9 Å²	59.9	51%	0.513	30%	0.301	S	S	.	.	H	α-helix	trans	-74	-38.8	176.2	-169.3	178.5	-179.3	-174.9	0	111.2	A504 L506 K507 E512 L513	A504-K509 HydrophobicContact CB-CB 4.36Å; A504-K509 HydrophobicContact CB-CD 4.29Å; A504-K509 HydrophobicContact CB-CG 4.21Å; L506-K509 HydrophobicContact CB-CB 4.27Å; L506-K509 WeakPolarHBondContact O-CB 3.22Å; L506-K509 PolarHBondContact O-N 3.5Å; K507-K509 VanDerWaalsContact C-N 3.28Å; K507-K509 PolarHBondContact O-N 2.89Å; K509-E512 PolarHBondContact O-N 2.69Å; K509-L513 HydrophobicContact CG-CD1 3.94Å; K509-L513 WeakPolarHBondContact O-CB 3.43Å; K509-L513 WeakPolarHBondContact O-CG 3.18Å; K509-L513 PolarHBondContact O-N 3.02Å
510	Q	91.6	Very high	93.2	Very high	17 Å²	17	60 Å²	60	8%	0.079	30%	0.302	C	S	.	.	H	α-helix	trans	-57.2	-51.3	172.9	-64.9	177.3	-12.7	0	0	110.8	A501 A504 L506 K507 E512 L513 H514 R832	A501-Q510 WeakPolarHBondContact O-CG 3.45Å; A504-Q510 HydrophobicContact CB-CG 3.77Å; A504-Q510 WeakPolarHBondContact O-CG 3.31Å; A504-Q510 PolarHBondContact O-NE2 3.06Å; L506-Q510 WeakPolarHBondContact O-CG 3.42Å; L506-Q510 PolarHBondContact O-N 3.38Å; K507-Q510 WeakPolarHBondContact O-CB 3.35Å; K507-Q510 PolarHBondContact O-N 3.35Å; Q510-E512 VanDerWaalsContact C-N 3.28Å; Q510-E512 PolarHBondContact O-N 3.23Å; Q510-L513 PolarHBondContact O-N 3.19Å; Q510-H514 WeakPolarHBondContact O-CB 3.26Å; Q510-H514 PolarHBondContact O-CD2 3.5Å; Q510-H514 VanDerWaalsContact O-CD2 3.31Å; Q510-H514 PolarHBondContact O-N 3.23Å; Q510-R832 PolarHBondContact NE2-O 3.26Å; Q510-R832 VanDerWaalsContact NE2-O 3.14Å
511	D	92.4	Very high	93.3	Very high	74 Å²	74	58.6 Å²	58.6	40%	0.396	30%	0.295	S	S	.	.	H	α-helix	trans	-62	-36.2	179.5	-67.6	-21.7	0	0	0	111.8	K507 R515	K507-D511 VanDerWaalsContact O-CG 3.3Å; K507-D511 PolarHBondContact O-N 2.78Å; D511-R515 WeakPolarHBondContact O-CB 3.08Å; D511-R515 PolarHBondContact O-N 2.97Å; D511-R515 PolarHBondContact O-NH2 3.29Å
512	E	96	Very high	93.3	Very high	80 Å²	80	62.3 Å²	62.3	37%	0.374	31%	0.313	S	S	.	.	H	α-helix	trans	-65.2	-47.5	174.7	-167.1	-167.5	148.6	0	0	112.7	S508 K509 Q510 R515 K516	S508-E512 PolarHBondContact O-N 3.47Å; S508-E512 VanDerWaalsContact O-N 3.14Å; K509-E512 PolarHBondContact O-N 2.69Å; Q510-E512 VanDerWaalsContact C-N 3.28Å; Q510-E512 PolarHBondContact O-N 3.23Å; E512-R515 WeakPolarHBondContact O-CB 3.33Å; E512-R515 PolarHBondContact O-N 3.43Å; E512-K516 PolarHBondContact O-N 2.88Å; E512-K516 WeakPolarHBondContact OE1-CE 3.32Å; E512-K516 IonicContact OE1-NZ 2.71Å; E512-K516 PolarHBondContact OE1-NZ 3.4Å
513	L	96.8	Very high	93.6	Very high	11 Å²	11	64.2 Å²	64.2	6%	0.058	31%	0.312	C	S	.	.	H	α-helix	trans	-70.2	-38.9	-178.4	-70.5	165.6	0	0	0	111.8	Y497 Q500 A501 A504 K509 Q510 R515 K516 A517	Y497-L513 HydrophobicContact CD1-CD2 4.01Å; Q500-L513 HydrophobicContact CB-CD1 3.99Å; Q500-L513 HydrophobicContact CB-CD2 4.31Å; A501-L513 HydrophobicContact CB-CB 3.6Å; A504-L513 HydrophobicContact CB-CD1 4.06Å; K509-L513 HydrophobicContact CG-CD1 3.94Å; K509-L513 WeakPolarHBondContact O-CB 3.43Å; K509-L513 WeakPolarHBondContact O-CG 3.18Å; K509-L513 PolarHBondContact O-N 3.02Å; Q510-L513 PolarHBondContact O-N 3.19Å; L513-R515 VanDerWaalsContact C-N 3.29Å; L513-R515 PolarHBondContact O-N 3.41Å; L513-K516 PolarHBondContact O-N 3.4Å; L513-A517 WeakPolarHBondContact O-CB 3.47Å; L513-A517 PolarHBondContact O-N 3.32Å
514	H	95.2	Very high	93.8	Very high	35 Å²	35	60.2 Å²	60.2	16%	0.162	29%	0.29	C	S	.	.	H	α-helix	trans	-60	-39.3	172.5	-78.4	-42.7	0	0	0	112.5	A501 Q510 L518 Q541 V545	A501-H514 VanDerWaalsContact CB-CE1 3.41Å; A501-H514 WeakPolarHBondContact CB-CE1 3.46Å; A501-H514 WeakPolarHBondContact CB-ND1 3.47Å; Q510-H514 WeakPolarHBondContact O-CB 3.26Å; Q510-H514 PolarHBondContact O-CD2 3.5Å; Q510-H514 VanDerWaalsContact O-CD2 3.31Å; Q510-H514 PolarHBondContact O-N 3.23Å; H514-L518 WeakPolarHBondContact O-CB 3.5Å; H514-L518 PolarHBondContact O-N 2.99Å; H514-Q541 PolarHBondContact ND1-NE2 2.9Å; H514-V545 HydrophobicContact CB-CG2 3.95Å
515	R	96.4	Very high	94	Very high	125 Å²	125	61.2 Å²	61.2	47%	0.472	29%	0.294	S	S	.	.	H	α-helix	trans	-66.7	-44.2	175.1	-166.1	-170.3	-40	97.7	10.9	111.9	D511 E512 L513 L518 Q519	D511-R515 WeakPolarHBondContact O-CB 3.08Å; D511-R515 PolarHBondContact O-N 2.97Å; D511-R515 PolarHBondContact O-NH2 3.29Å; E512-R515 WeakPolarHBondContact O-CB 3.33Å; E512-R515 PolarHBondContact O-N 3.43Å; L513-R515 VanDerWaalsContact C-N 3.29Å; L513-R515 PolarHBondContact O-N 3.41Å; R515-L518 PolarHBondContact O-N 3.44Å; R515-Q519 WeakPolarHBondContact O-CB 3.47Å; R515-Q519 VanDerWaalsContact O-CG 3.28Å; R515-Q519 WeakPolarHBondContact O-CG 3.38Å; R515-Q519 PolarHBondContact O-N 3.22Å
516	K	97.3	Very high	94.4	Very high	77 Å²	77	63.7 Å²	63.7	34%	0.335	30%	0.3	S	S	.	.	H	α-helix	trans	-60.3	-47.5	175.3	-77.5	174.2	168.2	167.5	0	111	Y497 E512 L513 L518 Q519 T520	Y497-K516 HydrophobicContact CD2-CB 3.82Å; Y497-K516 HydrophobicContact CE2-CB 4.17Å; Y497-K516 HydrophobicContact CG-CB 4.16Å; E512-K516 PolarHBondContact O-N 2.88Å; E512-K516 WeakPolarHBondContact OE1-CE 3.32Å; E512-K516 IonicContact OE1-NZ 2.71Å; E512-K516 PolarHBondContact OE1-NZ 3.4Å; L513-K516 PolarHBondContact O-N 3.4Å; K516-L518 PolarHBondContact O-N 3.28Å; K516-Q519 PolarHBondContact O-N 2.83Å; K516-T520 WeakPolarHBondContact O-CG2 3.47Å; K516-T520 PolarHBondContact O-N 3.34Å; K516-T520 PolarHBondContact O-OG1 3.13Å
517	A	97.8	Very high	94.8	Very high	0 Å²	0	62 Å²	62	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-55.7	-51.2	177	0	0	0	0	0	111.3	L513 Q519 T520 L521 Q541	L513-A517 WeakPolarHBondContact O-CB 3.47Å; L513-A517 PolarHBondContact O-N 3.32Å; A517-Q519 PolarHBondContact O-N 2.86Å; A517-T520 WeakPolarHBondContact CA-OG1 3.33Å; A517-T520 PolarHBondContact O-N 3.42Å; A517-T520 PolarHBondContact O-OG1 3.15Å; A517-L521 WeakPolarHBondContact O-CB 3.43Å; A517-L521 VanDerWaalsContact O-CG 3.24Å; A517-L521 WeakPolarHBondContact O-CG 3.43Å; A517-L521 PolarHBondContact O-N 3.21Å; A517-Q541 HydrophobicContact CB-CG 4.21Å
518	L	96.6	Very high	95	Very high	24 Å²	24	58 Å²	58	13%	0.126	28%	0.278	C	S	.	.	H	α-helix	trans	-60.5	-47.7	179.7	-173.3	64.6	0	0	0	111.8	H514 R515 K516 T520 L521 E522 Q541 L542	H514-L518 WeakPolarHBondContact O-CB 3.5Å; H514-L518 PolarHBondContact O-N 2.99Å; R515-L518 PolarHBondContact O-N 3.44Å; K516-L518 PolarHBondContact O-N 3.28Å; L518-T520 VanDerWaalsContact C-N 3.32Å; L518-T520 PolarHBondContact O-N 3.45Å; L518-L521 PolarHBondContact O-N 3.29Å; L518-E522 HydrophobicContact CD1-CG 4.29Å; L518-E522 HydrophobicContact CG-CG 4.34Å; L518-E522 WeakPolarHBondContact O-CB 3.37Å; L518-E522 VanDerWaalsContact O-CG 3.3Å; L518-E522 WeakPolarHBondContact O-CG 3.48Å; L518-E522 PolarHBondContact O-N 3.06Å; L518-Q541 HydrophobicContact CB-CG 4.25Å; L518-Q541 HydrophobicContact CD1-CG 4.31Å; L518-L542 HydrophobicContact CD1-CD2 3.65Å; L518-L542 HydrophobicContact CD1-CG 3.86Å; L518-L542 HydrophobicContact CD2-CD2 3.98Å; L518-L542 HydrophobicContact CG-CD2 4.48Å
519	Q	97	Very high	95	Very high	115 Å²	115	58.5 Å²	58.5	54%	0.537	28%	0.279	S	S	.	.	H	α-helix	trans	-58.3	-42.2	177.6	-73.6	174.7	-4.1	0	0	112.5	R515 K516 A517 R523	R515-Q519 WeakPolarHBondContact O-CB 3.47Å; R515-Q519 VanDerWaalsContact O-CG 3.28Å; R515-Q519 WeakPolarHBondContact O-CG 3.38Å; R515-Q519 PolarHBondContact O-N 3.22Å; K516-Q519 PolarHBondContact O-N 2.83Å; A517-Q519 PolarHBondContact O-N 2.86Å; Q519-R523 WeakPolarHBondContact O-CB 3.44Å; Q519-R523 PolarHBondContact O-N 3.28Å; Q519-R523 VanDerWaalsContact O-N 3.08Å
520	T	97.2	Very high	94.7	Very high	19 Å²	19	55.2 Å²	55.2	12%	0.117	28%	0.278	C	S	.	.	H	α-helix	trans	-70.2	-37.6	178.4	49.3	0	0	0	0	112.8	L493 G494 Y497 K516 A517 L518 R523 A524	L493-T520 HydrophobicContact CD2-CG2 3.89Å; L493-T520 HydrophobicContact CG-CG2 4.19Å; G494-T520 WeakPolarHBondContact CA-OG1 3.46Å; Y497-T520 HydrophobicContact CD2-CG2 4.18Å; Y497-T520 HydrophobicContact CE2-CG2 4.12Å; K516-T520 WeakPolarHBondContact O-CG2 3.47Å; K516-T520 PolarHBondContact O-N 3.34Å; K516-T520 PolarHBondContact O-OG1 3.13Å; A517-T520 WeakPolarHBondContact CA-OG1 3.33Å; A517-T520 PolarHBondContact O-N 3.42Å; A517-T520 PolarHBondContact O-OG1 3.15Å; L518-T520 VanDerWaalsContact C-N 3.32Å; L518-T520 PolarHBondContact O-N 3.45Å; T520-R523 WeakPolarHBondContact O-CB 3.32Å; T520-R523 PolarHBondContact O-N 3Å; T520-A524 PolarHBondContact O-N 3.25Å
521	L	96.8	Very high	94.6	Very high	2 Å²	2	56.2 Å²	56.2	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-72.2	-40.9	178.6	-69.2	171.1	0	0	0	111.6	L491 A517 L518 R523 A524 Q525 V538 Q541	L491-L521 HydrophobicContact CD1-CD2 3.62Å; A517-L521 WeakPolarHBondContact O-CB 3.43Å; A517-L521 VanDerWaalsContact O-CG 3.24Å; A517-L521 WeakPolarHBondContact O-CG 3.43Å; A517-L521 PolarHBondContact O-N 3.21Å; L518-L521 PolarHBondContact O-N 3.29Å; L521-R523 PolarHBondContact O-N 3.44Å; L521-A524 WeakPolarHBondContact O-CB 3.23Å; L521-A524 PolarHBondContact O-N 3.36Å; L521-A524 VanDerWaalsContact O-N 3.1Å; L521-Q525 PolarHBondContact O-N 2.77Å; L521-V538 HydrophobicContact CB-CG2 3.68Å; L521-V538 WeakPolarHBondContact O-CG2 3.36Å; L521-Q541 HydrophobicContact CD1-CB 3.66Å; L521-Q541 HydrophobicContact CD1-CG 3.97Å
522	E	95.5	Very high	94.5	Very high	79 Å²	79	54.7 Å²	54.7	37%	0.369	28%	0.278	S	S	.	.	H	α-helix	trans	-60.1	-37.2	171.5	-73.3	173.9	171.5	0	0	111	L518 Q525 Q526	L518-E522 HydrophobicContact CD1-CG 4.29Å; L518-E522 HydrophobicContact CG-CG 4.34Å; L518-E522 WeakPolarHBondContact O-CB 3.37Å; L518-E522 VanDerWaalsContact O-CG 3.3Å; L518-E522 WeakPolarHBondContact O-CG 3.48Å; L518-E522 PolarHBondContact O-N 3.06Å; E522-Q525 PolarHBondContact O-N 3.13Å; E522-Q526 VanDerWaalsContact O-CG 3.31Å; E522-Q526 WeakPolarHBondContact O-CG 3.33Å; E522-Q526 PolarHBondContact O-N 3.43Å
523	R	95.9	Very high	94.2	Very high	112 Å²	112	53.7 Å²	53.7	42%	0.423	27%	0.273	S	S	.	.	H	α-helix	trans	-64.6	-41.5	173	-175.3	57.8	174.2	176	2.1	112.1	Y490 Q519 T520 L521 Q525 Q526 L527	Y490-R523 HydrophobicContact CD1-CB 4.28Å; Y490-R523 HydrophobicContact CD1-CG 3.97Å; Y490-R523 HydrophobicContact CD2-CG 4.27Å; Y490-R523 HydrophobicContact CE1-CG 3.83Å; Y490-R523 HydrophobicContact CE2-CG 4.13Å; Y490-R523 HydrophobicContact CG-CG 4.19Å; Q519-R523 WeakPolarHBondContact O-CB 3.44Å; Q519-R523 PolarHBondContact O-N 3.28Å; Q519-R523 VanDerWaalsContact O-N 3.08Å; T520-R523 WeakPolarHBondContact O-CB 3.32Å; T520-R523 PolarHBondContact O-N 3Å; L521-R523 PolarHBondContact O-N 3.44Å; R523-Q525 VanDerWaalsContact C-N 3.3Å; R523-Q525 PolarHBondContact O-N 3.48Å; R523-Q526 VanDerWaalsContact NH1-OE1 3.13Å; R523-Q526 PolarHBondContact O-N 3.06Å; R523-L527 WeakPolarHBondContact O-CG 3.43Å; R523-L527 PolarHBondContact O-N 3.5Å
524	A	95.9	Very high	94.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-59.8	-43.1	173.2	0	0	0	0	0	111.1	T520 L521 Q526 L527 A528 V534	T520-A524 PolarHBondContact O-N 3.25Å; L521-A524 WeakPolarHBondContact O-CB 3.23Å; L521-A524 PolarHBondContact O-N 3.36Å; L521-A524 VanDerWaalsContact O-N 3.1Å; A524-Q526 PolarHBondContact O-N 3.25Å; A524-L527 PolarHBondContact O-N 3.44Å; A524-A528 PolarHBondContact O-N 3.43Å; A524-V534 HydrophobicContact CB-CG1 3.74Å; A524-V534 HydrophobicContact CB-CG2 4.46Å
525	Q	94.6	Very high	94	Very high	32 Å²	32	51.7 Å²	51.7	15%	0.15	26%	0.264	C	S	.	.	H	α-helix	trans	-64.8	-39	179.1	-170.4	-178	22.5	0	0	112.6	L521 E522 R523 L527 A528 P529 V534 V538	L521-Q525 PolarHBondContact O-N 2.77Å; E522-Q525 PolarHBondContact O-N 3.13Å; R523-Q525 VanDerWaalsContact C-N 3.3Å; R523-Q525 PolarHBondContact O-N 3.48Å; Q525-L527 VanDerWaalsContact C-N 3.26Å; Q525-L527 PolarHBondContact O-N 3.34Å; Q525-A528 CarbonylContact O-C 3.5Å; Q525-A528 PolarHBondContact O-N 3.46Å; Q525-P529 WeakPolarHBondContact O-CA 3.49Å; Q525-V534 HydrophobicContact CB-CG1 3.93Å; Q525-V538 HydrophobicContact CB-CG2 4.2Å
526	Q	94.4	Very high	93.8	Very high	126 Å²	126	46 Å²	46	59%	0.589	24%	0.243	S	C	*	.	H	α-helix	trans	-61.4	-36.1	174.9	-73.2	168.5	11.5	0	0	112.4	E522 R523 A524	E522-Q526 VanDerWaalsContact O-CG 3.31Å; E522-Q526 WeakPolarHBondContact O-CG 3.33Å; E522-Q526 PolarHBondContact O-N 3.43Å; R523-Q526 VanDerWaalsContact NH1-OE1 3.13Å; R523-Q526 PolarHBondContact O-N 3.06Å; A524-Q526 PolarHBondContact O-N 3.25Å
527	L	94	Very high	93.7	Very high	66 Å²	66	43 Å²	43	35%	0.346	23%	0.23	S	C	.	.	H	α-helix	trans	-79.9	-31.1	179.6	-63.2	172	0	0	0	112.2	L486 P487 Y490 R523 A524 Q525	L486-L527 HydrophobicContact CD2-CD1 4.07Å; L486-L527 HydrophobicContact CG-CD1 4.05Å; P487-L527 HydrophobicContact CB-CB 4.24Å; P487-L527 HydrophobicContact CG-CB 3.83Å; Y490-L527 HydrophobicContact CD2-CD1 3.63Å; Y490-L527 HydrophobicContact CE2-CD1 3.72Å; R523-L527 WeakPolarHBondContact O-CG 3.43Å; R523-L527 PolarHBondContact O-N 3.5Å; A524-L527 PolarHBondContact O-N 3.44Å; Q525-L527 VanDerWaalsContact C-N 3.26Å; Q525-L527 PolarHBondContact O-N 3.34Å
528	A	92	Very high	93.6	Very high	20 Å²	20	43.1 Å²	43.1	17%	0.165	23%	0.23	C	C	.	.			trans	-135.5	76.1	178.9	0	0	0	0	0	111.6	P487 A524 Q525 G530 D531	P487-A528 HydrophobicContact CB-CB 3.69Å; P487-A528 HydrophobicContact CG-CB 3.76Å; A524-A528 PolarHBondContact O-N 3.43Å; Q525-A528 CarbonylContact O-C 3.5Å; Q525-A528 PolarHBondContact O-N 3.46Å; A528-G530 PolarHBondContact O-N 3.41Å; A528-D531 HydrophobicContact CB-CB 3.97Å; A528-D531 PolarHBondContact O-N 2.93Å
529	P	88.5	Confident	93.6	Very high	97 Å²	97	42 Å²	42	63%	0.63	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-13.1	-175.3	28	-35.8	0	0	0	113.8	Q525	Q525-P529 WeakPolarHBondContact O-CA 3.49Å
530	G	86.1	Confident	93.5	Very high	49 Å²	49	36.6 Å²	36.6	51%	0.505	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-0.4	177.6	0	0	0	0	0	114.5	A528 P532	A528-G530 PolarHBondContact O-N 3.41Å; G530-P532 WeakPolarHBondContact O-CD 3.2Å
531	D	90.2	Very high	93.5	Very high	37 Å²	37	35.8 Å²	35.8	20%	0.198	19%	0.194	C	C	.	.			trans	-81.3	111.6	-178.8	-172.2	-26.7	0	0	0	110.3	A528 Q533 V534 I535	A528-D531 HydrophobicContact CB-CB 3.97Å; A528-D531 PolarHBondContact O-N 2.93Å; D531-Q533 VanDerWaalsContact C-N 3.27Å; D531-Q533 PolarHBondContact O-N 2.96Å; D531-Q533 WeakPolarHBondContact OD1-CB 3.47Å; D531-Q533 PolarHBondContact OD1-N 3.24Å; D531-V534 HydrophobicContact CB-CB 4.14Å; D531-V534 HydrophobicContact CB-CG2 3.9Å; D531-V534 PolarHBondContact O-N 3.44Å; D531-I535 WeakPolarHBondContact O-CG1 3.43Å; D531-I535 PolarHBondContact O-N 3.37Å
532	P	89.8	Confident	93.5	Very high	42 Å²	42	36.1 Å²	36.1	27%	0.273	20%	0.196	S	C	.	.	H	α-helix	trans	-63.9	-31.7	-176.9	29.2	-37.4	0	0	0	112.5	G530 I535 L536 C562	G530-P532 WeakPolarHBondContact O-CD 3.2Å; P532-I535 PolarHBondContact O-N 3.3Å; P532-L536 VanDerWaalsContact O-CB 3.28Å; P532-L536 WeakPolarHBondContact O-CB 3.44Å; P532-L536 PolarHBondContact O-N 2.99Å; P532-C562 HydrophobicContact CB-CB 4.1Å; P532-C562 VanDerWaalsContact CG-SG 3.55Å
533	Q	90.9	Very high	93.5	Very high	59 Å²	59	32.4 Å²	32.4	28%	0.276	18%	0.178	S	C	.	.	H	α-helix	trans	-68.5	-41.3	-179.5	-171.6	-178.8	1	0	0	110.3	L491 D531 L536 Y537 L882	L491-Q533 HydrophobicContact CD2-CG 4.14Å; D531-Q533 VanDerWaalsContact C-N 3.27Å; D531-Q533 PolarHBondContact O-N 2.96Å; D531-Q533 WeakPolarHBondContact OD1-CB 3.47Å; D531-Q533 PolarHBondContact OD1-N 3.24Å; Q533-L536 PolarHBondContact O-N 2.67Å; Q533-Y537 HydrophobicContact CG-CD2 3.92Å; Q533-Y537 HydrophobicContact CG-CE2 3.69Å; Q533-Y537 WeakPolarHBondContact O-CD2 3.17Å; Q533-Y537 PolarHBondContact O-N 3.32Å; Q533-Y537 VanDerWaalsContact O-N 3.13Å; Q533-L882 PolarHBondContact NE2-OXT 3.38Å
534	V	93.4	Very high	93.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-64.3	-47.2	176.7	176.9	0	0	0	0	110.8	L491 A524 Q525 D531 L536 Y537 V538	L491-V534 HydrophobicContact CD2-CG2 4.13Å; A524-V534 HydrophobicContact CB-CG1 3.74Å; A524-V534 HydrophobicContact CB-CG2 4.46Å; Q525-V534 HydrophobicContact CB-CG1 3.93Å; D531-V534 HydrophobicContact CB-CB 4.14Å; D531-V534 HydrophobicContact CB-CG2 3.9Å; D531-V534 PolarHBondContact O-N 3.44Å; V534-L536 VanDerWaalsContact C-N 3.33Å; V534-L536 PolarHBondContact O-N 3.43Å; V534-Y537 PolarHBondContact O-N 3.21Å; V534-V538 HydrophobicContact CG1-CG2 4.38Å; V534-V538 VanDerWaalsContact O-CG2 3.3Å; V534-V538 WeakPolarHBondContact O-CG2 3.37Å; V534-V538 PolarHBondContact O-N 3.47Å
535	I	93.4	Very high	93.2	Very high	5 Å²	5	31.1 Å²	31.1	3%	0.026	18%	0.182	C	C	.	.	H	α-helix	trans	-64.2	-39.9	180	-55.8	163.7	0	0	0	110.9	D531 P532 Y537 V538 S539 Q554 A558	D531-I535 WeakPolarHBondContact O-CG1 3.43Å; D531-I535 PolarHBondContact O-N 3.37Å; P532-I535 PolarHBondContact O-N 3.3Å; I535-Y537 VanDerWaalsContact C-N 3.35Å; I535-Y537 PolarHBondContact O-N 2.76Å; I535-V538 PolarHBondContact O-N 3.42Å; I535-S539 WeakPolarHBondContact O-CB 3.33Å; I535-S539 PolarHBondContact O-N 3.29Å; I535-S539 PolarHBondContact O-OG 3.05Å; I535-Q554 HydrophobicContact CG2-CB 4.36Å; I535-Q554 WeakPolarHBondContact CG2-O 3.47Å; I535-A558 HydrophobicContact CB-CB 3.92Å; I535-A558 HydrophobicContact CD1-CB 4.42Å; I535-A558 HydrophobicContact CG2-CB 3.68Å
536	L	93.6	Very high	93.1	Very high	6 Å²	6	32.1 Å²	32.1	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-55.6	-49.4	174.8	173.4	65.4	0	0	0	111.1	P532 Q533 V534 S539 L540 L555 H567 A568 L571	P532-L536 VanDerWaalsContact O-CB 3.28Å; P532-L536 WeakPolarHBondContact O-CB 3.44Å; P532-L536 PolarHBondContact O-N 2.99Å; Q533-L536 PolarHBondContact O-N 2.67Å; V534-L536 VanDerWaalsContact C-N 3.33Å; V534-L536 PolarHBondContact O-N 3.43Å; L536-S539 WeakPolarHBondContact O-CB 3.48Å; L536-S539 PolarHBondContact O-N 3.36Å; L536-L540 WeakPolarHBondContact O-CB 3.41Å; L536-L540 PolarHBondContact O-N 2.97Å; L536-L555 HydrophobicContact CD1-CD1 4.1Å; L536-H567 HydrophobicContact CD2-CB 3.71Å; L536-A568 HydrophobicContact CD1-CB 4.08Å; L536-L571 HydrophobicContact CD1-CB 4.41Å; L536-L571 HydrophobicContact CD1-CD2 3.99Å
537	Y	95.1	Very high	93.1	Very high	13 Å²	13	30.2 Å²	30.2	5%	0.051	18%	0.175	C	C	.	.	H	α-helix	trans	-75.4	-31.1	-177	-73.1	-56.7	0	0	0	113.9	L491 L495 Q533 V534 I535 S539 L540 Q541 P879 R880 E881	L491-Y537 HydrophobicContact CD1-CD2 3.81Å; L491-Y537 HydrophobicContact CD1-CG 4.3Å; L495-Y537 HydrophobicContact CD1-CD2 4.38Å; L495-Y537 HydrophobicContact CD1-CE2 4.18Å; L495-Y537 HydrophobicContact CD2-CD1 3.55Å; L495-Y537 HydrophobicContact CD2-CD2 4.02Å; L495-Y537 HydrophobicContact CD2-CE1 3.83Å; L495-Y537 HydrophobicContact CD2-CE2 4.21Å; L495-Y537 HydrophobicContact CD2-CG 3.65Å; Q533-Y537 HydrophobicContact CG-CD2 3.92Å; Q533-Y537 HydrophobicContact CG-CE2 3.69Å; Q533-Y537 WeakPolarHBondContact O-CD2 3.17Å; Q533-Y537 PolarHBondContact O-N 3.32Å; Q533-Y537 VanDerWaalsContact O-N 3.13Å; V534-Y537 PolarHBondContact O-N 3.21Å; I535-Y537 VanDerWaalsContact C-N 3.35Å; I535-Y537 PolarHBondContact O-N 2.76Å; Y537-S539 VanDerWaalsContact C-N 3.34Å; Y537-L540 HydrophobicContact CD1-CD2 3.94Å; Y537-L540 HydrophobicContact CE1-CD2 4.21Å; Y537-L540 PolarHBondContact O-N 2.78Å; Y537-Q541 WeakPolarHBondContact O-CB 3.45Å; Y537-Q541 PolarHBondContact O-N 2.92Å; Y537-P879 PolarHBondContact OH-O 3.41Å; Y537-R880 HydrophobicContact CE1-CG 4.49Å; Y537-E881 WeakPolarHBondContact CE2-O 3.48Å; Y537-E881 VanDerWaalsContact CZ-O 3.31Å; Y537-E881 PolarHBondContact OH-N 2.79Å; Y537-E881 PolarHBondContact OH-O 3.07Å
538	V	95.5	Very high	93.1	Very high	2 Å²	2	28 Å²	28	1%	0.012	16%	0.163	C	C	.	.	H	α-helix	trans	-58.7	-49.3	166.3	172.4	0	0	0	0	109.9	L521 Q525 V534 I535 L540 Q541 L542	L521-V538 HydrophobicContact CB-CG2 3.68Å; L521-V538 WeakPolarHBondContact O-CG2 3.36Å; Q525-V538 HydrophobicContact CB-CG2 4.2Å; V534-V538 HydrophobicContact CG1-CG2 4.38Å; V534-V538 VanDerWaalsContact O-CG2 3.3Å; V534-V538 WeakPolarHBondContact O-CG2 3.37Å; V534-V538 PolarHBondContact O-N 3.47Å; I535-V538 PolarHBondContact O-N 3.42Å; V538-L540 VanDerWaalsContact C-N 3.34Å; V538-L540 PolarHBondContact O-N 3.25Å; V538-Q541 PolarHBondContact O-N 3.43Å; V538-L542 HydrophobicContact CG1-CD1 4.09Å; V538-L542 WeakPolarHBondContact O-CG 3.41Å; V538-L542 PolarHBondContact O-N 3.33Å
539	S	95.3	Very high	93.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62	-41.5	179.5	-54.9	0	0	0	0	111.7	I535 L536 Y537 L542 A543 A551 Q554 L555	I535-S539 WeakPolarHBondContact O-CB 3.33Å; I535-S539 PolarHBondContact O-N 3.29Å; I535-S539 PolarHBondContact O-OG 3.05Å; L536-S539 WeakPolarHBondContact O-CB 3.48Å; L536-S539 PolarHBondContact O-N 3.36Å; Y537-S539 VanDerWaalsContact C-N 3.34Å; S539-L542 PolarHBondContact O-N 3.44Å; S539-A543 WeakPolarHBondContact O-CB 3.28Å; S539-A543 PolarHBondContact O-N 3.49Å; S539-A551 WeakPolarHBondContact O-CB 3.28Å; S539-Q554 WeakPolarHBondContact OG-CB 3.42Å; S539-L555 PolarHBondContact OG-N 3Å
540	L	96.1	Very high	93.5	Very high	3 Å²	3	28 Å²	28	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-43.2	175.7	-177.2	63.6	0	0	0	111.3	L536 Y537 V538 A543 L544 L571 F875 I878 R880	L536-L540 WeakPolarHBondContact O-CB 3.41Å; L536-L540 PolarHBondContact O-N 2.97Å; Y537-L540 HydrophobicContact CD1-CD2 3.94Å; Y537-L540 HydrophobicContact CE1-CD2 4.21Å; Y537-L540 PolarHBondContact O-N 2.78Å; V538-L540 VanDerWaalsContact C-N 3.34Å; V538-L540 PolarHBondContact O-N 3.25Å; L540-A543 WeakPolarHBondContact O-CB 3.49Å; L540-A543 PolarHBondContact O-N 3.4Å; L540-L544 HydrophobicContact CG-CD1 4.48Å; L540-L544 WeakPolarHBondContact O-CG 3.43Å; L540-L544 PolarHBondContact O-N 3.37Å; L540-L571 HydrophobicContact CB-CD2 4.07Å; L540-L571 HydrophobicContact CD1-CD1 3.84Å; L540-L571 HydrophobicContact CD1-CD2 4.45Å; L540-F875 HydrophobicContact CD1-CB 4.04Å; L540-I878 HydrophobicContact CD1-CB 4.37Å; L540-I878 HydrophobicContact CD1-CD1 4.35Å; L540-I878 HydrophobicContact CD2-CB 4.38Å; L540-I878 HydrophobicContact CD2-CG2 4.24Å; L540-R880 HydrophobicContact CD2-CG 3.9Å
541	Q	96.7	Very high	93.9	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.009	14%	0.141	C	C	.	.	H	α-helix	trans	-66	-39.3	178.8	-172.6	53.3	47.1	0	0	111.8	S498 H514 A517 L518 L521 Y537 V538 A543 L544 V545	S498-Q541 PolarHBondContact OG-OE1 3.48Å; H514-Q541 PolarHBondContact ND1-NE2 2.9Å; A517-Q541 HydrophobicContact CB-CG 4.21Å; L518-Q541 HydrophobicContact CB-CG 4.25Å; L518-Q541 HydrophobicContact CD1-CG 4.31Å; L521-Q541 HydrophobicContact CD1-CB 3.66Å; L521-Q541 HydrophobicContact CD1-CG 3.97Å; Y537-Q541 WeakPolarHBondContact O-CB 3.45Å; Y537-Q541 PolarHBondContact O-N 2.92Å; V538-Q541 PolarHBondContact O-N 3.43Å; Q541-A543 VanDerWaalsContact C-N 3.34Å; Q541-L544 PolarHBondContact O-N 3Å; Q541-V545 WeakPolarHBondContact O-CG2 3.35Å; Q541-V545 PolarHBondContact O-N 3.4Å; Q541-V545 VanDerWaalsContact O-N 3.14Å
542	L	96.3	Very high	94.1	Very high	9 Å²	9	24.8 Å²	24.8	5%	0.047	14%	0.136	C	C	.	.	H	α-helix	trans	-62	-41	171.4	-71.3	169.8	0	0	0	111.7	L518 V538 S539 V545 R546 Q547 A551 Q554	L518-L542 HydrophobicContact CD1-CD2 3.65Å; L518-L542 HydrophobicContact CD1-CG 3.86Å; L518-L542 HydrophobicContact CD2-CD2 3.98Å; L518-L542 HydrophobicContact CG-CD2 4.48Å; V538-L542 HydrophobicContact CG1-CD1 4.09Å; V538-L542 WeakPolarHBondContact O-CG 3.41Å; V538-L542 PolarHBondContact O-N 3.33Å; S539-L542 PolarHBondContact O-N 3.44Å; L542-V545 CarbonylContact O-C 3.33Å; L542-V545 PolarHBondContact O-N 2.97Å; L542-R546 PolarHBondContact O-N 3.34Å; L542-Q547 HydrophobicContact CB-CB 4.48Å; L542-Q547 HydrophobicContact CD2-CB 4.32Å; L542-Q547 VanDerWaalsContact CD2-OE1 3.3Å; L542-Q547 PolarHBondContact O-N 2.94Å; L542-A551 HydrophobicContact CB-CB 3.76Å; L542-Q554 HydrophobicContact CD1-CG 4.2Å
543	A	95.8	Very high	94.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.3	-41.9	176.1	0	0	0	0	0	112.2	S539 L540 Q541 V545 R546 A551 L571 L575 F875	S539-A543 WeakPolarHBondContact O-CB 3.28Å; S539-A543 PolarHBondContact O-N 3.49Å; L540-A543 WeakPolarHBondContact O-CB 3.49Å; L540-A543 PolarHBondContact O-N 3.4Å; Q541-A543 VanDerWaalsContact C-N 3.34Å; A543-V545 VanDerWaalsContact C-N 3.3Å; A543-V545 PolarHBondContact O-N 3.37Å; A543-R546 WeakPolarHBondContact O-CA 3.35Å; A543-R546 PolarHBondContact O-N 3.49Å; A543-A551 HydrophobicContact CB-CB 4.28Å; A543-L571 HydrophobicContact CB-CD1 4.2Å; A543-L575 HydrophobicContact CB-CD2 3.89Å; A543-F875 HydrophobicContact CB-CD1 3.93Å; A543-F875 HydrophobicContact CB-CD2 3.92Å; A543-F875 HydrophobicContact CB-CE1 4.01Å; A543-F875 HydrophobicContact CB-CE2 4Å; A543-F875 HydrophobicContact CB-CG 3.89Å; A543-F875 HydrophobicContact CB-CZ 4.05Å; A543-F875 WeakPolarHBondContact O-CD2 3.36Å; A543-F875 WeakPolarHBondContact O-CE2 3.48Å
544	L	93.4	Very high	94.3	Very high	30 Å²	30	28.3 Å²	28.3	16%	0.157	15%	0.148	C	C	.	.	H	α-helix	trans	-61	-37.9	175.4	-71.8	170.7	0	0	0	112.2	L540 Q541 R546 F875	L540-L544 HydrophobicContact CG-CD1 4.48Å; L540-L544 WeakPolarHBondContact O-CG 3.43Å; L540-L544 PolarHBondContact O-N 3.37Å; Q541-L544 PolarHBondContact O-N 3Å; L544-R546 PolarHBondContact O-N 2.76Å; L544-F875 HydrophobicContact CD2-CB 3.96Å; L544-F875 HydrophobicContact CG-CB 4.47Å
545	V	93.2	Very high	94.2	Very high	56 Å²	56	28.3 Å²	28.3	34%	0.339	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	4.8	175.7	-177.2	0	0	0	0	112.4	H514 Q541 L542 A543 Q547	H514-V545 HydrophobicContact CB-CG2 3.95Å; Q541-V545 WeakPolarHBondContact O-CG2 3.35Å; Q541-V545 PolarHBondContact O-N 3.4Å; Q541-V545 VanDerWaalsContact O-N 3.14Å; L542-V545 CarbonylContact O-C 3.33Å; L542-V545 PolarHBondContact O-N 2.97Å; A543-V545 VanDerWaalsContact C-N 3.3Å; A543-V545 PolarHBondContact O-N 3.37Å; V545-Q547 VanDerWaalsContact C-N 3.3Å; V545-Q547 HydrophobicContact CG1-CG 4.45Å; V545-Q547 PolarHBondContact O-N 3.33Å
546	R	91.9	Very high	94.1	Very high	52 Å²	52	32.3 Å²	32.3	20%	0.196	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	23.2	-180	-53.3	-62.1	-178.2	142.3	1.9	115.2	L542 A543 L544 I548 T835 S869	L542-R546 PolarHBondContact O-N 3.34Å; A543-R546 WeakPolarHBondContact O-CA 3.35Å; A543-R546 PolarHBondContact O-N 3.49Å; L544-R546 PolarHBondContact O-N 2.76Å; R546-I548 VanDerWaalsContact C-N 3.32Å; R546-I548 PolarHBondContact O-N 2.82Å; R546-I548 VanDerWaalsContact O-N 3.15Å; R546-T835 HydrophobicContact CG-CG2 4.42Å; R546-T835 PolarHBondContact NH2-O 3.41Å; R546-T835 PolarHBondContact NH2-OG1 3.11Å; R546-S869 PolarHBondContact NH1-O 3.48Å
547	Q	94.2	Very high	93.6	Very high	87 Å²	87	36.7 Å²	36.7	41%	0.407	19%	0.188	S	C	.	.			trans	-88	68.9	171.1	-64.3	-173.6	4.3	0	0	110.9	L542 V545 S549 S550 A551	L542-Q547 HydrophobicContact CB-CB 4.48Å; L542-Q547 HydrophobicContact CD2-CB 4.32Å; L542-Q547 VanDerWaalsContact CD2-OE1 3.3Å; L542-Q547 PolarHBondContact O-N 2.94Å; V545-Q547 VanDerWaalsContact C-N 3.3Å; V545-Q547 HydrophobicContact CG1-CG 4.45Å; V545-Q547 PolarHBondContact O-N 3.33Å; Q547-S549 PolarHBondContact O-N 3.16Å; Q547-S550 PolarHBondContact O-N 2.98Å; Q547-A551 WeakPolarHBondContact O-CB 3.28Å; Q547-A551 PolarHBondContact O-N 3.46Å
548	I	94.9	Very high	93.1	Very high	18 Å²	18	36.2 Å²	36.2	9%	0.092	19%	0.186	C	C	.	.	H	α-helix	trans	-63.2	-38.9	-168.3	-49.9	-55.5	0	0	0	112.9	R546 M552 L575 A578 Q579 F875	R546-I548 VanDerWaalsContact C-N 3.32Å; R546-I548 PolarHBondContact O-N 2.82Å; R546-I548 VanDerWaalsContact O-N 3.15Å; I548-M552 WeakPolarHBondContact O-CB 3.35Å; I548-M552 PolarHBondContact O-N 3.34Å; I548-M552 VanDerWaalsContact O-N 3.08Å; I548-L575 HydrophobicContact CD1-CD2 4.29Å; I548-L575 HydrophobicContact CG2-CD2 3.94Å; I548-A578 HydrophobicContact CD1-CB 4.23Å; I548-A578 HydrophobicContact CG2-CB 4.34Å; I548-Q579 HydrophobicContact CG2-CG 3.83Å; I548-F875 HydrophobicContact CD1-CE2 4.07Å; I548-F875 HydrophobicContact CD1-CZ 3.95Å
549	S	93.7	Very high	92.8	Very high	75 Å²	75	37.3 Å²	37.3	52%	0.524	19%	0.192	S	C	.	.	H	α-helix	trans	-65.2	-51.5	-179.9	52	0	0	0	0	111.9	Q547 A551 M552 E553	Q547-S549 PolarHBondContact O-N 3.16Å; S549-A551 VanDerWaalsContact C-N 3.32Å; S549-A551 PolarHBondContact O-N 3.23Å; S549-M552 PolarHBondContact O-N 3.33Å; S549-M552 VanDerWaalsContact O-N 3.16Å; S549-E553 PolarHBondContact O-N 2.95Å; S549-E553 VanDerWaalsContact O-N 3.09Å
550	S	94.1	Very high	92.3	Very high	44 Å²	44	44.5 Å²	44.5	31%	0.308	22%	0.223	S	C	.	.	H	α-helix	trans	-62.9	-40.4	179.5	-47.7	0	0	0	0	111.5	Q547 M552 E553 Q554	Q547-S550 PolarHBondContact O-N 2.98Å; S550-M552 VanDerWaalsContact C-N 3.31Å; S550-M552 PolarHBondContact O-N 2.92Å; S550-E553 PolarHBondContact O-N 2.91Å; S550-Q554 WeakPolarHBondContact O-CG 3.24Å; S550-Q554 PolarHBondContact O-N 3.26Å
551	A	95.5	Very high	91.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.5	-40.7	175.5	0	0	0	0	0	112.2	S539 L542 A543 Q547 S549 L555 L575	S539-A551 WeakPolarHBondContact O-CB 3.28Å; L542-A551 HydrophobicContact CB-CB 3.76Å; A543-A551 HydrophobicContact CB-CB 4.28Å; Q547-A551 WeakPolarHBondContact O-CB 3.28Å; Q547-A551 PolarHBondContact O-N 3.46Å; S549-A551 VanDerWaalsContact C-N 3.32Å; S549-A551 PolarHBondContact O-N 3.23Å; A551-L555 VanDerWaalsContact O-CB 3.27Å; A551-L555 WeakPolarHBondContact O-CB 3.43Å; A551-L555 PolarHBondContact O-N 3.38Å; A551-L575 HydrophobicContact CB-CD1 4.14Å; A551-L575 HydrophobicContact CB-CD2 3.93Å
552	M	94.4	Very high	90.8	Very high	18 Å²	18	50.7 Å²	50.7	9%	0.089	26%	0.262	C	S	.	.	H	α-helix	trans	-69.2	-41.2	-179.6	-176.8	170.1	-80	0	0	112.4	I548 S549 S550 L555 Q556 L572 L575 F576 Q579	I548-M552 WeakPolarHBondContact O-CB 3.35Å; I548-M552 PolarHBondContact O-N 3.34Å; I548-M552 VanDerWaalsContact O-N 3.08Å; S549-M552 PolarHBondContact O-N 3.33Å; S549-M552 VanDerWaalsContact O-N 3.16Å; S550-M552 VanDerWaalsContact C-N 3.31Å; S550-M552 PolarHBondContact O-N 2.92Å; M552-L555 PolarHBondContact O-N 3.3Å; M552-Q556 WeakPolarHBondContact O-CB 3.31Å; M552-Q556 VanDerWaalsContact O-CG 3.26Å; M552-Q556 WeakPolarHBondContact O-CG 3.17Å; M552-Q556 PolarHBondContact O-N 2.86Å; M552-L572 HydrophobicContact CE-CD1 4.49Å; M552-L575 HydrophobicContact CB-CD1 4.42Å; M552-L575 HydrophobicContact CE-CB 3.93Å; M552-F576 HydrophobicContact CE-CD1 3.57Å; M552-F576 HydrophobicContact CE-CE1 3.64Å; M552-F576 HydrophobicContact CE-CG 4.18Å; M552-F576 HydrophobicContact CE-CZ 4.31Å; M552-F576 HydrophobicContact SD-CE1 4.16Å; M552-Q579 PolarHBondContact SD-NE2 3.17Å; M552-Q579 VanDerWaalsContact SD-NE2 3.37Å
553	E	92.1	Very high	90.1	Very high	125 Å²	125	59.4 Å²	59.4	58%	0.584	30%	0.295	S	S	*	.	H	α-helix	trans	-60.2	-48.8	176.9	-71.4	173.6	-172.4	0	0	111.3	S549 S550 Q556 E557	S549-E553 PolarHBondContact O-N 2.95Å; S549-E553 VanDerWaalsContact O-N 3.09Å; S550-E553 PolarHBondContact O-N 2.91Å; E553-Q556 PolarHBondContact O-N 2.99Å; E553-E557 PolarHBondContact O-N 3.11Å
554	Q	91.1	Very high	89.5	Confident	49 Å²	49	64.4 Å²	64.4	23%	0.229	32%	0.321	C	S	.	.	H	α-helix	trans	-62.7	-44.9	178.4	-67.5	-64.7	-29.5	0	0	111.9	I535 S539 L542 S550 Q556 E557 A558	I535-Q554 HydrophobicContact CG2-CB 4.36Å; I535-Q554 WeakPolarHBondContact CG2-O 3.47Å; S539-Q554 WeakPolarHBondContact OG-CB 3.42Å; L542-Q554 HydrophobicContact CD1-CG 4.2Å; S550-Q554 WeakPolarHBondContact O-CG 3.24Å; S550-Q554 PolarHBondContact O-N 3.26Å; Q554-Q556 VanDerWaalsContact C-N 3.33Å; Q554-Q556 PolarHBondContact O-N 3.11Å; Q554-E557 WeakPolarHBondContact O-CB 3.41Å; Q554-E557 PolarHBondContact O-N 2.88Å; Q554-E557 VanDerWaalsContact O-N 3.09Å; Q554-A558 PolarHBondContact O-N 3.33Å; Q554-A558 VanDerWaalsContact O-N 3.13Å
555	L	92.7	Very high	89.3	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-65.9	-36	-179.5	-173.8	63.8	0	0	0	112.7	L536 S539 A551 M552 E557 A558 L559 A568 L571 L572 L575	L536-L555 HydrophobicContact CD1-CD1 4.1Å; S539-L555 PolarHBondContact OG-N 3Å; A551-L555 VanDerWaalsContact O-CB 3.27Å; A551-L555 WeakPolarHBondContact O-CB 3.43Å; A551-L555 PolarHBondContact O-N 3.38Å; M552-L555 PolarHBondContact O-N 3.3Å; L555-E557 PolarHBondContact O-N 3.06Å; L555-A558 HydrophobicContact CD1-CB 4.47Å; L555-A558 WeakPolarHBondContact O-CB 3.28Å; L555-A558 PolarHBondContact O-N 3.18Å; L555-A558 VanDerWaalsContact O-N 3.17Å; L555-L559 HydrophobicContact CG-CD1 4.27Å; L555-L559 WeakPolarHBondContact O-CG 3.46Å; L555-L559 PolarHBondContact O-N 3.35Å; L555-A568 HydrophobicContact CD1-CB 3.99Å; L555-L571 HydrophobicContact CD1-CD2 4.19Å; L555-L571 HydrophobicContact CD2-CB 3.92Å; L555-L571 HydrophobicContact CD2-CD2 4.07Å; L555-L571 HydrophobicContact CD2-CG 3.82Å; L555-L572 HydrophobicContact CD2-CB 3.75Å; L555-L572 HydrophobicContact CD2-CD1 4.35Å; L555-L575 HydrophobicContact CD2-CD1 3.74Å
556	Q	90.2	Very high	89.2	Confident	90 Å²	90	63.4 Å²	63.4	42%	0.421	32%	0.315	S	S	.	.	H	α-helix	trans	-64.3	-29.8	174.5	-76	177.2	3.4	0	0	112	M552 E553 Q554 K560	M552-Q556 WeakPolarHBondContact O-CB 3.31Å; M552-Q556 VanDerWaalsContact O-CG 3.26Å; M552-Q556 WeakPolarHBondContact O-CG 3.17Å; M552-Q556 PolarHBondContact O-N 2.86Å; E553-Q556 PolarHBondContact O-N 2.99Å; Q554-Q556 VanDerWaalsContact C-N 3.33Å; Q554-Q556 PolarHBondContact O-N 3.11Å; Q556-K560 WeakPolarHBondContact O-CG 3.29Å; Q556-K560 PolarHBondContact O-N 3.41Å
557	E	83.9	Confident	89.3	Confident	98 Å²	98	63.7 Å²	63.7	46%	0.458	32%	0.319	S	S	.	.	H	α-helix	trans	-69.4	-42.3	170.8	-66.7	-175.6	163.5	0	0	111.8	E553 Q554 L555 L559 K560	E553-E557 PolarHBondContact O-N 3.11Å; Q554-E557 WeakPolarHBondContact O-CB 3.41Å; Q554-E557 PolarHBondContact O-N 2.88Å; Q554-E557 VanDerWaalsContact O-N 3.09Å; L555-E557 PolarHBondContact O-N 3.06Å; E557-L559 VanDerWaalsContact C-N 3.35Å; E557-L559 PolarHBondContact O-N 3.4Å; E557-K560 WeakPolarHBondContact O-CB 3.49Å; E557-K560 PolarHBondContact O-N 3.42Å
558	A	84.9	Confident	89.2	Confident	3 Å²	3	59.7 Å²	59.7	3%	0.025	30%	0.301	C	S	.	.	H	α-helix	trans	-58.4	-45.5	174.4	0	0	0	0	0	112.1	I535 Q554 L555 K560 V561 C562	I535-A558 HydrophobicContact CB-CB 3.92Å; I535-A558 HydrophobicContact CD1-CB 4.42Å; I535-A558 HydrophobicContact CG2-CB 3.68Å; Q554-A558 PolarHBondContact O-N 3.33Å; Q554-A558 VanDerWaalsContact O-N 3.13Å; L555-A558 HydrophobicContact CD1-CB 4.47Å; L555-A558 WeakPolarHBondContact O-CB 3.28Å; L555-A558 PolarHBondContact O-N 3.18Å; L555-A558 VanDerWaalsContact O-N 3.17Å; A558-K560 PolarHBondContact O-N 3.1Å; A558-V561 WeakPolarHBondContact O-CB 3.47Å; A558-V561 PolarHBondContact O-N 3.17Å; A558-C562 PolarHBondContact O-N 3.01Å
559	L	87.7	Confident	89.2	Confident	24 Å²	24	59.3 Å²	59.3	13%	0.126	30%	0.299	C	S	.	.	H	α-helix	trans	-68.6	-20.5	-178.8	-72.4	169.3	0	0	0	113.6	L555 E557 V561 C562 R563 A568 L569 L572	L555-L559 HydrophobicContact CG-CD1 4.27Å; L555-L559 WeakPolarHBondContact O-CG 3.46Å; L555-L559 PolarHBondContact O-N 3.35Å; E557-L559 VanDerWaalsContact C-N 3.35Å; E557-L559 PolarHBondContact O-N 3.4Å; L559-V561 VanDerWaalsContact C-N 3.26Å; L559-C562 WeakPolarHBondContact CA-O 3.25Å; L559-R563 WeakPolarHBondContact O-CG 3.14Å; L559-A568 HydrophobicContact CD2-CB 3.69Å; L559-A568 HydrophobicContact CG-CB 4.3Å; L559-L569 HydrophobicContact CD2-CD2 3.92Å; L559-L569 HydrophobicContact CD2-CG 4.3Å; L559-L572 HydrophobicContact CD1-CB 4.26Å; L559-L572 HydrophobicContact CD1-CD2 3.61Å; L559-L572 HydrophobicContact CD1-CG 4.39Å
560	K	86.6	Confident	89.3	Confident	151 Å²	151	55.9 Å²	55.9	66%	0.657	28%	0.275	S	S	*	.	H	α-helix	trans	-66.6	-33.1	169.8	-71.9	166.6	-166.2	165.9	0	111.4	Q556 E557 A558	Q556-K560 WeakPolarHBondContact O-CG 3.29Å; Q556-K560 PolarHBondContact O-N 3.41Å; E557-K560 WeakPolarHBondContact O-CB 3.49Å; E557-K560 PolarHBondContact O-N 3.42Å; A558-K560 PolarHBondContact O-N 3.1Å
561	V	82.3	Confident	89.4	Confident	91 Å²	91	53.8 Å²	53.8	55%	0.552	26%	0.26	S	S	*	.	H	α-helix	trans	-85.2	-48.1	180	-175.5	0	0	0	0	110.6	A558 L559	A558-V561 WeakPolarHBondContact O-CB 3.47Å; A558-V561 PolarHBondContact O-N 3.17Å; L559-V561 VanDerWaalsContact C-N 3.26Å
562	C	78.6	Confident	89.4	Confident	44 Å²	44	54.6 Å²	54.6	30%	0.297	26%	0.264	S	S	.	.			trans	-123.1	100.3	-179.1	-70.1	0	0	0	0	111.1	P532 A558 L559	P532-C562 HydrophobicContact CB-CB 4.1Å; P532-C562 VanDerWaalsContact CG-SG 3.55Å; A558-C562 PolarHBondContact O-N 3.01Å; L559-C562 WeakPolarHBondContact CA-O 3.25Å
563	R	81.4	Confident	89.4	Confident	193 Å²	193	53.7 Å²	53.7	73%	0.728	26%	0.26	S	S	*	.	S	Bend	trans	-75.3	-28	-175.2	-67	-176	179.6	-173.1	-0.4	114.1	L559	L559-R563 WeakPolarHBondContact O-CG 3.14Å
564	D	83.1	Confident	89.7	Confident	105 Å²	105	47.8 Å²	47.8	56%	0.561	23%	0.232	S	C	*	.	S	Bend	trans	-110.5	10.2	-163.9	-48.4	-28.9	0	0	0	113	A566 H596	D564-A566 PolarHBondContact O-N 3.26Å; D564-H596 PolarHBondContact O-NE2 3.03Å
565	D	89.2	Confident	89.9	Confident	54 Å²	54	45.4 Å²	45.4	29%	0.289	22%	0.221	S	C	.	.			trans	-70.5	121.8	178.9	176.5	41.1	0	0	0	111.5	H567 A568 L569	D565-H567 VanDerWaalsContact C-N 3.34Å; D565-H567 PolarHBondContact O-N 2.98Å; D565-A568 HydrophobicContact CB-CB 4.01Å; D565-A568 PolarHBondContact O-N 3.45Å; D565-A568 VanDerWaalsContact OD2-CB 3.29Å; D565-A568 WeakPolarHBondContact OD2-CB 3.46Å; D565-A568 PolarHBondContact OD2-N 3.37Å; D565-L569 WeakPolarHBondContact O-CG 3.42Å; D565-L569 PolarHBondContact O-N 2.89Å
566	A	91.2	Very high	90.1	Very high	10 Å²	10	47.1 Å²	47.1	8%	0.083	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-41.1	-176.7	0	0	0	0	0	112	D564 H570	D564-A566 PolarHBondContact O-N 3.26Å; A566-H570 VanDerWaalsContact O-CB 3.23Å; A566-H570 WeakPolarHBondContact O-CB 3.31Å; A566-H570 PolarHBondContact O-N 2.94Å
567	H	92.6	Very high	90.4	Very high	59 Å²	59	42.9 Å²	42.9	27%	0.273	21%	0.209	S	C	.	.	H	α-helix	trans	-72	-40.1	-178.2	-62.5	129.3	0	0	0	112	L536 D565 H570 L571 I878	L536-H567 HydrophobicContact CD2-CB 3.71Å; D565-H567 VanDerWaalsContact C-N 3.34Å; D565-H567 PolarHBondContact O-N 2.98Å; H567-H570 PolarHBondContact O-N 3.05Å; H567-L571 WeakPolarHBondContact O-CB 3.3Å; H567-L571 PolarHBondContact O-N 3.34Å; H567-I878 HydrophobicContact CB-CG2 4.16Å
568	A	93.3	Very high	90.9	Very high	3 Å²	3	38.2 Å²	38.2	3%	0.025	19%	0.187	C	C	.	.	H	α-helix	trans	-63	-45.3	174.1	0	0	0	0	0	112.5	L536 L555 L559 D565 H570 L571 L572	L536-A568 HydrophobicContact CD1-CB 4.08Å; L555-A568 HydrophobicContact CD1-CB 3.99Å; L559-A568 HydrophobicContact CD2-CB 3.69Å; L559-A568 HydrophobicContact CG-CB 4.3Å; D565-A568 HydrophobicContact CB-CB 4.01Å; D565-A568 PolarHBondContact O-N 3.45Å; D565-A568 VanDerWaalsContact OD2-CB 3.29Å; D565-A568 WeakPolarHBondContact OD2-CB 3.46Å; D565-A568 PolarHBondContact OD2-N 3.37Å; A568-H570 VanDerWaalsContact C-N 3.33Å; A568-H570 PolarHBondContact O-N 3.47Å; A568-L571 PolarHBondContact O-N 3.33Å; A568-L572 WeakPolarHBondContact O-CB 3.41Å; A568-L572 PolarHBondContact O-N 3.49Å
569	L	94.3	Very high	91.4	Very high	10 Å²	10	41.1 Å²	41.1	5%	0.052	20%	0.2	C	C	.	.	H	α-helix	trans	-64.5	-38.8	175.6	-67.9	174.3	0	0	0	111.7	L559 D565 L572 A573 V588 A592	L559-L569 HydrophobicContact CD2-CD2 3.92Å; L559-L569 HydrophobicContact CD2-CG 4.3Å; D565-L569 WeakPolarHBondContact O-CG 3.42Å; D565-L569 PolarHBondContact O-N 2.89Å; L569-L572 PolarHBondContact O-N 3.22Å; L569-A573 PolarHBondContact O-N 3.04Å; L569-V588 HydrophobicContact CB-CG1 4.4Å; L569-V588 HydrophobicContact CD2-CG1 4.33Å; L569-V588 WeakPolarHBondContact O-CG1 3.44Å; L569-A592 HydrophobicContact CB-CB 3.87Å; L569-A592 HydrophobicContact CD1-CB 3.92Å
570	H	95.6	Very high	91.8	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.009	21%	0.213	C	C	.	.	H	α-helix	trans	-62	-48.2	174.7	-166.9	-179	0	0	0	111.3	A566 H567 A568 L572 A573 L574 L602 T605 I878	A566-H570 VanDerWaalsContact O-CB 3.23Å; A566-H570 WeakPolarHBondContact O-CB 3.31Å; A566-H570 PolarHBondContact O-N 2.94Å; H567-H570 PolarHBondContact O-N 3.05Å; A568-H570 VanDerWaalsContact C-N 3.33Å; A568-H570 PolarHBondContact O-N 3.47Å; H570-L572 VanDerWaalsContact C-N 3.29Å; H570-L572 PolarHBondContact O-N 3.48Å; H570-A573 WeakPolarHBondContact O-CB 3.33Å; H570-A573 PolarHBondContact O-N 2.92Å; H570-L574 WeakPolarHBondContact O-CG 3.43Å; H570-L574 PolarHBondContact O-N 3.46Å; H570-L602 HydrophobicContact CB-CD2 3.59Å; H570-T605 PolarHBondContact NE2-OG1 3.45Å; H570-I878 HydrophobicContact CB-CD1 4.33Å
571	L	96.1	Very high	92.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.9	-40.2	177.4	-176	56.6	0	0	0	111.4	L536 L540 A543 L555 H567 A568 A573 L574 L575 F875 I878	L536-L571 HydrophobicContact CD1-CB 4.41Å; L536-L571 HydrophobicContact CD1-CD2 3.99Å; L540-L571 HydrophobicContact CB-CD2 4.07Å; L540-L571 HydrophobicContact CD1-CD1 3.84Å; L540-L571 HydrophobicContact CD1-CD2 4.45Å; A543-L571 HydrophobicContact CB-CD1 4.2Å; L555-L571 HydrophobicContact CD1-CD2 4.19Å; L555-L571 HydrophobicContact CD2-CB 3.92Å; L555-L571 HydrophobicContact CD2-CD2 4.07Å; L555-L571 HydrophobicContact CD2-CG 3.82Å; H567-L571 WeakPolarHBondContact O-CB 3.3Å; H567-L571 PolarHBondContact O-N 3.34Å; A568-L571 PolarHBondContact O-N 3.33Å; L571-A573 VanDerWaalsContact C-N 3.35Å; L571-A573 PolarHBondContact O-N 3.3Å; L571-L574 PolarHBondContact O-N 2.89Å; L571-L575 HydrophobicContact CD1-CG 4.3Å; L571-L575 HydrophobicContact CG-CD1 4.11Å; L571-L575 HydrophobicContact CG-CG 4.38Å; L571-L575 VanDerWaalsContact O-CG 3.31Å; L571-L575 WeakPolarHBondContact O-CG 3.49Å; L571-L575 PolarHBondContact O-N 2.9Å; L571-F875 HydrophobicContact CD1-CD1 3.8Å; L571-F875 HydrophobicContact CD1-CE1 4.28Å; L571-I878 HydrophobicContact CB-CD1 3.55Å; L571-I878 HydrophobicContact CD1-CD1 4.03Å; L571-I878 HydrophobicContact CG-CD1 4.31Å
572	L	95.4	Very high	92.8	Very high	17 Å²	17	38.9 Å²	38.9	9%	0.089	18%	0.184	C	C	.	.	H	α-helix	trans	-61.1	-44.9	177.4	179.6	63.5	0	0	0	111.2	M552 L555 L559 A568 L569 H570 L574 L575 F576 V588	M552-L572 HydrophobicContact CE-CD1 4.49Å; L555-L572 HydrophobicContact CD2-CB 3.75Å; L555-L572 HydrophobicContact CD2-CD1 4.35Å; L559-L572 HydrophobicContact CD1-CB 4.26Å; L559-L572 HydrophobicContact CD1-CD2 3.61Å; L559-L572 HydrophobicContact CD1-CG 4.39Å; A568-L572 WeakPolarHBondContact O-CB 3.41Å; A568-L572 PolarHBondContact O-N 3.49Å; L569-L572 PolarHBondContact O-N 3.22Å; H570-L572 VanDerWaalsContact C-N 3.29Å; H570-L572 PolarHBondContact O-N 3.48Å; L572-L574 VanDerWaalsContact C-N 3.34Å; L572-L574 PolarHBondContact O-N 3.49Å; L572-L575 PolarHBondContact O-N 2.99Å; L572-F576 HydrophobicContact CD1-CD2 4.02Å; L572-F576 HydrophobicContact CD1-CE2 3.57Å; L572-F576 HydrophobicContact CD1-CZ 4.02Å; L572-F576 HydrophobicContact CD2-CE2 3.95Å; L572-F576 HydrophobicContact CG-CD2 3.87Å; L572-F576 HydrophobicContact CG-CE2 3.59Å; L572-F576 HydrophobicContact CG-CZ 4.49Å; L572-F576 WeakPolarHBondContact O-CD2 3.27Å; L572-F576 PolarHBondContact O-N 3.43Å; L572-V588 HydrophobicContact CB-CG1 4.43Å; L572-V588 HydrophobicContact CD2-CG1 4.14Å; L572-V588 HydrophobicContact CD2-CG2 4.11Å; L572-V588 HydrophobicContact CG-CG1 4.39Å
573	A	96	Very high	93.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.2	-42.1	175.1	0	0	0	0	0	112.3	L569 H570 L571 F576 S577 A585 V588 V589	L569-A573 PolarHBondContact O-N 3.04Å; H570-A573 WeakPolarHBondContact O-CB 3.33Å; H570-A573 PolarHBondContact O-N 2.92Å; L571-A573 VanDerWaalsContact C-N 3.35Å; L571-A573 PolarHBondContact O-N 3.3Å; A573-F576 PolarHBondContact O-N 2.9Å; A573-S577 WeakPolarHBondContact O-CB 3.26Å; A573-S577 PolarHBondContact O-N 3.33Å; A573-A585 HydrophobicContact CB-CB 4.5Å; A573-A585 VanDerWaalsContact O-CB 3.3Å; A573-A585 WeakPolarHBondContact O-CB 3.46Å; A573-V588 HydrophobicContact CB-CB 4.43Å; A573-V588 HydrophobicContact CB-CG1 4.21Å; A573-V589 HydrophobicContact CB-CG2 3.35Å
574	L	97.1	Very high	94.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.3	-40.9	176.3	-65	177.4	0	0	0	111.7	H570 L571 L572 S577 A578 T605 P871 V872 L873 F875 I877 I878	H570-L574 WeakPolarHBondContact O-CG 3.43Å; H570-L574 PolarHBondContact O-N 3.46Å; L571-L574 PolarHBondContact O-N 2.89Å; L572-L574 VanDerWaalsContact C-N 3.34Å; L572-L574 PolarHBondContact O-N 3.49Å; L574-S577 PolarHBondContact O-N 2.88Å; L574-S577 PolarHBondContact O-OG 2.83Å; L574-A578 PolarHBondContact O-N 3.44Å; L574-T605 HydrophobicContact CD2-CG2 3.86Å; L574-P871 HydrophobicContact CB-CB 4.42Å; L574-V872 HydrophobicContact CD2-CG1 4.37Å; L574-L873 HydrophobicContact CD2-CB 4.06Å; L574-F875 HydrophobicContact CB-CD1 3.78Å; L574-F875 HydrophobicContact CB-CE1 3.63Å; L574-F875 HydrophobicContact CD1-CD1 4.12Å; L574-I877 HydrophobicContact CD1-CG2 3.69Å; L574-I878 HydrophobicContact CD1-CD1 4.19Å; L574-I878 HydrophobicContact CD1-CG1 4.47Å
575	L	96.7	Very high	95	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65.1	-42.5	176.2	-70.8	171.2	0	0	0	112.2	A543 I548 A551 M552 L555 L571 L572 S577 A578 Q579 F875	A543-L575 HydrophobicContact CB-CD2 3.89Å; I548-L575 HydrophobicContact CD1-CD2 4.29Å; I548-L575 HydrophobicContact CG2-CD2 3.94Å; A551-L575 HydrophobicContact CB-CD1 4.14Å; A551-L575 HydrophobicContact CB-CD2 3.93Å; M552-L575 HydrophobicContact CB-CD1 4.42Å; M552-L575 HydrophobicContact CE-CB 3.93Å; L555-L575 HydrophobicContact CD2-CD1 3.74Å; L571-L575 HydrophobicContact CD1-CG 4.3Å; L571-L575 HydrophobicContact CG-CD1 4.11Å; L571-L575 HydrophobicContact CG-CG 4.38Å; L571-L575 VanDerWaalsContact O-CG 3.31Å; L571-L575 WeakPolarHBondContact O-CG 3.49Å; L571-L575 PolarHBondContact O-N 2.9Å; L572-L575 PolarHBondContact O-N 2.99Å; L575-S577 VanDerWaalsContact C-N 3.31Å; L575-S577 PolarHBondContact O-N 3.01Å; L575-A578 WeakPolarHBondContact O-CB 3.46Å; L575-A578 PolarHBondContact O-N 2.67Å; L575-Q579 PolarHBondContact O-N 3.35Å; L575-Q579 VanDerWaalsContact O-N 3.1Å; L575-F875 HydrophobicContact CD2-CE1 3.95Å; L575-F875 HydrophobicContact CD2-CZ 4.03Å; L575-F875 HydrophobicContact CG-CE1 4.27Å
576	F	96.6	Very high	95.4	Very high	35 Å²	35	30 Å²	30	15%	0.154	14%	0.141	C	C	.	.	H	α-helix	trans	-61.9	-40.6	172	-79.7	-48.7	0	0	0	111.9	M552 L572 A573 A578 Q579 K580 H581 H584 A585 V588	M552-F576 HydrophobicContact CE-CD1 3.57Å; M552-F576 HydrophobicContact CE-CE1 3.64Å; M552-F576 HydrophobicContact CE-CG 4.18Å; M552-F576 HydrophobicContact CE-CZ 4.31Å; M552-F576 HydrophobicContact SD-CE1 4.16Å; L572-F576 HydrophobicContact CD1-CD2 4.02Å; L572-F576 HydrophobicContact CD1-CE2 3.57Å; L572-F576 HydrophobicContact CD1-CZ 4.02Å; L572-F576 HydrophobicContact CD2-CE2 3.95Å; L572-F576 HydrophobicContact CG-CD2 3.87Å; L572-F576 HydrophobicContact CG-CE2 3.59Å; L572-F576 HydrophobicContact CG-CZ 4.49Å; L572-F576 WeakPolarHBondContact O-CD2 3.27Å; L572-F576 PolarHBondContact O-N 3.43Å; A573-F576 PolarHBondContact O-N 2.9Å; F576-A578 VanDerWaalsContact C-N 3.29Å; F576-A578 PolarHBondContact O-N 3.41Å; F576-Q579 CarbonylContact O-C 3.16Å; F576-Q579 PolarHBondContact O-N 2.99Å; F576-K580 PolarHBondContact O-N 3.12Å; F576-H581 HydrophobicContact CB-CB 4.28Å; F576-H581 HydrophobicContact CD1-CB 4.21Å; F576-H581 PolarHBondContact O-N 2.69Å; F576-H584 HydrophobicContact CD1-CB 4.42Å; F576-H584 HydrophobicContact CD2-CB 4.32Å; F576-H584 HydrophobicContact CG-CB 4.25Å; F576-A585 HydrophobicContact CB-CB 3.82Å; F576-V588 HydrophobicContact CD2-CG2 4.2Å; F576-V588 HydrophobicContact CE2-CG2 4.05Å
577	S	96.3	Very high	95.6	Very high	1 Å²	1	33 Å²	33	1%	0.007	16%	0.156	C	C	.	.	H	α-helix	trans	-64.1	-35.3	175.7	83.7	0	0	0	0	112.3	A573 L574 L575 Q579 K580 P871 V872	A573-S577 WeakPolarHBondContact O-CB 3.26Å; A573-S577 PolarHBondContact O-N 3.33Å; L574-S577 PolarHBondContact O-N 2.88Å; L574-S577 PolarHBondContact O-OG 2.83Å; L575-S577 VanDerWaalsContact C-N 3.31Å; L575-S577 PolarHBondContact O-N 3.01Å; S577-Q579 VanDerWaalsContact C-N 3.32Å; S577-Q579 PolarHBondContact O-N 3.12Å; S577-K580 PolarHBondContact O-N 3.47Å; S577-P871 WeakPolarHBondContact OG-CA 3.4Å; S577-V872 PolarHBondContact OG-N 3.14Å
578	A	95.3	Very high	95.7	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.008	15%	0.147	C	C	.	.	H	α-helix	trans	-65.5	-35.7	175.5	0	0	0	0	0	112	I548 L574 L575 F576 K580 A868 S870 P871 F875	I548-A578 HydrophobicContact CD1-CB 4.23Å; I548-A578 HydrophobicContact CG2-CB 4.34Å; L574-A578 PolarHBondContact O-N 3.44Å; L575-A578 WeakPolarHBondContact O-CB 3.46Å; L575-A578 PolarHBondContact O-N 2.67Å; F576-A578 VanDerWaalsContact C-N 3.29Å; F576-A578 PolarHBondContact O-N 3.41Å; A578-K580 PolarHBondContact O-N 3.27Å; A578-A868 VanDerWaalsContact O-O 3.08Å; A578-S870 WeakPolarHBondContact CA-O 3.36Å; A578-P871 HydrophobicContact CB-CB 4.16Å; A578-F875 HydrophobicContact CB-CZ 4.05Å
579	Q	95.3	Very high	95.8	Very high	64 Å²	64	30.7 Å²	30.7	30%	0.299	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	4.6	172.3	-64	177.1	-6.7	0	0	113.8	I548 M552 L575 F576 S577 H581	I548-Q579 HydrophobicContact CG2-CG 3.83Å; M552-Q579 PolarHBondContact SD-NE2 3.17Å; M552-Q579 VanDerWaalsContact SD-NE2 3.37Å; L575-Q579 PolarHBondContact O-N 3.35Å; L575-Q579 VanDerWaalsContact O-N 3.1Å; F576-Q579 CarbonylContact O-C 3.16Å; F576-Q579 PolarHBondContact O-N 2.99Å; S577-Q579 VanDerWaalsContact C-N 3.32Å; S577-Q579 PolarHBondContact O-N 3.12Å; Q579-H581 WeakPolarHBondContact CB-ND1 3.3Å; Q579-H581 PolarHBondContact O-N 3.38Å; Q579-H581 PolarHBondContact OE1-ND1 3.46Å; Q579-H581 VanDerWaalsContact OE1-ND1 3.13Å
580	K	94.5	Very high	95.8	Very high	89 Å²	89	32.7 Å²	32.7	39%	0.387	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	16.3	-175.2	-44.7	-55.8	176.2	-170.3	0	114.7	F576 S577 A578 H582 E867 S870	F576-K580 PolarHBondContact O-N 3.12Å; S577-K580 PolarHBondContact O-N 3.47Å; A578-K580 PolarHBondContact O-N 3.27Å; K580-H582 PolarHBondContact O-CD2 2.88Å; K580-H582 PolarHBondContact O-N 2.91Å; K580-E867 VanDerWaalsContact CE-O 3.26Å; K580-E867 WeakPolarHBondContact CE-O 3.46Å; K580-E867 PolarHBondContact NZ-O 3.34Å; K580-S870 PolarHBondContact NZ-O 3.09Å
581	H	95.9	Very high	95.7	Very high	91 Å²	91	37.3 Å²	37.3	42%	0.421	18%	0.179	S	C	.	.			trans	-81.6	59	170.5	-63.6	128.3	0	0	0	110.9	F576 Q579 Q583 H584 A585	F576-H581 HydrophobicContact CB-CB 4.28Å; F576-H581 HydrophobicContact CD1-CB 4.21Å; F576-H581 PolarHBondContact O-N 2.69Å; Q579-H581 WeakPolarHBondContact CB-ND1 3.3Å; Q579-H581 PolarHBondContact O-N 3.38Å; Q579-H581 PolarHBondContact OE1-ND1 3.46Å; Q579-H581 VanDerWaalsContact OE1-ND1 3.13Å; H581-Q583 VanDerWaalsContact C-N 3.29Å; H581-Q583 PolarHBondContact O-N 2.91Å; H581-H584 HydrophobicContact CB-CB 4.39Å; H581-H584 PolarHBondContact O-N 3.2Å; H581-A585 PolarHBondContact O-N 2.88Å
582	H	95.5	Very high	95.6	Very high	39 Å²	39	37.3 Å²	37.3	18%	0.181	18%	0.179	C	C	.	.	H	α-helix	trans	-60	-35.6	-172	-61.1	-57	0	0	0	113.4	K580 A585 L586 L613	K580-H582 PolarHBondContact O-CD2 2.88Å; K580-H582 PolarHBondContact O-N 2.91Å; H582-A585 WeakPolarHBondContact O-CB 3.38Å; H582-A585 PolarHBondContact O-N 3.02Å; H582-L586 WeakPolarHBondContact O-CB 3.35Å; H582-L586 PolarHBondContact O-N 2.81Å; H582-L613 HydrophobicContact CB-CD1 3.91Å; H582-L613 HydrophobicContact CB-CD2 3.71Å; H582-L613 HydrophobicContact CB-CG 3.78Å
583	Q	96.4	Very high	95.6	Very high	101 Å²	101	37.6 Å²	37.6	47%	0.472	18%	0.18	S	C	.	.	H	α-helix	trans	-64.1	-49	179	-173	60.7	44.3	0	0	111.5	H581 A585 L586 D587	H581-Q583 VanDerWaalsContact C-N 3.29Å; H581-Q583 PolarHBondContact O-N 2.91Å; Q583-A585 VanDerWaalsContact C-N 3.3Å; Q583-A585 PolarHBondContact O-N 3.14Å; Q583-L586 PolarHBondContact O-N 3.36Å; Q583-L586 VanDerWaalsContact O-N 3.14Å; Q583-D587 PolarHBondContact NE2-OD1 3.02Å; Q583-D587 VanDerWaalsContact NE2-OD1 3.15Å; Q583-D587 PolarHBondContact O-N 3.3Å
584	H	95.4	Very high	95.4	Very high	104 Å²	104	42.4 Å²	42.4	48%	0.481	21%	0.21	S	C	.	.	H	α-helix	trans	-62.3	-38.5	176.1	-65.3	-45.6	0	0	0	112	F576 H581 L586 D587 V588	F576-H584 HydrophobicContact CD1-CB 4.42Å; F576-H584 HydrophobicContact CD2-CB 4.32Å; F576-H584 HydrophobicContact CG-CB 4.25Å; H581-H584 HydrophobicContact CB-CB 4.39Å; H581-H584 PolarHBondContact O-N 3.2Å; H584-L586 VanDerWaalsContact C-N 3.34Å; H584-L586 PolarHBondContact O-N 3.34Å; H584-D587 PolarHBondContact O-N 3.13Å; H584-V588 WeakPolarHBondContact O-CG2 3.33Å; H584-V588 PolarHBondContact O-N 3.32Å
585	A	96.9	Very high	95.1	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.5	-45	173.6	0	0	0	0	0	111.7	A573 F576 H581 H582 Q583 V588 V589 L609	A573-A585 HydrophobicContact CB-CB 4.5Å; A573-A585 VanDerWaalsContact O-CB 3.3Å; A573-A585 WeakPolarHBondContact O-CB 3.46Å; F576-A585 HydrophobicContact CB-CB 3.82Å; H581-A585 PolarHBondContact O-N 2.88Å; H582-A585 WeakPolarHBondContact O-CB 3.38Å; H582-A585 PolarHBondContact O-N 3.02Å; Q583-A585 VanDerWaalsContact C-N 3.3Å; Q583-A585 PolarHBondContact O-N 3.14Å; A585-V588 PolarHBondContact O-N 2.77Å; A585-V589 WeakPolarHBondContact O-CG2 3.48Å; A585-V589 PolarHBondContact O-N 2.76Å; A585-L609 HydrophobicContact CB-CD1 3.88Å; A585-L609 HydrophobicContact CB-CD2 3.9Å
586	L	96.5	Very high	94.9	Very high	3 Å²	3	51 Å²	51	2%	0.016	25%	0.25	C	C	.	.	H	α-helix	trans	-66	-39.4	179.4	-177.6	61	0	0	0	111.8	H582 Q583 H584 V589 N590 K606 L609 E610 L613	H582-L586 WeakPolarHBondContact O-CB 3.35Å; H582-L586 PolarHBondContact O-N 2.81Å; Q583-L586 PolarHBondContact O-N 3.36Å; Q583-L586 VanDerWaalsContact O-N 3.14Å; H584-L586 VanDerWaalsContact C-N 3.34Å; H584-L586 PolarHBondContact O-N 3.34Å; L586-V589 PolarHBondContact O-N 3.38Å; L586-N590 WeakPolarHBondContact O-CB 3.3Å; L586-N590 VanDerWaalsContact O-CG 3.31Å; L586-N590 PolarHBondContact O-N 3.06Å; L586-N590 PolarHBondContact O-ND2 2.98Å; L586-N590 VanDerWaalsContact O-ND2 3.11Å; L586-K606 HydrophobicContact CD1-CG 4.08Å; L586-L609 HydrophobicContact CB-CB 4.47Å; L586-L609 HydrophobicContact CB-CD1 4.44Å; L586-L609 HydrophobicContact CD1-CB 4.18Å; L586-E610 HydrophobicContact CD1-CG 3.98Å; L586-E610 HydrophobicContact CD2-CG 4.4Å; L586-L613 HydrophobicContact CB-CD1 4.06Å; L586-L613 HydrophobicContact CD2-CD1 3.82Å
587	D	95.9	Very high	94.5	Very high	75 Å²	75	52.8 Å²	52.8	40%	0.401	27%	0.265	S	S	.	.	H	α-helix	trans	-62.4	-43.9	176.7	-60.7	-25.3	0	0	0	111.1	Q583 H584 N590 M591	Q583-D587 PolarHBondContact NE2-OD1 3.02Å; Q583-D587 VanDerWaalsContact NE2-OD1 3.15Å; Q583-D587 PolarHBondContact O-N 3.3Å; H584-D587 PolarHBondContact O-N 3.13Å; D587-N590 PolarHBondContact O-N 2.82Å; D587-M591 PolarHBondContact O-N 2.94Å
588	V	95.1	Very high	94.1	Very high	13 Å²	13	58.8 Å²	58.8	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-63.7	-44.2	175.6	173.2	0	0	0	0	111.5	L569 L572 A573 F576 H584 A585 N590 M591 A592	L569-V588 HydrophobicContact CB-CG1 4.4Å; L569-V588 HydrophobicContact CD2-CG1 4.33Å; L569-V588 WeakPolarHBondContact O-CG1 3.44Å; L572-V588 HydrophobicContact CB-CG1 4.43Å; L572-V588 HydrophobicContact CD2-CG1 4.14Å; L572-V588 HydrophobicContact CD2-CG2 4.11Å; L572-V588 HydrophobicContact CG-CG1 4.39Å; A573-V588 HydrophobicContact CB-CB 4.43Å; A573-V588 HydrophobicContact CB-CG1 4.21Å; F576-V588 HydrophobicContact CD2-CG2 4.2Å; F576-V588 HydrophobicContact CE2-CG2 4.05Å; H584-V588 WeakPolarHBondContact O-CG2 3.33Å; H584-V588 PolarHBondContact O-N 3.32Å; A585-V588 PolarHBondContact O-N 2.77Å; V588-N590 PolarHBondContact O-N 3.21Å; V588-M591 HydrophobicContact CG2-CE 4.37Å; V588-M591 PolarHBondContact O-N 3.38Å; V588-A592 WeakPolarHBondContact O-CB 3.48Å; V588-A592 PolarHBondContact O-N 3.35Å
589	V	95.6	Very high	93.9	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.5	-41	178.2	172.2	0	0	0	0	111.5	A573 A585 L586 M591 A592 I593 L602 T605 K606 L609	A573-V589 HydrophobicContact CB-CG2 3.35Å; A585-V589 WeakPolarHBondContact O-CG2 3.48Å; A585-V589 PolarHBondContact O-N 2.76Å; L586-V589 PolarHBondContact O-N 3.38Å; V589-M591 VanDerWaalsContact C-N 3.33Å; V589-M591 PolarHBondContact O-N 3.29Å; V589-A592 PolarHBondContact O-N 3.33Å; V589-I593 HydrophobicContact CG1-CD1 3.6Å; V589-I593 HydrophobicContact CG1-CG1 4.24Å; V589-I593 WeakPolarHBondContact O-CB 3.3Å; V589-I593 VanDerWaalsContact O-CG1 3.27Å; V589-I593 WeakPolarHBondContact O-CG1 3.44Å; V589-I593 PolarHBondContact O-N 3.05Å; V589-L602 WeakPolarHBondContact CG1-O 3.38Å; V589-T605 HydrophobicContact CG2-CG2 4.16Å; V589-K606 HydrophobicContact CG1-CB 3.72Å; V589-K606 HydrophobicContact CG1-CG 4.45Å; V589-L609 HydrophobicContact CG2-CD1 3.88Å
590	N	95	Very high	93.8	Very high	52 Å²	52	58.3 Å²	58.3	28%	0.278	29%	0.291	S	S	.	.	H	α-helix	trans	-62.6	-42.1	176.8	-75.3	-38	0	0	0	111.5	L586 D587 V588 I593 T594 K606	L586-N590 WeakPolarHBondContact O-CB 3.3Å; L586-N590 VanDerWaalsContact O-CG 3.31Å; L586-N590 PolarHBondContact O-N 3.06Å; L586-N590 PolarHBondContact O-ND2 2.98Å; L586-N590 VanDerWaalsContact O-ND2 3.11Å; D587-N590 PolarHBondContact O-N 2.82Å; V588-N590 PolarHBondContact O-N 3.21Å; N590-I593 PolarHBondContact O-N 3.42Å; N590-T594 WeakPolarHBondContact O-CG2 3.42Å; N590-T594 PolarHBondContact O-N 3.46Å; N590-K606 WeakPolarHBondContact OD1-CE 3.36Å
591	M	93	Very high	93.7	Very high	99 Å²	99	56.5 Å²	56.5	49%	0.488	29%	0.286	S	S	.	.	H	α-helix	trans	-63.1	-40.6	172.8	172.8	175.1	41.5	0	0	112.2	D587 V588 V589 I593 T594 E595	D587-M591 PolarHBondContact O-N 2.94Å; V588-M591 HydrophobicContact CG2-CE 4.37Å; V588-M591 PolarHBondContact O-N 3.38Å; V589-M591 VanDerWaalsContact C-N 3.33Å; V589-M591 PolarHBondContact O-N 3.29Å; M591-I593 VanDerWaalsContact C-N 3.34Å; M591-I593 PolarHBondContact O-N 2.99Å; M591-T594 WeakPolarHBondContact CA-OG1 3.33Å; M591-T594 PolarHBondContact O-N 3.06Å; M591-T594 PolarHBondContact O-OG1 3.36Å; M591-E595 PolarHBondContact O-N 3.34Å
592	A	93.9	Very high	93.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.9	-37.4	177.1	0	0	0	0	0	111.9	L569 V588 V589 E595 H596 L602	L569-A592 HydrophobicContact CB-CB 3.87Å; L569-A592 HydrophobicContact CD1-CB 3.92Å; V588-A592 WeakPolarHBondContact O-CB 3.48Å; V588-A592 PolarHBondContact O-N 3.35Å; V589-A592 PolarHBondContact O-N 3.33Å; A592-E595 PolarHBondContact O-N 3.25Å; A592-H596 WeakPolarHBondContact O-CB 3.37Å; A592-H596 PolarHBondContact O-N 3.48Å; A592-L602 HydrophobicContact CB-CD1 3.69Å; A592-L602 HydrophobicContact CB-CD2 3.99Å
593	I	94.3	Very high	93.6	Very high	23 Å²	23	51 Å²	51	12%	0.118	26%	0.261	C	S	.	.	H	α-helix	trans	-71.2	-30.9	177.5	-69.5	167.7	0	0	0	111.7	V589 N590 M591 E595 H596 P597 L602 M603 K606	V589-I593 HydrophobicContact CG1-CD1 3.6Å; V589-I593 HydrophobicContact CG1-CG1 4.24Å; V589-I593 WeakPolarHBondContact O-CB 3.3Å; V589-I593 VanDerWaalsContact O-CG1 3.27Å; V589-I593 WeakPolarHBondContact O-CG1 3.44Å; V589-I593 PolarHBondContact O-N 3.05Å; N590-I593 PolarHBondContact O-N 3.42Å; M591-I593 VanDerWaalsContact C-N 3.34Å; M591-I593 PolarHBondContact O-N 2.99Å; I593-E595 VanDerWaalsContact C-N 3.3Å; I593-E595 PolarHBondContact O-N 3.02Å; I593-H596 CarbonylContact O-C 3.59Å; I593-P597 VanDerWaalsContact O-CA 3.27Å; I593-P597 WeakPolarHBondContact O-CA 3.44Å; I593-L602 HydrophobicContact CD1-CB 4.41Å; I593-L602 HydrophobicContact CG1-CB 3.89Å; I593-M603 HydrophobicContact CD1-CG 4.2Å; I593-M603 HydrophobicContact CG2-CE 4.3Å; I593-K606 HydrophobicContact CD1-CB 4.03Å; I593-K606 HydrophobicContact CD1-CD 3.65Å; I593-K606 HydrophobicContact CD1-CG 4.42Å
594	T	92.3	Very high	93.6	Very high	101 Å²	101	46.9 Å²	46.9	62%	0.62	24%	0.241	S	C	*	.	H	α-helix	trans	-65.6	-35.6	175	49.7	0	0	0	0	112	N590 M591	N590-T594 WeakPolarHBondContact O-CG2 3.42Å; N590-T594 PolarHBondContact O-N 3.46Å; M591-T594 WeakPolarHBondContact CA-OG1 3.33Å; M591-T594 PolarHBondContact O-N 3.06Å; M591-T594 PolarHBondContact O-OG1 3.36Å
595	E	91.2	Very high	93.6	Very high	115 Å²	115	41.9 Å²	41.9	54%	0.537	22%	0.218	S	C	.	.	H	α-helix	trans	-80.9	-37.2	175.3	-60.9	-54.3	134	0	0	112.2	M591 A592 I593 P597	M591-E595 PolarHBondContact O-N 3.34Å; A592-E595 PolarHBondContact O-N 3.25Å; I593-E595 VanDerWaalsContact C-N 3.3Å; I593-E595 PolarHBondContact O-N 3.02Å; E595-P597 WeakPolarHBondContact O-CD 3.19Å
596	H	91.6	Very high	93.6	Very high	65 Å²	65	43.1 Å²	43.1	30%	0.301	22%	0.223	S	C	.	.			trans	-124.1	72.9	-176	-59.7	-77.9	0	0	0	111.9	D564 A592 I593 E598 N599 L602	D564-H596 PolarHBondContact O-NE2 3.03Å; A592-H596 WeakPolarHBondContact O-CB 3.37Å; A592-H596 PolarHBondContact O-N 3.48Å; I593-H596 CarbonylContact O-C 3.59Å; H596-E598 PolarHBondContact O-N 3Å; H596-N599 HydrophobicContact CB-CB 4.34Å; H596-N599 PolarHBondContact O-N 3.37Å; H596-L602 HydrophobicContact CB-CD1 4.41Å
597	P	89	Confident	93.6	Very high	73 Å²	73	43 Å²	43	47%	0.474	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-13.1	-172.4	28.4	-36.1	0	0	0	114	I593 E595 M603 L629	I593-P597 VanDerWaalsContact O-CA 3.27Å; I593-P597 WeakPolarHBondContact O-CA 3.44Å; E595-P597 WeakPolarHBondContact O-CD 3.19Å; P597-M603 WeakPolarHBondContact O-CE 3.09Å; P597-L629 WeakPolarHBondContact O-CD2 3.49Å
598	E	87.6	Confident	93.6	Very high	126 Å²	126	40.6 Å²	40.6	59%	0.589	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-5.8	-177.6	-59.6	-175.3	176.5	0	0	113.4	H596 F600 L629	H596-E598 PolarHBondContact O-N 3Å; E598-F600 PolarHBondContact O-N 3.3Å; E598-L629 HydrophobicContact CG-CD1 4.35Å
599	N	90.6	Very high	93.6	Very high	34 Å²	34	40 Å²	40	18%	0.182	21%	0.205	C	C	.	.			trans	-83.3	102.1	-173.5	-171.4	-29.2	0	0	0	112.3	H596 N601 L602 M603	H596-N599 HydrophobicContact CB-CB 4.34Å; H596-N599 PolarHBondContact O-N 3.37Å; N599-N601 VanDerWaalsContact C-N 3.33Å; N599-N601 PolarHBondContact O-N 2.71Å; N599-N601 WeakPolarHBondContact OD1-CB 3.33Å; N599-N601 PolarHBondContact OD1-N 3.02Å; N599-L602 HydrophobicContact CB-CB 4.44Å; N599-L602 HydrophobicContact CB-CD1 4.02Å; N599-L602 HydrophobicContact CB-CG 4.34Å; N599-L602 PolarHBondContact O-N 3.12Å; N599-L602 PolarHBondContact OD1-N 3.49Å; N599-M603 PolarHBondContact O-N 3Å
600	F	92.8	Very high	93.6	Very high	22 Å²	22	40.2 Å²	40.2	10%	0.096	21%	0.206	C	C	.	.	H	α-helix	trans	-63.6	-31.1	179.2	-67.8	-79.9	0	0	0	114.1	E598 L602 M603 F604 M626 L629 W630 L633 T733 I737	E598-F600 PolarHBondContact O-N 3.3Å; F600-L602 VanDerWaalsContact C-N 3.33Å; F600-L602 PolarHBondContact O-N 3.19Å; F600-M603 CarbonylContact O-C 3.54Å; F600-M603 PolarHBondContact O-N 3.39Å; F600-M603 VanDerWaalsContact O-N 3.14Å; F600-F604 HydrophobicContact CB-CD2 4.36Å; F600-F604 HydrophobicContact CB-CE2 4.08Å; F600-F604 WeakPolarHBondContact O-CD2 3.5Å; F600-F604 PolarHBondContact O-N 3.2Å; F600-M626 HydrophobicContact CD1-CB 4.42Å; F600-M626 HydrophobicContact CD1-CE 4Å; F600-M626 HydrophobicContact CE1-CB 4.36Å; F600-L629 HydrophobicContact CD1-CD2 4.37Å; F600-L629 HydrophobicContact CE1-CB 4.45Å; F600-L629 HydrophobicContact CE1-CD2 3.8Å; F600-L629 HydrophobicContact CE1-CG 4.22Å; F600-L629 HydrophobicContact CE2-CD2 4.34Å; F600-L629 HydrophobicContact CZ-CB 4.48Å; F600-L629 HydrophobicContact CZ-CD2 3.79Å; F600-L629 HydrophobicContact CZ-CG 3.93Å; F600-W630 HydrophobicContact CE1-CB 4.39Å; F600-W630 HydrophobicContact CZ-CB 4.16Å; F600-L633 HydrophobicContact CE2-CD1 3.72Å; F600-L633 HydrophobicContact CZ-CD1 3.93Å; F600-T733 HydrophobicContact CB-CG2 3.8Å; F600-T733 HydrophobicContact CD1-CG2 3.59Å; F600-T733 HydrophobicContact CD2-CG2 3.72Å; F600-T733 HydrophobicContact CE1-CG2 4.01Å; F600-T733 HydrophobicContact CE2-CG2 4.13Å; F600-T733 HydrophobicContact CG-CG2 3.42Å; F600-T733 VanDerWaalsContact CG-CG2 3.42Å; F600-T733 HydrophobicContact CZ-CG2 4.26Å; F600-I737 HydrophobicContact CD1-CD1 4.15Å; F600-I737 HydrophobicContact CE1-CD1 3.97Å
601	N	93.1	Very high	93.6	Very high	51 Å²	51	39.1 Å²	39.1	27%	0.273	20%	0.199	S	C	.	.	H	α-helix	trans	-64.8	-38.4	179.7	-71.3	-25.5	0	0	0	111.8	N599 T605	N599-N601 VanDerWaalsContact C-N 3.33Å; N599-N601 PolarHBondContact O-N 2.71Å; N599-N601 WeakPolarHBondContact OD1-CB 3.33Å; N599-N601 PolarHBondContact OD1-N 3.02Å; N601-T605 PolarHBondContact O-N 2.91Å; N601-T605 VanDerWaalsContact O-N 3.16Å; N601-T605 PolarHBondContact O-OG1 3.11Å
602	L	94.9	Very high	93.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.6	-43.1	171.6	-73.3	175	0	0	0	111.2	H570 V589 A592 I593 H596 N599 F600 T605 K606	H570-L602 HydrophobicContact CB-CD2 3.59Å; V589-L602 WeakPolarHBondContact CG1-O 3.38Å; A592-L602 HydrophobicContact CB-CD1 3.69Å; A592-L602 HydrophobicContact CB-CD2 3.99Å; I593-L602 HydrophobicContact CD1-CB 4.41Å; I593-L602 HydrophobicContact CG1-CB 3.89Å; H596-L602 HydrophobicContact CB-CD1 4.41Å; N599-L602 HydrophobicContact CB-CB 4.44Å; N599-L602 HydrophobicContact CB-CD1 4.02Å; N599-L602 HydrophobicContact CB-CG 4.34Å; N599-L602 PolarHBondContact O-N 3.12Å; N599-L602 PolarHBondContact OD1-N 3.49Å; F600-L602 VanDerWaalsContact C-N 3.33Å; F600-L602 PolarHBondContact O-N 3.19Å; L602-T605 WeakPolarHBondContact O-CB 3.28Å; L602-T605 PolarHBondContact O-N 3.36Å; L602-K606 PolarHBondContact O-N 3.22Å
603	M	94.9	Very high	93.6	Very high	15 Å²	15	41.5 Å²	41.5	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-65.2	-39.7	177.6	-65.2	-167.7	-178.2	0	0	112.9	I593 P597 N599 F600 T605 K606 V607 M626 L629	I593-M603 HydrophobicContact CD1-CG 4.2Å; I593-M603 HydrophobicContact CG2-CE 4.3Å; P597-M603 WeakPolarHBondContact O-CE 3.09Å; N599-M603 PolarHBondContact O-N 3Å; F600-M603 CarbonylContact O-C 3.54Å; F600-M603 PolarHBondContact O-N 3.39Å; F600-M603 VanDerWaalsContact O-N 3.14Å; M603-T605 VanDerWaalsContact C-N 3.26Å; M603-T605 PolarHBondContact O-N 3.24Å; M603-K606 WeakPolarHBondContact O-CB 3.3Å; M603-K606 PolarHBondContact O-N 3.31Å; M603-K606 VanDerWaalsContact O-N 3.16Å; M603-V607 WeakPolarHBondContact O-CG2 3.43Å; M603-V607 PolarHBondContact O-N 3.42Å; M603-M626 HydrophobicContact CB-CE 3.81Å; M603-M626 HydrophobicContact CB-CG 3.75Å; M603-M626 HydrophobicContact CB-SD 3.77Å; M603-M626 HydrophobicContact CG-CG 4.26Å; M603-M626 HydrophobicContact SD-CB 4.44Å; M603-M626 HydrophobicContact SD-CG 3.5Å; M603-M626 WeakPolarHBondContact SD-CG 3.31Å; M603-L629 HydrophobicContact CE-CD2 3.74Å; M603-L629 HydrophobicContact SD-CD2 4.06Å
604	F	96.1	Very high	93.5	Very high	13 Å²	13	45.7 Å²	45.7	6%	0.057	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-40.1	172.8	-76.2	-58.3	0	0	0	111.8	F600 V607 K608 M626 T733 Q736 I737 Q740 L873	F600-F604 HydrophobicContact CB-CD2 4.36Å; F600-F604 HydrophobicContact CB-CE2 4.08Å; F600-F604 WeakPolarHBondContact O-CD2 3.5Å; F600-F604 PolarHBondContact O-N 3.2Å; F604-V607 PolarHBondContact O-N 3.18Å; F604-K608 PolarHBondContact O-N 2.89Å; F604-K608 VanDerWaalsContact O-N 3.14Å; F604-M626 HydrophobicContact CD1-CE 3.6Å; F604-M626 HydrophobicContact CD2-CE 4.03Å; F604-M626 HydrophobicContact CE1-CE 3.49Å; F604-M626 VanDerWaalsContact CE1-CE 3.49Å; F604-M626 HydrophobicContact CE2-CE 3.91Å; F604-M626 HydrophobicContact CG-CE 3.87Å; F604-M626 HydrophobicContact CZ-CE 3.63Å; F604-T733 HydrophobicContact CE2-CG2 4.32Å; F604-T733 HydrophobicContact CZ-CG2 4.43Å; F604-Q736 HydrophobicContact CE1-CB 3.94Å; F604-Q736 HydrophobicContact CE2-CB 4.23Å; F604-Q736 HydrophobicContact CZ-CB 3.44Å; F604-Q736 VanDerWaalsContact CZ-CB 3.44Å; F604-I737 HydrophobicContact CE1-CG1 4.14Å; F604-I737 HydrophobicContact CZ-CG1 3.9Å; F604-Q740 HydrophobicContact CD1-CG 3.77Å; F604-Q740 HydrophobicContact CE1-CG 3.75Å; F604-L873 HydrophobicContact CB-CD1 4.35Å
605	T	96.1	Very high	93.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.7	-40.1	175.8	-52.5	0	0	0	0	111.3	H570 L574 V589 N601 L602 M603 K608 L609 V872	H570-T605 PolarHBondContact NE2-OG1 3.45Å; L574-T605 HydrophobicContact CD2-CG2 3.86Å; V589-T605 HydrophobicContact CG2-CG2 4.16Å; N601-T605 PolarHBondContact O-N 2.91Å; N601-T605 VanDerWaalsContact O-N 3.16Å; N601-T605 PolarHBondContact O-OG1 3.11Å; L602-T605 WeakPolarHBondContact O-CB 3.28Å; L602-T605 PolarHBondContact O-N 3.36Å; M603-T605 VanDerWaalsContact C-N 3.26Å; M603-T605 PolarHBondContact O-N 3.24Å; T605-K608 PolarHBondContact O-N 3.07Å; T605-L609 HydrophobicContact CG2-CD1 4.13Å; T605-L609 WeakPolarHBondContact O-CG 3.45Å; T605-L609 PolarHBondContact O-N 3.42Å; T605-V872 HydrophobicContact CG2-CG1 4.12Å
606	K	96.4	Very high	93.4	Very high	25 Å²	25	38 Å²	38	11%	0.109	20%	0.199	C	C	.	.	H	α-helix	trans	-58.4	-49	172.8	-176.8	177.2	169.6	-177.8	0	111.7	L586 V589 N590 I593 L602 M603 K608 L609 E610 T622	L586-K606 HydrophobicContact CD1-CG 4.08Å; V589-K606 HydrophobicContact CG1-CB 3.72Å; V589-K606 HydrophobicContact CG1-CG 4.45Å; N590-K606 WeakPolarHBondContact OD1-CE 3.36Å; I593-K606 HydrophobicContact CD1-CB 4.03Å; I593-K606 HydrophobicContact CD1-CD 3.65Å; I593-K606 HydrophobicContact CD1-CG 4.42Å; L602-K606 PolarHBondContact O-N 3.22Å; M603-K606 WeakPolarHBondContact O-CB 3.3Å; M603-K606 PolarHBondContact O-N 3.31Å; M603-K606 VanDerWaalsContact O-N 3.16Å; K606-K608 VanDerWaalsContact C-N 3.29Å; K606-K608 PolarHBondContact O-N 3.28Å; K606-L609 PolarHBondContact O-N 2.82Å; K606-L609 VanDerWaalsContact O-N 3.14Å; K606-E610 WeakPolarHBondContact CE-OE1 3.17Å; K606-E610 HydrophobicContact CG-CG 4.17Å; K606-E610 IonicContact NZ-OE1 3.49Å; K606-E610 WeakPolarHBondContact O-CB 3.49Å; K606-E610 WeakPolarHBondContact O-CG 3.41Å; K606-E610 PolarHBondContact O-N 3.37Å; K606-T622 HydrophobicContact CB-CG2 4.46Å; K606-T622 HydrophobicContact CD-CG2 3.94Å; K606-T622 WeakPolarHBondContact CE-OG1 3.26Å; K606-T622 HydrophobicContact CG-CG2 4.22Å
607	V	96.6	Very high	93.2	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-53.5	-48.2	177.9	169.4	0	0	0	0	110.4	M603 F604 E610 Q611 A619 T622 M626 L744	M603-V607 WeakPolarHBondContact O-CG2 3.43Å; M603-V607 PolarHBondContact O-N 3.42Å; F604-V607 PolarHBondContact O-N 3.18Å; V607-E610 PolarHBondContact O-N 3.18Å; V607-Q611 VanDerWaalsContact O-CB 3.3Å; V607-Q611 WeakPolarHBondContact O-CB 3.48Å; V607-Q611 PolarHBondContact O-N 3.39Å; V607-A619 HydrophobicContact CG1-CB 4.15Å; V607-T622 HydrophobicContact CG2-CG2 3.59Å; V607-M626 HydrophobicContact CG2-SD 3.97Å; V607-L744 HydrophobicContact CG1-CD1 4.01Å
608	K	95.6	Very high	93.3	Very high	26 Å²	26	40.2 Å²	40.2	11%	0.113	20%	0.203	C	C	.	.	H	α-helix	trans	-66.8	-38	178.6	-70.3	-55.4	-170.2	-171.6	0	113.6	F604 T605 K606 Q611 V612 Q740 E743 V872 L873	F604-K608 PolarHBondContact O-N 2.89Å; F604-K608 VanDerWaalsContact O-N 3.14Å; T605-K608 PolarHBondContact O-N 3.07Å; K606-K608 VanDerWaalsContact C-N 3.29Å; K606-K608 PolarHBondContact O-N 3.28Å; K608-Q611 VanDerWaalsContact CD-OE1 3.23Å; K608-V612 WeakPolarHBondContact O-CG2 3.48Å; K608-V612 PolarHBondContact O-N 2.92Å; K608-Q740 VanDerWaalsContact NZ-OE1 3.13Å; K608-E743 IonicContact NZ-OE1 3.56Å; K608-E743 IonicContact NZ-OE2 3.79Å; K608-E743 PolarHBondContact NZ-OE2 3.06Å; K608-V872 HydrophobicContact CB-CG1 4.18Å; K608-V872 HydrophobicContact CB-CG2 3.73Å; K608-L873 HydrophobicContact CB-CG 4.39Å; K608-L873 HydrophobicContact CG-CD1 4.23Å; K608-L873 HydrophobicContact CG-CD2 3.82Å; K608-L873 HydrophobicContact CG-CG 3.94Å
609	L	95.9	Very high	93.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-68.4	-40.4	175.7	-70.9	170.6	0	0	0	112.2	A585 L586 V589 T605 K606 V612 L613 V872	A585-L609 HydrophobicContact CB-CD1 3.88Å; A585-L609 HydrophobicContact CB-CD2 3.9Å; L586-L609 HydrophobicContact CB-CB 4.47Å; L586-L609 HydrophobicContact CB-CD1 4.44Å; L586-L609 HydrophobicContact CD1-CB 4.18Å; V589-L609 HydrophobicContact CG2-CD1 3.88Å; T605-L609 HydrophobicContact CG2-CD1 4.13Å; T605-L609 WeakPolarHBondContact O-CG 3.45Å; T605-L609 PolarHBondContact O-N 3.42Å; K606-L609 PolarHBondContact O-N 2.82Å; K606-L609 VanDerWaalsContact O-N 3.14Å; L609-V612 PolarHBondContact O-N 3.33Å; L609-L613 WeakPolarHBondContact O-CB 3.32Å; L609-L613 PolarHBondContact O-N 3.5Å; L609-V872 HydrophobicContact CD2-CB 4.22Å; L609-V872 HydrophobicContact CD2-CG1 3.99Å; L609-V872 HydrophobicContact CD2-CG2 4.34Å; L609-V872 HydrophobicContact CG-CG1 4.11Å
610	E	95.3	Very high	93.6	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.019	17%	0.166	C	C	.	.	H	α-helix	trans	-67.2	-38.6	176.5	-71.5	-178.7	148.8	0	0	111.7	L586 K606 V607 V612 L613 K614 G615 E618 A619 T622	L586-E610 HydrophobicContact CD1-CG 3.98Å; L586-E610 HydrophobicContact CD2-CG 4.4Å; K606-E610 WeakPolarHBondContact CE-OE1 3.17Å; K606-E610 HydrophobicContact CG-CG 4.17Å; K606-E610 IonicContact NZ-OE1 3.49Å; K606-E610 WeakPolarHBondContact O-CB 3.49Å; K606-E610 WeakPolarHBondContact O-CG 3.41Å; K606-E610 PolarHBondContact O-N 3.37Å; V607-E610 PolarHBondContact O-N 3.18Å; E610-V612 VanDerWaalsContact C-N 3.28Å; E610-V612 PolarHBondContact O-N 3.23Å; E610-L613 PolarHBondContact O-N 3.1Å; E610-K614 HydrophobicContact CG-CD 4.29Å; E610-K614 WeakPolarHBondContact O-CA 3.49Å; E610-K614 PolarHBondContact O-N 3.42Å; E610-K614 IonicContact OE1-NZ 3.54Å; E610-K614 PolarHBondContact OE1-NZ 3.23Å; E610-G615 PolarHBondContact O-N 2.84Å; E610-E618 HydrophobicContact CB-CG 4.41Å; E610-E618 HydrophobicContact CG-CG 4.31Å; E610-A619 HydrophobicContact CB-CB 4.34Å; E610-T622 WeakPolarHBondContact OE2-CB 3.3Å; E610-T622 PolarHBondContact OE2-OG1 2.61Å
611	Q	94.2	Very high	93.5	Very high	30 Å²	30	33.8 Å²	33.8	14%	0.14	18%	0.175	C	C	.	.	H	α-helix	trans	-55.5	-43.9	173	-175.8	-176.5	2.7	0	0	111.4	V607 K608 G615 A619 L744 E747	V607-Q611 VanDerWaalsContact O-CB 3.3Å; V607-Q611 WeakPolarHBondContact O-CB 3.48Å; V607-Q611 PolarHBondContact O-N 3.39Å; K608-Q611 VanDerWaalsContact CD-OE1 3.23Å; Q611-G615 WeakPolarHBondContact O-CA 3.43Å; Q611-A619 HydrophobicContact CB-CB 4.28Å; Q611-L744 HydrophobicContact CB-CD2 4.11Å; Q611-L744 HydrophobicContact CG-CD2 3.71Å; Q611-E747 PolarHBondContact NE2-OE1 3.28Å; Q611-E747 PolarHBondContact NE2-OE2 3.44Å
612	V	93.1	Very high	93.5	Very high	81 Å²	81	31.5 Å²	31.5	49%	0.491	16%	0.163	S	C	.	.	H	α-helix	trans	-74.3	-40.2	179.6	175.1	0	0	0	0	112.7	K608 L609 E610 V872	K608-V612 WeakPolarHBondContact O-CG2 3.48Å; K608-V612 PolarHBondContact O-N 2.92Å; L609-V612 PolarHBondContact O-N 3.33Å; E610-V612 VanDerWaalsContact C-N 3.28Å; E610-V612 PolarHBondContact O-N 3.23Å; V612-V872 HydrophobicContact CG2-CG2 4.25Å
613	L	93.9	Very high	93.4	Very high	68 Å²	68	31.5 Å²	31.5	36%	0.356	16%	0.163	S	C	.	.	H	α-helix	trans	-90.4	-44.3	-172.2	-77.1	173.1	0	0	0	115	H582 L586 L609 E610	H582-L613 HydrophobicContact CB-CD1 3.91Å; H582-L613 HydrophobicContact CB-CD2 3.71Å; H582-L613 HydrophobicContact CB-CG 3.78Å; L586-L613 HydrophobicContact CB-CD1 4.06Å; L586-L613 HydrophobicContact CD2-CD1 3.82Å; L609-L613 WeakPolarHBondContact O-CB 3.32Å; L609-L613 PolarHBondContact O-N 3.5Å; E610-L613 PolarHBondContact O-N 3.1Å
614	K	91.7	Very high	93.1	Very high	111 Å²	111	31.9 Å²	31.9	48%	0.483	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-24.1	-170	-62.9	174.4	176.9	177.9	0	112	E610 E618	E610-K614 HydrophobicContact CG-CD 4.29Å; E610-K614 WeakPolarHBondContact O-CA 3.49Å; E610-K614 PolarHBondContact O-N 3.42Å; E610-K614 IonicContact OE1-NZ 3.54Å; E610-K614 PolarHBondContact OE1-NZ 3.23Å; K614-E618 HydrophobicContact CB-CB 4.01Å; K614-E618 HydrophobicContact CD-CB 3.96Å; K614-E618 HydrophobicContact CD-CG 3.56Å; K614-E618 IonicContact NZ-OE1 3.75Å; K614-E618 PolarHBondContact NZ-OE1 3.18Å
615	G	90.9	Very high	92.9	Very high	19 Å²	19	35.4 Å²	35.4	20%	0.196	18%	0.181	C	C	.	.			trans	102.4	177.1	-177.6	0	0	0	0	0	113.3	E610 Q611 E617	E610-G615 PolarHBondContact O-N 2.84Å; Q611-G615 WeakPolarHBondContact O-CA 3.43Å; G615-E617 VanDerWaalsContact C-N 3.27Å; G615-E617 PolarHBondContact O-N 3.43Å
616	P	91.1	Very high	92.7	Very high	34 Å²	34	35.4 Å²	35.4	22%	0.221	18%	0.181	C	C	.	.	H	α-helix	trans	-70.6	-19.7	-168.2	27.8	-36.1	0	0	0	113.8	L620 L744 Q748	P616-L620 VanDerWaalsContact O-CG 3.32Å; P616-L620 WeakPolarHBondContact O-CG 3.15Å; P616-L620 PolarHBondContact O-N 3.13Å; P616-L620 VanDerWaalsContact O-N 3.13Å; P616-L744 HydrophobicContact CB-CB 4.39Å; P616-L744 HydrophobicContact CB-CD2 4.11Å; P616-Q748 HydrophobicContact CB-CG 4.01Å; P616-Q748 HydrophobicContact CG-CG 3.66Å
617	E	88.5	Confident	92.3	Very high	108 Å²	108	34.4 Å²	34.4	51%	0.505	18%	0.176	S	C	.	.	H	α-helix	trans	-67.3	-45.3	-179.3	-61.8	-165.9	141.5	0	0	112.7	G615 L620 V621 S703	G615-E617 VanDerWaalsContact C-N 3.27Å; G615-E617 PolarHBondContact O-N 3.43Å; E617-L620 PolarHBondContact O-N 3.42Å; E617-V621 PolarHBondContact O-N 3.45Å; E617-S703 VanDerWaalsContact CD-OG 3.27Å; E617-S703 WeakPolarHBondContact OE1-CB 3.49Å; E617-S703 PolarHBondContact OE1-OG 3.47Å
618	E	90.7	Very high	92	Very high	78 Å²	78	41.1 Å²	41.1	36%	0.364	20%	0.202	S	C	.	.	H	α-helix	trans	-67.2	-42	177.2	-171.2	89.6	146.8	0	0	110.7	E610 K614 L620 V621 T622	E610-E618 HydrophobicContact CB-CG 4.41Å; E610-E618 HydrophobicContact CG-CG 4.31Å; K614-E618 HydrophobicContact CB-CB 4.01Å; K614-E618 HydrophobicContact CD-CB 3.96Å; K614-E618 HydrophobicContact CD-CG 3.56Å; K614-E618 IonicContact NZ-OE1 3.75Å; K614-E618 PolarHBondContact NZ-OE1 3.18Å; E618-L620 VanDerWaalsContact C-N 3.26Å; E618-L620 PolarHBondContact O-N 3.25Å; E618-V621 WeakPolarHBondContact O-CA 3.32Å; E618-V621 VanDerWaalsContact O-CB 3.28Å; E618-V621 WeakPolarHBondContact O-CB 3.48Å; E618-V621 PolarHBondContact O-N 3.32Å; E618-T622 PolarHBondContact O-N 2.96Å
619	A	92.5	Very high	91.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-57.8	-38.8	179	0	0	0	0	0	112	V607 E610 Q611 V621 T622 C623 L744	V607-A619 HydrophobicContact CG1-CB 4.15Å; E610-A619 HydrophobicContact CB-CB 4.34Å; Q611-A619 HydrophobicContact CB-CB 4.28Å; A619-V621 VanDerWaalsContact C-N 3.32Å; A619-V621 PolarHBondContact O-N 2.75Å; A619-T622 PolarHBondContact O-N 2.96Å; A619-C623 PolarHBondContact O-N 3.37Å; A619-C623 PolarHBondContact O-SG 3.28Å; A619-L744 HydrophobicContact CB-CD1 3.62Å; A619-L744 HydrophobicContact CB-CD2 3.78Å; A619-L744 HydrophobicContact CB-CG 4.37Å
620	L	91.3	Very high	91.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.8	-31	173.9	-72.9	172.2	0	0	0	113.2	P616 E617 E618 T622 C623 R624 L709 A741 L744 F745	P616-L620 VanDerWaalsContact O-CG 3.32Å; P616-L620 WeakPolarHBondContact O-CG 3.15Å; P616-L620 PolarHBondContact O-N 3.13Å; P616-L620 VanDerWaalsContact O-N 3.13Å; E617-L620 PolarHBondContact O-N 3.42Å; E618-L620 VanDerWaalsContact C-N 3.26Å; E618-L620 PolarHBondContact O-N 3.25Å; L620-T622 VanDerWaalsContact C-N 3.32Å; L620-C623 PolarHBondContact O-N 3.48Å; L620-R624 PolarHBondContact O-N 2.65Å; L620-L709 HydrophobicContact CB-CD2 4.31Å; L620-L709 HydrophobicContact CD2-CD2 3.77Å; L620-A741 HydrophobicContact CD2-CB 4.26Å; L620-L744 HydrophobicContact CD2-CB 3.77Å; L620-L744 HydrophobicContact CD2-CD1 3.83Å; L620-L744 HydrophobicContact CD2-CG 4.48Å; L620-L744 HydrophobicContact CG-CB 4.02Å; L620-L744 HydrophobicContact CG-CD1 4.03Å; L620-F745 HydrophobicContact CD1-CD1 4.01Å; L620-F745 HydrophobicContact CD1-CE1 3.63Å; L620-F745 HydrophobicContact CD1-CZ 4.09Å; L620-F745 HydrophobicContact CD2-CD2 4.33Å; L620-F745 HydrophobicContact CD2-CE1 4.31Å; L620-F745 HydrophobicContact CD2-CE2 4.07Å; L620-F745 HydrophobicContact CD2-CZ 4.07Å
621	V	91.1	Very high	90.9	Very high	47 Å²	47	44.5 Å²	44.5	29%	0.285	22%	0.218	S	C	.	.	H	α-helix	trans	-64.8	-40.3	172.9	178.4	0	0	0	0	110.2	E617 E618 A619 R624 Q625 A705	E617-V621 PolarHBondContact O-N 3.45Å; E618-V621 WeakPolarHBondContact O-CA 3.32Å; E618-V621 VanDerWaalsContact O-CB 3.28Å; E618-V621 WeakPolarHBondContact O-CB 3.48Å; E618-V621 PolarHBondContact O-N 3.32Å; A619-V621 VanDerWaalsContact C-N 3.32Å; A619-V621 PolarHBondContact O-N 2.75Å; V621-R624 WeakPolarHBondContact O-CB 3.37Å; V621-R624 PolarHBondContact O-N 3.47Å; V621-Q625 WeakPolarHBondContact O-CG 3.26Å; V621-Q625 PolarHBondContact O-N 3.05Å; V621-Q625 VanDerWaalsContact O-N 3.15Å; V621-A705 HydrophobicContact CG2-CB 4.19Å
622	T	93.2	Very high	90.5	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.018	24%	0.239	C	C	.	.	H	α-helix	trans	-67	-42	174.6	-62.1	0	0	0	0	111.5	K606 V607 E610 E618 A619 L620 R624 Q625 M626	K606-T622 HydrophobicContact CB-CG2 4.46Å; K606-T622 HydrophobicContact CD-CG2 3.94Å; K606-T622 WeakPolarHBondContact CE-OG1 3.26Å; K606-T622 HydrophobicContact CG-CG2 4.22Å; V607-T622 HydrophobicContact CG2-CG2 3.59Å; E610-T622 WeakPolarHBondContact OE2-CB 3.3Å; E610-T622 PolarHBondContact OE2-OG1 2.61Å; E618-T622 PolarHBondContact O-N 2.96Å; A619-T622 PolarHBondContact O-N 2.96Å; L620-T622 VanDerWaalsContact C-N 3.32Å; T622-R624 VanDerWaalsContact C-N 3.26Å; T622-R624 PolarHBondContact O-N 2.97Å; T622-Q625 WeakPolarHBondContact O-CA 3.33Å; T622-Q625 WeakPolarHBondContact O-CB 3.39Å; T622-Q625 PolarHBondContact O-N 2.69Å; T622-M626 WeakPolarHBondContact O-CG 3.12Å; T622-M626 PolarHBondContact O-N 3.37Å
623	C	92.5	Very high	90.1	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-56.5	-39.2	172.9	-68.2	0	0	0	0	112.5	A619 L620 M626 L627 A741	A619-C623 PolarHBondContact O-N 3.37Å; A619-C623 PolarHBondContact O-SG 3.28Å; L620-C623 PolarHBondContact O-N 3.48Å; C623-M626 WeakPolarHBondContact O-CB 3.5Å; C623-M626 PolarHBondContact O-N 3.39Å; C623-L627 PolarHBondContact O-N 3.36Å; C623-A741 HydrophobicContact CB-CB 4.5Å
624	R	89	Confident	89.4	Confident	22 Å²	22	43.3 Å²	43.3	8%	0.083	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-42.8	173.4	-174.3	-157.2	-58.8	-86	-11.6	112.5	L620 V621 T622 M626 L627 R628 A705 R708 L709	L620-R624 PolarHBondContact O-N 2.65Å; V621-R624 WeakPolarHBondContact O-CB 3.37Å; V621-R624 PolarHBondContact O-N 3.47Å; T622-R624 VanDerWaalsContact C-N 3.26Å; T622-R624 PolarHBondContact O-N 2.97Å; R624-M626 VanDerWaalsContact C-N 3.27Å; R624-M626 PolarHBondContact O-N 3.02Å; R624-L627 PolarHBondContact O-N 2.89Å; R624-R628 PolarHBondContact O-N 2.66Å; R624-R628 VanDerWaalsContact O-N 3.1Å; R624-A705 PolarHBondContact NH2-O 3.13Å; R624-R708 VanDerWaalsContact NH1-CB 3.32Å; R624-R708 PolarHBondContact NH1-O 2.87Å; R624-R708 VanDerWaalsContact NH2-C 3.25Å; R624-L709 HydrophobicContact CB-CD1 3.87Å; R624-L709 HydrophobicContact CG-CD1 4.21Å; R624-L709 VanDerWaalsContact NH2-CA 3.34Å
625	Q	90.6	Very high	88.7	Confident	88 Å²	88	41.1 Å²	41.1	41%	0.411	21%	0.212	S	C	.	.	H	α-helix	trans	-60.8	-41.9	177.2	-68.2	171.2	-0.7	0	0	110.2	V621 T622 L627 R628 L629	V621-Q625 WeakPolarHBondContact O-CG 3.26Å; V621-Q625 PolarHBondContact O-N 3.05Å; V621-Q625 VanDerWaalsContact O-N 3.15Å; T622-Q625 WeakPolarHBondContact O-CA 3.33Å; T622-Q625 WeakPolarHBondContact O-CB 3.39Å; T622-Q625 PolarHBondContact O-N 2.69Å; Q625-L627 PolarHBondContact O-N 3.5Å; Q625-R628 PolarHBondContact O-N 3.45Å; Q625-L629 WeakPolarHBondContact O-CB 3.43Å; Q625-L629 PolarHBondContact O-N 2.99Å
626	M	92.2	Very high	87.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.2	-43	175.6	-62.7	170.4	78.5	0	0	112.4	F600 M603 F604 V607 T622 C623 R624 R628 L629 W630 I737	F600-M626 HydrophobicContact CD1-CB 4.42Å; F600-M626 HydrophobicContact CD1-CE 4Å; F600-M626 HydrophobicContact CE1-CB 4.36Å; M603-M626 HydrophobicContact CB-CE 3.81Å; M603-M626 HydrophobicContact CB-CG 3.75Å; M603-M626 HydrophobicContact CB-SD 3.77Å; M603-M626 HydrophobicContact CG-CG 4.26Å; M603-M626 HydrophobicContact SD-CB 4.44Å; M603-M626 HydrophobicContact SD-CG 3.5Å; M603-M626 WeakPolarHBondContact SD-CG 3.31Å; F604-M626 HydrophobicContact CD1-CE 3.6Å; F604-M626 HydrophobicContact CD2-CE 4.03Å; F604-M626 HydrophobicContact CE1-CE 3.49Å; F604-M626 VanDerWaalsContact CE1-CE 3.49Å; F604-M626 HydrophobicContact CE2-CE 3.91Å; F604-M626 HydrophobicContact CG-CE 3.87Å; F604-M626 HydrophobicContact CZ-CE 3.63Å; V607-M626 HydrophobicContact CG2-SD 3.97Å; T622-M626 WeakPolarHBondContact O-CG 3.12Å; T622-M626 PolarHBondContact O-N 3.37Å; C623-M626 WeakPolarHBondContact O-CB 3.5Å; C623-M626 PolarHBondContact O-N 3.39Å; R624-M626 VanDerWaalsContact C-N 3.27Å; R624-M626 PolarHBondContact O-N 3.02Å; M626-R628 PolarHBondContact O-N 3.47Å; M626-L629 PolarHBondContact O-N 3.32Å; M626-W630 WeakPolarHBondContact O-CB 3.45Å; M626-W630 PolarHBondContact O-N 3.08Å; M626-I737 HydrophobicContact CB-CD1 3.76Å; M626-I737 HydrophobicContact CB-CG1 4.03Å; M626-I737 HydrophobicContact CB-CG2 4.3Å; M626-I737 HydrophobicContact CE-CD1 4.31Å; M626-I737 HydrophobicContact CE-CG1 3.72Å; M626-I737 HydrophobicContact SD-CG1 4.44Å
627	L	89.3	Confident	85.8	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-42.4	176.3	-71.5	175.6	0	0	0	112.3	C623 R624 Q625 W630 Q631 L709 L716 L734 I737 W738	C623-L627 PolarHBondContact O-N 3.36Å; R624-L627 PolarHBondContact O-N 2.89Å; Q625-L627 PolarHBondContact O-N 3.5Å; L627-W630 WeakPolarHBondContact O-CB 3.41Å; L627-W630 PolarHBondContact O-N 2.68Å; L627-Q631 WeakPolarHBondContact O-CG 3.33Å; L627-Q631 PolarHBondContact O-N 2.87Å; L627-L709 HydrophobicContact CD1-CD1 4.03Å; L627-L716 HydrophobicContact CB-CD1 3.93Å; L627-L716 HydrophobicContact CD1-CD1 3.99Å; L627-L716 HydrophobicContact CD2-CD1 4.27Å; L627-L716 HydrophobicContact CG-CD1 4.29Å; L627-L734 HydrophobicContact CD2-CD1 3.48Å; L627-L734 VanDerWaalsContact CD2-CD1 3.48Å; L627-I737 HydrophobicContact CD2-CB 4.3Å; L627-I737 HydrophobicContact CD2-CG2 3.57Å; L627-I737 HydrophobicContact CG-CG2 3.73Å; L627-W738 HydrophobicContact CD1-CH2 4.48Å; L627-W738 HydrophobicContact CD2-CZ2 4.4Å
628	R	88.6	Confident	84.4	Confident	141 Å²	141	47.9 Å²	47.9	53%	0.532	24%	0.238	S	C	.	.	H	α-helix	trans	-65.4	-40.9	176.5	-72.1	178.4	177.5	171.7	-2.9	112.4	R624 Q625 M626 W630 Q631 T632	R624-R628 PolarHBondContact O-N 2.66Å; R624-R628 VanDerWaalsContact O-N 3.1Å; Q625-R628 PolarHBondContact O-N 3.45Å; M626-R628 PolarHBondContact O-N 3.47Å; R628-W630 VanDerWaalsContact C-N 3.34Å; R628-Q631 PolarHBondContact O-N 3.46Å; R628-T632 PolarHBondContact O-N 2.87Å; R628-T632 VanDerWaalsContact O-N 3.1Å; R628-T632 PolarHBondContact O-OG1 2.85Å
629	L	89.4	Confident	82.5	Confident	31 Å²	31	50.3 Å²	50.3	16%	0.162	25%	0.253	C	S	.	.	H	α-helix	trans	-60.9	-47.2	174.8	176.2	65.9	0	0	0	110.2	P597 E598 F600 M603 Q625 M626 Q631 T632 L633	P597-L629 WeakPolarHBondContact O-CD2 3.49Å; E598-L629 HydrophobicContact CG-CD1 4.35Å; F600-L629 HydrophobicContact CD1-CD2 4.37Å; F600-L629 HydrophobicContact CE1-CB 4.45Å; F600-L629 HydrophobicContact CE1-CD2 3.8Å; F600-L629 HydrophobicContact CE1-CG 4.22Å; F600-L629 HydrophobicContact CE2-CD2 4.34Å; F600-L629 HydrophobicContact CZ-CB 4.48Å; F600-L629 HydrophobicContact CZ-CD2 3.79Å; F600-L629 HydrophobicContact CZ-CG 3.93Å; M603-L629 HydrophobicContact CE-CD2 3.74Å; M603-L629 HydrophobicContact SD-CD2 4.06Å; Q625-L629 WeakPolarHBondContact O-CB 3.43Å; Q625-L629 PolarHBondContact O-N 2.99Å; M626-L629 PolarHBondContact O-N 3.32Å; L629-Q631 PolarHBondContact O-N 3.2Å; L629-T632 WeakPolarHBondContact O-CB 3.49Å; L629-T632 PolarHBondContact O-N 3.47Å; L629-T632 VanDerWaalsContact O-N 3.13Å; L629-L633 HydrophobicContact CD1-CD1 4.29Å; L629-L633 HydrophobicContact CD1-CG 4.36Å; L629-L633 HydrophobicContact CG-CD1 4.12Å; L629-L633 WeakPolarHBondContact O-CG 3.48Å; L629-L633 PolarHBondContact O-N 3.32Å
630	W	89.6	Confident	80.2	Confident	9 Å²	9	53.8 Å²	53.8	3%	0.034	29%	0.289	C	S	.	.	H	α-helix	trans	-57.4	-46.2	177	-176.4	92.2	0	0	0	112.6	F600 M626 L627 R628 T632 L633 Y634 L730 W731 L734	F600-W630 HydrophobicContact CE1-CB 4.39Å; F600-W630 HydrophobicContact CZ-CB 4.16Å; M626-W630 WeakPolarHBondContact O-CB 3.45Å; M626-W630 PolarHBondContact O-N 3.08Å; L627-W630 WeakPolarHBondContact O-CB 3.41Å; L627-W630 PolarHBondContact O-N 2.68Å; R628-W630 VanDerWaalsContact C-N 3.34Å; W630-T632 VanDerWaalsContact C-N 3.28Å; W630-T632 PolarHBondContact O-N 3.39Å; W630-L633 PolarHBondContact O-N 3.32Å; W630-Y634 HydrophobicContact CH2-CD1 4.33Å; W630-Y634 HydrophobicContact CH2-CD2 4.11Å; W630-Y634 AromaticContact CH2-CG 3.93Å; W630-Y634 HydrophobicContact CH2-CG 3.93Å; W630-Y634 HydrophobicContact CZ2-CD2 4.15Å; W630-Y634 HydrophobicContact CZ2-CG 4.29Å; W630-Y634 HydrophobicContact CZ3-CG 4.33Å; W630-Y634 WeakPolarHBondContact O-CB 3.47Å; W630-Y634 PolarHBondContact O-N 3.28Å; W630-L730 PolarHBondContact NE1-O 2.7Å; W630-W731 HydrophobicContact CH2-CE3 4.19Å; W630-W731 HydrophobicContact CH2-CH2 4Å; W630-W731 AromaticContact CH2-CZ3 3.64Å; W630-W731 HydrophobicContact CH2-CZ3 3.64Å; W630-W731 HydrophobicContact CZ2-CD2 4.32Å; W630-W731 AromaticContact CZ2-CE3 3.77Å; W630-W731 HydrophobicContact CZ2-CE3 3.77Å; W630-W731 HydrophobicContact CZ2-CH2 4.21Å; W630-W731 AromaticContact CZ2-CZ3 3.7Å; W630-W731 HydrophobicContact CZ2-CZ3 3.7Å; W630-L734 HydrophobicContact CD2-CB 4.31Å; W630-L734 HydrophobicContact CD2-CD1 4.02Å; W630-L734 HydrophobicContact CD2-CD2 4.22Å; W630-L734 HydrophobicContact CD2-CG 4.41Å; W630-L734 HydrophobicContact CE3-CD1 4.2Å; W630-L734 HydrophobicContact CE3-CD2 4.26Å; W630-L734 HydrophobicContact CG-CB 4.49Å; W630-L734 HydrophobicContact CG-CD1 4.29Å; W630-L734 HydrophobicContact CH2-CD2 3.72Å; W630-L734 HydrophobicContact CZ2-CB 4.26Å; W630-L734 HydrophobicContact CZ2-CD2 3.63Å; W630-L734 HydrophobicContact CZ2-CG 4.44Å; W630-L734 HydrophobicContact CZ3-CD2 4.02Å
631	Q	85.4	Confident	77.7	Confident	60 Å²	60	60.4 Å²	60.4	28%	0.28	32%	0.324	S	S	.	.	H	α-helix	trans	-57.3	-42.1	175.6	-74.2	173	-35.7	0	0	112.3	L627 R628 L629 Y634 S635 L716	L627-Q631 WeakPolarHBondContact O-CG 3.33Å; L627-Q631 PolarHBondContact O-N 2.87Å; R628-Q631 PolarHBondContact O-N 3.46Å; L629-Q631 PolarHBondContact O-N 3.2Å; Q631-Y634 PolarHBondContact O-N 3.24Å; Q631-S635 WeakPolarHBondContact O-CB 3.42Å; Q631-S635 PolarHBondContact O-N 3.39Å; Q631-S635 PolarHBondContact O-OG 3.4Å; Q631-L716 HydrophobicContact CG-CD2 3.5Å; Q631-L716 VanDerWaalsContact CG-CD2 3.5Å; Q631-L716 HydrophobicContact CG-CG 4.44Å
632	T	86.3	Confident	74.9	Confident	95 Å²	95	61.1 Å²	61.1	58%	0.583	33%	0.331	S	S	*	.	H	α-helix	trans	-65.7	-46.1	-178.5	-53.4	0	0	0	0	110.3	R628 L629 W630 S635 F636	R628-T632 PolarHBondContact O-N 2.87Å; R628-T632 VanDerWaalsContact O-N 3.1Å; R628-T632 PolarHBondContact O-OG1 2.85Å; L629-T632 WeakPolarHBondContact O-CB 3.49Å; L629-T632 PolarHBondContact O-N 3.47Å; L629-T632 VanDerWaalsContact O-N 3.13Å; W630-T632 VanDerWaalsContact C-N 3.28Å; W630-T632 PolarHBondContact O-N 3.39Å; T632-S635 PolarHBondContact O-N 3.33Å; T632-F636 PolarHBondContact O-N 2.84Å
633	L	84.1	Confident	72.1	Confident	42 Å²	42	65.2 Å²	65.2	22%	0.22	37%	0.374	C	S	.	.	H	α-helix	trans	-65.4	-41.4	177.9	-66.5	174.7	0	0	0	112.1	F600 L629 W630 F636 S637	F600-L633 HydrophobicContact CE2-CD1 3.72Å; F600-L633 HydrophobicContact CZ-CD1 3.93Å; L629-L633 HydrophobicContact CD1-CD1 4.29Å; L629-L633 HydrophobicContact CD1-CG 4.36Å; L629-L633 HydrophobicContact CG-CD1 4.12Å; L629-L633 WeakPolarHBondContact O-CG 3.48Å; L629-L633 PolarHBondContact O-N 3.32Å; W630-L633 PolarHBondContact O-N 3.32Å; L633-F636 PolarHBondContact O-N 3.45Å; L633-S637 PolarHBondContact O-N 2.92Å
634	Y	80.1	Confident	69	Low	17 Å²	17	69.5 Å²	69.5	7%	0.067	40%	0.404	C	S	.	.	H	α-helix	trans	-64.5	-43.6	177.4	-177.9	-102.3	0	0	0	112.6	W630 Q631 F636 S637 Q638 W731	W630-Y634 HydrophobicContact CH2-CD1 4.33Å; W630-Y634 HydrophobicContact CH2-CD2 4.11Å; W630-Y634 AromaticContact CH2-CG 3.93Å; W630-Y634 HydrophobicContact CH2-CG 3.93Å; W630-Y634 HydrophobicContact CZ2-CD2 4.15Å; W630-Y634 HydrophobicContact CZ2-CG 4.29Å; W630-Y634 HydrophobicContact CZ3-CG 4.33Å; W630-Y634 WeakPolarHBondContact O-CB 3.47Å; W630-Y634 PolarHBondContact O-N 3.28Å; Q631-Y634 PolarHBondContact O-N 3.24Å; Y634-F636 VanDerWaalsContact C-N 3.27Å; Y634-F636 PolarHBondContact O-N 3Å; Y634-S637 WeakPolarHBondContact O-CB 3.45Å; Y634-S637 PolarHBondContact O-N 3.01Å; Y634-S637 VanDerWaalsContact O-N 3.1Å; Y634-Q638 HydrophobicContact CD1-CG 4.48Å; Y634-Q638 HydrophobicContact CE1-CG 4.02Å; Y634-Q638 VanDerWaalsContact CZ-NE2 3.3Å; Y634-Q638 PolarHBondContact O-N 3.12Å; Y634-Q638 VanDerWaalsContact O-N 3.12Å; Y634-Q638 PolarHBondContact OH-NE2 3.33Å; Y634-W731 HydrophobicContact CD2-CZ2 4.27Å; Y634-W731 AromaticContact CE2-CH2 3.81Å; Y634-W731 HydrophobicContact CE2-CH2 3.81Å; Y634-W731 AromaticContact CE2-CZ2 3.41Å; Y634-W731 HydrophobicContact CE2-CZ2 3.41Å; Y634-W731 VanDerWaalsContact CE2-CZ2 3.41Å; Y634-W731 AromaticContact CZ-CH2 3.93Å; Y634-W731 AromaticContact CZ-CZ2 3.85Å
635	S	75.8	Confident	66.3	Low	66 Å²	66	73.7 Å²	73.7	46%	0.462	43%	0.434	S	S	.	.	H	α-helix	trans	-61	-38	177.7	-56.6	0	0	0	0	111.8	Q631 T632 Q638 L639	Q631-S635 WeakPolarHBondContact O-CB 3.42Å; Q631-S635 PolarHBondContact O-N 3.39Å; Q631-S635 PolarHBondContact O-OG 3.4Å; T632-S635 PolarHBondContact O-N 3.33Å; S635-Q638 PolarHBondContact O-N 2.9Å; S635-L639 PolarHBondContact O-N 3.14Å
636	F	61.8	Low	63.3	Low	166 Å²	166	78.3 Å²	78.3	73%	0.728	46%	0.456	S	S	*	.	H	α-helix	trans	-66.2	-39.8	174.7	-158.3	-88.7	0	0	0	111.9	T632 L633 Y634 Q638 L639 G640	T632-F636 PolarHBondContact O-N 2.84Å; L633-F636 PolarHBondContact O-N 3.45Å; Y634-F636 VanDerWaalsContact C-N 3.27Å; Y634-F636 PolarHBondContact O-N 3Å; F636-Q638 VanDerWaalsContact C-N 3.29Å; F636-Q638 PolarHBondContact O-N 2.92Å; F636-L639 PolarHBondContact O-N 3.13Å; F636-G640 PolarHBondContact O-N 3.2Å
637	S	60.7	Low	60.1	Low	50 Å²	50	83.6 Å²	83.6	35%	0.35	49%	0.493	S	S	.	.	H	α-helix	trans	-62.9	-31.9	176.5	-173.9	0	0	0	0	113.1	L633 Y634	L633-S637 PolarHBondContact O-N 2.92Å; Y634-S637 WeakPolarHBondContact O-CB 3.45Å; Y634-S637 PolarHBondContact O-N 3.01Å; Y634-S637 VanDerWaalsContact O-N 3.1Å
638	Q	58.3	Low	57	Low	87 Å²	87	93 Å²	93	41%	0.407	53%	0.534	S	S	.	.	H	α-helix	trans	-77.7	-33.1	178.3	-69.2	-153.3	-26	0	0	113.6	Y634 S635 F636 G640 D641 S642	Y634-Q638 HydrophobicContact CD1-CG 4.48Å; Y634-Q638 HydrophobicContact CE1-CG 4.02Å; Y634-Q638 VanDerWaalsContact CZ-NE2 3.3Å; Y634-Q638 PolarHBondContact O-N 3.12Å; Y634-Q638 VanDerWaalsContact O-N 3.12Å; Y634-Q638 PolarHBondContact OH-NE2 3.33Å; S635-Q638 PolarHBondContact O-N 2.9Å; F636-Q638 VanDerWaalsContact C-N 3.29Å; F636-Q638 PolarHBondContact O-N 2.92Å; Q638-G640 PolarHBondContact O-N 3.4Å; Q638-D641 PolarHBondContact O-N 3.14Å; Q638-S642 PolarHBondContact O-N 3.33Å; Q638-S642 PolarHBondContact O-OG 2.62Å
639	L	51.6	Low	53.9	Low	129 Å²	129	95 Å²	95	68%	0.675	55%	0.549	S	S	*	.	H	α-helix	trans	-66.1	-25.5	174.8	-76.6	159	0	0	0	112.4	S635 F636 D641	S635-L639 PolarHBondContact O-N 3.14Å; F636-L639 PolarHBondContact O-N 3.13Å; L639-D641 VanDerWaalsContact C-N 3.32Å; L639-D641 PolarHBondContact O-N 3.46Å
640	G	44	Very low	50.6	Low	72 Å²	72	99.2 Å²	99.2	74%	0.742	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-20.9	173.8	0	0	0	0	0	115.2	F636 Q638	F636-G640 PolarHBondContact O-N 3.2Å; Q638-G640 PolarHBondContact O-N 3.4Å
641	D	39.3	Very low	47.5	Very low	139 Å²	139	105 Å²	105	74%	0.743	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-9.1	-174.9	-147.9	21	0	0	0	112.7	Q638 L639	Q638-D641 PolarHBondContact O-N 3.14Å; L639-D641 VanDerWaalsContact C-N 3.32Å; L639-D641 PolarHBondContact O-N 3.46Å
642	S	31.3	Very low	44.5	Very low	62 Å²	62	110.1 Å²	110.1	43%	0.434	64%	0.639	S	S	.	*	S	Bend	trans	-106.9	93.3	174.5	52	0	0	0	0	110.4	Q638 S644	Q638-S642 PolarHBondContact O-N 3.33Å; Q638-S642 PolarHBondContact O-OG 2.62Å; S642-S644 VanDerWaalsContact C-N 3.3Å; S642-S644 PolarHBondContact O-N 3.42Å
643	G	35.2	Very low	41.5	Very low	89 Å²	89	117 Å²	117	92%	0.918	65%	0.654	S	S	*	*			trans	-62.9	87.8	169.3	0	0	0	0	0	111.5
644	S	26.3	Very low	38.6	Very low	90 Å²	90	121.8 Å²	121.8	63%	0.629	68%	0.68	S	S	*	*			trans	-149.8	115	162.1	47.1	0	0	0	0	109.8	S642 E646	S642-S644 VanDerWaalsContact C-N 3.3Å; S642-S644 PolarHBondContact O-N 3.42Å; S644-E646 PolarHBondContact O-N 3.28Å
645	P	32.8	Very low	35.9	Very low	111 Å²	111	126.1 Å²	126.1	72%	0.721	71%	0.708	S	S	*	*			trans	-87.7	96.9	-179.8	33	-28.3	0	0	0	109.5
646	E	26.9	Very low	33.5	Very low	184 Å²	184	128.9 Å²	128.9	86%	0.86	73%	0.726	S	S	*	*			trans	-129.4	114.6	161.3	-73.7	-166.9	168	0	0	111.2	S644	S644-E646 PolarHBondContact O-N 3.28Å
647	S	25.5	Very low	31.7	Very low	112 Å²	112	127.7 Å²	127.7	78%	0.783	73%	0.728	S	S	*	*			trans	66.6	83.9	168.3	63.2	0	0	0	0	118.4	Q649	S647-Q649 PolarHBondContact O-N 2.88Å
648	F	23.3	Very low	29.9	Very low	201 Å²	201	130.2 Å²	130.2	88%	0.882	75%	0.745	S	S	*	*			trans	-64	108	151.2	-79.9	-90.5	0	0	0	109.7
649	Q	24	Very low	28.2	Very low	182 Å²	182	135.4 Å²	135.4	85%	0.85	77%	0.769	S	S	*	*			trans	-110.5	115.9	148.5	-80.1	-175.3	-5.4	0	0	107.6	S647	S647-Q649 PolarHBondContact O-N 2.88Å
650	T	20.6	Very low	27	Very low	121 Å²	121	136.2 Å²	136.2	74%	0.742	77%	0.773	S	S	*	*			trans	-52	129.8	172.4	48.3	0	0	0	0	110.9	Q652	T650-Q652 PolarHBondContact O-N 2.94Å
651	P	24.7	Very low	26	Very low	130 Å²	130	142.4 Å²	142.4	84%	0.844	78%	0.775	S	S	*	*			trans	-72.9	112.1	166	6.9	6.3	0	0	0	108.3	R653	P651-R653 PolarHBondContact O-N 3.48Å
652	Q	22.5	Very low	25.3	Very low	167 Å²	167	146.9 Å²	146.9	78%	0.78	78%	0.782	S	S	*	*			trans	-55.5	130.3	163.6	-77	178.8	-22	0	0	109	T650 N654	T650-Q652 PolarHBondContact O-N 2.94Å; Q652-N654 PolarHBondContact O-N 3.23Å
653	R	22.6	Very low	24.9	Very low	239 Å²	239	147.4 Å²	147.4	90%	0.902	80%	0.797	S	S	*	*			trans	-51.5	97.7	163.4	-87.1	175.1	163	171.5	-5.7	109.1	P651 V655	P651-R653 PolarHBondContact O-N 3.48Å; R653-V655 PolarHBondContact O-N 3.02Å
654	N	23.6	Very low	24.2	Very low	143 Å²	143	147.3 Å²	147.3	77%	0.765	80%	0.796	S	S	*	*			trans	-80.6	95.4	164.2	-86.7	-13.4	0	0	0	108.5	Q652 C656	Q652-N654 PolarHBondContact O-N 3.23Å; N654-C656 PolarHBondContact O-N 3.42Å; N654-C656 VanDerWaalsContact O-N 3.11Å
655	V	23.7	Very low	24	Very low	109 Å²	109	146.5 Å²	146.5	66%	0.661	80%	0.802	S	S	*	*			trans	-60.9	101.5	160.1	177.2	0	0	0	0	107.2	R653 N657	R653-V655 PolarHBondContact O-N 3.02Å; V655-N657 VanDerWaalsContact C-N 3.31Å; V655-N657 PolarHBondContact O-N 3.06Å; V655-N657 VanDerWaalsContact O-N 3.11Å
656	C	24.5	Very low	23.5	Very low	124 Å²	124	148.4 Å²	148.4	84%	0.838	81%	0.805	S	S	*	*			trans	-79.5	86.4	165.3	-80.5	0	0	0	0	108.5	N654	N654-C656 PolarHBondContact O-N 3.42Å; N654-C656 VanDerWaalsContact O-N 3.11Å
657	N	23.7	Very low	23.3	Very low	141 Å²	141	146.8 Å²	146.8	75%	0.754	80%	0.798	S	S	*	*			trans	-70.9	124.2	158.8	-87.3	-8.5	0	0	0	108.8	V655	V655-N657 VanDerWaalsContact C-N 3.31Å; V655-N657 PolarHBondContact O-N 3.06Å; V655-N657 VanDerWaalsContact O-N 3.11Å
658	S	22.9	Very low	23.2	Very low	103 Å²	103	149.4 Å²	149.4	72%	0.72	80%	0.795	S	S	*	*			trans	-54	136.8	156.6	54.2	0	0	0	0	110.4
659	E	23.4	Very low	23.1	Very low	195 Å²	195	147.1 Å²	147.1	91%	0.911	79%	0.792	S	S	*	*			trans	-167	138.1	132.3	-106.7	168.9	-151.5	0	0	112.2
660	I	25.8	Very low	23.1	Very low	147 Å²	147	142 Å²	142	75%	0.754	79%	0.787	S	S	*	*			trans	-95.3	133.9	-174.6	-59.5	168.4	0	0	0	107.4
661	Y	24.5	Very low	23.1	Very low	202 Å²	202	141.2 Å²	141.2	79%	0.792	79%	0.787	S	S	*	*			trans	139.4	129.7	138	-92.1	-76.9	0	0	0	115.6
662	R	24.2	Very low	23.1	Very low	232 Å²	232	143 Å²	143	88%	0.875	79%	0.789	S	S	*	*			trans	95	106.1	137.2	-138.9	-178.1	-67.7	-131.6	3.3	118.9
663	G	21.7	Very low	23.1	Very low	74 Å²	74	138.5 Å²	138.5	76%	0.763	79%	0.787	S	S	*	*				104.3	101.9	113.8	0	0	0	0	0	119
664	G	21.4	Very low	23.1	Very low	86 Å²	86	136.9 Å²	136.9	89%	0.887	79%	0.79	S	S	*	*				79.2	129.1	125.4	0	0	0	0	0	120.7
665	G	21.2	Very low	23	Very low	73 Å²	73	133.6 Å²	133.6	75%	0.753	79%	0.79	S	S	*	*			trans	115.9	98.4	136.4	0	0	0	0	0	118.6
666	L	23.1	Very low	22.9	Very low	151 Å²	151	136.6 Å²	136.6	79%	0.791	80%	0.801	S	S	*	*			trans	33.2	132.5	139.1	-77.4	102.2	0	0	0	123.4
667	E	22.4	Very low	22.8	Very low	151 Å²	151	137.2 Å²	137.2	71%	0.706	80%	0.802	S	S	*	*				94	106.3	129.1	-78.7	-177.8	178.7	0	0	122.3
668	K	23.4	Very low	22.8	Very low	166 Å²	166	139.4 Å²	139.4	72%	0.722	81%	0.809	S	S	*	*				75	130.2	116.6	-84.3	-175.2	176.9	176.5	0	122.7
669	D	21.7	Very low	22.8	Very low	154 Å²	154	144.1 Å²	144.1	82%	0.824	82%	0.817	S	S	*	*			trans	81.9	129.5	140.3	-70.1	-14.6	0	0	0	120.4
670	G	23.1	Very low	22.8	Very low	73 Å²	73	144.7 Å²	144.7	75%	0.753	82%	0.816	S	S	*	*			trans	143.6	54.5	147.8	0	0	0	0	0	118.9
671	S	20.7	Very low	22.7	Very low	106 Å²	106	146.6 Å²	146.6	74%	0.741	82%	0.822	S	S	*	*			trans	8.7	126.7	143	174.7	0	0	0	0	119.2
672	L	24.4	Very low	22.6	Very low	168 Å²	168	142 Å²	142	88%	0.88	82%	0.819	S	S	*	*				-179.5	123.9	107	-91.6	165.2	0	0	0	108.9
673	G	22.3	Very low	22.6	Very low	72 Å²	72	134.4 Å²	134.4	74%	0.742	81%	0.814	S	S	*	*			trans	-89.3	166.2	-178.5	0	0	0	0	0	113.7
674	E	24.2	Very low	22.6	Very low	204 Å²	204	138.9 Å²	138.9	95%	0.953	82%	0.817	S	S	*	*			trans	-158.8	129.5	136.6	-110.8	171	-170.4	0	0	108.2
675	G	20.8	Very low	22.8	Very low	75 Å²	75	143.2 Å²	143.2	77%	0.773	81%	0.814	S	S	*	*			trans	-82.4	152	-162.3	0	0	0	0	0	114.7
676	L	22.1	Very low	22.9	Very low	172 Å²	172	147.3 Å²	147.3	90%	0.901	82%	0.817	S	S	*	*			trans	-110.3	120.2	158.2	-81.6	163.6	0	0	0	108.8	M678	L676-M678 PolarHBondContact O-N 2.93Å
677	T	21.9	Very low	22.9	Very low	137 Å²	137	145.6 Å²	145.6	84%	0.84	81%	0.813	S	S	*	*			trans	-70.7	102.7	-178.3	40.3	0	0	0	0	110.7	K679	T677-K679 PolarHBondContact O-N 3.17Å
678	M	23.1	Very low	23.1	Very low	186 Å²	186	143.3 Å²	143.3	92%	0.916	81%	0.805	S	S	*	*			trans	-72.2	115.2	163.9	-84.9	-99	162.8	0	0	109.2	L676 K680	L676-M678 PolarHBondContact O-N 2.93Å; M678-K680 PolarHBondContact O-N 2.75Å; M678-K680 VanDerWaalsContact O-N 3.08Å
679	K	23.1	Very low	23.4	Very low	202 Å²	202	141.3 Å²	141.3	88%	0.878	81%	0.809	S	S	*	*			trans	-58	109	172	-94.6	175.7	173.8	172.9	0	109.6	T677 Q681	T677-K679 PolarHBondContact O-N 3.17Å; K679-Q681 PolarHBondContact O-N 3.46Å
680	K	23.5	Very low	23.9	Very low	207 Å²	207	140.8 Å²	140.8	90%	0.9	81%	0.807	S	S	*	*			trans	-59	107.1	165.1	-163.7	174.9	-172	177.1	0	108.9	M678	M678-K680 PolarHBondContact O-N 2.75Å; M678-K680 VanDerWaalsContact O-N 3.08Å
681	Q	23.6	Very low	24.2	Very low	187 Å²	187	141.1 Å²	141.1	87%	0.874	80%	0.802	S	S	*	*			trans	-86.2	138.7	162.1	-84	-175.2	-8.5	0	0	109.6	K679 G683	K679-Q681 PolarHBondContact O-N 3.46Å; Q681-G683 PolarHBondContact O-N 2.99Å
682	S	22.9	Very low	24.8	Very low	105 Å²	105	144.2 Å²	144.2	73%	0.734	81%	0.805	S	S	*	*			trans	-53.6	114.5	-162.4	177.3	0	0	0	0	114.7
683	G	23.1	Very low	25	Very low	74 Å²	74	143.9 Å²	143.9	76%	0.763	80%	0.804	S	S	*	*			trans	-75.5	126.5	161.3	0	0	0	0	0	110.9	Q681	Q681-G683 PolarHBondContact O-N 2.99Å
684	M	22.5	Very low	25.6	Very low	167 Å²	167	144.5 Å²	144.5	82%	0.823	80%	0.802	S	S	*	*			trans	-103.2	106.6	159	-79.2	178.7	62.6	0	0	107.5	L686	M684-L686 PolarHBondContact O-N 3.34Å
685	H	25.4	Very low	25.9	Very low	178 Å²	178	142.1 Å²	142.1	82%	0.824	80%	0.796	S	S	*	*			trans	-68.3	116	172.9	-143.5	-57.8	0	0	0	108.1
686	L	23.8	Very low	26.3	Very low	158 Å²	158	144.4 Å²	144.4	83%	0.827	80%	0.8	S	S	*	*			trans	-99.4	109.3	160.6	-95.5	142.1	0	0	0	107	M684 L688	M684-L686 PolarHBondContact O-N 3.34Å; L686-L688 PolarHBondContact O-N 2.9Å
687	T	23.7	Very low	27	Very low	115 Å²	115	140.2 Å²	140.2	71%	0.706	80%	0.799	S	S	*	*			trans	-55.1	118.6	171.8	41	0	0	0	0	110.5
688	L	26.9	Very low	27.4	Very low	103 Å²	103	138.4 Å²	138.4	54%	0.539	79%	0.791	S	S	.	*			trans	-52.5	144.5	154.7	-71.3	161.8	0	0	0	108.4	L686 D690	L686-L688 PolarHBondContact O-N 2.9Å; L688-D690 PolarHBondContact O-N 3.42Å
689	P	29	Very low	28	Very low	124 Å²	124	140.5 Å²	140.5	81%	0.805	79%	0.789	S	S	*	*			trans	-64.6	103.5	168.7	-16	29.4	0	0	0	109	A691	P689-A691 PolarHBondContact O-N 2.96Å
690	D	32.1	Very low	28.5	Very low	144 Å²	144	142.5 Å²	142.5	77%	0.77	79%	0.791	S	S	*	*			trans	-57	104.9	164.4	-81.2	-32.4	0	0	0	108.8	L688	L688-D690 PolarHBondContact O-N 3.42Å
691	A	29.5	Very low	29.2	Very low	80 Å²	80	137 Å²	137	66%	0.661	78%	0.784	S	S	*	*			trans	-123.7	71.7	158.5	0	0	0	0	0	107.4	P689 D693	P689-A691 PolarHBondContact O-N 2.96Å; A691-D693 PolarHBondContact O-N 3.03Å
692	H	33.5	Very low	30	Very low	170 Å²	170	131.4 Å²	131.4	79%	0.787	77%	0.765	S	S	*	*			trans	-65.7	89.8	154.8	-84.6	-60.5	0	0	0	108.1	A694	H692-A694 VanDerWaalsContact C-N 3.31Å; H692-A694 PolarHBondContact O-N 3.13Å
693	D	27.4	Very low	31.7	Very low	161 Å²	161	127.2 Å²	127.2	86%	0.861	74%	0.736	S	S	*	*			trans	-82.3	92.2	148.2	-93	-24.9	0	0	0	107	A691 D695	A691-D693 PolarHBondContact O-N 3.03Å; D693-D695 VanDerWaalsContact C-N 3.25Å; D693-D695 PolarHBondContact O-N 3.43Å
694	A	35.2	Very low	33.3	Very low	85 Å²	85	129.2 Å²	129.2	70%	0.702	73%	0.728	S	S	*	*			trans	-70.6	85.3	163.4	0	0	0	0	0	108.1	H692	H692-A694 VanDerWaalsContact C-N 3.31Å; H692-A694 PolarHBondContact O-N 3.13Å
695	D	30.3	Very low	34.6	Very low	155 Å²	155	122 Å²	122	83%	0.829	70%	0.696	S	S	*	*			trans	179	82.2	146.6	-92.9	-18.3	0	0	0	110.7	D693	D693-D695 VanDerWaalsContact C-N 3.25Å; D693-D695 PolarHBondContact O-N 3.43Å
696	S	30.3	Very low	36.1	Very low	122 Å²	122	113.7 Å²	113.7	85%	0.853	66%	0.658	S	S	*	*			trans	-161.5	75.1	150	-84.5	0	0	0	0	108.5	S698	S696-S698 PolarHBondContact O-N 3.46Å; S696-S698 VanDerWaalsContact O-N 3.08Å
697	G	36.6	Very low	37.8	Very low	85 Å²	85	108.7 Å²	108.7	88%	0.876	64%	0.636	S	S	*	*			trans	-63.7	106.2	162.8	0	0	0	0	0	108.9
698	S	30.8	Very low	39.3	Very low	98 Å²	98	110.4 Å²	110.4	69%	0.685	63%	0.629	S	S	*	*			trans	155	113.7	143	-167.8	0	0	0	0	111.6	S696	S696-S698 PolarHBondContact O-N 3.46Å; S696-S698 VanDerWaalsContact O-N 3.08Å
699	R	35.7	Very low	40.9	Very low	231 Å²	231	105.5 Å²	105.5	87%	0.872	60%	0.604	S	S	*	*	S	Bend	trans	117	107.9	149	-66.2	169.1	-179.1	-168.4	-1.5	116.8
700	R	33.1	Very low	42.4	Very low	244 Å²	244	103.1 Å²	103.1	92%	0.921	58%	0.582	S	S	*	*			trans	72.9	113.2	169.6	-63.2	-175.1	-173	175	2.5	115.2	S702	R700-S702 PolarHBondContact O-N 3.36Å
701	A	36.8	Very low	43.8	Very low	92 Å²	92	102.3 Å²	102.3	76%	0.76	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-46.6	132.5	159.7	0	0	0	0	0	108.6	S703	A701-S703 PolarHBondContact O-N 2.93Å; A701-S703 VanDerWaalsContact O-N 3.15Å
702	S	42.2	Very low	45	Very low	68 Å²	68	99.1 Å²	99.1	48%	0.476	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-46.1	124.8	161.1	44.1	0	0	0	0	107.4	R700 I704	R700-S702 PolarHBondContact O-N 3.36Å; S702-I704 PolarHBondContact O-N 3.17Å
703	S	56.9	Low	46.2	Very low	18 Å²	18	91.2 Å²	91.2	13%	0.126	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-49.3	132.7	-173.8	-179.7	0	0	0	0	110	E617 A701 A705 A706 S707	E617-S703 VanDerWaalsContact CD-OG 3.27Å; E617-S703 WeakPolarHBondContact OE1-CB 3.49Å; E617-S703 PolarHBondContact OE1-OG 3.47Å; A701-S703 PolarHBondContact O-N 2.93Å; A701-S703 VanDerWaalsContact O-N 3.15Å; S703-A705 PolarHBondContact O-N 3.2Å; S703-A706 WeakPolarHBondContact O-CA 3.45Å; S703-A706 WeakPolarHBondContact O-CB 3.35Å; S703-A706 PolarHBondContact O-N 3.18Å; S703-S707 PolarHBondContact O-N 3.31Å
704	I	57.7	Low	47.6	Very low	115 Å²	115	86.4 Å²	86.4	59%	0.59	49%	0.489	S	S	*	.	H	α-helix	trans	-53.7	-31.4	179.1	-66.5	167.6	0	0	0	110.5	S702 R708	S702-I704 PolarHBondContact O-N 3.17Å; I704-R708 HydrophobicContact CG2-CG 4.31Å; I704-R708 VanDerWaalsContact O-CB 3.28Å; I704-R708 WeakPolarHBondContact O-CB 3.3Å; I704-R708 WeakPolarHBondContact O-CG 3.5Å; I704-R708 PolarHBondContact O-N 3.28Å
705	A	48.8	Very low	48.8	Very low	17 Å²	17	89.4 Å²	89.4	14%	0.14	49%	0.489	C	S	.	.	H	α-helix	trans	-67.4	-41.6	174.3	0	0	0	0	0	112.7	V621 R624 S703 L709	V621-A705 HydrophobicContact CG2-CB 4.19Å; R624-A705 PolarHBondContact NH2-O 3.13Å; S703-A705 PolarHBondContact O-N 3.2Å; A705-L709 VanDerWaalsContact O-CB 3.32Å; A705-L709 WeakPolarHBondContact O-CB 3.05Å; A705-L709 PolarHBondContact O-N 3.08Å
706	A	57.3	Low	49.9	Very low	3 Å²	3	82.9 Å²	82.9	3%	0.025	45%	0.454	C	S	.	.	H	α-helix	trans	-65.4	-50.4	175.6	0	0	0	0	0	111.6	S703 R708 L709 E710 F745	S703-A706 WeakPolarHBondContact O-CA 3.45Å; S703-A706 WeakPolarHBondContact O-CB 3.35Å; S703-A706 PolarHBondContact O-N 3.18Å; A706-R708 PolarHBondContact O-N 3.46Å; A706-L709 PolarHBondContact O-N 3.16Å; A706-L709 VanDerWaalsContact O-N 3.07Å; A706-E710 PolarHBondContact O-N 2.85Å; A706-F745 HydrophobicContact CB-CE1 3.71Å; A706-F745 HydrophobicContact CB-CZ 4.42Å
707	S	59.2	Low	51.1	Low	53 Å²	53	80.1 Å²	80.1	37%	0.371	43%	0.432	S	S	.	.	H	α-helix	trans	-64.4	-39	-180	170.8	0	0	0	0	112.9	S703 L709 E710 E711	S703-S707 PolarHBondContact O-N 3.31Å; S707-L709 VanDerWaalsContact C-N 3.3Å; S707-L709 PolarHBondContact O-N 2.87Å; S707-E710 WeakPolarHBondContact O-CB 3.24Å; S707-E710 PolarHBondContact O-N 3.18Å; S707-E711 PolarHBondContact O-N 3.09Å
708	R	56.3	Low	51.9	Low	150 Å²	150	80.9 Å²	80.9	57%	0.566	41%	0.414	S	S	*	.	H	α-helix	trans	-69.2	-32.6	174.1	-71.4	175.3	176.8	178.6	0.1	111.3	R624 I704 A706 E710 E711 A712	R624-R708 VanDerWaalsContact NH1-CB 3.32Å; R624-R708 PolarHBondContact NH1-O 2.87Å; R624-R708 VanDerWaalsContact NH2-C 3.25Å; I704-R708 HydrophobicContact CG2-CG 4.31Å; I704-R708 VanDerWaalsContact O-CB 3.28Å; I704-R708 WeakPolarHBondContact O-CB 3.3Å; I704-R708 WeakPolarHBondContact O-CG 3.5Å; I704-R708 PolarHBondContact O-N 3.28Å; A706-R708 PolarHBondContact O-N 3.46Å; R708-E710 VanDerWaalsContact C-N 3.33Å; R708-E711 PolarHBondContact O-N 2.97Å; R708-A712 PolarHBondContact O-N 2.6Å
709	L	60.7	Low	52.7	Low	0 Å²	0	79.9 Å²	79.9	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-69.9	-42.1	-178.9	177.8	60.9	0	0	0	107.6	L620 R624 L627 A705 A706 S707 E711 A712 M713 F745	L620-L709 HydrophobicContact CB-CD2 4.31Å; L620-L709 HydrophobicContact CD2-CD2 3.77Å; R624-L709 HydrophobicContact CB-CD1 3.87Å; R624-L709 HydrophobicContact CG-CD1 4.21Å; R624-L709 VanDerWaalsContact NH2-CA 3.34Å; L627-L709 HydrophobicContact CD1-CD1 4.03Å; A705-L709 VanDerWaalsContact O-CB 3.32Å; A705-L709 WeakPolarHBondContact O-CB 3.05Å; A705-L709 PolarHBondContact O-N 3.08Å; A706-L709 PolarHBondContact O-N 3.16Å; A706-L709 VanDerWaalsContact O-N 3.07Å; S707-L709 VanDerWaalsContact C-N 3.3Å; S707-L709 PolarHBondContact O-N 2.87Å; L709-E711 VanDerWaalsContact C-N 3.28Å; L709-E711 PolarHBondContact O-N 3.15Å; L709-A712 CarbonylContact O-C 3.6Å; L709-A712 PolarHBondContact O-N 3.17Å; L709-M713 HydrophobicContact CD1-CG 4.07Å; L709-M713 HydrophobicContact CD1-SD 4.36Å; L709-M713 HydrophobicContact CD2-SD 4.2Å; L709-M713 HydrophobicContact CG-CE 4.21Å; L709-M713 HydrophobicContact CG-CG 3.98Å; L709-M713 HydrophobicContact CG-SD 3.75Å; L709-M713 WeakPolarHBondContact O-CB 3.42Å; L709-M713 WeakPolarHBondContact O-CG 3.5Å; L709-M713 PolarHBondContact O-N 3.23Å; L709-F745 HydrophobicContact CD2-CE2 3.95Å; L709-F745 HydrophobicContact CD2-CZ 3.83Å
710	E	59.8	Low	53.1	Low	75 Å²	75	73.9 Å²	73.9	35%	0.35	40%	0.399	S	S	.	.	H	α-helix	trans	-49.9	-44.1	169.7	-175.9	-171.1	-175.2	0	0	113.5	A706 S707 R708 M713 S714	A706-E710 PolarHBondContact O-N 2.85Å; S707-E710 WeakPolarHBondContact O-CB 3.24Å; S707-E710 PolarHBondContact O-N 3.18Å; R708-E710 VanDerWaalsContact C-N 3.33Å; E710-M713 HydrophobicContact CB-CE 4.06Å; E710-M713 PolarHBondContact O-N 3.37Å; E710-S714 WeakPolarHBondContact O-CB 3.5Å; E710-S714 PolarHBondContact O-N 3.21Å; E710-S714 PolarHBondContact O-OG 3.19Å
711	E	61.3	Low	53.6	Low	126 Å²	126	66.9 Å²	66.9	59%	0.589	39%	0.387	S	S	*	.	H	α-helix	trans	-61.2	-48.2	174.9	-168	176.1	-163	0	0	111.8	S707 R708 L709 M713 S714 E715	S707-E711 PolarHBondContact O-N 3.09Å; R708-E711 PolarHBondContact O-N 2.97Å; L709-E711 VanDerWaalsContact C-N 3.28Å; L709-E711 PolarHBondContact O-N 3.15Å; E711-M713 VanDerWaalsContact C-N 3.31Å; E711-M713 PolarHBondContact O-N 3.41Å; E711-S714 PolarHBondContact O-N 2.98Å; E711-E715 PolarHBondContact O-N 2.7Å
712	A	54.8	Low	54.2	Low	14 Å²	14	64.8 Å²	64.8	12%	0.116	37%	0.365	C	S	.	.	H	α-helix	trans	-65.7	-32.3	176.1	0	0	0	0	0	112.9	R708 L709 L716	R708-A712 PolarHBondContact O-N 2.6Å; L709-A712 CarbonylContact O-C 3.6Å; L709-A712 PolarHBondContact O-N 3.17Å; A712-L716 WeakPolarHBondContact O-CB 3.49Å; A712-L716 WeakPolarHBondContact O-CD1 3.3Å; A712-L716 WeakPolarHBondContact O-CG 3.3Å; A712-L716 PolarHBondContact O-N 3.06Å
713	M	58.7	Low	54.6	Low	4 Å²	4	63.4 Å²	63.4	2%	0.02	35%	0.352	C	S	.	.	H	α-helix	trans	-70.8	-35.9	177.2	-69.4	-175.5	-47.3	0	0	111.4	L709 E710 E711 L716 T717 W738 F745 F756 C757	L709-M713 HydrophobicContact CD1-CG 4.07Å; L709-M713 HydrophobicContact CD1-SD 4.36Å; L709-M713 HydrophobicContact CD2-SD 4.2Å; L709-M713 HydrophobicContact CG-CE 4.21Å; L709-M713 HydrophobicContact CG-CG 3.98Å; L709-M713 HydrophobicContact CG-SD 3.75Å; L709-M713 WeakPolarHBondContact O-CB 3.42Å; L709-M713 WeakPolarHBondContact O-CG 3.5Å; L709-M713 PolarHBondContact O-N 3.23Å; E710-M713 HydrophobicContact CB-CE 4.06Å; E710-M713 PolarHBondContact O-N 3.37Å; E711-M713 VanDerWaalsContact C-N 3.31Å; E711-M713 PolarHBondContact O-N 3.41Å; M713-L716 WeakPolarHBondContact O-CB 3.33Å; M713-L716 PolarHBondContact O-N 2.84Å; M713-T717 PolarHBondContact O-N 3.4Å; M713-W738 HydrophobicContact CB-CH2 3.74Å; M713-W738 HydrophobicContact CB-CZ3 4.08Å; M713-W738 HydrophobicContact CG-CH2 3.47Å; M713-W738 VanDerWaalsContact CG-CH2 3.47Å; M713-W738 HydrophobicContact CG-CZ3 3.46Å; M713-W738 VanDerWaalsContact CG-CZ3 3.46Å; M713-W738 HydrophobicContact SD-CE3 4.38Å; M713-W738 HydrophobicContact SD-CH2 4.09Å; M713-W738 HydrophobicContact SD-CZ3 3.41Å; M713-W738 WeakPolarHBondContact SD-CZ3 3.05Å; M713-F745 HydrophobicContact CE-CE2 4.17Å; M713-F745 HydrophobicContact CE-CZ 4.35Å; M713-F745 HydrophobicContact SD-CE2 4.38Å; M713-F756 HydrophobicContact CB-CE1 4.01Å; M713-F756 HydrophobicContact CE-CD1 4.44Å; M713-C757 VanDerWaalsContact SD-SG 3.69Å
714	S	58.1	Low	54.3	Low	59 Å²	59	71.8 Å²	71.8	41%	0.413	39%	0.386	S	S	.	.	H	α-helix	trans	-72.3	-29.3	177.5	-57.7	0	0	0	0	112.8	E710 E711 L716 T717	E710-S714 WeakPolarHBondContact O-CB 3.5Å; E710-S714 PolarHBondContact O-N 3.21Å; E710-S714 PolarHBondContact O-OG 3.19Å; E711-S714 PolarHBondContact O-N 2.98Å; S714-L716 PolarHBondContact O-N 3.28Å; S714-T717 PolarHBondContact O-OG1 3.32Å; S714-T717 VanDerWaalsContact O-OG1 3.13Å
715	E	58.7	Low	53.9	Low	148 Å²	148	73 Å²	73	69%	0.692	39%	0.39	S	S	*	.	S	Bend	trans	-72.8	-19.1	171.2	-69.1	179.6	166.7	0	0	112.7	E711	E711-E715 PolarHBondContact O-N 2.7Å
716	L	55.1	Low	54.3	Low	18 Å²	18	74.1 Å²	74.1	9%	0.094	40%	0.402	C	S	.	.			trans	-96.5	-9.3	-172	-91.3	168.8	0	0	0	115.1	L627 Q631 A712 M713 S714 M718	L627-L716 HydrophobicContact CB-CD1 3.93Å; L627-L716 HydrophobicContact CD1-CD1 3.99Å; L627-L716 HydrophobicContact CD2-CD1 4.27Å; L627-L716 HydrophobicContact CG-CD1 4.29Å; Q631-L716 HydrophobicContact CG-CD2 3.5Å; Q631-L716 VanDerWaalsContact CG-CD2 3.5Å; Q631-L716 HydrophobicContact CG-CG 4.44Å; A712-L716 WeakPolarHBondContact O-CB 3.49Å; A712-L716 WeakPolarHBondContact O-CD1 3.3Å; A712-L716 WeakPolarHBondContact O-CG 3.3Å; A712-L716 PolarHBondContact O-N 3.06Å; M713-L716 WeakPolarHBondContact O-CB 3.33Å; M713-L716 PolarHBondContact O-N 2.84Å; S714-L716 PolarHBondContact O-N 3.28Å; L716-M718 VanDerWaalsContact C-N 3.35Å; L716-M718 PolarHBondContact O-N 2.95Å
717	T	54.9	Low	55.1	Low	65 Å²	65	76.9 Å²	76.9	40%	0.399	42%	0.42	S	S	.	.			trans	-66.7	93	178.4	42.5	0	0	0	0	110.3	M713 S714 F756	M713-T717 PolarHBondContact O-N 3.4Å; S714-T717 PolarHBondContact O-OG1 3.32Å; S714-T717 VanDerWaalsContact O-OG1 3.13Å; T717-F756 HydrophobicContact CG2-CE2 4.45Å; T717-F756 HydrophobicContact CG2-CZ 3.78Å
718	M	53.3	Low	56.1	Low	101 Å²	101	79.4 Å²	79.4	50%	0.498	43%	0.427	S	S	.	.			trans	-84.4	141.8	178.1	-65.7	-58.8	-72.6	0	0	110.4	L716 S720 V722	L716-M718 VanDerWaalsContact C-N 3.35Å; L716-M718 PolarHBondContact O-N 2.95Å; M718-S720 PolarHBondContact O-N 3.06Å; M718-V722 HydrophobicContact CE-CG1 4.46Å
719	P	46.8	Very low	57.2	Low	76 Å²	76	79.7 Å²	79.7	49%	0.494	44%	0.435	S	S	.	.			trans	-62	139.5	175.1	21.4	-28.9	0	0	0	111.3	S721 V722	P719-S721 PolarHBondContact O-N 3.38Å; P719-V722 HydrophobicContact CG-CG2 4.21Å; P719-V722 PolarHBondContact O-N 3.28Å
720	S	45.1	Very low	58.4	Low	106 Å²	106	81 Å²	81	74%	0.741	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-15.3	-174.8	60.4	0	0	0	0	115.5	M718	M718-S720 PolarHBondContact O-N 3.06Å
721	S	42.9	Very low	59.7	Low	96 Å²	96	78 Å²	78	67%	0.671	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-19.9	178.2	53.3	0	0	0	0	114.4	P719	P719-S721 PolarHBondContact O-N 3.38Å
722	V	49.1	Very low	61	Low	48 Å²	48	74.2 Å²	74.2	29%	0.291	41%	0.413	S	S	.	.	S	Bend	trans	-89.6	-15.7	-176.6	-179.4	0	0	0	0	112.8	M718 P719 K724	M718-V722 HydrophobicContact CE-CG1 4.46Å; P719-V722 HydrophobicContact CG-CG2 4.21Å; P719-V722 PolarHBondContact O-N 3.28Å; V722-K724 PolarHBondContact O-N 3.1Å
723	L	51.6	Low	62.8	Low	40 Å²	40	74.6 Å²	74.6	21%	0.209	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-10.5	-175.8	-94.5	91.3	0	0	0	116	W731 L764	L723-W731 HydrophobicContact CG-CH2 4.44Å; L723-W731 HydrophobicContact CG-CZ3 4.21Å; L723-L764 HydrophobicContact CD2-CB 4.3Å; L723-L764 HydrophobicContact CD2-CD2 3.51Å; L723-L764 HydrophobicContact CD2-CG 4.47Å; L723-L764 HydrophobicContact CG-CD2 4.1Å
724	K	49.6	Very low	64.3	Low	193 Å²	193	74.9 Å²	74.9	84%	0.839	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-0.7	-169.3	-68.2	-172.9	178.7	-178.3	0	114.9	V722	V722-K724 PolarHBondContact O-N 3.1Å
725	Q	49.2	Very low	65.9	Low	142 Å²	142	72.7 Å²	72.7	66%	0.664	40%	0.399	S	S	*	.	S	Bend	trans	-125.3	111.5	-178.9	-70.8	179.8	-20.5	0	0	110.2
726	G	58.7	Low	67.6	Low	40 Å²	40	69.8 Å²	69.8	41%	0.412	39%	0.385	S	S	.	.	S	Bend	trans	148	159.8	178.1	0	0	0	0	0	112.7	M728	G726-M728 PolarHBondContact O-N 3.39Å
727	P	72.7	Confident	69.4	Low	61 Å²	61	69 Å²	69	40%	0.396	38%	0.381	S	S	.	.			trans	-64.4	133.6	179.8	25.8	-32.7	0	0	0	111.1	Q729 L730	P727-Q729 PolarHBondContact O-N 2.93Å; P727-Q729 VanDerWaalsContact O-N 3.15Å; P727-L730 HydrophobicContact CG-CB 4.45Å; P727-L730 HydrophobicContact CG-CD1 3.6Å; P727-L730 HydrophobicContact CG-CG 3.92Å; P727-L730 PolarHBondContact O-N 3.26Å; P727-L730 VanDerWaalsContact O-N 3.15Å
728	M	80.1	Confident	71.2	Confident	106 Å²	106	66.1 Å²	66.1	52%	0.522	36%	0.363	S	S	.	.	H	α-helix	trans	-58.5	-34.2	-172.3	-175.8	82.4	-55.3	0	0	113.3	G726 L730 W731 T732 F765	G726-M728 PolarHBondContact O-N 3.39Å; M728-L730 VanDerWaalsContact C-N 3.31Å; M728-L730 PolarHBondContact O-N 3.49Å; M728-W731 HydrophobicContact CE-CB 3.81Å; M728-W731 HydrophobicContact CE-CG 4.05Å; M728-W731 PolarHBondContact O-N 3.44Å; M728-W731 VanDerWaalsContact O-N 3.15Å; M728-T732 HydrophobicContact CG-CG2 4.28Å; M728-T732 PolarHBondContact O-N 3.49Å; M728-T732 PolarHBondContact O-OG1 2.78Å; M728-F765 HydrophobicContact CE-CE1 3.79Å; M728-F765 HydrophobicContact CE-CZ 3.6Å; M728-F765 HydrophobicContact SD-CE1 3.83Å; M728-F765 HydrophobicContact SD-CZ 4.01Å
729	Q	81.2	Confident	73.2	Confident	155 Å²	155	61.9 Å²	61.9	72%	0.724	34%	0.342	S	S	*	.	H	α-helix	trans	-56.4	-42.6	179.3	-70.6	174.4	-16.1	0	0	112.5	P727 W731 T732 T733	P727-Q729 PolarHBondContact O-N 2.93Å; P727-Q729 VanDerWaalsContact O-N 3.15Å; Q729-W731 VanDerWaalsContact C-N 3.33Å; Q729-W731 PolarHBondContact O-N 2.84Å; Q729-T732 VanDerWaalsContact CA-OG1 3.3Å; Q729-T732 WeakPolarHBondContact CA-OG1 3.2Å; Q729-T732 PolarHBondContact O-N 3.23Å; Q729-T732 PolarHBondContact O-OG1 2.79Å; Q729-T733 PolarHBondContact O-N 3.38Å; Q729-T733 PolarHBondContact O-OG1 3.41Å
730	L	85.6	Confident	75.5	Confident	28 Å²	28	60.1 Å²	60.1	15%	0.147	33%	0.327	C	S	.	.	H	α-helix	trans	-61.7	-42.6	178.8	-73.6	179.5	0	0	0	111.3	W630 P727 M728 T733 L734	W630-L730 PolarHBondContact NE1-O 2.7Å; P727-L730 HydrophobicContact CG-CB 4.45Å; P727-L730 HydrophobicContact CG-CD1 3.6Å; P727-L730 HydrophobicContact CG-CG 3.92Å; P727-L730 PolarHBondContact O-N 3.26Å; P727-L730 VanDerWaalsContact O-N 3.15Å; M728-L730 VanDerWaalsContact C-N 3.31Å; M728-L730 PolarHBondContact O-N 3.49Å; L730-T733 PolarHBondContact O-N 3.09Å; L730-L734 PolarHBondContact O-N 3.37Å
731	W	86.5	Confident	77.7	Confident	11 Å²	11	55.2 Å²	55.2	4%	0.042	29%	0.293	C	S	.	.	H	α-helix	trans	-68.5	-39.7	178.9	-60.3	107.4	0	0	0	112	W630 Y634 L723 M728 Q729 T733 L734 E735 L764 F765	W630-W731 HydrophobicContact CH2-CE3 4.19Å; W630-W731 HydrophobicContact CH2-CH2 4Å; W630-W731 AromaticContact CH2-CZ3 3.64Å; W630-W731 HydrophobicContact CH2-CZ3 3.64Å; W630-W731 HydrophobicContact CZ2-CD2 4.32Å; W630-W731 AromaticContact CZ2-CE3 3.77Å; W630-W731 HydrophobicContact CZ2-CE3 3.77Å; W630-W731 HydrophobicContact CZ2-CH2 4.21Å; W630-W731 AromaticContact CZ2-CZ3 3.7Å; W630-W731 HydrophobicContact CZ2-CZ3 3.7Å; Y634-W731 HydrophobicContact CD2-CZ2 4.27Å; Y634-W731 AromaticContact CE2-CH2 3.81Å; Y634-W731 HydrophobicContact CE2-CH2 3.81Å; Y634-W731 AromaticContact CE2-CZ2 3.41Å; Y634-W731 HydrophobicContact CE2-CZ2 3.41Å; Y634-W731 VanDerWaalsContact CE2-CZ2 3.41Å; Y634-W731 AromaticContact CZ-CH2 3.93Å; Y634-W731 AromaticContact CZ-CZ2 3.85Å; L723-W731 HydrophobicContact CG-CH2 4.44Å; L723-W731 HydrophobicContact CG-CZ3 4.21Å; M728-W731 HydrophobicContact CE-CB 3.81Å; M728-W731 HydrophobicContact CE-CG 4.05Å; M728-W731 PolarHBondContact O-N 3.44Å; M728-W731 VanDerWaalsContact O-N 3.15Å; Q729-W731 VanDerWaalsContact C-N 3.33Å; Q729-W731 PolarHBondContact O-N 2.84Å; W731-T733 VanDerWaalsContact C-N 3.29Å; W731-T733 PolarHBondContact O-N 3.11Å; W731-L734 HydrophobicContact CE3-CD2 4.23Å; W731-L734 HydrophobicContact CZ3-CD2 4.3Å; W731-L734 PolarHBondContact O-N 3.1Å; W731-E735 PolarHBondContact O-N 3.47Å; W731-L764 HydrophobicContact CE3-CD2 4Å; W731-L764 HydrophobicContact CZ3-CD2 4.25Å; W731-F765 HydrophobicContact CB-CE2 4.07Å; W731-F765 HydrophobicContact CB-CZ 3.8Å
732	T	89.6	Confident	80.2	Confident	47 Å²	47	50.6 Å²	50.6	29%	0.288	26%	0.261	S	S	.	.	H	α-helix	trans	-63.9	-35.7	174.3	54.3	0	0	0	0	112	M728 Q729 E735 Q736 F765	M728-T732 HydrophobicContact CG-CG2 4.28Å; M728-T732 PolarHBondContact O-N 3.49Å; M728-T732 PolarHBondContact O-OG1 2.78Å; Q729-T732 VanDerWaalsContact CA-OG1 3.3Å; Q729-T732 WeakPolarHBondContact CA-OG1 3.2Å; Q729-T732 PolarHBondContact O-N 3.23Å; Q729-T732 PolarHBondContact O-OG1 2.79Å; T732-E735 WeakPolarHBondContact O-CB 3.23Å; T732-Q736 VanDerWaalsContact O-CG 3.3Å; T732-Q736 WeakPolarHBondContact O-CG 3.46Å; T732-Q736 PolarHBondContact O-N 3.21Å; T732-F765 HydrophobicContact CG2-CE2 4.12Å; T732-F765 HydrophobicContact CG2-CZ 3.96Å
733	T	91.1	Very high	82.3	Confident	22 Å²	22	49.9 Å²	49.9	14%	0.135	25%	0.254	C	S	.	.	H	α-helix	trans	-66.4	-42.6	172.8	-58.6	0	0	0	0	111.3	F600 F604 Q729 L730 W731 E735 Q736 I737	F600-T733 HydrophobicContact CB-CG2 3.8Å; F600-T733 HydrophobicContact CD1-CG2 3.59Å; F600-T733 HydrophobicContact CD2-CG2 3.72Å; F600-T733 HydrophobicContact CE1-CG2 4.01Å; F600-T733 HydrophobicContact CE2-CG2 4.13Å; F600-T733 HydrophobicContact CG-CG2 3.42Å; F600-T733 VanDerWaalsContact CG-CG2 3.42Å; F600-T733 HydrophobicContact CZ-CG2 4.26Å; F604-T733 HydrophobicContact CE2-CG2 4.32Å; F604-T733 HydrophobicContact CZ-CG2 4.43Å; Q729-T733 PolarHBondContact O-N 3.38Å; Q729-T733 PolarHBondContact O-OG1 3.41Å; L730-T733 PolarHBondContact O-N 3.09Å; W731-T733 VanDerWaalsContact C-N 3.29Å; W731-T733 PolarHBondContact O-N 3.11Å; T733-E735 PolarHBondContact O-N 3.21Å; T733-Q736 PolarHBondContact O-N 3.02Å; T733-I737 HydrophobicContact CG2-CD1 4.03Å; T733-I737 HydrophobicContact CG2-CG1 4.47Å; T733-I737 VanDerWaalsContact O-CG1 3.28Å; T733-I737 WeakPolarHBondContact O-CG1 3.25Å; T733-I737 PolarHBondContact O-N 3.49Å
734	L	90.9	Very high	84.3	Confident	10 Å²	10	48 Å²	48	5%	0.052	24%	0.244	C	C	.	.	H	α-helix	trans	-60.8	-45	176.4	-176.6	62.1	0	0	0	111.6	L627 W630 L730 W731 Q736 I737 W738 L764	L627-L734 HydrophobicContact CD2-CD1 3.48Å; L627-L734 VanDerWaalsContact CD2-CD1 3.48Å; W630-L734 HydrophobicContact CD2-CB 4.31Å; W630-L734 HydrophobicContact CD2-CD1 4.02Å; W630-L734 HydrophobicContact CD2-CD2 4.22Å; W630-L734 HydrophobicContact CD2-CG 4.41Å; W630-L734 HydrophobicContact CE3-CD1 4.2Å; W630-L734 HydrophobicContact CE3-CD2 4.26Å; W630-L734 HydrophobicContact CG-CB 4.49Å; W630-L734 HydrophobicContact CG-CD1 4.29Å; W630-L734 HydrophobicContact CH2-CD2 3.72Å; W630-L734 HydrophobicContact CZ2-CB 4.26Å; W630-L734 HydrophobicContact CZ2-CD2 3.63Å; W630-L734 HydrophobicContact CZ2-CG 4.44Å; W630-L734 HydrophobicContact CZ3-CD2 4.02Å; L730-L734 PolarHBondContact O-N 3.37Å; W731-L734 HydrophobicContact CE3-CD2 4.23Å; W731-L734 HydrophobicContact CZ3-CD2 4.3Å; W731-L734 PolarHBondContact O-N 3.1Å; L734-Q736 VanDerWaalsContact C-N 3.32Å; L734-Q736 PolarHBondContact O-N 2.96Å; L734-I737 PolarHBondContact O-N 3.46Å; L734-W738 PolarHBondContact O-N 2.95Å; L734-L764 HydrophobicContact CB-CD1 3.99Å; L734-L764 HydrophobicContact CD2-CD1 3.81Å; L734-L764 HydrophobicContact CD2-CD2 4.19Å; L734-L764 HydrophobicContact CG-CD1 3.77Å
735	E	92	Very high	86.3	Confident	13 Å²	13	38.8 Å²	38.8	6%	0.061	20%	0.204	C	C	.	.	H	α-helix	trans	-53.6	-50.9	172.5	-176.3	-157.3	169	0	0	110.7	W731 T732 T733 I737 W738 L739 A761 L764 F765 S768 V771	W731-E735 PolarHBondContact O-N 3.47Å; T732-E735 WeakPolarHBondContact O-CB 3.23Å; T733-E735 PolarHBondContact O-N 3.21Å; E735-I737 VanDerWaalsContact C-N 3.33Å; E735-I737 PolarHBondContact O-N 2.88Å; E735-W738 WeakPolarHBondContact O-CB 3.42Å; E735-W738 PolarHBondContact O-N 3.46Å; E735-L739 HydrophobicContact CG-CD1 4.13Å; E735-L739 HydrophobicContact CG-CG 4.49Å; E735-L739 VanDerWaalsContact O-CG 3.3Å; E735-L739 WeakPolarHBondContact O-CG 3.29Å; E735-L739 PolarHBondContact O-N 3.39Å; E735-A761 HydrophobicContact CG-CB 4.2Å; E735-L764 HydrophobicContact CB-CD1 4.09Å; E735-F765 HydrophobicContact CB-CD2 3.86Å; E735-F765 HydrophobicContact CB-CE2 4.08Å; E735-F765 HydrophobicContact CG-CD2 3.94Å; E735-F765 WeakPolarHBondContact OE2-CD2 3.31Å; E735-S768 WeakPolarHBondContact OE1-CB 3.5Å; E735-S768 PolarHBondContact OE1-OG 3.25Å; E735-V771 HydrophobicContact CG-CG2 4.22Å; E735-V771 WeakPolarHBondContact OE1-CG2 3.42Å
736	Q	93.4	Very high	88.3	Confident	87 Å²	87	32.6 Å²	32.6	41%	0.407	18%	0.175	S	C	.	.	H	α-helix	trans	-61	-39.9	179.2	-72.2	173.3	-4.1	0	0	112.4	F604 T732 T733 L734 W738 L739 Q740	F604-Q736 HydrophobicContact CE1-CB 3.94Å; F604-Q736 HydrophobicContact CE2-CB 4.23Å; F604-Q736 HydrophobicContact CZ-CB 3.44Å; F604-Q736 VanDerWaalsContact CZ-CB 3.44Å; T732-Q736 VanDerWaalsContact O-CG 3.3Å; T732-Q736 WeakPolarHBondContact O-CG 3.46Å; T732-Q736 PolarHBondContact O-N 3.21Å; T733-Q736 PolarHBondContact O-N 3.02Å; L734-Q736 VanDerWaalsContact C-N 3.32Å; L734-Q736 PolarHBondContact O-N 2.96Å; Q736-W738 PolarHBondContact O-N 3.2Å; Q736-L739 PolarHBondContact O-N 3.03Å; Q736-Q740 VanDerWaalsContact O-CG 3.31Å; Q736-Q740 WeakPolarHBondContact O-CG 3.28Å; Q736-Q740 PolarHBondContact O-N 3.09Å
737	I	93.4	Very high	89.8	Confident	1 Å²	1	35 Å²	35	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-60.4	-46.8	176	-66	162.1	0	0	0	110.7	F600 F604 M626 L627 T733 L734 E735 L739 Q740 A741	F600-I737 HydrophobicContact CD1-CD1 4.15Å; F600-I737 HydrophobicContact CE1-CD1 3.97Å; F604-I737 HydrophobicContact CE1-CG1 4.14Å; F604-I737 HydrophobicContact CZ-CG1 3.9Å; M626-I737 HydrophobicContact CB-CD1 3.76Å; M626-I737 HydrophobicContact CB-CG1 4.03Å; M626-I737 HydrophobicContact CB-CG2 4.3Å; M626-I737 HydrophobicContact CE-CD1 4.31Å; M626-I737 HydrophobicContact CE-CG1 3.72Å; M626-I737 HydrophobicContact SD-CG1 4.44Å; L627-I737 HydrophobicContact CD2-CB 4.3Å; L627-I737 HydrophobicContact CD2-CG2 3.57Å; L627-I737 HydrophobicContact CG-CG2 3.73Å; T733-I737 HydrophobicContact CG2-CD1 4.03Å; T733-I737 HydrophobicContact CG2-CG1 4.47Å; T733-I737 VanDerWaalsContact O-CG1 3.28Å; T733-I737 WeakPolarHBondContact O-CG1 3.25Å; T733-I737 PolarHBondContact O-N 3.49Å; L734-I737 PolarHBondContact O-N 3.46Å; E735-I737 VanDerWaalsContact C-N 3.33Å; E735-I737 PolarHBondContact O-N 2.88Å; I737-L739 PolarHBondContact O-N 3.07Å; I737-Q740 PolarHBondContact O-N 2.87Å; I737-A741 PolarHBondContact O-N 3.01Å
738	W	93.1	Very high	90.6	Very high	6 Å²	6	33.8 Å²	33.8	2%	0.023	17%	0.165	C	C	.	.	H	α-helix	trans	-60.6	-43.6	177.2	-75.6	122.7	0	0	0	112.5	L627 M713 L734 E735 Q736 A741 A742 F756 C757 E760 A761	L627-W738 HydrophobicContact CD1-CH2 4.48Å; L627-W738 HydrophobicContact CD2-CZ2 4.4Å; M713-W738 HydrophobicContact CB-CH2 3.74Å; M713-W738 HydrophobicContact CB-CZ3 4.08Å; M713-W738 HydrophobicContact CG-CH2 3.47Å; M713-W738 VanDerWaalsContact CG-CH2 3.47Å; M713-W738 HydrophobicContact CG-CZ3 3.46Å; M713-W738 VanDerWaalsContact CG-CZ3 3.46Å; M713-W738 HydrophobicContact SD-CE3 4.38Å; M713-W738 HydrophobicContact SD-CH2 4.09Å; M713-W738 HydrophobicContact SD-CZ3 3.41Å; M713-W738 WeakPolarHBondContact SD-CZ3 3.05Å; L734-W738 PolarHBondContact O-N 2.95Å; E735-W738 WeakPolarHBondContact O-CB 3.42Å; E735-W738 PolarHBondContact O-N 3.46Å; Q736-W738 PolarHBondContact O-N 3.2Å; W738-A741 PolarHBondContact O-N 3.5Å; W738-A742 WeakPolarHBondContact O-CB 3.32Å; W738-A742 PolarHBondContact O-N 3.45Å; W738-F756 HydrophobicContact CH2-CE1 4.41Å; W738-F756 HydrophobicContact CZ3-CE1 4.38Å; W738-C757 HydrophobicContact CE3-CB 4Å; W738-E760 HydrophobicContact CD2-CB 3.96Å; W738-E760 HydrophobicContact CE3-CB 4.29Å; W738-E760 HydrophobicContact CG-CB 4.3Å; W738-E760 HydrophobicContact CH2-CB 4.49Å; W738-E760 HydrophobicContact CH2-CG 4.26Å; W738-E760 HydrophobicContact CZ2-CB 4.23Å; W738-E760 HydrophobicContact CZ2-CG 4.32Å; W738-E760 HydrophobicContact CZ3-CB 4.48Å; W738-E760 HydrophobicContact CZ3-CG 4.41Å; W738-A761 HydrophobicContact CB-CB 3.87Å
739	L	94.5	Very high	91	Very high	11 Å²	11	36.4 Å²	36.4	6%	0.058	18%	0.176	C	C	.	.	H	α-helix	trans	-67.1	-37.3	178.6	-63.7	-179.7	0	0	0	112	E735 Q736 I737 A742 E743 A761 S770 V771 M774	E735-L739 HydrophobicContact CG-CD1 4.13Å; E735-L739 HydrophobicContact CG-CG 4.49Å; E735-L739 VanDerWaalsContact O-CG 3.3Å; E735-L739 WeakPolarHBondContact O-CG 3.29Å; E735-L739 PolarHBondContact O-N 3.39Å; Q736-L739 PolarHBondContact O-N 3.03Å; I737-L739 PolarHBondContact O-N 3.07Å; L739-A742 PolarHBondContact O-N 3.29Å; L739-E743 PolarHBondContact O-N 3.45Å; L739-A761 HydrophobicContact CD2-CB 3.68Å; L739-A761 HydrophobicContact CG-CB 4.05Å; L739-S770 VanDerWaalsContact CD1-CB 3.43Å; L739-V771 HydrophobicContact CD1-CG2 4.27Å; L739-V771 HydrophobicContact CD2-CG2 4.15Å; L739-M774 HydrophobicContact CB-CG 4.39Å; L739-M774 HydrophobicContact CD2-CB 3.99Å; L739-M774 HydrophobicContact CD2-CG 3.91Å; L739-M774 WeakPolarHBondContact O-CE 3.49Å
740	Q	94.5	Very high	91.4	Very high	40 Å²	40	31.4 Å²	31.4	19%	0.187	15%	0.152	C	C	.	.	H	α-helix	trans	-64.7	-42.9	173.2	-70.4	-54.9	-51.4	0	0	112	F604 K608 Q736 I737 A742 E743 L744	F604-Q740 HydrophobicContact CD1-CG 3.77Å; F604-Q740 HydrophobicContact CE1-CG 3.75Å; K608-Q740 VanDerWaalsContact NZ-OE1 3.13Å; Q736-Q740 VanDerWaalsContact O-CG 3.31Å; Q736-Q740 WeakPolarHBondContact O-CG 3.28Å; Q736-Q740 PolarHBondContact O-N 3.09Å; I737-Q740 PolarHBondContact O-N 2.87Å; Q740-A742 VanDerWaalsContact C-N 3.33Å; Q740-A742 PolarHBondContact O-N 3.5Å; Q740-E743 PolarHBondContact O-N 3.31Å; Q740-L744 WeakPolarHBondContact O-CG 3.26Å; Q740-L744 PolarHBondContact O-N 2.91Å
741	A	92.9	Very high	91.6	Very high	2 Å²	2	32.2 Å²	32.2	2%	0.017	16%	0.157	C	C	.	.	H	α-helix	trans	-62.1	-41.2	174.9	0	0	0	0	0	112	L620 C623 I737 W738 E743 L744 F745	L620-A741 HydrophobicContact CD2-CB 4.26Å; C623-A741 HydrophobicContact CB-CB 4.5Å; I737-A741 PolarHBondContact O-N 3.01Å; W738-A741 PolarHBondContact O-N 3.5Å; A741-E743 VanDerWaalsContact C-N 3.34Å; A741-E743 PolarHBondContact O-N 3.03Å; A741-L744 PolarHBondContact O-N 3Å; A741-F745 WeakPolarHBondContact O-CD2 3.27Å; A741-F745 PolarHBondContact O-N 3.5Å
742	A	93.8	Very high	91.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.5	-42	176.4	0	0	0	0	0	112.6	W738 L739 Q740 F745 M746 C757 I758 M774	W738-A742 WeakPolarHBondContact O-CB 3.32Å; W738-A742 PolarHBondContact O-N 3.45Å; L739-A742 PolarHBondContact O-N 3.29Å; Q740-A742 VanDerWaalsContact C-N 3.33Å; Q740-A742 PolarHBondContact O-N 3.5Å; A742-F745 PolarHBondContact O-N 2.93Å; A742-M746 WeakPolarHBondContact O-CG 3.37Å; A742-M746 PolarHBondContact O-N 3.22Å; A742-C757 HydrophobicContact CB-CB 3.78Å; A742-I758 HydrophobicContact CB-CD1 4.05Å; A742-I758 HydrophobicContact CB-CG1 3.57Å; A742-M774 HydrophobicContact CB-CE 4.17Å
743	E	93.8	Very high	91.6	Very high	33 Å²	33	40.1 Å²	40.1	15%	0.154	19%	0.188	C	C	.	.	H	α-helix	trans	-58.3	-48.8	175.7	-174.3	164.5	-149.8	0	0	111.7	K608 L739 Q740 A741 F745 M746 E747 M774 R777	K608-E743 IonicContact NZ-OE1 3.56Å; K608-E743 IonicContact NZ-OE2 3.79Å; K608-E743 PolarHBondContact NZ-OE2 3.06Å; L739-E743 PolarHBondContact O-N 3.45Å; Q740-E743 PolarHBondContact O-N 3.31Å; A741-E743 VanDerWaalsContact C-N 3.34Å; A741-E743 PolarHBondContact O-N 3.03Å; E743-F745 VanDerWaalsContact C-N 3.33Å; E743-F745 PolarHBondContact O-N 3.29Å; E743-M746 PolarHBondContact O-N 3.39Å; E743-E747 PolarHBondContact O-N 2.87Å; E743-M774 HydrophobicContact CB-CE 3.69Å; E743-M774 HydrophobicContact CG-CE 4.47Å; E743-R777 VanDerWaalsContact CD-NH1 3.34Å; E743-R777 IonicContact OE1-CZ 2.87Å; E743-R777 IonicContact OE1-NH1 2.67Å; E743-R777 PolarHBondContact OE1-NH1 3.21Å; E743-R777 IonicContact OE1-NH2 3.58Å
744	L	93	Very high	91.5	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.4	-37.3	178.8	-63.7	169.4	0	0	0	112.4	V607 Q611 P616 A619 L620 Q740 A741 E747 Q748	V607-L744 HydrophobicContact CG1-CD1 4.01Å; Q611-L744 HydrophobicContact CB-CD2 4.11Å; Q611-L744 HydrophobicContact CG-CD2 3.71Å; P616-L744 HydrophobicContact CB-CB 4.39Å; P616-L744 HydrophobicContact CB-CD2 4.11Å; A619-L744 HydrophobicContact CB-CD1 3.62Å; A619-L744 HydrophobicContact CB-CD2 3.78Å; A619-L744 HydrophobicContact CB-CG 4.37Å; L620-L744 HydrophobicContact CD2-CB 3.77Å; L620-L744 HydrophobicContact CD2-CD1 3.83Å; L620-L744 HydrophobicContact CD2-CG 4.48Å; L620-L744 HydrophobicContact CG-CB 4.02Å; L620-L744 HydrophobicContact CG-CD1 4.03Å; Q740-L744 WeakPolarHBondContact O-CG 3.26Å; Q740-L744 PolarHBondContact O-N 2.91Å; A741-L744 PolarHBondContact O-N 3Å; L744-E747 PolarHBondContact O-N 3.39Å; L744-Q748 PolarHBondContact O-N 3.08Å
745	F	91.9	Very high	91.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.3	-35.9	175.6	-78.4	-52.3	0	0	0	113.2	L620 A706 L709 M713 A741 A742 E743 E747 Q748 Q749 H750 E753 A754	L620-F745 HydrophobicContact CD1-CD1 4.01Å; L620-F745 HydrophobicContact CD1-CE1 3.63Å; L620-F745 HydrophobicContact CD1-CZ 4.09Å; L620-F745 HydrophobicContact CD2-CD2 4.33Å; L620-F745 HydrophobicContact CD2-CE1 4.31Å; L620-F745 HydrophobicContact CD2-CE2 4.07Å; L620-F745 HydrophobicContact CD2-CZ 4.07Å; A706-F745 HydrophobicContact CB-CE1 3.71Å; A706-F745 HydrophobicContact CB-CZ 4.42Å; L709-F745 HydrophobicContact CD2-CE2 3.95Å; L709-F745 HydrophobicContact CD2-CZ 3.83Å; M713-F745 HydrophobicContact CE-CE2 4.17Å; M713-F745 HydrophobicContact CE-CZ 4.35Å; M713-F745 HydrophobicContact SD-CE2 4.38Å; A741-F745 WeakPolarHBondContact O-CD2 3.27Å; A741-F745 PolarHBondContact O-N 3.5Å; A742-F745 PolarHBondContact O-N 2.93Å; E743-F745 VanDerWaalsContact C-N 3.33Å; E743-F745 PolarHBondContact O-N 3.29Å; F745-E747 VanDerWaalsContact C-N 3.29Å; F745-E747 PolarHBondContact O-N 3.48Å; F745-Q748 PolarHBondContact O-N 3.45Å; F745-Q749 PolarHBondContact O-N 3.26Å; F745-H750 HydrophobicContact CB-CB 4.41Å; F745-H750 HydrophobicContact CD1-CB 4.09Å; F745-H750 PolarHBondContact O-N 2.94Å; F745-E753 HydrophobicContact CB-CB 4.48Å; F745-E753 HydrophobicContact CD1-CB 4.02Å; F745-E753 HydrophobicContact CD2-CB 4.02Å; F745-E753 HydrophobicContact CE1-CB 4.18Å; F745-E753 HydrophobicContact CE2-CB 4.17Å; F745-E753 HydrophobicContact CG-CB 3.94Å; F745-E753 HydrophobicContact CZ-CB 4.24Å; F745-A754 HydrophobicContact CB-CB 3.82Å
746	M	91.9	Very high	91.4	Very high	11 Å²	11	42 Å²	42	5%	0.054	20%	0.2	C	C	.	.	H	α-helix	trans	-62.5	-38.3	173.8	-72.9	-170.7	-65.3	0	0	111.5	A742 E743 Q748 Q749 A754 M774 R777 L778 V781	A742-M746 WeakPolarHBondContact O-CG 3.37Å; A742-M746 PolarHBondContact O-N 3.22Å; E743-M746 PolarHBondContact O-N 3.39Å; M746-Q748 VanDerWaalsContact C-N 3.3Å; M746-Q748 PolarHBondContact O-N 3.11Å; M746-Q749 PolarHBondContact O-N 3.48Å; M746-A754 HydrophobicContact CG-CB 3.62Å; M746-M774 HydrophobicContact CE-CE 3.29Å; M746-M774 HydrophobicContact CE-SD 4.27Å; M746-R777 HydrophobicContact CE-CB 4.09Å; M746-R777 HydrophobicContact SD-CB 4.22Å; M746-L778 HydrophobicContact CG-CD1 4.1Å; M746-L778 HydrophobicContact SD-CB 3.96Å; M746-L778 HydrophobicContact SD-CD1 4.1Å; M746-V781 HydrophobicContact SD-CG2 4.46Å
747	E	89.5	Confident	91.2	Very high	92 Å²	92	37.9 Å²	37.9	43%	0.43	18%	0.181	S	C	.	.	H	α-helix	trans	-65.1	-33.3	175.4	-69.3	-178.4	175.6	0	0	113	Q611 E743 L744 F745 Q749	Q611-E747 PolarHBondContact NE2-OE1 3.28Å; Q611-E747 PolarHBondContact NE2-OE2 3.44Å; E743-E747 PolarHBondContact O-N 2.87Å; L744-E747 PolarHBondContact O-N 3.39Å; F745-E747 VanDerWaalsContact C-N 3.29Å; F745-E747 PolarHBondContact O-N 3.48Å; E747-Q749 PolarHBondContact O-N 3.02Å
748	Q	89	Confident	91.1	Very high	35 Å²	35	38 Å²	38	16%	0.164	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-1.4	173.1	-65.8	-178.6	7.5	0	0	113.6	P616 L744 F745 M746 H750	P616-Q748 HydrophobicContact CB-CG 4.01Å; P616-Q748 HydrophobicContact CG-CG 3.66Å; L744-Q748 PolarHBondContact O-N 3.08Å; F745-Q748 PolarHBondContact O-N 3.45Å; M746-Q748 VanDerWaalsContact C-N 3.3Å; M746-Q748 PolarHBondContact O-N 3.11Å; Q748-H750 HydrophobicContact CB-CB 4.48Å; Q748-H750 PolarHBondContact O-CD2 3.06Å; Q748-H750 PolarHBondContact O-N 3.22Å; Q748-H750 PolarHBondContact OE1-ND1 3.4Å
749	Q	88.4	Confident	91	Very high	160 Å²	160	43.8 Å²	43.8	75%	0.748	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	18.6	-170.7	-56.6	-169.3	-9.4	0	0	114.7	F745 M746 E747 L751	F745-Q749 PolarHBondContact O-N 3.26Å; M746-Q749 PolarHBondContact O-N 3.48Å; E747-Q749 PolarHBondContact O-N 3.02Å; Q749-L751 VanDerWaalsContact C-N 3.28Å; Q749-L751 PolarHBondContact O-N 2.84Å
750	H	89.6	Confident	90.6	Very high	50 Å²	50	45.4 Å²	45.4	23%	0.231	22%	0.216	C	C	.	.			trans	-84.2	72.1	174.9	-69.8	177.6	0	0	0	109.7	F745 Q748 K752 E753 A754	F745-H750 HydrophobicContact CB-CB 4.41Å; F745-H750 HydrophobicContact CD1-CB 4.09Å; F745-H750 PolarHBondContact O-N 2.94Å; Q748-H750 HydrophobicContact CB-CB 4.48Å; Q748-H750 PolarHBondContact O-CD2 3.06Å; Q748-H750 PolarHBondContact O-N 3.22Å; Q748-H750 PolarHBondContact OE1-ND1 3.4Å; H750-K752 VanDerWaalsContact C-N 3.28Å; H750-K752 PolarHBondContact O-N 3.46Å; H750-E753 HydrophobicContact CB-CB 4.43Å; H750-E753 WeakPolarHBondContact CB-OE2 3.44Å; H750-E753 PolarHBondContact O-N 3.28Å; H750-A754 WeakPolarHBondContact O-CB 3.43Å; H750-A754 PolarHBondContact O-N 3.02Å; H750-A754 VanDerWaalsContact O-N 3.07Å
751	L	91.1	Very high	90.4	Very high	46 Å²	46	43.5 Å²	43.5	24%	0.241	21%	0.207	C	C	.	.	H	α-helix	trans	-71	-20.7	-169.2	-54.3	-175.1	0	0	0	113.9	Q749 G755 L778 V781 K782	Q749-L751 VanDerWaalsContact C-N 3.28Å; Q749-L751 PolarHBondContact O-N 2.84Å; L751-G755 PolarHBondContact O-N 3.42Å; L751-G755 VanDerWaalsContact O-N 3.16Å; L751-L778 HydrophobicContact CB-CD1 4.27Å; L751-L778 HydrophobicContact CD2-CD1 4.13Å; L751-V781 HydrophobicContact CD1-CG1 4.32Å; L751-V781 HydrophobicContact CD2-CB 4.38Å; L751-V781 HydrophobicContact CD2-CG1 3.51Å; L751-K782 HydrophobicContact CD1-CG 3.96Å
752	K	88.3	Confident	90.2	Very high	177 Å²	177	44 Å²	44	77%	0.77	21%	0.211	S	C	*	.	H	α-helix	trans	-74.5	-47.6	178.5	-67	-178	178.5	-179.6	0	109.9	H750 G755 F756	H750-K752 VanDerWaalsContact C-N 3.28Å; H750-K752 PolarHBondContact O-N 3.46Å; K752-G755 WeakPolarHBondContact O-CA 3.5Å; K752-G755 PolarHBondContact O-N 3.45Å; K752-F756 PolarHBondContact O-N 3.28Å
753	E	86.9	Confident	89.8	Confident	46 Å²	46	46.1 Å²	46.1	22%	0.215	23%	0.233	C	C	.	.	H	α-helix	trans	-65.9	-42.3	178.8	-60.5	88	154.3	0	0	111.1	F745 H750 G755 F756 C757	F745-E753 HydrophobicContact CB-CB 4.48Å; F745-E753 HydrophobicContact CD1-CB 4.02Å; F745-E753 HydrophobicContact CD2-CB 4.02Å; F745-E753 HydrophobicContact CE1-CB 4.18Å; F745-E753 HydrophobicContact CE2-CB 4.17Å; F745-E753 HydrophobicContact CG-CB 3.94Å; F745-E753 HydrophobicContact CZ-CB 4.24Å; H750-E753 HydrophobicContact CB-CB 4.43Å; H750-E753 WeakPolarHBondContact CB-OE2 3.44Å; H750-E753 PolarHBondContact O-N 3.28Å; E753-G755 VanDerWaalsContact C-N 3.31Å; E753-G755 PolarHBondContact O-N 3.04Å; E753-F756 WeakPolarHBondContact O-CB 3.12Å; E753-F756 PolarHBondContact O-N 2.95Å; E753-C757 PolarHBondContact O-N 3.03Å; E753-C757 PolarHBondContact O-SG 2.91Å
754	A	90.2	Very high	89.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-58.9	-43	171.1	0	0	0	0	0	111.9	F745 M746 H750 F756 C757 I758 L778	F745-A754 HydrophobicContact CB-CB 3.82Å; M746-A754 HydrophobicContact CG-CB 3.62Å; H750-A754 WeakPolarHBondContact O-CB 3.43Å; H750-A754 PolarHBondContact O-N 3.02Å; H750-A754 VanDerWaalsContact O-N 3.07Å; A754-F756 VanDerWaalsContact C-N 3.35Å; A754-F756 PolarHBondContact O-N 3.48Å; A754-C757 PolarHBondContact O-N 3.01Å; A754-I758 WeakPolarHBondContact O-CD1 3.41Å; A754-I758 VanDerWaalsContact O-CG1 3.3Å; A754-I758 WeakPolarHBondContact O-CG1 3.46Å; A754-I758 PolarHBondContact O-N 3.46Å; A754-I758 VanDerWaalsContact O-N 3.09Å; A754-L778 HydrophobicContact CB-CD1 4.14Å
755	G	90.2	Very high	89.1	Confident	21 Å²	21	48 Å²	48	22%	0.216	24%	0.242	C	C	.	.	H	α-helix	trans	-61.6	-40.5	175.6	0	0	0	0	0	113	L751 K752 E753 Q759	L751-G755 PolarHBondContact O-N 3.42Å; L751-G755 VanDerWaalsContact O-N 3.16Å; K752-G755 WeakPolarHBondContact O-CA 3.5Å; K752-G755 PolarHBondContact O-N 3.45Å; E753-G755 VanDerWaalsContact C-N 3.31Å; E753-G755 PolarHBondContact O-N 3.04Å; G755-Q759 WeakPolarHBondContact O-CB 3.32Å; G755-Q759 PolarHBondContact O-N 3.46Å
756	F	89.6	Confident	88.9	Confident	64 Å²	64	52 Å²	52	28%	0.281	27%	0.268	S	S	.	.	H	α-helix	trans	-62.6	-50.3	175.3	-179.3	-90.6	0	0	0	111.8	M713 T717 W738 K752 E753 A754 I758 Q759 E760	M713-F756 HydrophobicContact CB-CE1 4.01Å; M713-F756 HydrophobicContact CE-CD1 4.44Å; T717-F756 HydrophobicContact CG2-CE2 4.45Å; T717-F756 HydrophobicContact CG2-CZ 3.78Å; W738-F756 HydrophobicContact CH2-CE1 4.41Å; W738-F756 HydrophobicContact CZ3-CE1 4.38Å; K752-F756 PolarHBondContact O-N 3.28Å; E753-F756 WeakPolarHBondContact O-CB 3.12Å; E753-F756 PolarHBondContact O-N 2.95Å; A754-F756 VanDerWaalsContact C-N 3.35Å; A754-F756 PolarHBondContact O-N 3.48Å; F756-I758 VanDerWaalsContact C-N 3.28Å; F756-I758 PolarHBondContact O-N 2.93Å; F756-Q759 WeakPolarHBondContact O-CA 3.35Å; F756-Q759 WeakPolarHBondContact O-CB 3.29Å; F756-Q759 PolarHBondContact O-N 3.49Å; F756-E760 HydrophobicContact CD1-CG 4.14Å; F756-E760 HydrophobicContact CE1-CG 3.6Å; F756-E760 HydrophobicContact CE2-CG 4.5Å; F756-E760 HydrophobicContact CZ-CG 3.83Å; F756-E760 PolarHBondContact O-N 3.06Å
757	C	89.6	Confident	88.7	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.4	-41.4	179.3	-64.4	0	0	0	0	112.1	M713 W738 A742 E753 A754 Q759 E760 A761	M713-C757 VanDerWaalsContact SD-SG 3.69Å; W738-C757 HydrophobicContact CE3-CB 4Å; A742-C757 HydrophobicContact CB-CB 3.78Å; E753-C757 PolarHBondContact O-N 3.03Å; E753-C757 PolarHBondContact O-SG 2.91Å; A754-C757 PolarHBondContact O-N 3.01Å; C757-Q759 VanDerWaalsContact C-N 3.33Å; C757-E760 PolarHBondContact O-N 3.29Å; C757-A761 PolarHBondContact O-N 2.79Å
758	I	91.8	Very high	88.9	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-67.4	-36	176.6	-67.1	164.8	0	0	0	111.2	A742 A754 F756 A761 A762 V771 M774 R775 L778	A742-I758 HydrophobicContact CB-CD1 4.05Å; A742-I758 HydrophobicContact CB-CG1 3.57Å; A754-I758 WeakPolarHBondContact O-CD1 3.41Å; A754-I758 VanDerWaalsContact O-CG1 3.3Å; A754-I758 WeakPolarHBondContact O-CG1 3.46Å; A754-I758 PolarHBondContact O-N 3.46Å; A754-I758 VanDerWaalsContact O-N 3.09Å; F756-I758 VanDerWaalsContact C-N 3.28Å; F756-I758 PolarHBondContact O-N 2.93Å; I758-A761 PolarHBondContact O-N 3.06Å; I758-A762 VanDerWaalsContact O-CB 3.27Å; I758-A762 WeakPolarHBondContact O-CB 3.48Å; I758-A762 PolarHBondContact O-N 3.08Å; I758-V771 HydrophobicContact CG2-CG1 4.39Å; I758-M774 HydrophobicContact CD1-CB 4.03Å; I758-M774 HydrophobicContact CG1-CB 4.11Å; I758-R775 HydrophobicContact CG2-CB 4.47Å; I758-R775 HydrophobicContact CG2-CG 3.32Å; I758-L778 HydrophobicContact CD1-CB 4.06Å; I758-L778 HydrophobicContact CD1-CD2 4.06Å
759	Q	89.8	Confident	89.1	Confident	126 Å²	126	54.6 Å²	54.6	59%	0.589	29%	0.29	S	S	*	.	H	α-helix	trans	-66.1	-39.7	176.5	-176	61.4	30.6	0	0	111.7	G755 F756 C757 A762 G763	G755-Q759 WeakPolarHBondContact O-CB 3.32Å; G755-Q759 PolarHBondContact O-N 3.46Å; F756-Q759 WeakPolarHBondContact O-CA 3.35Å; F756-Q759 WeakPolarHBondContact O-CB 3.29Å; F756-Q759 PolarHBondContact O-N 3.49Å; C757-Q759 VanDerWaalsContact C-N 3.33Å; Q759-A762 CarbonylContact O-C 3.6Å; Q759-A762 PolarHBondContact O-N 3.47Å; Q759-G763 PolarHBondContact O-N 3.3Å
760	E	87.1	Confident	89.4	Confident	46 Å²	46	49 Å²	49	22%	0.215	27%	0.268	C	S	.	.	H	α-helix	trans	-64.5	-46.3	174.1	-68.4	-56.3	115.5	0	0	111.3	W738 F756 C757 A762 G763 L764	W738-E760 HydrophobicContact CD2-CB 3.96Å; W738-E760 HydrophobicContact CE3-CB 4.29Å; W738-E760 HydrophobicContact CG-CB 4.3Å; W738-E760 HydrophobicContact CH2-CB 4.49Å; W738-E760 HydrophobicContact CH2-CG 4.26Å; W738-E760 HydrophobicContact CZ2-CB 4.23Å; W738-E760 HydrophobicContact CZ2-CG 4.32Å; W738-E760 HydrophobicContact CZ3-CB 4.48Å; W738-E760 HydrophobicContact CZ3-CG 4.41Å; F756-E760 HydrophobicContact CD1-CG 4.14Å; F756-E760 HydrophobicContact CE1-CG 3.6Å; F756-E760 HydrophobicContact CE2-CG 4.5Å; F756-E760 HydrophobicContact CZ-CG 3.83Å; F756-E760 PolarHBondContact O-N 3.06Å; C757-E760 PolarHBondContact O-N 3.29Å; E760-A762 VanDerWaalsContact C-N 3.28Å; E760-A762 PolarHBondContact O-N 3.37Å; E760-G763 WeakPolarHBondContact O-CA 3.49Å; E760-G763 PolarHBondContact O-N 3.23Å; E760-L764 PolarHBondContact O-N 2.75Å
761	A	89.9	Confident	89.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.3	-39.5	173.5	0	0	0	0	0	112.2	E735 W738 L739 C757 I758 G763 L764 F765 V771	E735-A761 HydrophobicContact CG-CB 4.2Å; W738-A761 HydrophobicContact CB-CB 3.87Å; L739-A761 HydrophobicContact CD2-CB 3.68Å; L739-A761 HydrophobicContact CG-CB 4.05Å; C757-A761 PolarHBondContact O-N 2.79Å; I758-A761 PolarHBondContact O-N 3.06Å; A761-G763 VanDerWaalsContact C-N 3.3Å; A761-G763 PolarHBondContact O-N 2.84Å; A761-L764 WeakPolarHBondContact O-CB 3.47Å; A761-L764 PolarHBondContact O-N 2.82Å; A761-L764 VanDerWaalsContact O-N 3.17Å; A761-F765 PolarHBondContact O-N 2.96Å; A761-V771 HydrophobicContact CB-CG2 3.92Å
762	A	89.8	Confident	89.8	Confident	11 Å²	11	45 Å²	45	9%	0.091	25%	0.249	C	C	.	.	H	α-helix	trans	-68	-28.9	174.5	0	0	0	0	0	112.7	I758 Q759 E760 L764 F765 P766 V771	I758-A762 VanDerWaalsContact O-CB 3.27Å; I758-A762 WeakPolarHBondContact O-CB 3.48Å; I758-A762 PolarHBondContact O-N 3.08Å; Q759-A762 CarbonylContact O-C 3.6Å; Q759-A762 PolarHBondContact O-N 3.47Å; E760-A762 VanDerWaalsContact C-N 3.28Å; E760-A762 PolarHBondContact O-N 3.37Å; A762-L764 VanDerWaalsContact C-N 3.26Å; A762-L764 PolarHBondContact O-N 3.28Å; A762-F765 CarbonylContact O-C 3.34Å; A762-P766 VanDerWaalsContact O-CA 3.24Å; A762-P766 WeakPolarHBondContact O-CA 3.35Å; A762-P766 VanDerWaalsContact O-CD 3.24Å; A762-P766 WeakPolarHBondContact O-CD 3.27Å; A762-P766 WeakPolarHBondContact O-CG 3.44Å; A762-P766 VanDerWaalsContact O-N 3.11Å; A762-V771 HydrophobicContact CB-CG1 3.67Å
763	G	84.9	Confident	90.2	Very high	46 Å²	46	38.4 Å²	38.4	47%	0.474	22%	0.219	S	C	.	.	H	α-helix	trans	-63.9	-32.4	170.9	0	0	0	0	0	112.5	Q759 E760 A761	Q759-G763 PolarHBondContact O-N 3.3Å; E760-G763 WeakPolarHBondContact O-CA 3.49Å; E760-G763 PolarHBondContact O-N 3.23Å; A761-G763 VanDerWaalsContact C-N 3.3Å; A761-G763 PolarHBondContact O-N 2.84Å
764	L	85	Confident	90.6	Very high	26 Å²	26	36.6 Å²	36.6	14%	0.136	21%	0.211	C	C	.	.	H	α-helix	trans	-75.6	-57.6	173.7	-52.2	178.7	0	0	0	111.7	L723 W731 L734 E735 E760 A761 A762	L723-L764 HydrophobicContact CD2-CB 4.3Å; L723-L764 HydrophobicContact CD2-CD2 3.51Å; L723-L764 HydrophobicContact CD2-CG 4.47Å; L723-L764 HydrophobicContact CG-CD2 4.1Å; W731-L764 HydrophobicContact CE3-CD2 4Å; W731-L764 HydrophobicContact CZ3-CD2 4.25Å; L734-L764 HydrophobicContact CB-CD1 3.99Å; L734-L764 HydrophobicContact CD2-CD1 3.81Å; L734-L764 HydrophobicContact CD2-CD2 4.19Å; L734-L764 HydrophobicContact CG-CD1 3.77Å; E735-L764 HydrophobicContact CB-CD1 4.09Å; E760-L764 PolarHBondContact O-N 2.75Å; A761-L764 WeakPolarHBondContact O-CB 3.47Å; A761-L764 PolarHBondContact O-N 2.82Å; A761-L764 VanDerWaalsContact O-N 3.17Å; A762-L764 VanDerWaalsContact C-N 3.26Å; A762-L764 PolarHBondContact O-N 3.28Å
765	F	86.9	Confident	90.8	Very high	46 Å²	46	41.6 Å²	41.6	20%	0.202	23%	0.229	C	C	.	.			trans	-134.5	85.9	-175.6	-56.9	-74.4	0	0	0	110.9	M728 W731 T732 E735 A761 A762 T767 S768	M728-F765 HydrophobicContact CE-CE1 3.79Å; M728-F765 HydrophobicContact CE-CZ 3.6Å; M728-F765 HydrophobicContact SD-CE1 3.83Å; M728-F765 HydrophobicContact SD-CZ 4.01Å; W731-F765 HydrophobicContact CB-CE2 4.07Å; W731-F765 HydrophobicContact CB-CZ 3.8Å; T732-F765 HydrophobicContact CG2-CE2 4.12Å; T732-F765 HydrophobicContact CG2-CZ 3.96Å; E735-F765 HydrophobicContact CB-CD2 3.86Å; E735-F765 HydrophobicContact CB-CE2 4.08Å; E735-F765 HydrophobicContact CG-CD2 3.94Å; E735-F765 WeakPolarHBondContact OE2-CD2 3.31Å; A761-F765 PolarHBondContact O-N 2.96Å; A762-F765 CarbonylContact O-C 3.34Å; F765-T767 PolarHBondContact O-N 3.49Å; F765-T767 VanDerWaalsContact O-N 3.16Å; F765-S768 WeakPolarHBondContact O-CB 3.43Å; F765-S768 PolarHBondContact O-N 3.38Å; F765-S768 VanDerWaalsContact O-N 3.14Å
766	P	87.6	Confident	91	Very high	84 Å²	84	40.6 Å²	40.6	55%	0.545	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.3	-174.6	-21	27.2	0	0	0	114.2	A762	A762-P766 VanDerWaalsContact O-CA 3.24Å; A762-P766 WeakPolarHBondContact O-CA 3.35Å; A762-P766 VanDerWaalsContact O-CD 3.24Å; A762-P766 WeakPolarHBondContact O-CD 3.27Å; A762-P766 WeakPolarHBondContact O-CG 3.44Å; A762-P766 VanDerWaalsContact O-N 3.11Å
767	T	88.4	Confident	91.3	Very high	112 Å²	112	40.1 Å²	40.1	69%	0.687	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.6	9.1	-176.8	54.5	0	0	0	0	113.1	F765 H769 V798	F765-T767 PolarHBondContact O-N 3.49Å; F765-T767 VanDerWaalsContact O-N 3.16Å; T767-H769 PolarHBondContact O-N 3.46Å; T767-V798 WeakPolarHBondContact O-CG1 3.3Å
768	S	92.3	Very high	91.5	Very high	17 Å²	17	40.7 Å²	40.7	12%	0.119	22%	0.219	C	C	.	.			trans	-64.4	132.5	177.1	173	0	0	0	0	111	E735 F765 S770 V771 L772	E735-S768 WeakPolarHBondContact OE1-CB 3.5Å; E735-S768 PolarHBondContact OE1-OG 3.25Å; F765-S768 WeakPolarHBondContact O-CB 3.43Å; F765-S768 PolarHBondContact O-N 3.38Å; F765-S768 VanDerWaalsContact O-N 3.14Å; S768-S770 PolarHBondContact O-N 3.31Å; S768-S770 PolarHBondContact OG-N 2.93Å; S768-V771 PolarHBondContact O-N 3.06Å; S768-L772 WeakPolarHBondContact O-CG 3.49Å; S768-L772 PolarHBondContact O-N 3.03Å
769	H	94.2	Very high	91.6	Very high	64 Å²	64	40.7 Å²	40.7	30%	0.296	22%	0.219	S	C	.	.	H	α-helix	trans	-60.4	-35.2	176.7	68.5	-79.7	0	0	0	112	T767 L772 Y773 V798 N799 I805	T767-H769 PolarHBondContact O-N 3.46Å; H769-L772 PolarHBondContact O-N 3.43Å; H769-Y773 VanDerWaalsContact O-CB 3.22Å; H769-Y773 WeakPolarHBondContact O-CB 3.38Å; H769-Y773 PolarHBondContact O-N 2.97Å; H769-V798 HydrophobicContact CB-CB 4.07Å; H769-V798 HydrophobicContact CB-CG1 3.94Å; H769-N799 HydrophobicContact CB-CB 3.67Å; H769-N799 PolarHBondContact CD2-ND2 3.33Å; H769-N799 VanDerWaalsContact CD2-ND2 3.33Å; H769-N799 PolarHBondContact NE2-ND2 3.42Å; H769-I805 HydrophobicContact CB-CD1 4.38Å
770	S	94	Very high	91.8	Very high	41 Å²	41	36.7 Å²	36.7	29%	0.287	20%	0.201	S	C	.	.	H	α-helix	trans	-66.2	-41.9	177.5	-55.6	0	0	0	0	111.5	L739 S768 Y773 M774	L739-S770 VanDerWaalsContact CD1-CB 3.43Å; S768-S770 PolarHBondContact O-N 3.31Å; S768-S770 PolarHBondContact OG-N 2.93Å; S770-Y773 PolarHBondContact O-N 3.33Å; S770-M774 VanDerWaalsContact O-CG 3.28Å; S770-M774 WeakPolarHBondContact O-CG 3.47Å; S770-M774 PolarHBondContact O-N 3.12Å
771	V	94.3	Very high	92	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.5	-48.9	175.1	173.8	0	0	0	0	110.9	E735 L739 I758 A761 A762 S768 Y773 M774 R775	E735-V771 HydrophobicContact CG-CG2 4.22Å; E735-V771 WeakPolarHBondContact OE1-CG2 3.42Å; L739-V771 HydrophobicContact CD1-CG2 4.27Å; L739-V771 HydrophobicContact CD2-CG2 4.15Å; I758-V771 HydrophobicContact CG2-CG1 4.39Å; A761-V771 HydrophobicContact CB-CG2 3.92Å; A762-V771 HydrophobicContact CB-CG1 3.67Å; S768-V771 PolarHBondContact O-N 3.06Å; V771-Y773 VanDerWaalsContact C-N 3.31Å; V771-Y773 PolarHBondContact O-N 3.11Å; V771-M774 PolarHBondContact O-N 3.44Å; V771-R775 WeakPolarHBondContact O-CG 3.46Å; V771-R775 PolarHBondContact O-N 3.3Å
772	L	95.4	Very high	92	Very high	14 Å²	14	43.9 Å²	43.9	7%	0.073	24%	0.237	C	C	.	.	H	α-helix	trans	-60.3	-41.4	178.4	-69	172.7	0	0	0	111.7	S768 H769 R775 G776 E794 A795 V798	S768-L772 WeakPolarHBondContact O-CG 3.49Å; S768-L772 PolarHBondContact O-N 3.03Å; H769-L772 PolarHBondContact O-N 3.43Å; L772-R775 PolarHBondContact O-N 2.97Å; L772-G776 PolarHBondContact O-N 3.31Å; L772-E794 HydrophobicContact CD1-CB 4.29Å; L772-A795 HydrophobicContact CB-CB 3.72Å; L772-V798 HydrophobicContact CD1-CG2 3.98Å
773	Y	95.8	Very high	92	Very high	37 Å²	37	45.8 Å²	45.8	15%	0.145	26%	0.258	C	S	.	.	H	α-helix	trans	-59.5	-48.4	174.2	175.2	-109.9	0	0	0	111.9	H769 S770 V771 R775 G776 R777 Y792 I805 S808	H769-Y773 VanDerWaalsContact O-CB 3.22Å; H769-Y773 WeakPolarHBondContact O-CB 3.38Å; H769-Y773 PolarHBondContact O-N 2.97Å; S770-Y773 PolarHBondContact O-N 3.33Å; V771-Y773 VanDerWaalsContact C-N 3.31Å; V771-Y773 PolarHBondContact O-N 3.11Å; Y773-R775 VanDerWaalsContact C-N 3.35Å; Y773-R775 PolarHBondContact O-N 3.01Å; Y773-G776 WeakPolarHBondContact O-CA 3.23Å; Y773-G776 PolarHBondContact O-N 3.3Å; Y773-G776 VanDerWaalsContact O-N 3.11Å; Y773-R777 VanDerWaalsContact CE1-CD 3.49Å; Y773-R777 HydrophobicContact CE1-CG 4.21Å; Y773-R777 HydrophobicContact CE2-CG 4.31Å; Y773-R777 PolarHBondContact O-N 3.49Å; Y773-Y792 AromaticContact CD2-CD1 3.91Å; Y773-Y792 HydrophobicContact CD2-CD1 3.91Å; Y773-Y792 AromaticContact CD2-CE1 3.71Å; Y773-Y792 HydrophobicContact CD2-CE1 3.71Å; Y773-Y792 HydrophobicContact CE2-CD1 4.38Å; Y773-Y792 AromaticContact CE2-CE1 3.91Å; Y773-Y792 HydrophobicContact CE2-CE1 3.91Å; Y773-Y792 WeakPolarHBondContact O-CE1 3.34Å; Y773-I805 HydrophobicContact CD2-CB 4.24Å; Y773-I805 HydrophobicContact CD2-CG1 3.71Å; Y773-I805 HydrophobicContact CD2-CG2 4.46Å; Y773-I805 HydrophobicContact CE2-CG1 4.36Å; Y773-I805 HydrophobicContact CG-CG1 4.11Å; Y773-S808 WeakPolarHBondContact CE2-OG 3.09Å; Y773-S808 PolarHBondContact OH-OG 3.24Å
774	M	95.3	Very high	92.4	Very high	9 Å²	9	46 Å²	46	4%	0.044	25%	0.252	C	S	.	.	H	α-helix	trans	-66.9	-34.2	179.4	-69.5	-59.9	-73.2	0	0	112.7	L739 A742 E743 M746 I758 S770 V771 G776 R777 L778	L739-M774 HydrophobicContact CB-CG 4.39Å; L739-M774 HydrophobicContact CD2-CB 3.99Å; L739-M774 HydrophobicContact CD2-CG 3.91Å; L739-M774 WeakPolarHBondContact O-CE 3.49Å; A742-M774 HydrophobicContact CB-CE 4.17Å; E743-M774 HydrophobicContact CB-CE 3.69Å; E743-M774 HydrophobicContact CG-CE 4.47Å; M746-M774 HydrophobicContact CE-CE 3.29Å; M746-M774 HydrophobicContact CE-SD 4.27Å; I758-M774 HydrophobicContact CD1-CB 4.03Å; I758-M774 HydrophobicContact CG1-CB 4.11Å; S770-M774 VanDerWaalsContact O-CG 3.28Å; S770-M774 WeakPolarHBondContact O-CG 3.47Å; S770-M774 PolarHBondContact O-N 3.12Å; V771-M774 PolarHBondContact O-N 3.44Å; M774-G776 VanDerWaalsContact C-N 3.35Å; M774-R777 PolarHBondContact O-N 3.07Å; M774-L778 PolarHBondContact O-N 3.11Å
775	R	94.6	Very high	92.8	Very high	104 Å²	104	47.6 Å²	47.6	39%	0.392	26%	0.261	S	S	.	.	H	α-helix	trans	-61.4	-43.1	169.2	-71.4	179.7	64.8	-174.7	-2.7	111.7	I758 V771 L772 Y773 L778 A779 L791	I758-R775 HydrophobicContact CG2-CB 4.47Å; I758-R775 HydrophobicContact CG2-CG 3.32Å; V771-R775 WeakPolarHBondContact O-CG 3.46Å; V771-R775 PolarHBondContact O-N 3.3Å; L772-R775 PolarHBondContact O-N 2.97Å; Y773-R775 VanDerWaalsContact C-N 3.35Å; Y773-R775 PolarHBondContact O-N 3.01Å; R775-L778 PolarHBondContact O-N 3.47Å; R775-A779 PolarHBondContact O-N 2.75Å; R775-L791 HydrophobicContact CB-CD1 4.03Å; R775-L791 HydrophobicContact CB-CD2 4.37Å
776	G	94.9	Very high	93	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.7	-45.7	175.4	0	0	0	0	0	112.2	L772 Y773 M774 L778 A779 E780 A788	L772-G776 PolarHBondContact O-N 3.31Å; Y773-G776 WeakPolarHBondContact O-CA 3.23Å; Y773-G776 PolarHBondContact O-N 3.3Å; Y773-G776 VanDerWaalsContact O-N 3.11Å; M774-G776 VanDerWaalsContact C-N 3.35Å; G776-L778 PolarHBondContact O-N 2.88Å; G776-A779 PolarHBondContact O-N 3.38Å; G776-E780 PolarHBondContact O-N 3.29Å; G776-A788 WeakPolarHBondContact O-CB 3.43Å
777	R	95	Very high	93.3	Very high	54 Å²	54	51.3 Å²	51.3	20%	0.204	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-42.7	174.7	-73.8	-172.8	66.6	-168.4	4	112.6	E743 M746 Y773 M774 A779 E780 V781 Y792	E743-R777 VanDerWaalsContact CD-NH1 3.34Å; E743-R777 IonicContact OE1-CZ 2.87Å; E743-R777 IonicContact OE1-NH1 2.67Å; E743-R777 PolarHBondContact OE1-NH1 3.21Å; E743-R777 IonicContact OE1-NH2 3.58Å; M746-R777 HydrophobicContact CE-CB 4.09Å; M746-R777 HydrophobicContact SD-CB 4.22Å; Y773-R777 VanDerWaalsContact CE1-CD 3.49Å; Y773-R777 HydrophobicContact CE1-CG 4.21Å; Y773-R777 HydrophobicContact CE2-CG 4.31Å; Y773-R777 PolarHBondContact O-N 3.49Å; M774-R777 PolarHBondContact O-N 3.07Å; R777-A779 VanDerWaalsContact C-N 3.34Å; R777-A779 PolarHBondContact O-N 3.25Å; R777-E780 WeakPolarHBondContact O-CB 3.37Å; R777-E780 PolarHBondContact O-N 3.14Å; R777-V781 WeakPolarHBondContact O-CG2 3.48Å; R777-V781 PolarHBondContact O-N 2.9Å; R777-Y792 VanDerWaalsContact CA-OH 3.26Å; R777-Y792 WeakPolarHBondContact CA-OH 3.43Å; R777-Y792 HydrophobicContact CG-CE1 4.2Å; R777-Y792 VanDerWaalsContact CG-OH 3.27Å; R777-Y792 WeakPolarHBondContact CG-OH 3.47Å; R777-Y792 PolarHBondContact N-OH 3.27Å
778	L	94.8	Very high	93.6	Very high	12 Å²	12	46 Å²	46	6%	0.063	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-40.5	176.6	-177.5	64.3	0	0	0	111.7	M746 L751 A754 I758 M774 R775 G776 E780 V781 K782	M746-L778 HydrophobicContact CG-CD1 4.1Å; M746-L778 HydrophobicContact SD-CB 3.96Å; M746-L778 HydrophobicContact SD-CD1 4.1Å; L751-L778 HydrophobicContact CB-CD1 4.27Å; L751-L778 HydrophobicContact CD2-CD1 4.13Å; A754-L778 HydrophobicContact CB-CD1 4.14Å; I758-L778 HydrophobicContact CD1-CB 4.06Å; I758-L778 HydrophobicContact CD1-CD2 4.06Å; M774-L778 PolarHBondContact O-N 3.11Å; R775-L778 PolarHBondContact O-N 3.47Å; G776-L778 PolarHBondContact O-N 2.88Å; L778-E780 VanDerWaalsContact C-N 3.35Å; L778-V781 PolarHBondContact O-N 3.26Å; L778-K782 HydrophobicContact CG-CD 4.29Å; L778-K782 WeakPolarHBondContact O-CB 3.34Å; L778-K782 VanDerWaalsContact O-CG 3.27Å; L778-K782 WeakPolarHBondContact O-CG 3.46Å; L778-K782 PolarHBondContact O-N 3.42Å
779	A	94	Very high	93.8	Very high	5 Å²	5	46.5 Å²	46.5	4%	0.041	24%	0.239	C	C	.	.	H	α-helix	trans	-65.1	-38.5	175.3	0	0	0	0	0	111.9	R775 G776 R777 K782 G783 S784 E787 A788 L791	R775-A779 PolarHBondContact O-N 2.75Å; G776-A779 PolarHBondContact O-N 3.38Å; R777-A779 VanDerWaalsContact C-N 3.34Å; R777-A779 PolarHBondContact O-N 3.25Å; A779-K782 PolarHBondContact O-N 3.29Å; A779-G783 PolarHBondContact O-N 3.02Å; A779-G783 VanDerWaalsContact O-N 3.12Å; A779-S784 PolarHBondContact O-N 3.27Å; A779-E787 HydrophobicContact CB-CB 4.43Å; A779-E787 HydrophobicContact CB-CG 4.3Å; A779-A788 HydrophobicContact CB-CB 4.05Å; A779-L791 HydrophobicContact CB-CD1 4.24Å
780	E	93.1	Very high	93.8	Very high	43 Å²	43	48.2 Å²	48.2	20%	0.201	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-47.5	174	-178.5	180	170.2	0	0	111.5	G776 R777 L778 K782 G783 A788 Y792 M812 R815	G776-E780 PolarHBondContact O-N 3.29Å; R777-E780 WeakPolarHBondContact O-CB 3.37Å; R777-E780 PolarHBondContact O-N 3.14Å; L778-E780 VanDerWaalsContact C-N 3.35Å; E780-K782 VanDerWaalsContact C-N 3.27Å; E780-K782 PolarHBondContact O-N 2.91Å; E780-G783 PolarHBondContact O-N 3.1Å; E780-A788 HydrophobicContact CB-CB 4.07Å; E780-Y792 PolarHBondContact OE2-OH 3.32Å; E780-M812 HydrophobicContact CB-SD 4.48Å; E780-M812 VanDerWaalsContact CD-SD 3.56Å; E780-M812 HydrophobicContact CG-CE 4.46Å; E780-M812 HydrophobicContact CG-SD 3.75Å; E780-R815 IonicContact OE1-CZ 3.6Å; E780-R815 IonicContact OE1-NH1 2.69Å; E780-R815 PolarHBondContact OE1-NH1 3.14Å; E780-R815 IonicContact OE1-NH2 3.47Å
781	V	91.8	Very high	93.9	Very high	76 Å²	76	46.7 Å²	46.7	46%	0.461	24%	0.236	S	C	.	.	H	α-helix	trans	-65	-32	178	179.3	0	0	0	0	111.4	M746 L751 R777 L778 G783	M746-V781 HydrophobicContact SD-CG2 4.46Å; L751-V781 HydrophobicContact CD1-CG1 4.32Å; L751-V781 HydrophobicContact CD2-CB 4.38Å; L751-V781 HydrophobicContact CD2-CG1 3.51Å; R777-V781 WeakPolarHBondContact O-CG2 3.48Å; R777-V781 PolarHBondContact O-N 2.9Å; L778-V781 PolarHBondContact O-N 3.26Å; V781-G783 VanDerWaalsContact C-N 3.26Å; V781-G783 PolarHBondContact O-N 2.88Å
782	K	91.3	Very high	93.9	Very high	120 Å²	120	46.7 Å²	46.7	52%	0.522	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-12.1	172.5	-73.1	172.9	179.9	177.1	0	113.8	L751 L778 A779 E780	L751-K782 HydrophobicContact CD1-CG 3.96Å; L778-K782 HydrophobicContact CG-CD 4.29Å; L778-K782 WeakPolarHBondContact O-CB 3.34Å; L778-K782 VanDerWaalsContact O-CG 3.27Å; L778-K782 WeakPolarHBondContact O-CG 3.46Å; L778-K782 PolarHBondContact O-N 3.42Å; A779-K782 PolarHBondContact O-N 3.29Å; E780-K782 VanDerWaalsContact C-N 3.27Å; E780-K782 PolarHBondContact O-N 2.91Å
783	G	89.8	Confident	93.9	Very high	51 Å²	51	50.3 Å²	50.3	53%	0.526	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	3.8	-178.3	0	0	0	0	0	115.3	A779 E780 V781 L785	A779-G783 PolarHBondContact O-N 3.02Å; A779-G783 VanDerWaalsContact O-N 3.12Å; E780-G783 PolarHBondContact O-N 3.1Å; V781-G783 VanDerWaalsContact C-N 3.26Å; V781-G783 PolarHBondContact O-N 2.88Å; G783-L785 VanDerWaalsContact C-N 3.35Å; G783-L785 PolarHBondContact O-N 2.98Å
784	S	93.1	Very high	93.9	Very high	51 Å²	51	51.9 Å²	51.9	36%	0.357	26%	0.26	S	S	.	.			trans	-81.3	73.5	178.4	-64.5	0	0	0	0	111.5	A779 E786 E787 A788	A779-S784 PolarHBondContact O-N 3.27Å; S784-E786 PolarHBondContact O-N 3.48Å; S784-E787 PolarHBondContact O-N 2.96Å; S784-A788 PolarHBondContact O-N 3.13Å
785	L	92.4	Very high	93.8	Very high	59 Å²	59	51.5 Å²	51.5	31%	0.309	26%	0.257	S	S	.	.	H	α-helix	trans	-62.9	-38.9	-169.3	-56.8	-179.1	0	0	0	115	G783 K789 M812 L816	G783-L785 VanDerWaalsContact C-N 3.35Å; G783-L785 PolarHBondContact O-N 2.98Å; L785-K789 WeakPolarHBondContact O-CB 3.49Å; L785-K789 PolarHBondContact O-N 2.95Å; L785-M812 HydrophobicContact CB-CE 3.75Å; L785-M812 HydrophobicContact CD2-CE 3.5Å; L785-M812 VanDerWaalsContact CD2-CE 3.5Å; L785-M812 HydrophobicContact CD2-SD 4.27Å; L785-M812 HydrophobicContact CG-CE 4.19Å; L785-M812 WeakPolarHBondContact O-CE 3.34Å; L785-L816 HydrophobicContact CB-CD2 4.08Å; L785-L816 HydrophobicContact CD1-CD2 4.35Å
786	E	91.8	Very high	93.8	Very high	107 Å²	107	48.4 Å²	48.4	50%	0.5	25%	0.248	S	C	.	.	H	α-helix	trans	-72.3	-35	179.1	-73.1	-63.7	164	0	0	112.3	S784 K789 Q790	S784-E786 PolarHBondContact O-N 3.48Å; E786-K789 PolarHBondContact O-N 3.45Å; E786-K789 IonicContact OE1-NZ 3.59Å; E786-K789 IonicContact OE2-NZ 2.82Å; E786-K789 PolarHBondContact OE2-NZ 3.21Å; E786-Q790 PolarHBondContact O-N 3.17Å
787	E	94.1	Very high	93.8	Very high	102 Å²	102	53.6 Å²	53.6	48%	0.477	28%	0.281	S	S	.	.	H	α-helix	trans	-65	-46.4	173.6	-173.1	-177.3	-178	0	0	110.5	A779 S784 K789 Q790 L791	A779-E787 HydrophobicContact CB-CB 4.43Å; A779-E787 HydrophobicContact CB-CG 4.3Å; S784-E787 PolarHBondContact O-N 2.96Å; E787-K789 VanDerWaalsContact C-N 3.34Å; E787-K789 PolarHBondContact O-N 3.12Å; E787-Q790 PolarHBondContact O-N 3.34Å; E787-Q790 VanDerWaalsContact O-N 3.14Å; E787-L791 HydrophobicContact CG-CD1 4.02Å; E787-L791 WeakPolarHBondContact O-CG 3.34Å; E787-L791 PolarHBondContact O-N 3.12Å
788	A	94.7	Very high	93.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-58	-44.7	176.3	0	0	0	0	0	112	G776 A779 E780 S784 Q790 L791 Y792 M812	G776-A788 WeakPolarHBondContact O-CB 3.43Å; A779-A788 HydrophobicContact CB-CB 4.05Å; E780-A788 HydrophobicContact CB-CB 4.07Å; S784-A788 PolarHBondContact O-N 3.13Å; A788-Q790 VanDerWaalsContact C-N 3.34Å; A788-Q790 PolarHBondContact O-N 3.05Å; A788-L791 PolarHBondContact O-N 2.79Å; A788-Y792 HydrophobicContact CB-CE2 4.34Å; A788-Y792 WeakPolarHBondContact O-CB 3.31Å; A788-Y792 VanDerWaalsContact O-CD2 3.26Å; A788-Y792 WeakPolarHBondContact O-CD2 3.38Å; A788-Y792 VanDerWaalsContact O-CG 3.27Å; A788-Y792 PolarHBondContact O-N 3.15Å; A788-M812 HydrophobicContact CB-CE 3.86Å
789	K	94.8	Very high	93.6	Very high	28 Å²	28	56 Å²	56	12%	0.122	30%	0.3	C	S	.	.	H	α-helix	trans	-59.8	-41.6	175.2	168	176.6	148.7	-148.7	0	112.6	L785 E786 E787 K793 L809 L813 L816	L785-K789 WeakPolarHBondContact O-CB 3.49Å; L785-K789 PolarHBondContact O-N 2.95Å; E786-K789 PolarHBondContact O-N 3.45Å; E786-K789 IonicContact OE1-NZ 3.59Å; E786-K789 IonicContact OE2-NZ 2.82Å; E786-K789 PolarHBondContact OE2-NZ 3.21Å; E787-K789 VanDerWaalsContact C-N 3.34Å; E787-K789 PolarHBondContact O-N 3.12Å; K789-K793 WeakPolarHBondContact O-CG 3.35Å; K789-K793 PolarHBondContact O-N 3.43Å; K789-K793 VanDerWaalsContact O-N 3.08Å; K789-L809 HydrophobicContact CG-CD1 4.28Å; K789-L813 HydrophobicContact CD-CD2 4.14Å; K789-L816 HydrophobicContact CB-CD1 4.25Å; K789-L816 HydrophobicContact CD-CD1 3.33Å; K789-L816 HydrophobicContact CG-CD1 4.41Å
790	Q	95.4	Very high	93.5	Very high	99 Å²	99	59.2 Å²	59.2	46%	0.463	32%	0.321	S	S	.	.	H	α-helix	trans	-66.3	-45.4	178.1	-178.6	58.1	26.6	0	0	111.1	E786 E787 A788 Y792 K793 E794	E786-Q790 PolarHBondContact O-N 3.17Å; E787-Q790 PolarHBondContact O-N 3.34Å; E787-Q790 VanDerWaalsContact O-N 3.14Å; A788-Q790 VanDerWaalsContact C-N 3.34Å; A788-Q790 PolarHBondContact O-N 3.05Å; Q790-Y792 PolarHBondContact O-N 2.76Å; Q790-K793 WeakPolarHBondContact O-CB 3.46Å; Q790-K793 PolarHBondContact O-N 3.24Å; Q790-E794 WeakPolarHBondContact CG-OE1 3.42Å; Q790-E794 PolarHBondContact NE2-OE1 3.42Å; Q790-E794 WeakPolarHBondContact O-CG 3.25Å; Q790-E794 PolarHBondContact O-N 2.94Å
791	L	94.9	Very high	93.2	Very high	10 Å²	10	61.2 Å²	61.2	5%	0.052	33%	0.333	C	S	.	.	H	α-helix	trans	-63.1	-40.9	177.4	-71.3	166.7	0	0	0	112.5	R775 A779 E787 A788 K793 E794 A795	R775-L791 HydrophobicContact CB-CD1 4.03Å; R775-L791 HydrophobicContact CB-CD2 4.37Å; A779-L791 HydrophobicContact CB-CD1 4.24Å; E787-L791 HydrophobicContact CG-CD1 4.02Å; E787-L791 WeakPolarHBondContact O-CG 3.34Å; E787-L791 PolarHBondContact O-N 3.12Å; A788-L791 PolarHBondContact O-N 2.79Å; L791-K793 VanDerWaalsContact C-N 3.34Å; L791-K793 PolarHBondContact O-N 3.28Å; L791-E794 PolarHBondContact O-N 3.34Å; L791-A795 WeakPolarHBondContact O-CB 3.28Å; L791-A795 PolarHBondContact O-N 2.82Å
792	Y	95.9	Very high	93.1	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-65.3	-36.7	174.5	-67.5	-33.8	0	0	0	112.6	Y773 R777 E780 A788 Q790 A795 L796 I805 M812	Y773-Y792 AromaticContact CD2-CD1 3.91Å; Y773-Y792 HydrophobicContact CD2-CD1 3.91Å; Y773-Y792 AromaticContact CD2-CE1 3.71Å; Y773-Y792 HydrophobicContact CD2-CE1 3.71Å; Y773-Y792 HydrophobicContact CE2-CD1 4.38Å; Y773-Y792 AromaticContact CE2-CE1 3.91Å; Y773-Y792 HydrophobicContact CE2-CE1 3.91Å; Y773-Y792 WeakPolarHBondContact O-CE1 3.34Å; R777-Y792 VanDerWaalsContact CA-OH 3.26Å; R777-Y792 WeakPolarHBondContact CA-OH 3.43Å; R777-Y792 HydrophobicContact CG-CE1 4.2Å; R777-Y792 VanDerWaalsContact CG-OH 3.27Å; R777-Y792 WeakPolarHBondContact CG-OH 3.47Å; R777-Y792 PolarHBondContact N-OH 3.27Å; E780-Y792 PolarHBondContact OE2-OH 3.32Å; A788-Y792 HydrophobicContact CB-CE2 4.34Å; A788-Y792 WeakPolarHBondContact O-CB 3.31Å; A788-Y792 VanDerWaalsContact O-CD2 3.26Å; A788-Y792 WeakPolarHBondContact O-CD2 3.38Å; A788-Y792 VanDerWaalsContact O-CG 3.27Å; A788-Y792 PolarHBondContact O-N 3.15Å; Q790-Y792 PolarHBondContact O-N 2.76Å; Y792-A795 PolarHBondContact O-N 2.61Å; Y792-L796 WeakPolarHBondContact O-CB 3.34Å; Y792-L796 PolarHBondContact O-N 3.31Å; Y792-I805 WeakPolarHBondContact O-CG2 3.34Å; Y792-M812 HydrophobicContact CD2-CG 3.92Å; Y792-M812 HydrophobicContact CE2-CG 3.58Å
793	K	94.8	Very high	93.1	Very high	90 Å²	90	52.9 Å²	52.9	39%	0.391	29%	0.294	S	S	.	.	H	α-helix	trans	-63.9	-45	172.5	-76.9	178.7	176.2	-172.6	0	111.5	K789 Q790 L791 L796 T797 L809	K789-K793 WeakPolarHBondContact O-CG 3.35Å; K789-K793 PolarHBondContact O-N 3.43Å; K789-K793 VanDerWaalsContact O-N 3.08Å; Q790-K793 WeakPolarHBondContact O-CB 3.46Å; Q790-K793 PolarHBondContact O-N 3.24Å; L791-K793 VanDerWaalsContact C-N 3.34Å; L791-K793 PolarHBondContact O-N 3.28Å; K793-L796 PolarHBondContact O-N 2.95Å; K793-T797 WeakPolarHBondContact O-CG2 3.44Å; K793-T797 PolarHBondContact O-N 2.99Å; K793-L809 HydrophobicContact CG-CD1 4.23Å; K793-L809 HydrophobicContact CG-CD2 4.25Å
794	E	94.8	Very high	93.2	Very high	70 Å²	70	53.5 Å²	53.5	33%	0.327	29%	0.289	S	S	.	.	H	α-helix	trans	-60.3	-46	176.1	-72.5	171.1	-164.1	0	0	111	L772 Q790 L791 L796 T797 V798	L772-E794 HydrophobicContact CD1-CB 4.29Å; Q790-E794 WeakPolarHBondContact CG-OE1 3.42Å; Q790-E794 PolarHBondContact NE2-OE1 3.42Å; Q790-E794 WeakPolarHBondContact O-CG 3.25Å; Q790-E794 PolarHBondContact O-N 2.94Å; L791-E794 PolarHBondContact O-N 3.34Å; E794-L796 VanDerWaalsContact C-N 3.3Å; E794-L796 PolarHBondContact O-N 2.77Å; E794-T797 PolarHBondContact O-N 3.44Å; E794-T797 PolarHBondContact O-OG1 3.16Å; E794-V798 PolarHBondContact O-N 2.92Å; E794-V798 VanDerWaalsContact O-N 3.17Å
795	A	94.8	Very high	93.3	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57.8	-42.2	175.2	0	0	0	0	0	112.1	L772 L791 Y792 T797 V798 N799 I805	L772-A795 HydrophobicContact CB-CB 3.72Å; L791-A795 WeakPolarHBondContact O-CB 3.28Å; L791-A795 PolarHBondContact O-N 2.82Å; Y792-A795 PolarHBondContact O-N 2.61Å; A795-T797 VanDerWaalsContact C-N 3.34Å; A795-V798 PolarHBondContact O-N 3.15Å; A795-N799 PolarHBondContact O-N 3.03Å; A795-I805 HydrophobicContact CB-CD1 3.89Å; A795-I805 HydrophobicContact CB-CG1 4.45Å; A795-I805 HydrophobicContact CB-CG2 3.95Å
796	L	94.8	Very high	93.4	Very high	39 Å²	39	49.1 Å²	49.1	20%	0.204	26%	0.262	C	S	.	.	H	α-helix	trans	-70.3	-28.4	176.9	-167.4	67.9	0	0	0	112.7	Y792 K793 E794 V798 N799 P800 I805 M806 L809	Y792-L796 WeakPolarHBondContact O-CB 3.34Å; Y792-L796 PolarHBondContact O-N 3.31Å; K793-L796 PolarHBondContact O-N 2.95Å; E794-L796 VanDerWaalsContact C-N 3.3Å; E794-L796 PolarHBondContact O-N 2.77Å; L796-V798 VanDerWaalsContact C-N 3.28Å; L796-N799 CarbonylContact O-C 3.57Å; L796-P800 VanDerWaalsContact O-CA 3.27Å; L796-P800 WeakPolarHBondContact O-CA 3.23Å; L796-P800 VanDerWaalsContact O-N 3.14Å; L796-I805 HydrophobicContact CB-CG2 4.07Å; L796-I805 HydrophobicContact CD1-CG2 4.49Å; L796-M806 HydrophobicContact CD1-CE 3.86Å; L796-M806 HydrophobicContact CD1-CG 3.65Å; L796-M806 HydrophobicContact CD2-CG 4.41Å; L796-L809 HydrophobicContact CD2-CD2 4.07Å
797	T	95	Very high	93.6	Very high	110 Å²	110	45.1 Å²	45.1	68%	0.675	24%	0.243	S	C	*	.	H	α-helix	trans	-68	-30.7	172.5	67.7	0	0	0	0	112.4	K793 E794 A795	K793-T797 WeakPolarHBondContact O-CG2 3.44Å; K793-T797 PolarHBondContact O-N 2.99Å; E794-T797 PolarHBondContact O-N 3.44Å; E794-T797 PolarHBondContact O-OG1 3.16Å; A795-T797 VanDerWaalsContact C-N 3.34Å
798	V	93.2	Very high	93.6	Very high	74 Å²	74	40.8 Å²	40.8	45%	0.448	22%	0.224	S	C	.	.	H	α-helix	trans	-80.1	-44.6	175.7	178.7	0	0	0	0	111	T767 H769 L772 E794 A795 L796	T767-V798 WeakPolarHBondContact O-CG1 3.3Å; H769-V798 HydrophobicContact CB-CB 4.07Å; H769-V798 HydrophobicContact CB-CG1 3.94Å; L772-V798 HydrophobicContact CD1-CG2 3.98Å; E794-V798 PolarHBondContact O-N 2.92Å; E794-V798 VanDerWaalsContact O-N 3.17Å; A795-V798 PolarHBondContact O-N 3.15Å; L796-V798 VanDerWaalsContact C-N 3.28Å
799	N	91.7	Very high	93.6	Very high	42 Å²	42	41.1 Å²	41.1	23%	0.225	23%	0.226	C	C	.	.			trans	-122.9	91.9	175.3	-176.9	-0.9	0	0	0	110.7	H769 A795 L796 D801 G802	H769-N799 HydrophobicContact CB-CB 3.67Å; H769-N799 PolarHBondContact CD2-ND2 3.33Å; H769-N799 VanDerWaalsContact CD2-ND2 3.33Å; H769-N799 PolarHBondContact NE2-ND2 3.42Å; A795-N799 PolarHBondContact O-N 3.03Å; L796-N799 CarbonylContact O-C 3.57Å; N799-D801 PolarHBondContact O-N 2.97Å; N799-D801 VanDerWaalsContact O-N 3.13Å; N799-D801 PolarHBondContact OD1-N 2.77Å; N799-D801 VanDerWaalsContact OD1-N 3.1Å; N799-G802 PolarHBondContact O-N 3.26Å; N799-G802 PolarHBondContact OD1-N 3.07Å
800	P	90.8	Very high	93.6	Very high	73 Å²	73	39.8 Å²	39.8	47%	0.474	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-13.8	179.6	-24.4	35.5	0	0	0	115.1	L796 M806	L796-P800 VanDerWaalsContact O-CA 3.27Å; L796-P800 WeakPolarHBondContact O-CA 3.23Å; L796-P800 VanDerWaalsContact O-N 3.14Å; P800-M806 WeakPolarHBondContact O-CE 3.27Å
801	D	87.3	Confident	93.5	Very high	85 Å²	85	36.3 Å²	36.3	46%	0.455	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	4.8	-175.8	-61	-18.8	0	0	0	112	N799 V803 R832	N799-D801 PolarHBondContact O-N 2.97Å; N799-D801 VanDerWaalsContact O-N 3.13Å; N799-D801 PolarHBondContact OD1-N 2.77Å; N799-D801 VanDerWaalsContact OD1-N 3.1Å; D801-V803 PolarHBondContact O-N 2.92Å; D801-R832 VanDerWaalsContact CG-NH1 3.32Å; D801-R832 IonicContact OD1-CZ 2.98Å; D801-R832 IonicContact OD1-NE 3.91Å; D801-R832 IonicContact OD1-NH1 2.63Å; D801-R832 PolarHBondContact OD1-NH1 3.02Å; D801-R832 IonicContact OD1-NH2 3.03Å; D801-R832 PolarHBondContact OD1-NH2 3.3Å; D801-R832 IonicContact OD2-NH1 3.63Å
802	G	90.4	Very high	93.5	Very high	9 Å²	9	35.9 Å²	35.9	9%	0.093	20%	0.202	C	C	.	.			trans	-69.2	92.4	-178.8	0	0	0	0	0	113.4	N799 C804 I805 M806	N799-G802 PolarHBondContact O-N 3.26Å; N799-G802 PolarHBondContact OD1-N 3.07Å; G802-C804 PolarHBondContact O-N 2.88Å; G802-I805 WeakPolarHBondContact O-CB 3.44Å; G802-I805 PolarHBondContact O-N 3.4Å; G802-M806 PolarHBondContact O-N 3.21Å
803	V	91.7	Very high	93.4	Very high	12 Å²	12	36.3 Å²	36.3	7%	0.073	21%	0.205	C	C	.	.	H	α-helix	trans	-59.8	-43.4	-177.9	179.3	0	0	0	0	112.4	D801 I805 M806 H807 A829 R832 Q833 C836 A839	D801-V803 PolarHBondContact O-N 2.92Å; V803-I805 PolarHBondContact O-N 3Å; V803-M806 PolarHBondContact O-N 3.39Å; V803-H807 WeakPolarHBondContact O-CB 3.47Å; V803-H807 PolarHBondContact O-N 3.27Å; V803-A829 HydrophobicContact CG1-CB 4.31Å; V803-R832 HydrophobicContact CG2-CB 4.04Å; V803-Q833 HydrophobicContact CB-CB 4.43Å; V803-Q833 HydrophobicContact CG1-CB 4.23Å; V803-Q833 HydrophobicContact CG2-CB 3.59Å; V803-C836 HydrophobicContact CG1-CB 3.9Å; V803-A839 HydrophobicContact CG1-CB 4.38Å
804	C	91.8	Very high	93.3	Very high	64 Å²	64	33.2 Å²	33.2	43%	0.432	19%	0.194	S	C	.	.	H	α-helix	trans	-60.7	-35.4	175.9	-59.6	0	0	0	0	112.1	G802 S808	G802-C804 PolarHBondContact O-N 2.88Å; C804-S808 PolarHBondContact O-N 3.42Å; C804-S808 VanDerWaalsContact O-N 3.1Å; C804-S808 PolarHBondContact O-OG 3.13Å
805	I	94.6	Very high	93.1	Very high	6 Å²	6	36.8 Å²	36.8	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-70.4	-45.1	177.3	-53.5	169.5	0	0	0	109.9	H769 Y773 Y792 A795 L796 G802 V803 H807 S808 L809	H769-I805 HydrophobicContact CB-CD1 4.38Å; Y773-I805 HydrophobicContact CD2-CB 4.24Å; Y773-I805 HydrophobicContact CD2-CG1 3.71Å; Y773-I805 HydrophobicContact CD2-CG2 4.46Å; Y773-I805 HydrophobicContact CE2-CG1 4.36Å; Y773-I805 HydrophobicContact CG-CG1 4.11Å; Y792-I805 WeakPolarHBondContact O-CG2 3.34Å; A795-I805 HydrophobicContact CB-CD1 3.89Å; A795-I805 HydrophobicContact CB-CG1 4.45Å; A795-I805 HydrophobicContact CB-CG2 3.95Å; L796-I805 HydrophobicContact CB-CG2 4.07Å; L796-I805 HydrophobicContact CD1-CG2 4.49Å; G802-I805 WeakPolarHBondContact O-CB 3.44Å; G802-I805 PolarHBondContact O-N 3.4Å; V803-I805 PolarHBondContact O-N 3Å; I805-H807 VanDerWaalsContact C-N 3.33Å; I805-H807 PolarHBondContact O-N 3.07Å; I805-S808 PolarHBondContact O-N 2.67Å; I805-L809 VanDerWaalsContact O-CB 3.26Å; I805-L809 WeakPolarHBondContact O-CB 3.37Å; I805-L809 PolarHBondContact O-N 3.48Å
806	M	95.2	Very high	93	Very high	11 Å²	11	38.9 Å²	38.9	5%	0.054	22%	0.216	C	C	.	.	H	α-helix	trans	-61.3	-42	176.2	-66.2	-176.6	-176.6	0	0	111.9	L796 P800 G802 V803 L809 G810 V825 D828 A829 R832	L796-M806 HydrophobicContact CD1-CE 3.86Å; L796-M806 HydrophobicContact CD1-CG 3.65Å; L796-M806 HydrophobicContact CD2-CG 4.41Å; P800-M806 WeakPolarHBondContact O-CE 3.27Å; G802-M806 PolarHBondContact O-N 3.21Å; V803-M806 PolarHBondContact O-N 3.39Å; M806-L809 PolarHBondContact O-N 2.93Å; M806-G810 PolarHBondContact O-N 3.03Å; M806-V825 HydrophobicContact CB-CG1 3.9Å; M806-V825 HydrophobicContact CG-CG1 4.38Å; M806-V825 WeakPolarHBondContact O-CG1 3.27Å; M806-D828 HydrophobicContact SD-CB 4.36Å; M806-A829 HydrophobicContact CB-CB 3.71Å; M806-A829 HydrophobicContact CG-CB 4.49Å; M806-A829 HydrophobicContact SD-CB 3.94Å; M806-R832 HydrophobicContact CE-CG 4.37Å
807	H	95.1	Very high	92.8	Very high	23 Å²	23	39.5 Å²	39.5	11%	0.106	23%	0.231	C	C	.	.	H	α-helix	trans	-58.4	-55.5	175.9	170.8	-119.1	0	0	0	111.2	V803 I805 L809 G810 L811 E838	V803-H807 WeakPolarHBondContact O-CB 3.47Å; V803-H807 PolarHBondContact O-N 3.27Å; I805-H807 VanDerWaalsContact C-N 3.33Å; I805-H807 PolarHBondContact O-N 3.07Å; H807-L809 PolarHBondContact O-N 3.32Å; H807-G810 PolarHBondContact O-N 3.19Å; H807-L811 WeakPolarHBondContact NE2-CD1 3.38Å; H807-L811 PolarHBondContact O-N 3.29Å; H807-E838 PolarHBondContact CD2-O 3.39Å; H807-E838 VanDerWaalsContact CD2-O 3.27Å; H807-E838 IonicContact CE1-OE2 3.63Å; H807-E838 IonicContact ND1-OE2 2.87Å; H807-E838 PolarHBondContact NE2-O 2.86Å
808	S	94.6	Very high	92.7	Very high	12 Å²	12	38.2 Å²	38.2	8%	0.084	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-42.2	178.2	-59.5	0	0	0	0	112.2	Y773 C804 I805 G810 L811 M812	Y773-S808 WeakPolarHBondContact CE2-OG 3.09Å; Y773-S808 PolarHBondContact OH-OG 3.24Å; C804-S808 PolarHBondContact O-N 3.42Å; C804-S808 VanDerWaalsContact O-N 3.1Å; C804-S808 PolarHBondContact O-OG 3.13Å; I805-S808 PolarHBondContact O-N 2.67Å; S808-G810 PolarHBondContact O-N 3.29Å; S808-L811 PolarHBondContact O-N 2.98Å; S808-M812 WeakPolarHBondContact O-CB 3.25Å; S808-M812 WeakPolarHBondContact O-CG 3.38Å; S808-M812 PolarHBondContact O-N 2.99Å
809	L	95.1	Very high	92.7	Very high	6 Å²	6	38.6 Å²	38.6	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-62.6	-40.9	175.7	-179.3	60.3	0	0	0	112.2	K789 K793 L796 I805 M806 H807 M812 L813 V825	K789-L809 HydrophobicContact CG-CD1 4.28Å; K793-L809 HydrophobicContact CG-CD1 4.23Å; K793-L809 HydrophobicContact CG-CD2 4.25Å; L796-L809 HydrophobicContact CD2-CD2 4.07Å; I805-L809 VanDerWaalsContact O-CB 3.26Å; I805-L809 WeakPolarHBondContact O-CB 3.37Å; I805-L809 PolarHBondContact O-N 3.48Å; M806-L809 PolarHBondContact O-N 2.93Å; H807-L809 PolarHBondContact O-N 3.32Å; L809-M812 PolarHBondContact O-N 2.96Å; L809-L813 HydrophobicContact CD1-CD1 4.29Å; L809-L813 HydrophobicContact CD1-CG 4.21Å; L809-L813 HydrophobicContact CG-CD1 4.04Å; L809-L813 HydrophobicContact CG-CG 4.41Å; L809-L813 WeakPolarHBondContact O-CB 3.38Å; L809-L813 VanDerWaalsContact O-CG 3.26Å; L809-L813 WeakPolarHBondContact O-CG 3.46Å; L809-L813 PolarHBondContact O-N 3.4Å; L809-V825 HydrophobicContact CD2-CG1 4.43Å
810	G	94.3	Very high	92.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.9	-48.8	177.3	0	0	0	0	0	112.1	M806 H807 S808 M812 L813 S814 A822	M806-G810 PolarHBondContact O-N 3.03Å; H807-G810 PolarHBondContact O-N 3.19Å; S808-G810 PolarHBondContact O-N 3.29Å; G810-M812 VanDerWaalsContact C-N 3.34Å; G810-M812 PolarHBondContact O-N 3.34Å; G810-L813 PolarHBondContact O-N 2.98Å; G810-S814 PolarHBondContact O-N 2.98Å; G810-A822 WeakPolarHBondContact O-CB 3.21Å
811	L	93.4	Very high	92.8	Very high	27 Å²	27	41.7 Å²	41.7	14%	0.141	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-42.8	174.9	-68.2	-176.3	0	0	0	111.8	H807 S808 L813 S814 R815 E845	H807-L811 WeakPolarHBondContact NE2-CD1 3.38Å; H807-L811 PolarHBondContact O-N 3.29Å; S808-L811 PolarHBondContact O-N 2.98Å; L811-L813 PolarHBondContact O-N 3.08Å; L811-S814 WeakPolarHBondContact O-CB 3.4Å; L811-S814 PolarHBondContact O-N 2.96Å; L811-R815 WeakPolarHBondContact O-CG 3.38Å; L811-R815 PolarHBondContact O-N 3.47Å; L811-E845 WeakPolarHBondContact CD2-OE2 3.43Å
812	M	94.2	Very high	93.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.7	-42.6	176.8	-72.7	-56.8	-67.3	0	0	112.9	E780 L785 A788 Y792 S808 L809 G810 S814 R815 L816	E780-M812 HydrophobicContact CB-SD 4.48Å; E780-M812 VanDerWaalsContact CD-SD 3.56Å; E780-M812 HydrophobicContact CG-CE 4.46Å; E780-M812 HydrophobicContact CG-SD 3.75Å; L785-M812 HydrophobicContact CB-CE 3.75Å; L785-M812 HydrophobicContact CD2-CE 3.5Å; L785-M812 VanDerWaalsContact CD2-CE 3.5Å; L785-M812 HydrophobicContact CD2-SD 4.27Å; L785-M812 HydrophobicContact CG-CE 4.19Å; L785-M812 WeakPolarHBondContact O-CE 3.34Å; A788-M812 HydrophobicContact CB-CE 3.86Å; Y792-M812 HydrophobicContact CD2-CG 3.92Å; Y792-M812 HydrophobicContact CE2-CG 3.58Å; S808-M812 WeakPolarHBondContact O-CB 3.25Å; S808-M812 WeakPolarHBondContact O-CG 3.38Å; S808-M812 PolarHBondContact O-N 2.99Å; L809-M812 PolarHBondContact O-N 2.96Å; G810-M812 VanDerWaalsContact C-N 3.34Å; G810-M812 PolarHBondContact O-N 3.34Å; M812-S814 VanDerWaalsContact C-N 3.29Å; M812-S814 PolarHBondContact O-N 3.13Å; M812-R815 PolarHBondContact O-N 3.34Å; M812-L816 WeakPolarHBondContact O-CG 3.4Å; M812-L816 PolarHBondContact O-N 3.01Å
813	L	93.9	Very high	93.4	Very high	10 Å²	10	38.7 Å²	38.7	5%	0.052	21%	0.213	C	C	.	.	H	α-helix	trans	-63.3	-37	175.1	-74	170.4	0	0	0	111.8	K789 L809 G810 L811 L816 G817 H818 L821 A822 V825	K789-L813 HydrophobicContact CD-CD2 4.14Å; L809-L813 HydrophobicContact CD1-CD1 4.29Å; L809-L813 HydrophobicContact CD1-CG 4.21Å; L809-L813 HydrophobicContact CG-CD1 4.04Å; L809-L813 HydrophobicContact CG-CG 4.41Å; L809-L813 WeakPolarHBondContact O-CB 3.38Å; L809-L813 VanDerWaalsContact O-CG 3.26Å; L809-L813 WeakPolarHBondContact O-CG 3.46Å; L809-L813 PolarHBondContact O-N 3.4Å; G810-L813 PolarHBondContact O-N 2.98Å; L811-L813 PolarHBondContact O-N 3.08Å; L813-L816 PolarHBondContact O-N 2.89Å; L813-G817 PolarHBondContact O-N 3.3Å; L813-H818 HydrophobicContact CB-CB 4.39Å; L813-H818 HydrophobicContact CD2-CB 4.27Å; L813-H818 WeakPolarHBondContact O-CA 3.38Å; L813-H818 PolarHBondContact O-N 3.39Å; L813-L821 HydrophobicContact CD1-CB 4.24Å; L813-A822 HydrophobicContact CB-CB 3.87Å; L813-V825 HydrophobicContact CD1-CG2 4.1Å
814	S	93	Very high	93.6	Very high	25 Å²	25	44.5 Å²	44.5	18%	0.175	24%	0.237	C	C	.	.	H	α-helix	trans	-62.8	-46.5	174.7	-169.2	0	0	0	0	111.7	G810 L811 M812 L816 G817	G810-S814 PolarHBondContact O-N 2.98Å; L811-S814 WeakPolarHBondContact O-CB 3.4Å; L811-S814 PolarHBondContact O-N 2.96Å; M812-S814 VanDerWaalsContact C-N 3.29Å; M812-S814 PolarHBondContact O-N 3.13Å; S814-L816 VanDerWaalsContact C-N 3.29Å; S814-L816 PolarHBondContact O-N 3.1Å; S814-G817 PolarHBondContact O-N 3.09Å
815	R	90.5	Very high	93.7	Very high	145 Å²	145	42.7 Å²	42.7	55%	0.547	22%	0.224	S	C	.	.	H	α-helix	trans	-61.8	-34.4	176.5	-69.9	-179.9	-172.7	162.3	7.3	112.9	E780 L811 M812 G817	E780-R815 IonicContact OE1-CZ 3.6Å; E780-R815 IonicContact OE1-NH1 2.69Å; E780-R815 PolarHBondContact OE1-NH1 3.14Å; E780-R815 IonicContact OE1-NH2 3.47Å; L811-R815 WeakPolarHBondContact O-CG 3.38Å; L811-R815 PolarHBondContact O-N 3.47Å; M812-R815 PolarHBondContact O-N 3.34Å; R815-G817 PolarHBondContact O-N 2.96Å
816	L	92.1	Very high	93.7	Very high	44 Å²	44	42.4 Å²	42.4	23%	0.23	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	2.3	174.6	-65.9	170.9	0	0	0	113.6	L785 K789 M812 L813 S814	L785-L816 HydrophobicContact CB-CD2 4.08Å; L785-L816 HydrophobicContact CD1-CD2 4.35Å; K789-L816 HydrophobicContact CB-CD1 4.25Å; K789-L816 HydrophobicContact CD-CD1 3.33Å; K789-L816 HydrophobicContact CG-CD1 4.41Å; M812-L816 WeakPolarHBondContact O-CG 3.4Å; M812-L816 PolarHBondContact O-N 3.01Å; L813-L816 PolarHBondContact O-N 2.89Å; S814-L816 VanDerWaalsContact C-N 3.29Å; S814-L816 PolarHBondContact O-N 3.1Å
817	G	90.6	Very high	93.6	Very high	51 Å²	51	47.8 Å²	47.8	53%	0.526	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	86	-1	177.3	0	0	0	0	0	115.1	L813 S814 R815 K819	L813-G817 PolarHBondContact O-N 3.3Å; S814-G817 PolarHBondContact O-N 3.09Å; R815-G817 PolarHBondContact O-N 2.96Å; G817-K819 VanDerWaalsContact C-N 3.25Å; G817-K819 PolarHBondContact O-N 2.88Å
818	H	93.5	Very high	93.4	Very high	83 Å²	83	49.6 Å²	49.6	38%	0.384	25%	0.252	S	S	.	.			trans	-84.9	57.2	179.3	-60.4	-61.1	0	0	0	112.4	L813 S820 L821 A822	L813-H818 HydrophobicContact CB-CB 4.39Å; L813-H818 HydrophobicContact CD2-CB 4.27Å; L813-H818 WeakPolarHBondContact O-CA 3.38Å; L813-H818 PolarHBondContact O-N 3.39Å; H818-S820 VanDerWaalsContact C-N 3.33Å; H818-S820 PolarHBondContact O-N 2.92Å; H818-L821 HydrophobicContact CB-CB 4.41Å; H818-L821 HydrophobicContact CB-CD1 4.32Å; H818-L821 PolarHBondContact O-N 3.17Å; H818-A822 PolarHBondContact O-N 2.72Å
819	K	92.4	Very high	93.3	Very high	82 Å²	82	49 Å²	49	36%	0.357	25%	0.249	S	C	.	.	H	α-helix	trans	-59.8	-34.4	-171.4	-62.2	179.5	-178.7	176.4	0	114.6	G817 Q823 V846 A849 Q850	G817-K819 VanDerWaalsContact C-N 3.25Å; G817-K819 PolarHBondContact O-N 2.88Å; K819-Q823 PolarHBondContact O-N 3.06Å; K819-V846 WeakPolarHBondContact O-CG1 3.01Å; K819-A849 HydrophobicContact CD-CB 4.19Å; K819-A849 PolarHBondContact NZ-O 3.47Å; K819-Q850 HydrophobicContact CB-CG 3.9Å; K819-Q850 HydrophobicContact CD-CG 4.22Å; K819-Q850 PolarHBondContact O-NE2 3.13Å
820	S	92.4	Very high	93.2	Very high	88 Å²	88	49.4 Å²	49.4	62%	0.615	25%	0.251	S	S	*	.	H	α-helix	trans	-70.1	-41.8	179.4	53.6	0	0	0	0	112.4	H818 Q823 K824	H818-S820 VanDerWaalsContact C-N 3.33Å; H818-S820 PolarHBondContact O-N 2.92Å; S820-Q823 PolarHBondContact O-N 2.73Å; S820-K824 PolarHBondContact O-N 3.45Å
821	L	93.8	Very high	92.9	Very high	92 Å²	92	54.7 Å²	54.7	48%	0.482	28%	0.276	S	S	.	.	H	α-helix	trans	-66.7	-42.1	174	-70	172.8	0	0	0	110.9	L813 H818 Q823 K824 V825	L813-L821 HydrophobicContact CD1-CB 4.24Å; H818-L821 HydrophobicContact CB-CB 4.41Å; H818-L821 HydrophobicContact CB-CD1 4.32Å; H818-L821 PolarHBondContact O-N 3.17Å; L821-Q823 VanDerWaalsContact C-N 3.33Å; L821-Q823 PolarHBondContact O-N 3.22Å; L821-K824 PolarHBondContact O-N 2.92Å; L821-V825 WeakPolarHBondContact O-CG2 3.24Å; L821-V825 PolarHBondContact O-N 2.94Å
822	A	94.6	Very high	92.7	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-55.8	-47.8	175.3	0	0	0	0	0	111.8	G810 L813 H818 K824 V825 L826 V846	G810-A822 WeakPolarHBondContact O-CB 3.21Å; L813-A822 HydrophobicContact CB-CB 3.87Å; H818-A822 PolarHBondContact O-N 2.72Å; A822-K824 VanDerWaalsContact C-N 3.33Å; A822-K824 PolarHBondContact O-N 3.39Å; A822-V825 PolarHBondContact O-N 3.42Å; A822-L826 WeakPolarHBondContact O-CB 3.43Å; A822-L826 WeakPolarHBondContact O-CD1 2.91Å; A822-L826 WeakPolarHBondContact O-CG 3.23Å; A822-L826 PolarHBondContact O-N 2.96Å; A822-V846 HydrophobicContact CB-CG1 4.06Å; A822-V846 HydrophobicContact CB-CG2 3.97Å
823	Q	95.1	Very high	92.4	Very high	31 Å²	31	60.8 Å²	60.8	15%	0.145	30%	0.3	C	S	.	.	H	α-helix	trans	-60.3	-42.1	177.7	-174.8	-172.6	12.2	0	0	112	K819 S820 L821 L826 R827 L843 V846 L847	K819-Q823 PolarHBondContact O-N 3.06Å; S820-Q823 PolarHBondContact O-N 2.73Å; L821-Q823 VanDerWaalsContact C-N 3.33Å; L821-Q823 PolarHBondContact O-N 3.22Å; Q823-L826 PolarHBondContact O-N 3.47Å; Q823-R827 WeakPolarHBondContact O-CB 3.27Å; Q823-R827 WeakPolarHBondContact O-CG 3.49Å; Q823-R827 PolarHBondContact O-N 3.34Å; Q823-L843 HydrophobicContact CG-CD1 3.93Å; Q823-V846 HydrophobicContact CB-CG1 3.94Å; Q823-L847 HydrophobicContact CG-CD2 4.42Å; Q823-L847 VanDerWaalsContact NE2-CD2 3.29Å
824	K	94.8	Very high	92.1	Very high	135 Å²	135	61.2 Å²	61.2	59%	0.587	30%	0.304	S	S	*	.	H	α-helix	trans	-62	-50.3	178.1	-172.7	-177.9	176.7	-174.9	0	111.1	S820 L821 A822 L826 R827 D828	S820-K824 PolarHBondContact O-N 3.45Å; L821-K824 PolarHBondContact O-N 2.92Å; A822-K824 VanDerWaalsContact C-N 3.33Å; A822-K824 PolarHBondContact O-N 3.39Å; K824-L826 VanDerWaalsContact C-N 3.29Å; K824-L826 PolarHBondContact O-N 3.07Å; K824-R827 PolarHBondContact O-N 3.5Å; K824-D828 VanDerWaalsContact O-CG 3.25Å; K824-D828 PolarHBondContact O-N 3.48Å
825	V	94.6	Very high	91.9	Very high	25 Å²	25	61.7 Å²	61.7	15%	0.152	31%	0.306	C	S	.	.	H	α-helix	trans	-60.1	-40	179.6	174.3	0	0	0	0	111.5	M806 L809 L813 L821 A822 D828 A829	M806-V825 HydrophobicContact CB-CG1 3.9Å; M806-V825 HydrophobicContact CG-CG1 4.38Å; M806-V825 WeakPolarHBondContact O-CG1 3.27Å; L809-V825 HydrophobicContact CD2-CG1 4.43Å; L813-V825 HydrophobicContact CD1-CG2 4.1Å; L821-V825 WeakPolarHBondContact O-CG2 3.24Å; L821-V825 PolarHBondContact O-N 2.94Å; A822-V825 PolarHBondContact O-N 3.42Å; V825-D828 PolarHBondContact O-N 3.13Å; V825-A829 PolarHBondContact O-N 3.27Å
826	L	94.8	Very high	91.9	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-73.9	-32.7	178.6	-72.7	160	0	0	0	113.2	A822 Q823 K824 A829 V830 G842 L843 V846	A822-L826 WeakPolarHBondContact O-CB 3.43Å; A822-L826 WeakPolarHBondContact O-CD1 2.91Å; A822-L826 WeakPolarHBondContact O-CG 3.23Å; A822-L826 PolarHBondContact O-N 2.96Å; Q823-L826 PolarHBondContact O-N 3.47Å; K824-L826 VanDerWaalsContact C-N 3.29Å; K824-L826 PolarHBondContact O-N 3.07Å; L826-A829 WeakPolarHBondContact O-CB 3.34Å; L826-A829 PolarHBondContact O-N 2.9Å; L826-V830 WeakPolarHBondContact O-CG2 3.24Å; L826-V830 PolarHBondContact O-N 3.45Å; L826-G842 WeakPolarHBondContact CD1-O 3.35Å; L826-L843 HydrophobicContact CB-CB 4.13Å; L826-L843 HydrophobicContact CB-CD1 4.04Å; L826-V846 HydrophobicContact CD1-CB 4.27Å; L826-V846 HydrophobicContact CD1-CG2 3.57Å
827	R	93	Very high	92	Very high	124 Å²	124	55 Å²	55	47%	0.468	28%	0.281	S	S	.	.	H	α-helix	trans	-63.2	-45.4	169.5	-79	-179.1	179.9	-96	0.7	110.8	Q823 K824 A829 V830 E831 L843	Q823-R827 WeakPolarHBondContact O-CB 3.27Å; Q823-R827 WeakPolarHBondContact O-CG 3.49Å; Q823-R827 PolarHBondContact O-N 3.34Å; K824-R827 PolarHBondContact O-N 3.5Å; R827-A829 VanDerWaalsContact C-N 3.27Å; R827-A829 PolarHBondContact O-N 2.78Å; R827-V830 PolarHBondContact O-N 3.34Å; R827-E831 WeakPolarHBondContact O-CG 3.26Å; R827-E831 PolarHBondContact O-N 3.08Å; R827-L843 HydrophobicContact CG-CD1 4.07Å; R827-L843 HydrophobicContact CG-CD2 4.27Å
828	D	91.7	Very high	92.1	Very high	61 Å²	61	56.4 Å²	56.4	33%	0.326	27%	0.274	S	S	.	.	H	α-helix	trans	-58.5	-42.3	174.9	-62.3	-12.6	0	0	0	110	M806 K824 V825 V830 E831 R832	M806-D828 HydrophobicContact SD-CB 4.36Å; K824-D828 VanDerWaalsContact O-CG 3.25Å; K824-D828 PolarHBondContact O-N 3.48Å; V825-D828 PolarHBondContact O-N 3.13Å; D828-V830 PolarHBondContact O-N 3.13Å; D828-E831 PolarHBondContact O-N 2.89Å; D828-R832 VanDerWaalsContact O-CG 3.31Å; D828-R832 WeakPolarHBondContact O-CG 3.4Å; D828-R832 PolarHBondContact O-N 2.88Å
829	A	92.6	Very high	92.2	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.6	-44.4	176.8	0	0	0	0	0	113.2	V803 M806 V825 L826 R827 R832 Q833 A839	V803-A829 HydrophobicContact CG1-CB 4.31Å; M806-A829 HydrophobicContact CB-CB 3.71Å; M806-A829 HydrophobicContact CG-CB 4.49Å; M806-A829 HydrophobicContact SD-CB 3.94Å; V825-A829 PolarHBondContact O-N 3.27Å; L826-A829 WeakPolarHBondContact O-CB 3.34Å; L826-A829 PolarHBondContact O-N 2.9Å; R827-A829 VanDerWaalsContact C-N 3.27Å; R827-A829 PolarHBondContact O-N 2.78Å; A829-R832 PolarHBondContact O-N 3.36Å; A829-Q833 PolarHBondContact O-N 3.12Å; A829-A839 HydrophobicContact CB-CB 4.13Å
830	V	91.9	Very high	92.3	Very high	14 Å²	14	51 Å²	51	9%	0.085	25%	0.248	C	C	.	.	H	α-helix	trans	-68.8	-35.8	177.7	166.8	0	0	0	0	112	L826 R827 D828 R832 Q833 S834 A839 W840 L843	L826-V830 WeakPolarHBondContact O-CG2 3.24Å; L826-V830 PolarHBondContact O-N 3.45Å; R827-V830 PolarHBondContact O-N 3.34Å; D828-V830 PolarHBondContact O-N 3.13Å; V830-R832 VanDerWaalsContact C-N 3.34Å; V830-Q833 CarbonylContact O-C 3.53Å; V830-S834 VanDerWaalsContact O-CA 3.25Å; V830-S834 WeakPolarHBondContact O-CA 3.23Å; V830-S834 PolarHBondContact O-N 3.3Å; V830-S834 VanDerWaalsContact O-N 3.12Å; V830-A839 HydrophobicContact CG2-CB 4.01Å; V830-W840 HydrophobicContact CB-CZ2 4.49Å; V830-W840 HydrophobicContact CG1-CD2 3.98Å; V830-W840 HydrophobicContact CG1-CE3 4.28Å; V830-W840 HydrophobicContact CG1-CH2 3.55Å; V830-W840 HydrophobicContact CG1-CZ2 3.15Å; V830-W840 HydrophobicContact CG1-CZ3 4.09Å; V830-W840 HydrophobicContact CG2-CD2 3.91Å; V830-W840 HydrophobicContact CG2-CE3 4.27Å; V830-W840 HydrophobicContact CG2-CG 4.14Å; V830-L843 HydrophobicContact CG2-CD2 4.4Å
831	E	88.9	Confident	92.5	Very high	112 Å²	112	50.7 Å²	50.7	52%	0.523	24%	0.237	S	C	.	.	H	α-helix	trans	-65.9	-38.4	174.4	-74.8	179.9	-174	0	0	111.6	R827 D828	R827-E831 WeakPolarHBondContact O-CG 3.26Å; R827-E831 PolarHBondContact O-N 3.08Å; D828-E831 PolarHBondContact O-N 2.89Å
832	R	88.4	Confident	92.5	Very high	84 Å²	84	46.3 Å²	46.3	32%	0.317	21%	0.214	S	C	.	.	H	α-helix	trans	-68.8	-48.3	175.9	-66.4	-52.7	-174.7	125.1	18.1	112.5	Q510 D801 V803 M806 D828 A829 V830	Q510-R832 PolarHBondContact NE2-O 3.26Å; Q510-R832 VanDerWaalsContact NE2-O 3.14Å; D801-R832 VanDerWaalsContact CG-NH1 3.32Å; D801-R832 IonicContact OD1-CZ 2.98Å; D801-R832 IonicContact OD1-NE 3.91Å; D801-R832 IonicContact OD1-NH1 2.63Å; D801-R832 PolarHBondContact OD1-NH1 3.02Å; D801-R832 IonicContact OD1-NH2 3.03Å; D801-R832 PolarHBondContact OD1-NH2 3.3Å; D801-R832 IonicContact OD2-NH1 3.63Å; V803-R832 HydrophobicContact CG2-CB 4.04Å; M806-R832 HydrophobicContact CE-CG 4.37Å; D828-R832 VanDerWaalsContact O-CG 3.31Å; D828-R832 WeakPolarHBondContact O-CG 3.4Å; D828-R832 PolarHBondContact O-N 2.88Å; A829-R832 PolarHBondContact O-N 3.36Å; V830-R832 VanDerWaalsContact C-N 3.34Å
833	Q	87.1	Confident	92.6	Very high	70 Å²	70	46.6 Å²	46.6	33%	0.327	22%	0.215	S	C	.	.			trans	-134.8	92.4	178.2	-171.5	178.2	17.8	0	0	111.2	V803 A829 V830 T835 C836	V803-Q833 HydrophobicContact CB-CB 4.43Å; V803-Q833 HydrophobicContact CG1-CB 4.23Å; V803-Q833 HydrophobicContact CG2-CB 3.59Å; A829-Q833 PolarHBondContact O-N 3.12Å; V830-Q833 CarbonylContact O-C 3.53Å; Q833-T835 PolarHBondContact O-N 2.87Å; Q833-T835 VanDerWaalsContact O-N 3.08Å; Q833-C836 HydrophobicContact CB-CB 4.35Å; Q833-C836 HydrophobicContact CG-CB 4.14Å; Q833-C836 WeakPolarHBondContact O-CB 3.4Å; Q833-C836 PolarHBondContact O-N 3.48Å; Q833-C836 VanDerWaalsContact O-N 3.13Å
834	S	88.3	Confident	92.6	Very high	20 Å²	20	45.1 Å²	45.1	14%	0.14	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-16.2	-179.2	66.6	0	0	0	0	114.1	V830 W840 L866	V830-S834 VanDerWaalsContact O-CA 3.25Å; V830-S834 WeakPolarHBondContact O-CA 3.23Å; V830-S834 PolarHBondContact O-N 3.3Å; V830-S834 VanDerWaalsContact O-N 3.12Å; S834-W840 PolarHBondContact O-NE1 2.84Å; S834-L866 VanDerWaalsContact O-CD1 3.25Å; S834-L866 WeakPolarHBondContact O-CD1 3.46Å
835	T	88.4	Confident	92.6	Very high	35 Å²	35	42.2 Å²	42.2	22%	0.215	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	0.5	178.5	69.4	0	0	0	0	114.4	R546 Q833 H837	R546-T835 HydrophobicContact CG-CG2 4.42Å; R546-T835 PolarHBondContact NH2-O 3.41Å; R546-T835 PolarHBondContact NH2-OG1 3.11Å; Q833-T835 PolarHBondContact O-N 2.87Å; Q833-T835 VanDerWaalsContact O-N 3.08Å; T835-H837 PolarHBondContact O-N 3.46Å
836	C	90.8	Very high	92.6	Very high	14 Å²	14	41 Å²	41	10%	0.095	19%	0.19	C	C	.	.			trans	-83.4	102.2	-179.7	-177	0	0	0	0	110.4	V803 Q833 E838 A839 W840	V803-C836 HydrophobicContact CG1-CB 3.9Å; Q833-C836 HydrophobicContact CB-CB 4.35Å; Q833-C836 HydrophobicContact CG-CB 4.14Å; Q833-C836 WeakPolarHBondContact O-CB 3.4Å; Q833-C836 PolarHBondContact O-N 3.48Å; Q833-C836 VanDerWaalsContact O-N 3.13Å; C836-E838 VanDerWaalsContact C-N 3.34Å; C836-E838 PolarHBondContact O-N 3Å; C836-A839 HydrophobicContact CB-CB 4.07Å; C836-A839 PolarHBondContact O-N 3.16Å; C836-W840 VanDerWaalsContact O-CD1 3.26Å; C836-W840 PolarHBondContact O-N 2.99Å
837	H	93.9	Very high	92.6	Very high	34 Å²	34	41.1 Å²	41.1	16%	0.157	19%	0.19	C	C	.	.	H	α-helix	trans	-63.6	-36.6	-179.1	66	-81	0	0	0	112.9	T835 A839 W840 Q841 A863 L866 E867	T835-H837 PolarHBondContact O-N 3.46Å; H837-A839 VanDerWaalsContact C-N 3.34Å; H837-A839 PolarHBondContact O-N 3.4Å; H837-W840 PolarHBondContact O-N 3.33Å; H837-Q841 PolarHBondContact O-N 3.36Å; H837-A863 WeakPolarHBondContact CB-O 3.33Å; H837-L866 HydrophobicContact CB-CB 3.84Å; H837-E867 HydrophobicContact CB-CB 4.2Å
838	E	93.8	Very high	92.7	Very high	81 Å²	81	40.4 Å²	40.4	38%	0.379	19%	0.192	S	C	.	.	H	α-helix	trans	-59.6	-42	176.7	-61.8	179.9	-175.7	0	0	112.1	H807 C836 W840 Q841 G842	H807-E838 PolarHBondContact CD2-O 3.39Å; H807-E838 VanDerWaalsContact CD2-O 3.27Å; H807-E838 IonicContact CE1-OE2 3.63Å; H807-E838 IonicContact ND1-OE2 2.87Å; H807-E838 PolarHBondContact NE2-O 2.86Å; C836-E838 VanDerWaalsContact C-N 3.34Å; C836-E838 PolarHBondContact O-N 3Å; E838-W840 PolarHBondContact O-N 3.26Å; E838-Q841 PolarHBondContact O-N 3.42Å; E838-G842 PolarHBondContact O-N 2.93Å
839	A	94.1	Very high	92.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.3	-40.3	177.4	0	0	0	0	0	112.1	V803 A829 V830 C836 H837 L843	V803-A839 HydrophobicContact CG1-CB 4.38Å; A829-A839 HydrophobicContact CB-CB 4.13Å; V830-A839 HydrophobicContact CG2-CB 4.01Å; C836-A839 HydrophobicContact CB-CB 4.07Å; C836-A839 PolarHBondContact O-N 3.16Å; H837-A839 VanDerWaalsContact C-N 3.34Å; H837-A839 PolarHBondContact O-N 3.4Å; A839-L843 WeakPolarHBondContact O-CB 3.21Å; A839-L843 PolarHBondContact O-N 3.18Å
840	W	95.8	Very high	92.7	Very high	50 Å²	50	42.3 Å²	42.3	19%	0.189	21%	0.207	C	C	.	.	H	α-helix	trans	-65.7	-42	174.1	-77.2	108.4	0	0	0	112.4	V830 S834 C836 H837 E838 L843 G844 C859 A863 L866	V830-W840 HydrophobicContact CB-CZ2 4.49Å; V830-W840 HydrophobicContact CG1-CD2 3.98Å; V830-W840 HydrophobicContact CG1-CE3 4.28Å; V830-W840 HydrophobicContact CG1-CH2 3.55Å; V830-W840 HydrophobicContact CG1-CZ2 3.15Å; V830-W840 HydrophobicContact CG1-CZ3 4.09Å; V830-W840 HydrophobicContact CG2-CD2 3.91Å; V830-W840 HydrophobicContact CG2-CE3 4.27Å; V830-W840 HydrophobicContact CG2-CG 4.14Å; S834-W840 PolarHBondContact O-NE1 2.84Å; C836-W840 VanDerWaalsContact O-CD1 3.26Å; C836-W840 PolarHBondContact O-N 2.99Å; H837-W840 PolarHBondContact O-N 3.33Å; E838-W840 PolarHBondContact O-N 3.26Å; W840-L843 HydrophobicContact CE3-CD2 4.33Å; W840-L843 HydrophobicContact CZ3-CD2 4.38Å; W840-L843 PolarHBondContact O-N 3.3Å; W840-G844 PolarHBondContact O-N 3.41Å; W840-C859 HydrophobicContact CE3-CB 4.18Å; W840-A863 HydrophobicContact CB-CB 3.85Å; W840-L866 VanDerWaalsContact CD1-CD1 3.46Å; W840-L866 HydrophobicContact CG-CD1 4.48Å
841	Q	96.1	Very high	92.7	Very high	82 Å²	82	44.2 Å²	44.2	38%	0.383	23%	0.229	S	C	.	.	H	α-helix	trans	-60.5	-50.6	174.6	-178.3	-173.1	-27.3	0	0	110.8	H837 E838 L843 G844 E845 F860 A863	H837-Q841 PolarHBondContact O-N 3.36Å; E838-Q841 PolarHBondContact O-N 3.42Å; Q841-L843 VanDerWaalsContact C-N 3.29Å; Q841-L843 PolarHBondContact O-N 2.63Å; Q841-G844 WeakPolarHBondContact O-CA 3.39Å; Q841-G844 PolarHBondContact O-N 3.11Å; Q841-G844 VanDerWaalsContact O-N 3.07Å; Q841-E845 PolarHBondContact NE2-OE1 3.43Å; Q841-E845 WeakPolarHBondContact O-CG 3.4Å; Q841-E845 PolarHBondContact O-N 3.28Å; Q841-F860 HydrophobicContact CG-CE1 4.34Å; Q841-A863 HydrophobicContact CB-CB 4.29Å
842	G	94.2	Very high	92.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-38.7	177.9	0	0	0	0	0	112.4	L826 E838 E845 V846	L826-G842 WeakPolarHBondContact CD1-O 3.35Å; E838-G842 PolarHBondContact O-N 2.93Å; G842-E845 PolarHBondContact O-N 3.2Å; G842-V846 WeakPolarHBondContact O-CG2 3.18Å; G842-V846 PolarHBondContact O-N 3.35Å
843	L	95.6	Very high	93.1	Very high	6 Å²	6	43.9 Å²	43.9	3%	0.031	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-44	173.7	-177.3	60	0	0	0	111.3	Q823 L826 R827 V830 A839 W840 Q841 V846 L847	Q823-L843 HydrophobicContact CG-CD1 3.93Å; L826-L843 HydrophobicContact CB-CB 4.13Å; L826-L843 HydrophobicContact CB-CD1 4.04Å; R827-L843 HydrophobicContact CG-CD1 4.07Å; R827-L843 HydrophobicContact CG-CD2 4.27Å; V830-L843 HydrophobicContact CG2-CD2 4.4Å; A839-L843 WeakPolarHBondContact O-CB 3.21Å; A839-L843 PolarHBondContact O-N 3.18Å; W840-L843 HydrophobicContact CE3-CD2 4.33Å; W840-L843 HydrophobicContact CZ3-CD2 4.38Å; W840-L843 PolarHBondContact O-N 3.3Å; Q841-L843 VanDerWaalsContact C-N 3.29Å; Q841-L843 PolarHBondContact O-N 2.63Å; L843-V846 PolarHBondContact O-N 3.04Å; L843-L847 HydrophobicContact CD1-CD1 4.32Å; L843-L847 HydrophobicContact CD1-CG 4.33Å; L843-L847 HydrophobicContact CG-CD1 3.99Å; L843-L847 HydrophobicContact CG-CG 4.45Å; L843-L847 WeakPolarHBondContact O-CB 3.44Å; L843-L847 WeakPolarHBondContact O-CG 3.48Å; L843-L847 PolarHBondContact O-N 2.8Å
844	G	95.7	Very high	93.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.2	-45.6	174.8	0	0	0	0	0	112.8	W840 Q841 V846 L847 Q848 A856	W840-G844 PolarHBondContact O-N 3.41Å; Q841-G844 WeakPolarHBondContact O-CA 3.39Å; Q841-G844 PolarHBondContact O-N 3.11Å; Q841-G844 VanDerWaalsContact O-N 3.07Å; G844-V846 VanDerWaalsContact C-N 3.35Å; G844-V846 PolarHBondContact O-N 2.96Å; G844-L847 PolarHBondContact O-N 3.46Å; G844-Q848 WeakPolarHBondContact O-CB 3.46Å; G844-Q848 PolarHBondContact O-N 3.48Å; G844-A856 WeakPolarHBondContact O-CB 3.48Å
845	E	94.9	Very high	93.7	Very high	74 Å²	74	49.4 Å²	49.4	35%	0.346	26%	0.264	S	S	.	.	H	α-helix	trans	-60.5	-43	176.7	-71.1	177	-165	0	0	111.9	L811 Q841 G842 A849 F860	L811-E845 WeakPolarHBondContact CD2-OE2 3.43Å; Q841-E845 PolarHBondContact NE2-OE1 3.43Å; Q841-E845 WeakPolarHBondContact O-CG 3.4Å; Q841-E845 PolarHBondContact O-N 3.28Å; G842-E845 PolarHBondContact O-N 3.2Å; E845-A849 WeakPolarHBondContact O-CB 3.44Å; E845-A849 PolarHBondContact O-N 3.33Å; E845-F860 HydrophobicContact CG-CE1 4.22Å; E845-F860 HydrophobicContact CG-CZ 4.34Å
846	V	95.6	Very high	93.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-67	-42.8	177	173.4	0	0	0	0	111.5	K819 A822 Q823 L826 G842 L843 G844 A849 Q850	K819-V846 WeakPolarHBondContact O-CG1 3.01Å; A822-V846 HydrophobicContact CB-CG1 4.06Å; A822-V846 HydrophobicContact CB-CG2 3.97Å; Q823-V846 HydrophobicContact CB-CG1 3.94Å; L826-V846 HydrophobicContact CD1-CB 4.27Å; L826-V846 HydrophobicContact CD1-CG2 3.57Å; G842-V846 WeakPolarHBondContact O-CG2 3.18Å; G842-V846 PolarHBondContact O-N 3.35Å; L843-V846 PolarHBondContact O-N 3.04Å; G844-V846 VanDerWaalsContact C-N 3.35Å; G844-V846 PolarHBondContact O-N 2.96Å; V846-A849 PolarHBondContact O-N 2.93Å; V846-Q850 VanDerWaalsContact O-CG 3.31Å; V846-Q850 WeakPolarHBondContact O-CG 3.47Å; V846-Q850 PolarHBondContact O-N 3.2Å
847	L	94.7	Very high	94.2	Very high	2 Å²	2	51 Å²	51	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-63.8	-42.1	177.4	-74.2	171.9	0	0	0	111.9	Q823 L843 G844 A849 Q850 G851 Q852 A855 A856	Q823-L847 HydrophobicContact CG-CD2 4.42Å; Q823-L847 VanDerWaalsContact NE2-CD2 3.29Å; L843-L847 HydrophobicContact CD1-CD1 4.32Å; L843-L847 HydrophobicContact CD1-CG 4.33Å; L843-L847 HydrophobicContact CG-CD1 3.99Å; L843-L847 HydrophobicContact CG-CG 4.45Å; L843-L847 WeakPolarHBondContact O-CB 3.44Å; L843-L847 WeakPolarHBondContact O-CG 3.48Å; L843-L847 PolarHBondContact O-N 2.8Å; G844-L847 PolarHBondContact O-N 3.46Å; L847-A849 VanDerWaalsContact C-N 3.35Å; L847-Q850 CarbonylContact O-C 3.44Å; L847-Q850 WeakPolarHBondContact O-CA 3.33Å; L847-Q850 WeakPolarHBondContact O-CB 3.3Å; L847-Q850 PolarHBondContact O-N 3.47Å; L847-Q850 VanDerWaalsContact O-N 3.1Å; L847-G851 PolarHBondContact O-N 3.46Å; L847-G851 VanDerWaalsContact O-N 3.12Å; L847-Q852 HydrophobicContact CB-CB 4.44Å; L847-Q852 HydrophobicContact CD2-CB 4.27Å; L847-Q852 VanDerWaalsContact CD2-OE1 3.25Å; L847-Q852 PolarHBondContact O-N 3.44Å; L847-A855 HydrophobicContact CD1-CB 4.03Å; L847-A856 HydrophobicContact CB-CB 3.95Å
848	Q	94.2	Very high	94.2	Very high	110 Å²	110	54.3 Å²	54.3	51%	0.514	29%	0.292	S	S	.	.	H	α-helix	trans	-61.7	-44.5	173.8	-172.8	-177.6	28.1	0	0	110.8	G844 Q850 G851 A856	G844-Q848 WeakPolarHBondContact O-CB 3.46Å; G844-Q848 PolarHBondContact O-N 3.48Å; Q848-Q850 PolarHBondContact O-N 2.93Å; Q848-G851 PolarHBondContact O-N 3Å; Q848-A856 HydrophobicContact CB-CB 4.1Å
849	A	91.6	Very high	94.3	Very high	43 Å²	43	50.9 Å²	50.9	36%	0.355	28%	0.277	S	S	.	.	H	α-helix	trans	-64.2	-22.2	175.6	0	0	0	0	0	113.1	K819 E845 V846 L847	K819-A849 HydrophobicContact CD-CB 4.19Å; K819-A849 PolarHBondContact NZ-O 3.47Å; E845-A849 WeakPolarHBondContact O-CB 3.44Å; E845-A849 PolarHBondContact O-N 3.33Å; V846-A849 PolarHBondContact O-N 2.93Å; L847-A849 VanDerWaalsContact C-N 3.35Å
850	Q	92.4	Very high	94.4	Very high	58 Å²	58	53.6 Å²	53.6	27%	0.271	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-7.7	172	-68.6	178.7	6.5	0	0	113.4	K819 V846 L847 Q848	K819-Q850 HydrophobicContact CB-CG 3.9Å; K819-Q850 HydrophobicContact CD-CG 4.22Å; K819-Q850 PolarHBondContact O-NE2 3.13Å; V846-Q850 VanDerWaalsContact O-CG 3.31Å; V846-Q850 WeakPolarHBondContact O-CG 3.47Å; V846-Q850 PolarHBondContact O-N 3.2Å; L847-Q850 CarbonylContact O-C 3.44Å; L847-Q850 WeakPolarHBondContact O-CA 3.33Å; L847-Q850 WeakPolarHBondContact O-CB 3.3Å; L847-Q850 PolarHBondContact O-N 3.47Å; L847-Q850 VanDerWaalsContact O-N 3.1Å; Q848-Q850 PolarHBondContact O-N 2.93Å
851	G	91.7	Very high	94.3	Very high	53 Å²	53	55.6 Å²	55.6	55%	0.546	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	8.1	-177.6	0	0	0	0	0	115.1	L847 Q848 N853	L847-G851 PolarHBondContact O-N 3.46Å; L847-G851 VanDerWaalsContact O-N 3.12Å; Q848-G851 PolarHBondContact O-N 3Å; G851-N853 VanDerWaalsContact C-N 3.33Å; G851-N853 PolarHBondContact O-N 2.92Å; G851-N853 VanDerWaalsContact O-N 3.16Å
852	Q	94	Very high	94.3	Very high	89 Å²	89	53.6 Å²	53.6	42%	0.416	30%	0.296	S	S	.	.			trans	-87.8	68.7	177.5	-64.5	-179.4	16.8	0	0	110.5	L847 E854 A856	L847-Q852 HydrophobicContact CB-CB 4.44Å; L847-Q852 HydrophobicContact CD2-CB 4.27Å; L847-Q852 VanDerWaalsContact CD2-OE1 3.25Å; L847-Q852 PolarHBondContact O-N 3.44Å; Q852-E854 PolarHBondContact O-N 3.22Å; Q852-A856 WeakPolarHBondContact O-CB 3.34Å; Q852-A856 PolarHBondContact O-N 3.01Å; Q852-A856 VanDerWaalsContact O-N 3.09Å
853	N	93.2	Very high	94.3	Very high	100 Å²	100	54 Å²	54	54%	0.535	30%	0.299	S	S	.	.	H	α-helix	trans	-65.4	-36.3	-169.8	-66.2	-24.8	0	0	0	114.1	G851 A856 V857	G851-N853 VanDerWaalsContact C-N 3.33Å; G851-N853 PolarHBondContact O-N 2.92Å; G851-N853 VanDerWaalsContact O-N 3.16Å; N853-A856 PolarHBondContact O-N 3.3Å; N853-V857 WeakPolarHBondContact O-CG2 3.44Å; N853-V857 PolarHBondContact O-N 2.78Å
854	E	93.2	Very high	94.3	Very high	170 Å²	170	58.7 Å²	58.7	79%	0.794	32%	0.324	S	S	*	.	H	α-helix	trans	-63.8	-52	179.8	-67	-178.3	171	0	0	111.3	Q852 A856 V857 D858	Q852-E854 PolarHBondContact O-N 3.22Å; E854-A856 PolarHBondContact O-N 3Å; E854-V857 WeakPolarHBondContact O-CB 3.49Å; E854-V857 PolarHBondContact O-N 3.43Å; E854-V857 VanDerWaalsContact O-N 3.12Å; E854-D858 PolarHBondContact O-N 3.21Å; E854-D858 VanDerWaalsContact O-N 3.15Å
855	A	92.9	Very high	94.1	Very high	37 Å²	37	65.3 Å²	65.3	31%	0.306	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-31.1	176.8	0	0	0	0	0	112.7	L847 C859	L847-A855 HydrophobicContact CD1-CB 4.03Å; A855-C859 PolarHBondContact O-N 3.01Å; A855-C859 VanDerWaalsContact O-N 3.12Å; A855-C859 PolarHBondContact O-SG 2.88Å
856	A	94.1	Very high	94.1	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.008	35%	0.346	C	S	.	.	H	α-helix	trans	-66.3	-42	174.2	0	0	0	0	0	111.8	G844 L847 Q848 Q852 N853 E854 D858 C859 F860	G844-A856 WeakPolarHBondContact O-CB 3.48Å; L847-A856 HydrophobicContact CB-CB 3.95Å; Q848-A856 HydrophobicContact CB-CB 4.1Å; Q852-A856 WeakPolarHBondContact O-CB 3.34Å; Q852-A856 PolarHBondContact O-N 3.01Å; Q852-A856 VanDerWaalsContact O-N 3.09Å; N853-A856 PolarHBondContact O-N 3.3Å; E854-A856 PolarHBondContact O-N 3Å; A856-D858 VanDerWaalsContact C-N 3.35Å; A856-D858 PolarHBondContact O-N 3.05Å; A856-C859 WeakPolarHBondContact O-CB 3.42Å; A856-C859 PolarHBondContact O-N 3.49Å; A856-F860 HydrophobicContact CB-CD2 4.5Å; A856-F860 HydrophobicContact CB-CE2 4.08Å; A856-F860 WeakPolarHBondContact O-CD2 3.44Å; A856-F860 WeakPolarHBondContact O-CG 3.48Å; A856-F860 PolarHBondContact O-N 3.44Å
857	V	95.8	Very high	93.9	Very high	80 Å²	80	67.4 Å²	67.4	49%	0.485	37%	0.365	S	S	.	.	H	α-helix	trans	-60.2	-45.6	175.9	170	0	0	0	0	110.7	N853 E854 C859 F860 L861	N853-V857 WeakPolarHBondContact O-CG2 3.44Å; N853-V857 PolarHBondContact O-N 2.78Å; E854-V857 WeakPolarHBondContact O-CB 3.49Å; E854-V857 PolarHBondContact O-N 3.43Å; E854-V857 VanDerWaalsContact O-N 3.12Å; V857-C859 VanDerWaalsContact C-N 3.31Å; V857-C859 PolarHBondContact O-N 3.05Å; V857-F860 PolarHBondContact O-N 3.39Å; V857-L861 HydrophobicContact CG1-CD1 4.01Å; V857-L861 HydrophobicContact CG1-CG 4.31Å; V857-L861 WeakPolarHBondContact O-CG 3.2Å; V857-L861 PolarHBondContact O-N 3.03Å
858	D	94.8	Very high	93.8	Very high	104 Å²	104	70.5 Å²	70.5	56%	0.556	39%	0.391	S	S	*	.	H	α-helix	trans	-58.6	-44.4	176.7	-65.8	-23.1	0	0	0	111.3	E854 A856 F860 L861 T862	E854-D858 PolarHBondContact O-N 3.21Å; E854-D858 VanDerWaalsContact O-N 3.15Å; A856-D858 VanDerWaalsContact C-N 3.35Å; A856-D858 PolarHBondContact O-N 3.05Å; D858-F860 PolarHBondContact O-N 3.38Å; D858-L861 PolarHBondContact O-N 2.94Å; D858-T862 WeakPolarHBondContact O-CG2 3.36Å; D858-T862 PolarHBondContact O-N 3.49Å; D858-T862 PolarHBondContact O-OG1 2.91Å
859	C	94.9	Very high	93.7	Very high	9 Å²	9	66.3 Å²	66.3	6%	0.061	37%	0.374	C	S	.	.	H	α-helix	trans	-61.5	-44.6	176.3	-66.3	0	0	0	0	111.8	W840 A855 A856 V857 T862 A863	W840-C859 HydrophobicContact CE3-CB 4.18Å; A855-C859 PolarHBondContact O-N 3.01Å; A855-C859 VanDerWaalsContact O-N 3.12Å; A855-C859 PolarHBondContact O-SG 2.88Å; A856-C859 WeakPolarHBondContact O-CB 3.42Å; A856-C859 PolarHBondContact O-N 3.49Å; V857-C859 VanDerWaalsContact C-N 3.31Å; V857-C859 PolarHBondContact O-N 3.05Å; C859-T862 PolarHBondContact O-N 3.27Å; C859-T862 PolarHBondContact O-OG1 3.35Å; C859-A863 WeakPolarHBondContact O-CB 3.27Å; C859-A863 PolarHBondContact O-N 3.24Å
860	F	96.1	Very high	93.7	Very high	58 Å²	58	65.2 Å²	65.2	25%	0.254	36%	0.364	S	S	.	.	H	α-helix	trans	-65.7	-38.7	178.3	-65.5	-46.8	0	0	0	112.8	Q841 E845 A856 V857 D858 A863 L864	Q841-F860 HydrophobicContact CG-CE1 4.34Å; E845-F860 HydrophobicContact CG-CE1 4.22Å; E845-F860 HydrophobicContact CG-CZ 4.34Å; A856-F860 HydrophobicContact CB-CD2 4.5Å; A856-F860 HydrophobicContact CB-CE2 4.08Å; A856-F860 WeakPolarHBondContact O-CD2 3.44Å; A856-F860 WeakPolarHBondContact O-CG 3.48Å; A856-F860 PolarHBondContact O-N 3.44Å; V857-F860 PolarHBondContact O-N 3.39Å; D858-F860 PolarHBondContact O-N 3.38Å; F860-A863 PolarHBondContact O-N 3.02Å; F860-L864 WeakPolarHBondContact O-CG 3.43Å; F860-L864 PolarHBondContact O-N 3Å
861	L	95.6	Very high	93.9	Very high	91 Å²	91	63 Å²	63	48%	0.476	35%	0.354	S	S	.	.	H	α-helix	trans	-61.4	-47	174.8	-71.4	174.1	0	0	0	111	V857 D858 A863 L864 E865	V857-L861 HydrophobicContact CG1-CD1 4.01Å; V857-L861 HydrophobicContact CG1-CG 4.31Å; V857-L861 WeakPolarHBondContact O-CG 3.2Å; V857-L861 PolarHBondContact O-N 3.03Å; D858-L861 PolarHBondContact O-N 2.94Å; L861-A863 VanDerWaalsContact C-N 3.33Å; L861-A863 PolarHBondContact O-N 3.33Å; L861-L864 PolarHBondContact O-N 3.23Å; L861-E865 WeakPolarHBondContact O-CG 3.48Å; L861-E865 PolarHBondContact O-N 2.97Å
862	T	94.3	Very high	93.9	Very high	41 Å²	41	62.1 Å²	62.1	25%	0.252	34%	0.338	S	S	.	.	H	α-helix	trans	-63.4	-37.4	176.1	58.2	0	0	0	0	112.7	D858 C859 E865 L866	D858-T862 WeakPolarHBondContact O-CG2 3.36Å; D858-T862 PolarHBondContact O-N 3.49Å; D858-T862 PolarHBondContact O-OG1 2.91Å; C859-T862 PolarHBondContact O-N 3.27Å; C859-T862 PolarHBondContact O-OG1 3.35Å; T862-E865 PolarHBondContact O-N 2.91Å; T862-L866 WeakPolarHBondContact O-CB 3.46Å; T862-L866 VanDerWaalsContact O-CG 3.28Å; T862-L866 WeakPolarHBondContact O-CG 3.4Å; T862-L866 PolarHBondContact O-N 3.45Å; T862-L866 VanDerWaalsContact O-N 3.08Å
863	A	95	Very high	93.9	Very high	7 Å²	7	59.1 Å²	59.1	6%	0.058	33%	0.325	C	S	.	.	H	α-helix	trans	-61.9	-45.1	175.6	0	0	0	0	0	111.3	H837 W840 Q841 C859 F860 L861 L866 E867	H837-A863 WeakPolarHBondContact CB-O 3.33Å; W840-A863 HydrophobicContact CB-CB 3.85Å; Q841-A863 HydrophobicContact CB-CB 4.29Å; C859-A863 WeakPolarHBondContact O-CB 3.27Å; C859-A863 PolarHBondContact O-N 3.24Å; F860-A863 PolarHBondContact O-N 3.02Å; L861-A863 VanDerWaalsContact C-N 3.33Å; L861-A863 PolarHBondContact O-N 3.33Å; A863-L866 PolarHBondContact O-N 3.07Å; A863-E867 VanDerWaalsContact O-CB 3.31Å; A863-E867 WeakPolarHBondContact O-CB 3.42Å; A863-E867 PolarHBondContact O-N 3.09Å
864	L	95.1	Very high	93.9	Very high	105 Å²	105	57.6 Å²	57.6	55%	0.55	32%	0.321	S	S	.	.	H	α-helix	trans	-63.8	-42.2	178.5	-71.7	169.9	0	0	0	112.5	F860 L861 L866 E867 A868	F860-L864 WeakPolarHBondContact O-CG 3.43Å; F860-L864 PolarHBondContact O-N 3Å; L861-L864 PolarHBondContact O-N 3.23Å; L864-L866 VanDerWaalsContact C-N 3.32Å; L864-L866 PolarHBondContact O-N 3.31Å; L864-E867 PolarHBondContact O-N 2.71Å; L864-A868 WeakPolarHBondContact O-CB 3.5Å; L864-A868 PolarHBondContact O-N 3.05Å
865	E	92.7	Very high	94	Very high	140 Å²	140	49.8 Å²	49.8	65%	0.654	28%	0.284	S	S	*	.	H	α-helix	trans	-61.1	-41.5	175.8	-72.3	177.1	-179.3	0	0	112	L861 T862	L861-E865 WeakPolarHBondContact O-CG 3.48Å; L861-E865 PolarHBondContact O-N 2.97Å; T862-E865 PolarHBondContact O-N 2.91Å
866	L	93.2	Very high	93.9	Very high	30 Å²	30	51 Å²	51	16%	0.157	29%	0.29	C	S	.	.	H	α-helix	trans	-74.1	-37.1	178.8	-70.1	171.8	0	0	0	112.6	S834 H837 W840 T862 A863 L864 A868 S869 S870	S834-L866 VanDerWaalsContact O-CD1 3.25Å; S834-L866 WeakPolarHBondContact O-CD1 3.46Å; H837-L866 HydrophobicContact CB-CB 3.84Å; W840-L866 VanDerWaalsContact CD1-CD1 3.46Å; W840-L866 HydrophobicContact CG-CD1 4.48Å; T862-L866 WeakPolarHBondContact O-CB 3.46Å; T862-L866 VanDerWaalsContact O-CG 3.28Å; T862-L866 WeakPolarHBondContact O-CG 3.4Å; T862-L866 PolarHBondContact O-N 3.45Å; T862-L866 VanDerWaalsContact O-N 3.08Å; A863-L866 PolarHBondContact O-N 3.07Å; L864-L866 VanDerWaalsContact C-N 3.32Å; L864-L866 PolarHBondContact O-N 3.31Å; L866-A868 VanDerWaalsContact C-N 3.33Å; L866-S869 CarbonylContact O-C 3.55Å; L866-S869 PolarHBondContact O-N 3.32Å; L866-S869 PolarHBondContact O-OG 3.24Å; L866-S870 PolarHBondContact O-N 3.41Å; L866-S870 VanDerWaalsContact O-N 3.08Å
867	E	93.1	Very high	93.8	Very high	87 Å²	87	53.6 Å²	53.6	41%	0.407	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-41.9	176	-173.9	-172.4	175.1	0	0	110.9	K580 H837 A863 L864 S869 S870	K580-E867 VanDerWaalsContact CE-O 3.26Å; K580-E867 WeakPolarHBondContact CE-O 3.46Å; K580-E867 PolarHBondContact NZ-O 3.34Å; H837-E867 HydrophobicContact CB-CB 4.2Å; A863-E867 VanDerWaalsContact O-CB 3.31Å; A863-E867 WeakPolarHBondContact O-CB 3.42Å; A863-E867 PolarHBondContact O-N 3.09Å; L864-E867 PolarHBondContact O-N 2.71Å; E867-S869 PolarHBondContact O-N 3.45Å; E867-S869 VanDerWaalsContact O-N 3.13Å; E867-S870 WeakPolarHBondContact O-CB 3.42Å; E867-S870 PolarHBondContact O-N 3.28Å
868	A	91.6	Very high	93.6	Very high	68 Å²	68	49.8 Å²	49.8	56%	0.562	28%	0.28	S	S	*	.	H	α-helix	trans	-59.1	-25.3	178.7	0	0	0	0	0	113.2	A578 L864 L866	A578-A868 VanDerWaalsContact O-O 3.08Å; L864-A868 WeakPolarHBondContact O-CB 3.5Å; L864-A868 PolarHBondContact O-N 3.05Å; L866-A868 VanDerWaalsContact C-N 3.33Å
869	S	91.9	Very high	93.5	Very high	22 Å²	22	46.7 Å²	46.7	15%	0.154	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	13.1	176.4	62.9	0	0	0	0	113.3	R546 L866 E867 P871	R546-S869 PolarHBondContact NH1-O 3.48Å; L866-S869 CarbonylContact O-C 3.55Å; L866-S869 PolarHBondContact O-N 3.32Å; L866-S869 PolarHBondContact O-OG 3.24Å; E867-S869 PolarHBondContact O-N 3.45Å; E867-S869 VanDerWaalsContact O-N 3.13Å; S869-P871 WeakPolarHBondContact O-CD 2.96Å
870	S	93.1	Very high	93.4	Very high	19 Å²	19	47.4 Å²	47.4	13%	0.133	27%	0.267	C	S	.	.			trans	-82	120.1	-177.1	-164.6	0	0	0	0	112.9	A578 K580 L866 E867	A578-S870 WeakPolarHBondContact CA-O 3.36Å; K580-S870 PolarHBondContact NZ-O 3.09Å; L866-S870 PolarHBondContact O-N 3.41Å; L866-S870 VanDerWaalsContact O-N 3.08Å; E867-S870 WeakPolarHBondContact O-CB 3.42Å; E867-S870 PolarHBondContact O-N 3.28Å
871	P	94.7	Very high	93.1	Very high	12 Å²	12	49.9 Å²	49.9	8%	0.078	28%	0.28	C	S	.	.			trans	-71.1	164.9	170.4	34	-37.3	0	0	0	110.9	L574 S577 A578 S869 L873 F875	L574-P871 HydrophobicContact CB-CB 4.42Å; S577-P871 WeakPolarHBondContact OG-CA 3.4Å; A578-P871 HydrophobicContact CB-CB 4.16Å; S869-P871 WeakPolarHBondContact O-CD 2.96Å; P871-L873 VanDerWaalsContact C-N 3.27Å; P871-L873 VanDerWaalsContact CB-O 3.24Å; P871-L873 WeakPolarHBondContact CB-O 3.33Å; P871-L873 WeakPolarHBondContact CG-O 3.04Å; P871-L873 PolarHBondContact O-N 3.07Å; P871-F875 HydrophobicContact CB-CE1 3.99Å; P871-F875 HydrophobicContact CB-CE2 4.32Å; P871-F875 HydrophobicContact CB-CZ 3.85Å; P871-F875 HydrophobicContact CG-CD1 4.45Å; P871-F875 HydrophobicContact CG-CD2 4.05Å; P871-F875 HydrophobicContact CG-CE1 4.16Å; P871-F875 HydrophobicContact CG-CE2 3.73Å; P871-F875 HydrophobicContact CG-CG 4.4Å; P871-F875 HydrophobicContact CG-CZ 3.78Å
872	V	93.3	Very high	92.6	Very high	34 Å²	34	47.2 Å²	47.2	21%	0.206	27%	0.265	C	S	.	.	S	Bend	trans	-67.7	-29.9	178.2	83.4	0	0	0	0	112.6	L574 S577 T605 K608 L609 V612	L574-V872 HydrophobicContact CD2-CG1 4.37Å; S577-V872 PolarHBondContact OG-N 3.14Å; T605-V872 HydrophobicContact CG2-CG1 4.12Å; K608-V872 HydrophobicContact CB-CG1 4.18Å; K608-V872 HydrophobicContact CB-CG2 3.73Å; L609-V872 HydrophobicContact CD2-CB 4.22Å; L609-V872 HydrophobicContact CD2-CG1 3.99Å; L609-V872 HydrophobicContact CD2-CG2 4.34Å; L609-V872 HydrophobicContact CG-CG1 4.11Å; V612-V872 HydrophobicContact CG2-CG2 4.25Å
873	L	93.4	Very high	92.6	Very high	27 Å²	27	47.5 Å²	47.5	14%	0.141	27%	0.266	C	S	.	.	S	Bend	trans	-133.9	150	170.8	-75.7	178.5	0	0	0	108.9	L574 F604 K608 P871	L574-L873 HydrophobicContact CD2-CB 4.06Å; F604-L873 HydrophobicContact CB-CD1 4.35Å; K608-L873 HydrophobicContact CB-CG 4.39Å; K608-L873 HydrophobicContact CG-CD1 4.23Å; K608-L873 HydrophobicContact CG-CD2 3.82Å; K608-L873 HydrophobicContact CG-CG 3.94Å; P871-L873 VanDerWaalsContact C-N 3.27Å; P871-L873 VanDerWaalsContact CB-O 3.24Å; P871-L873 WeakPolarHBondContact CB-O 3.33Å; P871-L873 WeakPolarHBondContact CG-O 3.04Å; P871-L873 PolarHBondContact O-N 3.07Å
874	P	92.9	Very high	92.4	Very high	68 Å²	68	49.6 Å²	49.6	44%	0.442	28%	0.277	S	S	.	.			trans	-56.7	140.3	179.1	-23.8	33.9	0	0	0	112.3	S876 I877	P874-S876 PolarHBondContact O-N 2.97Å; P874-S876 VanDerWaalsContact O-N 3.11Å; P874-I877 WeakPolarHBondContact O-CB 3.28Å; P874-I877 WeakPolarHBondContact O-CG2 3.05Å; P874-I877 PolarHBondContact O-N 3.29Å
875	F	94.7	Very high	92.3	Very high	6 Å²	6	46.6 Å²	46.6	3%	0.026	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-58.9	-25	175.8	-62.8	-64.1	0	0	0	113.1	L540 A543 L544 I548 L571 L574 L575 A578 P871 I877 I878	L540-F875 HydrophobicContact CD1-CB 4.04Å; A543-F875 HydrophobicContact CB-CD1 3.93Å; A543-F875 HydrophobicContact CB-CD2 3.92Å; A543-F875 HydrophobicContact CB-CE1 4.01Å; A543-F875 HydrophobicContact CB-CE2 4Å; A543-F875 HydrophobicContact CB-CG 3.89Å; A543-F875 HydrophobicContact CB-CZ 4.05Å; A543-F875 WeakPolarHBondContact O-CD2 3.36Å; A543-F875 WeakPolarHBondContact O-CE2 3.48Å; L544-F875 HydrophobicContact CD2-CB 3.96Å; L544-F875 HydrophobicContact CG-CB 4.47Å; I548-F875 HydrophobicContact CD1-CE2 4.07Å; I548-F875 HydrophobicContact CD1-CZ 3.95Å; L571-F875 HydrophobicContact CD1-CD1 3.8Å; L571-F875 HydrophobicContact CD1-CE1 4.28Å; L574-F875 HydrophobicContact CB-CD1 3.78Å; L574-F875 HydrophobicContact CB-CE1 3.63Å; L574-F875 HydrophobicContact CD1-CD1 4.12Å; L575-F875 HydrophobicContact CD2-CE1 3.95Å; L575-F875 HydrophobicContact CD2-CZ 4.03Å; L575-F875 HydrophobicContact CG-CE1 4.27Å; A578-F875 HydrophobicContact CB-CZ 4.05Å; P871-F875 HydrophobicContact CB-CE1 3.99Å; P871-F875 HydrophobicContact CB-CE2 4.32Å; P871-F875 HydrophobicContact CB-CZ 3.85Å; P871-F875 HydrophobicContact CG-CD1 4.45Å; P871-F875 HydrophobicContact CG-CD2 4.05Å; P871-F875 HydrophobicContact CG-CE1 4.16Å; P871-F875 HydrophobicContact CG-CE2 3.73Å; P871-F875 HydrophobicContact CG-CG 4.4Å; P871-F875 HydrophobicContact CG-CZ 3.78Å; F875-I877 PolarHBondContact O-N 3.24Å; F875-I877 VanDerWaalsContact O-N 3.11Å; F875-I878 PolarHBondContact O-N 3.15Å
876	S	90.8	Very high	92.2	Very high	63 Å²	63	41.1 Å²	41.1	44%	0.441	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-66.8	-4	176.1	59.7	0	0	0	0	114.7	P874 I878	P874-S876 PolarHBondContact O-N 2.97Å; P874-S876 VanDerWaalsContact O-N 3.11Å; S876-I878 PolarHBondContact O-N 3.33Å
877	I	92.1	Very high	92.2	Very high	54 Å²	54	41.8 Å²	41.8	28%	0.277	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-63.2	-27.1	169.6	-164.3	81.8	0	0	0	111.5	L574 P874 F875	L574-I877 HydrophobicContact CD1-CG2 3.69Å; P874-I877 WeakPolarHBondContact O-CB 3.28Å; P874-I877 WeakPolarHBondContact O-CG2 3.05Å; P874-I877 PolarHBondContact O-N 3.29Å; F875-I877 PolarHBondContact O-N 3.24Å; F875-I877 VanDerWaalsContact O-N 3.11Å
878	I	93.3	Very high	92.1	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	23%	0.233	C	C	.	.	S	Bend	trans	-80.1	120	176.3	-61.2	174.4	0	0	0	107.7	L540 H567 H570 L571 L574 F875 S876	L540-I878 HydrophobicContact CD1-CB 4.37Å; L540-I878 HydrophobicContact CD1-CD1 4.35Å; L540-I878 HydrophobicContact CD2-CB 4.38Å; L540-I878 HydrophobicContact CD2-CG2 4.24Å; H567-I878 HydrophobicContact CB-CG2 4.16Å; H570-I878 HydrophobicContact CB-CD1 4.33Å; L571-I878 HydrophobicContact CB-CD1 3.55Å; L571-I878 HydrophobicContact CD1-CD1 4.03Å; L571-I878 HydrophobicContact CG-CD1 4.31Å; L574-I878 HydrophobicContact CD1-CD1 4.19Å; L574-I878 HydrophobicContact CD1-CG1 4.47Å; F875-I878 PolarHBondContact O-N 3.15Å; S876-I878 PolarHBondContact O-N 3.33Å
879	P	91.4	Very high	92.2	Very high	38 Å²	38	36.6 Å²	36.6	25%	0.247	21%	0.21	C	C	.	.			trans	-64.5	139.6	-177.7	26.8	-33.7	0	0	0	110.8	Y537 E881	Y537-P879 PolarHBondContact OH-O 3.41Å; P879-E881 HydrophobicContact CB-CG 4.07Å; P879-E881 PolarHBondContact O-N 2.85Å
880	R	93.6	Very high	92.2	Very high	25 Å²	25	37.8 Å²	37.8	9%	0.094	21%	0.214	C	C	.	.			trans	-98.7	77.2	179	-74.2	172.5	-73.1	178.4	-1.6	109.2	I459 L495 S498 L499 T502 Y537 L540	I459-R880 VanDerWaalsContact CG2-O 3.27Å; I459-R880 WeakPolarHBondContact CG2-O 3.37Å; L495-R880 HydrophobicContact CD2-CB 4.03Å; L495-R880 HydrophobicContact CD2-CG 4.37Å; S498-R880 PolarHBondContact O-NH1 2.91Å; S498-R880 WeakPolarHBondContact OG-CD 3.48Å; S498-R880 PolarHBondContact OG-NH1 3.44Å; L499-R880 HydrophobicContact CD1-CB 4.42Å; L499-R880 HydrophobicContact CD2-CB 4.32Å; L499-R880 VanDerWaalsContact CD2-CZ 3.49Å; L499-R880 HydrophobicContact CG-CB 4.31Å; T502-R880 PolarHBondContact OG1-NH1 3.36Å; T502-R880 PolarHBondContact OG1-NH2 3.39Å; Y537-R880 HydrophobicContact CE1-CG 4.49Å; L540-R880 HydrophobicContact CD2-CG 3.9Å
881	E	89.2	Confident	92.1	Very high	110 Å²	110	39.3 Å²	39.3	51%	0.514	22%	0.221	S	C	.	.			trans	-120.8	149.7	-171.4	-66.8	177.2	-166.3	0	0	112.8	Y537 P879	Y537-E881 WeakPolarHBondContact CE2-O 3.48Å; Y537-E881 VanDerWaalsContact CZ-O 3.31Å; Y537-E881 PolarHBondContact OH-N 2.79Å; Y537-E881 PolarHBondContact OH-O 3.07Å; P879-E881 HydrophobicContact CB-CG 4.07Å; P879-E881 PolarHBondContact O-N 2.85Å
882	L	86.1	Confident	91.9	Very high	34 Å²	34	41.8 Å²	41.8	18%	0.178	23%	0.234	C	C	.	.			trans	-84.3	0	-178.9	-101.1	168.5	0	0	0	114	L452 A455 K456 I459 L491 A492 L495 Q533	L452-L882 HydrophobicContact CD1-CD1 4.35Å; L452-L882 HydrophobicContact CD1-CD2 4.26Å; A455-L882 HydrophobicContact CB-CD1 4.17Å; K456-L882 HydrophobicContact CB-CB 3.79Å; K456-L882 HydrophobicContact CB-CD1 4.12Å; K456-L882 HydrophobicContact CD-CB 4.32Å; K456-L882 WeakPolarHBondContact CD-O 3.32Å; K456-L882 WeakPolarHBondContact CE-O 3.34Å; K456-L882 HydrophobicContact CG-CB 3.88Å; K456-L882 PolarHBondContact NZ-O 3.2Å; I459-L882 HydrophobicContact CD1-CD1 3.62Å; I459-L882 HydrophobicContact CD1-CG 4.22Å; L491-L882 HydrophobicContact CD2-CD2 4.34Å; L491-L882 HydrophobicContact CG-CD2 4.38Å; A492-L882 HydrophobicContact CB-CD1 3.45Å; A492-L882 VanDerWaalsContact CB-CD1 3.45Å; A492-L882 HydrophobicContact CB-CD2 4.02Å; A492-L882 HydrophobicContact CB-CG 4.19Å; L495-L882 HydrophobicContact CD1-CD2 4.44Å; L495-L882 HydrophobicContact CD1-CG 4.04Å; Q533-L882 PolarHBondContact NE2-OXT 3.38Å

Retrieved 882 of 882 residues in 341.5 ms (Link to these results)

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