A0A077Z6U1_TRITR Loading...

Centromere

AlphaFold DB , UniProt , Accession A0A077Z6U1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 825 aa.

						>A0A077Z6U1_TRITR|A0A077Z6U1
MDQPESVVSTGCFLQIGNKPEFRKLRQHLISRWRHLDKARTGDLGNSLKERYQVLSSPDDDEFPLGMGSMASELEMELKDIETRVISLASTLCIAERRLDAIGLIKDLYQLFLSCQNVTEDTLDKFPQAYCSLQALARQVLNPSDGDDVDDEMSPDMRYSLLTCHPGMSVMFFSKILTWLSKRKRYMRQFLLRQWRATFAWDHQLESQSLTVTVKEVGKLVNLCDALETFGLLNFVISKLSSALCDVFLDRFREAEQCNLHYEASNGAHTLKTCMSPVFSMELNEEEMLRRSSAVQNFFDALSGILNVTVGNGVHLGSAVGNLLGDSLMEGIIAICLKPYVPFERNKTLIMEKQLESCRELERNFRNRRFLNAESYALQKFLLDYDSILCEKECETLISAFQLAFKLPLEPVTEVHSSLLKLTPNEINWPYPKVEGKVASLDSLLEPYHATISSVMSPSCSVRYAMVYPLNLTIMNSLVETVTAFGFTRFSVQFKLEQQDLTSSRLVLEATSPVGIPAFTYTICLVSWIVDYVERIESTLRKAFRSKSQALAIRYFEVSRTAAWLAIVLGKNHLKEASQSAYVTALSFNNMCFLARSLLEWNIDVEQKLAVAFHCSPCLFGFTYLDVAKKLRHLAVTYLNAFLECQSTQLVHDLKLASGFAKATIGGRSNICHEKIKLCLKQLLCVHSEWKTLLPGHVMRVSYGRLVDSLFTAVILNVLSLEDITSKEANGLDDSLTALMADVEFLFTSEKPPRPEAYCHTWRRMKELIFVLENNLKGIEERWNAGNGPLASCFTPDELRKLIRAIFQNTEQRAAVLSKLTRTVE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	37.4	Very low	70 Å²	70	79.9 Å²	79.9	35%	0.345	45%	0.45	S	S	.	.				0	-52.6	0	-78.5	-81	-165.6	0	0	110.4	Q3 S6 F112 I176	M1-Q3 PolarHBondContact N-O 3.24Å; M1-Q3 PolarHBondContact O-N 2.95Å; M1-S6 PolarHBondContact N-OG 3.24Å; M1-F112 HydrophobicContact CE-CE2 4.22Å; M1-F112 HydrophobicContact SD-CE2 4.35Å; M1-F112 HydrophobicContact SD-CZ 4.33Å; M1-I176 HydrophobicContact CE-CG1 4.05Å
2	D	38.6	Very low	37.5	Very low	172 Å²	172	80 Å²	80	92%	0.92	46%	0.458	S	S	*	.			trans	-72.3	-11.9	162.5	-64	-35.3	0	0	0	112.7
3	Q	37.4	Very low	37.4	Very low	132 Å²	132	83.2 Å²	83.2	62%	0.617	46%	0.464	S	S	*	.	S	Bend	trans	-123.7	113.3	162.8	-66.4	178.7	-16	0	0	107.9	M1 E5 S6	M1-Q3 PolarHBondContact N-O 3.24Å; M1-Q3 PolarHBondContact O-N 2.95Å; Q3-E5 PolarHBondContact O-N 3Å; Q3-S6 PolarHBondContact O-N 3.21Å; Q3-S6 PolarHBondContact O-OG 3.48Å
4	P	36.1	Very low	37.5	Very low	74 Å²	74	79.6 Å²	79.6	48%	0.481	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.7	176.4	20.9	-28.9	0	0	0	112	S6 V7 V8	P4-S6 PolarHBondContact O-N 2.82Å; P4-V7 PolarHBondContact O-N 2.92Å; P4-V8 PolarHBondContact O-N 3.27Å; P4-V8 VanDerWaalsContact O-N 3.15Å
5	E	37.8	Very low	37.9	Very low	151 Å²	151	84 Å²	84	71%	0.706	46%	0.459	S	S	*	.	H	α-helix	trans	-58.6	-29.7	177.8	-65.2	170.6	-179	0	0	113.2	Q3 V7 V8 S9	Q3-E5 PolarHBondContact O-N 3Å; E5-V7 VanDerWaalsContact C-N 3.32Å; E5-V7 PolarHBondContact O-N 3.46Å; E5-V8 WeakPolarHBondContact O-CB 3.48Å; E5-V8 PolarHBondContact O-N 3.04Å; E5-S9 PolarHBondContact O-N 3.34Å; E5-S9 VanDerWaalsContact O-N 3.1Å
6	S	38.1	Very low	38	Very low	60 Å²	60	80.8 Å²	80.8	42%	0.42	44%	0.44	S	S	.	.	H	α-helix	trans	-70.2	-28.5	177.4	86.6	0	0	0	0	112.7	M1 Q3 P4 S9	M1-S6 PolarHBondContact N-OG 3.24Å; Q3-S6 PolarHBondContact O-N 3.21Å; Q3-S6 PolarHBondContact O-OG 3.48Å; P4-S6 PolarHBondContact O-N 2.82Å; S6-S9 WeakPolarHBondContact O-CB 3.27Å; S6-S9 PolarHBondContact O-N 2.85Å; S6-S9 PolarHBondContact O-OG 3.28Å
7	V	38.3	Very low	38	Very low	25 Å²	25	78.5 Å²	78.5	15%	0.152	44%	0.439	C	S	.	.	H	α-helix	trans	-82.3	-27.6	173.6	-177.3	0	0	0	0	110.3	P4 E5 S9 T10 G11	P4-V7 PolarHBondContact O-N 2.92Å; E5-V7 VanDerWaalsContact C-N 3.32Å; E5-V7 PolarHBondContact O-N 3.46Å; V7-S9 PolarHBondContact O-N 2.75Å; V7-T10 PolarHBondContact O-N 2.69Å; V7-T10 PolarHBondContact O-OG1 3.16Å; V7-G11 PolarHBondContact O-N 2.75Å
8	V	37.9	Very low	38.3	Very low	74 Å²	74	80.1 Å²	80.1	45%	0.448	45%	0.447	S	S	.	.	H	α-helix	trans	-61.6	-27.5	167.2	-179.2	0	0	0	0	111	P4 E5 T10 G11 C12	P4-V8 PolarHBondContact O-N 3.27Å; P4-V8 VanDerWaalsContact O-N 3.15Å; E5-V8 WeakPolarHBondContact O-CB 3.48Å; E5-V8 PolarHBondContact O-N 3.04Å; V8-T10 VanDerWaalsContact C-N 3.29Å; V8-T10 PolarHBondContact O-N 3.35Å; V8-G11 CarbonylContact O-C 3.54Å; V8-G11 WeakPolarHBondContact O-CA 2.98Å; V8-G11 PolarHBondContact O-N 3.4Å; V8-C12 PolarHBondContact O-N 3.39Å
9	S	38.4	Very low	38.5	Very low	77 Å²	77	81.1 Å²	81.1	54%	0.538	45%	0.446	S	S	.	.	H	α-helix	trans	-63.4	-32.1	171.6	83.8	0	0	0	0	113.3	E5 S6 V7 C12	E5-S9 PolarHBondContact O-N 3.34Å; E5-S9 VanDerWaalsContact O-N 3.1Å; S6-S9 WeakPolarHBondContact O-CB 3.27Å; S6-S9 PolarHBondContact O-N 2.85Å; S6-S9 PolarHBondContact O-OG 3.28Å; V7-S9 PolarHBondContact O-N 2.75Å; S9-C12 WeakPolarHBondContact O-CB 3.43Å
10	T	39	Very low	39.1	Very low	32 Å²	32	81.6 Å²	81.6	20%	0.196	45%	0.453	C	S	.	.	H	α-helix	trans	-77.4	-29.7	166.1	11.9	0	0	0	0	111.9	V7 V8 C12 F13 L14	V7-T10 PolarHBondContact O-N 2.69Å; V7-T10 PolarHBondContact O-OG1 3.16Å; V8-T10 VanDerWaalsContact C-N 3.29Å; V8-T10 PolarHBondContact O-N 3.35Å; T10-C12 VanDerWaalsContact C-N 3.25Å; T10-C12 PolarHBondContact O-N 2.77Å; T10-F13 WeakPolarHBondContact O-CA 3.22Å; T10-F13 VanDerWaalsContact O-CB 3.31Å; T10-F13 WeakPolarHBondContact O-CB 3.45Å; T10-F13 PolarHBondContact O-N 3.46Å; T10-L14 PolarHBondContact O-N 2.75Å
11	G	34.5	Very low	39.4	Very low	12 Å²	12	84 Å²	84	12%	0.124	46%	0.461	C	S	.	.	H	α-helix	trans	-58.8	-32	167.2	0	0	0	0	0	113.7	V7 V8 F13 L14 Q15	V7-G11 PolarHBondContact O-N 2.75Å; V8-G11 CarbonylContact O-C 3.54Å; V8-G11 WeakPolarHBondContact O-CA 2.98Å; V8-G11 PolarHBondContact O-N 3.4Å; G11-F13 PolarHBondContact O-N 2.73Å; G11-L14 PolarHBondContact O-N 3.48Å; G11-Q15 PolarHBondContact O-N 3.42Å; G11-Q15 VanDerWaalsContact O-N 3.13Å
12	C	39.3	Very low	39.7	Very low	81 Å²	81	85 Å²	85	55%	0.547	46%	0.464	S	S	.	.	H	α-helix	trans	-61.7	-27.4	170.1	-78.8	0	0	0	0	112.1	V8 S9 T10 I16	V8-C12 PolarHBondContact O-N 3.39Å; S9-C12 WeakPolarHBondContact O-CB 3.43Å; T10-C12 VanDerWaalsContact C-N 3.25Å; T10-C12 PolarHBondContact O-N 2.77Å; C12-I16 WeakPolarHBondContact O-CG1 3.32Å
13	F	36.2	Very low	40.2	Very low	122 Å²	122	84.6 Å²	84.6	54%	0.535	45%	0.449	S	S	.	.	H	α-helix	trans	-77.1	-30.5	168.8	-92.1	-90.3	0	0	0	113	T10 G11 I16	T10-F13 WeakPolarHBondContact O-CA 3.22Å; T10-F13 VanDerWaalsContact O-CB 3.31Å; T10-F13 WeakPolarHBondContact O-CB 3.45Å; T10-F13 PolarHBondContact O-N 3.46Å; G11-F13 PolarHBondContact O-N 2.73Å; F13-I16 HydrophobicContact CB-CD1 4.25Å; F13-I16 HydrophobicContact CD1-CD1 3.47Å; F13-I16 VanDerWaalsContact CD1-CD1 3.47Å; F13-I16 HydrophobicContact CE1-CD1 3.87Å; F13-I16 HydrophobicContact CG-CD1 3.87Å; F13-I16 WeakPolarHBondContact O-CA 3.03Å; F13-I16 WeakPolarHBondContact O-CB 3.35Å; F13-I16 WeakPolarHBondContact O-CG1 3.48Å; F13-I16 PolarHBondContact O-N 3.48Å
14	L	38.2	Very low	40.9	Very low	32 Å²	32	85.1 Å²	85.1	17%	0.168	45%	0.45	C	S	.	.	H	α-helix	trans	-74.4	-27.1	179.9	-74.5	171.9	0	0	0	114	T10 G11 I16 G17 I105 K106 Y109	T10-L14 PolarHBondContact O-N 2.75Å; G11-L14 PolarHBondContact O-N 3.48Å; L14-I16 PolarHBondContact O-N 2.86Å; L14-G17 PolarHBondContact O-N 2.83Å; L14-I105 HydrophobicContact CD1-CG2 4.31Å; L14-I105 HydrophobicContact CD2-CB 4.39Å; L14-I105 HydrophobicContact CD2-CG2 3.96Å; L14-I105 HydrophobicContact CG-CG2 4.35Å; L14-K106 VanDerWaalsContact CD2-CA 3.48Å; L14-K106 HydrophobicContact CD2-CB 3.71Å; L14-K106 HydrophobicContact CD2-CG 4.3Å; L14-Y109 VanDerWaalsContact CD1-CB 3.41Å; L14-Y109 HydrophobicContact CD1-CD1 3.91Å; L14-Y109 HydrophobicContact CD1-CD2 4.35Å; L14-Y109 HydrophobicContact CD1-CG 3.64Å
15	Q	43.8	Very low	41.5	Very low	146 Å²	146	86 Å²	86	68%	0.682	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-64	-19.9	165.8	-79.2	-170.1	-11.1	0	0	112.6	G11 G17 N18 K19	G11-Q15 PolarHBondContact O-N 3.42Å; G11-Q15 VanDerWaalsContact O-N 3.13Å; Q15-G17 VanDerWaalsContact C-N 3.34Å; Q15-G17 PolarHBondContact O-N 3.41Å; Q15-N18 PolarHBondContact O-N 3.2Å; Q15-K19 PolarHBondContact O-N 3.28Å
16	I	39.3	Very low	41.9	Very low	33 Å²	33	86.2 Å²	86.2	17%	0.169	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-68.3	-33.3	-178.8	-56.5	-178.9	0	0	0	111.6	C12 F13 L14 N18 K19 F22	C12-I16 WeakPolarHBondContact O-CG1 3.32Å; F13-I16 HydrophobicContact CB-CD1 4.25Å; F13-I16 HydrophobicContact CD1-CD1 3.47Å; F13-I16 VanDerWaalsContact CD1-CD1 3.47Å; F13-I16 HydrophobicContact CE1-CD1 3.87Å; F13-I16 HydrophobicContact CG-CD1 3.87Å; F13-I16 WeakPolarHBondContact O-CA 3.03Å; F13-I16 WeakPolarHBondContact O-CB 3.35Å; F13-I16 WeakPolarHBondContact O-CG1 3.48Å; F13-I16 PolarHBondContact O-N 3.48Å; L14-I16 PolarHBondContact O-N 2.86Å; I16-N18 PolarHBondContact O-N 2.78Å; I16-K19 WeakPolarHBondContact O-CB 3.04Å; I16-K19 PolarHBondContact O-N 2.82Å; I16-F22 HydrophobicContact CB-CE2 4.43Å; I16-F22 HydrophobicContact CG2-CD1 4.44Å; I16-F22 HydrophobicContact CG2-CD2 3.16Å; I16-F22 HydrophobicContact CG2-CE1 4.25Å; I16-F22 HydrophobicContact CG2-CE2 2.92Å; I16-F22 HydrophobicContact CG2-CG 3.94Å; I16-F22 HydrophobicContact CG2-CZ 3.51Å
17	G	38.8	Very low	42.8	Very low	41 Å²	41	89.7 Å²	89.7	42%	0.423	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-62.4	-26.6	176.6	0	0	0	0	0	113.9	L14 Q15	L14-G17 PolarHBondContact O-N 2.83Å; Q15-G17 VanDerWaalsContact C-N 3.34Å; Q15-G17 PolarHBondContact O-N 3.41Å
18	N	42.4	Very low	43.5	Very low	107 Å²	107	93.7 Å²	93.7	57%	0.572	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-97.9	-5	174.9	-94.6	-10.1	0	0	0	113.6	Q15 I16 P20	Q15-N18 PolarHBondContact O-N 3.2Å; I16-N18 PolarHBondContact O-N 2.78Å; N18-P20 WeakPolarHBondContact O-CD 3.49Å
19	K	43	Very low	44.1	Very low	100 Å²	100	94.6 Å²	94.6	44%	0.435	47%	0.472	S	S	.	.	S	Bend	trans	-62.1	127.6	173.7	-80.1	-171.7	175.8	-174.9	0	108	Q15 I16 E21 F22	Q15-K19 PolarHBondContact O-N 3.28Å; I16-K19 WeakPolarHBondContact O-CB 3.04Å; I16-K19 PolarHBondContact O-N 2.82Å; K19-E21 PolarHBondContact O-N 3.2Å; K19-F22 PolarHBondContact O-N 2.79Å
20	P	50.6	Low	44.8	Very low	91 Å²	91	94.2 Å²	94.2	59%	0.591	46%	0.463	S	S	*	.	H	α-helix	trans	-53.4	-25.3	177.9	11.4	-22.1	0	0	0	112.3	N18 F22 R23 K24	N18-P20 WeakPolarHBondContact O-CD 3.49Å; P20-F22 PolarHBondContact O-N 3.36Å; P20-R23 PolarHBondContact O-N 3.46Å; P20-K24 VanDerWaalsContact O-CB 3.27Å; P20-K24 WeakPolarHBondContact O-CB 3.05Å; P20-K24 VanDerWaalsContact O-CG 3.22Å; P20-K24 WeakPolarHBondContact O-CG 3.35Å; P20-K24 PolarHBondContact O-N 2.99Å
21	E	44.7	Very low	45.6	Very low	132 Å²	132	94.9 Å²	94.9	62%	0.617	47%	0.469	S	S	*	.	H	α-helix	trans	-58	-40.1	172.6	-65.8	-175.5	162.5	0	0	114.2	K19 K24 L25	K19-E21 PolarHBondContact O-N 3.2Å; E21-K24 CarbonylContact O-C 3.58Å; E21-K24 WeakPolarHBondContact O-CB 3.45Å; E21-K24 PolarHBondContact O-N 3.49Å; E21-L25 WeakPolarHBondContact O-CB 3.46Å; E21-L25 PolarHBondContact O-N 3.03Å
22	F	42	Very low	46.4	Very low	92 Å²	92	101.7 Å²	101.7	40%	0.404	49%	0.491	S	S	.	.	H	α-helix	trans	-78.3	-35.4	179.7	-92.1	-98.7	0	0	0	112.7	I16 K19 P20 K24 L25 R26	I16-F22 HydrophobicContact CB-CE2 4.43Å; I16-F22 HydrophobicContact CG2-CD1 4.44Å; I16-F22 HydrophobicContact CG2-CD2 3.16Å; I16-F22 HydrophobicContact CG2-CE1 4.25Å; I16-F22 HydrophobicContact CG2-CE2 2.92Å; I16-F22 HydrophobicContact CG2-CG 3.94Å; I16-F22 HydrophobicContact CG2-CZ 3.51Å; K19-F22 PolarHBondContact O-N 2.79Å; P20-F22 PolarHBondContact O-N 3.36Å; F22-K24 VanDerWaalsContact C-N 3.31Å; F22-L25 PolarHBondContact O-N 3.19Å; F22-R26 WeakPolarHBondContact O-CB 3.33Å; F22-R26 PolarHBondContact O-N 2.66Å
23	R	49.5	Very low	46.9	Very low	163 Å²	163	103.6 Å²	103.6	62%	0.615	49%	0.487	S	S	*	.	H	α-helix	trans	-61.6	-43.5	168.1	-82.2	-172.1	-165.6	164.1	6.3	110.8	P20 L25 R26 Q27	P20-R23 PolarHBondContact O-N 3.46Å; R23-L25 VanDerWaalsContact C-N 3.35Å; R23-R26 PolarHBondContact O-N 3.03Å; R23-Q27 WeakPolarHBondContact O-CB 3.37Å; R23-Q27 WeakPolarHBondContact O-CG 3.46Å; R23-Q27 PolarHBondContact O-N 3.21Å
24	K	51.3	Low	47.7	Very low	143 Å²	143	105.4 Å²	105.4	62%	0.622	49%	0.491	S	S	*	.	H	α-helix	trans	-60.3	-44.7	172.7	-78.2	177.4	179.3	-176.1	0	110.6	P20 E21 F22 Q27 H28	P20-K24 VanDerWaalsContact O-CB 3.27Å; P20-K24 WeakPolarHBondContact O-CB 3.05Å; P20-K24 VanDerWaalsContact O-CG 3.22Å; P20-K24 WeakPolarHBondContact O-CG 3.35Å; P20-K24 PolarHBondContact O-N 2.99Å; E21-K24 CarbonylContact O-C 3.58Å; E21-K24 WeakPolarHBondContact O-CB 3.45Å; E21-K24 PolarHBondContact O-N 3.49Å; F22-K24 VanDerWaalsContact C-N 3.31Å; K24-Q27 CarbonylContact O-C 3.57Å; K24-Q27 PolarHBondContact O-N 3.38Å; K24-H28 WeakPolarHBondContact O-CA 3.22Å; K24-H28 WeakPolarHBondContact O-CB 3.29Å; K24-H28 PolarHBondContact O-N 3.1Å
25	L	48.8	Very low	48.5	Very low	91 Å²	91	110.5 Å²	110.5	48%	0.476	51%	0.513	S	S	.	.	H	α-helix	trans	-63.7	-43.3	178.6	-161.3	80.4	0	0	0	111.7	E21 F22 R23 H28 L29	E21-L25 WeakPolarHBondContact O-CB 3.46Å; E21-L25 PolarHBondContact O-N 3.03Å; F22-L25 PolarHBondContact O-N 3.19Å; R23-L25 VanDerWaalsContact C-N 3.35Å; L25-H28 CarbonylContact O-C 3.59Å; L25-H28 PolarHBondContact O-N 3.31Å; L25-L29 HydrophobicContact CG-CD1 4.42Å; L25-L29 WeakPolarHBondContact O-CB 3.33Å; L25-L29 WeakPolarHBondContact O-CG 3.25Å; L25-L29 PolarHBondContact O-N 3.41Å
26	R	46.7	Very low	48.7	Very low	156 Å²	156	106.3 Å²	106.3	59%	0.589	50%	0.495	S	S	*	.	H	α-helix	trans	-62.2	-48.4	174	-172.8	-178.1	-177.1	-167.9	3.4	111	F22 R23 H28 L29 I30	F22-R26 WeakPolarHBondContact O-CB 3.33Å; F22-R26 PolarHBondContact O-N 2.66Å; R23-R26 PolarHBondContact O-N 3.03Å; R26-H28 VanDerWaalsContact C-N 3.26Å; R26-H28 PolarHBondContact O-N 2.77Å; R26-L29 PolarHBondContact O-N 2.76Å; R26-I30 HydrophobicContact CG-CD1 3.99Å; R26-I30 WeakPolarHBondContact O-CB 3.4Å; R26-I30 VanDerWaalsContact O-CG1 3.24Å; R26-I30 WeakPolarHBondContact O-CG1 3.44Å; R26-I30 PolarHBondContact O-N 2.9Å
27	Q	55.4	Low	49.1	Very low	133 Å²	133	108.4 Å²	108.4	62%	0.621	51%	0.507	S	S	*	.	H	α-helix	trans	-62.6	-35.6	175.7	-77.2	-178.4	-16.4	0	0	112	R23 K24 S31	R23-Q27 WeakPolarHBondContact O-CB 3.37Å; R23-Q27 WeakPolarHBondContact O-CG 3.46Å; R23-Q27 PolarHBondContact O-N 3.21Å; K24-Q27 CarbonylContact O-C 3.57Å; K24-Q27 PolarHBondContact O-N 3.38Å; Q27-S31 VanDerWaalsContact O-CB 3.22Å; Q27-S31 WeakPolarHBondContact O-CB 3.46Å; Q27-S31 PolarHBondContact O-N 3.05Å; Q27-S31 PolarHBondContact O-OG 3.45Å
28	H	54.5	Low	49.8	Very low	109 Å²	109	113.9 Å²	113.9	51%	0.505	52%	0.519	S	S	.	.	H	α-helix	trans	-73.8	-37.8	178.9	-163.8	74.4	0	0	0	111.2	K24 L25 R26 S31 R32	K24-H28 WeakPolarHBondContact O-CA 3.22Å; K24-H28 WeakPolarHBondContact O-CB 3.29Å; K24-H28 PolarHBondContact O-N 3.1Å; L25-H28 CarbonylContact O-C 3.59Å; L25-H28 PolarHBondContact O-N 3.31Å; R26-H28 VanDerWaalsContact C-N 3.26Å; R26-H28 PolarHBondContact O-N 2.77Å; H28-S31 PolarHBondContact O-N 2.73Å; H28-S31 PolarHBondContact O-OG 2.84Å; H28-R32 WeakPolarHBondContact O-CA 3.43Å; H28-R32 WeakPolarHBondContact O-CB 3.31Å; H28-R32 PolarHBondContact O-N 3.15Å
29	L	49.6	Very low	50.3	Low	93 Å²	93	111 Å²	111	49%	0.487	51%	0.51	S	S	.	.	H	α-helix	trans	-65.3	-45.1	170.9	-79.9	165.7	0	0	0	110.6	L25 R26 R32 W33	L25-L29 HydrophobicContact CG-CD1 4.42Å; L25-L29 WeakPolarHBondContact O-CB 3.33Å; L25-L29 WeakPolarHBondContact O-CG 3.25Å; L25-L29 PolarHBondContact O-N 3.41Å; R26-L29 PolarHBondContact O-N 2.76Å; L29-R32 PolarHBondContact O-N 3.47Å; L29-W33 VanDerWaalsContact O-CB 3.24Å; L29-W33 WeakPolarHBondContact O-CB 3.24Å; L29-W33 PolarHBondContact O-N 3.49Å
30	I	53.6	Low	50.6	Low	69 Å²	69	110.1 Å²	110.1	35%	0.354	50%	0.504	S	S	.	.	H	α-helix	trans	-63.1	-42.9	174.7	-68.5	167	0	0	0	110.8	R26 W33 R34	R26-I30 HydrophobicContact CG-CD1 3.99Å; R26-I30 WeakPolarHBondContact O-CB 3.4Å; R26-I30 VanDerWaalsContact O-CG1 3.24Å; R26-I30 WeakPolarHBondContact O-CG1 3.44Å; R26-I30 PolarHBondContact O-N 2.9Å; I30-W33 PolarHBondContact O-N 2.78Å; I30-R34 WeakPolarHBondContact O-CG 3.49Å; I30-R34 PolarHBondContact O-N 3.11Å
31	S	55.7	Low	50.4	Low	46 Å²	46	109.6 Å²	109.6	32%	0.322	50%	0.499	S	S	.	.	H	α-helix	trans	-69.4	-40.1	179.3	82.9	0	0	0	0	111.1	Q27 H28 W33 R34 H35	Q27-S31 VanDerWaalsContact O-CB 3.22Å; Q27-S31 WeakPolarHBondContact O-CB 3.46Å; Q27-S31 PolarHBondContact O-N 3.05Å; Q27-S31 PolarHBondContact O-OG 3.45Å; H28-S31 PolarHBondContact O-N 2.73Å; H28-S31 PolarHBondContact O-OG 2.84Å; S31-W33 VanDerWaalsContact C-N 3.31Å; S31-R34 PolarHBondContact O-N 2.83Å; S31-H35 VanDerWaalsContact O-CB 3.29Å; S31-H35 WeakPolarHBondContact O-CB 3.38Å; S31-H35 PolarHBondContact O-N 2.79Å
32	R	51.6	Low	50.8	Low	155 Å²	155	104.6 Å²	104.6	59%	0.585	48%	0.483	S	S	*	.	H	α-helix	trans	-67.7	-34.5	176	-170.8	171.5	178.8	149.3	-1.5	110.7	H28 L29 H35 L36	H28-R32 WeakPolarHBondContact O-CA 3.43Å; H28-R32 WeakPolarHBondContact O-CB 3.31Å; H28-R32 PolarHBondContact O-N 3.15Å; L29-R32 PolarHBondContact O-N 3.47Å; R32-H35 PolarHBondContact O-N 2.55Å; R32-L36 HydrophobicContact CG-CD1 4.18Å; R32-L36 VanDerWaalsContact O-CB 3.25Å; R32-L36 WeakPolarHBondContact O-CB 3.39Å; R32-L36 WeakPolarHBondContact O-CG 3.2Å; R32-L36 PolarHBondContact O-N 3.37Å
33	W	48.3	Very low	51.4	Low	122 Å²	122	105.1 Å²	105.1	46%	0.462	49%	0.49	S	S	.	.	H	α-helix	trans	-67.6	-49.3	171.1	-163.3	76.5	0	0	0	111.1	L29 I30 S31 H35 L36 D37 L92	L29-W33 VanDerWaalsContact O-CB 3.24Å; L29-W33 WeakPolarHBondContact O-CB 3.24Å; L29-W33 PolarHBondContact O-N 3.49Å; I30-W33 PolarHBondContact O-N 2.78Å; S31-W33 VanDerWaalsContact C-N 3.31Å; W33-H35 PolarHBondContact O-N 2.8Å; W33-L36 PolarHBondContact O-N 2.91Å; W33-L36 VanDerWaalsContact O-N 3.15Å; W33-D37 WeakPolarHBondContact O-CB 3.39Å; W33-D37 PolarHBondContact O-N 2.78Å; W33-L92 VanDerWaalsContact CD1-CD1 3.49Å; W33-L92 HydrophobicContact CG-CD1 4.23Å; W33-L92 VanDerWaalsContact NE1-CD1 3.28Å
34	R	54.7	Low	51.3	Low	160 Å²	160	100 Å²	100	60%	0.604	48%	0.475	S	S	*	.	H	α-helix	trans	-58.7	-35	172.5	-74.1	-175.3	-153.7	158.6	3.9	112.7	I30 S31 K38	I30-R34 WeakPolarHBondContact O-CG 3.49Å; I30-R34 PolarHBondContact O-N 3.11Å; S31-R34 PolarHBondContact O-N 2.83Å; R34-K38 VanDerWaalsContact O-CB 3.25Å; R34-K38 WeakPolarHBondContact O-CB 3.25Å; R34-K38 WeakPolarHBondContact O-CG 3.21Å; R34-K38 PolarHBondContact O-N 2.97Å
35	H	53.4	Low	51.4	Low	138 Å²	138	94.8 Å²	94.8	64%	0.639	46%	0.462	S	S	*	.	H	α-helix	trans	-72.3	-41.7	176	-106.8	-74.6	0	0	0	111.8	S31 R32 W33 A39	S31-H35 VanDerWaalsContact O-CB 3.29Å; S31-H35 WeakPolarHBondContact O-CB 3.38Å; S31-H35 PolarHBondContact O-N 2.79Å; R32-H35 PolarHBondContact O-N 2.55Å; W33-H35 PolarHBondContact O-N 2.8Å; H35-A39 WeakPolarHBondContact O-CA 3.46Å; H35-A39 WeakPolarHBondContact O-CB 3.34Å; H35-A39 PolarHBondContact O-N 3.15Å
36	L	49.1	Very low	51.9	Low	59 Å²	59	95.1 Å²	95.1	31%	0.309	46%	0.464	S	S	.	.	H	α-helix	trans	-65.5	-42.8	174.8	-87.9	159.6	0	0	0	110.9	R32 W33 R40	R32-L36 HydrophobicContact CG-CD1 4.18Å; R32-L36 VanDerWaalsContact O-CB 3.25Å; R32-L36 WeakPolarHBondContact O-CB 3.39Å; R32-L36 WeakPolarHBondContact O-CG 3.2Å; R32-L36 PolarHBondContact O-N 3.37Å; W33-L36 PolarHBondContact O-N 2.91Å; W33-L36 VanDerWaalsContact O-N 3.15Å; L36-R40 WeakPolarHBondContact O-CB 3.22Å; L36-R40 WeakPolarHBondContact O-CG 3.16Å; L36-R40 PolarHBondContact O-N 3.38Å
37	D	48.1	Very low	52.1	Low	77 Å²	77	90.3 Å²	90.3	41%	0.412	45%	0.454	S	S	.	.	H	α-helix	trans	-59.5	-56.4	174.5	-173.2	43.6	0	0	0	109.3	W33 A39 T41	W33-D37 WeakPolarHBondContact O-CB 3.39Å; W33-D37 PolarHBondContact O-N 2.78Å; D37-A39 PolarHBondContact O-N 3.3Å; D37-T41 WeakPolarHBondContact O-CB 3.28Å; D37-T41 WeakPolarHBondContact O-CG2 3.38Å; D37-T41 PolarHBondContact O-N 3.24Å; D37-T41 PolarHBondContact O-OG1 3.13Å
38	K	53.3	Low	51.9	Low	156 Å²	156	87.7 Å²	87.7	68%	0.678	44%	0.444	S	S	*	.	H	α-helix	trans	-61.5	-44.3	176.5	-81.1	-174.4	173.8	-173.3	0	114.5	R34 G42	R34-K38 VanDerWaalsContact O-CB 3.25Å; R34-K38 WeakPolarHBondContact O-CB 3.25Å; R34-K38 WeakPolarHBondContact O-CG 3.21Å; R34-K38 PolarHBondContact O-N 2.97Å; K38-G42 WeakPolarHBondContact O-CA 3.2Å; K38-G42 PolarHBondContact O-N 3.47Å
39	A	52.1	Low	51.9	Low	46 Å²	46	89 Å²	89	38%	0.38	45%	0.448	S	S	.	.	H	α-helix	trans	-69.6	-46	-176.9	0	0	0	0	0	110.4	H35 D37 G42 D43	H35-A39 WeakPolarHBondContact O-CA 3.46Å; H35-A39 WeakPolarHBondContact O-CB 3.34Å; H35-A39 PolarHBondContact O-N 3.15Å; D37-A39 PolarHBondContact O-N 3.3Å; A39-G42 PolarHBondContact O-N 3.45Å; A39-D43 VanDerWaalsContact O-CB 3.25Å; A39-D43 WeakPolarHBondContact O-CB 3.24Å; A39-D43 PolarHBondContact O-N 2.94Å
40	R	50	Low	52.2	Low	81 Å²	81	90.8 Å²	90.8	31%	0.306	45%	0.454	S	S	.	.	H	α-helix	trans	-76	-38.6	179.7	-70.3	-173.1	173.6	-169.3	-2.3	113.2	L36 G42 L44	L36-R40 WeakPolarHBondContact O-CB 3.22Å; L36-R40 WeakPolarHBondContact O-CG 3.16Å; L36-R40 PolarHBondContact O-N 3.38Å; R40-G42 VanDerWaalsContact C-N 3.28Å; R40-L44 WeakPolarHBondContact O-CA 3.24Å; R40-L44 WeakPolarHBondContact O-CB 3.16Å; R40-L44 PolarHBondContact O-N 2.84Å
41	T	46.6	Very low	52.3	Low	80 Å²	80	91.9 Å²	91.9	49%	0.491	45%	0.454	S	S	.	.	H	α-helix	trans	-67.3	-33.7	173	57.4	0	0	0	0	111.3	D37 G45	D37-T41 WeakPolarHBondContact O-CB 3.28Å; D37-T41 WeakPolarHBondContact O-CG2 3.38Å; D37-T41 PolarHBondContact O-N 3.24Å; D37-T41 PolarHBondContact O-OG1 3.13Å; T41-G45 WeakPolarHBondContact O-CA 3.33Å; T41-G45 PolarHBondContact O-N 2.94Å
42	G	53.3	Low	52	Low	28 Å²	28	97.4 Å²	97.4	29%	0.289	47%	0.468	S	S	.	.	H	α-helix	trans	-67.3	-50.2	173	0	0	0	0	0	112.7	K38 A39 R40 G45 N46	K38-G42 WeakPolarHBondContact O-CA 3.2Å; K38-G42 PolarHBondContact O-N 3.47Å; A39-G42 PolarHBondContact O-N 3.45Å; R40-G42 VanDerWaalsContact C-N 3.28Å; G42-G45 PolarHBondContact O-N 3.42Å; G42-N46 VanDerWaalsContact O-CB 3.28Å; G42-N46 WeakPolarHBondContact O-CB 3.42Å; G42-N46 PolarHBondContact O-N 2.87Å; G42-N46 PolarHBondContact O-ND2 2.74Å
43	D	53.8	Low	52.2	Low	102 Å²	102	96.1 Å²	96.1	55%	0.545	47%	0.469	S	S	.	.	H	α-helix	trans	-67.7	-40	179.3	-69.7	-18.4	0	0	0	111.7	A39 S47	A39-D43 VanDerWaalsContact O-CB 3.25Å; A39-D43 WeakPolarHBondContact O-CB 3.24Å; A39-D43 PolarHBondContact O-N 2.94Å; D43-S47 VanDerWaalsContact O-CB 3.24Å; D43-S47 WeakPolarHBondContact O-CB 3.43Å; D43-S47 PolarHBondContact O-N 2.76Å; D43-S47 PolarHBondContact O-OG 3.3Å
44	L	48.4	Very low	52.6	Low	57 Å²	57	95.7 Å²	95.7	30%	0.298	48%	0.48	S	S	.	.	H	α-helix	trans	-67.2	-43.5	173.6	-172.6	67.4	0	0	0	110.7	R40 N46 S47 L48 I81	R40-L44 WeakPolarHBondContact O-CA 3.24Å; R40-L44 WeakPolarHBondContact O-CB 3.16Å; R40-L44 PolarHBondContact O-N 2.84Å; L44-N46 VanDerWaalsContact C-N 3.35Å; L44-N46 PolarHBondContact O-N 3.26Å; L44-S47 PolarHBondContact O-N 2.91Å; L44-L48 HydrophobicContact CD1-CD1 4.49Å; L44-L48 HydrophobicContact CG-CD1 4Å; L44-L48 VanDerWaalsContact O-CB 3.24Å; L44-L48 WeakPolarHBondContact O-CB 3.43Å; L44-L48 VanDerWaalsContact O-CG 3.25Å; L44-L48 WeakPolarHBondContact O-CG 3.38Å; L44-L48 PolarHBondContact O-N 3.4Å; L44-I81 HydrophobicContact CD1-CD1 3.62Å; L44-I81 HydrophobicContact CD2-CD1 4.41Å
45	G	52.3	Low	52.3	Low	33 Å²	33	93.4 Å²	93.4	34%	0.34	48%	0.479	S	S	.	.	H	α-helix	trans	-61.3	-42.7	175.8	0	0	0	0	0	111.9	T41 G42 K49	T41-G45 WeakPolarHBondContact O-CA 3.33Å; T41-G45 PolarHBondContact O-N 2.94Å; G42-G45 PolarHBondContact O-N 3.42Å; G45-K49 WeakPolarHBondContact O-CB 2.95Å; G45-K49 PolarHBondContact O-N 3.08Å
46	N	58.5	Low	52	Low	97 Å²	97	89.7 Å²	89.7	52%	0.519	47%	0.468	S	S	.	.	H	α-helix	trans	-69.4	-44.4	176.3	-71.1	-22.3	0	0	0	111.7	G42 L44 L48 K49 E50	G42-N46 VanDerWaalsContact O-CB 3.28Å; G42-N46 WeakPolarHBondContact O-CB 3.42Å; G42-N46 PolarHBondContact O-N 2.87Å; G42-N46 PolarHBondContact O-ND2 2.74Å; L44-N46 VanDerWaalsContact C-N 3.35Å; L44-N46 PolarHBondContact O-N 3.26Å; N46-L48 PolarHBondContact O-N 3.41Å; N46-K49 CarbonylContact O-C 3.6Å; N46-K49 PolarHBondContact O-N 2.88Å; N46-K49 VanDerWaalsContact O-N 3.11Å; N46-E50 WeakPolarHBondContact O-CB 3.22Å; N46-E50 PolarHBondContact O-N 3.33Å
47	S	51	Low	51.9	Low	56 Å²	56	90.9 Å²	90.9	39%	0.392	48%	0.482	S	S	.	.	H	α-helix	trans	-63.2	-41.2	177.2	-61.6	0	0	0	0	111.8	D43 L44 K49 R51	D43-S47 VanDerWaalsContact O-CB 3.24Å; D43-S47 WeakPolarHBondContact O-CB 3.43Å; D43-S47 PolarHBondContact O-N 2.76Å; D43-S47 PolarHBondContact O-OG 3.3Å; L44-S47 PolarHBondContact O-N 2.91Å; S47-K49 VanDerWaalsContact C-N 3.35Å; S47-R51 WeakPolarHBondContact O-CB 3.25Å; S47-R51 WeakPolarHBondContact O-CG 3.5Å; S47-R51 PolarHBondContact O-N 3.5Å
48	L	51.3	Low	51.7	Low	77 Å²	77	92.5 Å²	92.5	40%	0.403	50%	0.497	S	S	.	.	H	α-helix	trans	-64.2	-40.1	172.5	-77	168.4	0	0	0	111.1	L44 N46 Y52 L74	L44-L48 HydrophobicContact CD1-CD1 4.49Å; L44-L48 HydrophobicContact CG-CD1 4Å; L44-L48 VanDerWaalsContact O-CB 3.24Å; L44-L48 WeakPolarHBondContact O-CB 3.43Å; L44-L48 VanDerWaalsContact O-CG 3.25Å; L44-L48 WeakPolarHBondContact O-CG 3.38Å; L44-L48 PolarHBondContact O-N 3.4Å; N46-L48 PolarHBondContact O-N 3.41Å; L48-Y52 WeakPolarHBondContact O-CB 3.33Å; L48-Y52 PolarHBondContact O-N 3.04Å; L48-L74 HydrophobicContact CD2-CD2 4.42Å
49	K	54.7	Low	51.3	Low	138 Å²	138	91.7 Å²	91.7	60%	0.6	50%	0.5	S	S	*	.	H	α-helix	trans	-70.4	-41.5	-179.3	-159.2	178.1	-168.9	-176.9	0	112.5	G45 N46 S47 Q53	G45-K49 WeakPolarHBondContact O-CB 2.95Å; G45-K49 PolarHBondContact O-N 3.08Å; N46-K49 CarbonylContact O-C 3.6Å; N46-K49 PolarHBondContact O-N 2.88Å; N46-K49 VanDerWaalsContact O-N 3.11Å; S47-K49 VanDerWaalsContact C-N 3.35Å; K49-Q53 WeakPolarHBondContact O-CG 3.14Å; K49-Q53 PolarHBondContact O-N 2.95Å
50	E	56.9	Low	50.9	Low	130 Å²	130	96.7 Å²	96.7	61%	0.607	52%	0.52	S	S	*	.	H	α-helix	trans	-63.8	-46.7	172.8	-79.1	-177	168.5	0	0	110.9	N46 Y52 Q53 V54	N46-E50 WeakPolarHBondContact O-CB 3.22Å; N46-E50 PolarHBondContact O-N 3.33Å; E50-Y52 PolarHBondContact O-N 2.78Å; E50-Q53 WeakPolarHBondContact O-CB 3.39Å; E50-Q53 PolarHBondContact O-N 2.88Å; E50-V54 WeakPolarHBondContact O-CG2 3.37Å; E50-V54 PolarHBondContact O-N 3.45Å
51	R	54.9	Low	50.8	Low	91 Å²	91	100.6 Å²	100.6	34%	0.343	55%	0.547	S	S	.	.	H	α-helix	trans	-69.5	-33.3	178.1	-70.6	-172.9	-170.6	-170	12.2	112.6	S47 Q53 V54 L55 E77	S47-R51 WeakPolarHBondContact O-CB 3.25Å; S47-R51 WeakPolarHBondContact O-CG 3.5Å; S47-R51 PolarHBondContact O-N 3.5Å; R51-Q53 VanDerWaalsContact C-N 3.33Å; R51-V54 WeakPolarHBondContact O-CB 3.45Å; R51-V54 PolarHBondContact O-N 2.83Å; R51-L55 WeakPolarHBondContact O-CG 3.26Å; R51-L55 PolarHBondContact O-N 2.79Å; R51-E77 IonicContact NH2-OE2 3.71Å
52	Y	50.2	Low	50.8	Low	162 Å²	162	105 Å²	105	64%	0.635	56%	0.562	S	S	*	*	H	α-helix	trans	-66	-35.8	171.7	-164.3	-88.6	0	0	0	111.5	L48 E50 V54 L55 S56	L48-Y52 WeakPolarHBondContact O-CB 3.33Å; L48-Y52 PolarHBondContact O-N 3.04Å; E50-Y52 PolarHBondContact O-N 2.78Å; Y52-V54 VanDerWaalsContact C-N 3.34Å; Y52-L55 CarbonylContact O-C 3.51Å; Y52-L55 PolarHBondContact O-N 3.25Å; Y52-S56 WeakPolarHBondContact CD1-OG 3.48Å; Y52-S56 WeakPolarHBondContact CE1-OG 3.25Å; Y52-S56 WeakPolarHBondContact O-CB 3.38Å; Y52-S56 PolarHBondContact O-N 3.32Å; Y52-S56 PolarHBondContact O-OG 3.47Å
53	Q	55.2	Low	50.3	Low	128 Å²	128	112.1 Å²	112.1	60%	0.598	59%	0.585	S	S	*	*	H	α-helix	trans	-64.2	-38.4	171.8	-78.5	177	-9.8	0	0	112	K49 E50 R51 L55 S56 S57	K49-Q53 WeakPolarHBondContact O-CG 3.14Å; K49-Q53 PolarHBondContact O-N 2.95Å; E50-Q53 WeakPolarHBondContact O-CB 3.39Å; E50-Q53 PolarHBondContact O-N 2.88Å; R51-Q53 VanDerWaalsContact C-N 3.33Å; Q53-L55 VanDerWaalsContact C-N 3.33Å; Q53-S56 PolarHBondContact O-N 2.83Å; Q53-S57 PolarHBondContact O-N 2.96Å
54	V	56.1	Low	50	Low	114 Å²	114	111.7 Å²	111.7	69%	0.691	59%	0.588	S	S	*	*	H	α-helix	trans	-63.6	-39.5	172.4	176.2	0	0	0	0	111.2	E50 R51 Y52	E50-V54 WeakPolarHBondContact O-CG2 3.37Å; E50-V54 PolarHBondContact O-N 3.45Å; R51-V54 WeakPolarHBondContact O-CB 3.45Å; R51-V54 PolarHBondContact O-N 2.83Å; Y52-V54 VanDerWaalsContact C-N 3.34Å
55	L	48.9	Very low	50.2	Low	112 Å²	112	117.8 Å²	117.8	59%	0.586	62%	0.62	S	S	*	*	H	α-helix	trans	-75.2	-22.2	176.8	-72.1	167.2	0	0	0	114.2	R51 Y52 Q53 M67	R51-L55 WeakPolarHBondContact O-CG 3.26Å; R51-L55 PolarHBondContact O-N 2.79Å; Y52-L55 CarbonylContact O-C 3.51Å; Y52-L55 PolarHBondContact O-N 3.25Å; Q53-L55 VanDerWaalsContact C-N 3.33Å; L55-M67 HydrophobicContact CD2-CE 3.64Å; L55-M67 HydrophobicContact CD2-SD 3.79Å
56	S	46.6	Very low	50.3	Low	59 Å²	59	118 Å²	118	41%	0.413	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.7	4.1	-174.9	-53.1	0	0	0	0	113.8	Y52 Q53 P58	Y52-S56 WeakPolarHBondContact CD1-OG 3.48Å; Y52-S56 WeakPolarHBondContact CE1-OG 3.25Å; Y52-S56 WeakPolarHBondContact O-CB 3.38Å; Y52-S56 PolarHBondContact O-N 3.32Å; Y52-S56 PolarHBondContact O-OG 3.47Å; Q53-S56 PolarHBondContact O-N 2.83Å; S56-P58 WeakPolarHBondContact O-CD 3.24Å
57	S	47.3	Very low	49.9	Very low	84 Å²	84	117.7 Å²	117.7	59%	0.587	62%	0.619	S	S	*	*			trans	-68.9	110	171.6	175.7	0	0	0	0	108.9	Q53 D59	Q53-S57 PolarHBondContact O-N 2.96Å; S57-D59 PolarHBondContact O-N 3.25Å
58	P	44.4	Very low	49.9	Very low	112 Å²	112	117.8 Å²	117.8	73%	0.727	63%	0.628	S	S	*	*			trans	-93.1	82.1	-177.6	33.6	-20.9	0	0	0	107.9	S56	S56-P58 WeakPolarHBondContact O-CD 3.24Å
59	D	45.6	Very low	50.2	Low	139 Å²	139	117.2 Å²	117.2	74%	0.743	63%	0.63	S	S	*	*			trans	-161.3	128	161.5	-88.2	-34.9	0	0	0	110.1	S57	S57-D59 PolarHBondContact O-N 3.25Å
60	D	41.8	Very low	50.2	Low	151 Å²	151	116.2 Å²	116.2	81%	0.807	63%	0.629	S	S	*	*			trans	83.9	120.4	158.9	-59	-30.8	0	0	0	121.9	E62	D60-E62 PolarHBondContact O-N 3.24Å
61	D	48.3	Very low	50.1	Low	162 Å²	162	112.9 Å²	112.9	87%	0.866	62%	0.624	S	S	*	*	S	Bend	trans	-63.3	38.4	-174.7	-74.8	-51.5	0	0	0	116.8
62	E	47.4	Very low	50.4	Low	174 Å²	174	111.4 Å²	111.4	81%	0.813	63%	0.628	S	S	*	*			trans	-114.7	76.6	166.7	-77	-169	163.8	0	0	110.3	D60 P64	D60-E62 PolarHBondContact O-N 3.24Å; E62-P64 WeakPolarHBondContact O-CD 2.98Å; E62-P64 WeakPolarHBondContact O-CG 3.49Å
63	F	42	Very low	51	Low	176 Å²	176	108.7 Å²	108.7	77%	0.772	62%	0.621	S	S	*	*			trans	-60.1	102.8	171.2	-96.6	-91.6	0	0	0	110.2	L65 M67	F63-L65 PolarHBondContact O-N 2.71Å; F63-M67 HydrophobicContact CE1-CE 4.33Å
64	P	48.6	Very low	51.3	Low	94 Å²	94	105.1 Å²	105.1	61%	0.61	61%	0.605	S	S	*	*			trans	-79.2	131.5	-175.9	-4.4	24	0	0	0	108.2	E62 G66 M67	E62-P64 WeakPolarHBondContact O-CD 2.98Å; E62-P64 WeakPolarHBondContact O-CG 3.49Å; P64-G66 PolarHBondContact O-N 3.28Å; P64-M67 PolarHBondContact O-N 3.42Å
65	L	51.8	Low	51.5	Low	185 Å²	185	106.4 Å²	106.4	97%	0.969	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.5	7.1	173.9	-81.1	142	0	0	0	115.4	F63	F63-L65 PolarHBondContact O-N 2.71Å
66	G	53.8	Low	52.4	Low	36 Å²	36	107.2 Å²	107.2	37%	0.371	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.9	-14.4	176.8	0	0	0	0	0	115.7	P64 G68 S69 M70	P64-G66 PolarHBondContact O-N 3.28Å; G66-G68 VanDerWaalsContact C-N 3.28Å; G66-G68 PolarHBondContact O-N 3.32Å; G66-S69 PolarHBondContact O-N 3.46Å; G66-S69 VanDerWaalsContact O-N 3.14Å; G66-S69 PolarHBondContact O-OG 3.35Å; G66-M70 PolarHBondContact O-N 2.93Å
67	M	50.3	Low	53.2	Low	92 Å²	92	109.3 Å²	109.3	45%	0.453	61%	0.61	S	S	.	*	H	α-helix	trans	-61.7	-32.3	-177.7	-87.5	-146.9	-153.6	0	0	113.7	L55 F63 P64 S69 M70 A71	L55-M67 HydrophobicContact CD2-CE 3.64Å; L55-M67 HydrophobicContact CD2-SD 3.79Å; F63-M67 HydrophobicContact CE1-CE 4.33Å; P64-M67 PolarHBondContact O-N 3.42Å; M67-S69 VanDerWaalsContact C-N 3.29Å; M67-S69 PolarHBondContact O-N 3.02Å; M67-M70 PolarHBondContact O-N 3.4Å; M67-A71 WeakPolarHBondContact O-CB 3.37Å; M67-A71 PolarHBondContact O-N 2.96Å
68	G	52.4	Low	53.9	Low	57 Å²	57	109.1 Å²	109.1	59%	0.588	60%	0.602	S	S	*	*	H	α-helix	trans	-62	-36.9	177	0	0	0	0	0	112.8	G66 S72	G66-G68 VanDerWaalsContact C-N 3.28Å; G66-G68 PolarHBondContact O-N 3.32Å; G68-S72 PolarHBondContact O-N 2.85Å
69	S	56.6	Low	54.9	Low	65 Å²	65	110.5 Å²	110.5	46%	0.455	60%	0.596	S	S	.	*	H	α-helix	trans	-69.2	-45.8	175.7	71.6	0	0	0	0	111.6	G66 M67 A71 S72 E73	G66-S69 PolarHBondContact O-N 3.46Å; G66-S69 VanDerWaalsContact O-N 3.14Å; G66-S69 PolarHBondContact O-OG 3.35Å; M67-S69 VanDerWaalsContact C-N 3.29Å; M67-S69 PolarHBondContact O-N 3.02Å; S69-A71 PolarHBondContact O-N 2.94Å; S69-S72 PolarHBondContact O-N 2.92Å; S69-S72 PolarHBondContact O-OG 2.94Å; S69-E73 PolarHBondContact O-N 3.28Å
70	M	54.3	Low	56.1	Low	117 Å²	117	107.8 Å²	107.8	58%	0.576	58%	0.582	S	S	*	*	H	α-helix	trans	-63.7	-40	178.7	-85.1	-164.8	172.6	0	0	113	G66 M67 E73 L74	G66-M70 PolarHBondContact O-N 2.93Å; M67-M70 PolarHBondContact O-N 3.4Å; M70-E73 PolarHBondContact O-N 3.09Å; M70-L74 WeakPolarHBondContact O-CB 3.14Å; M70-L74 PolarHBondContact O-N 2.96Å
71	A	56.1	Low	57	Low	60 Å²	60	102.9 Å²	102.9	50%	0.496	56%	0.555	S	S	.	*	H	α-helix	trans	-64.7	-42.7	175.9	0	0	0	0	0	111.1	M67 S69 L74 E75	M67-A71 WeakPolarHBondContact O-CB 3.37Å; M67-A71 PolarHBondContact O-N 2.96Å; S69-A71 PolarHBondContact O-N 2.94Å; A71-L74 PolarHBondContact O-N 2.96Å; A71-E75 WeakPolarHBondContact O-CB 3.46Å; A71-E75 PolarHBondContact O-N 3.43Å
72	S	61.2	Low	57.5	Low	61 Å²	61	100.7 Å²	100.7	43%	0.427	54%	0.54	S	S	.	.	H	α-helix	trans	-66.6	-37.5	177.5	86.4	0	0	0	0	112.9	G68 S69 E75 M76	G68-S72 PolarHBondContact O-N 2.85Å; S69-S72 PolarHBondContact O-N 2.92Å; S69-S72 PolarHBondContact O-OG 2.94Å; S72-E75 PolarHBondContact O-N 3.12Å; S72-M76 WeakPolarHBondContact O-CB 3.22Å; S72-M76 PolarHBondContact O-N 3.42Å
73	E	62.7	Low	58.4	Low	105 Å²	105	96.5 Å²	96.5	49%	0.491	53%	0.526	S	S	.	.	H	α-helix	trans	-65	-44.1	174.9	-79.1	-178.3	172	0	0	111	S69 M70 E75 M76 E77	S69-E73 PolarHBondContact O-N 3.28Å; M70-E73 PolarHBondContact O-N 3.09Å; E73-E75 VanDerWaalsContact C-N 3.34Å; E73-E75 PolarHBondContact O-N 3.24Å; E73-M76 WeakPolarHBondContact O-CB 3.19Å; E73-M76 PolarHBondContact O-N 3.48Å; E73-E77 PolarHBondContact O-N 3.12Å
74	L	60.4	Low	59.5	Low	52 Å²	52	93.5 Å²	93.5	27%	0.272	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-41.9	176.7	-159.6	95.1	0	0	0	111.4	L48 M70 A71 M76 E77 L78	L48-L74 HydrophobicContact CD2-CD2 4.42Å; M70-L74 WeakPolarHBondContact O-CB 3.14Å; M70-L74 PolarHBondContact O-N 2.96Å; A71-L74 PolarHBondContact O-N 2.96Å; L74-M76 VanDerWaalsContact C-N 3.34Å; L74-E77 PolarHBondContact O-N 3.03Å; L74-L78 HydrophobicContact CD2-CD1 4.19Å; L74-L78 HydrophobicContact CG-CD1 4.35Å; L74-L78 WeakPolarHBondContact O-CB 3.41Å; L74-L78 PolarHBondContact O-N 3.07Å
75	E	60	Low	60	Low	142 Å²	142	93 Å²	93	66%	0.664	50%	0.504	S	S	*	.	H	α-helix	trans	-65	-38.1	176.7	-162	175.8	-169.4	0	0	111.3	A71 S72 E73 K79	A71-E75 WeakPolarHBondContact O-CB 3.46Å; A71-E75 PolarHBondContact O-N 3.43Å; S72-E75 PolarHBondContact O-N 3.12Å; E73-E75 VanDerWaalsContact C-N 3.34Å; E73-E75 PolarHBondContact O-N 3.24Å; E75-K79 VanDerWaalsContact O-CB 3.31Å; E75-K79 WeakPolarHBondContact O-CB 3.44Å; E75-K79 PolarHBondContact O-N 3.02Å
76	M	68	Low	60.2	Low	129 Å²	129	89 Å²	89	64%	0.635	48%	0.483	S	S	*	.	H	α-helix	trans	-63.8	-46.1	172.4	-117.1	-164.3	-49.9	0	0	112.5	S72 E73 L74 K79 D80	S72-M76 WeakPolarHBondContact O-CB 3.22Å; S72-M76 PolarHBondContact O-N 3.42Å; E73-M76 WeakPolarHBondContact O-CB 3.19Å; E73-M76 PolarHBondContact O-N 3.48Å; L74-M76 VanDerWaalsContact C-N 3.34Å; M76-K79 PolarHBondContact O-N 3.45Å; M76-D80 PolarHBondContact O-N 2.92Å
77	E	64.3	Low	60.8	Low	103 Å²	103	90.5 Å²	90.5	48%	0.481	49%	0.488	S	S	.	.	H	α-helix	trans	-63.3	-43.8	177.6	-77.4	-173.3	153.7	0	0	111.4	R51 E73 L74 K79 D80 I81	R51-E77 IonicContact NH2-OE2 3.71Å; E73-E77 PolarHBondContact O-N 3.12Å; L74-E77 PolarHBondContact O-N 3.03Å; E77-K79 VanDerWaalsContact C-N 3.29Å; E77-K79 PolarHBondContact O-N 3.32Å; E77-D80 PolarHBondContact O-N 3.22Å; E77-I81 WeakPolarHBondContact O-CB 3.43Å; E77-I81 VanDerWaalsContact O-CG1 3.26Å; E77-I81 WeakPolarHBondContact O-CG1 3.43Å; E77-I81 PolarHBondContact O-N 3.44Å
78	L	62.2	Low	61.3	Low	80 Å²	80	89.1 Å²	89.1	42%	0.419	48%	0.482	S	S	.	.	H	α-helix	trans	-58.4	-42.1	173.9	-96	150.7	0	0	0	111.5	L74 I81 E82	L74-L78 HydrophobicContact CD2-CD1 4.19Å; L74-L78 HydrophobicContact CG-CD1 4.35Å; L74-L78 WeakPolarHBondContact O-CB 3.41Å; L74-L78 PolarHBondContact O-N 3.07Å; L78-I81 PolarHBondContact O-N 3.39Å; L78-E82 WeakPolarHBondContact O-CB 3.4Å; L78-E82 PolarHBondContact O-N 3.48Å
79	K	66	Low	61.5	Low	140 Å²	140	88.9 Å²	88.9	61%	0.609	48%	0.475	S	S	*	.	H	α-helix	trans	-70.3	-35.9	178.7	-155.5	171.7	-169.9	171.6	0	112.8	E75 M76 E77 T83	E75-K79 VanDerWaalsContact O-CB 3.31Å; E75-K79 WeakPolarHBondContact O-CB 3.44Å; E75-K79 PolarHBondContact O-N 3.02Å; M76-K79 PolarHBondContact O-N 3.45Å; E77-K79 VanDerWaalsContact C-N 3.29Å; E77-K79 PolarHBondContact O-N 3.32Å; K79-T83 WeakPolarHBondContact O-CB 3.03Å; K79-T83 PolarHBondContact O-N 2.89Å; K79-T83 PolarHBondContact O-OG1 2.89Å
80	D	70.4	Confident	61.7	Low	83 Å²	83	88.6 Å²	88.6	44%	0.444	47%	0.472	S	S	.	.	H	α-helix	trans	-63.9	-45.3	170.7	-179.4	66	0	0	0	110.9	M76 E77 E82 T83 R84	M76-D80 PolarHBondContact O-N 2.92Å; E77-D80 PolarHBondContact O-N 3.22Å; D80-E82 PolarHBondContact O-N 3.15Å; D80-T83 PolarHBondContact O-N 3.36Å; D80-R84 WeakPolarHBondContact O-CB 3.49Å; D80-R84 WeakPolarHBondContact O-CG 3.24Å; D80-R84 PolarHBondContact O-N 3.46Å; D80-R84 WeakPolarHBondContact OD2-CD 3.37Å; D80-R84 IonicContact OD2-NH1 3.59Å
81	I	61.2	Low	62.1	Low	47 Å²	47	87 Å²	87	24%	0.241	47%	0.469	C	S	.	.	H	α-helix	trans	-59.9	-48.4	176.2	-69	168.4	0	0	0	110.2	L44 E77 L78 T83 R84 V85	L44-I81 HydrophobicContact CD1-CD1 3.62Å; L44-I81 HydrophobicContact CD2-CD1 4.41Å; E77-I81 WeakPolarHBondContact O-CB 3.43Å; E77-I81 VanDerWaalsContact O-CG1 3.26Å; E77-I81 WeakPolarHBondContact O-CG1 3.43Å; E77-I81 PolarHBondContact O-N 3.44Å; L78-I81 PolarHBondContact O-N 3.39Å; I81-T83 PolarHBondContact O-N 3.13Å; I81-R84 PolarHBondContact O-N 3.38Å; I81-V85 HydrophobicContact CG2-CG2 4.22Å; I81-V85 WeakPolarHBondContact O-CB 3.45Å; I81-V85 VanDerWaalsContact O-CG2 3.26Å; I81-V85 WeakPolarHBondContact O-CG2 3.4Å; I81-V85 PolarHBondContact O-N 2.71Å
82	E	58.6	Low	62.3	Low	117 Å²	117	87 Å²	87	55%	0.547	46%	0.461	S	S	.	.	H	α-helix	trans	-57.3	-49	177.1	-172.3	-179.2	-172.9	0	0	111.1	L78 D80 R84 V85 I86	L78-E82 WeakPolarHBondContact O-CB 3.4Å; L78-E82 PolarHBondContact O-N 3.48Å; D80-E82 PolarHBondContact O-N 3.15Å; E82-R84 VanDerWaalsContact C-N 3.3Å; E82-R84 PolarHBondContact O-N 2.95Å; E82-V85 PolarHBondContact O-N 3.46Å; E82-V85 VanDerWaalsContact O-N 3.17Å; E82-I86 HydrophobicContact CG-CD1 3.94Å; E82-I86 VanDerWaalsContact O-CG1 3.3Å; E82-I86 WeakPolarHBondContact O-CG1 3.14Å; E82-I86 PolarHBondContact O-N 2.89Å
83	T	66	Low	62.3	Low	85 Å²	85	86.6 Å²	86.6	52%	0.521	46%	0.457	S	S	.	.	H	α-helix	trans	-59.4	-41.5	178	-53.6	0	0	0	0	111.5	K79 D80 I81 S87	K79-T83 WeakPolarHBondContact O-CB 3.03Å; K79-T83 PolarHBondContact O-N 2.89Å; K79-T83 PolarHBondContact O-OG1 2.89Å; D80-T83 PolarHBondContact O-N 3.36Å; I81-T83 PolarHBondContact O-N 3.13Å; T83-S87 WeakPolarHBondContact O-CB 3.46Å; T83-S87 PolarHBondContact O-N 3.15Å
84	R	64.7	Low	62.4	Low	113 Å²	113	86 Å²	86	43%	0.426	46%	0.457	S	S	.	.	H	α-helix	trans	-71.3	-35.9	178	-69.7	173	78	-179.3	13.9	112.2	D80 I81 E82 S87 L88	D80-R84 WeakPolarHBondContact O-CB 3.49Å; D80-R84 WeakPolarHBondContact O-CG 3.24Å; D80-R84 PolarHBondContact O-N 3.46Å; D80-R84 WeakPolarHBondContact OD2-CD 3.37Å; D80-R84 IonicContact OD2-NH1 3.59Å; I81-R84 PolarHBondContact O-N 3.38Å; E82-R84 VanDerWaalsContact C-N 3.3Å; E82-R84 PolarHBondContact O-N 2.95Å; R84-S87 PolarHBondContact O-N 3.39Å; R84-L88 WeakPolarHBondContact O-CB 3.25Å; R84-L88 PolarHBondContact O-N 3.14Å
85	V	58.4	Low	62.5	Low	83 Å²	83	85.5 Å²	85.5	50%	0.503	46%	0.46	S	S	.	.	H	α-helix	trans	-65.5	-45.2	173.9	168.7	0	0	0	0	110.2	I81 E82 S87 L88 A89	I81-V85 HydrophobicContact CG2-CG2 4.22Å; I81-V85 WeakPolarHBondContact O-CB 3.45Å; I81-V85 VanDerWaalsContact O-CG2 3.26Å; I81-V85 WeakPolarHBondContact O-CG2 3.4Å; I81-V85 PolarHBondContact O-N 2.71Å; E82-V85 PolarHBondContact O-N 3.46Å; E82-V85 VanDerWaalsContact O-N 3.17Å; V85-S87 VanDerWaalsContact C-N 3.35Å; V85-S87 PolarHBondContact O-N 3.26Å; V85-L88 PolarHBondContact O-N 2.91Å; V85-A89 VanDerWaalsContact O-CB 3.3Å; V85-A89 WeakPolarHBondContact O-CB 3.49Å; V85-A89 PolarHBondContact O-N 3.26Å
86	I	57.5	Low	62.6	Low	102 Å²	102	84.7 Å²	84.7	52%	0.523	46%	0.456	S	S	.	.	H	α-helix	trans	-61	-43.2	174.8	-67.7	167.3	0	0	0	110.8	E82 A89 S90	E82-I86 HydrophobicContact CG-CD1 3.94Å; E82-I86 VanDerWaalsContact O-CG1 3.3Å; E82-I86 WeakPolarHBondContact O-CG1 3.14Å; E82-I86 PolarHBondContact O-N 2.89Å; I86-A89 PolarHBondContact O-N 2.93Å; I86-S90 WeakPolarHBondContact O-CB 3.31Å; I86-S90 PolarHBondContact O-N 3.49Å; I86-S90 PolarHBondContact O-OG 3.48Å; I86-S90 VanDerWaalsContact O-OG 3.09Å
87	S	65.6	Low	62.6	Low	67 Å²	67	82.7 Å²	82.7	47%	0.469	44%	0.441	S	S	.	.	H	α-helix	trans	-63.4	-41.2	175.6	179.2	0	0	0	0	112.7	T83 R84 V85 S90 T91	T83-S87 WeakPolarHBondContact O-CB 3.46Å; T83-S87 PolarHBondContact O-N 3.15Å; R84-S87 PolarHBondContact O-N 3.39Å; V85-S87 VanDerWaalsContact C-N 3.35Å; V85-S87 PolarHBondContact O-N 3.26Å; S87-S90 WeakPolarHBondContact CA-OG 3.45Å; S87-S90 PolarHBondContact O-OG 2.93Å; S87-T91 WeakPolarHBondContact O-CB 3.48Å; S87-T91 PolarHBondContact O-N 3.25Å; S87-T91 PolarHBondContact O-OG1 2.89Å
88	L	61.3	Low	62.9	Low	63 Å²	63	83.8 Å²	83.8	33%	0.33	44%	0.441	S	S	.	.	H	α-helix	trans	-66.8	-43.8	174.8	-98.2	147.9	0	0	0	111.9	R84 V85 T91 L92	R84-L88 WeakPolarHBondContact O-CB 3.25Å; R84-L88 PolarHBondContact O-N 3.14Å; V85-L88 PolarHBondContact O-N 2.91Å; L88-T91 PolarHBondContact O-N 3.2Å; L88-L92 WeakPolarHBondContact O-CB 3.41Å; L88-L92 WeakPolarHBondContact O-CG 3.42Å; L88-L92 PolarHBondContact O-N 3.37Å
89	A	55.5	Low	63.2	Low	53 Å²	53	83.8 Å²	83.8	44%	0.438	44%	0.441	S	S	.	.	H	α-helix	trans	-61.8	-43.7	177.6	0	0	0	0	0	111.4	V85 I86 L92 C93	V85-A89 VanDerWaalsContact O-CB 3.3Å; V85-A89 WeakPolarHBondContact O-CB 3.49Å; V85-A89 PolarHBondContact O-N 3.26Å; I86-A89 PolarHBondContact O-N 2.93Å; A89-L92 PolarHBondContact O-N 3.31Å; A89-C93 WeakPolarHBondContact O-CB 3.36Å; A89-C93 PolarHBondContact O-N 3.3Å
90	S	60.9	Low	63.2	Low	58 Å²	58	81.4 Å²	81.4	41%	0.406	44%	0.435	S	S	.	.	H	α-helix	trans	-64.4	-41.2	174.5	58.9	0	0	0	0	112.2	I86 S87 L92 C93 I94	I86-S90 WeakPolarHBondContact O-CB 3.31Å; I86-S90 PolarHBondContact O-N 3.49Å; I86-S90 PolarHBondContact O-OG 3.48Å; I86-S90 VanDerWaalsContact O-OG 3.09Å; S87-S90 WeakPolarHBondContact CA-OG 3.45Å; S87-S90 PolarHBondContact O-OG 2.93Å; S90-L92 PolarHBondContact O-N 3.43Å; S90-C93 PolarHBondContact O-N 3.37Å; S90-I94 VanDerWaalsContact O-CG1 3.28Å; S90-I94 WeakPolarHBondContact O-CG1 3.31Å; S90-I94 PolarHBondContact O-N 3Å
91	T	63.7	Low	63.3	Low	84 Å²	84	77.5 Å²	77.5	52%	0.515	41%	0.414	S	S	.	.	H	α-helix	trans	-63	-41.6	175.5	-55.2	0	0	0	0	111.8	S87 L88 I94 A95	S87-T91 WeakPolarHBondContact O-CB 3.48Å; S87-T91 PolarHBondContact O-N 3.25Å; S87-T91 PolarHBondContact O-OG1 2.89Å; L88-T91 PolarHBondContact O-N 3.2Å; T91-I94 PolarHBondContact O-N 2.93Å; T91-A95 WeakPolarHBondContact O-CB 3.36Å; T91-A95 PolarHBondContact O-N 3.47Å
92	L	60.3	Low	63.8	Low	61 Å²	61	78.3 Å²	78.3	32%	0.319	42%	0.418	S	S	.	.	H	α-helix	trans	-65.4	-42.9	175.3	-78.1	167.2	0	0	0	111.7	W33 L88 A89 S90 I94 A95 E96	W33-L92 VanDerWaalsContact CD1-CD1 3.49Å; W33-L92 HydrophobicContact CG-CD1 4.23Å; W33-L92 VanDerWaalsContact NE1-CD1 3.28Å; L88-L92 WeakPolarHBondContact O-CB 3.41Å; L88-L92 WeakPolarHBondContact O-CG 3.42Å; L88-L92 PolarHBondContact O-N 3.37Å; A89-L92 PolarHBondContact O-N 3.31Å; S90-L92 PolarHBondContact O-N 3.43Å; L92-I94 VanDerWaalsContact C-N 3.33Å; L92-I94 PolarHBondContact O-N 3.4Å; L92-A95 PolarHBondContact O-N 2.87Å; L92-A95 VanDerWaalsContact O-N 3.13Å; L92-E96 WeakPolarHBondContact O-CB 3.41Å; L92-E96 PolarHBondContact O-N 3.22Å
93	C	60.4	Low	64.4	Low	52 Å²	52	74.4 Å²	74.4	35%	0.351	41%	0.409	S	S	.	.	H	α-helix	trans	-60	-43.5	175.8	-170.5	0	0	0	0	111.2	A89 S90 A95 E96 R97	A89-C93 WeakPolarHBondContact O-CB 3.36Å; A89-C93 PolarHBondContact O-N 3.3Å; S90-C93 PolarHBondContact O-N 3.37Å; C93-A95 PolarHBondContact O-N 2.92Å; C93-E96 PolarHBondContact O-N 2.69Å; C93-R97 WeakPolarHBondContact O-CB 3.38Å; C93-R97 VanDerWaalsContact O-CG 3.23Å; C93-R97 WeakPolarHBondContact O-CG 3.37Å; C93-R97 PolarHBondContact O-N 3.26Å; C93-R97 PolarHBondContact SG-NE 3.33Å; C93-R97 VanDerWaalsContact SG-NE 3.38Å
94	I	64.1	Low	65	Low	93 Å²	93	72 Å²	72	48%	0.477	39%	0.393	S	S	.	.	H	α-helix	trans	-62.7	-42	173.9	-67.2	164.6	0	0	0	111.1	S90 T91 L92 R98	S90-I94 VanDerWaalsContact O-CG1 3.28Å; S90-I94 WeakPolarHBondContact O-CG1 3.31Å; S90-I94 PolarHBondContact O-N 3Å; T91-I94 PolarHBondContact O-N 2.93Å; L92-I94 VanDerWaalsContact C-N 3.33Å; L92-I94 PolarHBondContact O-N 3.4Å; I94-R98 WeakPolarHBondContact O-CB 3.32Å; I94-R98 WeakPolarHBondContact O-CG 3.39Å; I94-R98 PolarHBondContact O-N 3.36Å
95	A	64.1	Low	65.4	Low	41 Å²	41	67.8 Å²	67.8	34%	0.339	38%	0.378	S	S	.	.	H	α-helix	trans	-66.7	-39.9	179.5	0	0	0	0	0	112.5	T91 L92 C93 R98 L99	T91-A95 WeakPolarHBondContact O-CB 3.36Å; T91-A95 PolarHBondContact O-N 3.47Å; L92-A95 PolarHBondContact O-N 2.87Å; L92-A95 VanDerWaalsContact O-N 3.13Å; C93-A95 PolarHBondContact O-N 2.92Å; A95-R98 PolarHBondContact O-N 2.89Å; A95-L99 WeakPolarHBondContact O-CG 3.38Å; A95-L99 PolarHBondContact O-N 3.34Å
96	E	62.1	Low	66.2	Low	124 Å²	124	68.5 Å²	68.5	58%	0.579	38%	0.375	S	S	*	.	H	α-helix	trans	-64.5	-49.9	175.9	-171.6	167.7	-152.1	0	0	111	L92 C93 R98 L99 D100	L92-E96 WeakPolarHBondContact O-CB 3.41Å; L92-E96 PolarHBondContact O-N 3.22Å; C93-E96 PolarHBondContact O-N 2.69Å; E96-R98 PolarHBondContact O-N 2.99Å; E96-L99 WeakPolarHBondContact O-CA 3.49Å; E96-L99 WeakPolarHBondContact O-CB 3.39Å; E96-L99 PolarHBondContact O-N 3.47Å; E96-D100 PolarHBondContact O-N 2.96Å
97	R	66.9	Low	67.1	Low	87 Å²	87	67.9 Å²	67.9	33%	0.328	37%	0.373	S	S	.	.	H	α-helix	trans	-57.6	-36.9	174.7	-69.4	170.2	-178.4	-155.5	-8.9	112.8	C93 A101 D156	C93-R97 WeakPolarHBondContact O-CB 3.38Å; C93-R97 VanDerWaalsContact O-CG 3.23Å; C93-R97 WeakPolarHBondContact O-CG 3.37Å; C93-R97 PolarHBondContact O-N 3.26Å; C93-R97 PolarHBondContact SG-NE 3.33Å; C93-R97 VanDerWaalsContact SG-NE 3.38Å; R97-A101 WeakPolarHBondContact O-CB 3.46Å; R97-A101 PolarHBondContact O-N 2.86Å; R97-D156 IonicContact CZ-OD2 3.14Å; R97-D156 IonicContact NH1-OD1 3.31Å; R97-D156 PolarHBondContact NH1-OD1 2.91Å; R97-D156 IonicContact NH1-OD2 2.94Å; R97-D156 PolarHBondContact NH1-OD2 3.47Å; R97-D156 IonicContact NH2-OD2 2.78Å; R97-D156 PolarHBondContact NH2-OD2 3.49Å
98	R	70	Confident	67.9	Low	127 Å²	127	65.1 Å²	65.1	48%	0.479	35%	0.353	S	S	.	.	H	α-helix	trans	-69.1	-37.1	173.9	-79.3	-178.5	170	-168.4	-2.5	112.6	I94 A95 E96 A101 I102	I94-R98 WeakPolarHBondContact O-CB 3.32Å; I94-R98 WeakPolarHBondContact O-CG 3.39Å; I94-R98 PolarHBondContact O-N 3.36Å; A95-R98 PolarHBondContact O-N 2.89Å; E96-R98 PolarHBondContact O-N 2.99Å; R98-A101 PolarHBondContact O-N 2.83Å; R98-I102 WeakPolarHBondContact O-CD1 3.3Å; R98-I102 VanDerWaalsContact O-CG1 3.24Å; R98-I102 WeakPolarHBondContact O-CG1 3.48Å; R98-I102 PolarHBondContact O-N 2.9Å
99	L	68.7	Low	68.7	Low	80 Å²	80	65 Å²	65	42%	0.419	35%	0.348	S	S	.	.	H	α-helix	trans	-64.8	-42	174.5	-79.4	165.4	0	0	0	111.2	A95 E96 I102 G103	A95-L99 WeakPolarHBondContact O-CG 3.38Å; A95-L99 PolarHBondContact O-N 3.34Å; E96-L99 WeakPolarHBondContact O-CA 3.49Å; E96-L99 WeakPolarHBondContact O-CB 3.39Å; E96-L99 PolarHBondContact O-N 3.47Å; L99-I102 PolarHBondContact O-N 3.34Å; L99-G103 PolarHBondContact O-N 3Å
100	D	67.8	Low	69.9	Low	90 Å²	90	67 Å²	67	48%	0.481	35%	0.348	S	S	.	.	H	α-helix	trans	-62.8	-44.6	175	-65.1	-23.8	0	0	0	110.8	E96 I102 G103 L104 M157	E96-D100 PolarHBondContact O-N 2.96Å; D100-I102 VanDerWaalsContact C-N 3.31Å; D100-I102 PolarHBondContact O-N 3Å; D100-G103 WeakPolarHBondContact O-CA 3.28Å; D100-G103 PolarHBondContact O-N 3.28Å; D100-G103 VanDerWaalsContact O-N 3.12Å; D100-L104 PolarHBondContact O-N 2.9Å; D100-M157 HydrophobicContact CB-CE 4.02Å; D100-M157 HydrophobicContact CB-SD 4.23Å
101	A	71.2	Confident	70.9	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-59.1	-39.9	174.6	0	0	0	0	0	112.2	R97 R98 L104 I105 M157 L161 C164	R97-A101 WeakPolarHBondContact O-CB 3.46Å; R97-A101 PolarHBondContact O-N 2.86Å; R98-A101 PolarHBondContact O-N 2.83Å; A101-L104 PolarHBondContact O-N 2.73Å; A101-I105 VanDerWaalsContact O-CG1 3.23Å; A101-I105 WeakPolarHBondContact O-CG1 3.44Å; A101-I105 PolarHBondContact O-N 2.84Å; A101-M157 HydrophobicContact CB-CE 4.45Å; A101-M157 HydrophobicContact CB-SD 4.49Å; A101-L161 HydrophobicContact CB-CD1 4.35Å; A101-C164 HydrophobicContact CB-CB 4.47Å
102	I	72	Confident	71.7	Confident	65 Å²	65	63 Å²	63	33%	0.333	32%	0.318	S	S	.	.	H	α-helix	trans	-65.1	-41	174.8	-69.4	163.3	0	0	0	111.3	R98 L99 D100 L104 I105 K106	R98-I102 WeakPolarHBondContact O-CD1 3.3Å; R98-I102 VanDerWaalsContact O-CG1 3.24Å; R98-I102 WeakPolarHBondContact O-CG1 3.48Å; R98-I102 PolarHBondContact O-N 2.9Å; L99-I102 PolarHBondContact O-N 3.34Å; D100-I102 VanDerWaalsContact C-N 3.31Å; D100-I102 PolarHBondContact O-N 3Å; I102-L104 VanDerWaalsContact C-N 3.32Å; I102-I105 PolarHBondContact O-N 3.45Å; I102-K106 PolarHBondContact O-N 3.42Å; I102-K106 VanDerWaalsContact O-N 3.09Å
103	G	71	Confident	72.6	Confident	34 Å²	34	62.3 Å²	62.3	35%	0.351	31%	0.314	S	S	.	.	H	α-helix	trans	-55.9	-48.9	172.3	0	0	0	0	0	111.2	L99 D100 I105 K106 D107	L99-G103 PolarHBondContact O-N 3Å; D100-G103 WeakPolarHBondContact O-CA 3.28Å; D100-G103 PolarHBondContact O-N 3.28Å; D100-G103 VanDerWaalsContact O-N 3.12Å; G103-I105 VanDerWaalsContact C-N 3.34Å; G103-I105 PolarHBondContact O-N 3.09Å; G103-K106 VanDerWaalsContact O-CB 3.25Å; G103-K106 WeakPolarHBondContact O-CB 3.3Å; G103-K106 PolarHBondContact O-N 2.93Å; G103-K106 VanDerWaalsContact O-N 3.07Å; G103-D107 PolarHBondContact O-N 2.8Å; G103-D107 VanDerWaalsContact O-N 3.13Å
104	L	78.2	Confident	73.5	Confident	36 Å²	36	62 Å²	62	19%	0.188	31%	0.313	C	S	.	.	H	α-helix	trans	-63.2	-36.6	178.1	-169.7	65	0	0	0	112.9	D100 A101 I102 K106 D107 L108 L136 M153 M157 L161	D100-L104 PolarHBondContact O-N 2.9Å; A101-L104 PolarHBondContact O-N 2.73Å; I102-L104 VanDerWaalsContact C-N 3.32Å; L104-K106 VanDerWaalsContact C-N 3.28Å; L104-K106 PolarHBondContact O-N 2.9Å; L104-D107 PolarHBondContact O-N 3.26Å; L104-L108 WeakPolarHBondContact O-CB 3.47Å; L104-L108 PolarHBondContact O-N 2.85Å; L104-L136 HydrophobicContact CD1-CD1 3.98Å; L104-L136 HydrophobicContact CD1-CD2 4.14Å; L104-L136 HydrophobicContact CD2-CD1 4.15Å; L104-L136 HydrophobicContact CG-CD1 4.45Å; L104-L136 HydrophobicContact CG-CD2 4.31Å; L104-M153 HydrophobicContact CD2-CE 3.71Å; L104-M157 HydrophobicContact CB-CE 3.88Å; L104-M157 HydrophobicContact CD2-CE 3.7Å; L104-M157 HydrophobicContact CG-CE 4.39Å; L104-L161 HydrophobicContact CB-CD1 4.35Å; L104-L161 HydrophobicContact CD2-CD1 3.89Å; L104-L161 HydrophobicContact CD2-CD2 4.35Å; L104-L161 HydrophobicContact CG-CD1 4.35Å
105	I	74.4	Confident	74.2	Confident	23 Å²	23	57.7 Å²	57.7	12%	0.118	29%	0.291	C	S	.	.	H	α-helix	trans	-63.7	-36.3	174.7	-66.8	165.7	0	0	0	111.1	L14 A101 I102 G103 L108 Y109 L161 C164 M168	L14-I105 HydrophobicContact CD1-CG2 4.31Å; L14-I105 HydrophobicContact CD2-CB 4.39Å; L14-I105 HydrophobicContact CD2-CG2 3.96Å; L14-I105 HydrophobicContact CG-CG2 4.35Å; A101-I105 VanDerWaalsContact O-CG1 3.23Å; A101-I105 WeakPolarHBondContact O-CG1 3.44Å; A101-I105 PolarHBondContact O-N 2.84Å; I102-I105 PolarHBondContact O-N 3.45Å; G103-I105 VanDerWaalsContact C-N 3.34Å; G103-I105 PolarHBondContact O-N 3.09Å; I105-L108 VanDerWaalsContact O-CB 3.31Å; I105-L108 WeakPolarHBondContact O-CB 3.26Å; I105-L108 PolarHBondContact O-N 3.31Å; I105-Y109 PolarHBondContact O-N 3.48Å; I105-L161 HydrophobicContact CD1-CD1 4.45Å; I105-L161 HydrophobicContact CG1-CD1 3.91Å; I105-C164 HydrophobicContact CD1-CB 4.29Å; I105-M168 HydrophobicContact CD1-CE 4.14Å; I105-M168 HydrophobicContact CD1-CG 4.23Å; I105-M168 HydrophobicContact CD1-SD 4.48Å; I105-M168 HydrophobicContact CG1-CE 3.77Å; I105-M168 HydrophobicContact CG1-SD 4.44Å
106	K	74.5	Confident	74.8	Confident	99 Å²	99	58.5 Å²	58.5	43%	0.43	29%	0.288	S	S	.	.	H	α-helix	trans	-64.1	-45.1	176	-173.1	-172.2	170.5	-166.7	0	110.7	L14 I102 G103 L104 Y109 Q110	L14-K106 VanDerWaalsContact CD2-CA 3.48Å; L14-K106 HydrophobicContact CD2-CB 3.71Å; L14-K106 HydrophobicContact CD2-CG 4.3Å; I102-K106 PolarHBondContact O-N 3.42Å; I102-K106 VanDerWaalsContact O-N 3.09Å; G103-K106 VanDerWaalsContact O-CB 3.25Å; G103-K106 WeakPolarHBondContact O-CB 3.3Å; G103-K106 PolarHBondContact O-N 2.93Å; G103-K106 VanDerWaalsContact O-N 3.07Å; L104-K106 VanDerWaalsContact C-N 3.28Å; L104-K106 PolarHBondContact O-N 2.9Å; K106-Y109 PolarHBondContact O-N 3.4Å; K106-Q110 WeakPolarHBondContact O-CG 3.48Å; K106-Q110 PolarHBondContact O-N 3.23Å
107	D	77.2	Confident	75.4	Confident	89 Å²	89	57.6 Å²	57.6	48%	0.476	29%	0.287	S	S	.	.	H	α-helix	trans	-66.3	-41.9	179.1	-62	-21.7	0	0	0	110.6	G103 L104 Y109 Q110 L111	G103-D107 PolarHBondContact O-N 2.8Å; G103-D107 VanDerWaalsContact O-N 3.13Å; L104-D107 PolarHBondContact O-N 3.26Å; D107-Y109 VanDerWaalsContact C-N 3.28Å; D107-Y109 PolarHBondContact O-N 2.8Å; D107-Q110 PolarHBondContact O-N 3.44Å; D107-Q110 VanDerWaalsContact O-N 3.12Å; D107-L111 WeakPolarHBondContact O-CB 3.28Å; D107-L111 VanDerWaalsContact O-CG 3.26Å; D107-L111 WeakPolarHBondContact O-CG 3.19Å; D107-L111 PolarHBondContact O-N 3.47Å
108	L	81	Confident	75.6	Confident	9 Å²	9	54.3 Å²	54.3	5%	0.047	28%	0.277	C	S	.	.	H	α-helix	trans	-49.9	-46.8	169.5	-101.8	157.2	0	0	0	112.8	L104 I105 L111 F112 L133 L136 M168 F173 I176	L104-L108 WeakPolarHBondContact O-CB 3.47Å; L104-L108 PolarHBondContact O-N 2.85Å; I105-L108 VanDerWaalsContact O-CB 3.31Å; I105-L108 WeakPolarHBondContact O-CB 3.26Å; I105-L108 PolarHBondContact O-N 3.31Å; L108-L111 PolarHBondContact O-N 3.17Å; L108-F112 WeakPolarHBondContact O-CB 3.36Å; L108-F112 PolarHBondContact O-N 3.49Å; L108-L133 HydrophobicContact CD2-CD1 3.49Å; L108-L133 VanDerWaalsContact CD2-CD1 3.49Å; L108-L136 HydrophobicContact CD1-CD2 3.66Å; L108-L136 HydrophobicContact CD2-CD2 3.72Å; L108-L136 HydrophobicContact CG-CD2 3.35Å; L108-M168 HydrophobicContact CD1-CE 4.36Å; L108-F173 HydrophobicContact CD1-CE1 3.9Å; L108-F173 HydrophobicContact CD1-CZ 4.16Å; L108-F173 HydrophobicContact CD2-CE1 4.26Å; L108-I176 HydrophobicContact CD2-CD1 4.34Å
109	Y	78.5	Confident	75.9	Confident	59 Å²	59	51.5 Å²	51.5	23%	0.231	27%	0.274	C	S	.	.	H	α-helix	trans	-68.9	-40	179.9	-178.4	-108.4	0	0	0	112.2	L14 I105 K106 D107 F112 L113	L14-Y109 VanDerWaalsContact CD1-CB 3.41Å; L14-Y109 HydrophobicContact CD1-CD1 3.91Å; L14-Y109 HydrophobicContact CD1-CD2 4.35Å; L14-Y109 HydrophobicContact CD1-CG 3.64Å; I105-Y109 PolarHBondContact O-N 3.48Å; K106-Y109 PolarHBondContact O-N 3.4Å; D107-Y109 VanDerWaalsContact C-N 3.28Å; D107-Y109 PolarHBondContact O-N 2.8Å; Y109-F112 PolarHBondContact O-N 3.01Å; Y109-L113 HydrophobicContact CD1-CD1 3.92Å; Y109-L113 HydrophobicContact CD1-CG 4.41Å; Y109-L113 HydrophobicContact CE1-CD1 3.37Å; Y109-L113 HydrophobicContact CE1-CG 4.03Å; Y109-L113 HydrophobicContact CE2-CD1 4.47Å; Y109-L113 HydrophobicContact CE2-CD2 4.37Å; Y109-L113 HydrophobicContact CE2-CG 4.26Å; Y109-L113 WeakPolarHBondContact O-CG 3.45Å; Y109-L113 PolarHBondContact O-N 2.86Å
110	Q	80.2	Confident	76	Confident	96 Å²	96	51.6 Å²	51.6	45%	0.449	27%	0.272	S	S	.	.	H	α-helix	trans	-64.4	-41.2	175	-67.4	-57.6	-39.2	0	0	112	K106 D107 L113 S114	K106-Q110 WeakPolarHBondContact O-CG 3.48Å; K106-Q110 PolarHBondContact O-N 3.23Å; D107-Q110 PolarHBondContact O-N 3.44Å; D107-Q110 VanDerWaalsContact O-N 3.12Å; Q110-L113 PolarHBondContact O-N 3.36Å; Q110-S114 WeakPolarHBondContact O-CB 3.23Å; Q110-S114 PolarHBondContact O-N 3.31Å; Q110-S114 PolarHBondContact O-OG 2.9Å
111	L	82.9	Confident	76.3	Confident	36 Å²	36	53.7 Å²	53.7	19%	0.188	28%	0.283	C	S	.	.	H	α-helix	trans	-61.6	-45.8	173.6	-68.8	171.7	0	0	0	111	D107 L108 L113 S114 C115 A129 L133	D107-L111 WeakPolarHBondContact O-CB 3.28Å; D107-L111 VanDerWaalsContact O-CG 3.26Å; D107-L111 WeakPolarHBondContact O-CG 3.19Å; D107-L111 PolarHBondContact O-N 3.47Å; L108-L111 PolarHBondContact O-N 3.17Å; L111-L113 PolarHBondContact O-N 3.37Å; L111-S114 WeakPolarHBondContact O-CB 3.4Å; L111-S114 PolarHBondContact O-N 2.97Å; L111-C115 PolarHBondContact O-N 2.92Å; L111-C115 PolarHBondContact O-SG 2.82Å; L111-A129 HydrophobicContact CD2-CB 4.01Å; L111-L133 HydrophobicContact CB-CB 4.18Å; L111-L133 HydrophobicContact CB-CD1 4.33Å
112	F	80.8	Confident	76.5	Confident	22 Å²	22	55.9 Å²	55.9	10%	0.096	30%	0.296	C	S	.	.	H	α-helix	trans	-60.2	-46.4	177.2	-179.5	-94	0	0	0	112.6	M1 L108 Y109 S114 C115 Q116 L133 W179	M1-F112 HydrophobicContact CE-CE2 4.22Å; M1-F112 HydrophobicContact SD-CE2 4.35Å; M1-F112 HydrophobicContact SD-CZ 4.33Å; L108-F112 WeakPolarHBondContact O-CB 3.36Å; L108-F112 PolarHBondContact O-N 3.49Å; Y109-F112 PolarHBondContact O-N 3.01Å; F112-S114 VanDerWaalsContact C-N 3.29Å; F112-S114 PolarHBondContact O-N 3.13Å; F112-C115 CarbonylContact O-C 3.34Å; F112-C115 PolarHBondContact O-N 3.45Å; F112-C115 VanDerWaalsContact O-N 3.1Å; F112-Q116 WeakPolarHBondContact O-CB 3.33Å; F112-Q116 PolarHBondContact O-N 3Å; F112-L133 HydrophobicContact CB-CD2 4.26Å; F112-L133 HydrophobicContact CD2-CD2 4.31Å; F112-W179 HydrophobicContact CD2-CE3 4.34Å; F112-W179 HydrophobicContact CD2-CH2 4.25Å; F112-W179 HydrophobicContact CD2-CZ3 4.01Å; F112-W179 AromaticContact CE2-CD2 3.98Å; F112-W179 HydrophobicContact CE2-CD2 3.98Å; F112-W179 AromaticContact CE2-CE3 3.87Å; F112-W179 HydrophobicContact CE2-CE3 3.87Å; F112-W179 AromaticContact CE2-CH2 3.85Å; F112-W179 HydrophobicContact CE2-CH2 3.85Å; F112-W179 AromaticContact CE2-CZ2 3.96Å; F112-W179 HydrophobicContact CE2-CZ2 3.96Å; F112-W179 AromaticContact CE2-CZ3 3.79Å; F112-W179 HydrophobicContact CE2-CZ3 3.79Å; F112-W179 HydrophobicContact CZ-CH2 4.36Å; F112-W179 HydrophobicContact CZ-CZ2 4.16Å
113	L	78.2	Confident	76.6	Confident	46 Å²	46	53.1 Å²	53.1	24%	0.241	28%	0.282	C	S	.	.	H	α-helix	trans	-60.3	-41.2	176.3	-74.2	179	0	0	0	111.8	Y109 Q110 L111 C115 Q116 N117	Y109-L113 HydrophobicContact CD1-CD1 3.92Å; Y109-L113 HydrophobicContact CD1-CG 4.41Å; Y109-L113 HydrophobicContact CE1-CD1 3.37Å; Y109-L113 HydrophobicContact CE1-CG 4.03Å; Y109-L113 HydrophobicContact CE2-CD1 4.47Å; Y109-L113 HydrophobicContact CE2-CD2 4.37Å; Y109-L113 HydrophobicContact CE2-CG 4.26Å; Y109-L113 WeakPolarHBondContact O-CG 3.45Å; Y109-L113 PolarHBondContact O-N 2.86Å; Q110-L113 PolarHBondContact O-N 3.36Å; L111-L113 PolarHBondContact O-N 3.37Å; L113-C115 PolarHBondContact O-N 2.94Å; L113-Q116 PolarHBondContact O-N 3.37Å; L113-Q116 VanDerWaalsContact O-N 3.13Å; L113-N117 PolarHBondContact O-N 2.91Å; L113-N117 VanDerWaalsContact O-N 3.15Å
114	S	79.7	Confident	76.7	Confident	47 Å²	47	55 Å²	55	33%	0.329	28%	0.284	S	S	.	.	H	α-helix	trans	-64	-29.6	176.5	-56.9	0	0	0	0	112.3	Q110 L111 F112	Q110-S114 WeakPolarHBondContact O-CB 3.23Å; Q110-S114 PolarHBondContact O-N 3.31Å; Q110-S114 PolarHBondContact O-OG 2.9Å; L111-S114 WeakPolarHBondContact O-CB 3.4Å; L111-S114 PolarHBondContact O-N 2.97Å; F112-S114 VanDerWaalsContact C-N 3.29Å; F112-S114 PolarHBondContact O-N 3.13Å
115	C	79.6	Confident	76.5	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.007	30%	0.304	C	S	.	.	H	α-helix	trans	-84	-22	173	-63	0	0	0	0	114.3	L111 F112 L113 F126 Y130 L133 W179	L111-C115 PolarHBondContact O-N 2.92Å; L111-C115 PolarHBondContact O-SG 2.82Å; F112-C115 CarbonylContact O-C 3.34Å; F112-C115 PolarHBondContact O-N 3.45Å; F112-C115 VanDerWaalsContact O-N 3.1Å; L113-C115 PolarHBondContact O-N 2.94Å; C115-F126 HydrophobicContact CB-CE2 4.28Å; C115-Y130 VanDerWaalsContact SG-CA 3.56Å; C115-L133 HydrophobicContact CB-CD2 4.46Å; C115-W179 HydrophobicContact CB-CH2 3.85Å; C115-W179 HydrophobicContact CB-CZ3 3.94Å
116	Q	76.1	Confident	76.7	Confident	59 Å²	59	58.7 Å²	58.7	28%	0.276	30%	0.298	S	S	.	.	H	α-helix	trans	-79.3	-50.5	-177.4	-173.3	177.1	3	0	0	111.1	F112 L113 V118 R183	F112-Q116 WeakPolarHBondContact O-CB 3.33Å; F112-Q116 PolarHBondContact O-N 3Å; L113-Q116 PolarHBondContact O-N 3.37Å; L113-Q116 VanDerWaalsContact O-N 3.13Å; Q116-V118 PolarHBondContact O-N 3.1Å; Q116-R183 PolarHBondContact O-NH2 3.41Å
117	N	73.6	Confident	76.8	Confident	104 Å²	104	54.6 Å²	54.6	56%	0.556	28%	0.281	S	S	*	.	S	Bend	trans	-101.6	53.1	-169.8	-65.7	-22.1	0	0	0	112.2	L113 T119 T122	L113-N117 PolarHBondContact O-N 2.91Å; L113-N117 VanDerWaalsContact O-N 3.15Å; N117-T119 PolarHBondContact O-N 3.29Å; N117-T119 VanDerWaalsContact O-N 3.15Å; N117-T122 PolarHBondContact O-OG1 2.9Å
118	V	73	Confident	76.9	Confident	19 Å²	19	57.3 Å²	57.3	12%	0.115	29%	0.291	C	S	.	.			trans	-73.6	107.6	177.3	-170.5	0	0	0	0	109.4	Q116 T122 F126 M187 F190	Q116-V118 PolarHBondContact O-N 3.1Å; V118-T122 WeakPolarHBondContact CA-OG1 3.23Å; V118-F126 HydrophobicContact CB-CD2 4.48Å; V118-F126 HydrophobicContact CG1-CB 4.29Å; V118-F126 HydrophobicContact CG1-CD1 4.31Å; V118-F126 HydrophobicContact CG1-CD2 4.42Å; V118-F126 HydrophobicContact CG1-CG 4.08Å; V118-F126 HydrophobicContact CG2-CB 4.35Å; V118-F126 HydrophobicContact CG2-CD1 4.43Å; V118-F126 HydrophobicContact CG2-CD2 3.25Å; V118-F126 HydrophobicContact CG2-CE2 3.49Å; V118-F126 VanDerWaalsContact CG2-CE2 3.49Å; V118-F126 HydrophobicContact CG2-CG 3.76Å; V118-F126 HydrophobicContact CG2-CZ 4.17Å; V118-M187 HydrophobicContact CB-CE 3.9Å; V118-M187 HydrophobicContact CB-SD 4.26Å; V118-M187 HydrophobicContact CG1-SD 4.47Å; V118-M187 HydrophobicContact CG2-CE 3.54Å; V118-M187 HydrophobicContact CG2-SD 4.12Å; V118-F190 HydrophobicContact CG1-CD1 4.5Å; V118-F190 HydrophobicContact CG1-CE1 3.91Å
119	T	76	Confident	77	Confident	68 Å²	68	57.1 Å²	57.1	42%	0.417	29%	0.291	S	S	.	.			trans	-106.1	176.5	167	62.9	0	0	0	0	109.7	N117 D121 T122	N117-T119 PolarHBondContact O-N 3.29Å; N117-T119 VanDerWaalsContact O-N 3.15Å; T119-D121 PolarHBondContact O-N 2.85Å; T119-T122 PolarHBondContact N-OG1 3.49Å; T119-T122 PolarHBondContact O-N 2.87Å; T119-T122 PolarHBondContact O-OG1 3.23Å; T119-T122 PolarHBondContact OG1-OG1 3Å
120	E	70.1	Confident	77.3	Confident	82 Å²	82	54.6 Å²	54.6	38%	0.383	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-57.6	-37.9	173.2	-166.9	179.2	153.6	0	0	111.7	T122 L123 K219	E120-T122 VanDerWaalsContact C-N 3.27Å; E120-T122 PolarHBondContact O-N 3.29Å; E120-L123 HydrophobicContact CG-CD1 4.44Å; E120-K219 WeakPolarHBondContact OE1-CE 3.46Å; E120-K219 IonicContact OE1-NZ 2.77Å; E120-K219 PolarHBondContact OE1-NZ 3.23Å
121	D	74.3	Confident	77.4	Confident	134 Å²	134	52.7 Å²	52.7	72%	0.717	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-75.2	-12	-177.4	-55.3	-41.5	0	0	0	114.2	T119	T119-D121 PolarHBondContact O-N 2.85Å
122	T	75.5	Confident	77.5	Confident	45 Å²	45	53.4 Å²	53.4	28%	0.276	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-110.4	10.7	-178	62.1	0	0	0	0	113.2	N117 V118 T119 E120 D124 K125 F126	N117-T122 PolarHBondContact O-OG1 2.9Å; V118-T122 WeakPolarHBondContact CA-OG1 3.23Å; T119-T122 PolarHBondContact N-OG1 3.49Å; T119-T122 PolarHBondContact O-N 2.87Å; T119-T122 PolarHBondContact O-OG1 3.23Å; T119-T122 PolarHBondContact OG1-OG1 3Å; E120-T122 VanDerWaalsContact C-N 3.27Å; E120-T122 PolarHBondContact O-N 3.29Å; T122-D124 PolarHBondContact O-N 3.13Å; T122-K125 PolarHBondContact O-N 2.99Å; T122-F126 PolarHBondContact O-N 2.76Å
123	L	74.8	Confident	77.7	Confident	7 Å²	7	52.4 Å²	52.4	4%	0.037	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-27.8	-178.6	-90.7	162.6	0	0	0	113.1	E120 P127 F190 L191 Q194 L223 A226	E120-L123 HydrophobicContact CG-CD1 4.44Å; L123-P127 WeakPolarHBondContact O-CD 3.42Å; L123-F190 HydrophobicContact CD2-CE1 4.16Å; L123-F190 HydrophobicContact CG-CE1 4.49Å; L123-L191 HydrophobicContact CD2-CD2 3.64Å; L123-Q194 HydrophobicContact CD1-CG 4.38Å; L123-L223 HydrophobicContact CD2-CD1 4.3Å; L123-A226 HydrophobicContact CD2-CB 4.39Å
124	D	71.7	Confident	78.1	Confident	74 Å²	74	52.1 Å²	52.1	40%	0.396	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-41.7	178.5	64.4	-34	0	0	0	112.9	T122 N222	T122-D124 PolarHBondContact O-N 3.13Å; D124-N222 HydrophobicContact CB-CB 4.45Å
125	K	75.3	Confident	78.3	Confident	136 Å²	136	51.9 Å²	51.9	59%	0.591	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-22.9	-175.2	-68.9	167.1	-169.3	173.7	0	113.3	T122 A129	T122-K125 PolarHBondContact O-N 2.99Å; K125-A129 WeakPolarHBondContact O-CB 3.48Å; K125-A129 PolarHBondContact O-N 3.31Å; K125-A129 VanDerWaalsContact O-N 3.1Å
126	F	77.6	Confident	78.4	Confident	1 Å²	1	52.9 Å²	52.9	0%	0.004	29%	0.285	C	S	.	.	H	α-helix	trans	-64	-46.3	-170.5	169.6	-111.6	0	0	0	114.9	C115 V118 T122 Q128 A129 Y130 M187 F230	C115-F126 HydrophobicContact CB-CE2 4.28Å; V118-F126 HydrophobicContact CB-CD2 4.48Å; V118-F126 HydrophobicContact CG1-CB 4.29Å; V118-F126 HydrophobicContact CG1-CD1 4.31Å; V118-F126 HydrophobicContact CG1-CD2 4.42Å; V118-F126 HydrophobicContact CG1-CG 4.08Å; V118-F126 HydrophobicContact CG2-CB 4.35Å; V118-F126 HydrophobicContact CG2-CD1 4.43Å; V118-F126 HydrophobicContact CG2-CD2 3.25Å; V118-F126 HydrophobicContact CG2-CE2 3.49Å; V118-F126 VanDerWaalsContact CG2-CE2 3.49Å; V118-F126 HydrophobicContact CG2-CG 3.76Å; V118-F126 HydrophobicContact CG2-CZ 4.17Å; T122-F126 PolarHBondContact O-N 2.76Å; F126-Q128 PolarHBondContact O-N 3.29Å; F126-A129 PolarHBondContact O-N 3.4Å; F126-Y130 HydrophobicContact CE2-CD2 4.38Å; F126-Y130 HydrophobicContact CZ-CD2 4.23Å; F126-Y130 WeakPolarHBondContact O-CB 3.36Å; F126-Y130 PolarHBondContact O-N 3.32Å; F126-M187 HydrophobicContact CE1-CG 4.33Å; F126-M187 HydrophobicContact CE1-SD 4.16Å; F126-M187 HydrophobicContact CE2-CE 4.45Å; F126-M187 HydrophobicContact CE2-SD 4.43Å; F126-M187 HydrophobicContact CZ-CB 4.39Å; F126-M187 HydrophobicContact CZ-CE 4.34Å; F126-M187 HydrophobicContact CZ-CG 3.76Å; F126-M187 HydrophobicContact CZ-SD 3.8Å; F126-F230 HydrophobicContact CD1-CE2 4.18Å; F126-F230 HydrophobicContact CE1-CD2 4.26Å; F126-F230 AromaticContact CE1-CE2 3.23Å; F126-F230 HydrophobicContact CE1-CE2 3.23Å; F126-F230 AromaticContact CE1-CZ 3.43Å; F126-F230 HydrophobicContact CE1-CZ 3.43Å; F126-F230 VanDerWaalsContact CE1-CZ 3.43Å; F126-F230 HydrophobicContact CZ-CE1 4.41Å; F126-F230 AromaticContact CZ-CE2 3.69Å; F126-F230 HydrophobicContact CZ-CE2 3.69Å; F126-F230 AromaticContact CZ-CZ 3.36Å; F126-F230 HydrophobicContact CZ-CZ 3.36Å
127	P	76.3	Confident	78.8	Confident	12 Å²	12	50 Å²	50	8%	0.078	27%	0.272	C	S	.	.	H	α-helix	trans	-59.8	-47.6	-176.4	-24.9	35.2	0	0	0	112	L123 A129 Y130 C131 A226 T229	L123-P127 WeakPolarHBondContact O-CD 3.42Å; P127-A129 PolarHBondContact O-N 3.32Å; P127-Y130 PolarHBondContact O-N 3.3Å; P127-C131 WeakPolarHBondContact O-CB 3.38Å; P127-C131 PolarHBondContact O-N 2.9Å; P127-C131 PolarHBondContact O-SG 3.34Å; P127-A226 HydrophobicContact CG-CB 3.73Å; P127-T229 HydrophobicContact CB-CG2 4.38Å
128	Q	79.5	Confident	79.3	Confident	146 Å²	146	51.1 Å²	51.1	68%	0.682	27%	0.268	S	S	*	.	H	α-helix	trans	-62	-45.4	176.3	-169.1	174.8	14.6	0	0	110.9	F126 Y130 C131 S132	F126-Q128 PolarHBondContact O-N 3.29Å; Q128-Y130 VanDerWaalsContact C-N 3.34Å; Q128-Y130 PolarHBondContact O-N 2.77Å; Q128-C131 PolarHBondContact O-N 3.15Å; Q128-S132 WeakPolarHBondContact O-CB 3.47Å; Q128-S132 PolarHBondContact O-N 3.49Å; Q128-S132 PolarHBondContact O-OG 3.09Å; Q128-S132 VanDerWaalsContact O-OG 3.05Å
129	A	82.9	Confident	79.8	Confident	6 Å²	6	52.9 Å²	52.9	5%	0.05	28%	0.275	C	S	.	.	H	α-helix	trans	-61.1	-41.9	178.6	0	0	0	0	0	112.9	L111 K125 F126 P127 L133	L111-A129 HydrophobicContact CD2-CB 4.01Å; K125-A129 WeakPolarHBondContact O-CB 3.48Å; K125-A129 PolarHBondContact O-N 3.31Å; K125-A129 VanDerWaalsContact O-N 3.1Å; F126-A129 PolarHBondContact O-N 3.4Å; P127-A129 PolarHBondContact O-N 3.32Å; A129-L133 WeakPolarHBondContact O-CB 3.45Å; A129-L133 PolarHBondContact O-N 2.88Å
130	Y	85.9	Confident	80	Confident	6 Å²	6	49.7 Å²	49.7	2%	0.024	26%	0.255	C	S	.	.	H	α-helix	trans	-64.2	-47.4	177.4	179.2	-85.1	0	0	0	111.6	C115 F126 P127 Q128 L133 Q134 L180 T229 F230	C115-Y130 VanDerWaalsContact SG-CA 3.56Å; F126-Y130 HydrophobicContact CE2-CD2 4.38Å; F126-Y130 HydrophobicContact CZ-CD2 4.23Å; F126-Y130 WeakPolarHBondContact O-CB 3.36Å; F126-Y130 PolarHBondContact O-N 3.32Å; P127-Y130 PolarHBondContact O-N 3.3Å; Q128-Y130 VanDerWaalsContact C-N 3.34Å; Q128-Y130 PolarHBondContact O-N 2.77Å; Y130-L133 PolarHBondContact O-N 3.37Å; Y130-Q134 VanDerWaalsContact O-CB 3.26Å; Y130-Q134 WeakPolarHBondContact O-CB 3.4Å; Y130-Q134 PolarHBondContact O-N 3.15Å; Y130-L180 HydrophobicContact CD2-CD2 3.63Å; Y130-L180 HydrophobicContact CE2-CB 4.06Å; Y130-L180 HydrophobicContact CE2-CD2 3.59Å; Y130-L180 HydrophobicContact CE2-CG 4.36Å; Y130-T229 HydrophobicContact CD1-CG2 4.25Å; Y130-F230 HydrophobicContact CD1-CE2 4.42Å; Y130-F230 HydrophobicContact CD1-CZ 4Å; Y130-F230 HydrophobicContact CD2-CE1 4.28Å; Y130-F230 AromaticContact CD2-CZ 3.65Å; Y130-F230 HydrophobicContact CD2-CZ 3.65Å; Y130-F230 HydrophobicContact CE1-CE1 4.41Å; Y130-F230 HydrophobicContact CE1-CZ 4.17Å; Y130-F230 AromaticContact CE2-CE1 3.96Å; Y130-F230 HydrophobicContact CE2-CE1 3.96Å; Y130-F230 AromaticContact CE2-CZ 3.81Å; Y130-F230 HydrophobicContact CE2-CZ 3.81Å; Y130-F230 HydrophobicContact CG-CE2 4.32Å; Y130-F230 AromaticContact CG-CZ 3.76Å; Y130-F230 HydrophobicContact CG-CZ 3.76Å
131	C	82.6	Confident	80.5	Confident	56 Å²	56	47.1 Å²	47.1	38%	0.378	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-48.8	178.4	-74.6	0	0	0	0	111.7	P127 Q128 L133 Q134 A135 T229	P127-C131 WeakPolarHBondContact O-CB 3.38Å; P127-C131 PolarHBondContact O-N 2.9Å; P127-C131 PolarHBondContact O-SG 3.34Å; Q128-C131 PolarHBondContact O-N 3.15Å; C131-L133 PolarHBondContact O-N 2.88Å; C131-Q134 PolarHBondContact O-N 3.47Å; C131-A135 VanDerWaalsContact O-CB 3.31Å; C131-A135 WeakPolarHBondContact O-CB 3.44Å; C131-A135 PolarHBondContact O-N 3.37Å; C131-T229 WeakPolarHBondContact SG-CG2 3.26Å
132	S	84.2	Confident	80.6	Confident	51 Å²	51	46.8 Å²	46.8	36%	0.357	24%	0.242	S	C	.	.	H	α-helix	trans	-61.2	-43.1	178.1	-61.8	0	0	0	0	111.8	Q128 Q134 L136	Q128-S132 WeakPolarHBondContact O-CB 3.47Å; Q128-S132 PolarHBondContact O-N 3.49Å; Q128-S132 PolarHBondContact O-OG 3.09Å; Q128-S132 VanDerWaalsContact O-OG 3.05Å; S132-Q134 VanDerWaalsContact C-N 3.35Å; S132-Q134 PolarHBondContact O-N 3.29Å; S132-L136 VanDerWaalsContact O-CB 3.23Å; S132-L136 WeakPolarHBondContact O-CB 3.49Å; S132-L136 PolarHBondContact O-N 2.86Å
133	L	85.8	Confident	80.1	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.4	-39.1	177.3	-173.9	57.3	0	0	0	112.1	L108 L111 F112 C115 A129 Y130 C131 A137 I176 L180	L108-L133 HydrophobicContact CD2-CD1 3.49Å; L108-L133 VanDerWaalsContact CD2-CD1 3.49Å; L111-L133 HydrophobicContact CB-CB 4.18Å; L111-L133 HydrophobicContact CB-CD1 4.33Å; F112-L133 HydrophobicContact CB-CD2 4.26Å; F112-L133 HydrophobicContact CD2-CD2 4.31Å; C115-L133 HydrophobicContact CB-CD2 4.46Å; A129-L133 WeakPolarHBondContact O-CB 3.45Å; A129-L133 PolarHBondContact O-N 2.88Å; Y130-L133 PolarHBondContact O-N 3.37Å; C131-L133 PolarHBondContact O-N 2.88Å; L133-A137 VanDerWaalsContact O-CB 3.25Å; L133-A137 WeakPolarHBondContact O-CB 2.93Å; L133-A137 PolarHBondContact O-N 3.17Å; L133-A137 VanDerWaalsContact O-N 3.08Å; L133-I176 HydrophobicContact CD1-CG2 4.17Å; L133-I176 HydrophobicContact CD2-CG2 4.38Å; L133-I176 HydrophobicContact CG-CG2 4.04Å; L133-L180 HydrophobicContact CD2-CD1 4.46Å; L133-L180 HydrophobicContact CD2-CD2 4.11Å; L133-L180 HydrophobicContact CG-CD1 4.18Å
134	Q	85.8	Confident	79.2	Confident	41 Å²	41	50.3 Å²	50.3	19%	0.192	27%	0.268	C	S	.	.	H	α-helix	trans	-68.4	-46.3	177.3	-176.8	174.5	68.3	0	0	112.1	Y130 C131 S132 A137 R138 L177 L180	Y130-Q134 VanDerWaalsContact O-CB 3.26Å; Y130-Q134 WeakPolarHBondContact O-CB 3.4Å; Y130-Q134 PolarHBondContact O-N 3.15Å; C131-Q134 PolarHBondContact O-N 3.47Å; S132-Q134 VanDerWaalsContact C-N 3.35Å; S132-Q134 PolarHBondContact O-N 3.29Å; Q134-A137 PolarHBondContact O-N 3Å; Q134-R138 VanDerWaalsContact CD-CZ 3.44Å; Q134-R138 VanDerWaalsContact CD-NH1 3.28Å; Q134-R138 WeakPolarHBondContact O-CB 3.13Å; Q134-R138 WeakPolarHBondContact O-CG 3.35Å; Q134-R138 PolarHBondContact O-N 2.86Å; Q134-R138 VanDerWaalsContact OE1-NH1 3.11Å; Q134-L177 HydrophobicContact CG-CD2 4.18Å; Q134-L180 HydrophobicContact CB-CD1 4Å
135	A	83.5	Confident	78	Confident	42 Å²	42	54.8 Å²	54.8	35%	0.347	29%	0.292	S	S	.	.	H	α-helix	trans	-60.4	-50.7	179.1	0	0	0	0	0	110.4	C131 A137 R138 Q139	C131-A135 VanDerWaalsContact O-CB 3.31Å; C131-A135 WeakPolarHBondContact O-CB 3.44Å; C131-A135 PolarHBondContact O-N 3.37Å; A135-A137 PolarHBondContact O-N 3.37Å; A135-R138 WeakPolarHBondContact O-CB 3.39Å; A135-R138 PolarHBondContact O-N 2.93Å; A135-R138 VanDerWaalsContact O-N 3.09Å; A135-Q139 WeakPolarHBondContact O-CG 3.21Å; A135-Q139 PolarHBondContact O-N 2.99Å
136	L	82.8	Confident	76.5	Confident	21 Å²	21	50.7 Å²	50.7	11%	0.11	29%	0.288	C	S	.	.	H	α-helix	trans	-61	-44.4	179.4	-167.6	77.3	0	0	0	112.2	L104 L108 S132 R138 Q139 V140 M153	L104-L136 HydrophobicContact CD1-CD1 3.98Å; L104-L136 HydrophobicContact CD1-CD2 4.14Å; L104-L136 HydrophobicContact CD2-CD1 4.15Å; L104-L136 HydrophobicContact CG-CD1 4.45Å; L104-L136 HydrophobicContact CG-CD2 4.31Å; L108-L136 HydrophobicContact CD1-CD2 3.66Å; L108-L136 HydrophobicContact CD2-CD2 3.72Å; L108-L136 HydrophobicContact CG-CD2 3.35Å; S132-L136 VanDerWaalsContact O-CB 3.23Å; S132-L136 WeakPolarHBondContact O-CB 3.49Å; S132-L136 PolarHBondContact O-N 2.86Å; L136-R138 VanDerWaalsContact C-N 3.28Å; L136-R138 PolarHBondContact O-N 3.48Å; L136-Q139 PolarHBondContact O-N 3.15Å; L136-V140 WeakPolarHBondContact O-CG2 3.35Å; L136-V140 PolarHBondContact O-N 3.43Å; L136-V140 VanDerWaalsContact O-N 3.15Å; L136-M153 HydrophobicContact CD1-CE 3.42Å; L136-M153 VanDerWaalsContact CD1-CE 3.42Å; L136-M153 HydrophobicContact CG-CE 4.2Å
137	A	84	Confident	75	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-65	-32.1	177.3	0	0	0	0	0	112.7	L133 Q134 A135 L141 F173 I176 L177	L133-A137 VanDerWaalsContact O-CB 3.25Å; L133-A137 WeakPolarHBondContact O-CB 2.93Å; L133-A137 PolarHBondContact O-N 3.17Å; L133-A137 VanDerWaalsContact O-N 3.08Å; Q134-A137 PolarHBondContact O-N 3Å; A135-A137 PolarHBondContact O-N 3.37Å; A137-L141 WeakPolarHBondContact O-CD1 3.33Å; A137-L141 VanDerWaalsContact O-CG 3.26Å; A137-L141 WeakPolarHBondContact O-CG 3.46Å; A137-L141 PolarHBondContact O-N 3.35Å; A137-F173 HydrophobicContact CB-CD1 4.16Å; A137-I176 HydrophobicContact CB-CG2 4.06Å; A137-L177 HydrophobicContact CB-CD2 3.67Å; A137-L177 HydrophobicContact CB-CG 3.98Å
138	R	84.3	Confident	73.6	Confident	127 Å²	127	63.6 Å²	63.6	48%	0.479	36%	0.357	S	S	.	.	H	α-helix	trans	-71.3	-47.3	174.4	-78.5	177.6	176.5	147.7	-2.2	112.2	Q134 A135 L136 V140 L141 N142 L177	Q134-R138 VanDerWaalsContact CD-CZ 3.44Å; Q134-R138 VanDerWaalsContact CD-NH1 3.28Å; Q134-R138 WeakPolarHBondContact O-CB 3.13Å; Q134-R138 WeakPolarHBondContact O-CG 3.35Å; Q134-R138 PolarHBondContact O-N 2.86Å; Q134-R138 VanDerWaalsContact OE1-NH1 3.11Å; A135-R138 WeakPolarHBondContact O-CB 3.39Å; A135-R138 PolarHBondContact O-N 2.93Å; A135-R138 VanDerWaalsContact O-N 3.09Å; L136-R138 VanDerWaalsContact C-N 3.28Å; L136-R138 PolarHBondContact O-N 3.48Å; R138-V140 PolarHBondContact O-N 2.98Å; R138-L141 PolarHBondContact O-N 3.38Å; R138-N142 PolarHBondContact O-N 2.96Å; R138-L177 HydrophobicContact CG-CD1 3.96Å; R138-L177 HydrophobicContact CG-CD2 4.16Å
139	Q	82.4	Confident	72.1	Confident	56 Å²	56	63 Å²	63	26%	0.262	36%	0.363	S	S	.	.	H	α-helix	trans	-55.5	-38.6	177.5	-72.9	168.3	-5.1	0	0	111.6	A135 L136 D151 M153	A135-Q139 WeakPolarHBondContact O-CG 3.21Å; A135-Q139 PolarHBondContact O-N 2.99Å; L136-Q139 PolarHBondContact O-N 3.15Å; Q139-D151 PolarHBondContact NE2-O 2.98Å; Q139-M153 HydrophobicContact CB-CB 4.33Å
140	V	81.3	Confident	70.3	Confident	0 Å²	0	70 Å²	70	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-70.6	-31.3	176.8	178.2	0	0	0	0	112.7	L136 R138 M153 R158 L161 L162 F173	L136-V140 WeakPolarHBondContact O-CG2 3.35Å; L136-V140 PolarHBondContact O-N 3.43Å; L136-V140 VanDerWaalsContact O-N 3.15Å; R138-V140 PolarHBondContact O-N 2.98Å; V140-M153 HydrophobicContact CG2-CE 3.7Å; V140-M153 HydrophobicContact CG2-SD 3.73Å; V140-R158 VanDerWaalsContact O-CZ 3.22Å; V140-R158 PolarHBondContact O-NE 3.17Å; V140-R158 PolarHBondContact O-NH2 2.98Å; V140-L161 HydrophobicContact CG1-CD2 4.34Å; V140-L161 HydrophobicContact CG2-CD2 3.49Å; V140-L161 VanDerWaalsContact CG2-CD2 3.49Å; V140-L162 HydrophobicContact CG1-CD2 3.83Å; V140-L162 HydrophobicContact CG1-CG 4.25Å; V140-F173 HydrophobicContact CB-CD1 4.15Å; V140-F173 HydrophobicContact CB-CD2 4.18Å; V140-F173 HydrophobicContact CB-CE1 4.35Å; V140-F173 HydrophobicContact CB-CE2 4.41Å; V140-F173 HydrophobicContact CB-CG 4.04Å; V140-F173 HydrophobicContact CB-CZ 4.48Å; V140-F173 HydrophobicContact CG1-CB 4.45Å; V140-F173 HydrophobicContact CG1-CD1 4.26Å; V140-F173 HydrophobicContact CG1-CD2 3.41Å; V140-F173 VanDerWaalsContact CG1-CD2 3.41Å; V140-F173 HydrophobicContact CG1-CE1 4.4Å; V140-F173 HydrophobicContact CG1-CE2 3.61Å; V140-F173 HydrophobicContact CG1-CG 3.77Å; V140-F173 HydrophobicContact CG1-CZ 4.1Å; V140-F173 HydrophobicContact CG2-CD1 4.29Å; V140-F173 HydrophobicContact CG2-CE1 4.04Å; V140-F173 HydrophobicContact CG2-CE2 4.48Å; V140-F173 HydrophobicContact CG2-CZ 4.14Å
141	L	80.8	Confident	68.7	Low	29 Å²	29	76.2 Å²	76.2	15%	0.152	43%	0.433	C	S	.	.	H	α-helix	trans	-84.7	-44.9	-178	-70.4	172	0	0	0	112.5	A137 R138 R158 V170 F173 L177	A137-L141 WeakPolarHBondContact O-CD1 3.33Å; A137-L141 VanDerWaalsContact O-CG 3.26Å; A137-L141 WeakPolarHBondContact O-CG 3.46Å; A137-L141 PolarHBondContact O-N 3.35Å; R138-L141 PolarHBondContact O-N 3.38Å; L141-R158 PolarHBondContact O-NH2 2.78Å; L141-R158 VanDerWaalsContact O-NH2 3.14Å; L141-V170 HydrophobicContact CD2-CB 4.36Å; L141-V170 HydrophobicContact CD2-CG1 3.46Å; L141-V170 VanDerWaalsContact CD2-CG1 3.46Å; L141-V170 VanDerWaalsContact CD2-O 3.25Å; L141-V170 WeakPolarHBondContact CD2-O 3.39Å; L141-F173 HydrophobicContact CD1-CB 4.23Å; L141-F173 HydrophobicContact CD2-CB 3.95Å; L141-F173 HydrophobicContact CG-CB 3.91Å; L141-L177 HydrophobicContact CD1-CD1 3.4Å; L141-L177 HydrophobicContact CD1-CG 4.03Å
142	N	74.8	Confident	67.7	Low	126 Å²	126	78 Å²	78	67%	0.674	44%	0.436	S	S	*	.			trans	-123.5	88.7	-176.3	-65.6	-9.5	0	0	0	108.6	R138 S144	R138-N142 PolarHBondContact O-N 2.96Å; N142-S144 PolarHBondContact O-N 2.83Å
143	P	65.3	Low	67.2	Low	59 Å²	59	77 Å²	77	38%	0.383	43%	0.426	S	S	.	.			trans	-66.2	132.9	165.7	34.3	-37.8	0	0	0	107.3	D145	P143-D145 PolarHBondContact O-N 3.31Å
144	S	57.2	Low	66.5	Low	68 Å²	68	79.9 Å²	79.9	48%	0.476	45%	0.446	S	S	.	.			trans	-67	130.5	168.8	-4.6	0	0	0	0	108	N142 G146 E152	N142-S144 PolarHBondContact O-N 2.83Å; S144-G146 VanDerWaalsContact C-N 3.31Å; S144-G146 PolarHBondContact O-N 3.25Å; S144-G146 VanDerWaalsContact O-N 3.16Å; S144-E152 WeakPolarHBondContact CB-OE1 3.42Å; S144-E152 PolarHBondContact OG-OE1 3.46Å
145	D	46.8	Very low	66	Low	167 Å²	167	83.1 Å²	83.1	89%	0.893	47%	0.471	S	S	*	.			trans	-82.2	82.1	169.3	-76.5	-33.2	0	0	0	107.7	P143	P143-D145 PolarHBondContact O-N 3.31Å
146	G	43.5	Very low	65.5	Low	50 Å²	50	84.8 Å²	84.8	52%	0.515	47%	0.474	S	S	.	.	S	Bend	trans	89.7	134.2	164.9	0	0	0	0	0	117.5	S144	S144-G146 VanDerWaalsContact C-N 3.31Å; S144-G146 PolarHBondContact O-N 3.25Å; S144-G146 VanDerWaalsContact O-N 3.16Å
147	D	46.1	Very low	65.2	Low	157 Å²	157	85.6 Å²	85.6	84%	0.84	48%	0.478	S	S	*	.			trans	85.5	0.6	152.6	-60.6	-20.5	0	0	0	122
148	D	47	Very low	65.1	Low	128 Å²	128	88.5 Å²	88.5	68%	0.684	49%	0.488	S	S	*	.			trans	-97.4	109.9	167.7	-80.3	-32.1	0	0	0	111.4	D150	D148-D150 VanDerWaalsContact C-N 3.35Å; D148-D150 PolarHBondContact O-N 2.93Å
149	V	46.7	Very low	64.7	Low	134 Å²	134	89.9 Å²	89.9	81%	0.812	50%	0.495	S	S	*	.			trans	-78.7	-5.6	-160.8	179.6	0	0	0	0	115.1
150	D	45.6	Very low	64.4	Low	151 Å²	151	87.7 Å²	87.7	81%	0.807	49%	0.486	S	S	*	.	S	Bend	trans	-108.1	109.9	-173.5	-66.5	-33.6	0	0	0	111.8	D148	D148-D150 VanDerWaalsContact C-N 3.35Å; D148-D150 PolarHBondContact O-N 2.93Å
151	D	52.9	Low	64.3	Low	137 Å²	137	87.7 Å²	87.7	73%	0.733	49%	0.486	S	S	*	.	S	Bend	trans	75.7	39.7	171.9	-70.1	-25.4	0	0	0	118.8	Q139	Q139-D151 PolarHBondContact NE2-O 2.98Å
152	E	60.9	Low	64.2	Low	93 Å²	93	88.3 Å²	88.3	44%	0.435	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-85.4	118.4	174.6	-66.3	-164.4	153.3	0	0	113.9	S144 S154	S144-E152 WeakPolarHBondContact CB-OE1 3.42Å; S144-E152 PolarHBondContact OG-OE1 3.46Å; E152-S154 PolarHBondContact O-N 3.49Å
153	M	73.6	Confident	64.1	Low	32 Å²	32	85 Å²	85	16%	0.158	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-61.3	117.5	166.9	179.3	-179.1	-62.8	0	0	109.2	L104 L136 Q139 V140 M157 R158 L161	L104-M153 HydrophobicContact CD2-CE 3.71Å; L136-M153 HydrophobicContact CD1-CE 3.42Å; L136-M153 VanDerWaalsContact CD1-CE 3.42Å; L136-M153 HydrophobicContact CG-CE 4.2Å; Q139-M153 HydrophobicContact CB-CB 4.33Å; V140-M153 HydrophobicContact CG2-CE 3.7Å; V140-M153 HydrophobicContact CG2-SD 3.73Å; M153-M157 HydrophobicContact CG-CB 4.02Å; M153-M157 HydrophobicContact CG-CG 4.02Å; M153-M157 HydrophobicContact SD-CG 4.47Å; M153-R158 HydrophobicContact CG-CB 4.39Å; M153-R158 HydrophobicContact SD-CB 4.04Å; M153-L161 HydrophobicContact CE-CD2 4.42Å; M153-L161 HydrophobicContact SD-CD2 4.38Å
154	S	72.3	Confident	64.4	Low	60 Å²	60	84 Å²	84	42%	0.42	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-55.7	145.4	-177.8	74.1	0	0	0	0	112.1	E152 D156 M157 R158	E152-S154 PolarHBondContact O-N 3.49Å; S154-D156 PolarHBondContact O-N 2.93Å; S154-D156 VanDerWaalsContact O-N 3.12Å; S154-M157 PolarHBondContact O-N 3.49Å; S154-M157 VanDerWaalsContact OG-CB 3.3Å; S154-M157 WeakPolarHBondContact OG-CB 3.46Å; S154-M157 PolarHBondContact OG-N 3.48Å; S154-R158 PolarHBondContact O-N 2.95Å
155	P	73.7	Confident	64.9	Low	109 Å²	109	83.3 Å²	83.3	71%	0.708	46%	0.456	S	S	*	.	H	α-helix	trans	-53.1	-36.5	178.1	-27	33.7	0	0	0	112.8	R158 Y159	P155-R158 PolarHBondContact O-N 2.77Å; P155-Y159 WeakPolarHBondContact O-CB 3.3Å; P155-Y159 PolarHBondContact O-N 2.94Å
156	D	73	Confident	65.9	Low	77 Å²	77	81.6 Å²	81.6	41%	0.412	45%	0.454	S	S	.	.	H	α-helix	trans	-65.8	-42	176.5	-80.6	-23.2	0	0	0	113	R97 S154 Y159 S160	R97-D156 IonicContact CZ-OD2 3.14Å; R97-D156 IonicContact NH1-OD1 3.31Å; R97-D156 PolarHBondContact NH1-OD1 2.91Å; R97-D156 IonicContact NH1-OD2 2.94Å; R97-D156 PolarHBondContact NH1-OD2 3.47Å; R97-D156 IonicContact NH2-OD2 2.78Å; R97-D156 PolarHBondContact NH2-OD2 3.49Å; S154-D156 PolarHBondContact O-N 2.93Å; S154-D156 VanDerWaalsContact O-N 3.12Å; D156-Y159 PolarHBondContact O-N 3.31Å; D156-S160 WeakPolarHBondContact O-CB 3.41Å; D156-S160 PolarHBondContact O-N 2.83Å; D156-S160 PolarHBondContact O-OG 2.81Å
157	M	78	Confident	67.1	Low	38 Å²	38	81 Å²	81	19%	0.187	45%	0.448	C	S	.	.	H	α-helix	trans	-68.2	-41.8	176.9	-175.5	60.2	169.6	0	0	110.8	D100 A101 L104 M153 S154 Y159 S160 L161	D100-M157 HydrophobicContact CB-CE 4.02Å; D100-M157 HydrophobicContact CB-SD 4.23Å; A101-M157 HydrophobicContact CB-CE 4.45Å; A101-M157 HydrophobicContact CB-SD 4.49Å; L104-M157 HydrophobicContact CB-CE 3.88Å; L104-M157 HydrophobicContact CD2-CE 3.7Å; L104-M157 HydrophobicContact CG-CE 4.39Å; M153-M157 HydrophobicContact CG-CB 4.02Å; M153-M157 HydrophobicContact CG-CG 4.02Å; M153-M157 HydrophobicContact SD-CG 4.47Å; S154-M157 PolarHBondContact O-N 3.49Å; S154-M157 VanDerWaalsContact OG-CB 3.3Å; S154-M157 WeakPolarHBondContact OG-CB 3.46Å; S154-M157 PolarHBondContact OG-N 3.48Å; M157-Y159 PolarHBondContact O-N 3.38Å; M157-S160 PolarHBondContact O-N 3.41Å; M157-L161 WeakPolarHBondContact O-CB 3.48Å; M157-L161 PolarHBondContact O-N 3.15Å
158	R	80	Confident	68.5	Low	60 Å²	60	73.8 Å²	73.8	23%	0.226	41%	0.41	C	S	.	.	H	α-helix	trans	-58.5	-48.7	173.9	-177.6	-173.5	-177.7	-149.6	8.6	111.3	V140 L141 M153 S154 P155 S160 L161 L162	V140-R158 VanDerWaalsContact O-CZ 3.22Å; V140-R158 PolarHBondContact O-NE 3.17Å; V140-R158 PolarHBondContact O-NH2 2.98Å; L141-R158 PolarHBondContact O-NH2 2.78Å; L141-R158 VanDerWaalsContact O-NH2 3.14Å; M153-R158 HydrophobicContact CG-CB 4.39Å; M153-R158 HydrophobicContact SD-CB 4.04Å; S154-R158 PolarHBondContact O-N 2.95Å; P155-R158 PolarHBondContact O-N 2.77Å; R158-S160 VanDerWaalsContact C-N 3.32Å; R158-S160 PolarHBondContact O-N 3.39Å; R158-L161 PolarHBondContact O-N 2.84Å; R158-L162 HydrophobicContact CG-CD1 4Å; R158-L162 WeakPolarHBondContact O-CB 3.44Å; R158-L162 WeakPolarHBondContact O-CG 3.39Å; R158-L162 PolarHBondContact O-N 3.49Å
159	Y	77.6	Confident	69.9	Low	157 Å²	157	69.9 Å²	69.9	62%	0.616	39%	0.393	S	S	*	.	H	α-helix	trans	-60.1	-44.3	177.1	-178.9	-98.6	0	0	0	111.3	P155 D156 M157 L161 L162 T163	P155-Y159 WeakPolarHBondContact O-CB 3.3Å; P155-Y159 PolarHBondContact O-N 2.94Å; D156-Y159 PolarHBondContact O-N 3.31Å; M157-Y159 PolarHBondContact O-N 3.38Å; Y159-L161 PolarHBondContact O-N 3.25Å; Y159-L162 PolarHBondContact O-N 3Å; Y159-T163 HydrophobicContact CD1-CG2 4.44Å; Y159-T163 HydrophobicContact CD2-CG2 4.22Å; Y159-T163 HydrophobicContact CE1-CG2 4.09Å; Y159-T163 HydrophobicContact CE2-CG2 3.85Å; Y159-T163 WeakPolarHBondContact O-CB 3.25Å; Y159-T163 WeakPolarHBondContact O-CG2 3.47Å; Y159-T163 PolarHBondContact O-N 3.41Å; Y159-T163 PolarHBondContact O-OG1 3.42Å
160	S	76.1	Confident	71.5	Confident	10 Å²	10	67 Å²	67	7%	0.07	38%	0.375	C	S	.	.	H	α-helix	trans	-63	-41.1	178	-59.2	0	0	0	0	112	D156 M157 R158 T163 C164	D156-S160 WeakPolarHBondContact O-CB 3.41Å; D156-S160 PolarHBondContact O-N 2.83Å; D156-S160 PolarHBondContact O-OG 2.81Å; M157-S160 PolarHBondContact O-N 3.41Å; R158-S160 VanDerWaalsContact C-N 3.32Å; R158-S160 PolarHBondContact O-N 3.39Å; S160-T163 PolarHBondContact O-N 3.39Å; S160-C164 WeakPolarHBondContact O-CA 3.36Å; S160-C164 WeakPolarHBondContact O-CB 3.35Å; S160-C164 PolarHBondContact O-N 3.33Å
161	L	78.3	Confident	73.1	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-63.5	-46.4	176.3	-165.9	77	0	0	0	112	A101 L104 I105 V140 M153 M157 R158 Y159 T163 M168 F173	A101-L161 HydrophobicContact CB-CD1 4.35Å; L104-L161 HydrophobicContact CB-CD1 4.35Å; L104-L161 HydrophobicContact CD2-CD1 3.89Å; L104-L161 HydrophobicContact CD2-CD2 4.35Å; L104-L161 HydrophobicContact CG-CD1 4.35Å; I105-L161 HydrophobicContact CD1-CD1 4.45Å; I105-L161 HydrophobicContact CG1-CD1 3.91Å; V140-L161 HydrophobicContact CG1-CD2 4.34Å; V140-L161 HydrophobicContact CG2-CD2 3.49Å; V140-L161 VanDerWaalsContact CG2-CD2 3.49Å; M153-L161 HydrophobicContact CE-CD2 4.42Å; M153-L161 HydrophobicContact SD-CD2 4.38Å; M157-L161 WeakPolarHBondContact O-CB 3.48Å; M157-L161 PolarHBondContact O-N 3.15Å; R158-L161 PolarHBondContact O-N 2.84Å; Y159-L161 PolarHBondContact O-N 3.25Å; L161-T163 VanDerWaalsContact C-N 3.28Å; L161-T163 PolarHBondContact O-N 3.41Å; L161-M168 HydrophobicContact CD1-CE 4.35Å; L161-M168 HydrophobicContact CG-CE 4.25Å; L161-F173 HydrophobicContact CD2-CE1 4.19Å; L161-F173 HydrophobicContact CD2-CE2 4.01Å; L161-F173 HydrophobicContact CD2-CZ 3.41Å; L161-F173 VanDerWaalsContact CD2-CZ 3.41Å; L161-F173 HydrophobicContact CG-CZ 4.13Å
162	L	79.1	Confident	74.6	Confident	42 Å²	42	61.2 Å²	61.2	22%	0.22	34%	0.34	C	S	.	.	H	α-helix	trans	-70.8	-23.4	-178.5	-70	175	0	0	0	113.1	V140 R158 Y159 M168 V170 F173	V140-L162 HydrophobicContact CG1-CD2 3.83Å; V140-L162 HydrophobicContact CG1-CG 4.25Å; R158-L162 HydrophobicContact CG-CD1 4Å; R158-L162 WeakPolarHBondContact O-CB 3.44Å; R158-L162 WeakPolarHBondContact O-CG 3.39Å; R158-L162 PolarHBondContact O-N 3.49Å; Y159-L162 PolarHBondContact O-N 3Å; L162-M168 WeakPolarHBondContact CA-O 3.47Å; L162-M168 WeakPolarHBondContact CD2-O 3.29Å; L162-V170 HydrophobicContact CD1-CG2 4.21Å; L162-V170 HydrophobicContact CD2-CG2 4.21Å; L162-F173 HydrophobicContact CD2-CD2 4.22Å; L162-F173 HydrophobicContact CD2-CE2 4.13Å
163	T	73.4	Confident	75.7	Confident	57 Å²	57	56.8 Å²	56.8	35%	0.35	32%	0.319	S	S	.	.	H	α-helix	trans	-105.2	-7.4	-179.6	60.9	0	0	0	0	113.9	Y159 S160 L161 H165	Y159-T163 HydrophobicContact CD1-CG2 4.44Å; Y159-T163 HydrophobicContact CD2-CG2 4.22Å; Y159-T163 HydrophobicContact CE1-CG2 4.09Å; Y159-T163 HydrophobicContact CE2-CG2 3.85Å; Y159-T163 WeakPolarHBondContact O-CB 3.25Å; Y159-T163 WeakPolarHBondContact O-CG2 3.47Å; Y159-T163 PolarHBondContact O-N 3.41Å; Y159-T163 PolarHBondContact O-OG1 3.42Å; S160-T163 PolarHBondContact O-N 3.39Å; L161-T163 VanDerWaalsContact C-N 3.28Å; L161-T163 PolarHBondContact O-N 3.41Å; T163-H165 VanDerWaalsContact C-N 3.26Å; T163-H165 PolarHBondContact O-N 2.81Å
164	C	70.9	Confident	76.1	Confident	38 Å²	38	57.5 Å²	57.5	26%	0.257	33%	0.327	S	S	.	.	S	Bend	trans	-60.8	-35	179.2	173.6	0	0	0	0	112.3	A101 I105 S160	A101-C164 HydrophobicContact CB-CB 4.47Å; I105-C164 HydrophobicContact CD1-CB 4.29Å; S160-C164 WeakPolarHBondContact O-CA 3.36Å; S160-C164 WeakPolarHBondContact O-CB 3.35Å; S160-C164 PolarHBondContact O-N 3.33Å
165	H	67.3	Low	76.8	Confident	52 Å²	52	60.6 Å²	60.6	24%	0.241	33%	0.333	C	S	.	.	S	Bend	trans	-151.5	139.8	-176.7	-174.8	-94.6	0	0	0	111.1	T163 G167 M168	T163-H165 VanDerWaalsContact C-N 3.26Å; T163-H165 PolarHBondContact O-N 2.81Å; H165-G167 PolarHBondContact ND1-N 2.89Å; H165-G167 PolarHBondContact O-N 3.21Å; H165-M168 HydrophobicContact CB-CB 4.36Å; H165-M168 HydrophobicContact CB-CG 3.88Å; H165-M168 WeakPolarHBondContact O-CB 3.49Å; H165-M168 PolarHBondContact O-N 3.09Å
166	P	67.4	Low	77.3	Confident	131 Å²	131	55.6 Å²	55.6	85%	0.851	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.4	-178	-24.4	32.3	0	0	0	114.3
167	G	69.6	Low	77.9	Confident	38 Å²	38	53.9 Å²	53.9	39%	0.392	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-21.2	177.1	0	0	0	0	0	115.1	H165 S169 F172	H165-G167 PolarHBondContact ND1-N 2.89Å; H165-G167 PolarHBondContact O-N 3.21Å; G167-S169 PolarHBondContact O-N 3.48Å; G167-F172 WeakPolarHBondContact O-CB 3.25Å
168	M	75.1	Confident	78.2	Confident	6 Å²	6	55.3 Å²	55.3	3%	0.03	30%	0.302	C	S	.	.			trans	-83.2	56.8	-175.4	-68.5	-66.7	-62.9	0	0	111.4	I105 L108 L161 L162 H165 F172 F173	I105-M168 HydrophobicContact CD1-CE 4.14Å; I105-M168 HydrophobicContact CD1-CG 4.23Å; I105-M168 HydrophobicContact CD1-SD 4.48Å; I105-M168 HydrophobicContact CG1-CE 3.77Å; I105-M168 HydrophobicContact CG1-SD 4.44Å; L108-M168 HydrophobicContact CD1-CE 4.36Å; L161-M168 HydrophobicContact CD1-CE 4.35Å; L161-M168 HydrophobicContact CG-CE 4.25Å; L162-M168 WeakPolarHBondContact CA-O 3.47Å; L162-M168 WeakPolarHBondContact CD2-O 3.29Å; H165-M168 HydrophobicContact CB-CB 4.36Å; H165-M168 HydrophobicContact CB-CG 3.88Å; H165-M168 WeakPolarHBondContact O-CB 3.49Å; H165-M168 PolarHBondContact O-N 3.09Å; M168-F172 HydrophobicContact CE-CD1 4.23Å; M168-F172 HydrophobicContact CE-CE1 3.95Å; M168-F172 HydrophobicContact SD-CD1 3.94Å; M168-F172 HydrophobicContact SD-CE1 3.67Å; M168-F172 HydrophobicContact SD-CZ 4.14Å; M168-F173 HydrophobicContact CE-CE1 4.44Å; M168-F173 HydrophobicContact CE-CE2 3.86Å; M168-F173 HydrophobicContact CE-CZ 3.44Å; M168-F173 VanDerWaalsContact CE-CZ 3.44Å
169	S	76.5	Confident	78.5	Confident	46 Å²	46	55.1 Å²	55.1	32%	0.322	30%	0.301	S	S	.	.	S	Bend	trans	-90.1	167.4	-177.6	59.6	0	0	0	0	112.8	G167 M171 F172 F173	G167-S169 PolarHBondContact O-N 3.48Å; S169-M171 PolarHBondContact O-N 3.44Å; S169-M171 VanDerWaalsContact O-N 3.15Å; S169-M171 PolarHBondContact OG-N 3.27Å; S169-F172 WeakPolarHBondContact O-CA 3.32Å; S169-F172 VanDerWaalsContact O-CB 3.28Å; S169-F172 WeakPolarHBondContact O-CB 3.3Å; S169-F172 PolarHBondContact O-N 3.49Å; S169-F172 PolarHBondContact OG-N 3.39Å; S169-F173 WeakPolarHBondContact O-CD2 3.5Å; S169-F173 PolarHBondContact O-N 3.48Å
170	V	80.9	Confident	78.9	Confident	72 Å²	72	47.7 Å²	47.7	44%	0.436	27%	0.272	S	S	.	.	H	α-helix	trans	-49.6	-38.4	166	178.3	0	0	0	0	110.7	L141 L162 F172 F173 S174	L141-V170 HydrophobicContact CD2-CB 4.36Å; L141-V170 HydrophobicContact CD2-CG1 3.46Å; L141-V170 VanDerWaalsContact CD2-CG1 3.46Å; L141-V170 VanDerWaalsContact CD2-O 3.25Å; L141-V170 WeakPolarHBondContact CD2-O 3.39Å; L162-V170 HydrophobicContact CD1-CG2 4.21Å; L162-V170 HydrophobicContact CD2-CG2 4.21Å; V170-F172 VanDerWaalsContact C-N 3.31Å; V170-F172 PolarHBondContact O-N 2.95Å; V170-F173 PolarHBondContact O-N 3.15Å; V170-S174 WeakPolarHBondContact O-CB 3.25Å; V170-S174 PolarHBondContact O-N 3.43Å
171	M	78.7	Confident	79.3	Confident	121 Å²	121	51.1 Å²	51.1	60%	0.596	30%	0.296	S	S	*	.	H	α-helix	trans	-64	-32.2	176.2	-68.1	-61.2	-68.5	0	0	113.6	S169 K175	S169-M171 PolarHBondContact O-N 3.44Å; S169-M171 VanDerWaalsContact O-N 3.15Å; S169-M171 PolarHBondContact OG-N 3.27Å; M171-K175 WeakPolarHBondContact O-CB 3.48Å; M171-K175 VanDerWaalsContact O-CG 3.3Å; M171-K175 WeakPolarHBondContact O-CG 3.23Å; M171-K175 PolarHBondContact O-N 2.87Å
172	F	83.6	Confident	79.5	Confident	47 Å²	47	58.8 Å²	58.8	21%	0.206	33%	0.329	C	S	.	.	H	α-helix	trans	-65.2	-48.3	175.7	170	-98.5	0	0	0	111.3	G167 M168 S169 V170 S174 K175 I176	G167-F172 WeakPolarHBondContact O-CB 3.25Å; M168-F172 HydrophobicContact CE-CD1 4.23Å; M168-F172 HydrophobicContact CE-CE1 3.95Å; M168-F172 HydrophobicContact SD-CD1 3.94Å; M168-F172 HydrophobicContact SD-CE1 3.67Å; M168-F172 HydrophobicContact SD-CZ 4.14Å; S169-F172 WeakPolarHBondContact O-CA 3.32Å; S169-F172 VanDerWaalsContact O-CB 3.28Å; S169-F172 WeakPolarHBondContact O-CB 3.3Å; S169-F172 PolarHBondContact O-N 3.49Å; S169-F172 PolarHBondContact OG-N 3.39Å; V170-F172 VanDerWaalsContact C-N 3.31Å; V170-F172 PolarHBondContact O-N 2.95Å; F172-S174 PolarHBondContact O-N 3.34Å; F172-K175 WeakPolarHBondContact O-CB 3.2Å; F172-K175 PolarHBondContact O-N 3.33Å; F172-K175 VanDerWaalsContact O-N 3.17Å; F172-I176 HydrophobicContact CD1-CD1 3.97Å; F172-I176 HydrophobicContact CE1-CD1 3.37Å; F172-I176 HydrophobicContact CE1-CG1 4.37Å; F172-I176 HydrophobicContact CE2-CD1 4.4Å; F172-I176 HydrophobicContact CZ-CD1 3.63Å; F172-I176 HydrophobicContact CZ-CG1 4.37Å; F172-I176 PolarHBondContact O-N 2.98Å
173	F	84.3	Confident	79.7	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-66.9	-36.7	177.8	-68.6	-79.7	0	0	0	112.4	L108 A137 V140 L141 L161 L162 M168 S169 V170 K175 I176 L177	L108-F173 HydrophobicContact CD1-CE1 3.9Å; L108-F173 HydrophobicContact CD1-CZ 4.16Å; L108-F173 HydrophobicContact CD2-CE1 4.26Å; A137-F173 HydrophobicContact CB-CD1 4.16Å; V140-F173 HydrophobicContact CB-CD1 4.15Å; V140-F173 HydrophobicContact CB-CD2 4.18Å; V140-F173 HydrophobicContact CB-CE1 4.35Å; V140-F173 HydrophobicContact CB-CE2 4.41Å; V140-F173 HydrophobicContact CB-CG 4.04Å; V140-F173 HydrophobicContact CB-CZ 4.48Å; V140-F173 HydrophobicContact CG1-CB 4.45Å; V140-F173 HydrophobicContact CG1-CD1 4.26Å; V140-F173 HydrophobicContact CG1-CD2 3.41Å; V140-F173 VanDerWaalsContact CG1-CD2 3.41Å; V140-F173 HydrophobicContact CG1-CE1 4.4Å; V140-F173 HydrophobicContact CG1-CE2 3.61Å; V140-F173 HydrophobicContact CG1-CG 3.77Å; V140-F173 HydrophobicContact CG1-CZ 4.1Å; V140-F173 HydrophobicContact CG2-CD1 4.29Å; V140-F173 HydrophobicContact CG2-CE1 4.04Å; V140-F173 HydrophobicContact CG2-CE2 4.48Å; V140-F173 HydrophobicContact CG2-CZ 4.14Å; L141-F173 HydrophobicContact CD1-CB 4.23Å; L141-F173 HydrophobicContact CD2-CB 3.95Å; L141-F173 HydrophobicContact CG-CB 3.91Å; L161-F173 HydrophobicContact CD2-CE1 4.19Å; L161-F173 HydrophobicContact CD2-CE2 4.01Å; L161-F173 HydrophobicContact CD2-CZ 3.41Å; L161-F173 VanDerWaalsContact CD2-CZ 3.41Å; L161-F173 HydrophobicContact CG-CZ 4.13Å; L162-F173 HydrophobicContact CD2-CD2 4.22Å; L162-F173 HydrophobicContact CD2-CE2 4.13Å; M168-F173 HydrophobicContact CE-CE1 4.44Å; M168-F173 HydrophobicContact CE-CE2 3.86Å; M168-F173 HydrophobicContact CE-CZ 3.44Å; M168-F173 VanDerWaalsContact CE-CZ 3.44Å; S169-F173 WeakPolarHBondContact O-CD2 3.5Å; S169-F173 PolarHBondContact O-N 3.48Å; V170-F173 PolarHBondContact O-N 3.15Å; F173-K175 VanDerWaalsContact C-N 3.31Å; F173-K175 PolarHBondContact O-N 3.41Å; F173-I176 HydrophobicContact CD1-CD1 4.28Å; F173-I176 WeakPolarHBondContact O-CB 3.35Å; F173-I176 PolarHBondContact O-N 2.94Å; F173-I176 VanDerWaalsContact O-N 3.15Å; F173-L177 PolarHBondContact O-N 3.46Å
174	S	82.9	Confident	80.2	Confident	46 Å²	46	61.2 Å²	61.2	32%	0.322	33%	0.331	S	S	.	.	H	α-helix	trans	-60.9	-39.8	172	-179.9	0	0	0	0	112	V170 F172 L177 T178	V170-S174 WeakPolarHBondContact O-CB 3.25Å; V170-S174 PolarHBondContact O-N 3.43Å; F172-S174 PolarHBondContact O-N 3.34Å; S174-L177 PolarHBondContact O-N 2.86Å; S174-T178 WeakPolarHBondContact O-CB 3.37Å; S174-T178 PolarHBondContact O-N 3.39Å; S174-T178 PolarHBondContact O-OG1 3.05Å
175	K	85.4	Confident	80.7	Confident	126 Å²	126	68.5 Å²	68.5	55%	0.548	35%	0.353	S	S	.	.	H	α-helix	trans	-65.6	-37.4	173	-76.5	176	-178.9	-179.4	0	112.6	M171 F172 F173 T178 W179	M171-K175 WeakPolarHBondContact O-CB 3.48Å; M171-K175 VanDerWaalsContact O-CG 3.3Å; M171-K175 WeakPolarHBondContact O-CG 3.23Å; M171-K175 PolarHBondContact O-N 2.87Å; F172-K175 WeakPolarHBondContact O-CB 3.2Å; F172-K175 PolarHBondContact O-N 3.33Å; F172-K175 VanDerWaalsContact O-N 3.17Å; F173-K175 VanDerWaalsContact C-N 3.31Å; F173-K175 PolarHBondContact O-N 3.41Å; K175-T178 PolarHBondContact O-N 2.9Å; K175-W179 VanDerWaalsContact O-CB 3.29Å; K175-W179 WeakPolarHBondContact O-CB 3.36Å; K175-W179 PolarHBondContact O-N 3.09Å
176	I	85.1	Confident	81.5	Confident	4 Å²	4	71.8 Å²	71.8	2%	0.021	37%	0.365	C	S	.	.	H	α-helix	trans	-60.1	-50.2	172.8	-70.3	173.1	0	0	0	110.2	M1 L108 L133 A137 F172 F173 T178 W179 L180	M1-I176 HydrophobicContact CE-CG1 4.05Å; L108-I176 HydrophobicContact CD2-CD1 4.34Å; L133-I176 HydrophobicContact CD1-CG2 4.17Å; L133-I176 HydrophobicContact CD2-CG2 4.38Å; L133-I176 HydrophobicContact CG-CG2 4.04Å; A137-I176 HydrophobicContact CB-CG2 4.06Å; F172-I176 HydrophobicContact CD1-CD1 3.97Å; F172-I176 HydrophobicContact CE1-CD1 3.37Å; F172-I176 HydrophobicContact CE1-CG1 4.37Å; F172-I176 HydrophobicContact CE2-CD1 4.4Å; F172-I176 HydrophobicContact CZ-CD1 3.63Å; F172-I176 HydrophobicContact CZ-CG1 4.37Å; F172-I176 PolarHBondContact O-N 2.98Å; F173-I176 HydrophobicContact CD1-CD1 4.28Å; F173-I176 WeakPolarHBondContact O-CB 3.35Å; F173-I176 PolarHBondContact O-N 2.94Å; F173-I176 VanDerWaalsContact O-N 3.15Å; I176-T178 VanDerWaalsContact C-N 3.31Å; I176-T178 PolarHBondContact O-N 3.08Å; I176-W179 WeakPolarHBondContact O-CB 3.37Å; I176-W179 PolarHBondContact O-N 2.81Å; I176-W179 VanDerWaalsContact O-N 3.15Å; I176-L180 HydrophobicContact CG2-CD1 3.95Å; I176-L180 HydrophobicContact CG2-CG 4.3Å; I176-L180 WeakPolarHBondContact O-CG 3.44Å; I176-L180 PolarHBondContact O-N 3.44Å
177	L	84.7	Confident	82.2	Confident	40 Å²	40	65.6 Å²	65.6	21%	0.209	32%	0.324	C	S	.	.	H	α-helix	trans	-61.4	-40.7	178.4	-70.7	-169.5	0	0	0	112.3	Q134 A137 R138 L141 F173 S174 W179 L180 S181	Q134-L177 HydrophobicContact CG-CD2 4.18Å; A137-L177 HydrophobicContact CB-CD2 3.67Å; A137-L177 HydrophobicContact CB-CG 3.98Å; R138-L177 HydrophobicContact CG-CD1 3.96Å; R138-L177 HydrophobicContact CG-CD2 4.16Å; L141-L177 HydrophobicContact CD1-CD1 3.4Å; L141-L177 HydrophobicContact CD1-CG 4.03Å; F173-L177 PolarHBondContact O-N 3.46Å; S174-L177 PolarHBondContact O-N 2.86Å; L177-W179 VanDerWaalsContact C-N 3.34Å; L177-W179 PolarHBondContact O-N 3.21Å; L177-L180 HydrophobicContact CD2-CD1 4.36Å; L177-L180 PolarHBondContact O-N 2.8Å; L177-S181 VanDerWaalsContact O-CB 3.31Å; L177-S181 WeakPolarHBondContact O-CB 3.26Å; L177-S181 PolarHBondContact O-N 3.32Å
178	T	85.2	Confident	83.2	Confident	69 Å²	69	68.1 Å²	68.1	42%	0.423	32%	0.322	S	S	.	.	H	α-helix	trans	-62	-43	175	-57	0	0	0	0	111.3	S174 K175 I176 S181 K182	S174-T178 WeakPolarHBondContact O-CB 3.37Å; S174-T178 PolarHBondContact O-N 3.39Å; S174-T178 PolarHBondContact O-OG1 3.05Å; K175-T178 PolarHBondContact O-N 2.9Å; I176-T178 VanDerWaalsContact C-N 3.31Å; I176-T178 PolarHBondContact O-N 3.08Å; T178-S181 PolarHBondContact O-N 3.17Å; T178-K182 WeakPolarHBondContact O-CG 3.41Å; T178-K182 PolarHBondContact O-N 3.36Å
179	W	86	Confident	83.7	Confident	55 Å²	55	72.7 Å²	72.7	21%	0.208	34%	0.343	C	S	.	.	H	α-helix	trans	-63.8	-47.8	176.6	177.7	86.2	0	0	0	111.4	F112 C115 K175 I176 L177 S181 K182 R183	F112-W179 HydrophobicContact CD2-CE3 4.34Å; F112-W179 HydrophobicContact CD2-CH2 4.25Å; F112-W179 HydrophobicContact CD2-CZ3 4.01Å; F112-W179 AromaticContact CE2-CD2 3.98Å; F112-W179 HydrophobicContact CE2-CD2 3.98Å; F112-W179 AromaticContact CE2-CE3 3.87Å; F112-W179 HydrophobicContact CE2-CE3 3.87Å; F112-W179 AromaticContact CE2-CH2 3.85Å; F112-W179 HydrophobicContact CE2-CH2 3.85Å; F112-W179 AromaticContact CE2-CZ2 3.96Å; F112-W179 HydrophobicContact CE2-CZ2 3.96Å; F112-W179 AromaticContact CE2-CZ3 3.79Å; F112-W179 HydrophobicContact CE2-CZ3 3.79Å; F112-W179 HydrophobicContact CZ-CH2 4.36Å; F112-W179 HydrophobicContact CZ-CZ2 4.16Å; C115-W179 HydrophobicContact CB-CH2 3.85Å; C115-W179 HydrophobicContact CB-CZ3 3.94Å; K175-W179 VanDerWaalsContact O-CB 3.29Å; K175-W179 WeakPolarHBondContact O-CB 3.36Å; K175-W179 PolarHBondContact O-N 3.09Å; I176-W179 WeakPolarHBondContact O-CB 3.37Å; I176-W179 PolarHBondContact O-N 2.81Å; I176-W179 VanDerWaalsContact O-N 3.15Å; L177-W179 VanDerWaalsContact C-N 3.34Å; L177-W179 PolarHBondContact O-N 3.21Å; W179-S181 VanDerWaalsContact C-N 3.3Å; W179-S181 PolarHBondContact O-N 3.1Å; W179-K182 PolarHBondContact O-N 3.04Å; W179-R183 HydrophobicContact CH2-CG 4.42Å; W179-R183 HydrophobicContact CZ2-CG 4.35Å; W179-R183 VanDerWaalsContact O-CB 3.25Å; W179-R183 WeakPolarHBondContact O-CB 3.42Å; W179-R183 PolarHBondContact O-N 3.5Å
180	L	86.4	Confident	84.2	Confident	1 Å²	1	72 Å²	72	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-58.1	-42.9	175.5	-72.5	173.3	0	0	0	111.5	Y130 L133 Q134 I176 L177 R183 K184	Y130-L180 HydrophobicContact CD2-CD2 3.63Å; Y130-L180 HydrophobicContact CE2-CB 4.06Å; Y130-L180 HydrophobicContact CE2-CD2 3.59Å; Y130-L180 HydrophobicContact CE2-CG 4.36Å; L133-L180 HydrophobicContact CD2-CD1 4.46Å; L133-L180 HydrophobicContact CD2-CD2 4.11Å; L133-L180 HydrophobicContact CG-CD1 4.18Å; Q134-L180 HydrophobicContact CB-CD1 4Å; I176-L180 HydrophobicContact CG2-CD1 3.95Å; I176-L180 HydrophobicContact CG2-CG 4.3Å; I176-L180 WeakPolarHBondContact O-CG 3.44Å; I176-L180 PolarHBondContact O-N 3.44Å; L177-L180 HydrophobicContact CD2-CD1 4.36Å; L177-L180 PolarHBondContact O-N 2.8Å; L180-R183 CarbonylContact O-C 3.56Å; L180-R183 PolarHBondContact O-N 3.05Å; L180-K184 WeakPolarHBondContact O-CB 3.44Å; L180-K184 PolarHBondContact O-N 2.99Å
181	S	83.8	Confident	84.6	Confident	82 Å²	82	68.6 Å²	68.6	57%	0.573	31%	0.314	S	S	*	.	H	α-helix	trans	-61	-47.8	176.7	-178.3	0	0	0	0	112.2	L177 T178 W179 R183 K184	L177-S181 VanDerWaalsContact O-CB 3.31Å; L177-S181 WeakPolarHBondContact O-CB 3.26Å; L177-S181 PolarHBondContact O-N 3.32Å; T178-S181 PolarHBondContact O-N 3.17Å; W179-S181 VanDerWaalsContact C-N 3.3Å; W179-S181 PolarHBondContact O-N 3.1Å; S181-R183 VanDerWaalsContact C-N 3.35Å; S181-R183 PolarHBondContact O-N 2.81Å; S181-K184 VanDerWaalsContact O-CB 3.3Å; S181-K184 WeakPolarHBondContact O-CB 3.36Å; S181-K184 PolarHBondContact O-N 3.26Å
182	K	83.6	Confident	85.2	Confident	162 Å²	162	64.9 Å²	64.9	70%	0.704	30%	0.296	S	S	*	.	H	α-helix	trans	-62.6	-42.3	174.2	-72	-179.5	179.9	-178	0	111.6	T178 W179 K184 R185	T178-K182 WeakPolarHBondContact O-CG 3.41Å; T178-K182 PolarHBondContact O-N 3.36Å; W179-K182 PolarHBondContact O-N 3.04Å; K182-K184 VanDerWaalsContact C-N 3.29Å; K182-K184 PolarHBondContact O-N 3.38Å; K182-R185 PolarHBondContact O-N 3.45Å
183	R	82	Confident	85.4	Confident	64 Å²	64	71.2 Å²	71.2	24%	0.242	32%	0.318	C	S	.	.	H	α-helix	trans	-65.3	-32.3	179.8	-161.2	67.8	168.2	162.9	0.2	111.8	Q116 W179 L180 S181 R185 Y186 M187	Q116-R183 PolarHBondContact O-NH2 3.41Å; W179-R183 HydrophobicContact CH2-CG 4.42Å; W179-R183 HydrophobicContact CZ2-CG 4.35Å; W179-R183 VanDerWaalsContact O-CB 3.25Å; W179-R183 WeakPolarHBondContact O-CB 3.42Å; W179-R183 PolarHBondContact O-N 3.5Å; L180-R183 CarbonylContact O-C 3.56Å; L180-R183 PolarHBondContact O-N 3.05Å; S181-R183 VanDerWaalsContact C-N 3.35Å; S181-R183 PolarHBondContact O-N 2.81Å; R183-R185 PolarHBondContact O-N 2.83Å; R183-Y186 WeakPolarHBondContact O-CB 3.14Å; R183-Y186 PolarHBondContact O-N 3.39Å; R183-Y186 VanDerWaalsContact O-N 3.09Å; R183-M187 HydrophobicContact CG-CE 3.98Å; R183-M187 HydrophobicContact CG-CG 4.12Å; R183-M187 WeakPolarHBondContact O-CG 3.45Å; R183-M187 PolarHBondContact O-N 2.99Å
184	K	84.8	Confident	85.5	Confident	85 Å²	85	72.5 Å²	72.5	37%	0.37	32%	0.324	S	S	.	.	H	α-helix	trans	-52	-41.8	176.8	-168.4	178.9	-177.9	173.9	0	112.2	L180 S181 K182 M187 R188 F230	L180-K184 WeakPolarHBondContact O-CB 3.44Å; L180-K184 PolarHBondContact O-N 2.99Å; S181-K184 VanDerWaalsContact O-CB 3.3Å; S181-K184 WeakPolarHBondContact O-CB 3.36Å; S181-K184 PolarHBondContact O-N 3.26Å; K182-K184 VanDerWaalsContact C-N 3.29Å; K182-K184 PolarHBondContact O-N 3.38Å; K184-M187 PolarHBondContact O-N 3.45Å; K184-R188 WeakPolarHBondContact O-CB 3.11Å; K184-R188 VanDerWaalsContact O-CG 3.28Å; K184-R188 WeakPolarHBondContact O-CG 3.18Å; K184-R188 PolarHBondContact O-N 3.5Å; K184-F230 HydrophobicContact CB-CE1 4.39Å; K184-F230 HydrophobicContact CG-CD1 3.79Å; K184-F230 HydrophobicContact CG-CE1 3.96Å
185	R	82	Confident	85.8	Confident	192 Å²	192	70.5 Å²	70.5	73%	0.725	31%	0.31	S	S	*	.	H	α-helix	trans	-64.5	-46.4	178.4	-173.9	177.6	-178.3	170.1	1.3	112.4	K182 R183 M187 R188 Q189	K182-R185 PolarHBondContact O-N 3.45Å; R183-R185 PolarHBondContact O-N 2.83Å; R185-M187 VanDerWaalsContact C-N 3.34Å; R185-R188 PolarHBondContact O-N 3.07Å; R185-Q189 PolarHBondContact O-N 3.28Å
186	Y	82.5	Confident	85.8	Confident	121 Å²	121	73.5 Å²	73.5	48%	0.475	32%	0.318	S	S	.	.	H	α-helix	trans	-61.7	-44.8	176.4	173.9	-92	0	0	0	111	R183 R188 Q189 F190	R183-Y186 WeakPolarHBondContact O-CB 3.14Å; R183-Y186 PolarHBondContact O-N 3.39Å; R183-Y186 VanDerWaalsContact O-N 3.09Å; Y186-R188 PolarHBondContact O-N 2.94Å; Y186-Q189 PolarHBondContact O-N 3.23Å; Y186-Q189 VanDerWaalsContact O-N 3.15Å; Y186-F190 PolarHBondContact O-N 3.38Å
187	M	83.9	Confident	85.8	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-64.5	-40.6	-179.8	-68.9	-62.5	167.7	0	0	112.1	V118 F126 R183 K184 R185 Q189 F190 L191 F230	V118-M187 HydrophobicContact CB-CE 3.9Å; V118-M187 HydrophobicContact CB-SD 4.26Å; V118-M187 HydrophobicContact CG1-SD 4.47Å; V118-M187 HydrophobicContact CG2-CE 3.54Å; V118-M187 HydrophobicContact CG2-SD 4.12Å; F126-M187 HydrophobicContact CE1-CG 4.33Å; F126-M187 HydrophobicContact CE1-SD 4.16Å; F126-M187 HydrophobicContact CE2-CE 4.45Å; F126-M187 HydrophobicContact CE2-SD 4.43Å; F126-M187 HydrophobicContact CZ-CB 4.39Å; F126-M187 HydrophobicContact CZ-CE 4.34Å; F126-M187 HydrophobicContact CZ-CG 3.76Å; F126-M187 HydrophobicContact CZ-SD 3.8Å; R183-M187 HydrophobicContact CG-CE 3.98Å; R183-M187 HydrophobicContact CG-CG 4.12Å; R183-M187 WeakPolarHBondContact O-CG 3.45Å; R183-M187 PolarHBondContact O-N 2.99Å; K184-M187 PolarHBondContact O-N 3.45Å; R185-M187 VanDerWaalsContact C-N 3.34Å; M187-Q189 VanDerWaalsContact C-N 3.28Å; M187-Q189 PolarHBondContact O-N 3.47Å; M187-F190 PolarHBondContact O-N 3.29Å; M187-L191 WeakPolarHBondContact O-CB 3.45Å; M187-L191 VanDerWaalsContact O-CG 3.26Å; M187-L191 WeakPolarHBondContact O-CG 3.36Å; M187-L191 PolarHBondContact O-N 2.84Å; M187-F230 HydrophobicContact CB-CD1 4.11Å; M187-F230 HydrophobicContact CB-CE1 3.7Å; M187-F230 HydrophobicContact CB-CZ 4.11Å; M187-F230 HydrophobicContact CG-CE1 4.35Å; M187-F230 HydrophobicContact CG-CZ 4.47Å
188	R	89.5	Confident	85.9	Confident	91 Å²	91	73.7 Å²	73.7	34%	0.343	33%	0.325	S	S	.	.	H	α-helix	trans	-56.7	-42.2	173.2	-75	177.2	75.2	111.5	-7.3	112	K184 R185 Y186 L192 F230 G231 L232	K184-R188 WeakPolarHBondContact O-CB 3.11Å; K184-R188 VanDerWaalsContact O-CG 3.28Å; K184-R188 WeakPolarHBondContact O-CG 3.18Å; K184-R188 PolarHBondContact O-N 3.5Å; R185-R188 PolarHBondContact O-N 3.07Å; Y186-R188 PolarHBondContact O-N 2.94Å; R188-L192 WeakPolarHBondContact O-CB 3.45Å; R188-L192 VanDerWaalsContact O-CG 3.22Å; R188-L192 WeakPolarHBondContact O-CG 3.29Å; R188-L192 PolarHBondContact O-N 2.76Å; R188-L192 VanDerWaalsContact O-N 3.09Å; R188-F230 HydrophobicContact CG-CB 4.29Å; R188-F230 HydrophobicContact CG-CD1 4.32Å; R188-F230 PolarHBondContact NH1-O 3.05Å; R188-G231 PolarHBondContact NH1-O 3.12Å; R188-L232 HydrophobicContact CB-CD1 3.73Å; R188-L232 HydrophobicContact CG-CD1 3.64Å; R188-L232 HydrophobicContact CG-CD2 4.45Å; R188-L232 HydrophobicContact CG-CG 4.05Å; R188-L232 VanDerWaalsContact CZ-CD2 3.41Å
189	Q	86.9	Confident	85.9	Confident	102 Å²	102	70.4 Å²	70.4	48%	0.477	31%	0.305	S	S	.	.	H	α-helix	trans	-69.1	-40.7	176.8	-69	-178.2	-12.3	0	0	112.5	R185 Y186 M187 R193	R185-Q189 PolarHBondContact O-N 3.28Å; Y186-Q189 PolarHBondContact O-N 3.23Å; Y186-Q189 VanDerWaalsContact O-N 3.15Å; M187-Q189 VanDerWaalsContact C-N 3.28Å; M187-Q189 PolarHBondContact O-N 3.47Å; Q189-R193 WeakPolarHBondContact O-CG 3.4Å; Q189-R193 PolarHBondContact O-N 2.88Å; Q189-R193 VanDerWaalsContact O-N 3.09Å
190	F	86.8	Confident	85.8	Confident	33 Å²	33	69.7 Å²	69.7	15%	0.145	31%	0.311	C	S	.	.	H	α-helix	trans	-61.1	-50	175.6	174.5	-102.6	0	0	0	111.5	V118 L123 Y186 M187 L192 R193 Q194	V118-F190 HydrophobicContact CG1-CD1 4.5Å; V118-F190 HydrophobicContact CG1-CE1 3.91Å; L123-F190 HydrophobicContact CD2-CE1 4.16Å; L123-F190 HydrophobicContact CG-CE1 4.49Å; Y186-F190 PolarHBondContact O-N 3.38Å; M187-F190 PolarHBondContact O-N 3.29Å; F190-L192 VanDerWaalsContact C-N 3.35Å; F190-L192 PolarHBondContact O-N 3.39Å; F190-R193 WeakPolarHBondContact O-CB 3.46Å; F190-R193 PolarHBondContact O-N 3.39Å; F190-R193 VanDerWaalsContact O-N 3.08Å; F190-Q194 HydrophobicContact CD1-CG 4.28Å; F190-Q194 HydrophobicContact CD2-CG 4.42Å; F190-Q194 HydrophobicContact CE1-CG 3.87Å; F190-Q194 HydrophobicContact CE2-CG 4.03Å; F190-Q194 HydrophobicContact CZ-CG 3.74Å; F190-Q194 WeakPolarHBondContact O-CG 3.2Å; F190-Q194 PolarHBondContact O-N 3.44Å
191	L	89.4	Confident	85.6	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61.8	-39.9	179.1	-67.3	174.5	0	0	0	112.2	L123 M187 R193 Q194 W195 L223 A226 L227 F230 L232	L123-L191 HydrophobicContact CD2-CD2 3.64Å; M187-L191 WeakPolarHBondContact O-CB 3.45Å; M187-L191 VanDerWaalsContact O-CG 3.26Å; M187-L191 WeakPolarHBondContact O-CG 3.36Å; M187-L191 PolarHBondContact O-N 2.84Å; L191-R193 VanDerWaalsContact C-N 3.31Å; L191-R193 PolarHBondContact O-N 2.83Å; L191-Q194 PolarHBondContact O-N 2.67Å; L191-W195 WeakPolarHBondContact O-CB 3.36Å; L191-W195 PolarHBondContact O-N 2.97Å; L191-L223 HydrophobicContact CD2-CD1 3.84Å; L191-A226 HydrophobicContact CD1-CB 4.19Å; L191-A226 HydrophobicContact CD2-CB 3.63Å; L191-L227 HydrophobicContact CB-CD2 3.87Å; L191-F230 HydrophobicContact CD1-CB 3.93Å; L191-F230 HydrophobicContact CD1-CD2 3.68Å; L191-F230 HydrophobicContact CD1-CE2 4.44Å; L191-F230 HydrophobicContact CD1-CG 3.79Å; L191-L232 HydrophobicContact CB-CD1 4.45Å
192	L	89.4	Confident	85.5	Confident	42 Å²	42	73.7 Å²	73.7	22%	0.22	32%	0.32	C	S	.	.	H	α-helix	trans	-65.6	-33.5	174.7	-72.4	173.3	0	0	0	112.8	R188 F190 R196 L232 F235 V236	R188-L192 WeakPolarHBondContact O-CB 3.45Å; R188-L192 VanDerWaalsContact O-CG 3.22Å; R188-L192 WeakPolarHBondContact O-CG 3.29Å; R188-L192 PolarHBondContact O-N 2.76Å; R188-L192 VanDerWaalsContact O-N 3.09Å; F190-L192 VanDerWaalsContact C-N 3.35Å; F190-L192 PolarHBondContact O-N 3.39Å; L192-R196 WeakPolarHBondContact O-CG 3.34Å; L192-R196 PolarHBondContact O-N 3.41Å; L192-L232 HydrophobicContact CD1-CD2 4.48Å; L192-L232 HydrophobicContact CD2-CD1 4.44Å; L192-L232 HydrophobicContact CD2-CD2 4.5Å; L192-L232 HydrophobicContact CG-CD1 4.13Å; L192-F235 HydrophobicContact CD2-CD1 4.09Å; L192-F235 HydrophobicContact CD2-CE1 4.02Å; L192-V236 HydrophobicContact CD2-CG1 3.57Å
193	R	87.9	Confident	85	Confident	180 Å²	180	68.7 Å²	68.7	68%	0.679	30%	0.299	S	S	*	.	H	α-helix	trans	-69.7	-43.6	173.4	-73.7	176.3	-178.5	-179.2	0.5	111.3	Q189 F190 L191 W195 R196 A197	Q189-R193 WeakPolarHBondContact O-CG 3.4Å; Q189-R193 PolarHBondContact O-N 2.88Å; Q189-R193 VanDerWaalsContact O-N 3.09Å; F190-R193 WeakPolarHBondContact O-CB 3.46Å; F190-R193 PolarHBondContact O-N 3.39Å; F190-R193 VanDerWaalsContact O-N 3.08Å; L191-R193 VanDerWaalsContact C-N 3.31Å; L191-R193 PolarHBondContact O-N 2.83Å; R193-W195 VanDerWaalsContact C-N 3.33Å; R193-R196 PolarHBondContact O-N 3.44Å; R193-A197 WeakPolarHBondContact O-CB 3.17Å; R193-A197 PolarHBondContact O-N 2.77Å
194	Q	88	Confident	84.7	Confident	27 Å²	27	70 Å²	70	13%	0.126	31%	0.308	C	S	.	.	H	α-helix	trans	-62.9	-41.2	175.6	-67.6	-59.5	-16.3	0	0	111.3	L123 F190 L191 R196 A197 T198 L223	L123-Q194 HydrophobicContact CD1-CG 4.38Å; F190-Q194 HydrophobicContact CD1-CG 4.28Å; F190-Q194 HydrophobicContact CD2-CG 4.42Å; F190-Q194 HydrophobicContact CE1-CG 3.87Å; F190-Q194 HydrophobicContact CE2-CG 4.03Å; F190-Q194 HydrophobicContact CZ-CG 3.74Å; F190-Q194 WeakPolarHBondContact O-CG 3.2Å; F190-Q194 PolarHBondContact O-N 3.44Å; L191-Q194 PolarHBondContact O-N 2.67Å; Q194-R196 PolarHBondContact O-N 2.87Å; Q194-A197 CarbonylContact O-C 3.48Å; Q194-A197 PolarHBondContact O-N 3.38Å; Q194-T198 WeakPolarHBondContact O-CB 3.42Å; Q194-T198 PolarHBondContact O-N 2.88Å; Q194-T198 PolarHBondContact O-OG1 3.14Å; Q194-T198 VanDerWaalsContact O-OG1 3.07Å; Q194-L223 HydrophobicContact CB-CD1 3.87Å; Q194-L223 HydrophobicContact CB-CD2 4.26Å
195	W	88.3	Confident	83.9	Confident	5 Å²	5	71.9 Å²	71.9	2%	0.019	32%	0.321	C	S	.	.	H	α-helix	trans	-54.7	-52.1	174.9	178.3	-96.9	0	0	0	111.4	L191 R193 A197 T198 F199 W201 L220 L223 L227 V236 L316	L191-W195 WeakPolarHBondContact O-CB 3.36Å; L191-W195 PolarHBondContact O-N 2.97Å; R193-W195 VanDerWaalsContact C-N 3.33Å; W195-A197 PolarHBondContact O-N 2.76Å; W195-T198 PolarHBondContact O-N 3.42Å; W195-F199 HydrophobicContact CD2-CD1 4.5Å; W195-F199 AromaticContact CE2-CD1 3.7Å; W195-F199 AromaticContact CH2-CD1 3.77Å; W195-F199 HydrophobicContact CH2-CD1 3.77Å; W195-F199 HydrophobicContact CH2-CE1 4.28Å; W195-F199 AromaticContact CZ2-CD1 3.32Å; W195-F199 HydrophobicContact CZ2-CD1 3.32Å; W195-F199 AromaticContact CZ2-CE1 3.79Å; W195-F199 HydrophobicContact CZ2-CE1 3.79Å; W195-F199 HydrophobicContact CZ2-CG 4.37Å; W195-F199 HydrophobicContact CZ3-CD1 4.5Å; W195-F199 CarbonylContact O-C 3.54Å; W195-F199 WeakPolarHBondContact O-CA 3.46Å; W195-F199 PolarHBondContact O-N 2.89Å; W195-W201 AromaticContact NE1-CH2 3.93Å; W195-W201 AromaticContact NE1-CZ3 3.66Å; W195-L220 HydrophobicContact CE3-CD1 4.18Å; W195-L220 HydrophobicContact CH2-CD1 4.29Å; W195-L220 HydrophobicContact CZ3-CD1 3.61Å; W195-L223 HydrophobicContact CB-CD2 4.23Å; W195-L223 HydrophobicContact CE3-CD2 4.08Å; W195-L223 HydrophobicContact CE3-CG 4.41Å; W195-L227 HydrophobicContact CB-CD1 4.4Å; W195-L227 HydrophobicContact CD2-CD1 3.94Å; W195-L227 HydrophobicContact CE3-CD1 3.31Å; W195-L227 HydrophobicContact CG-CD1 4.41Å; W195-L227 HydrophobicContact CZ3-CD1 3.85Å; W195-V236 HydrophobicContact CD2-CB 4.15Å; W195-V236 HydrophobicContact CD2-CG1 4.36Å; W195-V236 HydrophobicContact CD2-CG2 4.07Å; W195-V236 HydrophobicContact CE3-CG2 4.35Å; W195-V236 HydrophobicContact CG-CB 4.38Å; W195-V236 HydrophobicContact CG-CG1 4.13Å; W195-V236 HydrophobicContact CH2-CG2 4.08Å; W195-V236 HydrophobicContact CZ2-CB 3.98Å; W195-V236 HydrophobicContact CZ2-CG2 3.79Å; W195-V236 HydrophobicContact CZ3-CG2 4.35Å; W195-L316 HydrophobicContact CH2-CD1 4.4Å; W195-L316 HydrophobicContact CH2-CD2 4.24Å
196	R	86.4	Confident	83.3	Confident	188 Å²	188	72 Å²	72	71%	0.709	33%	0.33	S	S	*	.	H	α-helix	trans	-63.1	-27.8	177.1	-68.2	174.1	-176.7	-178.7	-0.5	113.5	L192 R193 Q194	L192-R196 WeakPolarHBondContact O-CG 3.34Å; L192-R196 PolarHBondContact O-N 3.41Å; R193-R196 PolarHBondContact O-N 3.44Å; Q194-R196 PolarHBondContact O-N 2.87Å
197	A	85.3	Confident	82.5	Confident	41 Å²	41	68.8 Å²	68.8	34%	0.339	33%	0.325	S	S	.	.	H	α-helix	trans	-82.1	-36.8	-179.1	0	0	0	0	0	112.7	R193 Q194 W195 K215	R193-A197 WeakPolarHBondContact O-CB 3.17Å; R193-A197 PolarHBondContact O-N 2.77Å; Q194-A197 CarbonylContact O-C 3.48Å; Q194-A197 PolarHBondContact O-N 3.38Å; W195-A197 PolarHBondContact O-N 2.76Å; A197-K215 WeakPolarHBondContact O-CD 3.22Å; A197-K215 WeakPolarHBondContact O-CE 3.45Å; A197-K215 PolarHBondContact O-NZ 3.12Å
198	T	85.2	Confident	81.9	Confident	8 Å²	8	71 Å²	71	5%	0.049	34%	0.336	C	S	.	.	H	α-helix	trans	-87.2	-38.9	-178.1	-52.8	0	0	0	0	111.9	Q194 W195 V214 K215 K219 L220	Q194-T198 WeakPolarHBondContact O-CB 3.42Å; Q194-T198 PolarHBondContact O-N 2.88Å; Q194-T198 PolarHBondContact O-OG1 3.14Å; Q194-T198 VanDerWaalsContact O-OG1 3.07Å; W195-T198 PolarHBondContact O-N 3.42Å; T198-V214 CarbonylContact O-C 3.57Å; T198-V214 WeakPolarHBondContact O-CA 3.5Å; T198-K215 PolarHBondContact O-N 3.07Å; T198-K219 HydrophobicContact CG2-CB 4.12Å; T198-L220 HydrophobicContact CG2-CB 4.47Å
199	F	86.8	Confident	81.3	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	102.1	-177.7	-177.3	-117.2	0	0	0	110.4	W195 W201 V212 T213 V214 L220 L240 I305 L306	W195-F199 HydrophobicContact CD2-CD1 4.5Å; W195-F199 AromaticContact CE2-CD1 3.7Å; W195-F199 AromaticContact CH2-CD1 3.77Å; W195-F199 HydrophobicContact CH2-CD1 3.77Å; W195-F199 HydrophobicContact CH2-CE1 4.28Å; W195-F199 AromaticContact CZ2-CD1 3.32Å; W195-F199 HydrophobicContact CZ2-CD1 3.32Å; W195-F199 AromaticContact CZ2-CE1 3.79Å; W195-F199 HydrophobicContact CZ2-CE1 3.79Å; W195-F199 HydrophobicContact CZ2-CG 4.37Å; W195-F199 HydrophobicContact CZ3-CD1 4.5Å; W195-F199 CarbonylContact O-C 3.54Å; W195-F199 WeakPolarHBondContact O-CA 3.46Å; W195-F199 PolarHBondContact O-N 2.89Å; F199-W201 HydrophobicContact CD1-CE3 4.2Å; F199-W201 AromaticContact CD1-CZ3 3.99Å; F199-W201 HydrophobicContact CD1-CZ3 3.99Å; F199-W201 AromaticContact CE1-CE3 3.98Å; F199-W201 HydrophobicContact CE1-CE3 3.98Å; F199-W201 AromaticContact CE1-CZ3 3.94Å; F199-W201 HydrophobicContact CE1-CZ3 3.94Å; F199-V212 HydrophobicContact CE2-CG1 3.56Å; F199-V212 HydrophobicContact CZ-CG1 3.95Å; F199-T213 WeakPolarHBondContact CA-O 3.28Å; F199-V214 HydrophobicContact CD2-CB 4.47Å; F199-V214 HydrophobicContact CD2-CG2 3.28Å; F199-V214 HydrophobicContact CE2-CG2 3.75Å; F199-V214 HydrophobicContact CG-CG2 4.31Å; F199-L220 HydrophobicContact CB-CD1 4.04Å; F199-L240 HydrophobicContact CE1-CD1 3.74Å; F199-L240 HydrophobicContact CE1-CD2 3.68Å; F199-L240 HydrophobicContact CE1-CG 4.18Å; F199-L240 HydrophobicContact CZ-CD1 3.82Å; F199-L240 HydrophobicContact CZ-CD2 3.84Å; F199-L240 HydrophobicContact CZ-CG 4.45Å; F199-I305 HydrophobicContact CE2-CG2 4.11Å; F199-L306 HydrophobicContact CE2-CD2 4.17Å; F199-L306 HydrophobicContact CZ-CD2 3.88Å
200	A	83	Confident	81.1	Confident	40 Å²	40	62 Å²	62	33%	0.331	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	148.2	-177.1	0	0	0	0	0	110.1	T213	A200-T213 PolarHBondContact N-O 2.98Å; A200-T213 PolarHBondContact O-N 3.25Å
201	W	83	Confident	81	Confident	76 Å²	76	61.7 Å²	61.7	29%	0.288	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	129.6	162.8	58.6	92.8	0	0	0	108.4	W195 F199 L210 T211 V212 K239 L240 A243	W195-W201 AromaticContact NE1-CH2 3.93Å; W195-W201 AromaticContact NE1-CZ3 3.66Å; F199-W201 HydrophobicContact CD1-CE3 4.2Å; F199-W201 AromaticContact CD1-CZ3 3.99Å; F199-W201 HydrophobicContact CD1-CZ3 3.99Å; F199-W201 AromaticContact CE1-CE3 3.98Å; F199-W201 HydrophobicContact CE1-CE3 3.98Å; F199-W201 AromaticContact CE1-CZ3 3.94Å; F199-W201 HydrophobicContact CE1-CZ3 3.94Å; W201-L210 HydrophobicContact CB-CD1 4.49Å; W201-T211 CarbonylContact C-O 3.51Å; W201-T211 WeakPolarHBondContact CA-O 3.26Å; W201-V212 HydrophobicContact CB-CG2 4.33Å; W201-K239 HydrophobicContact CH2-CB 4.46Å; W201-K239 HydrophobicContact CZ2-CB 4.34Å; W201-L240 HydrophobicContact CD2-CD1 4.2Å; W201-L240 HydrophobicContact CE3-CD1 3.9Å; W201-L240 HydrophobicContact CH2-CB 4.23Å; W201-L240 HydrophobicContact CZ3-CB 4.27Å; W201-L240 HydrophobicContact CZ3-CD1 4.22Å; W201-A243 HydrophobicContact CG-CB 4.48Å
202	D	80.1	Confident	80.9	Confident	90 Å²	90	61.7 Å²	61.7	48%	0.481	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	140.4	176.4	-172.8	32.3	0	0	0	109.9	T211	D202-T211 PolarHBondContact N-O 3.38Å; D202-T211 PolarHBondContact O-N 3.09Å
203	H	74.5	Confident	80.7	Confident	57 Å²	57	61.3 Å²	61.3	26%	0.264	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	115.6	-179.2	174.5	-122.9	0	0	0	109.6	V247 R251	H203-V247 HydrophobicContact CB-CG2 4.3Å; H203-V247 WeakPolarHBondContact CD2-CG1 3.31Å; H203-R251 PolarHBondContact CE1-NH2 3Å; H203-R251 PolarHBondContact NE2-NH1 3.4Å; H203-R251 PolarHBondContact NE2-NH2 3.47Å
204	Q	74.6	Confident	80.7	Confident	92 Å²	92	52.8 Å²	52.8	43%	0.43	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	109.4	174.3	-67.5	-169.2	-10	0	0	109.5	E206 S207 Q208 S209	Q204-E206 VanDerWaalsContact C-N 3.33Å; Q204-E206 PolarHBondContact O-N 2.81Å; Q204-S207 WeakPolarHBondContact CB-OG 3.38Å; Q204-S207 PolarHBondContact OE1-OG 2.93Å; Q204-Q208 WeakPolarHBondContact O-CA 3.3Å; Q204-Q208 PolarHBondContact O-N 3.15Å; Q204-S209 PolarHBondContact N-O 3.08Å; Q204-S209 PolarHBondContact O-N 3.2Å
205	L	69.3	Low	80.4	Confident	124 Å²	124	57.5 Å²	57.5	65%	0.649	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-45.5	177.3	-86.4	140.9	0	0	0	111.9	Q208 R251	L205-Q208 PolarHBondContact O-N 3.23Å; L205-R251 VanDerWaalsContact CD2-NH2 3.32Å
206	E	68.2	Low	80	Confident	196 Å²	196	61.2 Å²	61.2	92%	0.916	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-47	-174.4	-64.3	-179.9	175.8	0	0	113.4	Q204 Q208	Q204-E206 VanDerWaalsContact C-N 3.33Å; Q204-E206 PolarHBondContact O-N 2.81Å; E206-Q208 PolarHBondContact O-N 2.77Å
207	S	65.8	Low	79.4	Confident	52 Å²	52	54.3 Å²	54.3	36%	0.364	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	0.1	179	65.2	0	0	0	0	113.2	Q204 S209	Q204-S207 WeakPolarHBondContact CB-OG 3.38Å; Q204-S207 PolarHBondContact OE1-OG 2.93Å; S207-S209 PolarHBondContact O-N 3.31Å; S207-S209 PolarHBondContact OG-OG 3.31Å
208	Q	71.5	Confident	78.9	Confident	48 Å²	48	54.5 Å²	54.5	22%	0.224	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	45.9	43.8	-174	-57.3	-169.8	14.6	0	0	113.2	Q204 L205 E206 M275	Q204-Q208 WeakPolarHBondContact O-CA 3.3Å; Q204-Q208 PolarHBondContact O-N 3.15Å; L205-Q208 PolarHBondContact O-N 3.23Å; E206-Q208 PolarHBondContact O-N 2.77Å; Q208-M275 HydrophobicContact CB-CB 4.4Å; Q208-M275 WeakPolarHBondContact CB-O 3.26Å; Q208-M275 PolarHBondContact O-N 2.93Å; Q208-M275 VanDerWaalsContact O-N 3.1Å; Q208-M275 PolarHBondContact OE1-O 3.47Å; Q208-M275 VanDerWaalsContact OE1-O 3.07Å
209	S	77.6	Confident	78.6	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.007	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	136.3	-176.7	66.2	0	0	0	0	112.6	Q204 S207 T273	Q204-S209 PolarHBondContact N-O 3.08Å; Q204-S209 PolarHBondContact O-N 3.2Å; S207-S209 PolarHBondContact O-N 3.31Å; S207-S209 PolarHBondContact OG-OG 3.31Å; S209-T273 CarbonylContact C-O 3.53Å; S209-T273 WeakPolarHBondContact CA-O 3.41Å; S209-T273 WeakPolarHBondContact CB-O 3.38Å
210	L	82.7	Confident	78.5	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.016	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	122.4	167.7	174	67.5	0	0	0	107.3	W201 V212 L244 V247 F248 K272 T273 F298	W201-L210 HydrophobicContact CB-CD1 4.49Å; L210-V212 HydrophobicContact CD1-CG2 4.49Å; L210-V212 HydrophobicContact CD2-CG2 4.33Å; L210-V212 HydrophobicContact CG-CG2 4.2Å; L210-L244 HydrophobicContact CD2-CD2 3.92Å; L210-V247 HydrophobicContact CB-CG1 3.99Å; L210-V247 HydrophobicContact CD1-CG1 4.13Å; L210-V247 HydrophobicContact CD2-CG1 4.49Å; L210-V247 HydrophobicContact CG-CG1 4.42Å; L210-F248 HydrophobicContact CD2-CB 4.02Å; L210-K272 CarbonylContact O-C 3.57Å; L210-K272 WeakPolarHBondContact O-CA 3.31Å; L210-T273 PolarHBondContact N-O 3.47Å; L210-T273 VanDerWaalsContact N-O 3.13Å; L210-T273 PolarHBondContact O-N 2.93Å; L210-F298 HydrophobicContact CD2-CE2 4.45Å; L210-F298 HydrophobicContact CD2-CZ 4.24Å
211	T	84	Confident	78.4	Confident	26 Å²	26	56.4 Å²	56.4	16%	0.16	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	116.8	175.6	-53.6	0	0	0	0	108.9	W201 D202 T270 L271 K272	W201-T211 CarbonylContact C-O 3.51Å; W201-T211 WeakPolarHBondContact CA-O 3.26Å; D202-T211 PolarHBondContact N-O 3.38Å; D202-T211 PolarHBondContact O-N 3.09Å; T211-T270 HydrophobicContact CG2-CG2 3.51Å; T211-L271 CarbonylContact C-O 3.39Å; T211-L271 VanDerWaalsContact CA-O 3.32Å; T211-L271 WeakPolarHBondContact CA-O 3.41Å; T211-K272 HydrophobicContact CG2-CB 4.48Å
212	V	87.1	Confident	78.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	120.1	173.1	-178.9	0	0	0	0	108	F199 W201 L210 T270 L271 L302	F199-V212 HydrophobicContact CE2-CG1 3.56Å; F199-V212 HydrophobicContact CZ-CG1 3.95Å; W201-V212 HydrophobicContact CB-CG2 4.33Å; L210-V212 HydrophobicContact CD1-CG2 4.49Å; L210-V212 HydrophobicContact CD2-CG2 4.33Å; L210-V212 HydrophobicContact CG-CG2 4.2Å; V212-T270 WeakPolarHBondContact O-CA 3.5Å; V212-L271 HydrophobicContact CB-CB 4.47Å; V212-L271 PolarHBondContact N-O 3.11Å; V212-L271 PolarHBondContact O-N 3.46Å; V212-L302 HydrophobicContact CG1-CD1 4.14Å
213	T	85.4	Confident	78.6	Confident	34 Å²	34	51.1 Å²	51.1	21%	0.209	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	124.2	-176.5	-56.9	0	0	0	0	111.1	F199 A200 H269 T270	F199-T213 WeakPolarHBondContact CA-O 3.28Å; A200-T213 PolarHBondContact N-O 2.98Å; A200-T213 PolarHBondContact O-N 3.25Å; T213-H269 CarbonylContact C-O 3.42Å; T213-H269 VanDerWaalsContact CA-O 3.29Å; T213-H269 WeakPolarHBondContact CA-O 3.29Å; T213-T270 WeakPolarHBondContact CG2-OG1 3.44Å; T213-T270 PolarHBondContact OG1-OG1 3.09Å
214	V	87.3	Confident	79.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	122.6	161.4	171.3	0	0	0	0	107.7	T198 F199 V217 L220 A268 H269 I305	T198-V214 CarbonylContact O-C 3.57Å; T198-V214 WeakPolarHBondContact O-CA 3.5Å; F199-V214 HydrophobicContact CD2-CB 4.47Å; F199-V214 HydrophobicContact CD2-CG2 3.28Å; F199-V214 HydrophobicContact CE2-CG2 3.75Å; F199-V214 HydrophobicContact CG-CG2 4.31Å; V214-V217 HydrophobicContact CG1-CG2 4.06Å; V214-L220 HydrophobicContact CG1-CD2 4.29Å; V214-L220 HydrophobicContact CG2-CD2 3.88Å; V214-A268 CarbonylContact O-C 3.55Å; V214-A268 WeakPolarHBondContact O-CA 3.5Å; V214-H269 PolarHBondContact N-O 3.26Å; V214-H269 PolarHBondContact O-N 3.11Å; V214-I305 HydrophobicContact CB-CG2 4.09Å; V214-I305 HydrophobicContact CG2-CG2 3.22Å
215	K	83	Confident	79.4	Confident	126 Å²	126	46.2 Å²	46.2	55%	0.548	25%	0.248	S	C	.	.	S	Bend	trans	-75.5	-35.8	177.7	-68.9	-170.7	-174.6	159.2	0	113.5	A197 T198 G267 A268	A197-K215 WeakPolarHBondContact O-CD 3.22Å; A197-K215 WeakPolarHBondContact O-CE 3.45Å; A197-K215 PolarHBondContact O-NZ 3.12Å; T198-K215 PolarHBondContact O-N 3.07Å; K215-G267 CarbonylContact O-C 3.57Å; K215-A268 WeakPolarHBondContact O-CA 3.22Å; K215-A268 WeakPolarHBondContact O-CB 3.37Å; K215-A268 PolarHBondContact O-N 2.56Å
216	E	79.3	Confident	80.2	Confident	83 Å²	83	40.3 Å²	40.3	39%	0.388	22%	0.217	S	C	.	.			trans	-155.7	110.9	-176	-166.8	178.2	161.6	0	0	109.9	G218 K219 L220	E216-G218 VanDerWaalsContact C-N 3.32Å; E216-G218 PolarHBondContact O-N 3.37Å; E216-K219 HydrophobicContact CB-CB 4.31Å; E216-K219 HydrophobicContact CB-CD 4.29Å; E216-K219 HydrophobicContact CB-CG 4.34Å; E216-K219 HydrophobicContact CG-CD 4.43Å; E216-K219 HydrophobicContact CG-CG 4.21Å; E216-K219 PolarHBondContact O-N 3.37Å; E216-K219 WeakPolarHBondContact OE2-CD 3.22Å; E216-K219 WeakPolarHBondContact OE2-CE 3.38Å; E216-K219 IonicContact OE2-NZ 2.9Å; E216-K219 PolarHBondContact OE2-NZ 3.18Å; E216-L220 PolarHBondContact O-N 2.82Å
217	V	74.4	Confident	81.2	Confident	43 Å²	43	31 Å²	31	26%	0.261	17%	0.173	S	C	.	.	H	α-helix	trans	-62.6	-38.5	-174.6	-178.2	0	0	0	0	111.9	V214 K219 L220 V221 H269 V308	V214-V217 HydrophobicContact CG1-CG2 4.06Å; V217-K219 VanDerWaalsContact C-N 3.33Å; V217-K219 PolarHBondContact O-N 3.4Å; V217-L220 WeakPolarHBondContact O-CB 3.46Å; V217-L220 PolarHBondContact O-N 3.46Å; V217-L220 VanDerWaalsContact O-N 3.12Å; V217-V221 PolarHBondContact O-N 3.49Å; V217-H269 WeakPolarHBondContact CG2-CD2 3.18Å; V217-V308 HydrophobicContact CG1-CG2 3.82Å
218	G	75	Confident	82.1	Confident	45 Å²	45	31.4 Å²	31.4	46%	0.464	17%	0.169	S	C	.	.	H	α-helix	trans	-61.2	-39.5	178.8	0	0	0	0	0	113.1	E216 L220	E216-G218 VanDerWaalsContact C-N 3.32Å; E216-G218 PolarHBondContact O-N 3.37Å; G218-L220 VanDerWaalsContact C-N 3.33Å; G218-L220 PolarHBondContact O-N 3.38Å
219	K	78.2	Confident	82.7	Confident	49 Å²	49	31.5 Å²	31.5	21%	0.213	17%	0.173	C	C	.	.	H	α-helix	trans	-69.1	-31.5	175.3	-73.5	-176.1	-179.7	160.5	0	112.7	E120 T198 E216 V217 V221 N222 L223	E120-K219 WeakPolarHBondContact OE1-CE 3.46Å; E120-K219 IonicContact OE1-NZ 2.77Å; E120-K219 PolarHBondContact OE1-NZ 3.23Å; T198-K219 HydrophobicContact CG2-CB 4.12Å; E216-K219 HydrophobicContact CB-CB 4.31Å; E216-K219 HydrophobicContact CB-CD 4.29Å; E216-K219 HydrophobicContact CB-CG 4.34Å; E216-K219 HydrophobicContact CG-CD 4.43Å; E216-K219 HydrophobicContact CG-CG 4.21Å; E216-K219 PolarHBondContact O-N 3.37Å; E216-K219 WeakPolarHBondContact OE2-CD 3.22Å; E216-K219 WeakPolarHBondContact OE2-CE 3.38Å; E216-K219 IonicContact OE2-NZ 2.9Å; E216-K219 PolarHBondContact OE2-NZ 3.18Å; V217-K219 VanDerWaalsContact C-N 3.33Å; V217-K219 PolarHBondContact O-N 3.4Å; K219-V221 VanDerWaalsContact C-N 3.33Å; K219-V221 PolarHBondContact O-N 2.87Å; K219-N222 PolarHBondContact O-N 3.11Å; K219-L223 WeakPolarHBondContact O-CB 3.21Å; K219-L223 PolarHBondContact O-N 3.12Å
220	L	83.8	Confident	83.2	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.1	-39.3	179	-173.2	60.5	0	0	0	111.8	W195 T198 F199 V214 E216 V217 G218 L223 C224 V308 L316	W195-L220 HydrophobicContact CE3-CD1 4.18Å; W195-L220 HydrophobicContact CH2-CD1 4.29Å; W195-L220 HydrophobicContact CZ3-CD1 3.61Å; T198-L220 HydrophobicContact CG2-CB 4.47Å; F199-L220 HydrophobicContact CB-CD1 4.04Å; V214-L220 HydrophobicContact CG1-CD2 4.29Å; V214-L220 HydrophobicContact CG2-CD2 3.88Å; E216-L220 PolarHBondContact O-N 2.82Å; V217-L220 WeakPolarHBondContact O-CB 3.46Å; V217-L220 PolarHBondContact O-N 3.46Å; V217-L220 VanDerWaalsContact O-N 3.12Å; G218-L220 VanDerWaalsContact C-N 3.33Å; G218-L220 PolarHBondContact O-N 3.38Å; L220-L223 PolarHBondContact O-N 2.89Å; L220-C224 WeakPolarHBondContact O-CB 3.41Å; L220-C224 PolarHBondContact O-N 3.23Å; L220-C224 PolarHBondContact O-SG 2.83Å; L220-V308 HydrophobicContact CD2-CG2 4.16Å; L220-L316 HydrophobicContact CD2-CD2 4.12Å
221	V	81.3	Confident	83.3	Confident	39 Å²	39	33.9 Å²	33.9	24%	0.236	20%	0.198	C	C	.	.	H	α-helix	trans	-56.8	-58.5	175.2	-178.9	0	0	0	0	110.1	V217 K219 L223 C224 D225 V308	V217-V221 PolarHBondContact O-N 3.49Å; K219-V221 VanDerWaalsContact C-N 3.33Å; K219-V221 PolarHBondContact O-N 2.87Å; V221-L223 PolarHBondContact O-N 2.72Å; V221-C224 WeakPolarHBondContact O-CB 3.23Å; V221-C224 PolarHBondContact O-N 3.38Å; V221-C224 VanDerWaalsContact O-N 3.12Å; V221-D225 PolarHBondContact O-N 2.94Å; V221-D225 VanDerWaalsContact O-N 3.11Å; V221-V308 HydrophobicContact CB-CG1 3.99Å; V221-V308 HydrophobicContact CG1-CG1 4.5Å; V221-V308 HydrophobicContact CG2-CB 4.4Å; V221-V308 HydrophobicContact CG2-CG1 3.5Å; V221-V308 HydrophobicContact CG2-CG2 4.22Å
222	N	80.5	Confident	83.6	Confident	54 Å²	54	32.8 Å²	32.8	29%	0.289	19%	0.191	S	C	.	.	H	α-helix	trans	-60	-36.3	-178.4	-61.8	-24.6	0	0	0	112	D124 K219 A226	D124-N222 HydrophobicContact CB-CB 4.45Å; K219-N222 PolarHBondContact O-N 3.11Å; N222-A226 WeakPolarHBondContact O-CB 3.5Å; N222-A226 PolarHBondContact O-N 2.9Å
223	L	86.5	Confident	83.6	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-71.1	-38.9	178.8	-174.4	61.1	0	0	0	112.5	L123 L191 Q194 W195 K219 L220 V221 A226 L227	L123-L223 HydrophobicContact CD2-CD1 4.3Å; L191-L223 HydrophobicContact CD2-CD1 3.84Å; Q194-L223 HydrophobicContact CB-CD1 3.87Å; Q194-L223 HydrophobicContact CB-CD2 4.26Å; W195-L223 HydrophobicContact CB-CD2 4.23Å; W195-L223 HydrophobicContact CE3-CD2 4.08Å; W195-L223 HydrophobicContact CE3-CG 4.41Å; K219-L223 WeakPolarHBondContact O-CB 3.21Å; K219-L223 PolarHBondContact O-N 3.12Å; L220-L223 PolarHBondContact O-N 2.89Å; V221-L223 PolarHBondContact O-N 2.72Å; L223-A226 PolarHBondContact O-N 2.79Å; L223-L227 HydrophobicContact CG-CD1 4.09Å; L223-L227 WeakPolarHBondContact O-CB 3.44Å; L223-L227 WeakPolarHBondContact O-CD1 3.18Å; L223-L227 WeakPolarHBondContact O-CG 3.38Å; L223-L227 PolarHBondContact O-N 2.93Å
224	C	86.4	Confident	83.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.9	-44.6	173.8	-77.1	0	0	0	0	111.2	L220 V221 A226 L227 E228 L233 V310	L220-C224 WeakPolarHBondContact O-CB 3.41Å; L220-C224 PolarHBondContact O-N 3.23Å; L220-C224 PolarHBondContact O-SG 2.83Å; V221-C224 WeakPolarHBondContact O-CB 3.23Å; V221-C224 PolarHBondContact O-N 3.38Å; V221-C224 VanDerWaalsContact O-N 3.12Å; C224-A226 VanDerWaalsContact C-N 3.33Å; C224-A226 PolarHBondContact O-N 2.82Å; C224-L227 PolarHBondContact O-N 2.84Å; C224-E228 PolarHBondContact O-N 2.86Å; C224-L233 HydrophobicContact CB-CD1 4.31Å; C224-V310 HydrophobicContact CB-CB 4.23Å; C224-V310 HydrophobicContact CB-CG1 3.66Å; C224-V310 HydrophobicContact CB-CG2 3.86Å
225	D	81.1	Confident	83.7	Confident	47 Å²	47	42.4 Å²	42.4	25%	0.251	24%	0.237	S	C	.	.	H	α-helix	trans	-63.5	-40.2	177.3	-65.5	-15.4	0	0	0	112	V221 E228 T229 G311	V221-D225 PolarHBondContact O-N 2.94Å; V221-D225 VanDerWaalsContact O-N 3.11Å; D225-E228 PolarHBondContact O-N 2.81Å; D225-T229 WeakPolarHBondContact O-CB 3.41Å; D225-T229 PolarHBondContact O-N 2.68Å; D225-T229 PolarHBondContact O-OG1 3.29Å; D225-G311 VanDerWaalsContact OD1-CA 3.23Å; D225-G311 WeakPolarHBondContact OD1-CA 3.44Å; D225-G311 PolarHBondContact OD1-N 2.91Å
226	A	85.1	Confident	83.9	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-44.6	172.1	0	0	0	0	0	111.7	L123 P127 L191 N222 L223 C224 E228 T229 F230	L123-A226 HydrophobicContact CD2-CB 4.39Å; P127-A226 HydrophobicContact CG-CB 3.73Å; L191-A226 HydrophobicContact CD1-CB 4.19Å; L191-A226 HydrophobicContact CD2-CB 3.63Å; N222-A226 WeakPolarHBondContact O-CB 3.5Å; N222-A226 PolarHBondContact O-N 2.9Å; L223-A226 PolarHBondContact O-N 2.79Å; C224-A226 VanDerWaalsContact C-N 3.33Å; C224-A226 PolarHBondContact O-N 2.82Å; A226-E228 VanDerWaalsContact C-N 3.31Å; A226-E228 PolarHBondContact O-N 2.81Å; A226-T229 PolarHBondContact O-N 2.82Å; A226-F230 WeakPolarHBondContact O-CD2 3.11Å; A226-F230 PolarHBondContact O-N 2.82Å; A226-F230 VanDerWaalsContact O-N 3.11Å
227	L	88.9	Confident	84.3	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.9	-37.9	178.5	-74.6	164.5	0	0	0	112.3	L191 W195 L223 C224 F230 G231 L232 L233 V236	L191-L227 HydrophobicContact CB-CD2 3.87Å; W195-L227 HydrophobicContact CB-CD1 4.4Å; W195-L227 HydrophobicContact CD2-CD1 3.94Å; W195-L227 HydrophobicContact CE3-CD1 3.31Å; W195-L227 HydrophobicContact CG-CD1 4.41Å; W195-L227 HydrophobicContact CZ3-CD1 3.85Å; L223-L227 HydrophobicContact CG-CD1 4.09Å; L223-L227 WeakPolarHBondContact O-CB 3.44Å; L223-L227 WeakPolarHBondContact O-CD1 3.18Å; L223-L227 WeakPolarHBondContact O-CG 3.38Å; L223-L227 PolarHBondContact O-N 2.93Å; C224-L227 PolarHBondContact O-N 2.84Å; L227-F230 CarbonylContact O-C 3.54Å; L227-F230 PolarHBondContact O-N 2.86Å; L227-G231 PolarHBondContact O-N 3.3Å; L227-G231 VanDerWaalsContact O-N 3.12Å; L227-L232 HydrophobicContact CB-CB 4.35Å; L227-L232 HydrophobicContact CD2-CB 3.62Å; L227-L232 HydrophobicContact CD2-CD1 3.92Å; L227-L232 HydrophobicContact CD2-CG 4.46Å; L227-L232 PolarHBondContact O-N 3.08Å; L227-L233 HydrophobicContact CB-CB 4.25Å; L227-L233 HydrophobicContact CB-CD1 4.31Å; L227-L233 PolarHBondContact O-N 3.48Å; L227-V236 HydrophobicContact CD1-CG2 3.97Å; L227-V236 HydrophobicContact CD2-CG1 4.49Å
228	E	85.9	Confident	84.8	Confident	61 Å²	61	33.1 Å²	33.1	29%	0.285	20%	0.198	S	C	.	.	H	α-helix	trans	-64.2	-50.1	176	-175.9	62.2	-175.2	0	0	111	C224 D225 A226 F230 G231 L233 V310 N312	C224-E228 PolarHBondContact O-N 2.86Å; D225-E228 PolarHBondContact O-N 2.81Å; A226-E228 VanDerWaalsContact C-N 3.31Å; A226-E228 PolarHBondContact O-N 2.81Å; E228-F230 PolarHBondContact O-N 3.12Å; E228-F230 VanDerWaalsContact O-N 3.07Å; E228-G231 PolarHBondContact O-N 3.03Å; E228-L233 HydrophobicContact CB-CB 4.34Å; E228-L233 HydrophobicContact CB-CD2 4.26Å; E228-L233 VanDerWaalsContact OE2-CB 3.26Å; E228-L233 WeakPolarHBondContact OE2-CB 3.32Å; E228-L233 WeakPolarHBondContact OE2-CD2 3.47Å; E228-V310 HydrophobicContact CB-CG1 4.48Å; E228-N312 PolarHBondContact OE1-ND2 3.47Å
229	T	83.5	Confident	85.2	Confident	49 Å²	49	36.4 Å²	36.4	30%	0.301	20%	0.2	S	C	.	.	H	α-helix	trans	-53.9	-34.7	176.7	-61.4	0	0	0	0	112.3	P127 Y130 C131 D225 A226	P127-T229 HydrophobicContact CB-CG2 4.38Å; Y130-T229 HydrophobicContact CD1-CG2 4.25Å; C131-T229 WeakPolarHBondContact SG-CG2 3.26Å; D225-T229 WeakPolarHBondContact O-CB 3.41Å; D225-T229 PolarHBondContact O-N 2.68Å; D225-T229 PolarHBondContact O-OG1 3.29Å; A226-T229 PolarHBondContact O-N 2.82Å
230	F	86.9	Confident	85.5	Confident	1 Å²	1	34.1 Å²	34.1	0%	0.004	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	4.8	179.8	-76.6	-93.9	0	0	0	114.1	F126 Y130 K184 M187 R188 L191 A226 L227 E228 L232	F126-F230 HydrophobicContact CD1-CE2 4.18Å; F126-F230 HydrophobicContact CE1-CD2 4.26Å; F126-F230 AromaticContact CE1-CE2 3.23Å; F126-F230 HydrophobicContact CE1-CE2 3.23Å; F126-F230 AromaticContact CE1-CZ 3.43Å; F126-F230 HydrophobicContact CE1-CZ 3.43Å; F126-F230 VanDerWaalsContact CE1-CZ 3.43Å; F126-F230 HydrophobicContact CZ-CE1 4.41Å; F126-F230 AromaticContact CZ-CE2 3.69Å; F126-F230 HydrophobicContact CZ-CE2 3.69Å; F126-F230 AromaticContact CZ-CZ 3.36Å; F126-F230 HydrophobicContact CZ-CZ 3.36Å; Y130-F230 HydrophobicContact CD1-CE2 4.42Å; Y130-F230 HydrophobicContact CD1-CZ 4Å; Y130-F230 HydrophobicContact CD2-CE1 4.28Å; Y130-F230 AromaticContact CD2-CZ 3.65Å; Y130-F230 HydrophobicContact CD2-CZ 3.65Å; Y130-F230 HydrophobicContact CE1-CE1 4.41Å; Y130-F230 HydrophobicContact CE1-CZ 4.17Å; Y130-F230 AromaticContact CE2-CE1 3.96Å; Y130-F230 HydrophobicContact CE2-CE1 3.96Å; Y130-F230 AromaticContact CE2-CZ 3.81Å; Y130-F230 HydrophobicContact CE2-CZ 3.81Å; Y130-F230 HydrophobicContact CG-CE2 4.32Å; Y130-F230 AromaticContact CG-CZ 3.76Å; Y130-F230 HydrophobicContact CG-CZ 3.76Å; K184-F230 HydrophobicContact CB-CE1 4.39Å; K184-F230 HydrophobicContact CG-CD1 3.79Å; K184-F230 HydrophobicContact CG-CE1 3.96Å; M187-F230 HydrophobicContact CB-CD1 4.11Å; M187-F230 HydrophobicContact CB-CE1 3.7Å; M187-F230 HydrophobicContact CB-CZ 4.11Å; M187-F230 HydrophobicContact CG-CE1 4.35Å; M187-F230 HydrophobicContact CG-CZ 4.47Å; R188-F230 HydrophobicContact CG-CB 4.29Å; R188-F230 HydrophobicContact CG-CD1 4.32Å; R188-F230 PolarHBondContact NH1-O 3.05Å; L191-F230 HydrophobicContact CD1-CB 3.93Å; L191-F230 HydrophobicContact CD1-CD2 3.68Å; L191-F230 HydrophobicContact CD1-CE2 4.44Å; L191-F230 HydrophobicContact CD1-CG 3.79Å; A226-F230 WeakPolarHBondContact O-CD2 3.11Å; A226-F230 PolarHBondContact O-N 2.82Å; A226-F230 VanDerWaalsContact O-N 3.11Å; L227-F230 CarbonylContact O-C 3.54Å; L227-F230 PolarHBondContact O-N 2.86Å; E228-F230 PolarHBondContact O-N 3.12Å; E228-F230 VanDerWaalsContact O-N 3.07Å; F230-L232 HydrophobicContact CB-CD1 4.45Å
231	G	86.2	Confident	85.5	Confident	53 Å²	53	34.5 Å²	34.5	55%	0.546	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	44	179.4	0	0	0	0	0	112.3	R188 L227 E228	R188-G231 PolarHBondContact NH1-O 3.12Å; L227-G231 PolarHBondContact O-N 3.3Å; L227-G231 VanDerWaalsContact O-N 3.12Å; E228-G231 PolarHBondContact O-N 3.03Å
232	L	89.4	Confident	85.6	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.021	20%	0.2	C	C	.	.			trans	-120.6	-16.3	-179.4	-77.9	178	0	0	0	113.3	R188 L191 L192 L227 F230 N234 F235 V236	R188-L232 HydrophobicContact CB-CD1 3.73Å; R188-L232 HydrophobicContact CG-CD1 3.64Å; R188-L232 HydrophobicContact CG-CD2 4.45Å; R188-L232 HydrophobicContact CG-CG 4.05Å; R188-L232 VanDerWaalsContact CZ-CD2 3.41Å; L191-L232 HydrophobicContact CB-CD1 4.45Å; L192-L232 HydrophobicContact CD1-CD2 4.48Å; L192-L232 HydrophobicContact CD2-CD1 4.44Å; L192-L232 HydrophobicContact CD2-CD2 4.5Å; L192-L232 HydrophobicContact CG-CD1 4.13Å; L227-L232 HydrophobicContact CB-CB 4.35Å; L227-L232 HydrophobicContact CD2-CB 3.62Å; L227-L232 HydrophobicContact CD2-CD1 3.92Å; L227-L232 HydrophobicContact CD2-CG 4.46Å; L227-L232 PolarHBondContact O-N 3.08Å; F230-L232 HydrophobicContact CB-CD1 4.45Å; L232-N234 PolarHBondContact O-N 3.11Å; L232-F235 WeakPolarHBondContact O-CB 3.46Å; L232-F235 PolarHBondContact O-N 2.91Å; L232-F235 VanDerWaalsContact O-N 3.11Å; L232-V236 PolarHBondContact O-N 2.71Å; L232-V236 VanDerWaalsContact O-N 3.08Å
233	L	87.7	Confident	85.4	Confident	11 Å²	11	33.5 Å²	33.5	6%	0.058	19%	0.192	C	C	.	.	H	α-helix	trans	-56.5	-54.5	-175.7	-174.4	70.7	0	0	0	111.6	C224 L227 E228 F235 V236 I237 V310	C224-L233 HydrophobicContact CB-CD1 4.31Å; L227-L233 HydrophobicContact CB-CB 4.25Å; L227-L233 HydrophobicContact CB-CD1 4.31Å; L227-L233 PolarHBondContact O-N 3.48Å; E228-L233 HydrophobicContact CB-CB 4.34Å; E228-L233 HydrophobicContact CB-CD2 4.26Å; E228-L233 VanDerWaalsContact OE2-CB 3.26Å; E228-L233 WeakPolarHBondContact OE2-CB 3.32Å; E228-L233 WeakPolarHBondContact OE2-CD2 3.47Å; L233-F235 PolarHBondContact O-N 3.11Å; L233-F235 VanDerWaalsContact O-N 3.11Å; L233-V236 HydrophobicContact CD1-CG2 4.49Å; L233-V236 WeakPolarHBondContact O-CG2 3.37Å; L233-V236 PolarHBondContact O-N 2.97Å; L233-I237 HydrophobicContact CD1-CD1 3.88Å; L233-I237 HydrophobicContact CD1-CG1 4.22Å; L233-I237 HydrophobicContact CD2-CD1 4.07Å; L233-I237 HydrophobicContact CG-CD1 3.58Å; L233-I237 HydrophobicContact CG-CG1 4.19Å; L233-I237 VanDerWaalsContact O-CG1 3.29Å; L233-I237 WeakPolarHBondContact O-CG1 3.43Å; L233-I237 PolarHBondContact O-N 3.48Å; L233-V310 HydrophobicContact CD1-CG1 4.14Å; L233-V310 HydrophobicContact CD2-CB 4.31Å; L233-V310 HydrophobicContact CD2-CG1 3.39Å; L233-V310 HydrophobicContact CG-CG1 4.4Å
234	N	85.6	Confident	85.2	Confident	121 Å²	121	33.6 Å²	33.6	65%	0.647	19%	0.193	S	C	*	.	H	α-helix	trans	-55.7	-33.6	177.6	-70.2	-19.3	0	0	0	113.4	L232 S238	L232-N234 PolarHBondContact O-N 3.11Å; N234-S238 WeakPolarHBondContact O-CB 3.47Å; N234-S238 PolarHBondContact O-N 3.39Å; N234-S238 PolarHBondContact O-OG 2.77Å; N234-S238 VanDerWaalsContact O-OG 3.11Å
235	F	88.2	Confident	84.9	Confident	104 Å²	104	34.7 Å²	34.7	46%	0.456	20%	0.201	S	C	.	.	H	α-helix	trans	-69.3	-42.7	176.8	169.3	-97.7	0	0	0	112.1	L192 L232 L233 S238 K239	L192-F235 HydrophobicContact CD2-CD1 4.09Å; L192-F235 HydrophobicContact CD2-CE1 4.02Å; L232-F235 WeakPolarHBondContact O-CB 3.46Å; L232-F235 PolarHBondContact O-N 2.91Å; L232-F235 VanDerWaalsContact O-N 3.11Å; L233-F235 PolarHBondContact O-N 3.11Å; L233-F235 VanDerWaalsContact O-N 3.11Å; F235-S238 PolarHBondContact O-OG 3.22Å; F235-K239 HydrophobicContact CE2-CG 4.39Å; F235-K239 HydrophobicContact CZ-CG 4.26Å; F235-K239 WeakPolarHBondContact O-CG 3.14Å; F235-K239 PolarHBondContact O-N 2.79Å
236	V	87.7	Confident	84.6	Confident	4 Å²	4	36.8 Å²	36.8	2%	0.024	21%	0.212	C	C	.	.	H	α-helix	trans	-74.9	-34.4	179.1	-62.1	0	0	0	0	112.2	L192 W195 L227 L232 L233 K239 L240	L192-V236 HydrophobicContact CD2-CG1 3.57Å; W195-V236 HydrophobicContact CD2-CB 4.15Å; W195-V236 HydrophobicContact CD2-CG1 4.36Å; W195-V236 HydrophobicContact CD2-CG2 4.07Å; W195-V236 HydrophobicContact CE3-CG2 4.35Å; W195-V236 HydrophobicContact CG-CB 4.38Å; W195-V236 HydrophobicContact CG-CG1 4.13Å; W195-V236 HydrophobicContact CH2-CG2 4.08Å; W195-V236 HydrophobicContact CZ2-CB 3.98Å; W195-V236 HydrophobicContact CZ2-CG2 3.79Å; W195-V236 HydrophobicContact CZ3-CG2 4.35Å; L227-V236 HydrophobicContact CD1-CG2 3.97Å; L227-V236 HydrophobicContact CD2-CG1 4.49Å; L232-V236 PolarHBondContact O-N 2.71Å; L232-V236 VanDerWaalsContact O-N 3.08Å; L233-V236 HydrophobicContact CD1-CG2 4.49Å; L233-V236 WeakPolarHBondContact O-CG2 3.37Å; L233-V236 PolarHBondContact O-N 2.97Å; V236-K239 PolarHBondContact O-N 2.87Å; V236-L240 PolarHBondContact O-N 2.79Å
237	I	86.9	Confident	84.1	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-65.7	-42.2	175.9	-65.1	-177.5	0	0	0	110.4	L233 K239 L240 S241 L316 A319 V320 L323	L233-I237 HydrophobicContact CD1-CD1 3.88Å; L233-I237 HydrophobicContact CD1-CG1 4.22Å; L233-I237 HydrophobicContact CD2-CD1 4.07Å; L233-I237 HydrophobicContact CG-CD1 3.58Å; L233-I237 HydrophobicContact CG-CG1 4.19Å; L233-I237 VanDerWaalsContact O-CG1 3.29Å; L233-I237 WeakPolarHBondContact O-CG1 3.43Å; L233-I237 PolarHBondContact O-N 3.48Å; I237-K239 VanDerWaalsContact C-N 3.32Å; I237-K239 PolarHBondContact O-N 2.99Å; I237-L240 PolarHBondContact O-N 2.89Å; I237-S241 WeakPolarHBondContact O-CB 3.26Å; I237-S241 PolarHBondContact O-N 3.31Å; I237-L316 HydrophobicContact CD1-CD1 3.7Å; I237-L316 HydrophobicContact CG1-CD1 3.84Å; I237-A319 HydrophobicContact CD1-CB 3.49Å; I237-A319 VanDerWaalsContact CD1-CB 3.49Å; I237-A319 HydrophobicContact CG2-CB 4.37Å; I237-V320 HydrophobicContact CG2-CB 4.49Å; I237-V320 HydrophobicContact CG2-CG2 3.88Å; I237-L323 HydrophobicContact CG2-CD1 3.84Å
238	S	85.2	Confident	83.5	Confident	50 Å²	50	37.8 Å²	37.8	35%	0.35	22%	0.218	S	C	.	.	H	α-helix	trans	-65.3	-34.9	176.1	64.3	0	0	0	0	112.7	N234 F235 S241 S242	N234-S238 WeakPolarHBondContact O-CB 3.47Å; N234-S238 PolarHBondContact O-N 3.39Å; N234-S238 PolarHBondContact O-OG 2.77Å; N234-S238 VanDerWaalsContact O-OG 3.11Å; F235-S238 PolarHBondContact O-OG 3.22Å; S238-S241 PolarHBondContact O-N 2.86Å; S238-S242 WeakPolarHBondContact O-CB 3.41Å; S238-S242 PolarHBondContact O-N 3.48Å
239	K	84.8	Confident	83	Confident	114 Å²	114	35.4 Å²	35.4	50%	0.496	21%	0.207	S	C	.	.	H	α-helix	trans	-67.5	-40.7	173.8	-72.5	-69.1	175.2	-168	0	112.9	W201 F235 V236 I237 A243	W201-K239 HydrophobicContact CH2-CB 4.46Å; W201-K239 HydrophobicContact CZ2-CB 4.34Å; F235-K239 HydrophobicContact CE2-CG 4.39Å; F235-K239 HydrophobicContact CZ-CG 4.26Å; F235-K239 WeakPolarHBondContact O-CG 3.14Å; F235-K239 PolarHBondContact O-N 2.79Å; V236-K239 PolarHBondContact O-N 2.87Å; I237-K239 VanDerWaalsContact C-N 3.32Å; I237-K239 PolarHBondContact O-N 2.99Å; K239-A243 WeakPolarHBondContact O-CB 3.49Å; K239-A243 PolarHBondContact O-N 3.04Å; K239-A243 VanDerWaalsContact O-N 3.11Å
240	L	83.8	Confident	82.6	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-62.6	-49.2	172.5	172.2	66.6	0	0	0	110.7	F199 W201 V236 I237 S242 A243 L244 L306 V320	F199-L240 HydrophobicContact CE1-CD1 3.74Å; F199-L240 HydrophobicContact CE1-CD2 3.68Å; F199-L240 HydrophobicContact CE1-CG 4.18Å; F199-L240 HydrophobicContact CZ-CD1 3.82Å; F199-L240 HydrophobicContact CZ-CD2 3.84Å; F199-L240 HydrophobicContact CZ-CG 4.45Å; W201-L240 HydrophobicContact CD2-CD1 4.2Å; W201-L240 HydrophobicContact CE3-CD1 3.9Å; W201-L240 HydrophobicContact CH2-CB 4.23Å; W201-L240 HydrophobicContact CZ3-CB 4.27Å; W201-L240 HydrophobicContact CZ3-CD1 4.22Å; V236-L240 PolarHBondContact O-N 2.79Å; I237-L240 PolarHBondContact O-N 2.89Å; L240-S242 PolarHBondContact O-N 3.23Å; L240-A243 PolarHBondContact O-N 3.13Å; L240-A243 VanDerWaalsContact O-N 3.16Å; L240-L244 HydrophobicContact CD1-CD1 4.1Å; L240-L244 HydrophobicContact CD1-CG 4.13Å; L240-L244 HydrophobicContact CG-CD1 4.04Å; L240-L244 HydrophobicContact CG-CG 4.43Å; L240-L244 WeakPolarHBondContact O-CG 3.29Å; L240-L244 PolarHBondContact O-N 2.91Å; L240-L306 HydrophobicContact CD2-CD2 4.49Å; L240-V320 HydrophobicContact CD2-CG1 4.35Å; L240-V320 HydrophobicContact CD2-CG2 3.49Å; L240-V320 VanDerWaalsContact CD2-CG2 3.49Å
241	S	84.1	Confident	82	Confident	9 Å²	9	38.8 Å²	38.8	6%	0.063	22%	0.219	C	C	.	.	H	α-helix	trans	-58.8	-46.4	-179.5	171.3	0	0	0	0	111.8	I237 S238 A243 L244 C245 L323 L324	I237-S241 WeakPolarHBondContact O-CB 3.26Å; I237-S241 PolarHBondContact O-N 3.31Å; S238-S241 PolarHBondContact O-N 2.86Å; S241-A243 PolarHBondContact O-N 2.84Å; S241-L244 PolarHBondContact O-N 3.26Å; S241-C245 PolarHBondContact O-N 3.45Å; S241-L323 WeakPolarHBondContact OG-CB 3.22Å; S241-L324 WeakPolarHBondContact O-CD1 3.21Å
242	S	82.1	Confident	81.4	Confident	55 Å²	55	36.6 Å²	36.6	39%	0.385	20%	0.195	S	C	.	.	H	α-helix	trans	-57.2	-47	173.4	-178.8	0	0	0	0	111.7	S238 L240 L244 C245 D246	S238-S242 WeakPolarHBondContact O-CB 3.41Å; S238-S242 PolarHBondContact O-N 3.48Å; L240-S242 PolarHBondContact O-N 3.23Å; S242-L244 VanDerWaalsContact C-N 3.32Å; S242-L244 PolarHBondContact O-N 3.1Å; S242-C245 PolarHBondContact O-N 3.05Å; S242-D246 WeakPolarHBondContact O-CB 3.48Å; S242-D246 PolarHBondContact O-N 3.01Å; S242-D246 VanDerWaalsContact O-OD2 3.09Å; S242-D246 PolarHBondContact OG-OD2 3.24Å
243	A	77.9	Confident	80.5	Confident	16 Å²	16	41.4 Å²	41.4	13%	0.132	21%	0.213	C	C	.	.	H	α-helix	trans	-62.9	-37.4	178.9	0	0	0	0	0	112.8	W201 K239 L240 S241 V247	W201-A243 HydrophobicContact CG-CB 4.48Å; K239-A243 WeakPolarHBondContact O-CB 3.49Å; K239-A243 PolarHBondContact O-N 3.04Å; K239-A243 VanDerWaalsContact O-N 3.11Å; L240-A243 PolarHBondContact O-N 3.13Å; L240-A243 VanDerWaalsContact O-N 3.16Å; S241-A243 PolarHBondContact O-N 2.84Å; A243-V247 WeakPolarHBondContact O-CB 3.21Å; A243-V247 VanDerWaalsContact O-CG2 3.29Å; A243-V247 WeakPolarHBondContact O-CG2 3.4Å; A243-V247 PolarHBondContact O-N 3.37Å; A243-V247 VanDerWaalsContact O-N 3.12Å
244	L	82.2	Confident	79.7	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.021	24%	0.237	C	C	.	.	I	π-helix	trans	-68.3	-40.3	174.8	-68.9	175.7	0	0	0	111.8	L210 L240 S241 S242 F248 L249 F298 L302 V320 L324	L210-L244 HydrophobicContact CD2-CD2 3.92Å; L240-L244 HydrophobicContact CD1-CD1 4.1Å; L240-L244 HydrophobicContact CD1-CG 4.13Å; L240-L244 HydrophobicContact CG-CD1 4.04Å; L240-L244 HydrophobicContact CG-CG 4.43Å; L240-L244 WeakPolarHBondContact O-CG 3.29Å; L240-L244 PolarHBondContact O-N 2.91Å; S241-L244 PolarHBondContact O-N 3.26Å; S242-L244 VanDerWaalsContact C-N 3.32Å; S242-L244 PolarHBondContact O-N 3.1Å; L244-F248 WeakPolarHBondContact O-CA 3.42Å; L244-F248 VanDerWaalsContact O-CB 3.29Å; L244-F248 WeakPolarHBondContact O-CB 3.27Å; L244-F248 PolarHBondContact O-N 3.34Å; L244-L249 PolarHBondContact O-N 2.77Å; L244-F298 HydrophobicContact CD2-CZ 4.11Å; L244-L302 HydrophobicContact CD1-CD2 4.15Å; L244-V320 HydrophobicContact CD1-CG1 4.09Å; L244-L324 HydrophobicContact CB-CD1 3.63Å
245	C	79.7	Confident	79	Confident	23 Å²	23	41.3 Å²	41.3	16%	0.155	21%	0.209	C	C	.	.	I	π-helix	trans	-62.2	-58.2	174.2	-75.2	0	0	0	0	111.6	S241 S242 V247 L249 D250 L324	S241-C245 PolarHBondContact O-N 3.45Å; S242-C245 PolarHBondContact O-N 3.05Å; C245-V247 PolarHBondContact O-N 2.89Å; C245-L249 HydrophobicContact CB-CD1 4.41Å; C245-L249 WeakPolarHBondContact O-CB 3.49Å; C245-L249 PolarHBondContact O-N 3.44Å; C245-D250 PolarHBondContact O-N 3.29Å; C245-D250 VanDerWaalsContact O-N 3.14Å; C245-L324 HydrophobicContact CB-CD1 4.48Å; C245-L324 WeakPolarHBondContact SG-CD1 3.34Å
246	D	73.8	Confident	78	Confident	91 Å²	91	39.6 Å²	39.6	49%	0.487	20%	0.203	S	C	.	.	I	π-helix	trans	-67.3	-27.4	-170.8	-57.5	-26.3	0	0	0	112.1	S242	S242-D246 WeakPolarHBondContact O-CB 3.48Å; S242-D246 PolarHBondContact O-N 3.01Å; S242-D246 VanDerWaalsContact O-OD2 3.09Å; S242-D246 PolarHBondContact OG-OD2 3.24Å
247	V	74.8	Confident	77.2	Confident	19 Å²	19	43.9 Å²	43.9	12%	0.115	22%	0.222	C	C	.	.	I	π-helix	trans	-102.6	-55.3	-176.9	-179.9	0	0	0	0	112.3	H203 L210 A243 C245 R251	H203-V247 HydrophobicContact CB-CG2 4.3Å; H203-V247 WeakPolarHBondContact CD2-CG1 3.31Å; L210-V247 HydrophobicContact CB-CG1 3.99Å; L210-V247 HydrophobicContact CD1-CG1 4.13Å; L210-V247 HydrophobicContact CD2-CG1 4.49Å; L210-V247 HydrophobicContact CG-CG1 4.42Å; A243-V247 WeakPolarHBondContact O-CB 3.21Å; A243-V247 VanDerWaalsContact O-CG2 3.29Å; A243-V247 WeakPolarHBondContact O-CG2 3.4Å; A243-V247 PolarHBondContact O-N 3.37Å; A243-V247 VanDerWaalsContact O-N 3.12Å; C245-V247 PolarHBondContact O-N 2.89Å; V247-R251 WeakPolarHBondContact O-CB 3.08Å; V247-R251 WeakPolarHBondContact O-CD 3.33Å; V247-R251 WeakPolarHBondContact O-CG 3.04Å
248	F	77.8	Confident	76.8	Confident	2 Å²	2	45 Å²	45	1%	0.009	23%	0.23	C	C	.	.	I	π-helix	trans	-80.5	-51.5	-173.9	177.5	-94.9	0	0	0	111	L210 L244 F252 T273 M275 F298 F299	L210-F248 HydrophobicContact CD2-CB 4.02Å; L244-F248 WeakPolarHBondContact O-CA 3.42Å; L244-F248 VanDerWaalsContact O-CB 3.29Å; L244-F248 WeakPolarHBondContact O-CB 3.27Å; L244-F248 PolarHBondContact O-N 3.34Å; F248-F252 HydrophobicContact CZ-CD2 4.34Å; F248-F252 WeakPolarHBondContact O-CB 3.31Å; F248-F252 PolarHBondContact O-N 3.45Å; F248-T273 HydrophobicContact CD2-CG2 4.49Å; F248-M275 HydrophobicContact CD2-CE 3.36Å; F248-M275 HydrophobicContact CE2-CE 3.49Å; F248-M275 VanDerWaalsContact CE2-CE 3.49Å; F248-M275 HydrophobicContact CG-CE 4.24Å; F248-M275 HydrophobicContact CZ-CE 4.45Å; F248-F298 HydrophobicContact CB-CZ 4.43Å; F248-F298 AromaticContact CD1-CD1 3.91Å; F248-F298 HydrophobicContact CD1-CD1 3.91Å; F248-F298 AromaticContact CD1-CE1 3.73Å; F248-F298 HydrophobicContact CD1-CE1 3.73Å; F248-F298 HydrophobicContact CD1-CZ 4.38Å; F248-F298 HydrophobicContact CD2-CD1 4.02Å; F248-F298 HydrophobicContact CD2-CD2 4.07Å; F248-F298 AromaticContact CD2-CE1 3.91Å; F248-F298 HydrophobicContact CD2-CE1 3.91Å; F248-F298 AromaticContact CD2-CE2 3.96Å; F248-F298 HydrophobicContact CD2-CE2 3.96Å; F248-F298 HydrophobicContact CD2-CG 4.09Å; F248-F298 AromaticContact CD2-CZ 3.87Å; F248-F298 HydrophobicContact CD2-CZ 3.87Å; F248-F298 AromaticContact CE1-CD1 3.5Å; F248-F298 HydrophobicContact CE1-CD1 3.5Å; F248-F298 VanDerWaalsContact CE1-CD1 3.5Å; F248-F298 AromaticContact CE1-CE1 3.83Å; F248-F298 HydrophobicContact CE1-CE1 3.83Å; F248-F298 HydrophobicContact CE1-CG 4.15Å; F248-F298 HydrophobicContact CE2-CB 3.92Å; F248-F298 AromaticContact CE2-CD1 3.62Å; F248-F298 HydrophobicContact CE2-CD1 3.62Å; F248-F298 AromaticContact CE2-CD2 3.72Å; F248-F298 HydrophobicContact CE2-CD2 3.72Å; F248-F298 HydrophobicContact CE2-CE1 4.01Å; F248-F298 HydrophobicContact CE2-CE2 4.11Å; F248-F298 AromaticContact CE2-CG 3.45Å; F248-F298 HydrophobicContact CE2-CG 3.45Å; F248-F298 VanDerWaalsContact CE2-CG 3.45Å; F248-F298 HydrophobicContact CE2-CZ 4.23Å; F248-F298 HydrophobicContact CG-CD1 4.17Å; F248-F298 AromaticContact CG-CE1 3.78Å; F248-F298 HydrophobicContact CG-CE1 3.78Å; F248-F298 AromaticContact CG-CZ 3.97Å; F248-F298 HydrophobicContact CG-CZ 3.97Å; F248-F298 HydrophobicContact CZ-CB 3.73Å; F248-F298 AromaticContact CZ-CD1 3.34Å; F248-F298 HydrophobicContact CZ-CD1 3.34Å; F248-F298 HydrophobicContact CZ-CD2 4.25Å; F248-F298 AromaticContact CZ-CE1 3.98Å; F248-F298 HydrophobicContact CZ-CE1 3.98Å; F248-F298 AromaticContact CZ-CG 3.49Å; F248-F298 HydrophobicContact CZ-CG 3.49Å; F248-F298 VanDerWaalsContact CZ-CG 3.49Å; F248-F299 HydrophobicContact CE1-CE2 4.05Å
249	L	74.7	Confident	76.5	Confident	10 Å²	10	47.4 Å²	47.4	5%	0.052	24%	0.239	C	C	.	.	I	π-helix	trans	-68.2	-48.9	-174.5	-63.2	-179.8	0	0	0	112.7	L244 C245 R251 F252 R253 L324 L328	L244-L249 PolarHBondContact O-N 2.77Å; C245-L249 HydrophobicContact CB-CD1 4.41Å; C245-L249 WeakPolarHBondContact O-CB 3.49Å; C245-L249 PolarHBondContact O-N 3.44Å; L249-R251 VanDerWaalsContact C-N 3.31Å; L249-R251 PolarHBondContact O-N 2.85Å; L249-F252 PolarHBondContact O-N 3.17Å; L249-R253 WeakPolarHBondContact O-CG 3.17Å; L249-R253 PolarHBondContact O-N 3.1Å; L249-L324 HydrophobicContact CD1-CG 4.43Å; L249-L328 HydrophobicContact CD1-CB 4.16Å; L249-L328 HydrophobicContact CD2-CB 4.38Å; L249-L328 HydrophobicContact CD2-CD1 3.4Å; L249-L328 HydrophobicContact CD2-CG 4.49Å
250	D	74	Confident	76.5	Confident	73 Å²	73	44.5 Å²	44.5	39%	0.39	23%	0.229	S	C	.	.	H	α-helix	trans	-63.9	-37.6	-178.3	-79.8	-16.7	0	0	0	112	C245 R253	C245-D250 PolarHBondContact O-N 3.29Å; C245-D250 VanDerWaalsContact O-N 3.14Å; D250-R253 WeakPolarHBondContact O-CB 3.22Å; D250-R253 PolarHBondContact O-N 2.89Å; D250-R253 IonicContact OD1-NH1 3.5Å
251	R	74.3	Confident	76.4	Confident	48 Å²	48	49.2 Å²	49.2	18%	0.181	25%	0.251	C	S	.	.	H	α-helix	trans	-79.6	-32.3	178	-63.6	-176.3	172.4	-152.4	-11	113.8	H203 L205 V247 L249 R253 E254 A255 M275	H203-R251 PolarHBondContact CE1-NH2 3Å; H203-R251 PolarHBondContact NE2-NH1 3.4Å; H203-R251 PolarHBondContact NE2-NH2 3.47Å; L205-R251 VanDerWaalsContact CD2-NH2 3.32Å; V247-R251 WeakPolarHBondContact O-CB 3.08Å; V247-R251 WeakPolarHBondContact O-CD 3.33Å; V247-R251 WeakPolarHBondContact O-CG 3.04Å; L249-R251 VanDerWaalsContact C-N 3.31Å; L249-R251 PolarHBondContact O-N 2.85Å; R251-R253 PolarHBondContact O-N 3.33Å; R251-E254 PolarHBondContact O-N 3.47Å; R251-A255 WeakPolarHBondContact O-CB 3.02Å; R251-A255 PolarHBondContact O-N 3.38Å; R251-M275 HydrophobicContact CB-SD 3.71Å
252	F	74.5	Confident	76.5	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.035	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-27.2	173.7	-176.4	-96.5	0	0	0	111.6	F248 L249 E254 C258 M275 R291 A294 V295 I335	F248-F252 HydrophobicContact CZ-CD2 4.34Å; F248-F252 WeakPolarHBondContact O-CB 3.31Å; F248-F252 PolarHBondContact O-N 3.45Å; L249-F252 PolarHBondContact O-N 3.17Å; F252-E254 PolarHBondContact O-N 2.89Å; F252-C258 HydrophobicContact CE2-CB 4.49Å; F252-M275 HydrophobicContact CB-CE 4.07Å; F252-M275 HydrophobicContact CD2-CE 4.3Å; F252-R291 HydrophobicContact CE1-CB 4.37Å; F252-R291 HydrophobicContact CZ-CB 3.7Å; F252-R291 HydrophobicContact CZ-CG 4.04Å; F252-R291 VanDerWaalsContact CZ-O 3.29Å; F252-R291 WeakPolarHBondContact CZ-O 3.32Å; F252-A294 HydrophobicContact CE2-CB 4.18Å; F252-V295 HydrophobicContact CD1-CG2 3.8Å; F252-V295 HydrophobicContact CD2-CG2 4.3Å; F252-V295 HydrophobicContact CE1-CG2 3.16Å; F252-V295 HydrophobicContact CE2-CG2 3.73Å; F252-V295 HydrophobicContact CG-CG2 4.34Å; F252-V295 HydrophobicContact CZ-CG2 3.14Å; F252-I335 HydrophobicContact CD1-CD1 3.66Å; F252-I335 HydrophobicContact CE1-CD1 4.17Å
253	R	70.1	Confident	76.6	Confident	105 Å²	105	55.7 Å²	55.7	40%	0.396	27%	0.27	S	S	.	.	H	α-helix	trans	-58.7	-37.6	170.9	-65.9	169.5	173	-170.4	-1.5	112.5	L249 D250 R251 R291 I335	L249-R253 WeakPolarHBondContact O-CG 3.17Å; L249-R253 PolarHBondContact O-N 3.1Å; D250-R253 WeakPolarHBondContact O-CB 3.22Å; D250-R253 PolarHBondContact O-N 2.89Å; D250-R253 IonicContact OD1-NH1 3.5Å; R251-R253 PolarHBondContact O-N 3.33Å; R253-R291 PolarHBondContact O-NH1 3.48Å; R253-I335 VanDerWaalsContact CA-CD1 3.47Å; R253-I335 HydrophobicContact CB-CD1 3.87Å; R253-I335 HydrophobicContact CB-CG1 3.83Å; R253-I335 HydrophobicContact CG-CD1 3.21Å; R253-I335 HydrophobicContact CG-CG1 3.36Å
254	E	70.8	Confident	76.8	Confident	123 Å²	123	58 Å²	58	58%	0.575	29%	0.289	S	S	*	.	H	α-helix	trans	-96.2	-37.7	-168.6	-69.6	-177	179.6	0	0	112	R251 F252 V278	R251-E254 PolarHBondContact O-N 3.47Å; F252-E254 PolarHBondContact O-N 2.89Å; E254-V278 VanDerWaalsContact C-CG2 3.48Å; E254-V278 HydrophobicContact CB-CG2 3.54Å; E254-V278 HydrophobicContact CG-CG2 4.45Å; E254-V278 WeakPolarHBondContact O-CG1 3.46Å; E254-V278 WeakPolarHBondContact O-CG2 3.24Å
255	A	71.8	Confident	76.5	Confident	7 Å²	7	61.2 Å²	61.2	6%	0.058	31%	0.312	C	S	.	.			trans	-63.1	142.3	-168.1	0	0	0	0	0	115.3	R251 M275 S276 R291	R251-A255 WeakPolarHBondContact O-CB 3.02Å; R251-A255 PolarHBondContact O-N 3.38Å; A255-M275 HydrophobicContact CB-CB 3.78Å; A255-M275 HydrophobicContact CB-CG 4.09Å; A255-M275 HydrophobicContact CB-SD 4.14Å; A255-S276 WeakPolarHBondContact CA-O 3.37Å; A255-R291 PolarHBondContact O-NH2 3.02Å
256	E	66.9	Low	76.3	Confident	68 Å²	68	68.4 Å²	68.4	32%	0.318	35%	0.349	S	S	.	.	S	Bend	trans	-78.5	-42.7	173.1	-169.8	-170.6	163.3	0	0	112.1	S276	E256-S276 PolarHBondContact N-O 3.29Å
257	Q	71.8	Confident	76.1	Confident	93 Å²	93	66 Å²	66	44%	0.435	35%	0.345	S	S	.	.			trans	-135.8	143.4	178.8	-65	-177.5	2	0	0	110.4	M275 S276	Q257-M275 WeakPolarHBondContact O-CA 3.25Å; Q257-S276 PolarHBondContact O-N 2.85Å; Q257-S276 VanDerWaalsContact O-N 3.12Å
258	C	76.8	Confident	76.4	Confident	25 Å²	25	66.2 Å²	66.2	17%	0.169	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	108.4	174.7	-177.1	0	0	0	0	108.9	F252 M275 A294	F252-C258 HydrophobicContact CE2-CB 4.49Å; C258-M275 HydrophobicContact CB-CG 4.45Å; C258-A294 HydrophobicContact CB-CB 4.17Å
259	N	80.9	Confident	76.7	Confident	101 Å²	101	67.9 Å²	67.9	54%	0.54	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	126.6	173.8	-72.1	-39	0	0	0	109.5	T273 C274	N259-T273 CarbonylContact O-C 3.57Å; N259-T273 WeakPolarHBondContact O-CA 3.33Å; N259-C274 PolarHBondContact N-O 3.46Å; N259-C274 PolarHBondContact O-N 3.01Å
260	L	83	Confident	77.3	Confident	54 Å²	54	69.3 Å²	69.3	28%	0.283	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.6	-178.7	-66.3	166.9	0	0	0	109.3	T273 A294 N297 F298	L260-T273 HydrophobicContact CD2-CG2 3.45Å; L260-T273 VanDerWaalsContact CD2-CG2 3.45Å; L260-A294 WeakPolarHBondContact CD1-O 3.35Å; L260-N297 HydrophobicContact CD1-CB 3.48Å; L260-N297 VanDerWaalsContact CD1-CB 3.48Å; L260-F298 HydrophobicContact CD1-CB 4.05Å; L260-F298 HydrophobicContact CD2-CB 3.86Å; L260-F298 HydrophobicContact CD2-CD2 3.81Å; L260-F298 HydrophobicContact CD2-CG 4.32Å
261	H	83.4	Confident	77.9	Confident	100 Å²	100	65.9 Å²	65.9	46%	0.463	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	121.7	175.4	-167.1	55.5	0	0	0	109.5	E263 K272	H261-E263 IonicContact CD2-OE1 3.31Å; H261-E263 IonicContact CE1-OE1 2.61Å; H261-E263 WeakPolarHBondContact NE2-CG 3.4Å; H261-E263 IonicContact NE2-OE1 3.17Å; H261-E263 PolarHBondContact NE2-OE1 2.64Å; H261-K272 PolarHBondContact N-O 3.16Å; H261-K272 PolarHBondContact O-N 3.44Å
262	Y	85.1	Confident	78.4	Confident	95 Å²	95	67.5 Å²	67.5	37%	0.373	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	122.2	178.4	173	-97.3	0	0	0	109.3	A264 H269 T270 L271 A301 I305	Y262-A264 HydrophobicContact CE1-CB 4.27Å; Y262-H269 HydrophobicContact CE2-CB 4.4Å; Y262-H269 AromaticContact CZ-ND1 3.65Å; Y262-H269 PolarHBondContact OH-CE1 2.97Å; Y262-H269 PolarHBondContact OH-ND1 3.33Å; Y262-T270 WeakPolarHBondContact CA-O 3.29Å; Y262-L271 HydrophobicContact CD2-CB 4.49Å; Y262-A301 HydrophobicContact CD2-CB 4.04Å; Y262-A301 HydrophobicContact CG-CB 4.27Å; Y262-I305 HydrophobicContact CE2-CD1 4.22Å; Y262-I305 HydrophobicContact CE2-CG1 4.06Å
263	E	84	Confident	78.9	Confident	105 Å²	105	67.2 Å²	67.2	49%	0.491	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132.1	176.6	-69.4	-176.7	163.4	0	0	110.2	H261 H269 T270	H261-E263 IonicContact CD2-OE1 3.31Å; H261-E263 IonicContact CE1-OE1 2.61Å; H261-E263 WeakPolarHBondContact NE2-CG 3.4Å; H261-E263 IonicContact NE2-OE1 3.17Å; H261-E263 PolarHBondContact NE2-OE1 2.64Å; E263-H269 CarbonylContact O-C 3.58Å; E263-H269 WeakPolarHBondContact O-CA 3.36Å; E263-T270 PolarHBondContact N-O 3.01Å; E263-T270 PolarHBondContact O-N 3.11Å
264	A	81.5	Confident	79.3	Confident	63 Å²	63	64.3 Å²	64.3	52%	0.521	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	114	169.9	0	0	0	0	0	108.5	Y262 A268	Y262-A264 HydrophobicContact CE1-CB 4.27Å; A264-A268 CarbonylContact C-O 3.58Å; A264-A268 WeakPolarHBondContact CA-O 3.48Å
265	S	76.8	Confident	79.7	Confident	73 Å²	73	59 Å²	59	51%	0.51	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	132.7	178.2	62.9	0	0	0	0	110.5	G267 A268	S265-G267 PolarHBondContact O-N 3.16Å; S265-G267 VanDerWaalsContact O-N 3.09Å; S265-A268 PolarHBondContact N-O 2.89Å; S265-A268 WeakPolarHBondContact O-CA 3.39Å; S265-A268 WeakPolarHBondContact O-CB 3.39Å; S265-A268 PolarHBondContact O-N 3.3Å
266	N	75.5	Confident	79.7	Confident	173 Å²	173	60.3 Å²	60.3	93%	0.925	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	34.3	178	-59.4	-20.2	0	0	0	114.8	A268	N266-A268 PolarHBondContact O-N 3.4Å
267	G	70	Confident	79.5	Confident	40 Å²	40	60.8 Å²	60.8	41%	0.412	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	-4	-177.4	0	0	0	0	0	115	K215 S265 H269	K215-G267 CarbonylContact O-C 3.57Å; S265-G267 PolarHBondContact O-N 3.16Å; S265-G267 VanDerWaalsContact O-N 3.09Å; G267-H269 PolarHBondContact O-CD2 3.42Å
268	A	80.3	Confident	79.1	Confident	25 Å²	25	60 Å²	60	21%	0.207	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	131.2	169.8	0	0	0	0	0	110.4	V214 K215 A264 S265 N266	V214-A268 CarbonylContact O-C 3.55Å; V214-A268 WeakPolarHBondContact O-CA 3.5Å; K215-A268 WeakPolarHBondContact O-CA 3.22Å; K215-A268 WeakPolarHBondContact O-CB 3.37Å; K215-A268 PolarHBondContact O-N 2.56Å; A264-A268 CarbonylContact C-O 3.58Å; A264-A268 WeakPolarHBondContact CA-O 3.48Å; S265-A268 PolarHBondContact N-O 2.89Å; S265-A268 WeakPolarHBondContact O-CA 3.39Å; S265-A268 WeakPolarHBondContact O-CB 3.39Å; S265-A268 PolarHBondContact O-N 3.3Å; N266-A268 PolarHBondContact O-N 3.4Å
269	H	85.5	Confident	78	Confident	36 Å²	36	66.5 Å²	66.5	17%	0.167	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.2	177.3	-64.2	-102.9	0	0	0	108.7	T213 V214 V217 Y262 E263 G267 I305	T213-H269 CarbonylContact C-O 3.42Å; T213-H269 VanDerWaalsContact CA-O 3.29Å; T213-H269 WeakPolarHBondContact CA-O 3.29Å; V214-H269 PolarHBondContact N-O 3.26Å; V214-H269 PolarHBondContact O-N 3.11Å; V217-H269 WeakPolarHBondContact CG2-CD2 3.18Å; Y262-H269 HydrophobicContact CE2-CB 4.4Å; Y262-H269 AromaticContact CZ-ND1 3.65Å; Y262-H269 PolarHBondContact OH-CE1 2.97Å; Y262-H269 PolarHBondContact OH-ND1 3.33Å; E263-H269 CarbonylContact O-C 3.58Å; E263-H269 WeakPolarHBondContact O-CA 3.36Å; G267-H269 PolarHBondContact O-CD2 3.42Å; H269-I305 HydrophobicContact CB-CD1 4.25Å; H269-I305 HydrophobicContact CB-CG1 3.92Å
270	T	86.5	Confident	76.7	Confident	40 Å²	40	67.9 Å²	67.9	25%	0.245	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	121.2	176.5	-59.6	0	0	0	0	109.3	T211 V212 T213 Y262 E263	T211-T270 HydrophobicContact CG2-CG2 3.51Å; V212-T270 WeakPolarHBondContact O-CA 3.5Å; T213-T270 WeakPolarHBondContact CG2-OG1 3.44Å; T213-T270 PolarHBondContact OG1-OG1 3.09Å; Y262-T270 WeakPolarHBondContact CA-O 3.29Å; E263-T270 PolarHBondContact N-O 3.01Å; E263-T270 PolarHBondContact O-N 3.11Å
271	L	86.9	Confident	75.2	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.005	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	114.6	169.9	173.1	58.7	0	0	0	108.1	T211 V212 Y262 F298 A301 L302 I305	T211-L271 CarbonylContact C-O 3.39Å; T211-L271 VanDerWaalsContact CA-O 3.32Å; T211-L271 WeakPolarHBondContact CA-O 3.41Å; V212-L271 HydrophobicContact CB-CB 4.47Å; V212-L271 PolarHBondContact N-O 3.11Å; V212-L271 PolarHBondContact O-N 3.46Å; Y262-L271 HydrophobicContact CD2-CB 4.49Å; L271-F298 HydrophobicContact CD2-CD2 3.75Å; L271-F298 HydrophobicContact CD2-CE2 3.6Å; L271-F298 HydrophobicContact CD2-CZ 4.45Å; L271-F298 HydrophobicContact CG-CD2 4.38Å; L271-F298 HydrophobicContact CG-CE2 4.26Å; L271-A301 HydrophobicContact CD1-CB 3.66Å; L271-A301 HydrophobicContact CD2-CB 4.02Å; L271-A301 HydrophobicContact CG-CB 4.4Å; L271-L302 HydrophobicContact CD2-CB 4Å; L271-L302 HydrophobicContact CD2-CD1 4.22Å; L271-I305 HydrophobicContact CB-CD1 3.68Å
272	K	85.2	Confident	73.9	Confident	82 Å²	82	74.7 Å²	74.7	36%	0.357	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	124.9	174.6	-174.1	172.2	-177.3	-179.7	0	109.6	L210 T211 H261	L210-K272 CarbonylContact O-C 3.57Å; L210-K272 WeakPolarHBondContact O-CA 3.31Å; T211-K272 HydrophobicContact CG2-CB 4.48Å; H261-K272 PolarHBondContact N-O 3.16Å; H261-K272 PolarHBondContact O-N 3.44Å
273	T	83.4	Confident	72.8	Confident	2 Å²	2	73 Å²	73	1%	0.012	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	141.1	169.3	80.2	0	0	0	0	108.4	S209 L210 F248 N259 L260 F298	S209-T273 CarbonylContact C-O 3.53Å; S209-T273 WeakPolarHBondContact CA-O 3.41Å; S209-T273 WeakPolarHBondContact CB-O 3.38Å; L210-T273 PolarHBondContact N-O 3.47Å; L210-T273 VanDerWaalsContact N-O 3.13Å; L210-T273 PolarHBondContact O-N 2.93Å; F248-T273 HydrophobicContact CD2-CG2 4.49Å; N259-T273 CarbonylContact O-C 3.57Å; N259-T273 WeakPolarHBondContact O-CA 3.33Å; L260-T273 HydrophobicContact CD2-CG2 3.45Å; L260-T273 VanDerWaalsContact CD2-CG2 3.45Å; T273-F298 HydrophobicContact CG2-CD2 3.39Å; T273-F298 HydrophobicContact CG2-CE2 3.42Å; T273-F298 VanDerWaalsContact CG2-CE2 3.42Å
274	C	79.8	Confident	72	Confident	44 Å²	44	71.4 Å²	71.4	30%	0.297	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	127.4	170.3	-59.2	0	0	0	0	108.3	N259	N259-C274 PolarHBondContact N-O 3.46Å; N259-C274 PolarHBondContact O-N 3.01Å
275	M	78.4	Confident	71.3	Confident	11 Å²	11	73 Å²	73	5%	0.054	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.9	-177.6	-67.7	-178.7	-174.8	0	0	111.1	Q208 F248 R251 F252 A255 Q257 C258	Q208-M275 HydrophobicContact CB-CB 4.4Å; Q208-M275 WeakPolarHBondContact CB-O 3.26Å; Q208-M275 PolarHBondContact O-N 2.93Å; Q208-M275 VanDerWaalsContact O-N 3.1Å; Q208-M275 PolarHBondContact OE1-O 3.47Å; Q208-M275 VanDerWaalsContact OE1-O 3.07Å; F248-M275 HydrophobicContact CD2-CE 3.36Å; F248-M275 HydrophobicContact CE2-CE 3.49Å; F248-M275 VanDerWaalsContact CE2-CE 3.49Å; F248-M275 HydrophobicContact CG-CE 4.24Å; F248-M275 HydrophobicContact CZ-CE 4.45Å; R251-M275 HydrophobicContact CB-SD 3.71Å; F252-M275 HydrophobicContact CB-CE 4.07Å; F252-M275 HydrophobicContact CD2-CE 4.3Å; A255-M275 HydrophobicContact CB-CB 3.78Å; A255-M275 HydrophobicContact CB-CG 4.09Å; A255-M275 HydrophobicContact CB-SD 4.14Å; Q257-M275 WeakPolarHBondContact O-CA 3.25Å; C258-M275 HydrophobicContact CB-CG 4.45Å
276	S	71.5	Confident	71.1	Confident	36 Å²	36	76.1 Å²	76.1	25%	0.252	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-83.9	139.2	176.9	-44.4	0	0	0	0	111.3	A255 E256 Q257	A255-S276 WeakPolarHBondContact CA-O 3.37Å; E256-S276 PolarHBondContact N-O 3.29Å; Q257-S276 PolarHBondContact O-N 2.85Å; Q257-S276 VanDerWaalsContact O-N 3.12Å
277	P	64.2	Low	71	Confident	77 Å²	77	68.2 Å²	68.2	50%	0.5	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-61.4	147.9	172.8	18.7	-26.4	0	0	0	113
278	V	62.1	Low	71	Confident	77 Å²	77	66.8 Å²	66.8	47%	0.467	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-67.8	130.9	-173.6	-160.3	0	0	0	0	112.6	E254	E254-V278 VanDerWaalsContact C-CG2 3.48Å; E254-V278 HydrophobicContact CB-CG2 3.54Å; E254-V278 HydrophobicContact CG-CG2 4.45Å; E254-V278 WeakPolarHBondContact O-CG1 3.46Å; E254-V278 WeakPolarHBondContact O-CG2 3.24Å
279	F	54.3	Low	70.6	Confident	162 Å²	162	69.9 Å²	69.9	71%	0.711	37%	0.368	S	S	*	.			trans	-115.7	127.4	147.6	-71.4	-81.4	0	0	0	108	M281	F279-M281 PolarHBondContact O-N 2.95Å
280	S	52.5	Low	70.1	Confident	130 Å²	130	73.5 Å²	73.5	91%	0.909	38%	0.38	S	S	*	.			trans	-50.3	102	-176.5	-42.1	0	0	0	0	111
281	M	51.4	Low	69.6	Low	113 Å²	113	72.9 Å²	72.9	56%	0.557	37%	0.374	S	S	*	.			trans	-123.5	141.8	-179.7	-158.8	173.1	80.7	0	0	110.1	F279 L283	F279-M281 PolarHBondContact O-N 2.95Å; M281-L283 PolarHBondContact O-N 3.09Å
282	E	57.8	Low	69	Low	183 Å²	183	73.3 Å²	73.3	86%	0.855	38%	0.377	S	S	*	.			trans	-63.3	118.2	171.8	-68.8	-174.9	166.3	0	0	109.5	N284	E282-N284 PolarHBondContact O-N 3.16Å
283	L	60.8	Low	68.7	Low	61 Å²	61	71.7 Å²	71.7	32%	0.319	38%	0.376	S	S	.	.			trans	-66.8	120.3	178.5	-97.6	166	0	0	0	108.7	M281 E287 P339 Y340	M281-L283 PolarHBondContact O-N 3.09Å; L283-E287 HydrophobicContact CD2-CB 4.31Å; L283-E287 HydrophobicContact CD2-CG 3.57Å; L283-P339 HydrophobicContact CD1-CB 4.4Å; L283-Y340 VanDerWaalsContact C-CZ 3.43Å; L283-Y340 WeakPolarHBondContact CA-OH 3.32Å; L283-Y340 HydrophobicContact CB-CE1 4.25Å; L283-Y340 HydrophobicContact CB-CE2 3.84Å; L283-Y340 VanDerWaalsContact CB-CZ 3.47Å; L283-Y340 WeakPolarHBondContact CB-OH 3.36Å; L283-Y340 HydrophobicContact CD1-CE2 4.47Å; L283-Y340 HydrophobicContact CD2-CE2 4.12Å; L283-Y340 VanDerWaalsContact CD2-OH 3.29Å; L283-Y340 WeakPolarHBondContact CD2-OH 3.33Å; L283-Y340 HydrophobicContact CG-CE2 4.36Å; L283-Y340 WeakPolarHBondContact O-CE1 3.29Å; L283-Y340 PolarHBondContact O-OH 3.35Å
284	N	67.2	Low	68.4	Low	71 Å²	71	72.2 Å²	72.2	38%	0.38	38%	0.38	S	S	.	.			trans	-109.7	163.9	176	72.6	12	0	0	0	114	E282 E286 E287 M288 Y340	E282-N284 PolarHBondContact O-N 3.16Å; N284-E286 PolarHBondContact O-N 3.3Å; N284-E286 VanDerWaalsContact O-N 3.14Å; N284-E286 PolarHBondContact OD1-N 2.94Å; N284-E287 WeakPolarHBondContact O-CB 3.18Å; N284-E287 PolarHBondContact O-N 3.26Å; N284-E287 WeakPolarHBondContact OD1-CB 3.22Å; N284-E287 PolarHBondContact OD1-N 3.37Å; N284-M288 PolarHBondContact O-N 3.12Å; N284-Y340 VanDerWaalsContact C-OH 3.25Å; N284-Y340 PolarHBondContact N-OH 2.85Å; N284-Y340 PolarHBondContact O-OH 3.19Å
285	E	67.1	Low	68.4	Low	96 Å²	96	70.2 Å²	70.2	45%	0.449	37%	0.367	S	S	.	.	H	α-helix	trans	-53.4	-38.5	-175.9	-172.3	176.9	176	0	0	113.1	M288 L289	E285-M288 PolarHBondContact O-N 2.92Å; E285-L289 PolarHBondContact O-N 3.21Å; E285-L289 VanDerWaalsContact O-N 3.07Å
286	E	72.9	Confident	68.5	Low	138 Å²	138	71.8 Å²	71.8	65%	0.645	37%	0.374	S	S	*	.	H	α-helix	trans	-66.3	-40.5	176	-69.5	-176.7	173.2	0	0	112.9	N284 M288 L289 R290	N284-E286 PolarHBondContact O-N 3.3Å; N284-E286 VanDerWaalsContact O-N 3.14Å; N284-E286 PolarHBondContact OD1-N 2.94Å; E286-M288 VanDerWaalsContact C-N 3.35Å; E286-L289 PolarHBondContact O-N 2.86Å; E286-R290 WeakPolarHBondContact O-CB 3.45Å; E286-R290 WeakPolarHBondContact O-CG 3.35Å; E286-R290 PolarHBondContact O-N 2.9Å
287	E	72.6	Confident	69	Low	7 Å²	7	74.3 Å²	74.3	3%	0.033	38%	0.384	C	S	.	.	H	α-helix	trans	-65	-40.1	176.4	-177.2	60	-144.5	0	0	110.9	L283 N284 R290 R291	L283-E287 HydrophobicContact CD2-CB 4.31Å; L283-E287 HydrophobicContact CD2-CG 3.57Å; N284-E287 WeakPolarHBondContact O-CB 3.18Å; N284-E287 PolarHBondContact O-N 3.26Å; N284-E287 WeakPolarHBondContact OD1-CB 3.22Å; N284-E287 PolarHBondContact OD1-N 3.37Å; E287-R290 PolarHBondContact O-N 2.87Å; E287-R290 IonicContact OE2-CZ 3.3Å; E287-R290 IonicContact OE2-NE 2.94Å; E287-R290 IonicContact OE2-NH1 3.65Å; E287-R290 PolarHBondContact OE2-NH1 3.29Å; E287-R290 IonicContact OE2-NH2 2.74Å; E287-R290 PolarHBondContact OE2-NH2 3.22Å; E287-R291 WeakPolarHBondContact O-CB 3.48Å; E287-R291 VanDerWaalsContact O-CG 3.31Å; E287-R291 WeakPolarHBondContact O-CG 3.29Å; E287-R291 PolarHBondContact O-N 2.86Å; E287-R291 IonicContact OE1-CZ 2.88Å; E287-R291 IonicContact OE1-NE 2.81Å; E287-R291 PolarHBondContact OE1-NE 3.2Å; E287-R291 IonicContact OE1-NH2 3.61Å
288	M	70.2	Confident	70	Confident	10 Å²	10	70.7 Å²	70.7	5%	0.049	36%	0.361	C	S	.	.	H	α-helix	trans	-61.2	-47.7	174.2	-170.4	-147.9	65.3	0	0	111.8	N284 E285 E286 R291 S292 C336 Y340 Q354	N284-M288 PolarHBondContact O-N 3.12Å; E285-M288 PolarHBondContact O-N 2.92Å; E286-M288 VanDerWaalsContact C-N 3.35Å; M288-R291 PolarHBondContact O-N 3.28Å; M288-S292 PolarHBondContact O-N 3.46Å; M288-C336 HydrophobicContact CG-CB 4.31Å; M288-C336 WeakPolarHBondContact CG-O 3.49Å; M288-Y340 HydrophobicContact CB-CD2 4.43Å; M288-Y340 HydrophobicContact CB-CE2 3.84Å; M288-Y340 HydrophobicContact CG-CD2 4.22Å; M288-Y340 HydrophobicContact CG-CE2 4.02Å; M288-Q354 HydrophobicContact CE-CB 4.29Å; M288-Q354 HydrophobicContact CE-CG 3.67Å; M288-Q354 HydrophobicContact SD-CB 4.08Å; M288-Q354 VanDerWaalsContact SD-CD 3.54Å; M288-Q354 HydrophobicContact SD-CG 3.52Å; M288-Q354 VanDerWaalsContact SD-CG 3.52Å; M288-Q354 PolarHBondContact SD-NE2 2.81Å
289	L	72.6	Confident	70.9	Confident	90 Å²	90	67 Å²	67	47%	0.471	34%	0.339	S	S	.	.	H	α-helix	trans	-62.5	-44.8	177.9	-173.2	66	0	0	0	110.7	E285 E286 R291 S292 S293	E285-L289 PolarHBondContact O-N 3.21Å; E285-L289 VanDerWaalsContact O-N 3.07Å; E286-L289 PolarHBondContact O-N 2.86Å; L289-R291 VanDerWaalsContact C-N 3.35Å; L289-R291 PolarHBondContact O-N 2.83Å; L289-S292 PolarHBondContact O-N 3.28Å; L289-S293 WeakPolarHBondContact O-CB 3.36Å; L289-S293 PolarHBondContact O-N 2.97Å; L289-S293 PolarHBondContact O-OG 3.44Å; L289-S293 VanDerWaalsContact O-OG 3.1Å
290	R	75	Confident	72.3	Confident	112 Å²	112	61.5 Å²	61.5	42%	0.423	32%	0.316	S	S	.	.	H	α-helix	trans	-57.7	-45.3	175.2	-80.8	-172.4	-78.2	125.3	2.5	112	E286 E287 S293 A294	E286-R290 WeakPolarHBondContact O-CB 3.45Å; E286-R290 WeakPolarHBondContact O-CG 3.35Å; E286-R290 PolarHBondContact O-N 2.9Å; E287-R290 PolarHBondContact O-N 2.87Å; E287-R290 IonicContact OE2-CZ 3.3Å; E287-R290 IonicContact OE2-NE 2.94Å; E287-R290 IonicContact OE2-NH1 3.65Å; E287-R290 PolarHBondContact OE2-NH1 3.29Å; E287-R290 IonicContact OE2-NH2 2.74Å; E287-R290 PolarHBondContact OE2-NH2 3.22Å; R290-S293 PolarHBondContact O-N 3.31Å; R290-A294 WeakPolarHBondContact O-CB 3.47Å; R290-A294 PolarHBondContact O-N 2.88Å
291	R	76.3	Confident	73.8	Confident	28 Å²	28	56.2 Å²	56.2	11%	0.106	28%	0.281	C	S	.	.	H	α-helix	trans	-61.5	-51	175.6	-77.7	-177.1	-174.9	-145.5	1.1	111.3	F252 R253 A255 E287 M288 L289 S293 A294 V295	F252-R291 HydrophobicContact CE1-CB 4.37Å; F252-R291 HydrophobicContact CZ-CB 3.7Å; F252-R291 HydrophobicContact CZ-CG 4.04Å; F252-R291 VanDerWaalsContact CZ-O 3.29Å; F252-R291 WeakPolarHBondContact CZ-O 3.32Å; R253-R291 PolarHBondContact O-NH1 3.48Å; A255-R291 PolarHBondContact O-NH2 3.02Å; E287-R291 WeakPolarHBondContact O-CB 3.48Å; E287-R291 VanDerWaalsContact O-CG 3.31Å; E287-R291 WeakPolarHBondContact O-CG 3.29Å; E287-R291 PolarHBondContact O-N 2.86Å; E287-R291 IonicContact OE1-CZ 2.88Å; E287-R291 IonicContact OE1-NE 2.81Å; E287-R291 PolarHBondContact OE1-NE 3.2Å; E287-R291 IonicContact OE1-NH2 3.61Å; M288-R291 PolarHBondContact O-N 3.28Å; L289-R291 VanDerWaalsContact C-N 3.35Å; L289-R291 PolarHBondContact O-N 2.83Å; R291-S293 VanDerWaalsContact C-N 3.32Å; R291-S293 PolarHBondContact O-N 3.23Å; R291-A294 PolarHBondContact O-N 3.07Å; R291-A294 VanDerWaalsContact O-N 3.11Å; R291-V295 WeakPolarHBondContact O-CG2 3.33Å; R291-V295 PolarHBondContact O-N 3.1Å
292	S	73.7	Confident	75.4	Confident	10 Å²	10	50.9 Å²	50.9	7%	0.07	25%	0.254	C	S	.	.	H	α-helix	trans	-56.3	-46.3	177.4	-172.6	0	0	0	0	112	M288 L289 A294 V295 Q296	M288-S292 PolarHBondContact O-N 3.46Å; L289-S292 PolarHBondContact O-N 3.28Å; S292-A294 PolarHBondContact O-N 3.47Å; S292-V295 PolarHBondContact O-N 3.48Å; S292-Q296 PolarHBondContact O-N 2.84Å
293	S	78.5	Confident	76.5	Confident	48 Å²	48	43.6 Å²	43.6	34%	0.336	22%	0.224	S	C	.	.	H	α-helix	trans	-64.2	-37.8	176.6	-63	0	0	0	0	112.5	L289 R290 R291 Q296 N297	L289-S293 WeakPolarHBondContact O-CB 3.36Å; L289-S293 PolarHBondContact O-N 2.97Å; L289-S293 PolarHBondContact O-OG 3.44Å; L289-S293 VanDerWaalsContact O-OG 3.1Å; R290-S293 PolarHBondContact O-N 3.31Å; R291-S293 VanDerWaalsContact C-N 3.32Å; R291-S293 PolarHBondContact O-N 3.23Å; S293-Q296 PolarHBondContact O-N 3.46Å; S293-N297 WeakPolarHBondContact O-CB 3.37Å; S293-N297 PolarHBondContact O-N 3.35Å; S293-N297 PolarHBondContact O-ND2 2.81Å; S293-N297 PolarHBondContact O-OD1 2.81Å
294	A	78.1	Confident	77.3	Confident	13 Å²	13	42.6 Å²	42.6	11%	0.107	23%	0.228	C	C	.	.	H	α-helix	trans	-64.6	-43.1	176.2	0	0	0	0	0	112	F252 C258 L260 R290 R291 S292 Q296 N297 F298	F252-A294 HydrophobicContact CE2-CB 4.18Å; C258-A294 HydrophobicContact CB-CB 4.17Å; L260-A294 WeakPolarHBondContact CD1-O 3.35Å; R290-A294 WeakPolarHBondContact O-CB 3.47Å; R290-A294 PolarHBondContact O-N 2.88Å; R291-A294 PolarHBondContact O-N 3.07Å; R291-A294 VanDerWaalsContact O-N 3.11Å; S292-A294 PolarHBondContact O-N 3.47Å; A294-Q296 VanDerWaalsContact C-N 3.34Å; A294-Q296 PolarHBondContact O-N 3.12Å; A294-N297 PolarHBondContact O-N 3.3Å; A294-F298 WeakPolarHBondContact O-CB 3.45Å; A294-F298 PolarHBondContact O-N 2.84Å
295	V	78.9	Confident	78	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.006	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-47	173.9	-173.2	0	0	0	0	110.1	F252 R291 S292 N297 F298 F299 L328 I332 F365	F252-V295 HydrophobicContact CD1-CG2 3.8Å; F252-V295 HydrophobicContact CD2-CG2 4.3Å; F252-V295 HydrophobicContact CE1-CG2 3.16Å; F252-V295 HydrophobicContact CE2-CG2 3.73Å; F252-V295 HydrophobicContact CG-CG2 4.34Å; F252-V295 HydrophobicContact CZ-CG2 3.14Å; R291-V295 WeakPolarHBondContact O-CG2 3.33Å; R291-V295 PolarHBondContact O-N 3.1Å; S292-V295 PolarHBondContact O-N 3.48Å; V295-N297 PolarHBondContact O-N 3.39Å; V295-F298 PolarHBondContact O-N 3.22Å; V295-F299 HydrophobicContact CG1-CD2 3.8Å; V295-F299 HydrophobicContact CG1-CE2 3.82Å; V295-F299 WeakPolarHBondContact O-CD2 3.34Å; V295-F299 PolarHBondContact O-N 3.25Å; V295-F299 VanDerWaalsContact O-N 3.1Å; V295-L328 HydrophobicContact CG1-CD1 4.21Å; V295-I332 HydrophobicContact CG1-CD1 4.07Å; V295-I332 HydrophobicContact CG1-CG1 4.31Å; V295-F365 HydrophobicContact CG1-CE2 4.43Å; V295-F365 HydrophobicContact CG1-CZ 3.94Å
296	Q	79.8	Confident	78.7	Confident	44 Å²	44	34.7 Å²	34.7	21%	0.206	19%	0.189	C	C	.	.	H	α-helix	trans	-57.4	-50.7	177.6	-172.8	173.6	-30.7	0	0	111.7	S292 S293 A294 F298 F299 D300 L361 N364	S292-Q296 PolarHBondContact O-N 2.84Å; S293-Q296 PolarHBondContact O-N 3.46Å; A294-Q296 VanDerWaalsContact C-N 3.34Å; A294-Q296 PolarHBondContact O-N 3.12Å; Q296-F298 VanDerWaalsContact C-N 3.28Å; Q296-F298 PolarHBondContact O-N 3.05Å; Q296-F299 PolarHBondContact O-N 3.34Å; Q296-D300 WeakPolarHBondContact O-CB 3.34Å; Q296-D300 PolarHBondContact O-N 3Å; Q296-D300 VanDerWaalsContact O-OD1 3.09Å; Q296-L361 HydrophobicContact CB-CD1 3.67Å; Q296-L361 HydrophobicContact CG-CD1 4.08Å; Q296-N364 PolarHBondContact NE2-ND2 3.49Å
297	N	83.1	Confident	79.1	Confident	89 Å²	89	33.3 Å²	33.3	48%	0.476	19%	0.186	S	C	.	.	H	α-helix	trans	-60.6	-37.4	-179.5	-70.2	-16.6	0	0	0	112.4	L260 S293 A294 V295 D300 A301	L260-N297 HydrophobicContact CD1-CB 3.48Å; L260-N297 VanDerWaalsContact CD1-CB 3.48Å; S293-N297 WeakPolarHBondContact O-CB 3.37Å; S293-N297 PolarHBondContact O-N 3.35Å; S293-N297 PolarHBondContact O-ND2 2.81Å; S293-N297 PolarHBondContact O-OD1 2.81Å; A294-N297 PolarHBondContact O-N 3.3Å; V295-N297 PolarHBondContact O-N 3.39Å; N297-D300 PolarHBondContact O-N 3.34Å; N297-A301 PolarHBondContact O-N 3.4Å
298	F	84.5	Confident	79.4	Confident	1 Å²	1	33.2 Å²	33.2	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-50.3	175.8	172.6	-105.7	0	0	0	111.3	L210 L244 F248 L260 L271 T273 A294 V295 Q296 D300 A301 L302	L210-F298 HydrophobicContact CD2-CE2 4.45Å; L210-F298 HydrophobicContact CD2-CZ 4.24Å; L244-F298 HydrophobicContact CD2-CZ 4.11Å; F248-F298 HydrophobicContact CB-CZ 4.43Å; F248-F298 AromaticContact CD1-CD1 3.91Å; F248-F298 HydrophobicContact CD1-CD1 3.91Å; F248-F298 AromaticContact CD1-CE1 3.73Å; F248-F298 HydrophobicContact CD1-CE1 3.73Å; F248-F298 HydrophobicContact CD1-CZ 4.38Å; F248-F298 HydrophobicContact CD2-CD1 4.02Å; F248-F298 HydrophobicContact CD2-CD2 4.07Å; F248-F298 AromaticContact CD2-CE1 3.91Å; F248-F298 HydrophobicContact CD2-CE1 3.91Å; F248-F298 AromaticContact CD2-CE2 3.96Å; F248-F298 HydrophobicContact CD2-CE2 3.96Å; F248-F298 HydrophobicContact CD2-CG 4.09Å; F248-F298 AromaticContact CD2-CZ 3.87Å; F248-F298 HydrophobicContact CD2-CZ 3.87Å; F248-F298 AromaticContact CE1-CD1 3.5Å; F248-F298 HydrophobicContact CE1-CD1 3.5Å; F248-F298 VanDerWaalsContact CE1-CD1 3.5Å; F248-F298 AromaticContact CE1-CE1 3.83Å; F248-F298 HydrophobicContact CE1-CE1 3.83Å; F248-F298 HydrophobicContact CE1-CG 4.15Å; F248-F298 HydrophobicContact CE2-CB 3.92Å; F248-F298 AromaticContact CE2-CD1 3.62Å; F248-F298 HydrophobicContact CE2-CD1 3.62Å; F248-F298 AromaticContact CE2-CD2 3.72Å; F248-F298 HydrophobicContact CE2-CD2 3.72Å; F248-F298 HydrophobicContact CE2-CE1 4.01Å; F248-F298 HydrophobicContact CE2-CE2 4.11Å; F248-F298 AromaticContact CE2-CG 3.45Å; F248-F298 HydrophobicContact CE2-CG 3.45Å; F248-F298 VanDerWaalsContact CE2-CG 3.45Å; F248-F298 HydrophobicContact CE2-CZ 4.23Å; F248-F298 HydrophobicContact CG-CD1 4.17Å; F248-F298 AromaticContact CG-CE1 3.78Å; F248-F298 HydrophobicContact CG-CE1 3.78Å; F248-F298 AromaticContact CG-CZ 3.97Å; F248-F298 HydrophobicContact CG-CZ 3.97Å; F248-F298 HydrophobicContact CZ-CB 3.73Å; F248-F298 AromaticContact CZ-CD1 3.34Å; F248-F298 HydrophobicContact CZ-CD1 3.34Å; F248-F298 HydrophobicContact CZ-CD2 4.25Å; F248-F298 AromaticContact CZ-CE1 3.98Å; F248-F298 HydrophobicContact CZ-CE1 3.98Å; F248-F298 AromaticContact CZ-CG 3.49Å; F248-F298 HydrophobicContact CZ-CG 3.49Å; F248-F298 VanDerWaalsContact CZ-CG 3.49Å; L260-F298 HydrophobicContact CD1-CB 4.05Å; L260-F298 HydrophobicContact CD2-CB 3.86Å; L260-F298 HydrophobicContact CD2-CD2 3.81Å; L260-F298 HydrophobicContact CD2-CG 4.32Å; L271-F298 HydrophobicContact CD2-CD2 3.75Å; L271-F298 HydrophobicContact CD2-CE2 3.6Å; L271-F298 HydrophobicContact CD2-CZ 4.45Å; L271-F298 HydrophobicContact CG-CD2 4.38Å; L271-F298 HydrophobicContact CG-CE2 4.26Å; T273-F298 HydrophobicContact CG2-CD2 3.39Å; T273-F298 HydrophobicContact CG2-CE2 3.42Å; T273-F298 VanDerWaalsContact CG2-CE2 3.42Å; A294-F298 WeakPolarHBondContact O-CB 3.45Å; A294-F298 PolarHBondContact O-N 2.84Å; V295-F298 PolarHBondContact O-N 3.22Å; Q296-F298 VanDerWaalsContact C-N 3.28Å; Q296-F298 PolarHBondContact O-N 3.05Å; F298-D300 VanDerWaalsContact C-N 3.3Å; F298-D300 PolarHBondContact O-N 3.14Å; F298-A301 PolarHBondContact O-N 3.48Å; F298-L302 HydrophobicContact CE1-CD2 4.11Å; F298-L302 HydrophobicContact CZ-CD2 4.27Å; F298-L302 VanDerWaalsContact O-CB 3.31Å; F298-L302 WeakPolarHBondContact O-CB 3.28Å; F298-L302 PolarHBondContact O-N 3.26Å
299	F	82.3	Confident	79.6	Confident	1 Å²	1	35.9 Å²	35.9	0%	0.004	20%	0.203	C	C	.	.	H	α-helix	trans	-70.2	-27.4	178.8	-79	-76.8	0	0	0	112.8	F248 V295 Q296 L302 S303 L324 L328 F365 F370	F248-F299 HydrophobicContact CE1-CE2 4.05Å; V295-F299 HydrophobicContact CG1-CD2 3.8Å; V295-F299 HydrophobicContact CG1-CE2 3.82Å; V295-F299 WeakPolarHBondContact O-CD2 3.34Å; V295-F299 PolarHBondContact O-N 3.25Å; V295-F299 VanDerWaalsContact O-N 3.1Å; Q296-F299 PolarHBondContact O-N 3.34Å; F299-L302 HydrophobicContact CD1-CD2 4.17Å; F299-L302 HydrophobicContact CE1-CD2 4.19Å; F299-L302 PolarHBondContact O-N 3.39Å; F299-S303 VanDerWaalsContact O-CB 3.29Å; F299-S303 WeakPolarHBondContact O-CB 3.4Å; F299-S303 PolarHBondContact O-N 3.37Å; F299-L324 HydrophobicContact CE1-CD2 3.93Å; F299-L324 HydrophobicContact CZ-CD2 3.8Å; F299-L328 HydrophobicContact CD2-CD1 4.42Å; F299-L328 HydrophobicContact CD2-CD2 4.35Å; F299-L328 HydrophobicContact CE1-CD2 4.02Å; F299-L328 HydrophobicContact CE2-CD1 3.38Å; F299-L328 HydrophobicContact CE2-CD2 3.71Å; F299-L328 HydrophobicContact CE2-CG 4.22Å; F299-L328 HydrophobicContact CZ-CD1 3.63Å; F299-L328 HydrophobicContact CZ-CD2 3.53Å; F299-L328 HydrophobicContact CZ-CG 4.2Å; F299-F365 HydrophobicContact CB-CD1 4.3Å; F299-F365 HydrophobicContact CB-CE1 3.65Å; F299-F365 HydrophobicContact CB-CZ 4.25Å; F299-F365 HydrophobicContact CD2-CE1 4.02Å; F299-F365 HydrophobicContact CD2-CE2 4.48Å; F299-F365 AromaticContact CD2-CZ 3.74Å; F299-F365 HydrophobicContact CD2-CZ 3.74Å; F299-F365 HydrophobicContact CE2-CZ 4.5Å; F299-F365 HydrophobicContact CG-CE1 4.01Å; F299-F365 HydrophobicContact CG-CZ 4.19Å; F299-F370 HydrophobicContact CB-CD2 4.45Å; F299-F370 HydrophobicContact CB-CE2 4.37Å; F299-F370 HydrophobicContact CD1-CD1 4.11Å; F299-F370 HydrophobicContact CD1-CD2 4.15Å; F299-F370 HydrophobicContact CD1-CE1 4.1Å; F299-F370 HydrophobicContact CD1-CE2 4.12Å; F299-F370 HydrophobicContact CD1-CG 4.14Å; F299-F370 HydrophobicContact CD1-CZ 4.11Å; F299-F370 HydrophobicContact CE1-CD1 4.41Å; F299-F370 HydrophobicContact CE1-CE1 4.49Å; F299-F370 WeakPolarHBondContact O-CE2 3.45Å
300	D	83.3	Confident	79.5	Confident	45 Å²	45	32 Å²	32	24%	0.241	18%	0.183	C	C	.	.	H	α-helix	trans	-64.9	-48.8	172.9	-75	9	0	0	0	110.7	Q296 N297 F298 S303 G304 R368	Q296-D300 WeakPolarHBondContact O-CB 3.34Å; Q296-D300 PolarHBondContact O-N 3Å; Q296-D300 VanDerWaalsContact O-OD1 3.09Å; N297-D300 PolarHBondContact O-N 3.34Å; F298-D300 VanDerWaalsContact C-N 3.3Å; F298-D300 PolarHBondContact O-N 3.14Å; D300-S303 WeakPolarHBondContact O-CB 3.41Å; D300-S303 PolarHBondContact O-N 2.88Å; D300-S303 PolarHBondContact O-OG 2.95Å; D300-G304 PolarHBondContact O-N 2.91Å; D300-R368 VanDerWaalsContact CG-CZ 3.49Å; D300-R368 IonicContact OD1-CZ 2.7Å; D300-R368 IonicContact OD1-NE 2.67Å; D300-R368 PolarHBondContact OD1-NE 2.74Å; D300-R368 IonicContact OD1-NH1 3.55Å; D300-R368 PolarHBondContact OD1-NH1 3.29Å; D300-R368 IonicContact OD1-NH2 2.68Å; D300-R368 PolarHBondContact OD1-NH2 2.74Å; D300-R368 IonicContact OD2-CZ 2.75Å; D300-R368 IonicContact OD2-NH2 3.98Å; D300-R368 PolarHBondContact OD2-NH2 3.31Å
301	A	82.7	Confident	79	Confident	19 Å²	19	29 Å²	29	16%	0.157	19%	0.187	C	C	.	.	H	α-helix	trans	-64.3	-41.1	174.9	0	0	0	0	0	111.9	Y262 L271 N297 F298 S303 G304	Y262-A301 HydrophobicContact CD2-CB 4.04Å; Y262-A301 HydrophobicContact CG-CB 4.27Å; L271-A301 HydrophobicContact CD1-CB 3.66Å; L271-A301 HydrophobicContact CD2-CB 4.02Å; L271-A301 HydrophobicContact CG-CB 4.4Å; N297-A301 PolarHBondContact O-N 3.4Å; F298-A301 PolarHBondContact O-N 3.48Å; A301-S303 VanDerWaalsContact C-N 3.3Å; A301-S303 PolarHBondContact O-N 3.05Å; A301-G304 PolarHBondContact O-N 3.38Å
302	L	85.4	Confident	78.5	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-66.5	-32.9	177.4	-169.1	66.3	0	0	0	111.8	V212 L244 L271 F298 F299 G304 I305 L306 F370	V212-L302 HydrophobicContact CG1-CD1 4.14Å; L244-L302 HydrophobicContact CD1-CD2 4.15Å; L271-L302 HydrophobicContact CD2-CB 4Å; L271-L302 HydrophobicContact CD2-CD1 4.22Å; F298-L302 HydrophobicContact CE1-CD2 4.11Å; F298-L302 HydrophobicContact CZ-CD2 4.27Å; F298-L302 VanDerWaalsContact O-CB 3.31Å; F298-L302 WeakPolarHBondContact O-CB 3.28Å; F298-L302 PolarHBondContact O-N 3.26Å; F299-L302 HydrophobicContact CD1-CD2 4.17Å; F299-L302 HydrophobicContact CE1-CD2 4.19Å; F299-L302 PolarHBondContact O-N 3.39Å; L302-G304 VanDerWaalsContact C-N 3.28Å; L302-G304 PolarHBondContact O-N 2.87Å; L302-I305 WeakPolarHBondContact O-CB 2.95Å; L302-I305 PolarHBondContact O-N 3.31Å; L302-I305 VanDerWaalsContact O-N 3.1Å; L302-L306 HydrophobicContact CD1-CD1 4.01Å; L302-L306 HydrophobicContact CD1-CG 4.12Å; L302-L306 HydrophobicContact CD2-CD1 3.9Å; L302-L306 HydrophobicContact CG-CD1 3.62Å; L302-L306 HydrophobicContact CG-CG 4.02Å; L302-L306 WeakPolarHBondContact O-CG 3.34Å; L302-L306 PolarHBondContact O-N 3.38Å; L302-F370 HydrophobicContact CB-CZ 4.42Å; L302-F370 HydrophobicContact CD2-CE1 4.35Å; L302-F370 HydrophobicContact CD2-CZ 4.27Å; L302-F370 HydrophobicContact CG-CZ 4.27Å
303	S	81.8	Confident	78.4	Confident	31 Å²	31	35.4 Å²	35.4	22%	0.217	23%	0.234	C	C	.	.	H	α-helix	trans	-59.2	-40.8	176.8	79.2	0	0	0	0	111.3	F299 D300 A301 I305 L306 N307	F299-S303 VanDerWaalsContact O-CB 3.29Å; F299-S303 WeakPolarHBondContact O-CB 3.4Å; F299-S303 PolarHBondContact O-N 3.37Å; D300-S303 WeakPolarHBondContact O-CB 3.41Å; D300-S303 PolarHBondContact O-N 2.88Å; D300-S303 PolarHBondContact O-OG 2.95Å; A301-S303 VanDerWaalsContact C-N 3.3Å; A301-S303 PolarHBondContact O-N 3.05Å; S303-I305 VanDerWaalsContact C-N 3.26Å; S303-I305 PolarHBondContact O-N 2.87Å; S303-L306 PolarHBondContact O-N 2.96Å; S303-N307 WeakPolarHBondContact O-CB 3.41Å; S303-N307 PolarHBondContact O-N 2.96Å
304	G	77.8	Confident	78.2	Confident	39 Å²	39	36.1 Å²	36.1	40%	0.402	24%	0.237	S	C	.	.	H	α-helix	trans	-61.9	-35.4	177	0	0	0	0	0	112.6	D300 A301 L302	D300-G304 PolarHBondContact O-N 2.91Å; A301-G304 PolarHBondContact O-N 3.38Å; L302-G304 VanDerWaalsContact C-N 3.28Å; L302-G304 PolarHBondContact O-N 2.87Å
305	I	81.2	Confident	78.4	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-75.6	-37.5	178.2	-60	-177.2	0	0	0	111.5	F199 V214 Y262 H269 L271 L302 S303	F199-I305 HydrophobicContact CE2-CG2 4.11Å; V214-I305 HydrophobicContact CB-CG2 4.09Å; V214-I305 HydrophobicContact CG2-CG2 3.22Å; Y262-I305 HydrophobicContact CE2-CD1 4.22Å; Y262-I305 HydrophobicContact CE2-CG1 4.06Å; H269-I305 HydrophobicContact CB-CD1 4.25Å; H269-I305 HydrophobicContact CB-CG1 3.92Å; L271-I305 HydrophobicContact CB-CD1 3.68Å; L302-I305 WeakPolarHBondContact O-CB 2.95Å; L302-I305 PolarHBondContact O-N 3.31Å; L302-I305 VanDerWaalsContact O-N 3.1Å; S303-I305 VanDerWaalsContact C-N 3.26Å; S303-I305 PolarHBondContact O-N 2.87Å
306	L	82.7	Confident	78.6	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-100	3.7	-172.9	-58.7	-176	0	0	0	114.5	F199 L240 L302 S303 V308 L316 G317 V320 F370	F199-L306 HydrophobicContact CE2-CD2 4.17Å; F199-L306 HydrophobicContact CZ-CD2 3.88Å; L240-L306 HydrophobicContact CD2-CD2 4.49Å; L302-L306 HydrophobicContact CD1-CD1 4.01Å; L302-L306 HydrophobicContact CD1-CG 4.12Å; L302-L306 HydrophobicContact CD2-CD1 3.9Å; L302-L306 HydrophobicContact CG-CD1 3.62Å; L302-L306 HydrophobicContact CG-CG 4.02Å; L302-L306 WeakPolarHBondContact O-CG 3.34Å; L302-L306 PolarHBondContact O-N 3.38Å; S303-L306 PolarHBondContact O-N 2.96Å; L306-V308 PolarHBondContact O-N 3.41Å; L306-L316 HydrophobicContact CD2-CD2 3.85Å; L306-L316 HydrophobicContact CD2-CG 4.25Å; L306-G317 PolarHBondContact O-N 3.24Å; L306-V320 HydrophobicContact CD1-CG2 4.35Å; L306-F370 HydrophobicContact CD1-CE1 3.94Å; L306-F370 HydrophobicContact CD1-CZ 4.13Å
307	N	80	Confident	78.8	Confident	110 Å²	110	35.2 Å²	35.2	59%	0.588	23%	0.231	S	C	*	.			trans	-78.5	54	177.7	-169.3	27.4	0	0	0	112.3	S303 H315	S303-N307 WeakPolarHBondContact O-CB 3.41Å; S303-N307 PolarHBondContact O-N 2.96Å; N307-H315 PolarHBondContact OD1-CE1 3.33Å; N307-H315 VanDerWaalsContact OD1-CE1 3.31Å; N307-H315 PolarHBondContact OD1-ND1 2.91Å
308	V	79.6	Confident	78.7	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.024	22%	0.217	C	C	.	.			trans	-114.1	125.9	178.9	165.6	0	0	0	0	108.4	V217 L220 V221 L306 H315 L316	V217-V308 HydrophobicContact CG1-CG2 3.82Å; L220-V308 HydrophobicContact CD2-CG2 4.16Å; V221-V308 HydrophobicContact CB-CG1 3.99Å; V221-V308 HydrophobicContact CG1-CG1 4.5Å; V221-V308 HydrophobicContact CG2-CB 4.4Å; V221-V308 HydrophobicContact CG2-CG1 3.5Å; V221-V308 HydrophobicContact CG2-CG2 4.22Å; L306-V308 PolarHBondContact O-N 3.41Å; V308-H315 CarbonylContact O-C 3.6Å; V308-H315 VanDerWaalsContact O-CA 3.27Å; V308-H315 WeakPolarHBondContact O-CA 3.03Å; V308-L316 PolarHBondContact O-N 2.9Å
309	T	75.1	Confident	78.6	Confident	67 Å²	67	33 Å²	33	41%	0.411	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	131.3	172.1	47.8	0	0	0	0	110	H315	T309-H315 WeakPolarHBondContact CG2-NE2 3.44Å
310	V	70.5	Confident	78.6	Confident	9 Å²	9	33 Å²	33	6%	0.055	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	155.9	175.2	-168.1	0	0	0	0	108.9	C224 E228 L233 N312 G313 V314 L316	C224-V310 HydrophobicContact CB-CB 4.23Å; C224-V310 HydrophobicContact CB-CG1 3.66Å; C224-V310 HydrophobicContact CB-CG2 3.86Å; E228-V310 HydrophobicContact CB-CG1 4.48Å; L233-V310 HydrophobicContact CD1-CG1 4.14Å; L233-V310 HydrophobicContact CD2-CB 4.31Å; L233-V310 HydrophobicContact CD2-CG1 3.39Å; L233-V310 HydrophobicContact CG-CG1 4.4Å; V310-N312 CarbonylContact O-C 3.59Å; V310-N312 PolarHBondContact O-N 3.32Å; V310-G313 WeakPolarHBondContact O-CA 3Å; V310-G313 PolarHBondContact O-N 3.17Å; V310-V314 WeakPolarHBondContact CB-O 3.41Å; V310-V314 PolarHBondContact N-O 3.21Å; V310-V314 PolarHBondContact O-N 2.83Å; V310-L316 HydrophobicContact CG2-CB 4.04Å
311	G	63	Low	78.5	Confident	49 Å²	49	31 Å²	31	51%	0.505	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-40.1	-18.6	-165	0	0	0	0	0	120.6	D225	D225-G311 VanDerWaalsContact OD1-CA 3.23Å; D225-G311 WeakPolarHBondContact OD1-CA 3.44Å; D225-G311 PolarHBondContact OD1-N 2.91Å
312	N	66.9	Low	78.4	Confident	120 Å²	120	34.4 Å²	34.4	64%	0.642	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.5	14.5	172.5	-60.2	-21.3	0	0	0	113.4	E228 V310 V314	E228-N312 PolarHBondContact OE1-ND2 3.47Å; V310-N312 CarbonylContact O-C 3.59Å; V310-N312 PolarHBondContact O-N 3.32Å; N312-V314 HydrophobicContact CB-CG2 4.27Å; N312-V314 PolarHBondContact O-N 2.87Å
313	G	71.1	Confident	78.2	Confident	51 Å²	51	38.6 Å²	38.6	53%	0.526	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	2.9	-171.4	0	0	0	0	0	114.4	V310	V310-G313 WeakPolarHBondContact O-CA 3Å; V310-G313 PolarHBondContact O-N 3.17Å
314	V	74.9	Confident	78.1	Confident	64 Å²	64	37.2 Å²	37.2	39%	0.388	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	131.9	179.4	-178.8	0	0	0	0	109.2	V310 N312	V310-V314 WeakPolarHBondContact CB-O 3.41Å; V310-V314 PolarHBondContact N-O 3.21Å; V310-V314 PolarHBondContact O-N 2.83Å; N312-V314 HydrophobicContact CB-CG2 4.27Å; N312-V314 PolarHBondContact O-N 2.87Å
315	H	81.3	Confident	78.2	Confident	34 Å²	34	35.4 Å²	35.4	16%	0.157	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	141.7	177.5	-69.2	-116.6	0	0	0	110.7	N307 V308 T309 G317 S318 A319 R369	N307-H315 PolarHBondContact OD1-CE1 3.33Å; N307-H315 VanDerWaalsContact OD1-CE1 3.31Å; N307-H315 PolarHBondContact OD1-ND1 2.91Å; V308-H315 CarbonylContact O-C 3.6Å; V308-H315 VanDerWaalsContact O-CA 3.27Å; V308-H315 WeakPolarHBondContact O-CA 3.03Å; T309-H315 WeakPolarHBondContact CG2-NE2 3.44Å; H315-G317 VanDerWaalsContact C-N 3.26Å; H315-G317 PolarHBondContact O-N 3Å; H315-S318 WeakPolarHBondContact O-CA 3.43Å; H315-S318 VanDerWaalsContact O-CB 3.25Å; H315-S318 WeakPolarHBondContact O-CB 3.36Å; H315-S318 PolarHBondContact O-N 3.36Å; H315-A319 PolarHBondContact O-N 3.03Å; H315-A319 VanDerWaalsContact O-N 3.09Å; H315-R369 PolarHBondContact CD2-NH1 2.88Å; H315-R369 PolarHBondContact NE2-NH1 2.87Å
316	L	83.2	Confident	78.1	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-54.9	-43	178.3	179.9	62.8	0	0	0	111.4	W195 L220 I237 L306 V308 V310 S318 A319 V320	W195-L316 HydrophobicContact CH2-CD1 4.4Å; W195-L316 HydrophobicContact CH2-CD2 4.24Å; L220-L316 HydrophobicContact CD2-CD2 4.12Å; I237-L316 HydrophobicContact CD1-CD1 3.7Å; I237-L316 HydrophobicContact CG1-CD1 3.84Å; L306-L316 HydrophobicContact CD2-CD2 3.85Å; L306-L316 HydrophobicContact CD2-CG 4.25Å; V308-L316 PolarHBondContact O-N 2.9Å; V310-L316 HydrophobicContact CG2-CB 4.04Å; L316-S318 PolarHBondContact O-N 3.29Å; L316-A319 PolarHBondContact O-N 3.38Å; L316-A319 VanDerWaalsContact O-N 3.16Å; L316-V320 WeakPolarHBondContact O-CG2 3.49Å; L316-V320 PolarHBondContact O-N 3.49Å
317	G	83.9	Confident	77.9	Confident	5 Å²	5	41.1 Å²	41.1	5%	0.052	26%	0.258	C	S	.	.	H	α-helix	trans	-57.4	-34.7	173.4	0	0	0	0	0	113.4	L306 H315 G321	L306-G317 PolarHBondContact O-N 3.24Å; H315-G317 VanDerWaalsContact C-N 3.26Å; H315-G317 PolarHBondContact O-N 3Å; G317-G321 PolarHBondContact O-N 3.11Å
318	S	82.5	Confident	77.9	Confident	25 Å²	25	36 Å²	36	18%	0.175	23%	0.23	C	C	.	.	H	α-helix	trans	-70.5	-40.8	175.7	-175.5	0	0	0	0	112.8	H315 L316 G321 N322 R369	H315-S318 WeakPolarHBondContact O-CA 3.43Å; H315-S318 VanDerWaalsContact O-CB 3.25Å; H315-S318 WeakPolarHBondContact O-CB 3.36Å; H315-S318 PolarHBondContact O-N 3.36Å; L316-S318 PolarHBondContact O-N 3.29Å; S318-G321 PolarHBondContact O-N 2.87Å; S318-N322 VanDerWaalsContact O-CG 3.28Å; S318-N322 PolarHBondContact O-N 3.45Å; S318-R369 VanDerWaalsContact CA-O 3.24Å; S318-R369 WeakPolarHBondContact CA-O 3.46Å
319	A	81	Confident	78	Confident	19 Å²	19	36 Å²	36	16%	0.157	23%	0.23	C	C	.	.	H	α-helix	trans	-67.9	-36.9	176.6	0	0	0	0	0	112.4	I237 H315 L316	I237-A319 HydrophobicContact CD1-CB 3.49Å; I237-A319 VanDerWaalsContact CD1-CB 3.49Å; I237-A319 HydrophobicContact CG2-CB 4.37Å; H315-A319 PolarHBondContact O-N 3.03Å; H315-A319 VanDerWaalsContact O-N 3.09Å; L316-A319 PolarHBondContact O-N 3.38Å; L316-A319 VanDerWaalsContact O-N 3.16Å
320	V	82.2	Confident	78.3	Confident	1 Å²	1	38 Å²	38	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-65.2	-45.4	170.9	175.8	0	0	0	0	110.7	I237 L240 L244 L306 L316 N322 L323 L324	I237-V320 HydrophobicContact CG2-CB 4.49Å; I237-V320 HydrophobicContact CG2-CG2 3.88Å; L240-V320 HydrophobicContact CD2-CG1 4.35Å; L240-V320 HydrophobicContact CD2-CG2 3.49Å; L240-V320 VanDerWaalsContact CD2-CG2 3.49Å; L244-V320 HydrophobicContact CD1-CG1 4.09Å; L306-V320 HydrophobicContact CD1-CG2 4.35Å; L316-V320 WeakPolarHBondContact O-CG2 3.49Å; L316-V320 PolarHBondContact O-N 3.49Å; V320-N322 VanDerWaalsContact C-N 3.28Å; V320-N322 PolarHBondContact O-N 3.34Å; V320-L323 PolarHBondContact O-N 3.35Å; V320-L324 WeakPolarHBondContact O-CB 3.35Å; V320-L324 PolarHBondContact O-N 2.73Å
321	G	82.4	Confident	78.7	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-56.1	-39.4	176.8	0	0	0	0	0	113.4	G317 S318 L323 L324 G325 F370	G317-G321 PolarHBondContact O-N 3.11Å; S318-G321 PolarHBondContact O-N 2.87Å; G321-L323 PolarHBondContact O-N 2.69Å; G321-L324 PolarHBondContact O-N 3.32Å; G321-G325 VanDerWaalsContact O-CA 3.28Å; G321-G325 WeakPolarHBondContact O-CA 3.29Å; G321-G325 PolarHBondContact O-N 2.87Å; G321-F370 CarbonylContact C-O 3.58Å; G321-F370 WeakPolarHBondContact CA-O 3.31Å
322	N	80.3	Confident	79.4	Confident	92 Å²	92	35.6 Å²	35.6	49%	0.492	21%	0.21	S	C	.	.	H	α-helix	trans	-64.2	-23	176.8	-71.7	-17.5	0	0	0	114.2	S318 V320	S318-N322 VanDerWaalsContact O-CG 3.28Å; S318-N322 PolarHBondContact O-N 3.45Å; V320-N322 VanDerWaalsContact C-N 3.28Å; V320-N322 PolarHBondContact O-N 3.34Å
323	L	80.3	Confident	80	Confident	88 Å²	88	30.9 Å²	30.9	46%	0.461	18%	0.184	S	C	.	.	H	α-helix	trans	-98.1	-25.3	177.5	-62.3	-176.1	0	0	0	113.3	I237 S241 V320 G321	I237-L323 HydrophobicContact CG2-CD1 3.84Å; S241-L323 WeakPolarHBondContact OG-CB 3.22Å; V320-L323 PolarHBondContact O-N 3.35Å; G321-L323 PolarHBondContact O-N 2.69Å
324	L	79.6	Confident	80.4	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-105.3	-27.1	-173.7	-167.3	109.9	0	0	0	113.3	S241 L244 C245 L249 F299 V320 G321 D326 S327 L328	S241-L324 WeakPolarHBondContact O-CD1 3.21Å; L244-L324 HydrophobicContact CB-CD1 3.63Å; C245-L324 HydrophobicContact CB-CD1 4.48Å; C245-L324 WeakPolarHBondContact SG-CD1 3.34Å; L249-L324 HydrophobicContact CD1-CG 4.43Å; F299-L324 HydrophobicContact CE1-CD2 3.93Å; F299-L324 HydrophobicContact CZ-CD2 3.8Å; V320-L324 WeakPolarHBondContact O-CB 3.35Å; V320-L324 PolarHBondContact O-N 2.73Å; G321-L324 PolarHBondContact O-N 3.32Å; L324-D326 PolarHBondContact O-N 3.43Å; L324-S327 PolarHBondContact O-N 2.86Å; L324-L328 HydrophobicContact CD2-CB 3.99Å; L324-L328 HydrophobicContact CD2-CD2 4.21Å; L324-L328 HydrophobicContact CG-CB 4.41Å; L324-L328 VanDerWaalsContact O-CB 3.32Å; L324-L328 WeakPolarHBondContact O-CB 3.36Å; L324-L328 PolarHBondContact O-N 2.84Å
325	G	80.5	Confident	80.3	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-57.6	-45.1	-162.5	0	0	0	0	0	114	G321 L328 M329 L371	G321-G325 VanDerWaalsContact O-CA 3.28Å; G321-G325 WeakPolarHBondContact O-CA 3.29Å; G321-G325 PolarHBondContact O-N 2.87Å; G325-L328 WeakPolarHBondContact O-CB 3.03Å; G325-L328 PolarHBondContact O-N 3.19Å; G325-M329 WeakPolarHBondContact O-CG 3.43Å; G325-M329 PolarHBondContact O-N 3.3Å; G325-L371 WeakPolarHBondContact O-CD2 3.37Å
326	D	78.7	Confident	79.9	Confident	68 Å²	68	26.8 Å²	26.8	36%	0.364	16%	0.156	S	C	.	.	H	α-helix	trans	-68.3	-45.6	178.5	-70.3	-28.5	0	0	0	111.6	L324 L328 M329 E330 S375	L324-D326 PolarHBondContact O-N 3.43Å; D326-L328 VanDerWaalsContact C-N 3.3Å; D326-L328 PolarHBondContact O-N 3.39Å; D326-M329 PolarHBondContact O-N 2.89Å; D326-E330 WeakPolarHBondContact O-CB 3.47Å; D326-E330 WeakPolarHBondContact O-CG 3.32Å; D326-E330 PolarHBondContact O-N 3.1Å; D326-S375 VanDerWaalsContact OD1-CB 3.29Å; D326-S375 WeakPolarHBondContact OD1-CB 3.29Å; D326-S375 PolarHBondContact OD1-OG 3.18Å
327	S	79.2	Confident	79.6	Confident	54 Å²	54	27 Å²	27	38%	0.378	16%	0.157	S	C	.	.	H	α-helix	trans	-62.8	-36.4	176.3	-57.3	0	0	0	0	112.6	L324 G331	L324-S327 PolarHBondContact O-N 2.86Å; S327-G331 PolarHBondContact O-N 2.93Å
328	L	79.7	Confident	79.3	Confident	1 Å²	1	31 Å²	31	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-61.7	-50.6	172.6	167.8	66.2	0	0	0	110.7	L249 V295 F299 L324 G325 D326 G331 I332 F365	L249-L328 HydrophobicContact CD1-CB 4.16Å; L249-L328 HydrophobicContact CD2-CB 4.38Å; L249-L328 HydrophobicContact CD2-CD1 3.4Å; L249-L328 HydrophobicContact CD2-CG 4.49Å; V295-L328 HydrophobicContact CG1-CD1 4.21Å; F299-L328 HydrophobicContact CD2-CD1 4.42Å; F299-L328 HydrophobicContact CD2-CD2 4.35Å; F299-L328 HydrophobicContact CE1-CD2 4.02Å; F299-L328 HydrophobicContact CE2-CD1 3.38Å; F299-L328 HydrophobicContact CE2-CD2 3.71Å; F299-L328 HydrophobicContact CE2-CG 4.22Å; F299-L328 HydrophobicContact CZ-CD1 3.63Å; F299-L328 HydrophobicContact CZ-CD2 3.53Å; F299-L328 HydrophobicContact CZ-CG 4.2Å; L324-L328 HydrophobicContact CD2-CB 3.99Å; L324-L328 HydrophobicContact CD2-CD2 4.21Å; L324-L328 HydrophobicContact CG-CB 4.41Å; L324-L328 VanDerWaalsContact O-CB 3.32Å; L324-L328 WeakPolarHBondContact O-CB 3.36Å; L324-L328 PolarHBondContact O-N 2.84Å; G325-L328 WeakPolarHBondContact O-CB 3.03Å; G325-L328 PolarHBondContact O-N 3.19Å; D326-L328 VanDerWaalsContact C-N 3.3Å; D326-L328 PolarHBondContact O-N 3.39Å; L328-G331 PolarHBondContact O-N 3.44Å; L328-I332 HydrophobicContact CD1-CD1 3.75Å; L328-I332 HydrophobicContact CD1-CG1 4.24Å; L328-I332 HydrophobicContact CG-CD1 3.92Å; L328-I332 WeakPolarHBondContact O-CG1 3.18Å; L328-I332 PolarHBondContact O-N 3.38Å; L328-F365 HydrophobicContact CD2-CD2 4.07Å; L328-F365 HydrophobicContact CD2-CE2 3.9Å; L328-F365 HydrophobicContact CG-CE2 4.43Å
329	M	82.9	Confident	79	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.02	18%	0.183	C	C	.	.	H	α-helix	trans	-64.8	-42.3	179.8	-73.9	-60.5	-65.9	0	0	112.2	G325 D326 G331 I332 I333 E362 L371 A377 L378	G325-M329 WeakPolarHBondContact O-CG 3.43Å; G325-M329 PolarHBondContact O-N 3.3Å; D326-M329 PolarHBondContact O-N 2.89Å; M329-G331 VanDerWaalsContact C-N 3.3Å; M329-G331 PolarHBondContact O-N 3.23Å; M329-I332 PolarHBondContact O-N 2.81Å; M329-I332 HydrophobicContact SD-CD1 4.19Å; M329-I333 WeakPolarHBondContact O-CB 3.34Å; M329-I333 WeakPolarHBondContact O-CD1 3.1Å; M329-I333 WeakPolarHBondContact O-CG1 3.49Å; M329-I333 PolarHBondContact O-N 2.66Å; M329-E362 HydrophobicContact CE-CB 4.38Å; M329-E362 HydrophobicContact CE-CG 4.22Å; M329-L371 HydrophobicContact CG-CD1 3.95Å; M329-L371 HydrophobicContact CG-CD2 3.36Å; M329-L371 HydrophobicContact CG-CG 4.28Å; M329-L371 HydrophobicContact SD-CD1 3.69Å; M329-L371 HydrophobicContact SD-CD2 4.19Å; M329-A377 HydrophobicContact CB-CB 3.72Å; M329-L378 HydrophobicContact CE-CB 4.01Å
330	E	81.3	Confident	78.6	Confident	111 Å²	111	33.5 Å²	33.5	52%	0.519	18%	0.183	S	C	.	.	H	α-helix	trans	-60.5	-40.2	173.5	-73.2	-177.6	167.2	0	0	111.8	D326 I333 A334	D326-E330 WeakPolarHBondContact O-CB 3.47Å; D326-E330 WeakPolarHBondContact O-CG 3.32Å; D326-E330 PolarHBondContact O-N 3.1Å; E330-I333 PolarHBondContact O-N 3.22Å; E330-A334 VanDerWaalsContact O-CB 3.32Å; E330-A334 WeakPolarHBondContact O-CB 3.38Å; E330-A334 PolarHBondContact O-N 3.29Å
331	G	78.1	Confident	78.2	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-60.7	-50.2	172.9	0	0	0	0	0	112.9	S327 L328 M329 I333 A334 I335	S327-G331 PolarHBondContact O-N 2.93Å; L328-G331 PolarHBondContact O-N 3.44Å; M329-G331 VanDerWaalsContact C-N 3.3Å; M329-G331 PolarHBondContact O-N 3.23Å; G331-I333 VanDerWaalsContact C-N 3.32Å; G331-I333 PolarHBondContact O-N 2.95Å; G331-A334 PolarHBondContact O-N 2.91Å; G331-I335 WeakPolarHBondContact O-CD1 3.26Å; G331-I335 WeakPolarHBondContact O-CG1 3.46Å; G331-I335 PolarHBondContact O-N 3.46Å
332	I	76.6	Confident	77.6	Confident	6 Å²	6	34.6 Å²	34.6	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-59.8	-44.2	177.5	-66.5	160.4	0	0	0	110.7	V295 L328 M329 A334 I335 C336 L361 F365	V295-I332 HydrophobicContact CG1-CD1 4.07Å; V295-I332 HydrophobicContact CG1-CG1 4.31Å; L328-I332 HydrophobicContact CD1-CD1 3.75Å; L328-I332 HydrophobicContact CD1-CG1 4.24Å; L328-I332 HydrophobicContact CG-CD1 3.92Å; L328-I332 WeakPolarHBondContact O-CG1 3.18Å; L328-I332 PolarHBondContact O-N 3.38Å; M329-I332 PolarHBondContact O-N 2.81Å; M329-I332 HydrophobicContact SD-CD1 4.19Å; I332-A334 PolarHBondContact O-N 3.41Å; I332-I335 PolarHBondContact O-N 2.87Å; I332-C336 HydrophobicContact CG2-CB 4.32Å; I332-C336 WeakPolarHBondContact O-CA 3.42Å; I332-C336 VanDerWaalsContact O-CB 3.26Å; I332-C336 WeakPolarHBondContact O-CB 3.39Å; I332-C336 PolarHBondContact O-N 3.48Å; I332-L361 HydrophobicContact CD1-CD2 3.96Å; I332-L361 HydrophobicContact CG2-CD2 4.12Å; I332-F365 HydrophobicContact CD1-CE2 3.79Å
333	I	80.1	Confident	77	Confident	20 Å²	20	34.8 Å²	34.8	10%	0.103	19%	0.186	C	C	.	.	I	π-helix	trans	-60	-46.8	177.5	-69.9	160.3	0	0	0	110.5	M329 E330 G331 I335 L337 K338 A377 L378 F381	M329-I333 WeakPolarHBondContact O-CB 3.34Å; M329-I333 WeakPolarHBondContact O-CD1 3.1Å; M329-I333 WeakPolarHBondContact O-CG1 3.49Å; M329-I333 PolarHBondContact O-N 2.66Å; E330-I333 PolarHBondContact O-N 3.22Å; G331-I333 VanDerWaalsContact C-N 3.32Å; G331-I333 PolarHBondContact O-N 2.95Å; I333-I335 VanDerWaalsContact C-N 3.33Å; I333-I335 PolarHBondContact O-N 3.42Å; I333-L337 HydrophobicContact CG1-CD1 4.11Å; I333-L337 PolarHBondContact O-N 3.07Å; I333-K338 WeakPolarHBondContact O-CB 3.37Å; I333-K338 PolarHBondContact O-N 3.22Å; I333-A377 HydrophobicContact CD1-CB 4.08Å; I333-A377 WeakPolarHBondContact CD1-O 3.17Å; I333-L378 HydrophobicContact CG1-CD1 4.49Å; I333-F381 HydrophobicContact CD1-CB 4.02Å; I333-F381 HydrophobicContact CG1-CB 4.4Å; I333-F381 HydrophobicContact CG2-CB 4.08Å; I333-F381 HydrophobicContact CG2-CD2 3.34Å; I333-F381 HydrophobicContact CG2-CE2 3.89Å; I333-F381 HydrophobicContact CG2-CG 3.75Å
334	A	79.6	Confident	76.2	Confident	48 Å²	48	36 Å²	36	40%	0.397	19%	0.19	S	C	.	.	I	π-helix	trans	-64.9	-32.8	-178.1	0	0	0	0	0	113.7	E330 G331 I332 P339	E330-A334 VanDerWaalsContact O-CB 3.32Å; E330-A334 WeakPolarHBondContact O-CB 3.38Å; E330-A334 PolarHBondContact O-N 3.29Å; G331-A334 PolarHBondContact O-N 2.91Å; I332-A334 PolarHBondContact O-N 3.41Å; A334-P339 VanDerWaalsContact O-CD 3.26Å; A334-P339 WeakPolarHBondContact O-CD 3.37Å; A334-P339 WeakPolarHBondContact O-CG 3.36Å
335	I	73.3	Confident	75.1	Confident	13 Å²	13	46.1 Å²	46.1	7%	0.067	23%	0.228	C	C	.	.	I	π-helix	trans	-94.2	-46.7	-174.5	-55	157.7	0	0	0	111.9	F252 R253 G331 I332 I333 P339	F252-I335 HydrophobicContact CD1-CD1 3.66Å; F252-I335 HydrophobicContact CE1-CD1 4.17Å; R253-I335 VanDerWaalsContact CA-CD1 3.47Å; R253-I335 HydrophobicContact CB-CD1 3.87Å; R253-I335 HydrophobicContact CB-CG1 3.83Å; R253-I335 HydrophobicContact CG-CD1 3.21Å; R253-I335 HydrophobicContact CG-CG1 3.36Å; G331-I335 WeakPolarHBondContact O-CD1 3.26Å; G331-I335 WeakPolarHBondContact O-CG1 3.46Å; G331-I335 PolarHBondContact O-N 3.46Å; I332-I335 PolarHBondContact O-N 2.87Å; I333-I335 VanDerWaalsContact C-N 3.33Å; I333-I335 PolarHBondContact O-N 3.42Å; I335-P339 WeakPolarHBondContact O-CG 3.15Å
336	C	73.6	Confident	73.9	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.014	27%	0.266	C	S	.	.	I	π-helix	trans	-96.9	-34.1	-167.4	-58.5	0	0	0	0	111.7	M288 I332 Y340	M288-C336 HydrophobicContact CG-CB 4.31Å; M288-C336 WeakPolarHBondContact CG-O 3.49Å; I332-C336 HydrophobicContact CG2-CB 4.32Å; I332-C336 WeakPolarHBondContact O-CA 3.42Å; I332-C336 VanDerWaalsContact O-CB 3.26Å; I332-C336 WeakPolarHBondContact O-CB 3.39Å; I332-C336 PolarHBondContact O-N 3.48Å; C336-Y340 VanDerWaalsContact O-CD2 3.31Å; C336-Y340 WeakPolarHBondContact O-CD2 3.39Å
337	L	76.1	Confident	73.2	Confident	5 Å²	5	55.1 Å²	55.1	3%	0.026	27%	0.27	C	S	.	.	I	π-helix	trans	-102.2	-55.5	-173.3	-70.1	177.8	0	0	0	113.3	I333 Y340 V341 Q354 C358 L378 F381	I333-L337 HydrophobicContact CG1-CD1 4.11Å; I333-L337 PolarHBondContact O-N 3.07Å; L337-Y340 PolarHBondContact O-N 3.38Å; L337-V341 PolarHBondContact O-N 3.3Å; L337-Q354 HydrophobicContact CD2-CB 4.32Å; L337-C358 HydrophobicContact CD1-CB 4.05Å; L337-C358 HydrophobicContact CD2-CB 4.45Å; L337-C358 WeakPolarHBondContact CD2-SG 3.2Å; L337-L378 HydrophobicContact CD1-CD1 3.71Å; L337-F381 HydrophobicContact CB-CE1 3.98Å; L337-F381 HydrophobicContact CB-CE2 4.33Å; L337-F381 HydrophobicContact CB-CZ 3.75Å; L337-F381 HydrophobicContact CD1-CD1 4.03Å; L337-F381 HydrophobicContact CD1-CE1 3.86Å; L337-F381 HydrophobicContact CD1-CZ 4.45Å; L337-F381 HydrophobicContact CG-CE1 4.43Å
338	K	78.3	Confident	72.3	Confident	90 Å²	90	54.8 Å²	54.8	39%	0.391	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-55.2	-42.7	-174.4	-167.3	173.5	-175.3	176.8	0	112.7	I333 Y340 I388 K392	I333-K338 WeakPolarHBondContact O-CB 3.37Å; I333-K338 PolarHBondContact O-N 3.22Å; K338-Y340 VanDerWaalsContact C-N 3.27Å; K338-Y340 PolarHBondContact O-N 3.27Å; K338-I388 HydrophobicContact CG-CG2 3.92Å; K338-K392 VanDerWaalsContact O-CE 3.25Å; K338-K392 WeakPolarHBondContact O-CE 3.36Å; K338-K392 PolarHBondContact O-NZ 3.48Å
339	P	75	Confident	71.9	Confident	59 Å²	59	60.1 Å²	60.1	38%	0.383	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-65.3	-24.9	179.4	-25.4	38.8	0	0	0	114.3	L283 A334 I335 K392	L283-P339 HydrophobicContact CD1-CB 4.4Å; A334-P339 VanDerWaalsContact O-CD 3.26Å; A334-P339 WeakPolarHBondContact O-CD 3.37Å; A334-P339 WeakPolarHBondContact O-CG 3.36Å; I335-P339 WeakPolarHBondContact O-CG 3.15Å; P339-K392 PolarHBondContact O-NZ 2.86Å
340	Y	72.8	Confident	71.3	Confident	36 Å²	36	62.8 Å²	62.8	14%	0.141	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-101.1	-4.6	-174.9	-71.7	-88.9	0	0	0	115.8	L283 N284 M288 C336 L337 K338 P342	L283-Y340 VanDerWaalsContact C-CZ 3.43Å; L283-Y340 WeakPolarHBondContact CA-OH 3.32Å; L283-Y340 HydrophobicContact CB-CE1 4.25Å; L283-Y340 HydrophobicContact CB-CE2 3.84Å; L283-Y340 VanDerWaalsContact CB-CZ 3.47Å; L283-Y340 WeakPolarHBondContact CB-OH 3.36Å; L283-Y340 HydrophobicContact CD1-CE2 4.47Å; L283-Y340 HydrophobicContact CD2-CE2 4.12Å; L283-Y340 VanDerWaalsContact CD2-OH 3.29Å; L283-Y340 WeakPolarHBondContact CD2-OH 3.33Å; L283-Y340 HydrophobicContact CG-CE2 4.36Å; L283-Y340 WeakPolarHBondContact O-CE1 3.29Å; L283-Y340 PolarHBondContact O-OH 3.35Å; N284-Y340 VanDerWaalsContact C-OH 3.25Å; N284-Y340 PolarHBondContact N-OH 2.85Å; N284-Y340 PolarHBondContact O-OH 3.19Å; M288-Y340 HydrophobicContact CB-CD2 4.43Å; M288-Y340 HydrophobicContact CB-CE2 3.84Å; M288-Y340 HydrophobicContact CG-CD2 4.22Å; M288-Y340 HydrophobicContact CG-CE2 4.02Å; C336-Y340 VanDerWaalsContact O-CD2 3.31Å; C336-Y340 WeakPolarHBondContact O-CD2 3.39Å; L337-Y340 PolarHBondContact O-N 3.38Å; K338-Y340 VanDerWaalsContact C-N 3.27Å; K338-Y340 PolarHBondContact O-N 3.27Å; Y340-P342 WeakPolarHBondContact O-CD 3.29Å
341	V	74.7	Confident	70.8	Confident	6 Å²	6	58.6 Å²	58.6	4%	0.036	29%	0.289	C	S	.	.			trans	-44.2	108.7	172	173.4	0	0	0	0	109.2	L337 F381 Y385 I388 L389 K392	L337-V341 PolarHBondContact O-N 3.3Å; V341-F381 HydrophobicContact CG2-CE2 4.46Å; V341-F381 HydrophobicContact CG2-CZ 4.06Å; V341-Y385 HydrophobicContact CB-CE2 4.35Å; V341-Y385 HydrophobicContact CG1-CE2 3.77Å; V341-Y385 HydrophobicContact CG2-CD2 4.5Å; V341-Y385 HydrophobicContact CG2-CE2 3.97Å; V341-I388 HydrophobicContact CB-CG2 4.49Å; V341-I388 HydrophobicContact CG1-CG2 4.46Å; V341-I388 HydrophobicContact CG2-CG2 4Å; V341-L389 HydrophobicContact CG1-CB 3.99Å; V341-L389 HydrophobicContact CG1-CD1 3.93Å; V341-K392 HydrophobicContact CB-CD 4.17Å; V341-K392 HydrophobicContact CG1-CD 4.47Å; V341-K392 PolarHBondContact O-NZ 3.03Å
342	P	69.4	Low	70.6	Confident	19 Å²	19	63.8 Å²	63.8	12%	0.123	31%	0.313	C	S	.	.			trans	-80.4	137	-169.2	28	-32.9	0	0	0	111.4	Y340 E344 K347 M351 Y385 L389	Y340-P342 WeakPolarHBondContact O-CD 3.29Å; P342-E344 VanDerWaalsContact C-N 3.32Å; P342-E344 PolarHBondContact O-N 2.88Å; P342-K347 HydrophobicContact CB-CB 3.75Å; P342-K347 HydrophobicContact CB-CD 4.42Å; P342-K347 HydrophobicContact CG-CB 4.22Å; P342-M351 HydrophobicContact CG-CB 4Å; P342-Y385 WeakPolarHBondContact CD-OH 3.46Å; P342-L389 WeakPolarHBondContact O-CD1 3.26Å
343	F	66.4	Low	70.5	Confident	97 Å²	97	69.5 Å²	69.5	43%	0.425	34%	0.337	S	S	.	.	S	Bend	trans	-64.7	-34.9	174.2	-71.8	-65.5	0	0	0	113.6	K392 E393 T396	F343-K392 VanDerWaalsContact CE1-C 3.41Å; F343-K392 HydrophobicContact CE1-CB 3.59Å; F343-K392 WeakPolarHBondContact CE1-O 3.44Å; F343-K392 HydrophobicContact CZ-CB 3.75Å; F343-E393 HydrophobicContact CD1-CG 3.58Å; F343-E393 HydrophobicContact CE1-CB 4.38Å; F343-E393 HydrophobicContact CE1-CG 3.89Å; F343-T396 WeakPolarHBondContact CZ-OG1 3.2Å
344	E	63.4	Low	70.2	Confident	113 Å²	113	69 Å²	69	53%	0.528	33%	0.334	S	S	.	.	S	Bend	trans	-96.2	122.9	-173.5	-69.1	173.9	171.4	0	0	110.1	P342 N346 K347	P342-E344 VanDerWaalsContact C-N 3.32Å; P342-E344 PolarHBondContact O-N 2.88Å; E344-N346 PolarHBondContact O-N 2.87Å; E344-K347 HydrophobicContact CB-CG 4.44Å; E344-K347 WeakPolarHBondContact O-CB 3.43Å; E344-K347 PolarHBondContact O-N 3.04Å
345	R	57.8	Low	70	Confident	215 Å²	215	67.2 Å²	67.2	81%	0.811	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-56.1	-22.4	171.9	-72.6	-174.9	178.8	-174.8	-1.9	112.9	K347 T348	R345-K347 PolarHBondContact O-N 2.92Å; R345-T348 WeakPolarHBondContact CA-OG1 3.43Å; R345-T348 WeakPolarHBondContact O-CB 3.26Å; R345-T348 PolarHBondContact O-N 3.41Å; R345-T348 PolarHBondContact O-OG1 3.38Å
346	N	55.5	Low	70.3	Confident	154 Å²	154	70.1 Å²	70.1	82%	0.824	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-68	-20.7	176.4	-60	-3.5	0	0	0	111.9	E344 T348	E344-N346 PolarHBondContact O-N 2.87Å; N346-T348 VanDerWaalsContact C-N 3.35Å
347	K	62.3	Low	70.4	Confident	103 Å²	103	71.7 Å²	71.7	45%	0.448	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-91.5	9.2	172.1	-62.4	-176.5	-177.5	-180	0	113	P342 E344 R345 L349 I350 M351	P342-K347 HydrophobicContact CB-CB 3.75Å; P342-K347 HydrophobicContact CB-CD 4.42Å; P342-K347 HydrophobicContact CG-CB 4.22Å; E344-K347 HydrophobicContact CB-CG 4.44Å; E344-K347 WeakPolarHBondContact O-CB 3.43Å; E344-K347 PolarHBondContact O-N 3.04Å; R345-K347 PolarHBondContact O-N 2.92Å; K347-L349 PolarHBondContact O-N 2.85Å; K347-L349 VanDerWaalsContact O-N 3.14Å; K347-I350 HydrophobicContact CB-CD1 4.17Å; K347-I350 HydrophobicContact CD-CD1 4.43Å; K347-I350 HydrophobicContact CG-CD1 4.18Å; K347-I350 WeakPolarHBondContact O-CB 3.5Å; K347-I350 PolarHBondContact O-N 3.43Å; K347-M351 PolarHBondContact O-N 2.96Å
348	T	62	Low	70.4	Confident	48 Å²	48	71.8 Å²	71.8	29%	0.294	34%	0.344	S	S	.	.	H	α-helix	trans	-54.1	-34.2	175.2	-57.3	0	0	0	0	111.3	R345 N346 I350 M351 E352	R345-T348 WeakPolarHBondContact CA-OG1 3.43Å; R345-T348 WeakPolarHBondContact O-CB 3.26Å; R345-T348 PolarHBondContact O-N 3.41Å; R345-T348 PolarHBondContact O-OG1 3.38Å; N346-T348 VanDerWaalsContact C-N 3.35Å; T348-I350 VanDerWaalsContact C-N 3.3Å; T348-I350 PolarHBondContact O-N 3.2Å; T348-M351 HydrophobicContact CG2-CE 3.92Å; T348-M351 WeakPolarHBondContact O-CB 3.26Å; T348-M351 PolarHBondContact O-N 3.14Å; T348-E352 HydrophobicContact CG2-CG 4.29Å; T348-E352 WeakPolarHBondContact O-CG 3.09Å; T348-E352 PolarHBondContact O-N 3.41Å
349	L	70.3	Confident	70.5	Confident	112 Å²	112	71.7 Å²	71.7	59%	0.586	34%	0.341	S	S	*	.	H	α-helix	trans	-62.7	-35.5	177.3	-149.4	96.1	0	0	0	112.9	K347 K353	K347-L349 PolarHBondContact O-N 2.85Å; K347-L349 VanDerWaalsContact O-N 3.14Å; L349-K353 WeakPolarHBondContact O-CG 3.4Å; L349-K353 PolarHBondContact O-N 3.43Å
350	I	70.3	Confident	70.8	Confident	60 Å²	60	74 Å²	74	31%	0.308	35%	0.347	S	S	.	.	H	α-helix	trans	-67	-48	175.7	-59.6	174.6	0	0	0	108.4	K347 T348 E352 K353 Q354	K347-I350 HydrophobicContact CB-CD1 4.17Å; K347-I350 HydrophobicContact CD-CD1 4.43Å; K347-I350 HydrophobicContact CG-CD1 4.18Å; K347-I350 WeakPolarHBondContact O-CB 3.5Å; K347-I350 PolarHBondContact O-N 3.43Å; T348-I350 VanDerWaalsContact C-N 3.3Å; T348-I350 PolarHBondContact O-N 3.2Å; I350-E352 PolarHBondContact O-N 3.07Å; I350-K353 WeakPolarHBondContact O-CB 3.49Å; I350-K353 PolarHBondContact O-N 2.73Å; I350-Q354 HydrophobicContact CG2-CG 4.44Å; I350-Q354 VanDerWaalsContact O-CG 3.26Å; I350-Q354 WeakPolarHBondContact O-CG 3.39Å; I350-Q354 PolarHBondContact O-N 2.82Å
351	M	70.8	Confident	71.2	Confident	24 Å²	24	72.4 Å²	72.4	12%	0.118	34%	0.34	C	S	.	.	H	α-helix	trans	-59.2	-43	176.5	-179.3	-155.6	77.7	0	0	112.7	P342 K347 T348 K353 Q354 L355 Y385	P342-M351 HydrophobicContact CG-CB 4Å; K347-M351 PolarHBondContact O-N 2.96Å; T348-M351 HydrophobicContact CG2-CE 3.92Å; T348-M351 WeakPolarHBondContact O-CB 3.26Å; T348-M351 PolarHBondContact O-N 3.14Å; M351-K353 VanDerWaalsContact C-N 3.31Å; M351-K353 PolarHBondContact O-N 3Å; M351-Q354 WeakPolarHBondContact O-CB 3.31Å; M351-Q354 PolarHBondContact O-N 3.5Å; M351-Q354 VanDerWaalsContact O-N 3.14Å; M351-L355 HydrophobicContact CE-CD1 3.83Å; M351-L355 HydrophobicContact CG-CD1 4.05Å; M351-L355 HydrophobicContact CG-CG 4.29Å; M351-L355 WeakPolarHBondContact O-CB 3.4Å; M351-L355 WeakPolarHBondContact O-CG 3.07Å; M351-L355 PolarHBondContact O-N 2.92Å; M351-L355 HydrophobicContact SD-CD1 4.28Å; M351-Y385 HydrophobicContact CG-CE2 4.01Å; M351-Y385 HydrophobicContact SD-CD1 4.46Å; M351-Y385 HydrophobicContact SD-CD2 4.12Å; M351-Y385 HydrophobicContact SD-CE1 3.68Å; M351-Y385 HydrophobicContact SD-CE2 3.24Å; M351-Y385 WeakPolarHBondContact SD-CE2 3.24Å; M351-Y385 PolarHBondContact SD-OH 2.92Å
352	E	73.3	Confident	71.5	Confident	109 Å²	109	73.7 Å²	73.7	51%	0.509	35%	0.346	S	S	.	.	H	α-helix	trans	-60	-41.8	177.5	-77.8	178.2	172.6	0	0	111.7	T348 I350 L355 E356	T348-E352 HydrophobicContact CG2-CG 4.29Å; T348-E352 WeakPolarHBondContact O-CG 3.09Å; T348-E352 PolarHBondContact O-N 3.41Å; I350-E352 PolarHBondContact O-N 3.07Å; E352-L355 PolarHBondContact O-N 3.46Å; E352-E356 PolarHBondContact O-N 2.89Å
353	K	76	Confident	72.2	Confident	126 Å²	126	78.6 Å²	78.6	55%	0.548	36%	0.362	S	S	.	.	H	α-helix	trans	-61.3	-45.4	172.7	-72.2	178.7	177.8	-176	0	111.7	L349 I350 M351 L355 E356 S357	L349-K353 WeakPolarHBondContact O-CG 3.4Å; L349-K353 PolarHBondContact O-N 3.43Å; I350-K353 WeakPolarHBondContact O-CB 3.49Å; I350-K353 PolarHBondContact O-N 2.73Å; M351-K353 VanDerWaalsContact C-N 3.31Å; M351-K353 PolarHBondContact O-N 3Å; K353-L355 PolarHBondContact O-N 3.26Å; K353-E356 PolarHBondContact O-N 3.3Å; K353-S357 PolarHBondContact O-N 3.35Å; K353-S357 PolarHBondContact O-OG 2.7Å
354	Q	72.8	Confident	73	Confident	9 Å²	9	75.4 Å²	75.4	4%	0.042	35%	0.349	C	S	.	.	H	α-helix	trans	-62.5	-42.2	178.9	-65.5	178	-28.5	0	0	112.2	M288 L337 I350 M351 E356 S357 C358	M288-Q354 HydrophobicContact CE-CB 4.29Å; M288-Q354 HydrophobicContact CE-CG 3.67Å; M288-Q354 HydrophobicContact SD-CB 4.08Å; M288-Q354 VanDerWaalsContact SD-CD 3.54Å; M288-Q354 HydrophobicContact SD-CG 3.52Å; M288-Q354 VanDerWaalsContact SD-CG 3.52Å; M288-Q354 PolarHBondContact SD-NE2 2.81Å; L337-Q354 HydrophobicContact CD2-CB 4.32Å; I350-Q354 HydrophobicContact CG2-CG 4.44Å; I350-Q354 VanDerWaalsContact O-CG 3.26Å; I350-Q354 WeakPolarHBondContact O-CG 3.39Å; I350-Q354 PolarHBondContact O-N 2.82Å; M351-Q354 WeakPolarHBondContact O-CB 3.31Å; M351-Q354 PolarHBondContact O-N 3.5Å; M351-Q354 VanDerWaalsContact O-N 3.14Å; Q354-E356 VanDerWaalsContact C-N 3.35Å; Q354-S357 PolarHBondContact O-N 3.07Å; Q354-C358 PolarHBondContact O-N 2.7Å; Q354-C358 PolarHBondContact O-SG 3.38Å; Q354-C358 VanDerWaalsContact O-SG 3.35Å
355	L	75.5	Confident	74	Confident	11 Å²	11	70 Å²	70	6%	0.058	32%	0.324	C	S	.	.	H	α-helix	trans	-63.9	-40.1	175.5	-74.7	175	0	0	0	111.4	M351 E352 K353 C358 R359 F381 L382	M351-L355 HydrophobicContact CE-CD1 3.83Å; M351-L355 HydrophobicContact CG-CD1 4.05Å; M351-L355 HydrophobicContact CG-CG 4.29Å; M351-L355 WeakPolarHBondContact O-CB 3.4Å; M351-L355 WeakPolarHBondContact O-CG 3.07Å; M351-L355 PolarHBondContact O-N 2.92Å; M351-L355 HydrophobicContact SD-CD1 4.28Å; E352-L355 PolarHBondContact O-N 3.46Å; K353-L355 PolarHBondContact O-N 3.26Å; L355-C358 PolarHBondContact O-N 2.84Å; L355-R359 WeakPolarHBondContact O-CG 3.33Å; L355-R359 PolarHBondContact O-N 3.47Å; L355-F381 HydrophobicContact CD2-CD1 4.46Å; L355-F381 HydrophobicContact CD2-CE1 4.06Å; L355-L382 HydrophobicContact CD1-CD2 3.67Å; L355-L382 HydrophobicContact CD2-CD2 3.49Å; L355-L382 VanDerWaalsContact CD2-CD2 3.49Å; L355-L382 HydrophobicContact CD2-CG 4.43Å; L355-L382 HydrophobicContact CG-CD2 4.18Å
356	E	79.3	Confident	75.2	Confident	74 Å²	74	63.7 Å²	63.7	35%	0.346	30%	0.3	S	S	.	.	H	α-helix	trans	-67.8	-41	177.3	-164.1	56	-142	0	0	111.9	E352 K353 Q354 C358 R359 E360 R363	E352-E356 PolarHBondContact O-N 2.89Å; K353-E356 PolarHBondContact O-N 3.3Å; Q354-E356 VanDerWaalsContact C-N 3.35Å; E356-C358 VanDerWaalsContact C-N 3.27Å; E356-C358 PolarHBondContact O-N 3.4Å; E356-R359 PolarHBondContact O-N 2.81Å; E356-R359 WeakPolarHBondContact OE2-CD 3.1Å; E356-R359 IonicContact OE2-CZ 4Å; E356-R359 IonicContact OE2-NH1 3.7Å; E356-R359 PolarHBondContact OE2-NH1 3.19Å; E356-E360 PolarHBondContact O-N 2.83Å; E356-R363 IonicContact OE1-CZ 2.69Å; E356-R363 IonicContact OE1-NH1 2.73Å; E356-R363 PolarHBondContact OE1-NH1 2.85Å; E356-R363 IonicContact OE1-NH2 2.95Å; E356-R363 PolarHBondContact OE1-NH2 2.9Å
357	S	75.9	Confident	76.5	Confident	36 Å²	36	62.4 Å²	62.4	25%	0.252	29%	0.294	S	S	.	.	H	α-helix	trans	-59	-38.8	172	-61.9	0	0	0	0	112.2	K353 Q354 E360 L361	K353-S357 PolarHBondContact O-N 3.35Å; K353-S357 PolarHBondContact O-OG 2.7Å; Q354-S357 PolarHBondContact O-N 3.07Å; S357-E360 PolarHBondContact O-N 2.95Å; S357-L361 WeakPolarHBondContact O-CB 3.26Å; S357-L361 PolarHBondContact O-N 3.35Å
358	C	76.5	Confident	77.2	Confident	7 Å²	7	61 Å²	61	5%	0.047	29%	0.285	C	S	.	.	H	α-helix	trans	-71.5	-35.2	176.6	-70.2	0	0	0	0	112.9	L337 Q354 L355 E356 E360 L361 E362 L378	L337-C358 HydrophobicContact CD1-CB 4.05Å; L337-C358 HydrophobicContact CD2-CB 4.45Å; L337-C358 WeakPolarHBondContact CD2-SG 3.2Å; Q354-C358 PolarHBondContact O-N 2.7Å; Q354-C358 PolarHBondContact O-SG 3.38Å; Q354-C358 VanDerWaalsContact O-SG 3.35Å; L355-C358 PolarHBondContact O-N 2.84Å; E356-C358 VanDerWaalsContact C-N 3.27Å; E356-C358 PolarHBondContact O-N 3.4Å; C358-E360 VanDerWaalsContact C-N 3.34Å; C358-L361 PolarHBondContact O-N 3.42Å; C358-E362 WeakPolarHBondContact O-CB 3.42Å; C358-E362 PolarHBondContact O-N 3.18Å; C358-L378 HydrophobicContact CB-CD1 4.07Å; C358-L378 HydrophobicContact CB-CD2 4.34Å
359	R	80	Confident	77.8	Confident	88 Å²	88	64.9 Å²	64.9	33%	0.332	30%	0.295	S	S	.	.	H	α-helix	trans	-65.8	-38.4	171.3	-71.3	172.8	-169.6	147.9	1.6	111.5	L355 E356 E362 R363 L378	L355-R359 WeakPolarHBondContact O-CG 3.33Å; L355-R359 PolarHBondContact O-N 3.47Å; E356-R359 PolarHBondContact O-N 2.81Å; E356-R359 WeakPolarHBondContact OE2-CD 3.1Å; E356-R359 IonicContact OE2-CZ 4Å; E356-R359 IonicContact OE2-NH1 3.7Å; E356-R359 PolarHBondContact OE2-NH1 3.19Å; R359-E362 PolarHBondContact O-N 2.9Å; R359-R363 WeakPolarHBondContact O-CB 3.31Å; R359-R363 VanDerWaalsContact O-CG 3.26Å; R359-R363 WeakPolarHBondContact O-CG 3.31Å; R359-R363 PolarHBondContact O-N 3.3Å; R359-L378 HydrophobicContact CG-CD2 3.89Å
360	E	82.7	Confident	78.3	Confident	107 Å²	107	59.7 Å²	59.7	50%	0.5	27%	0.267	S	S	.	.	H	α-helix	trans	-63.5	-45.7	174.1	-172.2	176.8	-178.5	0	0	111.2	E356 S357 C358 E362 R363 N364	E356-E360 PolarHBondContact O-N 2.83Å; S357-E360 PolarHBondContact O-N 2.95Å; C358-E360 VanDerWaalsContact C-N 3.34Å; E360-E362 VanDerWaalsContact C-N 3.32Å; E360-E362 PolarHBondContact O-N 3.35Å; E360-R363 PolarHBondContact O-N 3Å; E360-N364 WeakPolarHBondContact O-CB 3.25Å; E360-N364 VanDerWaalsContact O-CG 3.24Å; E360-N364 PolarHBondContact O-N 3.3Å; E360-N364 PolarHBondContact O-ND2 3.14Å
361	L	79.9	Confident	78.7	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-57.8	-44.2	173.4	-172.7	66.7	0	0	0	111.7	Q296 I332 S357 C358 N364 F365	Q296-L361 HydrophobicContact CB-CD1 3.67Å; Q296-L361 HydrophobicContact CG-CD1 4.08Å; I332-L361 HydrophobicContact CD1-CD2 3.96Å; I332-L361 HydrophobicContact CG2-CD2 4.12Å; S357-L361 WeakPolarHBondContact O-CB 3.26Å; S357-L361 PolarHBondContact O-N 3.35Å; C358-L361 PolarHBondContact O-N 3.42Å; L361-N364 WeakPolarHBondContact O-CB 3.47Å; L361-N364 PolarHBondContact O-N 3.01Å; L361-F365 HydrophobicContact CD1-CE1 3.85Å; L361-F365 HydrophobicContact CD1-CE2 3.99Å; L361-F365 HydrophobicContact CD1-CZ 3.52Å; L361-F365 HydrophobicContact CD2-CE2 4.15Å; L361-F365 HydrophobicContact CD2-CZ 4.35Å; L361-F365 HydrophobicContact CG-CD2 4.31Å; L361-F365 HydrophobicContact CG-CE1 4.47Å; L361-F365 HydrophobicContact CG-CE2 3.79Å; L361-F365 HydrophobicContact CG-CZ 3.87Å; L361-F365 WeakPolarHBondContact O-CG 3.35Å; L361-F365 PolarHBondContact O-N 2.98Å
362	E	81.1	Confident	78.7	Confident	33 Å²	33	57.7 Å²	57.7	15%	0.154	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-48.4	176.8	-167.2	-165	146.4	0	0	111.7	M329 C358 R359 E360 N364 F365 R366 L371 L378	M329-E362 HydrophobicContact CE-CB 4.38Å; M329-E362 HydrophobicContact CE-CG 4.22Å; C358-E362 WeakPolarHBondContact O-CB 3.42Å; C358-E362 PolarHBondContact O-N 3.18Å; R359-E362 PolarHBondContact O-N 2.9Å; E360-E362 VanDerWaalsContact C-N 3.32Å; E360-E362 PolarHBondContact O-N 3.35Å; E362-N364 VanDerWaalsContact C-N 3.26Å; E362-N364 PolarHBondContact O-N 3.3Å; E362-F365 PolarHBondContact O-N 2.97Å; E362-R366 WeakPolarHBondContact O-CG 3.44Å; E362-R366 PolarHBondContact O-N 2.96Å; E362-R366 IonicContact OE1-CZ 2.76Å; E362-R366 IonicContact OE1-NE 3.41Å; E362-R366 PolarHBondContact OE1-NE 3.3Å; E362-R366 IonicContact OE1-NH2 2.84Å; E362-R366 PolarHBondContact OE1-NH2 3.47Å; E362-L371 HydrophobicContact CB-CD1 4.47Å; E362-L371 HydrophobicContact CG-CD1 3.79Å; E362-L378 WeakPolarHBondContact OE2-CD2 3.42Å
363	R	84.1	Confident	78.4	Confident	122 Å²	122	56.8 Å²	56.8	46%	0.46	27%	0.269	S	S	.	.	H	α-helix	trans	-57.2	-42.7	174.6	-71.6	174.1	-159.8	124	-0.9	110.8	E356 R359 E360 R366 N367	E356-R363 IonicContact OE1-CZ 2.69Å; E356-R363 IonicContact OE1-NH1 2.73Å; E356-R363 PolarHBondContact OE1-NH1 2.85Å; E356-R363 IonicContact OE1-NH2 2.95Å; E356-R363 PolarHBondContact OE1-NH2 2.9Å; R359-R363 WeakPolarHBondContact O-CB 3.31Å; R359-R363 VanDerWaalsContact O-CG 3.26Å; R359-R363 WeakPolarHBondContact O-CG 3.31Å; R359-R363 PolarHBondContact O-N 3.3Å; E360-R363 PolarHBondContact O-N 3Å; R363-R366 PolarHBondContact O-N 3.48Å; R363-N367 WeakPolarHBondContact O-CB 3.46Å; R363-N367 PolarHBondContact O-N 2.71Å; R363-N367 PolarHBondContact O-ND2 3.1Å
364	N	83.1	Confident	78.1	Confident	30 Å²	30	58.7 Å²	58.7	16%	0.16	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-41.3	178.3	-84.5	-21.1	0	0	0	112.5	Q296 E360 L361 E362 R368	Q296-N364 PolarHBondContact NE2-ND2 3.49Å; E360-N364 WeakPolarHBondContact O-CB 3.25Å; E360-N364 VanDerWaalsContact O-CG 3.24Å; E360-N364 PolarHBondContact O-N 3.3Å; E360-N364 PolarHBondContact O-ND2 3.14Å; L361-N364 WeakPolarHBondContact O-CB 3.47Å; L361-N364 PolarHBondContact O-N 3.01Å; E362-N364 VanDerWaalsContact C-N 3.26Å; E362-N364 PolarHBondContact O-N 3.3Å; N364-R368 VanDerWaalsContact CB-NH1 3.27Å; N364-R368 WeakPolarHBondContact O-CG 3.09Å; N364-R368 PolarHBondContact O-N 2.91Å; N364-R368 PolarHBondContact O-NH1 3.28Å
365	F	84.5	Confident	78	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-73.4	-35.2	175.2	-70.7	-12	0	0	0	112.9	V295 F299 L328 I332 L361 E362 R368 R369 F370 L371	V295-F365 HydrophobicContact CG1-CE2 4.43Å; V295-F365 HydrophobicContact CG1-CZ 3.94Å; F299-F365 HydrophobicContact CB-CD1 4.3Å; F299-F365 HydrophobicContact CB-CE1 3.65Å; F299-F365 HydrophobicContact CB-CZ 4.25Å; F299-F365 HydrophobicContact CD2-CE1 4.02Å; F299-F365 HydrophobicContact CD2-CE2 4.48Å; F299-F365 AromaticContact CD2-CZ 3.74Å; F299-F365 HydrophobicContact CD2-CZ 3.74Å; F299-F365 HydrophobicContact CE2-CZ 4.5Å; F299-F365 HydrophobicContact CG-CE1 4.01Å; F299-F365 HydrophobicContact CG-CZ 4.19Å; L328-F365 HydrophobicContact CD2-CD2 4.07Å; L328-F365 HydrophobicContact CD2-CE2 3.9Å; L328-F365 HydrophobicContact CG-CE2 4.43Å; I332-F365 HydrophobicContact CD1-CE2 3.79Å; L361-F365 HydrophobicContact CD1-CE1 3.85Å; L361-F365 HydrophobicContact CD1-CE2 3.99Å; L361-F365 HydrophobicContact CD1-CZ 3.52Å; L361-F365 HydrophobicContact CD2-CE2 4.15Å; L361-F365 HydrophobicContact CD2-CZ 4.35Å; L361-F365 HydrophobicContact CG-CD2 4.31Å; L361-F365 HydrophobicContact CG-CE1 4.47Å; L361-F365 HydrophobicContact CG-CE2 3.79Å; L361-F365 HydrophobicContact CG-CZ 3.87Å; L361-F365 WeakPolarHBondContact O-CG 3.35Å; L361-F365 PolarHBondContact O-N 2.98Å; E362-F365 PolarHBondContact O-N 2.97Å; F365-R368 CarbonylContact O-C 3.45Å; F365-R368 PolarHBondContact O-N 3.24Å; F365-R369 PolarHBondContact O-N 3.06Å; F365-F370 HydrophobicContact CB-CB 4.4Å; F365-F370 PolarHBondContact O-N 2.82Å; F365-L371 HydrophobicContact CB-CB 4.24Å; F365-L371 HydrophobicContact CB-CD1 3.47Å; F365-L371 VanDerWaalsContact CB-CD1 3.47Å; F365-L371 HydrophobicContact CB-CG 3.72Å; F365-L371 HydrophobicContact CD2-CD1 3.95Å; F365-L371 HydrophobicContact CD2-CG 4.37Å; F365-L371 HydrophobicContact CG-CD1 4.24Å; F365-L371 PolarHBondContact O-N 3.45Å
366	R	83.1	Confident	78.3	Confident	82 Å²	82	64.9 Å²	64.9	31%	0.309	30%	0.304	S	S	.	.	H	α-helix	trans	-63.4	-45	171.4	-72.3	178.3	-175.2	-93.6	2.1	111.6	E362 R363 R368 R369 L371 N372 A373 S375	E362-R366 WeakPolarHBondContact O-CG 3.44Å; E362-R366 PolarHBondContact O-N 2.96Å; E362-R366 IonicContact OE1-CZ 2.76Å; E362-R366 IonicContact OE1-NE 3.41Å; E362-R366 PolarHBondContact OE1-NE 3.3Å; E362-R366 IonicContact OE1-NH2 2.84Å; E362-R366 PolarHBondContact OE1-NH2 3.47Å; R363-R366 PolarHBondContact O-N 3.48Å; R366-R368 PolarHBondContact O-N 2.95Å; R366-R369 WeakPolarHBondContact O-CA 3.43Å; R366-R369 PolarHBondContact O-N 3.32Å; R366-L371 HydrophobicContact CG-CB 3.96Å; R366-N372 PolarHBondContact NH1-O 3.4Å; R366-A373 VanDerWaalsContact NH1-C 3.3Å; R366-A373 PolarHBondContact NH1-O 3.18Å; R366-S375 PolarHBondContact NH2-O 3.26Å
367	N	82.3	Confident	78.4	Confident	128 Å²	128	62 Å²	62	68%	0.684	29%	0.293	S	S	*	.	H	α-helix	trans	-60.8	-35.3	177.2	-72.2	-17.3	0	0	0	112.2	R363 R369	R363-N367 WeakPolarHBondContact O-CB 3.46Å; R363-N367 PolarHBondContact O-N 2.71Å; R363-N367 PolarHBondContact O-ND2 3.1Å; N367-R369 VanDerWaalsContact C-N 3.27Å
368	R	77.4	Confident	78.6	Confident	73 Å²	73	60.5 Å²	60.5	28%	0.275	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	2.9	174.9	-65.2	-177.8	-172.8	86.6	-12.3	113.7	D300 N364 F365 R366 F370	D300-R368 VanDerWaalsContact CG-CZ 3.49Å; D300-R368 IonicContact OD1-CZ 2.7Å; D300-R368 IonicContact OD1-NE 2.67Å; D300-R368 PolarHBondContact OD1-NE 2.74Å; D300-R368 IonicContact OD1-NH1 3.55Å; D300-R368 PolarHBondContact OD1-NH1 3.29Å; D300-R368 IonicContact OD1-NH2 2.68Å; D300-R368 PolarHBondContact OD1-NH2 2.74Å; D300-R368 IonicContact OD2-CZ 2.75Å; D300-R368 IonicContact OD2-NH2 3.98Å; D300-R368 PolarHBondContact OD2-NH2 3.31Å; N364-R368 VanDerWaalsContact CB-NH1 3.27Å; N364-R368 WeakPolarHBondContact O-CG 3.09Å; N364-R368 PolarHBondContact O-N 2.91Å; N364-R368 PolarHBondContact O-NH1 3.28Å; F365-R368 CarbonylContact O-C 3.45Å; F365-R368 PolarHBondContact O-N 3.24Å; R366-R368 PolarHBondContact O-N 2.95Å; R368-F370 HydrophobicContact CB-CD2 3.85Å; R368-F370 HydrophobicContact CB-CE2 4.41Å; R368-F370 PolarHBondContact O-N 2.75Å
369	R	75.3	Confident	78.7	Confident	129 Å²	129	66.3 Å²	66.3	49%	0.487	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	16.2	179.8	-48.1	-179.5	-173.5	170.7	6.4	114.5	H315 S318 F365 R366 N367	H315-R369 PolarHBondContact CD2-NH1 2.88Å; H315-R369 PolarHBondContact NE2-NH1 2.87Å; S318-R369 VanDerWaalsContact CA-O 3.24Å; S318-R369 WeakPolarHBondContact CA-O 3.46Å; F365-R369 PolarHBondContact O-N 3.06Å; R366-R369 WeakPolarHBondContact O-CA 3.43Å; R366-R369 PolarHBondContact O-N 3.32Å; N367-R369 VanDerWaalsContact C-N 3.27Å
370	F	80.7	Confident	79	Confident	3 Å²	3	66.6 Å²	66.6	1%	0.013	31%	0.312	C	S	.	.			trans	-78.1	-24.3	175.3	-82.9	-65.4	0	0	0	113.3	F299 L302 L306 G321 F365 R368	F299-F370 HydrophobicContact CB-CD2 4.45Å; F299-F370 HydrophobicContact CB-CE2 4.37Å; F299-F370 HydrophobicContact CD1-CD1 4.11Å; F299-F370 HydrophobicContact CD1-CD2 4.15Å; F299-F370 HydrophobicContact CD1-CE1 4.1Å; F299-F370 HydrophobicContact CD1-CE2 4.12Å; F299-F370 HydrophobicContact CD1-CG 4.14Å; F299-F370 HydrophobicContact CD1-CZ 4.11Å; F299-F370 HydrophobicContact CE1-CD1 4.41Å; F299-F370 HydrophobicContact CE1-CE1 4.49Å; F299-F370 WeakPolarHBondContact O-CE2 3.45Å; L302-F370 HydrophobicContact CB-CZ 4.42Å; L302-F370 HydrophobicContact CD2-CE1 4.35Å; L302-F370 HydrophobicContact CD2-CZ 4.27Å; L302-F370 HydrophobicContact CG-CZ 4.27Å; L306-F370 HydrophobicContact CD1-CE1 3.94Å; L306-F370 HydrophobicContact CD1-CZ 4.13Å; G321-F370 CarbonylContact C-O 3.58Å; G321-F370 WeakPolarHBondContact CA-O 3.31Å; F365-F370 HydrophobicContact CB-CB 4.4Å; F365-F370 PolarHBondContact O-N 2.82Å; R368-F370 HydrophobicContact CB-CD2 3.85Å; R368-F370 HydrophobicContact CB-CE2 4.41Å; R368-F370 PolarHBondContact O-N 2.75Å
371	L	78.4	Confident	79	Confident	8 Å²	8	62 Å²	62	4%	0.042	29%	0.29	C	S	.	.	S	Bend	trans	-103.9	133.6	171	-79.2	170	0	0	0	110.1	G325 M329 E362 F365 R366	G325-L371 WeakPolarHBondContact O-CD2 3.37Å; M329-L371 HydrophobicContact CG-CD1 3.95Å; M329-L371 HydrophobicContact CG-CD2 3.36Å; M329-L371 HydrophobicContact CG-CG 4.28Å; M329-L371 HydrophobicContact SD-CD1 3.69Å; M329-L371 HydrophobicContact SD-CD2 4.19Å; E362-L371 HydrophobicContact CB-CD1 4.47Å; E362-L371 HydrophobicContact CG-CD1 3.79Å; F365-L371 HydrophobicContact CB-CB 4.24Å; F365-L371 HydrophobicContact CB-CD1 3.47Å; F365-L371 VanDerWaalsContact CB-CD1 3.47Å; F365-L371 HydrophobicContact CB-CG 3.72Å; F365-L371 HydrophobicContact CD2-CD1 3.95Å; F365-L371 HydrophobicContact CD2-CG 4.37Å; F365-L371 HydrophobicContact CG-CD1 4.24Å; F365-L371 PolarHBondContact O-N 3.45Å; R366-L371 HydrophobicContact CG-CB 3.96Å
372	N	71.2	Confident	79	Confident	34 Å²	34	64.7 Å²	64.7	18%	0.182	31%	0.305	C	S	.	.			trans	-62.6	157.3	172.5	66.7	8.6	0	0	0	110	R366 E374 S375	R366-N372 PolarHBondContact NH1-O 3.4Å; N372-E374 PolarHBondContact O-N 2.82Å; N372-S375 WeakPolarHBondContact OD1-CA 3.39Å; N372-S375 WeakPolarHBondContact OD1-CB 3.4Å; N372-S375 PolarHBondContact OD1-N 3.41Å
373	A	67.2	Low	79	Confident	90 Å²	90	69.5 Å²	69.5	74%	0.744	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-22.3	177.2	0	0	0	0	0	112.2	R366	R366-A373 VanDerWaalsContact NH1-C 3.3Å; R366-A373 PolarHBondContact NH1-O 3.18Å
374	E	69.2	Low	78.9	Confident	166 Å²	166	67.1 Å²	67.1	78%	0.776	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-3.9	-171.7	-60.4	-174.9	172.4	0	0	114.7	N372 Y376	N372-E374 PolarHBondContact O-N 2.82Å; E374-Y376 PolarHBondContact O-N 3.21Å
375	S	71.3	Confident	78.8	Confident	8 Å²	8	67.1 Å²	67.1	6%	0.056	33%	0.325	C	S	.	.			trans	-64.7	118.9	-177.1	-171.2	0	0	0	0	108.3	D326 R366 N372	D326-S375 VanDerWaalsContact OD1-CB 3.29Å; D326-S375 WeakPolarHBondContact OD1-CB 3.29Å; D326-S375 PolarHBondContact OD1-OG 3.18Å; R366-S375 PolarHBondContact NH2-O 3.26Å; N372-S375 WeakPolarHBondContact OD1-CA 3.39Å; N372-S375 WeakPolarHBondContact OD1-CB 3.4Å; N372-S375 PolarHBondContact OD1-N 3.41Å
376	Y	80.4	Confident	78.6	Confident	142 Å²	142	72 Å²	72	56%	0.557	35%	0.351	S	S	*	.			trans	-109.6	12.4	178.9	66.4	-81.4	0	0	0	111	E374 L378 Q379 K380	E374-Y376 PolarHBondContact O-N 3.21Å; Y376-L378 PolarHBondContact O-N 3.36Å; Y376-Q379 CarbonylContact O-C 3.6Å; Y376-Q379 PolarHBondContact O-N 2.95Å; Y376-Q379 VanDerWaalsContact O-N 3.1Å; Y376-K380 HydrophobicContact CD2-CB 3.91Å; Y376-K380 HydrophobicContact CD2-CD 4.5Å; Y376-K380 HydrophobicContact CE2-CB 4.22Å; Y376-K380 HydrophobicContact CE2-CD 3.97Å; Y376-K380 HydrophobicContact CE2-CG 4.43Å; Y376-K380 VanDerWaalsContact O-CB 3.31Å; Y376-K380 WeakPolarHBondContact O-CB 3.49Å; Y376-K380 PolarHBondContact O-N 3.31Å
377	A	81.1	Confident	78.7	Confident	13 Å²	13	70.3 Å²	70.3	11%	0.107	35%	0.352	C	S	.	.	H	α-helix	trans	-57.2	-45.5	-174.7	0	0	0	0	0	112.8	M329 I333 K380 F381	M329-A377 HydrophobicContact CB-CB 3.72Å; I333-A377 HydrophobicContact CD1-CB 4.08Å; I333-A377 WeakPolarHBondContact CD1-O 3.17Å; A377-K380 PolarHBondContact O-N 3.18Å; A377-F381 PolarHBondContact O-N 3.3Å
378	L	80.1	Confident	78.7	Confident	5 Å²	5	65 Å²	65	3%	0.026	32%	0.324	C	S	.	.	H	α-helix	trans	-68.5	-39.9	176	-169	69.3	0	0	0	111.6	M329 I333 L337 C358 R359 E362 Y376 K380 F381 L382	M329-L378 HydrophobicContact CE-CB 4.01Å; I333-L378 HydrophobicContact CG1-CD1 4.49Å; L337-L378 HydrophobicContact CD1-CD1 3.71Å; C358-L378 HydrophobicContact CB-CD1 4.07Å; C358-L378 HydrophobicContact CB-CD2 4.34Å; R359-L378 HydrophobicContact CG-CD2 3.89Å; E362-L378 WeakPolarHBondContact OE2-CD2 3.42Å; Y376-L378 PolarHBondContact O-N 3.36Å; L378-K380 VanDerWaalsContact C-N 3.34Å; L378-F381 HydrophobicContact CD1-CD1 4.47Å; L378-F381 PolarHBondContact O-N 3.09Å; L378-L382 VanDerWaalsContact O-CG 3.31Å; L378-L382 WeakPolarHBondContact O-CG 3.46Å; L378-L382 PolarHBondContact O-N 3.38Å
379	Q	80.4	Confident	78.9	Confident	129 Å²	129	62.7 Å²	62.7	60%	0.603	32%	0.316	S	S	*	.	H	α-helix	trans	-65.3	-38.5	177.1	-169.9	173.1	5.6	0	0	111.8	Y376 L382 L383	Y376-Q379 CarbonylContact O-C 3.6Å; Y376-Q379 PolarHBondContact O-N 2.95Å; Y376-Q379 VanDerWaalsContact O-N 3.1Å; Q379-L382 WeakPolarHBondContact O-CB 3.42Å; Q379-L382 PolarHBondContact O-N 2.82Å; Q379-L383 VanDerWaalsContact O-CG 3.29Å; Q379-L383 WeakPolarHBondContact O-CG 3.4Å; Q379-L383 PolarHBondContact O-N 3.4Å
380	K	84.5	Confident	79.4	Confident	94 Å²	94	56.6 Å²	56.6	41%	0.409	29%	0.293	S	S	.	.	H	α-helix	trans	-62.7	-48	172.4	-173.2	-175.9	-179.8	-178.5	0	110.7	Y376 A377 L378 L382 L383 D384	Y376-K380 HydrophobicContact CD2-CB 3.91Å; Y376-K380 HydrophobicContact CD2-CD 4.5Å; Y376-K380 HydrophobicContact CE2-CB 4.22Å; Y376-K380 HydrophobicContact CE2-CD 3.97Å; Y376-K380 HydrophobicContact CE2-CG 4.43Å; Y376-K380 VanDerWaalsContact O-CB 3.31Å; Y376-K380 WeakPolarHBondContact O-CB 3.49Å; Y376-K380 PolarHBondContact O-N 3.31Å; A377-K380 PolarHBondContact O-N 3.18Å; L378-K380 VanDerWaalsContact C-N 3.34Å; K380-L382 VanDerWaalsContact C-N 3.25Å; K380-L382 PolarHBondContact O-N 3.09Å; K380-L383 PolarHBondContact O-N 2.93Å; K380-L383 VanDerWaalsContact O-N 3.09Å; K380-D384 WeakPolarHBondContact O-CB 3.29Å; K380-D384 PolarHBondContact O-N 2.91Å
381	F	83.6	Confident	79.7	Confident	10 Å²	10	60 Å²	60	4%	0.044	31%	0.31	C	S	.	.	H	α-helix	trans	-57.3	-39.6	174.3	171.6	-100.2	0	0	0	112.2	I333 L337 V341 L355 A377 L378 D384 Y385 I388	I333-F381 HydrophobicContact CD1-CB 4.02Å; I333-F381 HydrophobicContact CG1-CB 4.4Å; I333-F381 HydrophobicContact CG2-CB 4.08Å; I333-F381 HydrophobicContact CG2-CD2 3.34Å; I333-F381 HydrophobicContact CG2-CE2 3.89Å; I333-F381 HydrophobicContact CG2-CG 3.75Å; L337-F381 HydrophobicContact CB-CE1 3.98Å; L337-F381 HydrophobicContact CB-CE2 4.33Å; L337-F381 HydrophobicContact CB-CZ 3.75Å; L337-F381 HydrophobicContact CD1-CD1 4.03Å; L337-F381 HydrophobicContact CD1-CE1 3.86Å; L337-F381 HydrophobicContact CD1-CZ 4.45Å; L337-F381 HydrophobicContact CG-CE1 4.43Å; V341-F381 HydrophobicContact CG2-CE2 4.46Å; V341-F381 HydrophobicContact CG2-CZ 4.06Å; L355-F381 HydrophobicContact CD2-CD1 4.46Å; L355-F381 HydrophobicContact CD2-CE1 4.06Å; A377-F381 PolarHBondContact O-N 3.3Å; L378-F381 HydrophobicContact CD1-CD1 4.47Å; L378-F381 PolarHBondContact O-N 3.09Å; F381-D384 CarbonylContact O-C 3.53Å; F381-D384 PolarHBondContact O-N 3.5Å; F381-Y385 HydrophobicContact CE1-CD2 4.41Å; F381-Y385 HydrophobicContact CZ-CD2 4.33Å; F381-Y385 WeakPolarHBondContact O-CA 3.2Å; F381-Y385 PolarHBondContact O-N 3.35Å; F381-I388 HydrophobicContact CD2-CD1 3.49Å; F381-I388 VanDerWaalsContact CD2-CD1 3.49Å; F381-I388 HydrophobicContact CE2-CD1 3.48Å; F381-I388 VanDerWaalsContact CE2-CD1 3.48Å
382	L	80.3	Confident	79.9	Confident	59 Å²	59	61.4 Å²	61.4	31%	0.309	32%	0.315	S	S	.	.	H	α-helix	trans	-65.2	-39.9	175	-74.4	169.9	0	0	0	112.6	L355 L378 Q379 K380 Y385	L355-L382 HydrophobicContact CD1-CD2 3.67Å; L355-L382 HydrophobicContact CD2-CD2 3.49Å; L355-L382 VanDerWaalsContact CD2-CD2 3.49Å; L355-L382 HydrophobicContact CD2-CG 4.43Å; L355-L382 HydrophobicContact CG-CD2 4.18Å; L378-L382 VanDerWaalsContact O-CG 3.31Å; L378-L382 WeakPolarHBondContact O-CG 3.46Å; L378-L382 PolarHBondContact O-N 3.38Å; Q379-L382 WeakPolarHBondContact O-CB 3.42Å; Q379-L382 PolarHBondContact O-N 2.82Å; K380-L382 VanDerWaalsContact C-N 3.25Å; K380-L382 PolarHBondContact O-N 3.09Å; L382-Y385 VanDerWaalsContact O-CB 3.29Å; L382-Y385 WeakPolarHBondContact O-CB 3.44Å; L382-Y385 PolarHBondContact O-N 2.94Å
383	L	80.5	Confident	80.7	Confident	134 Å²	134	61 Å²	61	70%	0.702	31%	0.312	S	S	*	.	H	α-helix	trans	-68.3	-37.2	175.6	-70.5	168.9	0	0	0	111.8	Q379 K380 Y385	Q379-L383 VanDerWaalsContact O-CG 3.29Å; Q379-L383 WeakPolarHBondContact O-CG 3.4Å; Q379-L383 PolarHBondContact O-N 3.4Å; K380-L383 PolarHBondContact O-N 2.93Å; K380-L383 VanDerWaalsContact O-N 3.09Å; L383-Y385 VanDerWaalsContact C-N 3.29Å
384	D	83	Confident	81.7	Confident	72 Å²	72	56.7 Å²	56.7	39%	0.385	28%	0.277	S	S	.	.	S	Bend	trans	-85.8	-0.5	179.8	-65.9	-20.8	0	0	0	112.6	K380 F381 D386 S387 I388	K380-D384 WeakPolarHBondContact O-CB 3.29Å; K380-D384 PolarHBondContact O-N 2.91Å; F381-D384 CarbonylContact O-C 3.53Å; F381-D384 PolarHBondContact O-N 3.5Å; D384-D386 VanDerWaalsContact C-N 3.34Å; D384-D386 PolarHBondContact O-N 3.24Å; D384-S387 WeakPolarHBondContact O-CA 3.42Å; D384-S387 VanDerWaalsContact O-CB 3.26Å; D384-S387 WeakPolarHBondContact O-CB 3.44Å; D384-S387 PolarHBondContact O-N 2.95Å; D384-I388 HydrophobicContact CB-CD1 4.47Å; D384-I388 WeakPolarHBondContact O-CG1 3.17Å; D384-I388 PolarHBondContact O-N 3.46Å
385	Y	80.6	Confident	82.7	Confident	31 Å²	31	54.6 Å²	54.6	12%	0.122	27%	0.267	C	S	.	.	H	α-helix	trans	-55.1	-47.5	-172.6	178.2	-90.7	0	0	0	112.2	V341 P342 M351 F381 L382 L383 S387 I388 L389	V341-Y385 HydrophobicContact CB-CE2 4.35Å; V341-Y385 HydrophobicContact CG1-CE2 3.77Å; V341-Y385 HydrophobicContact CG2-CD2 4.5Å; V341-Y385 HydrophobicContact CG2-CE2 3.97Å; P342-Y385 WeakPolarHBondContact CD-OH 3.46Å; M351-Y385 HydrophobicContact CG-CE2 4.01Å; M351-Y385 HydrophobicContact SD-CD1 4.46Å; M351-Y385 HydrophobicContact SD-CD2 4.12Å; M351-Y385 HydrophobicContact SD-CE1 3.68Å; M351-Y385 HydrophobicContact SD-CE2 3.24Å; M351-Y385 WeakPolarHBondContact SD-CE2 3.24Å; M351-Y385 PolarHBondContact SD-OH 2.92Å; F381-Y385 HydrophobicContact CE1-CD2 4.41Å; F381-Y385 HydrophobicContact CZ-CD2 4.33Å; F381-Y385 WeakPolarHBondContact O-CA 3.2Å; F381-Y385 PolarHBondContact O-N 3.35Å; L382-Y385 VanDerWaalsContact O-CB 3.29Å; L382-Y385 WeakPolarHBondContact O-CB 3.44Å; L382-Y385 PolarHBondContact O-N 2.94Å; L383-Y385 VanDerWaalsContact C-N 3.29Å; Y385-S387 VanDerWaalsContact C-N 3.25Å; Y385-S387 PolarHBondContact O-N 3.28Å; Y385-I388 PolarHBondContact O-N 2.98Å; Y385-L389 HydrophobicContact CE1-CB 4.49Å; Y385-L389 HydrophobicContact CE1-CD2 4.3Å; Y385-L389 WeakPolarHBondContact O-CB 3.46Å; Y385-L389 PolarHBondContact O-N 3.26Å
386	D	80.4	Confident	83.5	Confident	102 Å²	102	57.6 Å²	57.6	55%	0.545	29%	0.285	S	S	.	.	H	α-helix	trans	-64.9	-31.5	178.7	-73	-28.6	0	0	0	112.1	D384 C390 L551	D384-D386 VanDerWaalsContact C-N 3.34Å; D384-D386 PolarHBondContact O-N 3.24Å; D386-C390 WeakPolarHBondContact O-CB 3.38Å; D386-C390 PolarHBondContact O-N 3.14Å; D386-L551 HydrophobicContact CB-CD1 3.77Å
387	S	84.9	Confident	84	Confident	46 Å²	46	51.9 Å²	51.9	32%	0.322	26%	0.264	S	S	.	.	H	α-helix	trans	-68.1	-45.7	174.9	-165.4	0	0	0	0	111.1	D384 Y385 L389 C390 E391	D384-S387 WeakPolarHBondContact O-CA 3.42Å; D384-S387 VanDerWaalsContact O-CB 3.26Å; D384-S387 WeakPolarHBondContact O-CB 3.44Å; D384-S387 PolarHBondContact O-N 2.95Å; Y385-S387 VanDerWaalsContact C-N 3.25Å; Y385-S387 PolarHBondContact O-N 3.28Å; S387-L389 PolarHBondContact O-N 3.04Å; S387-C390 WeakPolarHBondContact O-CB 3.5Å; S387-C390 PolarHBondContact O-N 3Å; S387-E391 WeakPolarHBondContact O-CG 3.25Å; S387-E391 PolarHBondContact O-N 3.49Å
388	I	82.2	Confident	84.5	Confident	18 Å²	18	53.1 Å²	53.1	9%	0.092	27%	0.269	C	S	.	.	H	α-helix	trans	-64.3	-42.3	178.4	-64.9	170.1	0	0	0	110.9	K338 V341 F381 D384 Y385 E391 K392	K338-I388 HydrophobicContact CG-CG2 3.92Å; V341-I388 HydrophobicContact CB-CG2 4.49Å; V341-I388 HydrophobicContact CG1-CG2 4.46Å; V341-I388 HydrophobicContact CG2-CG2 4Å; F381-I388 HydrophobicContact CD2-CD1 3.49Å; F381-I388 VanDerWaalsContact CD2-CD1 3.49Å; F381-I388 HydrophobicContact CE2-CD1 3.48Å; F381-I388 VanDerWaalsContact CE2-CD1 3.48Å; D384-I388 HydrophobicContact CB-CD1 4.47Å; D384-I388 WeakPolarHBondContact O-CG1 3.17Å; D384-I388 PolarHBondContact O-N 3.46Å; Y385-I388 PolarHBondContact O-N 2.98Å; I388-E391 PolarHBondContact O-N 3.47Å; I388-K392 PolarHBondContact O-N 2.87Å; I388-K392 VanDerWaalsContact O-N 3.09Å
389	L	82.1	Confident	85.1	Confident	23 Å²	23	55.7 Å²	55.7	12%	0.12	29%	0.287	C	S	.	.	H	α-helix	trans	-60.8	-47	174.9	178.3	63.7	0	0	0	110.8	V341 P342 Y385 S387 E391 K392 E393	V341-L389 HydrophobicContact CG1-CB 3.99Å; V341-L389 HydrophobicContact CG1-CD1 3.93Å; P342-L389 WeakPolarHBondContact O-CD1 3.26Å; Y385-L389 HydrophobicContact CE1-CB 4.49Å; Y385-L389 HydrophobicContact CE1-CD2 4.3Å; Y385-L389 WeakPolarHBondContact O-CB 3.46Å; Y385-L389 PolarHBondContact O-N 3.26Å; S387-L389 PolarHBondContact O-N 3.04Å; L389-E391 PolarHBondContact O-N 2.91Å; L389-K392 PolarHBondContact O-N 3.49Å; L389-E393 WeakPolarHBondContact O-CB 3.25Å; L389-E393 WeakPolarHBondContact O-CG 3.21Å; L389-E393 PolarHBondContact O-N 3.21Å
390	C	84.8	Confident	85.6	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.007	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-44.6	176.8	-178.1	0	0	0	0	111.8	D386 S387 K392 E393 C394 L551 Y555	D386-C390 WeakPolarHBondContact O-CB 3.38Å; D386-C390 PolarHBondContact O-N 3.14Å; S387-C390 WeakPolarHBondContact O-CB 3.5Å; S387-C390 PolarHBondContact O-N 3Å; C390-K392 PolarHBondContact O-N 3.4Å; C390-E393 PolarHBondContact O-N 2.92Å; C390-C394 VanDerWaalsContact O-CB 3.25Å; C390-C394 WeakPolarHBondContact O-CB 3.39Å; C390-C394 PolarHBondContact O-N 3.41Å; C390-C394 PolarHBondContact O-SG 3.34Å; C390-L551 HydrophobicContact CB-CD2 3.66Å; C390-Y555 VanDerWaalsContact SG-CZ 3.55Å
391	E	86.7	Confident	86.1	Confident	76 Å²	76	46.4 Å²	46.4	36%	0.355	25%	0.25	S	C	.	.	H	α-helix	trans	-56.7	-51.3	176.9	-78.6	177.1	178.5	0	0	111.9	S387 I388 L389 E393 C394 E395	S387-E391 WeakPolarHBondContact O-CG 3.25Å; S387-E391 PolarHBondContact O-N 3.49Å; I388-E391 PolarHBondContact O-N 3.47Å; L389-E391 PolarHBondContact O-N 2.91Å; E391-E393 VanDerWaalsContact C-N 3.31Å; E391-E393 PolarHBondContact O-N 3.21Å; E391-C394 WeakPolarHBondContact O-CB 3.48Å; E391-C394 PolarHBondContact O-N 3.38Å; E391-E395 WeakPolarHBondContact O-CG 3.23Å; E391-E395 PolarHBondContact O-N 3.27Å
392	K	84.3	Confident	86.5	Confident	36 Å²	36	50.3 Å²	50.3	16%	0.157	27%	0.268	C	S	.	.	H	α-helix	trans	-59.3	-42.3	176.7	-82	-179.4	147.8	-173.2	0	112.2	K338 P339 V341 F343 I388 L389 C390 C394 E395 T396	K338-K392 VanDerWaalsContact O-CE 3.25Å; K338-K392 WeakPolarHBondContact O-CE 3.36Å; K338-K392 PolarHBondContact O-NZ 3.48Å; P339-K392 PolarHBondContact O-NZ 2.86Å; V341-K392 HydrophobicContact CB-CD 4.17Å; V341-K392 HydrophobicContact CG1-CD 4.47Å; V341-K392 PolarHBondContact O-NZ 3.03Å; F343-K392 VanDerWaalsContact CE1-C 3.41Å; F343-K392 HydrophobicContact CE1-CB 3.59Å; F343-K392 WeakPolarHBondContact CE1-O 3.44Å; F343-K392 HydrophobicContact CZ-CB 3.75Å; I388-K392 PolarHBondContact O-N 2.87Å; I388-K392 VanDerWaalsContact O-N 3.09Å; L389-K392 PolarHBondContact O-N 3.49Å; C390-K392 PolarHBondContact O-N 3.4Å; K392-C394 VanDerWaalsContact C-N 3.3Å; K392-C394 PolarHBondContact O-N 3.27Å; K392-E395 PolarHBondContact O-N 3.46Å; K392-T396 PolarHBondContact O-N 3.19Å; K392-T396 PolarHBondContact O-OG1 3.35Å
393	E	87.4	Confident	87	Confident	25 Å²	25	52.4 Å²	52.4	12%	0.117	28%	0.279	C	S	.	.	H	α-helix	trans	-64	-42.7	179.8	-81.3	-171	-163.8	0	0	110.1	F343 L389 C390 E391 T396 L397 K542 Y555	F343-E393 HydrophobicContact CD1-CG 3.58Å; F343-E393 HydrophobicContact CE1-CB 4.38Å; F343-E393 HydrophobicContact CE1-CG 3.89Å; L389-E393 WeakPolarHBondContact O-CB 3.25Å; L389-E393 WeakPolarHBondContact O-CG 3.21Å; L389-E393 PolarHBondContact O-N 3.21Å; C390-E393 PolarHBondContact O-N 2.92Å; E391-E393 VanDerWaalsContact C-N 3.31Å; E391-E393 PolarHBondContact O-N 3.21Å; E393-T396 PolarHBondContact O-N 2.88Å; E393-L397 WeakPolarHBondContact O-CB 3.41Å; E393-L397 VanDerWaalsContact O-CG 3.23Å; E393-L397 WeakPolarHBondContact O-CG 3.48Å; E393-L397 PolarHBondContact O-N 2.98Å; E393-K542 IonicContact OE2-NZ 3.99Å; E393-K542 PolarHBondContact OE2-NZ 2.85Å; E393-Y555 PolarHBondContact OE2-OH 3.28Å; E393-Y555 VanDerWaalsContact OE2-OH 3.07Å
394	C	88.9	Confident	87.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-44.7	177.1	-72.1	0	0	0	0	112.1	C390 E391 K392 T396 L397 I398 V558	C390-C394 VanDerWaalsContact O-CB 3.25Å; C390-C394 WeakPolarHBondContact O-CB 3.39Å; C390-C394 PolarHBondContact O-N 3.41Å; C390-C394 PolarHBondContact O-SG 3.34Å; E391-C394 WeakPolarHBondContact O-CB 3.48Å; E391-C394 PolarHBondContact O-N 3.38Å; K392-C394 VanDerWaalsContact C-N 3.3Å; K392-C394 PolarHBondContact O-N 3.27Å; C394-T396 PolarHBondContact O-N 2.96Å; C394-L397 PolarHBondContact O-N 2.99Å; C394-I398 WeakPolarHBondContact O-CB 3.43Å; C394-I398 VanDerWaalsContact O-CG1 3.25Å; C394-I398 WeakPolarHBondContact O-CG1 3.44Å; C394-I398 PolarHBondContact O-N 3.3Å; C394-V558 HydrophobicContact CB-CG2 3.54Å; C394-V558 WeakPolarHBondContact SG-CG2 3.49Å
395	E	88.5	Confident	87.7	Confident	122 Å²	122	43.9 Å²	43.9	57%	0.57	24%	0.235	S	C	*	.	H	α-helix	trans	-61.7	-42.6	175.9	-73.3	174.5	177.6	0	0	112.2	E391 K392 I398 S399	E391-E395 WeakPolarHBondContact O-CG 3.23Å; E391-E395 PolarHBondContact O-N 3.27Å; K392-E395 PolarHBondContact O-N 3.46Å; E395-I398 PolarHBondContact O-N 2.91Å; E395-S399 WeakPolarHBondContact O-CB 3.49Å; E395-S399 PolarHBondContact O-N 2.97Å; E395-S399 PolarHBondContact O-OG 3.34Å
396	T	88.4	Confident	88.1	Confident	72 Å²	72	50.7 Å²	50.7	44%	0.442	27%	0.266	S	S	.	.	H	α-helix	trans	-66.4	-41.9	177.6	-55	0	0	0	0	111.1	F343 K392 E393 C394 S399 A400	F343-T396 WeakPolarHBondContact CZ-OG1 3.2Å; K392-T396 PolarHBondContact O-N 3.19Å; K392-T396 PolarHBondContact O-OG1 3.35Å; E393-T396 PolarHBondContact O-N 2.88Å; C394-T396 PolarHBondContact O-N 2.96Å; T396-S399 PolarHBondContact O-N 3.43Å; T396-A400 WeakPolarHBondContact O-CB 3.38Å; T396-A400 PolarHBondContact O-N 3.05Å
397	L	91	Very high	88.4	Confident	21 Å²	21	50.4 Å²	50.4	11%	0.11	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-47.5	175.3	-77	168.8	0	0	0	111.4	E393 C394 S399 A400 F401 R535 T539 V558	E393-L397 WeakPolarHBondContact O-CB 3.41Å; E393-L397 VanDerWaalsContact O-CG 3.23Å; E393-L397 WeakPolarHBondContact O-CG 3.48Å; E393-L397 PolarHBondContact O-N 2.98Å; C394-L397 PolarHBondContact O-N 2.99Å; L397-S399 VanDerWaalsContact C-N 3.3Å; L397-S399 PolarHBondContact O-N 2.86Å; L397-A400 PolarHBondContact O-N 3.5Å; L397-F401 HydrophobicContact CB-CD2 4.45Å; L397-F401 HydrophobicContact CB-CE2 4.11Å; L397-F401 WeakPolarHBondContact O-CD2 3.21Å; L397-F401 WeakPolarHBondContact O-CG 3.44Å; L397-F401 PolarHBondContact O-N 2.54Å; L397-R535 HydrophobicContact CD2-CG 3.89Å; L397-T539 HydrophobicContact CD1-CG2 3.97Å; L397-V558 HydrophobicContact CB-CG1 4.02Å; L397-V558 HydrophobicContact CD1-CG1 4.28Å
398	I	92	Very high	88.5	Confident	40 Å²	40	52.6 Å²	52.6	21%	0.205	28%	0.277	C	S	.	.	H	α-helix	trans	-58.1	-45.3	176.9	-70.9	166.5	0	0	0	110.5	C394 E395 A400 F401 Q402 V558 L565	C394-I398 WeakPolarHBondContact O-CB 3.43Å; C394-I398 VanDerWaalsContact O-CG1 3.25Å; C394-I398 WeakPolarHBondContact O-CG1 3.44Å; C394-I398 PolarHBondContact O-N 3.3Å; E395-I398 PolarHBondContact O-N 2.91Å; I398-A400 VanDerWaalsContact C-N 3.35Å; I398-A400 PolarHBondContact O-N 2.95Å; I398-F401 PolarHBondContact O-N 3.41Å; I398-Q402 WeakPolarHBondContact O-CG 3.42Å; I398-Q402 PolarHBondContact O-N 3.25Å; I398-V558 HydrophobicContact CD1-CG2 4.35Å; I398-V558 HydrophobicContact CG1-CG1 4.25Å; I398-L565 HydrophobicContact CG2-CD1 4.19Å
399	S	91.9	Very high	88.6	Confident	59 Å²	59	53.3 Å²	53.3	41%	0.413	28%	0.28	S	S	.	.	H	α-helix	trans	-61.4	-42.8	177.3	-58.1	0	0	0	0	111.8	E395 T396 L397 Q402 L403	E395-S399 WeakPolarHBondContact O-CB 3.49Å; E395-S399 PolarHBondContact O-N 2.97Å; E395-S399 PolarHBondContact O-OG 3.34Å; T396-S399 PolarHBondContact O-N 3.43Å; L397-S399 VanDerWaalsContact C-N 3.3Å; L397-S399 PolarHBondContact O-N 2.86Å; S399-Q402 PolarHBondContact O-N 2.9Å; S399-L403 WeakPolarHBondContact O-CG 3.21Å; S399-L403 PolarHBondContact O-N 2.97Å
400	A	91.8	Very high	88.7	Confident	27 Å²	27	58.9 Å²	58.9	22%	0.223	31%	0.306	C	S	.	.	H	α-helix	trans	-63.6	-41	175.9	0	0	0	0	0	112.3	T396 L397 I398 Q402 L403 A404	T396-A400 WeakPolarHBondContact O-CB 3.38Å; T396-A400 PolarHBondContact O-N 3.05Å; L397-A400 PolarHBondContact O-N 3.5Å; I398-A400 VanDerWaalsContact C-N 3.35Å; I398-A400 PolarHBondContact O-N 2.95Å; A400-Q402 VanDerWaalsContact C-N 3.33Å; A400-Q402 PolarHBondContact O-N 2.67Å; A400-L403 PolarHBondContact O-N 3.37Å; A400-A404 PolarHBondContact O-N 3.36Å; A400-A404 VanDerWaalsContact O-N 3.13Å
401	F	94.5	Very high	88.7	Confident	1 Å²	1	63.9 Å²	63.9	0%	0.004	34%	0.338	C	S	.	.	H	α-helix	trans	-63.3	-38.5	174.8	-70.5	-55.3	0	0	0	112.1	L397 I398 Y532 R535 I536 V558 A562 L565	L397-F401 HydrophobicContact CB-CD2 4.45Å; L397-F401 HydrophobicContact CB-CE2 4.11Å; L397-F401 WeakPolarHBondContact O-CD2 3.21Å; L397-F401 WeakPolarHBondContact O-CG 3.44Å; L397-F401 PolarHBondContact O-N 2.54Å; I398-F401 PolarHBondContact O-N 3.41Å; F401-Y532 HydrophobicContact CB-CE2 3.86Å; F401-Y532 HydrophobicContact CD1-CD1 4.4Å; F401-Y532 AromaticContact CD1-CD2 3.87Å; F401-Y532 HydrophobicContact CD1-CD2 3.87Å; F401-Y532 HydrophobicContact CD1-CE1 4.09Å; F401-Y532 AromaticContact CD1-CE2 3.53Å; F401-Y532 HydrophobicContact CD1-CE2 3.53Å; F401-Y532 HydrophobicContact CD1-CG 4.3Å; F401-Y532 AromaticContact CD1-CZ 3.62Å; F401-Y532 HydrophobicContact CE1-CE1 4.48Å; F401-Y532 HydrophobicContact CG-CE2 4.14Å; F401-Y532 WeakPolarHBondContact O-CE2 3.4Å; F401-R535 HydrophobicContact CD1-CG 4.48Å; F401-R535 HydrophobicContact CE1-CB 3.73Å; F401-R535 HydrophobicContact CE1-CG 3.63Å; F401-R535 HydrophobicContact CE2-CG 4.48Å; F401-R535 HydrophobicContact CZ-CB 4.08Å; F401-R535 HydrophobicContact CZ-CG 3.63Å; F401-I536 HydrophobicContact CE1-CG1 3.68Å; F401-I536 HydrophobicContact CZ-CG1 3.8Å; F401-V558 HydrophobicContact CE2-CG1 4.23Å; F401-A562 HydrophobicContact CB-CB 4.47Å; F401-A562 HydrophobicContact CD1-CB 3.87Å; F401-A562 HydrophobicContact CD2-CB 3.46Å; F401-A562 VanDerWaalsContact CD2-CB 3.46Å; F401-A562 HydrophobicContact CE1-CB 3.83Å; F401-A562 HydrophobicContact CE2-CB 3.45Å; F401-A562 VanDerWaalsContact CE2-CB 3.45Å; F401-A562 HydrophobicContact CG-CB 3.69Å; F401-A562 HydrophobicContact CZ-CB 3.64Å; F401-L565 HydrophobicContact CB-CD1 4.45Å
402	Q	92.2	Very high	88.7	Confident	91 Å²	91	62.6 Å²	62.6	43%	0.425	34%	0.336	S	S	.	.	H	α-helix	trans	-66.9	-39.5	175.3	-70.4	174.2	-13.2	0	0	112.3	I398 S399 A400 A404 F405 L565 L569	I398-Q402 WeakPolarHBondContact O-CG 3.42Å; I398-Q402 PolarHBondContact O-N 3.25Å; S399-Q402 PolarHBondContact O-N 2.9Å; A400-Q402 VanDerWaalsContact C-N 3.33Å; A400-Q402 PolarHBondContact O-N 2.67Å; Q402-A404 VanDerWaalsContact C-N 3.31Å; Q402-A404 PolarHBondContact O-N 3.15Å; Q402-F405 PolarHBondContact O-N 3.22Å; Q402-L565 HydrophobicContact CG-CD1 4.31Å; Q402-L569 HydrophobicContact CG-CD1 4.39Å
403	L	91.7	Very high	88.7	Confident	103 Å²	103	63.9 Å²	63.9	54%	0.539	35%	0.346	S	S	.	.	H	α-helix	trans	-65.2	-32.8	178.4	-75.5	170.2	0	0	0	112.8	S399 A400 F405 K406	S399-L403 WeakPolarHBondContact O-CG 3.21Å; S399-L403 PolarHBondContact O-N 2.97Å; A400-L403 PolarHBondContact O-N 3.37Å; L403-F405 PolarHBondContact O-N 3.48Å; L403-K406 HydrophobicContact CD2-CD 4.43Å; L403-K406 WeakPolarHBondContact O-CB 3.36Å; L403-K406 PolarHBondContact O-N 3.47Å
404	A	90.1	Very high	88.5	Confident	13 Å²	13	67.4 Å²	67.4	11%	0.107	36%	0.363	C	S	.	.	H	α-helix	trans	-58.4	-33.9	179.5	0	0	0	0	0	113.4	A400 Q402 K406 L407 W528 Y532	A400-A404 PolarHBondContact O-N 3.36Å; A400-A404 VanDerWaalsContact O-N 3.13Å; Q402-A404 VanDerWaalsContact C-N 3.31Å; Q402-A404 PolarHBondContact O-N 3.15Å; A404-K406 PolarHBondContact O-N 3.49Å; A404-L407 WeakPolarHBondContact O-CB 3.3Å; A404-L407 PolarHBondContact O-N 2.97Å; A404-W528 HydrophobicContact CB-CE3 4.05Å; A404-W528 HydrophobicContact CB-CZ3 4.39Å; A404-Y532 HydrophobicContact CB-CD2 3.6Å; A404-Y532 HydrophobicContact CB-CE2 4.03Å
405	F	87.9	Confident	87.7	Confident	15 Å²	15	68.5 Å²	68.5	7%	0.066	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-12.9	175.9	-85	-93.7	0	0	0	114	Q402 L403 W528 Y532 A566 L569 M591	Q402-F405 PolarHBondContact O-N 3.22Å; L403-F405 PolarHBondContact O-N 3.48Å; F405-W528 HydrophobicContact CD1-CH2 4.03Å; F405-W528 HydrophobicContact CD1-CZ2 4.1Å; F405-W528 AromaticContact CD2-CH2 3.99Å; F405-W528 HydrophobicContact CD2-CH2 3.99Å; F405-W528 HydrophobicContact CD2-CZ3 4.35Å; F405-W528 AromaticContact CE1-CH2 3.65Å; F405-W528 HydrophobicContact CE1-CH2 3.65Å; F405-W528 AromaticContact CE1-CZ2 3.98Å; F405-W528 HydrophobicContact CE1-CZ2 3.98Å; F405-W528 AromaticContact CE2-CH2 3.59Å; F405-W528 HydrophobicContact CE2-CH2 3.59Å; F405-W528 AromaticContact CE2-CZ3 3.99Å; F405-W528 HydrophobicContact CE2-CZ3 3.99Å; F405-W528 HydrophobicContact CG-CH2 4.18Å; F405-W528 HydrophobicContact CG-CZ2 4.43Å; F405-W528 AromaticContact CZ-CH2 3.37Å; F405-W528 HydrophobicContact CZ-CH2 3.37Å; F405-W528 HydrophobicContact CZ-CZ2 4.18Å; F405-W528 HydrophobicContact CZ-CZ3 4.19Å; F405-Y532 HydrophobicContact CD2-CE2 4.18Å; F405-Y532 AromaticContact CE2-CE2 3.8Å; F405-Y532 HydrophobicContact CE2-CE2 3.8Å; F405-Y532 AromaticContact CE2-CZ 3.96Å; F405-A566 HydrophobicContact CE2-CB 3.96Å; F405-A566 HydrophobicContact CZ-CB 3.65Å; F405-L569 HydrophobicContact CB-CB 4.22Å; F405-L569 HydrophobicContact CB-CD1 4.06Å; F405-L569 HydrophobicContact CD1-CB 3.63Å; F405-L569 HydrophobicContact CD2-CB 4.03Å; F405-L569 HydrophobicContact CD2-CD1 3.7Å; F405-L569 HydrophobicContact CE1-CB 4Å; F405-L569 HydrophobicContact CE2-CB 4.37Å; F405-L569 HydrophobicContact CE2-CD1 4.4Å; F405-L569 HydrophobicContact CG-CB 3.67Å; F405-L569 HydrophobicContact CG-CD1 3.88Å; F405-L569 HydrophobicContact CG-CG 4.43Å; F405-L569 HydrophobicContact CZ-CB 4.36Å; F405-M591 HydrophobicContact CZ-CE 4.38Å
406	K	88.4	Confident	86.5	Confident	174 Å²	174	67.3 Å²	67.3	76%	0.757	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-4.7	174.9	-57.7	-175.7	-178.4	177.9	0	112.6	L403 A404	L403-K406 HydrophobicContact CD2-CD 4.43Å; L403-K406 WeakPolarHBondContact O-CB 3.36Å; L403-K406 PolarHBondContact O-N 3.47Å; A404-K406 PolarHBondContact O-N 3.49Å
407	L	87.7	Confident	84.8	Confident	96 Å²	96	67 Å²	67	50%	0.503	37%	0.365	S	S	.	.	S	Bend	trans	-75.8	149.7	178.8	-65.2	176.1	0	0	0	110.8	A404 W528	A404-L407 WeakPolarHBondContact O-CB 3.3Å; A404-L407 PolarHBondContact O-N 2.97Å; L407-W528 HydrophobicContact CB-CB 4.49Å; L407-W528 HydrophobicContact CD1-CB 4.29Å
408	P	85.6	Confident	82.3	Confident	92 Å²	92	69.3 Å²	69.3	60%	0.597	38%	0.382	S	S	*	.			trans	-61.4	157.3	171.3	27.7	-34.5	0	0	0	111.1	E410	P408-E410 PolarHBondContact O-N 3.29Å
409	L	85.6	Confident	79.4	Confident	33 Å²	33	73.4 Å²	73.4	17%	0.173	40%	0.404	C	S	.	.	S	Bend	trans	-73.7	-6.9	175.8	-75.3	174.5	0	0	0	113.7	S527 Y582 V583 L586	L409-S527 WeakPolarHBondContact CA-OG 3.3Å; L409-S527 WeakPolarHBondContact O-CB 3.33Å; L409-S527 PolarHBondContact O-OG 3.29Å; L409-Y582 HydrophobicContact CB-CE1 4.41Å; L409-V583 HydrophobicContact CD1-CB 4.16Å; L409-V583 HydrophobicContact CD1-CG1 3.89Å; L409-V583 HydrophobicContact CD1-CG2 4.04Å; L409-L586 HydrophobicContact CB-CD1 3.91Å; L409-L586 HydrophobicContact CD1-CB 4.31Å; L409-L586 HydrophobicContact CD1-CD1 4.18Å; L409-L586 HydrophobicContact CD2-CB 4.33Å; L409-L586 HydrophobicContact CD2-CD1 4.48Å; L409-L586 HydrophobicContact CG-CD1 4.43Å
410	E	83.1	Confident	76.5	Confident	139 Å²	139	77.3 Å²	77.3	65%	0.65	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-100.9	145.4	172.6	-66.5	-171.4	170.4	0	0	110.9	P408	P408-E410 PolarHBondContact O-N 3.29Å
411	P	86.4	Confident	73.4	Confident	107 Å²	107	85.1 Å²	85.1	70%	0.695	45%	0.449	S	S	*	.	S	Bend	cis	-79	155.3	1.7	32.9	-35.5	0	0	0	113.2
412	V	86	Confident	70.1	Confident	49 Å²	49	89.9 Å²	89.9	30%	0.297	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-93.6	130.1	174.6	-176.4	0	0	0	0	109.3	L525 V526 Y582 L586	V412-L525 HydrophobicContact CG1-CB 3.54Å; V412-L525 HydrophobicContact CG1-CD1 4.29Å; V412-L525 HydrophobicContact CG1-CD2 4.08Å; V412-L525 HydrophobicContact CG1-CG 4.16Å; V412-V526 CarbonylContact C-O 3.59Å; V412-V526 VanDerWaalsContact CA-O 3.29Å; V412-V526 WeakPolarHBondContact CA-O 3.44Å; V412-V526 WeakPolarHBondContact CG1-O 3.45Å; V412-Y582 WeakPolarHBondContact CG2-OH 3.39Å; V412-L586 HydrophobicContact CG1-CD2 3.97Å; V412-L586 HydrophobicContact CG2-CD1 3.88Å; V412-L586 HydrophobicContact CG2-CD2 4.27Å
413	T	84.4	Confident	67	Low	62 Å²	62	88.8 Å²	88.8	38%	0.38	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	133.2	178.7	-56.4	0	0	0	0	110.5	V415 V526 V530	T413-V415 HydrophobicContact CG2-CG2 4.34Å; T413-V526 PolarHBondContact N-O 3.05Å; T413-V526 WeakPolarHBondContact O-CG2 3.42Å; T413-V526 PolarHBondContact O-N 3.46Å; T413-V530 HydrophobicContact CG2-CG2 4.42Å
414	E	82.1	Confident	64	Low	99 Å²	99	89.1 Å²	89.1	46%	0.463	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	119	171	-171.3	175.8	158.1	0	0	110	H416 I523 L525	E414-H416 IonicContact OE1-CE1 2.63Å; E414-H416 PolarHBondContact OE1-CE1 2.8Å; E414-H416 IonicContact OE1-ND1 3.43Å; E414-H416 IonicContact OE1-NE2 3.4Å; E414-I523 VanDerWaalsContact CD-CG2 3.46Å; E414-I523 HydrophobicContact CG-CG2 3.33Å; E414-I523 WeakPolarHBondContact OE1-CG2 3.37Å; E414-L525 HydrophobicContact CB-CD2 3.75Å; E414-L525 HydrophobicContact CG-CD2 4.12Å
415	V	73.7	Confident	61.3	Low	24 Å²	24	95.5 Å²	95.5	15%	0.145	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	115.7	176.4	-176	0	0	0	0	109.1	T413 C524 V526 V530 F593	T413-V415 HydrophobicContact CG2-CG2 4.34Å; V415-C524 PolarHBondContact N-O 3.09Å; V415-C524 PolarHBondContact O-N 3.5Å; V415-V526 HydrophobicContact CB-CG2 4.28Å; V415-V526 HydrophobicContact CG2-CG2 3.37Å; V415-V530 HydrophobicContact CG2-CG2 3.99Å; V415-F593 HydrophobicContact CB-CE2 4.29Å; V415-F593 HydrophobicContact CG1-CD2 4.24Å; V415-F593 HydrophobicContact CG1-CE2 3.52Å; V415-F593 HydrophobicContact CG1-CZ 4.1Å; V415-F593 HydrophobicContact CG2-CE2 4.45Å
416	H	63.3	Low	58.7	Low	97 Å²	97	100.1 Å²	100.1	45%	0.449	54%	0.535	S	S	.	.			trans	-80.5	162.3	174.6	-59.7	-80.2	0	0	0	110.5	E414 S418	E414-H416 IonicContact OE1-CE1 2.63Å; E414-H416 PolarHBondContact OE1-CE1 2.8Å; E414-H416 IonicContact OE1-ND1 3.43Å; E414-H416 IonicContact OE1-NE2 3.4Å; H416-S418 PolarHBondContact O-N 3.47Å
417	S	51.3	Low	56	Low	65 Å²	65	96.7 Å²	96.7	46%	0.455	52%	0.524	S	S	.	.			trans	-67.8	75.1	156.5	75.2	0	0	0	0	108.5	L419	S417-L419 PolarHBondContact O-N 3.05Å
418	S	38	Very low	53	Low	69 Å²	69	99.2 Å²	99.2	48%	0.483	54%	0.538	S	S	.	.			trans	-63.5	96.6	158.4	48.1	0	0	0	0	105.5	H416 L420	H416-S418 PolarHBondContact O-N 3.47Å; S418-L420 PolarHBondContact O-N 2.93Å
419	L	32.7	Very low	50.3	Low	127 Å²	127	102 Å²	102	67%	0.665	54%	0.537	S	S	*	.			trans	-51.9	82.6	146.8	-85.6	159.4	0	0	0	105.6	S417 K421	S417-L419 PolarHBondContact O-N 3.05Å; L419-K421 PolarHBondContact O-N 3.46Å
420	L	30.9	Very low	47.6	Very low	141 Å²	141	105.6 Å²	105.6	74%	0.738	56%	0.563	S	S	*	*			trans	-60.7	110.5	170.5	-95.4	155.4	0	0	0	104.7	S418 L422	S418-L420 PolarHBondContact O-N 2.93Å; L420-L422 VanDerWaalsContact C-N 3.26Å; L420-L422 PolarHBondContact O-N 3.33Å
421	K	25.9	Very low	44.9	Very low	191 Å²	191	108.1 Å²	108.1	83%	0.83	57%	0.567	S	S	*	*			trans	-54.9	92.3	173.3	-67.5	172.6	176.3	177.5	0	107.2	L419 T423	L419-K421 PolarHBondContact O-N 3.46Å; K421-T423 PolarHBondContact O-N 3.45Å
422	L	25.3	Very low	42.2	Very low	101 Å²	101	107.6 Å²	107.6	53%	0.529	56%	0.564	S	S	.	*			trans	-54.1	115.9	159	-75.6	163.5	0	0	0	105.4	L420 I427	L420-L422 VanDerWaalsContact C-N 3.26Å; L420-L422 PolarHBondContact O-N 3.33Å; L422-I427 HydrophobicContact CB-CD1 3.8Å; L422-I427 HydrophobicContact CB-CG1 4.16Å; L422-I427 HydrophobicContact CD1-CD1 4.36Å
423	T	26.3	Very low	39.4	Very low	68 Å²	68	115 Å²	115	42%	0.417	59%	0.592	S	S	.	*			trans	-70	148.4	-179.1	54.9	0	0	0	0	108.6	K421 N425 E426	K421-T423 PolarHBondContact O-N 3.45Å; T423-N425 PolarHBondContact O-N 3.48Å; T423-E426 PolarHBondContact N-OE2 2.66Å; T423-E426 WeakPolarHBondContact O-CB 3.46Å; T423-E426 PolarHBondContact O-N 2.88Å; T423-E426 PolarHBondContact OG1-OE2 3.18Å
424	P	30.6	Very low	36.9	Very low	110 Å²	110	117.5 Å²	117.5	71%	0.714	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-52.6	-26.4	-179.3	-27.7	34.2	0	0	0	114	E426 I427	P424-E426 VanDerWaalsContact C-N 3.27Å; P424-E426 PolarHBondContact O-N 3.07Å; P424-I427 PolarHBondContact O-N 3.28Å
425	N	33.3	Very low	34.3	Very low	146 Å²	146	122.1 Å²	122.1	78%	0.781	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-71	-20.2	177.8	-64.8	-10.1	0	0	0	113.4	T423	T423-N425 PolarHBondContact O-N 3.48Å
426	E	31.8	Very low	32.2	Very low	112 Å²	112	123.5 Å²	123.5	52%	0.523	65%	0.648	S	S	.	*	G	3₁₀ helix	trans	-87.1	-17.5	-179.1	-67.9	169.6	138	0	0	112.7	T423 P424	T423-E426 PolarHBondContact N-OE2 2.66Å; T423-E426 WeakPolarHBondContact O-CB 3.46Å; T423-E426 PolarHBondContact O-N 2.88Å; T423-E426 PolarHBondContact OG1-OE2 3.18Å; P424-E426 VanDerWaalsContact C-N 3.27Å; P424-E426 PolarHBondContact O-N 3.07Å
427	I	31.7	Very low	30.6	Very low	102 Å²	102	129 Å²	129	52%	0.523	67%	0.67	S	S	.	*			trans	-109.8	32.7	-175.2	-43.4	165.1	0	0	0	111	L422 P424 W429	L422-I427 HydrophobicContact CB-CD1 3.8Å; L422-I427 HydrophobicContact CB-CG1 4.16Å; L422-I427 HydrophobicContact CD1-CD1 4.36Å; P424-I427 PolarHBondContact O-N 3.28Å; I427-W429 PolarHBondContact O-N 2.93Å
428	N	25.9	Very low	29.6	Very low	149 Å²	149	132.3 Å²	132.3	80%	0.797	69%	0.687	S	S	*	*			trans	-71.5	76.4	177.5	-133	-0.9	0	0	0	109.7	P430	N428-P430 WeakPolarHBondContact O-CD 3.5Å
429	W	27.5	Very low	29.3	Very low	151 Å²	151	132.5 Å²	132.5	57%	0.572	69%	0.693	S	S	*	*			trans	-83.7	113.1	-178.8	-163.3	-98.1	0	0	0	108.4	I427 Y431 Q607	I427-W429 PolarHBondContact O-N 2.93Å; W429-Y431 PolarHBondContact O-N 3.24Å; W429-Q607 HydrophobicContact CH2-CG 4.36Å; W429-Q607 HydrophobicContact CZ3-CG 4.01Å
430	P	30.1	Very low	29.5	Very low	109 Å²	109	130 Å²	130	71%	0.708	69%	0.686	S	S	*	*			trans	-70.5	107.2	174	27.8	-29	0	0	0	108.1	N428 P432	N428-P430 WeakPolarHBondContact O-CD 3.5Å; P430-P432 WeakPolarHBondContact O-CD 3.47Å
431	Y	26	Very low	29.7	Very low	192 Å²	192	127.9 Å²	127.9	75%	0.753	68%	0.675	S	S	*	*			trans	-60.9	120.8	164.8	-90.1	-95.3	0	0	0	109.1	W429 K433	W429-Y431 PolarHBondContact O-N 3.24Å; Y431-K433 PolarHBondContact O-N 3.13Å
432	P	30	Very low	30.4	Very low	96 Å²	96	124.2 Å²	124.2	62%	0.623	67%	0.665	S	S	*	*			trans	-71.6	119.6	156.1	11	3.5	0	0	0	107.1	P430 V434	P430-P432 WeakPolarHBondContact O-CD 3.47Å; P432-V434 VanDerWaalsContact C-N 3.33Å; P432-V434 HydrophobicContact CB-CG2 4.3Å; P432-V434 PolarHBondContact O-N 3.31Å
433	K	27.1	Very low	31.2	Very low	203 Å²	203	123.4 Å²	123.4	88%	0.883	67%	0.668	S	S	*	*			trans	-61.5	97.3	164.3	-80.9	-176.2	175.9	-177.6	0	107.9	Y431 E435	Y431-K433 PolarHBondContact O-N 3.13Å; K433-E435 PolarHBondContact O-N 3.03Å
434	V	30.7	Very low	31.7	Very low	116 Å²	116	125.8 Å²	125.8	70%	0.703	68%	0.677	S	S	*	*			trans	-90.8	90.6	172	-175	0	0	0	0	107.8	P432 G436	P432-V434 VanDerWaalsContact C-N 3.33Å; P432-V434 HydrophobicContact CB-CG2 4.3Å; P432-V434 PolarHBondContact O-N 3.31Å; V434-G436 PolarHBondContact O-N 3.05Å
435	E	28.4	Very low	32.1	Very low	196 Å²	196	122.4 Å²	122.4	92%	0.916	65%	0.653	S	S	*	*			trans	-79.7	91	158.3	-75.7	-178.6	179.6	0	0	107.5	K433	K433-E435 PolarHBondContact O-N 3.03Å
436	G	29.1	Very low	32.4	Very low	52 Å²	52	122.7 Å²	122.7	54%	0.536	65%	0.649	S	S	.	*	S	Bend	trans	-168	128.8	178.7	0	0	0	0	0	112.2	V434 V438	V434-G436 PolarHBondContact O-N 3.05Å; G436-V438 PolarHBondContact O-N 3.44Å
437	K	30.4	Very low	32.8	Very low	212 Å²	212	121.7 Å²	121.7	92%	0.922	65%	0.653	S	S	*	*			trans	-45.6	127.3	178.8	-89.8	174.2	171.7	174.6	0	111.5	A439	K437-A439 PolarHBondContact O-N 2.74Å
438	V	30.3	Very low	33.1	Very low	135 Å²	135	122.5 Å²	122.5	82%	0.818	65%	0.65	S	S	*	*			trans	-51	105	174.5	-176.9	0	0	0	0	109.6	G436	G436-V438 PolarHBondContact O-N 3.44Å
439	A	32.6	Very low	33.7	Very low	74 Å²	74	120 Å²	120	61%	0.612	63%	0.634	S	S	*	*			trans	-69.4	137.7	169.8	0	0	0	0	0	109.1	K437 L441	K437-A439 PolarHBondContact O-N 2.74Å; A439-L441 PolarHBondContact O-N 3.31Å
440	S	35.9	Very low	34.3	Very low	74 Å²	74	116.5 Å²	116.5	52%	0.517	64%	0.637	S	S	.	*			trans	-55.4	125.8	176.2	172.1	0	0	0	0	110.6	D442 S443	S440-D442 PolarHBondContact O-N 2.83Å; S440-D442 VanDerWaalsContact O-N 3.16Å; S440-D442 PolarHBondContact OG-OD2 3.43Å; S440-S443 PolarHBondContact O-OG 3.26Å
441	L	35.8	Very low	34.6	Very low	97 Å²	97	115 Å²	115	51%	0.508	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.5	-23.4	-176.6	-155.6	77.5	0	0	0	113	A439 S443 L444 L445	A439-L441 PolarHBondContact O-N 3.31Å; L441-S443 VanDerWaalsContact C-N 3.28Å; L441-S443 PolarHBondContact O-N 2.95Å; L441-L444 PolarHBondContact O-N 2.71Å; L441-L445 HydrophobicContact CD2-CD1 3.79Å; L441-L445 HydrophobicContact CG-CD1 3.94Å; L441-L445 HydrophobicContact CG-CG 4.46Å; L441-L445 PolarHBondContact O-N 3.43Å
442	D	39.5	Very low	34.9	Very low	113 Å²	113	107.1 Å²	107.1	60%	0.604	60%	0.596	S	S	*	*	H	α-helix	trans	-59.7	-37.2	-174.3	-63.2	-33.9	0	0	0	112.3	S440 L444 L445 E446	S440-D442 PolarHBondContact O-N 2.83Å; S440-D442 VanDerWaalsContact O-N 3.16Å; S440-D442 PolarHBondContact OG-OD2 3.43Å; D442-L444 PolarHBondContact O-N 3.17Å; D442-L445 PolarHBondContact O-N 3.25Å; D442-E446 PolarHBondContact O-N 3.35Å
443	S	42	Very low	35.2	Very low	84 Å²	84	106.8 Å²	106.8	59%	0.587	60%	0.596	S	S	*	*	H	α-helix	trans	-69.6	-29.5	-179.8	61.6	0	0	0	0	114.1	S440 L441	S440-S443 PolarHBondContact O-OG 3.26Å; L441-S443 VanDerWaalsContact C-N 3.28Å; L441-S443 PolarHBondContact O-N 2.95Å
444	L	37.4	Very low	35.7	Very low	118 Å²	118	101.8 Å²	101.8	62%	0.618	59%	0.586	S	S	*	*	H	α-helix	trans	-81.1	-24.5	179.5	-87.2	157.4	0	0	0	112.3	L441 D442 Y448	L441-L444 PolarHBondContact O-N 2.71Å; D442-L444 PolarHBondContact O-N 3.17Å; L444-Y448 WeakPolarHBondContact O-CD2 3.39Å; L444-Y448 WeakPolarHBondContact O-CE2 2.97Å
445	L	37.8	Very low	35.9	Very low	39 Å²	39	99.1 Å²	99.1	20%	0.204	57%	0.571	C	S	.	*	H	α-helix	trans	-96	-14	-176.8	-66.7	175.7	0	0	0	113.6	L441 D442 P447 Y448 H449	L441-L445 HydrophobicContact CD2-CD1 3.79Å; L441-L445 HydrophobicContact CG-CD1 3.94Å; L441-L445 HydrophobicContact CG-CG 4.46Å; L441-L445 PolarHBondContact O-N 3.43Å; D442-L445 PolarHBondContact O-N 3.25Å; L445-P447 VanDerWaalsContact C-CD 3.44Å; L445-Y448 CarbonylContact O-C 3.58Å; L445-Y448 WeakPolarHBondContact O-CA 3.13Å; L445-Y448 PolarHBondContact O-N 3.36Å; L445-H449 PolarHBondContact O-CD2 2.92Å; L445-H449 PolarHBondContact O-N 3.22Å
446	E	39.9	Very low	35.8	Very low	152 Å²	152	92.3 Å²	92.3	71%	0.71	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-50.5	-45.2	-179.7	-152.9	-166.6	-163.7	0	0	113.9	D442 Y448	D442-E446 PolarHBondContact O-N 3.35Å; E446-Y448 PolarHBondContact O-N 2.93Å; E446-Y448 VanDerWaalsContact O-N 3.17Å
447	P	40.5	Very low	36.1	Very low	92 Å²	92	93 Å²	93	60%	0.597	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-65.8	-21.3	178	-18.4	31.8	0	0	0	113.5	L445	L445-P447 VanDerWaalsContact C-CD 3.44Å
448	Y	37.6	Very low	36.3	Very low	119 Å²	119	89.6 Å²	89.6	47%	0.467	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-101.9	-15.2	-171.3	-55.7	-77.9	0	0	0	113.1	L444 L445 E446 A450 T451 I452	L444-Y448 WeakPolarHBondContact O-CD2 3.39Å; L444-Y448 WeakPolarHBondContact O-CE2 2.97Å; L445-Y448 CarbonylContact O-C 3.58Å; L445-Y448 WeakPolarHBondContact O-CA 3.13Å; L445-Y448 PolarHBondContact O-N 3.36Å; E446-Y448 PolarHBondContact O-N 2.93Å; E446-Y448 VanDerWaalsContact O-N 3.17Å; Y448-A450 VanDerWaalsContact C-N 3.26Å; Y448-A450 PolarHBondContact O-N 2.99Å; Y448-T451 PolarHBondContact O-N 3.21Å; Y448-T451 VanDerWaalsContact O-N 3.09Å; Y448-I452 WeakPolarHBondContact O-CG1 3.46Å; Y448-I452 PolarHBondContact O-N 3.07Å
449	H	39.1	Very low	36.4	Very low	97 Å²	97	86.7 Å²	86.7	45%	0.449	52%	0.521	S	S	.	.	H	α-helix	trans	-56.7	-36.2	-177.9	-98.6	-70.3	0	0	0	113.6	L445 S453	L445-H449 PolarHBondContact O-CD2 2.92Å; L445-H449 PolarHBondContact O-N 3.22Å; H449-S453 WeakPolarHBondContact O-CB 3.39Å; H449-S453 PolarHBondContact O-N 3.34Å; H449-S453 PolarHBondContact O-OG 2.72Å
450	A	39.8	Very low	36.1	Very low	77 Å²	77	85.4 Å²	85.4	64%	0.636	51%	0.507	S	S	*	.	H	α-helix	trans	-67	-42.9	177	0	0	0	0	0	112.1	Y448 S454	Y448-A450 VanDerWaalsContact C-N 3.26Å; Y448-A450 PolarHBondContact O-N 2.99Å; A450-S454 PolarHBondContact O-N 3.46Å; A450-S454 VanDerWaalsContact O-N 3.15Å
451	T	36.8	Very low	35.8	Very low	76 Å²	76	86.9 Å²	86.9	47%	0.466	52%	0.518	S	S	.	.	H	α-helix	trans	-70.5	-36.4	178.4	-49.8	0	0	0	0	111.8	Y448 S454 V455	Y448-T451 PolarHBondContact O-N 3.21Å; Y448-T451 VanDerWaalsContact O-N 3.09Å; T451-S454 PolarHBondContact O-OG 3.14Å; T451-S454 VanDerWaalsContact O-OG 3.08Å; T451-V455 WeakPolarHBondContact O-CG2 3.38Å
452	I	32.5	Very low	35.6	Very low	28 Å²	28	84.5 Å²	84.5	14%	0.144	51%	0.507	C	S	.	.	H	α-helix	trans	-68.6	-42.4	176.3	-65.7	166.5	0	0	0	110.4	Y448 S454 V455 M456 L472	Y448-I452 WeakPolarHBondContact O-CG1 3.46Å; Y448-I452 PolarHBondContact O-N 3.07Å; I452-S454 VanDerWaalsContact C-N 3.31Å; I452-S454 PolarHBondContact O-N 2.95Å; I452-V455 PolarHBondContact O-N 2.76Å; I452-M456 HydrophobicContact CG2-SD 4.06Å; I452-M456 WeakPolarHBondContact O-CG 3.36Å; I452-M456 PolarHBondContact O-N 3.27Å; I452-L472 HydrophobicContact CD1-CD2 4.19Å; I452-L472 HydrophobicContact CG1-CD2 3.88Å
453	S	35.6	Very low	35	Very low	89 Å²	89	90.1 Å²	90.1	62%	0.622	52%	0.52	S	S	*	.	H	α-helix	trans	-68.1	-28.2	179.1	-62.2	0	0	0	0	113.4	H449	H449-S453 WeakPolarHBondContact O-CB 3.39Å; H449-S453 PolarHBondContact O-N 3.34Å; H449-S453 PolarHBondContact O-OG 2.72Å
454	S	37.7	Very low	34.3	Very low	97 Å²	97	91.9 Å²	91.9	68%	0.678	51%	0.514	S	S	*	.	H	α-helix	trans	-78.2	-23.9	-179.4	72.4	0	0	0	0	113.8	A450 T451 I452	A450-S454 PolarHBondContact O-N 3.46Å; A450-S454 VanDerWaalsContact O-N 3.15Å; T451-S454 PolarHBondContact O-OG 3.14Å; T451-S454 VanDerWaalsContact O-OG 3.08Å; I452-S454 VanDerWaalsContact C-N 3.31Å; I452-S454 PolarHBondContact O-N 2.95Å
455	V	35	Very low	33.8	Very low	61 Å²	61	89.6 Å²	89.6	37%	0.37	51%	0.512	S	S	.	.	H	α-helix	trans	-92.4	-28.3	-178.2	178.8	0	0	0	0	111.9	T451 I452	T451-V455 WeakPolarHBondContact O-CG2 3.38Å; I452-V455 PolarHBondContact O-N 2.76Å
456	M	26.5	Very low	33.3	Very low	52 Å²	52	96.1 Å²	96.1	26%	0.256	54%	0.544	S	S	.	.	S	Bend	trans	-89.8	122.8	-174	-63.9	-162.3	78.6	0	0	112.2	I452 C460 V462	I452-M456 HydrophobicContact CG2-SD 4.06Å; I452-M456 WeakPolarHBondContact O-CG 3.36Å; I452-M456 PolarHBondContact O-N 3.27Å; M456-C460 HydrophobicContact CE-CB 3.28Å; M456-V462 HydrophobicContact CE-CG2 3.77Å
457	S	35	Very low	32.7	Very low	66 Å²	66	91.6 Å²	91.6	46%	0.462	53%	0.527	S	S	.	.			trans	-54.3	144.2	164	162.4	0	0	0	0	110	S459 C460	S457-S459 PolarHBondContact O-N 3.03Å; S457-S459 PolarHBondContact OG-OG 2.8Å; S457-S459 VanDerWaalsContact OG-OG 3.06Å; S457-C460 PolarHBondContact O-N 3.2Å
458	P	36	Very low	32.4	Very low	142 Å²	142	95.9 Å²	95.9	92%	0.922	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-6.9	-178.8	-25.1	32.6	0	0	0	116.2
459	S	30.6	Very low	32.3	Very low	74 Å²	74	96 Å²	96	52%	0.517	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	11.2	-173.4	43.8	0	0	0	0	114.8	S457	S457-S459 PolarHBondContact O-N 3.03Å; S457-S459 PolarHBondContact OG-OG 2.8Å; S457-S459 VanDerWaalsContact OG-OG 3.06Å
460	C	27.9	Very low	32.2	Very low	47 Å²	47	95.1 Å²	95.1	32%	0.318	55%	0.546	S	S	.	.			trans	-104.5	123.2	175.6	-66.4	0	0	0	0	112.1	M456 S457	M456-C460 HydrophobicContact CE-CB 3.28Å; S457-C460 PolarHBondContact O-N 3.2Å
461	S	29.9	Very low	32.3	Very low	105 Å²	105	94.4 Å²	94.4	73%	0.734	53%	0.531	S	S	*	.			trans	-112	116.4	172	62.3	0	0	0	0	110.6
462	V	30.3	Very low	32.6	Very low	47 Å²	47	93.8 Å²	93.8	29%	0.285	52%	0.524	S	S	.	.			trans	-101.4	121.4	171.5	-177.1	0	0	0	0	108.3	M456 Y464	M456-V462 HydrophobicContact CE-CG2 3.77Å; V462-Y464 HydrophobicContact CB-CE2 4.42Å; V462-Y464 HydrophobicContact CG1-CD1 4.27Å; V462-Y464 HydrophobicContact CG1-CE1 4Å; V462-Y464 HydrophobicContact CG1-CE2 4.45Å
463	R	26.7	Very low	33.1	Very low	230 Å²	230	95.7 Å²	95.7	87%	0.868	54%	0.537	S	S	*	.			trans	-93.7	111.4	168.8	-77.9	-172.5	-178.2	-176.3	1.3	108.6	A465	R463-A465 PolarHBondContact O-N 3.31Å
464	Y	28.8	Very low	33.3	Very low	122 Å²	122	93.3 Å²	93.3	48%	0.478	52%	0.517	S	S	.	.			trans	-77	112.9	178.6	-57.5	-85.1	0	0	0	109.9	V462	V462-Y464 HydrophobicContact CB-CE2 4.42Å; V462-Y464 HydrophobicContact CG1-CD1 4.27Å; V462-Y464 HydrophobicContact CG1-CE1 4Å; V462-Y464 HydrophobicContact CG1-CE2 4.45Å
465	A	26.1	Very low	33.5	Very low	69 Å²	69	90.9 Å²	90.9	57%	0.57	50%	0.496	S	S	*	.			trans	-112.5	110	162.2	0	0	0	0	0	107.2	R463 V467	R463-A465 PolarHBondContact O-N 3.31Å; A465-V467 PolarHBondContact O-N 2.84Å
466	M	26.2	Very low	33.9	Very low	176 Å²	176	90.1 Å²	90.1	87%	0.867	49%	0.49	S	S	*	.			trans	32.2	72.9	174.6	-71.8	-166.7	176.9	0	0	115.2	Y468	M466-Y468 PolarHBondContact O-N 3.29Å
467	V	29.1	Very low	34.7	Very low	58 Å²	58	88 Å²	88	35%	0.352	48%	0.48	S	S	.	.			trans	-88.1	96.3	169.3	-176.7	0	0	0	0	107.1	A465 L470 F494	A465-V467 PolarHBondContact O-N 2.84Å; V467-L470 HydrophobicContact CG1-CB 4.14Å; V467-F494 HydrophobicContact CG2-CE2 3.96Å; V467-F494 HydrophobicContact CG2-CZ 4.21Å
468	Y	33.5	Very low	35.2	Very low	182 Å²	182	86.4 Å²	86.4	71%	0.714	47%	0.466	S	S	*	.			trans	-48.6	148.7	154	-89.7	-88.6	0	0	0	108.3	M466 L470	M466-Y468 PolarHBondContact O-N 3.29Å; Y468-L470 PolarHBondContact O-N 3.21Å
469	P	35.9	Very low	35.6	Very low	121 Å²	121	80.9 Å²	80.9	79%	0.786	43%	0.429	S	S	*	.			trans	-68.9	73.8	-158.9	31.4	-35.9	0	0	0	111.3	N471	P469-N471 PolarHBondContact O-N 3.39Å
470	L	35.6	Very low	36.4	Very low	79 Å²	79	80.5 Å²	80.5	41%	0.414	42%	0.42	S	S	.	.			trans	-61.1	110.4	157.6	-102.1	109.2	0	0	0	103.9	V467 Y468 L472 I474	V467-L470 HydrophobicContact CG1-CB 4.14Å; Y468-L470 PolarHBondContact O-N 3.21Å; L470-L472 PolarHBondContact O-N 2.81Å; L470-I474 HydrophobicContact CD2-CG2 4.44Å
471	N	43.4	Very low	37	Very low	62 Å²	62	78.9 Å²	78.9	33%	0.332	41%	0.408	S	S	.	.			trans	-35.9	113.9	177.1	-161.7	-24.7	0	0	0	108.9	P469 T473 I474	P469-N471 PolarHBondContact O-N 3.39Å; N471-T473 PolarHBondContact O-N 3.34Å; N471-T473 WeakPolarHBondContact OD1-CB 3.34Å; N471-T473 PolarHBondContact OD1-OG1 3.32Å; N471-I474 HydrophobicContact CB-CD1 4.13Å; N471-I474 HydrophobicContact CB-CG1 4.31Å; N471-I474 WeakPolarHBondContact O-CB 3.41Å; N471-I474 PolarHBondContact O-N 2.92Å
472	L	42.6	Very low	37.6	Very low	62 Å²	62	74.2 Å²	74.2	33%	0.325	38%	0.375	S	S	.	.	H	α-helix	trans	-49.9	-26.5	-177	-126	110.9	0	0	0	111.7	I452 L470 I474 M475 N476	I452-L472 HydrophobicContact CD1-CD2 4.19Å; I452-L472 HydrophobicContact CG1-CD2 3.88Å; L470-L472 PolarHBondContact O-N 2.81Å; L472-I474 PolarHBondContact O-N 3.4Å; L472-M475 WeakPolarHBondContact O-CB 3.49Å; L472-M475 PolarHBondContact O-N 2.76Å; L472-N476 PolarHBondContact O-N 3.09Å
473	T	42.2	Very low	38.1	Very low	68 Å²	68	76.1 Å²	76.1	42%	0.417	39%	0.387	S	S	.	.	H	α-helix	trans	-58.3	-39.5	172.8	-39.4	0	0	0	0	113.7	N471 N476 S477 L625	N471-T473 PolarHBondContact O-N 3.34Å; N471-T473 WeakPolarHBondContact OD1-CB 3.34Å; N471-T473 PolarHBondContact OD1-OG1 3.32Å; T473-N476 PolarHBondContact O-N 2.99Å; T473-S477 VanDerWaalsContact O-CB 3.31Å; T473-S477 WeakPolarHBondContact O-CB 3.39Å; T473-S477 PolarHBondContact O-N 3.42Å; T473-L625 HydrophobicContact CG2-CB 4.17Å; T473-L625 HydrophobicContact CG2-CD1 3.68Å
474	I	41.5	Very low	38.9	Very low	39 Å²	39	68 Å²	68	20%	0.2	37%	0.37	C	S	.	.	H	α-helix	trans	-64.3	-45.6	173.9	-67.7	168.6	0	0	0	109.6	L470 N471 L472 S477 L478 L625	L470-I474 HydrophobicContact CD2-CG2 4.44Å; N471-I474 HydrophobicContact CB-CD1 4.13Å; N471-I474 HydrophobicContact CB-CG1 4.31Å; N471-I474 WeakPolarHBondContact O-CB 3.41Å; N471-I474 PolarHBondContact O-N 2.92Å; L472-I474 PolarHBondContact O-N 3.4Å; I474-S477 PolarHBondContact O-N 3.34Å; I474-L478 HydrophobicContact CG2-CD1 3.85Å; I474-L478 VanDerWaalsContact O-CB 3.31Å; I474-L478 WeakPolarHBondContact O-CB 3.48Å; I474-L478 PolarHBondContact O-N 3.28Å; I474-L625 HydrophobicContact CG1-CD1 4.02Å; I474-L625 HydrophobicContact CG1-CD2 3.63Å
475	M	40.5	Very low	39.6	Very low	47 Å²	47	63.5 Å²	63.5	23%	0.232	35%	0.352	C	S	.	.	H	α-helix	trans	-63.2	-43.7	176.5	-80.7	-74.3	-79.4	0	0	111.8	L472 L478 V479	L472-M475 WeakPolarHBondContact O-CB 3.49Å; L472-M475 PolarHBondContact O-N 2.76Å; M475-L478 VanDerWaalsContact O-CB 3.28Å; M475-L478 WeakPolarHBondContact O-CB 3.47Å; M475-L478 PolarHBondContact O-N 3.22Å; M475-V479 VanDerWaalsContact O-CG2 3.29Å; M475-V479 WeakPolarHBondContact O-CG2 3.49Å; M475-V479 PolarHBondContact O-N 3.39Å
476	N	44.5	Very low	40.2	Very low	45 Å²	45	62.6 Å²	62.6	24%	0.241	35%	0.349	C	S	.	.	H	α-helix	trans	-62.7	-44.9	176	-74.4	-16	0	0	0	111.6	L472 T473 L478 V479 E480	L472-N476 PolarHBondContact O-N 3.09Å; T473-N476 PolarHBondContact O-N 2.99Å; N476-L478 VanDerWaalsContact C-N 3.28Å; N476-L478 PolarHBondContact O-N 3.02Å; N476-V479 PolarHBondContact O-N 2.87Å; N476-E480 WeakPolarHBondContact O-CB 3.44Å; N476-E480 WeakPolarHBondContact O-CG 3.41Å; N476-E480 PolarHBondContact O-N 3.22Å
477	S	43	Very low	40.8	Very low	6 Å²	6	56.2 Å²	56.2	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-60.5	-39.6	175	-178.8	0	0	0	0	111.5	T473 I474 T481	T473-S477 VanDerWaalsContact O-CB 3.31Å; T473-S477 WeakPolarHBondContact O-CB 3.39Å; T473-S477 PolarHBondContact O-N 3.42Å; I474-S477 PolarHBondContact O-N 3.34Å; S477-T481 VanDerWaalsContact O-CB 3.23Å; S477-T481 WeakPolarHBondContact O-CB 3.28Å; S477-T481 PolarHBondContact O-N 3.43Å; S477-T481 PolarHBondContact O-OG1 3.06Å
478	L	44.2	Very low	41.4	Very low	34 Å²	34	59 Å²	59	18%	0.178	34%	0.335	C	S	.	.	H	α-helix	trans	-61.8	-53.4	173.7	-98	154	0	0	0	112.3	I474 M475 N476 E480 T481 V482 F519	I474-L478 HydrophobicContact CG2-CD1 3.85Å; I474-L478 VanDerWaalsContact O-CB 3.31Å; I474-L478 WeakPolarHBondContact O-CB 3.48Å; I474-L478 PolarHBondContact O-N 3.28Å; M475-L478 VanDerWaalsContact O-CB 3.28Å; M475-L478 WeakPolarHBondContact O-CB 3.47Å; M475-L478 PolarHBondContact O-N 3.22Å; N476-L478 VanDerWaalsContact C-N 3.28Å; N476-L478 PolarHBondContact O-N 3.02Å; L478-E480 PolarHBondContact O-N 3.24Å; L478-T481 WeakPolarHBondContact O-CB 3.33Å; L478-T481 PolarHBondContact O-N 2.9Å; L478-V482 WeakPolarHBondContact O-CB 3.46Å; L478-V482 WeakPolarHBondContact O-CG2 3.37Å; L478-V482 PolarHBondContact O-N 3.35Å; L478-F519 HydrophobicContact CD2-CD1 4.21Å; L478-F519 HydrophobicContact CD2-CE1 3.15Å; L478-F519 HydrophobicContact CD2-CE2 3.81Å; L478-F519 HydrophobicContact CD2-CZ 2.92Å; L478-F519 HydrophobicContact CG-CZ 4.42Å
479	V	45.7	Very low	41.6	Very low	25 Å²	25	58.4 Å²	58.4	15%	0.152	33%	0.331	C	S	.	.	H	α-helix	trans	-59.7	-46.9	179.7	171.5	0	0	0	0	110.4	M475 N476 T481 V482 T483 F490	M475-V479 VanDerWaalsContact O-CG2 3.29Å; M475-V479 WeakPolarHBondContact O-CG2 3.49Å; M475-V479 PolarHBondContact O-N 3.39Å; N476-V479 PolarHBondContact O-N 2.87Å; V479-T481 VanDerWaalsContact C-N 3.33Å; V479-T481 PolarHBondContact O-N 3.07Å; V479-V482 PolarHBondContact O-N 3.2Å; V479-T483 WeakPolarHBondContact O-CB 3.38Å; V479-T483 PolarHBondContact O-N 3.08Å; V479-T483 PolarHBondContact O-OG1 3.17Å; V479-F490 HydrophobicContact CG2-CZ 4.21Å
480	E	46.1	Very low	41.6	Very low	67 Å²	67	55 Å²	55	31%	0.313	30%	0.304	S	S	.	.	H	α-helix	trans	-63	-38.8	177.1	-74.8	177.5	166.8	0	0	112.4	N476 L478 V482 T483 A484 K629	N476-E480 WeakPolarHBondContact O-CB 3.44Å; N476-E480 WeakPolarHBondContact O-CG 3.41Å; N476-E480 PolarHBondContact O-N 3.22Å; L478-E480 PolarHBondContact O-N 3.24Å; E480-V482 VanDerWaalsContact C-N 3.35Å; E480-T483 PolarHBondContact O-N 3.04Å; E480-A484 WeakPolarHBondContact O-CB 3.37Å; E480-A484 PolarHBondContact O-N 2.87Å; E480-K629 IonicContact OE1-NZ 2.85Å; E480-K629 PolarHBondContact OE1-NZ 2.71Å; E480-K629 WeakPolarHBondContact OE2-CD 3.49Å; E480-K629 WeakPolarHBondContact OE2-CE 3.24Å; E480-K629 IonicContact OE2-NZ 3Å; E480-K629 PolarHBondContact OE2-NZ 2.97Å
481	T	41.6	Very low	41.5	Very low	12 Å²	12	54.1 Å²	54.1	7%	0.074	30%	0.304	C	S	.	.	H	α-helix	trans	-63.1	-45.5	176.3	-61.6	0	0	0	0	110.3	S477 L478 V479 T483 A484 F485 R632	S477-T481 VanDerWaalsContact O-CB 3.23Å; S477-T481 WeakPolarHBondContact O-CB 3.28Å; S477-T481 PolarHBondContact O-N 3.43Å; S477-T481 PolarHBondContact O-OG1 3.06Å; L478-T481 WeakPolarHBondContact O-CB 3.33Å; L478-T481 PolarHBondContact O-N 2.9Å; V479-T481 VanDerWaalsContact C-N 3.33Å; V479-T481 PolarHBondContact O-N 3.07Å; T481-T483 PolarHBondContact O-N 3.2Å; T481-A484 PolarHBondContact O-N 3.5Å; T481-F485 HydrophobicContact CG2-CD2 3.64Å; T481-F485 HydrophobicContact CG2-CE2 3.32Å; T481-F485 HydrophobicContact CG2-CZ 4.46Å; T481-F485 WeakPolarHBondContact O-CD2 3.26Å; T481-F485 WeakPolarHBondContact O-CG 3.47Å; T481-F485 PolarHBondContact O-N 3.09Å; T481-R632 VanDerWaalsContact OG1-CD 3.29Å; T481-R632 WeakPolarHBondContact OG1-CD 3.49Å; T481-R632 PolarHBondContact OG1-NH1 2.73Å
482	V	41.3	Very low	41.2	Very low	8 Å²	8	52.6 Å²	52.6	5%	0.048	30%	0.297	C	S	.	.	H	α-helix	trans	-63.8	-41.7	177.6	173.3	0	0	0	0	110.7	L478 V479 E480 F485 G486 F487 F490 F519	L478-V482 WeakPolarHBondContact O-CB 3.46Å; L478-V482 WeakPolarHBondContact O-CG2 3.37Å; L478-V482 PolarHBondContact O-N 3.35Å; V479-V482 PolarHBondContact O-N 3.2Å; E480-V482 VanDerWaalsContact C-N 3.35Å; V482-F485 PolarHBondContact O-N 3.27Å; V482-G486 PolarHBondContact O-N 3.15Å; V482-F487 HydrophobicContact CB-CD2 4.41Å; V482-F487 HydrophobicContact CG1-CB 3.36Å; V482-F487 HydrophobicContact CG1-CD2 3.84Å; V482-F487 HydrophobicContact CG1-CG 3.87Å; V482-F487 WeakPolarHBondContact O-CB 3.36Å; V482-F487 VanDerWaalsContact O-CD2 3.3Å; V482-F487 WeakPolarHBondContact O-CD2 3.39Å; V482-F487 PolarHBondContact O-N 3.04Å; V482-F487 VanDerWaalsContact O-N 3.07Å; V482-F490 HydrophobicContact CB-CE1 4.14Å; V482-F490 HydrophobicContact CB-CZ 4.38Å; V482-F490 HydrophobicContact CG1-CD1 3.35Å; V482-F490 HydrophobicContact CG1-CE1 3.3Å; V482-F490 HydrophobicContact CG1-CE2 4.5Å; V482-F490 HydrophobicContact CG1-CG 4.02Å; V482-F490 HydrophobicContact CG1-CZ 3.91Å; V482-F519 HydrophobicContact CG2-CZ 4.4Å
483	T	42.5	Very low	40.7	Very low	87 Å²	87	56.4 Å²	56.4	53%	0.534	31%	0.313	S	S	.	.	H	α-helix	trans	-68.1	-40.3	177	-43.4	0	0	0	0	111.4	V479 E480 T481 F485 G486	V479-T483 WeakPolarHBondContact O-CB 3.38Å; V479-T483 PolarHBondContact O-N 3.08Å; V479-T483 PolarHBondContact O-OG1 3.17Å; E480-T483 PolarHBondContact O-N 3.04Å; T481-T483 PolarHBondContact O-N 3.2Å; T483-F485 PolarHBondContact O-N 3.36Å; T483-G486 PolarHBondContact O-N 3.07Å
484	A	43.6	Very low	40.3	Very low	60 Å²	60	55.9 Å²	55.9	50%	0.496	31%	0.305	S	S	.	.	H	α-helix	trans	-65.2	-28.8	176.3	0	0	0	0	0	112.4	E480 T481 G486	E480-A484 WeakPolarHBondContact O-CB 3.37Å; E480-A484 PolarHBondContact O-N 2.87Å; T481-A484 PolarHBondContact O-N 3.5Å; A484-G486 VanDerWaalsContact C-N 3.27Å
485	F	43.5	Very low	39.7	Very low	27 Å²	27	60.3 Å²	60.3	12%	0.118	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	4.7	171.6	-70.8	-55.5	0	0	0	114.1	T481 V482 T483 F487 F588 V636 H697 V698	T481-F485 HydrophobicContact CG2-CD2 3.64Å; T481-F485 HydrophobicContact CG2-CE2 3.32Å; T481-F485 HydrophobicContact CG2-CZ 4.46Å; T481-F485 WeakPolarHBondContact O-CD2 3.26Å; T481-F485 WeakPolarHBondContact O-CG 3.47Å; T481-F485 PolarHBondContact O-N 3.09Å; V482-F485 PolarHBondContact O-N 3.27Å; T483-F485 PolarHBondContact O-N 3.36Å; F485-F487 HydrophobicContact CB-CD2 3.75Å; F485-F487 HydrophobicContact CB-CE2 3.68Å; F485-F588 AromaticContact CE1-CE2 3.88Å; F485-F588 HydrophobicContact CE1-CE2 3.88Å; F485-F588 AromaticContact CE1-CZ 3.65Å; F485-F588 HydrophobicContact CE1-CZ 3.65Å; F485-F588 HydrophobicContact CZ-CE2 4.4Å; F485-F588 HydrophobicContact CZ-CZ 4.06Å; F485-V636 HydrophobicContact CE1-CG2 4.47Å; F485-H697 PolarHBondContact O-CE1 3.44Å; F485-V698 HydrophobicContact CD1-CG2 4.11Å; F485-V698 HydrophobicContact CE1-CG2 4.07Å
486	G	38.6	Very low	39.2	Very low	49 Å²	49	63.7 Å²	63.7	51%	0.505	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	11.7	174	0	0	0	0	0	115.3	V482 T483 A484 T488	V482-G486 PolarHBondContact O-N 3.15Å; T483-G486 PolarHBondContact O-N 3.07Å; A484-G486 VanDerWaalsContact C-N 3.27Å; G486-T488 PolarHBondContact O-N 3.34Å
487	F	38.6	Very low	38.5	Very low	42 Å²	42	65.7 Å²	65.7	18%	0.184	35%	0.349	C	S	.	.			trans	-77	111.4	176.8	-65.7	-77.8	0	0	0	110.4	V482 F485 H697	V482-F487 HydrophobicContact CB-CD2 4.41Å; V482-F487 HydrophobicContact CG1-CB 3.36Å; V482-F487 HydrophobicContact CG1-CD2 3.84Å; V482-F487 HydrophobicContact CG1-CG 3.87Å; V482-F487 WeakPolarHBondContact O-CB 3.36Å; V482-F487 VanDerWaalsContact O-CD2 3.3Å; V482-F487 WeakPolarHBondContact O-CD2 3.39Å; V482-F487 PolarHBondContact O-N 3.04Å; V482-F487 VanDerWaalsContact O-N 3.07Å; F485-F487 HydrophobicContact CB-CD2 3.75Å; F485-F487 HydrophobicContact CB-CE2 3.68Å; F487-H697 AromaticContact CE1-CE1 3.65Å; F487-H697 AromaticContact CE1-NE2 3.56Å; F487-H697 AromaticContact CE2-CE1 3.82Å; F487-H697 AromaticContact CZ-CE1 3.38Å; F487-H697 WeakPolarHBondContact CZ-CE1 3.47Å; F487-H697 AromaticContact CZ-CG 3.96Å; F487-H697 AromaticContact CZ-ND1 3.54Å; F487-H697 AromaticContact CZ-NE2 3.74Å
488	T	41	Very low	37.8	Very low	118 Å²	118	73.1 Å²	73.1	72%	0.724	38%	0.383	S	S	*	.			trans	-90.6	-15.5	-179.4	53.2	0	0	0	0	114.3	G486	G486-T488 PolarHBondContact O-N 3.34Å
489	R	37.3	Very low	37.5	Very low	169 Å²	169	78.4 Å²	78.4	64%	0.638	41%	0.407	S	S	*	.			trans	-145.9	130.6	177.4	-70.7	-176.9	179.2	168.1	0	110.4	P513	R489-P513 HydrophobicContact CB-CG 4.07Å; R489-P513 VanDerWaalsContact O-CD 3.29Å; R489-P513 WeakPolarHBondContact O-CD 3.44Å
490	F	36.2	Very low	36.8	Very low	49 Å²	49	83.1 Å²	83.1	22%	0.215	43%	0.431	C	S	.	.			trans	-152.3	148.6	171.5	55.6	-83.8	0	0	0	110.5	V479 V482 V492	V479-F490 HydrophobicContact CG2-CZ 4.21Å; V482-F490 HydrophobicContact CB-CE1 4.14Å; V482-F490 HydrophobicContact CB-CZ 4.38Å; V482-F490 HydrophobicContact CG1-CD1 3.35Å; V482-F490 HydrophobicContact CG1-CE1 3.3Å; V482-F490 HydrophobicContact CG1-CE2 4.5Å; V482-F490 HydrophobicContact CG1-CG 4.02Å; V482-F490 HydrophobicContact CG1-CZ 3.91Å; F490-V492 HydrophobicContact CD2-CG2 3.89Å; F490-V492 HydrophobicContact CE2-CG2 4.06Å
491	S	34.2	Very low	36.4	Very low	60 Å²	60	88.6 Å²	88.6	42%	0.42	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127.8	168.6	50.9	0	0	0	0	109.3	A510 T511	S491-A510 WeakPolarHBondContact O-CA 3.49Å; S491-T511 PolarHBondContact N-O 3.26Å; S491-T511 PolarHBondContact O-N 3.32Å; S491-T511 VanDerWaalsContact O-N 3.1Å; S491-T511 PolarHBondContact OG-OG1 3.26Å; S491-T511 VanDerWaalsContact OG-OG1 3.07Å
492	V	36.3	Very low	36	Very low	30 Å²	30	94.7 Å²	94.7	18%	0.182	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	118.6	171.9	-175.4	0	0	0	0	107.6	F490 F494 L508 A510	F490-V492 HydrophobicContact CD2-CG2 3.89Å; F490-V492 HydrophobicContact CE2-CG2 4.06Å; V492-F494 HydrophobicContact CG1-CE2 4.14Å; V492-F494 HydrophobicContact CG1-CZ 4.12Å; V492-L508 HydrophobicContact CG1-CD2 3.81Å; V492-A510 HydrophobicContact CG2-CB 4.44Å
493	Q	32.1	Very low	35.5	Very low	142 Å²	142	97.3 Å²	97.3	66%	0.664	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	132.1	169	-93.6	-174.8	-27.6	0	0	109.8	E509	Q493-E509 PolarHBondContact N-O 3.28Å; Q493-E509 VanDerWaalsContact N-O 3.09Å; Q493-E509 PolarHBondContact O-N 3.35Å
494	F	33.2	Very low	34.8	Very low	57 Å²	57	96.4 Å²	96.4	25%	0.25	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116.8	172.6	-61.4	-83	0	0	0	108.2	V467 V492 L506 L508	V467-F494 HydrophobicContact CG2-CE2 3.96Å; V467-F494 HydrophobicContact CG2-CZ 4.21Å; V492-F494 HydrophobicContact CG1-CE2 4.14Å; V492-F494 HydrophobicContact CG1-CZ 4.12Å; F494-L506 HydrophobicContact CB-CD2 4.31Å; F494-L506 HydrophobicContact CD1-CD2 3.46Å; F494-L506 VanDerWaalsContact CD1-CD2 3.46Å; F494-L506 HydrophobicContact CE1-CD2 4.19Å; F494-L506 HydrophobicContact CG-CD2 4.3Å; F494-L508 HydrophobicContact CD1-CD2 3.91Å; F494-L508 HydrophobicContact CD1-CG 4.32Å; F494-L508 HydrophobicContact CE1-CD2 3.4Å; F494-L508 HydrophobicContact CE1-CG 4.08Å; F494-L508 HydrophobicContact CZ-CD2 4.06Å
495	K	29.8	Very low	34.1	Very low	133 Å²	133	99.1 Å²	99.1	58%	0.578	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	123.3	173.3	-149.4	179.1	-177.7	-172.6	0	109	V507	K495-V507 PolarHBondContact N-O 2.7Å; K495-V507 PolarHBondContact O-N 2.59Å; K495-V507 VanDerWaalsContact O-N 3.1Å
496	L	29.1	Very low	33.3	Very low	117 Å²	117	102.7 Å²	102.7	61%	0.613	53%	0.532	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	109.4	167.9	-84.5	153.1	0	0	0	107.4
497	E	30	Very low	33	Very low	87 Å²	87	102.2 Å²	102.2	41%	0.407	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	109	164.5	-76.1	-173.1	162.3	0	0	108.1	Q499 R505	E497-Q499 PolarHBondContact O-N 3.36Å; E497-R505 PolarHBondContact N-O 3.31Å; E497-R505 PolarHBondContact O-N 2.82Å
498	Q	28.4	Very low	32.7	Very low	162 Å²	162	103.5 Å²	103.5	76%	0.757	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	110.1	164.5	-80.2	-177.8	-27	0	0	107.4
499	Q	38.9	Very low	32.2	Very low	145 Å²	145	102.6 Å²	102.6	68%	0.678	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	-26.3	170.7	-104.9	-177.5	-13.5	0	0	112.2	E497	E497-Q499 PolarHBondContact O-N 3.36Å
500	D	31.6	Very low	32.1	Very low	124 Å²	124	94.6 Å²	94.6	66%	0.663	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-161.2	163.1	171.8	-92.5	-42.2	0	0	0	110.7	T502 S503	D500-T502 PolarHBondContact O-N 2.98Å; D500-S503 PolarHBondContact O-N 3.26Å
501	L	36.4	Very low	31.9	Very low	182 Å²	182	94.3 Å²	94.3	95%	0.953	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-5.4	-175.8	-89.4	155.2	0	0	0	116
502	T	32.8	Very low	32	Very low	141 Å²	141	92.2 Å²	92.2	87%	0.865	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.9	-1.1	178.5	54.8	0	0	0	0	114.7	D500	D500-T502 PolarHBondContact O-N 2.98Å
503	S	31.6	Very low	31.9	Very low	63 Å²	63	96 Å²	96	44%	0.441	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	125.5	178.6	81.4	0	0	0	0	112.5	D500	D500-S503 PolarHBondContact O-N 3.26Å
504	S	27.3	Very low	32	Very low	68 Å²	68	93.4 Å²	93.4	48%	0.476	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.4	174.6	-61.1	0	0	0	0	108.5
505	R	28.8	Very low	31.8	Very low	116 Å²	116	93.1 Å²	93.1	44%	0.438	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	131.1	177.5	-173.2	178.8	175.8	-168.6	-4.4	109.1	E497 V507	E497-R505 PolarHBondContact N-O 3.31Å; E497-R505 PolarHBondContact O-N 2.82Å; R505-V507 HydrophobicContact CG-CG2 4.19Å
506	L	28.2	Very low	31.8	Very low	102 Å²	102	89.7 Å²	89.7	53%	0.534	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	109.5	177.4	-140	139.2	0	0	0	108.1	F494	F494-L506 HydrophobicContact CB-CD2 4.31Å; F494-L506 HydrophobicContact CD1-CD2 3.46Å; F494-L506 VanDerWaalsContact CD1-CD2 3.46Å; F494-L506 HydrophobicContact CE1-CD2 4.19Å; F494-L506 HydrophobicContact CG-CD2 4.3Å
507	V	31.6	Very low	31.9	Very low	39 Å²	39	86.2 Å²	86.2	24%	0.236	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.1	178.3	-176.5	0	0	0	0	108.9	K495 R505 E509	K495-V507 PolarHBondContact N-O 2.7Å; K495-V507 PolarHBondContact O-N 2.59Å; K495-V507 VanDerWaalsContact O-N 3.1Å; R505-V507 HydrophobicContact CG-CG2 4.19Å; V507-E509 HydrophobicContact CG1-CG 4.29Å
508	L	31.5	Very low	32.1	Very low	70 Å²	70	83.2 Å²	83.2	37%	0.366	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	102.3	173.4	-89.2	156.4	0	0	0	109.1	V492 F494	V492-L508 HydrophobicContact CG1-CD2 3.81Å; F494-L508 HydrophobicContact CD1-CD2 3.91Å; F494-L508 HydrophobicContact CD1-CG 4.32Å; F494-L508 HydrophobicContact CE1-CD2 3.4Å; F494-L508 HydrophobicContact CE1-CG 4.08Å; F494-L508 HydrophobicContact CZ-CD2 4.06Å
509	E	31.7	Very low	32.5	Very low	98 Å²	98	78.5 Å²	78.5	46%	0.458	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	110	165.5	-74.6	-175.6	170.1	0	0	108.7	Q493 V507	Q493-E509 PolarHBondContact N-O 3.28Å; Q493-E509 VanDerWaalsContact N-O 3.09Å; Q493-E509 PolarHBondContact O-N 3.35Å; V507-E509 HydrophobicContact CG1-CG 4.29Å
510	A	34.5	Very low	32.2	Very low	2 Å²	2	75.7 Å²	75.7	2%	0.017	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	111.1	164	0	0	0	0	0	107.2	S491 V492 I516 P517 A518 F519	S491-A510 WeakPolarHBondContact O-CA 3.49Å; V492-A510 HydrophobicContact CG2-CB 4.44Å; A510-I516 VanDerWaalsContact O-O 3.09Å; A510-P517 CarbonylContact O-C 3.47Å; A510-P517 VanDerWaalsContact O-CA 3.31Å; A510-P517 WeakPolarHBondContact O-CA 3.45Å; A510-A518 HydrophobicContact CB-CB 3.42Å; A510-A518 VanDerWaalsContact CB-CB 3.42Å; A510-A518 PolarHBondContact O-N 2.96Å; A510-F519 HydrophobicContact CB-CD2 4.01Å; A510-F519 HydrophobicContact CB-CE2 3.47Å; A510-F519 VanDerWaalsContact CB-CE2 3.47Å; A510-F519 HydrophobicContact CB-CZ 4.32Å
511	T	31.5	Very low	32.9	Very low	43 Å²	43	73.2 Å²	73.2	26%	0.264	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	124	176.7	39.9	0	0	0	0	109	S491	S491-T511 PolarHBondContact N-O 3.26Å; S491-T511 PolarHBondContact O-N 3.32Å; S491-T511 VanDerWaalsContact O-N 3.1Å; S491-T511 PolarHBondContact OG-OG1 3.26Å; S491-T511 VanDerWaalsContact OG-OG1 3.07Å
512	S	36.1	Very low	33.3	Very low	15 Å²	15	68.7 Å²	68.7	11%	0.105	40%	0.4	C	S	.	.			trans	-68.2	165	162.8	80.4	0	0	0	0	109.4	V514 G515 I516	S512-V514 PolarHBondContact O-N 2.77Å; S512-V514 PolarHBondContact OG-N 2.85Å; S512-V514 VanDerWaalsContact OG-N 3.11Å; S512-G515 PolarHBondContact O-N 2.66Å; S512-I516 PolarHBondContact N-O 3.14Å; S512-I516 PolarHBondContact OG-N 3.08Å
513	P	34.3	Very low	34.3	Very low	110 Å²	110	66.1 Å²	66.1	71%	0.714	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-14.1	169.7	-23	32.2	0	0	0	113.6	R489	R489-P513 HydrophobicContact CB-CG 4.07Å; R489-P513 VanDerWaalsContact O-CD 3.29Å; R489-P513 WeakPolarHBondContact O-CD 3.44Å
514	V	34.9	Very low	36.2	Very low	87 Å²	87	64.2 Å²	64.2	53%	0.527	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	9.3	177.4	-165.3	0	0	0	0	111.7	S512 I516	S512-V514 PolarHBondContact O-N 2.77Å; S512-V514 PolarHBondContact OG-N 2.85Å; S512-V514 VanDerWaalsContact OG-N 3.11Å; V514-I516 VanDerWaalsContact C-N 3.28Å; V514-I516 HydrophobicContact CB-CD1 4.41Å; V514-I516 HydrophobicContact CB-CG1 4.43Å; V514-I516 HydrophobicContact CG1-CD1 4.39Å; V514-I516 PolarHBondContact O-N 3.36Å
515	G	28.5	Very low	38.8	Very low	52 Å²	52	62.8 Å²	62.8	54%	0.536	35%	0.353	S	S	.	.			trans	71.1	18.7	174.3	0	0	0	0	0	114.7	S512	S512-G515 PolarHBondContact O-N 2.66Å
516	I	30.5	Very low	41.4	Very low	61 Å²	61	57.2 Å²	57.2	31%	0.313	33%	0.332	S	S	.	.			trans	-88.5	125.2	179.9	-54.1	173.2	0	0	0	108.3	A510 S512 V514 A518	A510-I516 VanDerWaalsContact O-O 3.09Å; S512-I516 PolarHBondContact N-O 3.14Å; S512-I516 PolarHBondContact OG-N 3.08Å; V514-I516 VanDerWaalsContact C-N 3.28Å; V514-I516 HydrophobicContact CB-CD1 4.41Å; V514-I516 HydrophobicContact CB-CG1 4.43Å; V514-I516 HydrophobicContact CG1-CD1 4.39Å; V514-I516 PolarHBondContact O-N 3.36Å; I516-A518 PolarHBondContact O-N 3.35Å
517	P	30.4	Very low	44.2	Very low	44 Å²	44	52.5 Å²	52.5	29%	0.286	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-63.8	116.1	172.6	-11.1	23.7	0	0	0	109.1	A510 F519 T520	A510-P517 CarbonylContact O-C 3.47Å; A510-P517 VanDerWaalsContact O-CA 3.31Å; A510-P517 WeakPolarHBondContact O-CA 3.45Å; P517-F519 PolarHBondContact O-N 2.93Å; P517-T520 HydrophobicContact CB-CG2 3.81Å; P517-T520 WeakPolarHBondContact CB-OG1 3.5Å; P517-T520 HydrophobicContact CG-CG2 4.01Å; P517-T520 PolarHBondContact O-N 3.1Å; P517-T520 PolarHBondContact O-OG1 3.37Å; P517-T520 VanDerWaalsContact O-OG1 3.08Å
518	A	35.7	Very low	47	Very low	24 Å²	24	52 Å²	52	20%	0.198	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-7.6	-173.3	0	0	0	0	0	113.6	A510 I516	A510-A518 HydrophobicContact CB-CB 3.42Å; A510-A518 VanDerWaalsContact CB-CB 3.42Å; A510-A518 PolarHBondContact O-N 2.96Å; I516-A518 PolarHBondContact O-N 3.35Å
519	F	36.6	Very low	49.8	Very low	63 Å²	63	48.6 Å²	48.6	28%	0.276	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	1.2	-178.6	-57	-62.4	0	0	0	114.9	L478 V482 A510 P517 Y521	L478-F519 HydrophobicContact CD2-CD1 4.21Å; L478-F519 HydrophobicContact CD2-CE1 3.15Å; L478-F519 HydrophobicContact CD2-CE2 3.81Å; L478-F519 HydrophobicContact CD2-CZ 2.92Å; L478-F519 HydrophobicContact CG-CZ 4.42Å; V482-F519 HydrophobicContact CG2-CZ 4.4Å; A510-F519 HydrophobicContact CB-CD2 4.01Å; A510-F519 HydrophobicContact CB-CE2 3.47Å; A510-F519 VanDerWaalsContact CB-CE2 3.47Å; A510-F519 HydrophobicContact CB-CZ 4.32Å; P517-F519 PolarHBondContact O-N 2.93Å; F519-Y521 PolarHBondContact O-N 3.24Å
520	T	32.4	Very low	52.5	Low	86 Å²	86	45.8 Å²	45.8	53%	0.528	27%	0.273	S	S	.	.			trans	-74.8	80.5	163.2	49.8	0	0	0	0	107.5	P517 T522	P517-T520 HydrophobicContact CB-CG2 3.81Å; P517-T520 WeakPolarHBondContact CB-OG1 3.5Å; P517-T520 HydrophobicContact CG-CG2 4.01Å; P517-T520 PolarHBondContact O-N 3.1Å; P517-T520 PolarHBondContact O-OG1 3.37Å; P517-T520 VanDerWaalsContact O-OG1 3.08Å; T520-T522 PolarHBondContact O-N 3.08Å
521	Y	45.1	Very low	55.2	Low	72 Å²	72	50.5 Å²	50.5	28%	0.282	30%	0.298	S	S	.	.			trans	-60	113.2	170.2	-85.6	-91.7	0	0	0	107.4	F519	F519-Y521 PolarHBondContact O-N 3.24Å
522	T	45.1	Very low	58.1	Low	87 Å²	87	48.6 Å²	48.6	53%	0.534	29%	0.286	S	S	.	.			trans	-56.6	150	171.2	-18.4	0	0	0	0	108.2	T520 C524	T520-T522 PolarHBondContact O-N 3.08Å; T522-C524 PolarHBondContact O-N 3.33Å
523	I	54.1	Low	60.7	Low	87 Å²	87	48.4 Å²	48.4	45%	0.446	28%	0.284	S	S	.	.			trans	-37.5	125.8	168.4	-62.8	175.5	0	0	0	109.5	E414	E414-I523 VanDerWaalsContact CD-CG2 3.46Å; E414-I523 HydrophobicContact CG-CG2 3.33Å; E414-I523 WeakPolarHBondContact OE1-CG2 3.37Å
524	C	70.4	Confident	63.4	Low	22 Å²	22	48.8 Å²	48.8	15%	0.149	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	145.6	178.4	71.5	0	0	0	0	111	V415 T522	V415-C524 PolarHBondContact N-O 3.09Å; V415-C524 PolarHBondContact O-N 3.5Å; T522-C524 PolarHBondContact O-N 3.33Å
525	L	81.9	Confident	66.2	Low	38 Å²	38	50 Å²	50	20%	0.199	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	124.2	179.2	-73.2	-173.7	0	0	0	109.3	V412 E414 L586 N589 T692 L693	V412-L525 HydrophobicContact CG1-CB 3.54Å; V412-L525 HydrophobicContact CG1-CD1 4.29Å; V412-L525 HydrophobicContact CG1-CD2 4.08Å; V412-L525 HydrophobicContact CG1-CG 4.16Å; E414-L525 HydrophobicContact CB-CD2 3.75Å; E414-L525 HydrophobicContact CG-CD2 4.12Å; L525-L586 HydrophobicContact CB-CD2 4.48Å; L525-L586 WeakPolarHBondContact O-CD2 3.4Å; L525-N589 WeakPolarHBondContact O-CB 3.27Å; L525-N589 PolarHBondContact O-ND2 2.79Å; L525-T692 WeakPolarHBondContact CD1-O 3.23Å; L525-L693 HydrophobicContact CB-CD2 3.86Å; L525-L693 HydrophobicContact CD1-CD2 3.68Å; L525-L693 HydrophobicContact CG-CD2 4.38Å
526	V	84.3	Confident	69.3	Low	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	169.6	-178.1	-65.7	0	0	0	0	110.7	V412 T413 V415 I529 V530 N589 N590 F593	V412-V526 CarbonylContact C-O 3.59Å; V412-V526 VanDerWaalsContact CA-O 3.29Å; V412-V526 WeakPolarHBondContact CA-O 3.44Å; V412-V526 WeakPolarHBondContact CG1-O 3.45Å; T413-V526 PolarHBondContact N-O 3.05Å; T413-V526 WeakPolarHBondContact O-CG2 3.42Å; T413-V526 PolarHBondContact O-N 3.46Å; V415-V526 HydrophobicContact CB-CG2 4.28Å; V415-V526 HydrophobicContact CG2-CG2 3.37Å; V526-I529 HydrophobicContact CB-CG2 3.63Å; V526-I529 HydrophobicContact CG1-CG2 4.17Å; V526-I529 HydrophobicContact CG2-CG2 4.1Å; V526-V530 HydrophobicContact CG2-CG2 3.48Å; V526-V530 VanDerWaalsContact CG2-CG2 3.48Å; V526-N589 HydrophobicContact CG1-CB 4.06Å; V526-N590 WeakPolarHBondContact CB-OD1 3.13Å; V526-F593 HydrophobicContact CG1-CB 3.97Å; V526-F593 HydrophobicContact CG1-CG 4.21Å
527	S	87.8	Confident	72.1	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.021	24%	0.242	C	C	.	.			trans	-114.6	-138.3	-177.1	-178.4	0	0	0	0	111.8	L409 I529 V530 N590	L409-S527 WeakPolarHBondContact CA-OG 3.3Å; L409-S527 WeakPolarHBondContact O-CB 3.33Å; L409-S527 PolarHBondContact O-OG 3.29Å; S527-I529 PolarHBondContact O-N 2.87Å; S527-V530 PolarHBondContact O-N 2.64Å; S527-N590 PolarHBondContact N-OD1 2.97Å
528	W	89	Confident	74.9	Confident	27 Å²	27	47.8 Å²	47.8	10%	0.102	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-13.8	174.1	58.7	-103.9	0	0	0	114.9	A404 F405 L407 V530 D531 Y532	A404-W528 HydrophobicContact CB-CE3 4.05Å; A404-W528 HydrophobicContact CB-CZ3 4.39Å; F405-W528 HydrophobicContact CD1-CH2 4.03Å; F405-W528 HydrophobicContact CD1-CZ2 4.1Å; F405-W528 AromaticContact CD2-CH2 3.99Å; F405-W528 HydrophobicContact CD2-CH2 3.99Å; F405-W528 HydrophobicContact CD2-CZ3 4.35Å; F405-W528 AromaticContact CE1-CH2 3.65Å; F405-W528 HydrophobicContact CE1-CH2 3.65Å; F405-W528 AromaticContact CE1-CZ2 3.98Å; F405-W528 HydrophobicContact CE1-CZ2 3.98Å; F405-W528 AromaticContact CE2-CH2 3.59Å; F405-W528 HydrophobicContact CE2-CH2 3.59Å; F405-W528 AromaticContact CE2-CZ3 3.99Å; F405-W528 HydrophobicContact CE2-CZ3 3.99Å; F405-W528 HydrophobicContact CG-CH2 4.18Å; F405-W528 HydrophobicContact CG-CZ2 4.43Å; F405-W528 AromaticContact CZ-CH2 3.37Å; F405-W528 HydrophobicContact CZ-CH2 3.37Å; F405-W528 HydrophobicContact CZ-CZ2 4.18Å; F405-W528 HydrophobicContact CZ-CZ3 4.19Å; L407-W528 HydrophobicContact CB-CB 4.49Å; L407-W528 HydrophobicContact CD1-CB 4.29Å; W528-V530 PolarHBondContact O-N 3.12Å; W528-D531 PolarHBondContact O-N 3.06Å; W528-Y532 HydrophobicContact CE3-CD2 4.11Å; W528-Y532 HydrophobicContact CE3-CG 4.34Å; W528-Y532 AromaticContact CZ3-CD2 3.64Å; W528-Y532 HydrophobicContact CZ3-CD2 3.64Å; W528-Y532 HydrophobicContact CZ3-CE2 4.25Å; W528-Y532 AromaticContact CZ3-CG 3.87Å; W528-Y532 HydrophobicContact CZ3-CG 3.87Å; W528-Y532 PolarHBondContact O-N 2.97Å; W528-Y532 VanDerWaalsContact O-N 3.15Å
529	I	91.4	Very high	77.6	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.4	-24	179.1	-160.5	67.8	0	0	0	112.7	V526 S527 Y532 V533 N590 F593 L594	V526-I529 HydrophobicContact CB-CG2 3.63Å; V526-I529 HydrophobicContact CG1-CG2 4.17Å; V526-I529 HydrophobicContact CG2-CG2 4.1Å; S527-I529 PolarHBondContact O-N 2.87Å; I529-Y532 HydrophobicContact CD1-CD1 4.14Å; I529-Y532 HydrophobicContact CD1-CG 4.23Å; I529-Y532 WeakPolarHBondContact O-CB 3.49Å; I529-Y532 PolarHBondContact O-N 2.69Å; I529-V533 HydrophobicContact CG1-CG2 4.34Å; I529-V533 WeakPolarHBondContact O-CB 3.45Å; I529-V533 VanDerWaalsContact O-CG2 3.25Å; I529-V533 WeakPolarHBondContact O-CG2 3.46Å; I529-V533 PolarHBondContact O-N 2.98Å; I529-N590 HydrophobicContact CB-CB 3.9Å; I529-N590 HydrophobicContact CD1-CB 4.39Å; I529-N590 HydrophobicContact CG1-CB 4.01Å; I529-N590 HydrophobicContact CG2-CB 4.04Å; I529-N590 WeakPolarHBondContact CG2-OD1 3.43Å; I529-F593 HydrophobicContact CG1-CD1 4.31Å; I529-F593 HydrophobicContact CG2-CD1 3.79Å; I529-F593 HydrophobicContact CG2-CE1 4.47Å; I529-L594 HydrophobicContact CD1-CB 4.14Å; I529-L594 HydrophobicContact CD1-CD2 4.28Å; I529-L594 HydrophobicContact CG1-CB 4.23Å
530	V	88.9	Confident	80.1	Confident	39 Å²	39	43.8 Å²	43.8	24%	0.236	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-53.1	176.5	179.3	0	0	0	0	109.7	T413 V415 V526 S527 W528 Y532 V533 E534 F593	T413-V530 HydrophobicContact CG2-CG2 4.42Å; V415-V530 HydrophobicContact CG2-CG2 3.99Å; V526-V530 HydrophobicContact CG2-CG2 3.48Å; V526-V530 VanDerWaalsContact CG2-CG2 3.48Å; S527-V530 PolarHBondContact O-N 2.64Å; W528-V530 PolarHBondContact O-N 3.12Å; V530-Y532 PolarHBondContact O-N 3.18Å; V530-V533 PolarHBondContact O-N 3.45Å; V530-E534 PolarHBondContact O-N 3.4Å; V530-F593 HydrophobicContact CG2-CE1 4.42Å
531	D	89.6	Confident	82.7	Confident	100 Å²	100	45 Å²	45	54%	0.535	22%	0.221	S	C	.	.	H	α-helix	trans	-62.9	-33.7	176.8	-58.3	-18.3	0	0	0	111.6	W528 R535	W528-D531 PolarHBondContact O-N 3.06Å; D531-R535 VanDerWaalsContact O-CB 3.32Å; D531-R535 WeakPolarHBondContact O-CB 3.43Å; D531-R535 PolarHBondContact O-N 3.5Å
532	Y	93.3	Very high	84.8	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.016	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-48.4	174.9	-162.6	-88.8	0	0	0	111.8	F401 A404 F405 W528 I529 V530 R535 I536 A562 A566 L594	F401-Y532 HydrophobicContact CB-CE2 3.86Å; F401-Y532 HydrophobicContact CD1-CD1 4.4Å; F401-Y532 AromaticContact CD1-CD2 3.87Å; F401-Y532 HydrophobicContact CD1-CD2 3.87Å; F401-Y532 HydrophobicContact CD1-CE1 4.09Å; F401-Y532 AromaticContact CD1-CE2 3.53Å; F401-Y532 HydrophobicContact CD1-CE2 3.53Å; F401-Y532 HydrophobicContact CD1-CG 4.3Å; F401-Y532 AromaticContact CD1-CZ 3.62Å; F401-Y532 HydrophobicContact CE1-CE1 4.48Å; F401-Y532 HydrophobicContact CG-CE2 4.14Å; F401-Y532 WeakPolarHBondContact O-CE2 3.4Å; A404-Y532 HydrophobicContact CB-CD2 3.6Å; A404-Y532 HydrophobicContact CB-CE2 4.03Å; F405-Y532 HydrophobicContact CD2-CE2 4.18Å; F405-Y532 AromaticContact CE2-CE2 3.8Å; F405-Y532 HydrophobicContact CE2-CE2 3.8Å; F405-Y532 AromaticContact CE2-CZ 3.96Å; W528-Y532 HydrophobicContact CE3-CD2 4.11Å; W528-Y532 HydrophobicContact CE3-CG 4.34Å; W528-Y532 AromaticContact CZ3-CD2 3.64Å; W528-Y532 HydrophobicContact CZ3-CD2 3.64Å; W528-Y532 HydrophobicContact CZ3-CE2 4.25Å; W528-Y532 AromaticContact CZ3-CG 3.87Å; W528-Y532 HydrophobicContact CZ3-CG 3.87Å; W528-Y532 PolarHBondContact O-N 2.97Å; W528-Y532 VanDerWaalsContact O-N 3.15Å; I529-Y532 HydrophobicContact CD1-CD1 4.14Å; I529-Y532 HydrophobicContact CD1-CG 4.23Å; I529-Y532 WeakPolarHBondContact O-CB 3.49Å; I529-Y532 PolarHBondContact O-N 2.69Å; V530-Y532 PolarHBondContact O-N 3.18Å; Y532-R535 PolarHBondContact O-N 2.97Å; Y532-I536 HydrophobicContact CD1-CD1 3.8Å; Y532-I536 HydrophobicContact CD1-CG1 4.4Å; Y532-I536 HydrophobicContact CE1-CD1 3.69Å; Y532-I536 HydrophobicContact CE1-CG1 4.42Å; Y532-I536 WeakPolarHBondContact O-CG1 3.32Å; Y532-I536 PolarHBondContact O-N 3.31Å; Y532-A562 HydrophobicContact CE1-CB 4.45Å; Y532-A562 PolarHBondContact OH-O 2.82Å; Y532-A566 HydrophobicContact CE1-CB 4.18Å; Y532-L594 HydrophobicContact CD1-CD2 4.47Å; Y532-L594 HydrophobicContact CE1-CD2 4.29Å
533	V	91.2	Very high	86.8	Confident	10 Å²	10	41 Å²	41	6%	0.061	20%	0.198	C	C	.	.	H	α-helix	trans	-63.7	-47.4	177.1	164.4	0	0	0	0	109.9	I529 V530 R535 I536 E537 F593 L594 S597 W601	I529-V533 HydrophobicContact CG1-CG2 4.34Å; I529-V533 WeakPolarHBondContact O-CB 3.45Å; I529-V533 VanDerWaalsContact O-CG2 3.25Å; I529-V533 WeakPolarHBondContact O-CG2 3.46Å; I529-V533 PolarHBondContact O-N 2.98Å; V530-V533 PolarHBondContact O-N 3.45Å; V533-R535 PolarHBondContact O-N 2.81Å; V533-I536 WeakPolarHBondContact O-CB 3.36Å; V533-I536 PolarHBondContact O-N 2.87Å; V533-I536 VanDerWaalsContact O-N 3.07Å; V533-E537 PolarHBondContact O-N 3.38Å; V533-F593 HydrophobicContact CB-CE1 4.02Å; V533-F593 HydrophobicContact CG1-CE1 4.08Å; V533-F593 HydrophobicContact CG1-CZ 4.49Å; V533-F593 HydrophobicContact CG2-CD1 3.93Å; V533-F593 HydrophobicContact CG2-CE1 3.76Å; V533-L594 HydrophobicContact CG2-CB 4.36Å; V533-L594 HydrophobicContact CG2-CD1 3.71Å; V533-S597 WeakPolarHBondContact CG1-OG 3.37Å; V533-W601 HydrophobicContact CB-CH2 4.34Å; V533-W601 HydrophobicContact CG1-CH2 3.4Å; V533-W601 HydrophobicContact CG1-CZ2 3.77Å; V533-W601 HydrophobicContact CG1-CZ3 4.45Å; V533-W601 VanDerWaalsContact O-CH2 3.31Å; V533-W601 WeakPolarHBondContact O-CH2 3.47Å
534	E	90.8	Very high	88.2	Confident	118 Å²	118	39.2 Å²	39.2	55%	0.551	19%	0.187	S	C	*	.	H	α-helix	trans	-58.2	-38.3	177.3	-172.7	178.4	-176.8	0	0	111.9	V530 E537 S538	V530-E534 PolarHBondContact O-N 3.4Å; E534-E537 PolarHBondContact O-N 2.95Å; E534-S538 WeakPolarHBondContact O-CB 3.18Å; E534-S538 PolarHBondContact O-N 3.36Å
535	R	92.8	Very high	88.9	Confident	112 Å²	112	47.7 Å²	47.7	42%	0.423	22%	0.216	S	C	.	.	H	α-helix	trans	-67.8	-38.6	175.8	-169.8	-179.9	-59.1	-83	-5.1	112.7	L397 F401 D531 Y532 V533 E537 T539	L397-R535 HydrophobicContact CD2-CG 3.89Å; F401-R535 HydrophobicContact CD1-CG 4.48Å; F401-R535 HydrophobicContact CE1-CB 3.73Å; F401-R535 HydrophobicContact CE1-CG 3.63Å; F401-R535 HydrophobicContact CE2-CG 4.48Å; F401-R535 HydrophobicContact CZ-CB 4.08Å; F401-R535 HydrophobicContact CZ-CG 3.63Å; D531-R535 VanDerWaalsContact O-CB 3.32Å; D531-R535 WeakPolarHBondContact O-CB 3.43Å; D531-R535 PolarHBondContact O-N 3.5Å; Y532-R535 PolarHBondContact O-N 2.97Å; V533-R535 PolarHBondContact O-N 2.81Å; R535-E537 VanDerWaalsContact C-N 3.35Å; R535-T539 WeakPolarHBondContact O-CB 3.46Å; R535-T539 PolarHBondContact O-N 2.77Å; R535-T539 PolarHBondContact O-OG1 3.39Å
536	I	93.3	Very high	89	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.7	-46	171.3	-67.4	176.4	0	0	0	109.9	F401 Y532 V533 T539 L540 A562 L594 L598 W601	F401-I536 HydrophobicContact CE1-CG1 3.68Å; F401-I536 HydrophobicContact CZ-CG1 3.8Å; Y532-I536 HydrophobicContact CD1-CD1 3.8Å; Y532-I536 HydrophobicContact CD1-CG1 4.4Å; Y532-I536 HydrophobicContact CE1-CD1 3.69Å; Y532-I536 HydrophobicContact CE1-CG1 4.42Å; Y532-I536 WeakPolarHBondContact O-CG1 3.32Å; Y532-I536 PolarHBondContact O-N 3.31Å; V533-I536 WeakPolarHBondContact O-CB 3.36Å; V533-I536 PolarHBondContact O-N 2.87Å; V533-I536 VanDerWaalsContact O-N 3.07Å; I536-T539 WeakPolarHBondContact O-CB 3.39Å; I536-T539 PolarHBondContact O-N 3.25Å; I536-L540 HydrophobicContact CG2-CD1 4.26Å; I536-L540 PolarHBondContact O-N 3.45Å; I536-A562 HydrophobicContact CD1-CB 3.99Å; I536-A562 HydrophobicContact CG1-CB 3.86Å; I536-L594 HydrophobicContact CD1-CD1 3.72Å; I536-L598 HydrophobicContact CG2-CD2 4.25Å; I536-W601 HydrophobicContact CB-CH2 4.38Å; I536-W601 HydrophobicContact CB-CZ3 4.04Å; I536-W601 HydrophobicContact CG2-CE3 4.26Å; I536-W601 HydrophobicContact CG2-CH2 4.34Å; I536-W601 HydrophobicContact CG2-CZ3 3.55Å
537	E	90.1	Very high	88.8	Confident	53 Å²	53	57.2 Å²	57.2	25%	0.248	26%	0.259	C	S	.	.	H	α-helix	trans	-61.8	-46.3	179.6	-163.8	-172.8	178	0	0	111.8	V533 E534 R535 T539 L540 R541 W601	V533-E537 PolarHBondContact O-N 3.38Å; E534-E537 PolarHBondContact O-N 2.95Å; R535-E537 VanDerWaalsContact C-N 3.35Å; E537-T539 VanDerWaalsContact C-N 3.26Å; E537-T539 PolarHBondContact O-N 2.94Å; E537-L540 WeakPolarHBondContact O-CB 3.34Å; E537-L540 PolarHBondContact O-N 2.9Å; E537-L540 VanDerWaalsContact O-N 3.17Å; E537-R541 VanDerWaalsContact CD-CZ 3.47Å; E537-R541 WeakPolarHBondContact O-CG 3.2Å; E537-R541 PolarHBondContact O-N 3.13Å; E537-R541 IonicContact OE1-CZ 3.19Å; E537-R541 IonicContact OE1-NE 2.84Å; E537-R541 PolarHBondContact OE1-NE 3.28Å; E537-R541 IonicContact OE1-NH2 2.7Å; E537-R541 PolarHBondContact OE1-NH2 2.81Å; E537-R541 IonicContact OE2-CZ 2.7Å; E537-R541 IonicContact OE2-NH2 3.18Å; E537-R541 PolarHBondContact OE2-NH2 3.5Å; E537-W601 HydrophobicContact CB-CH2 3.76Å; E537-W601 HydrophobicContact CB-CZ2 3.53Å; E537-W601 HydrophobicContact CG-CH2 4.4Å; E537-W601 HydrophobicContact CG-CZ2 3.73Å
538	S	90.1	Very high	88.6	Confident	58 Å²	58	59.5 Å²	59.5	41%	0.406	28%	0.275	S	S	.	.	H	α-helix	trans	-58.2	-40.8	176	-174.9	0	0	0	0	111.3	E534 R541 K542	E534-S538 WeakPolarHBondContact O-CB 3.18Å; E534-S538 PolarHBondContact O-N 3.36Å; S538-R541 PolarHBondContact O-N 3.05Å; S538-K542 WeakPolarHBondContact O-CG 3.46Å; S538-K542 PolarHBondContact O-N 3.39Å; S538-K542 VanDerWaalsContact O-N 3.07Å
539	T	91.4	Very high	88.3	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.012	29%	0.29	C	S	.	.	H	α-helix	trans	-65.5	-43.5	175.4	-52.7	0	0	0	0	111.6	L397 R535 I536 E537 R541 K542 A543 Y555 V558	L397-T539 HydrophobicContact CD1-CG2 3.97Å; R535-T539 WeakPolarHBondContact O-CB 3.46Å; R535-T539 PolarHBondContact O-N 2.77Å; R535-T539 PolarHBondContact O-OG1 3.39Å; I536-T539 WeakPolarHBondContact O-CB 3.39Å; I536-T539 PolarHBondContact O-N 3.25Å; E537-T539 VanDerWaalsContact C-N 3.26Å; E537-T539 PolarHBondContact O-N 2.94Å; T539-R541 PolarHBondContact O-N 3.45Å; T539-K542 WeakPolarHBondContact O-CB 3.34Å; T539-K542 PolarHBondContact O-N 3.04Å; T539-A543 PolarHBondContact O-N 2.87Å; T539-A543 VanDerWaalsContact O-N 3.08Å; T539-Y555 HydrophobicContact CG2-CD1 4.16Å; T539-Y555 WeakPolarHBondContact CG2-O 3.24Å; T539-V558 HydrophobicContact CG2-CB 4.35Å; T539-V558 HydrophobicContact CG2-CG1 4.19Å
540	L	88.6	Confident	87.9	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-62.1	-41.8	174	-83.2	173.6	0	0	0	112.5	I536 E537 K542 A543 F544 F556 S559 W601 V605 Y624	I536-L540 HydrophobicContact CG2-CD1 4.26Å; I536-L540 PolarHBondContact O-N 3.45Å; E537-L540 WeakPolarHBondContact O-CB 3.34Å; E537-L540 PolarHBondContact O-N 2.9Å; E537-L540 VanDerWaalsContact O-N 3.17Å; L540-K542 VanDerWaalsContact C-N 3.26Å; L540-K542 PolarHBondContact O-N 3.27Å; L540-A543 WeakPolarHBondContact O-CA 3.03Å; L540-A543 VanDerWaalsContact O-CB 3.26Å; L540-A543 WeakPolarHBondContact O-CB 3.39Å; L540-A543 PolarHBondContact O-N 3.18Å; L540-F544 HydrophobicContact CB-CE2 4.29Å; L540-F544 HydrophobicContact CB-CZ 4.32Å; L540-F544 HydrophobicContact CD2-CZ 4.33Å; L540-F544 WeakPolarHBondContact O-CD2 3.49Å; L540-F544 VanDerWaalsContact O-CG 3.3Å; L540-F544 WeakPolarHBondContact O-CG 3.49Å; L540-F544 PolarHBondContact O-N 3.24Å; L540-F556 HydrophobicContact CD2-CD2 3.86Å; L540-F556 HydrophobicContact CD2-CE2 4.46Å; L540-S559 WeakPolarHBondContact CD2-OG 3.33Å; L540-W601 HydrophobicContact CD1-CB 4.26Å; L540-W601 HydrophobicContact CD1-CD2 4.14Å; L540-W601 HydrophobicContact CD1-CE3 3.71Å; L540-W601 HydrophobicContact CD1-CG 4.4Å; L540-W601 HydrophobicContact CD1-CZ3 4.38Å; L540-V605 HydrophobicContact CD1-CG2 4.34Å; L540-V605 HydrophobicContact CD2-CG2 3.91Å; L540-Y624 HydrophobicContact CD1-CE2 3.88Å; L540-Y624 WeakPolarHBondContact CD1-OH 3.05Å; L540-Y624 HydrophobicContact CD2-CE2 4.37Å; L540-Y624 VanDerWaalsContact CD2-OH 3.28Å; L540-Y624 WeakPolarHBondContact CD2-OH 3.38Å
541	R	88.3	Confident	87.7	Confident	110 Å²	110	64.6 Å²	64.6	42%	0.415	31%	0.308	S	S	.	.	H	α-helix	trans	-62	-34.6	175.4	-72.2	174	-176.9	162.2	-3.6	111.6	E537 S538 T539 F544 R545	E537-R541 VanDerWaalsContact CD-CZ 3.47Å; E537-R541 WeakPolarHBondContact O-CG 3.2Å; E537-R541 PolarHBondContact O-N 3.13Å; E537-R541 IonicContact OE1-CZ 3.19Å; E537-R541 IonicContact OE1-NE 2.84Å; E537-R541 PolarHBondContact OE1-NE 3.28Å; E537-R541 IonicContact OE1-NH2 2.7Å; E537-R541 PolarHBondContact OE1-NH2 2.81Å; E537-R541 IonicContact OE2-CZ 2.7Å; E537-R541 IonicContact OE2-NH2 3.18Å; E537-R541 PolarHBondContact OE2-NH2 3.5Å; S538-R541 PolarHBondContact O-N 3.05Å; T539-R541 PolarHBondContact O-N 3.45Å; R541-F544 PolarHBondContact O-N 3.31Å; R541-R545 WeakPolarHBondContact O-CB 3.22Å; R541-R545 VanDerWaalsContact O-CG 3.27Å; R541-R545 WeakPolarHBondContact O-CG 3.49Å; R541-R545 PolarHBondContact O-N 2.71Å; R541-R545 VanDerWaalsContact O-N 3.13Å
542	K	88.3	Confident	87.4	Confident	77 Å²	77	59.9 Å²	59.9	34%	0.335	28%	0.283	S	S	.	.	H	α-helix	trans	-63.8	-43.5	170.6	-70	-179.2	177.2	-170.7	0	111.3	E393 S538 T539 L540 F544 R545 S546 Y555	E393-K542 IonicContact OE2-NZ 3.99Å; E393-K542 PolarHBondContact OE2-NZ 2.85Å; S538-K542 WeakPolarHBondContact O-CG 3.46Å; S538-K542 PolarHBondContact O-N 3.39Å; S538-K542 VanDerWaalsContact O-N 3.07Å; T539-K542 WeakPolarHBondContact O-CB 3.34Å; T539-K542 PolarHBondContact O-N 3.04Å; L540-K542 VanDerWaalsContact C-N 3.26Å; L540-K542 PolarHBondContact O-N 3.27Å; K542-F544 PolarHBondContact O-N 2.86Å; K542-R545 PolarHBondContact O-N 2.84Å; K542-S546 PolarHBondContact O-N 3.28Å; K542-S546 VanDerWaalsContact O-N 3.09Å; K542-Y555 HydrophobicContact CB-CD1 4.22Å; K542-Y555 HydrophobicContact CB-CD2 4.04Å; K542-Y555 HydrophobicContact CB-CE1 4.38Å; K542-Y555 HydrophobicContact CB-CE2 4.22Å; K542-Y555 HydrophobicContact CB-CG 4.06Å; K542-Y555 HydrophobicContact CD-CD1 4.32Å; K542-Y555 HydrophobicContact CD-CE1 3.92Å
543	A	86.8	Confident	87	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-56.6	-48.6	175.1	0	0	0	0	0	111.6	T539 L540 R545 S546 A552 L609	T539-A543 PolarHBondContact O-N 2.87Å; T539-A543 VanDerWaalsContact O-N 3.08Å; L540-A543 WeakPolarHBondContact O-CA 3.03Å; L540-A543 VanDerWaalsContact O-CB 3.26Å; L540-A543 WeakPolarHBondContact O-CB 3.39Å; L540-A543 PolarHBondContact O-N 3.18Å; A543-R545 VanDerWaalsContact C-N 3.3Å; A543-R545 PolarHBondContact O-N 3.38Å; A543-S546 PolarHBondContact O-N 2.61Å; A543-A552 WeakPolarHBondContact CB-O 3.35Å; A543-A552 WeakPolarHBondContact O-CB 3.34Å; A543-L609 HydrophobicContact CB-CD2 4.43Å
544	F	84	Confident	86.9	Confident	48 Å²	48	65.4 Å²	65.4	21%	0.211	31%	0.306	C	S	.	.	H	α-helix	trans	-65.8	-28.7	-179.3	-57.1	-28.6	0	0	0	114.3	L540 R541 K542 V605 K608 L609	L540-F544 HydrophobicContact CB-CE2 4.29Å; L540-F544 HydrophobicContact CB-CZ 4.32Å; L540-F544 HydrophobicContact CD2-CZ 4.33Å; L540-F544 WeakPolarHBondContact O-CD2 3.49Å; L540-F544 VanDerWaalsContact O-CG 3.3Å; L540-F544 WeakPolarHBondContact O-CG 3.49Å; L540-F544 PolarHBondContact O-N 3.24Å; R541-F544 PolarHBondContact O-N 3.31Å; K542-F544 PolarHBondContact O-N 2.86Å; F544-V605 HydrophobicContact CE1-CG2 4.13Å; F544-V605 HydrophobicContact CZ-CB 4.49Å; F544-V605 HydrophobicContact CZ-CG2 3.77Å; F544-K608 HydrophobicContact CD1-CB 3.74Å; F544-K608 HydrophobicContact CD1-CD 4.49Å; F544-K608 HydrophobicContact CD2-CB 4.5Å; F544-K608 HydrophobicContact CD2-CD 3.74Å; F544-K608 HydrophobicContact CE1-CB 3.99Å; F544-K608 HydrophobicContact CE2-CD 3.87Å; F544-K608 HydrophobicContact CG-CB 4.02Å; F544-K608 HydrophobicContact CG-CD 4.08Å; F544-K608 HydrophobicContact CZ-CB 4.45Å; F544-K608 HydrophobicContact CZ-CD 4.31Å; F544-L609 HydrophobicContact CD1-CD2 3.89Å; F544-L609 HydrophobicContact CD1-CG 4.15Å; F544-L609 HydrophobicContact CE1-CD2 4.15Å; F544-L609 HydrophobicContact CE1-CG 3.96Å
545	R	84.8	Confident	86.9	Confident	201 Å²	201	60.8 Å²	60.8	76%	0.758	28%	0.283	S	S	*	.	H	α-helix	trans	-89.6	-10.7	-179.6	-69.9	173.9	-179.4	176.9	0.7	113.1	R541 K542 A543	R541-R545 WeakPolarHBondContact O-CB 3.22Å; R541-R545 VanDerWaalsContact O-CG 3.27Å; R541-R545 WeakPolarHBondContact O-CG 3.49Å; R541-R545 PolarHBondContact O-N 2.71Å; R541-R545 VanDerWaalsContact O-N 3.13Å; K542-R545 PolarHBondContact O-N 2.84Å; A543-R545 VanDerWaalsContact C-N 3.3Å; A543-R545 PolarHBondContact O-N 3.38Å
546	S	83.7	Confident	86.7	Confident	24 Å²	24	55.8 Å²	55.8	17%	0.168	27%	0.265	C	S	.	.			trans	-70.5	131.8	-178.9	177.6	0	0	0	0	110.8	K542 A543 S548 L551	K542-S546 PolarHBondContact O-N 3.28Å; K542-S546 VanDerWaalsContact O-N 3.09Å; A543-S546 PolarHBondContact O-N 2.61Å; S546-S548 PolarHBondContact OG-N 3.16Å; S546-S548 PolarHBondContact OG-O 3.39Å; S546-L551 WeakPolarHBondContact OG-CB 3.12Å
547	K	81.3	Confident	86.5	Confident	214 Å²	214	59.8 Å²	59.8	93%	0.93	28%	0.283	S	S	*	.	S	Bend	trans	-82.6	-21.9	172.5	-61.2	-178.1	-178.9	-179.7	0	112.5
548	S	82.7	Confident	86.7	Confident	50 Å²	50	57.3 Å²	57.3	35%	0.35	27%	0.271	S	S	.	.	S	Bend	trans	-90.3	126.6	177.2	172	0	0	0	0	109.7	S546 A550 L551 A552	S546-S548 PolarHBondContact OG-N 3.16Å; S546-S548 PolarHBondContact OG-O 3.39Å; S548-A550 VanDerWaalsContact C-N 3.33Å; S548-A550 PolarHBondContact O-N 3.49Å; S548-A550 PolarHBondContact OG-N 2.73Å; S548-L551 PolarHBondContact O-N 3.49Å; S548-A552 WeakPolarHBondContact O-CB 3.43Å; S548-A552 PolarHBondContact O-N 3.41Å
549	Q	82.2	Confident	86.8	Confident	90 Å²	90	54.5 Å²	54.5	42%	0.421	25%	0.252	S	S	.	.	H	α-helix	trans	-58.9	-44.9	176.4	165.9	161.3	27.4	0	0	111.4	L551 A552 I553 F613	Q549-L551 VanDerWaalsContact C-N 3.34Å; Q549-L551 PolarHBondContact O-N 2.89Å; Q549-A552 PolarHBondContact O-N 3.1Å; Q549-I553 HydrophobicContact CG-CD1 3.78Å; Q549-I553 HydrophobicContact CG-CG1 4.42Å; Q549-I553 VanDerWaalsContact O-CG1 3.28Å; Q549-I553 WeakPolarHBondContact O-CG1 3.27Å; Q549-I553 PolarHBondContact O-N 3.03Å; Q549-F613 HydrophobicContact CB-CD1 3.82Å; Q549-F613 HydrophobicContact CB-CE1 3.94Å; Q549-F613 HydrophobicContact CG-CD1 3.41Å; Q549-F613 VanDerWaalsContact CG-CD1 3.41Å; Q549-F613 HydrophobicContact CG-CE1 3.55Å; Q549-F613 WeakPolarHBondContact O-CE1 3.38Å
550	A	83.1	Confident	86.8	Confident	63 Å²	63	56.8 Å²	56.8	52%	0.521	26%	0.261	S	S	.	.	H	α-helix	trans	-59	-44.1	-179.6	0	0	0	0	0	112.1	S548 I553 R554	S548-A550 VanDerWaalsContact C-N 3.33Å; S548-A550 PolarHBondContact O-N 3.49Å; S548-A550 PolarHBondContact OG-N 2.73Å; A550-I553 PolarHBondContact O-N 3.33Å; A550-R554 WeakPolarHBondContact O-CB 3.45Å; A550-R554 PolarHBondContact O-N 2.89Å
551	L	84.9	Confident	87	Confident	20 Å²	20	59.5 Å²	59.5	11%	0.105	28%	0.277	C	S	.	.	H	α-helix	trans	-70.8	-38.4	179.4	-50.9	179.3	0	0	0	111.9	D386 C390 S546 S548 Q549 I553 R554 Y555	D386-L551 HydrophobicContact CB-CD1 3.77Å; C390-L551 HydrophobicContact CB-CD2 3.66Å; S546-L551 WeakPolarHBondContact OG-CB 3.12Å; S548-L551 PolarHBondContact O-N 3.49Å; Q549-L551 VanDerWaalsContact C-N 3.34Å; Q549-L551 PolarHBondContact O-N 2.89Å; L551-I553 VanDerWaalsContact C-N 3.34Å; L551-R554 PolarHBondContact O-N 2.93Å; L551-Y555 HydrophobicContact CB-CE2 4.4Å; L551-Y555 WeakPolarHBondContact O-CD2 3.28Å; L551-Y555 PolarHBondContact O-N 3.1Å
552	A	84.8	Confident	87.3	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-44.5	176.4	0	0	0	0	0	111.1	A543 S548 Q549 R554 F556 F613	A543-A552 WeakPolarHBondContact CB-O 3.35Å; A543-A552 WeakPolarHBondContact O-CB 3.34Å; S548-A552 WeakPolarHBondContact O-CB 3.43Å; S548-A552 PolarHBondContact O-N 3.41Å; Q549-A552 PolarHBondContact O-N 3.1Å; A552-R554 VanDerWaalsContact C-N 3.34Å; A552-F556 PolarHBondContact O-N 3.43Å; A552-F556 VanDerWaalsContact O-N 3.09Å; A552-F613 HydrophobicContact CB-CE1 3.71Å; A552-F613 HydrophobicContact CB-CZ 3.76Å
553	I	84.7	Confident	87.6	Confident	37 Å²	37	50.6 Å²	50.6	19%	0.19	24%	0.242	C	C	.	.	H	α-helix	trans	-58.9	-48.4	173.3	-67.2	171.1	0	0	0	109.5	Q549 A550 L551 Y555 F556 E557 F613 F622	Q549-I553 HydrophobicContact CG-CD1 3.78Å; Q549-I553 HydrophobicContact CG-CG1 4.42Å; Q549-I553 VanDerWaalsContact O-CG1 3.28Å; Q549-I553 WeakPolarHBondContact O-CG1 3.27Å; Q549-I553 PolarHBondContact O-N 3.03Å; A550-I553 PolarHBondContact O-N 3.33Å; L551-I553 VanDerWaalsContact C-N 3.34Å; I553-Y555 PolarHBondContact O-N 3.44Å; I553-F556 PolarHBondContact O-N 3.38Å; I553-E557 HydrophobicContact CG2-CG 4.23Å; I553-E557 WeakPolarHBondContact O-CG 3.47Å; I553-E557 PolarHBondContact O-N 3.37Å; I553-F613 HydrophobicContact CD1-CE1 4.29Å; I553-F613 HydrophobicContact CD1-CZ 4.38Å; I553-F613 HydrophobicContact CG1-CE1 3.72Å; I553-F613 HydrophobicContact CG1-CE2 4.29Å; I553-F613 HydrophobicContact CG1-CZ 3.45Å; I553-F613 VanDerWaalsContact CG1-CZ 3.45Å; I553-F622 HydrophobicContact CG1-CZ 4.07Å
554	R	88.6	Confident	87.9	Confident	94 Å²	94	54.8 Å²	54.8	36%	0.355	26%	0.257	S	S	.	.	H	α-helix	trans	-61.9	-44.2	-176.5	-172.9	56.9	177.4	172.8	-1.8	113.1	A550 L551 A552 E557 V558	A550-R554 WeakPolarHBondContact O-CB 3.45Å; A550-R554 PolarHBondContact O-N 2.89Å; L551-R554 PolarHBondContact O-N 2.93Å; A552-R554 VanDerWaalsContact C-N 3.34Å; R554-E557 IonicContact NH1-OE2 2.9Å; R554-E557 PolarHBondContact NH1-OE2 3.24Å; R554-E557 VanDerWaalsContact NH1-OE2 3.15Å; R554-E557 WeakPolarHBondContact O-CB 3.47Å; R554-E557 PolarHBondContact O-N 3.14Å; R554-V558 WeakPolarHBondContact O-CG2 3.09Å; R554-V558 PolarHBondContact O-N 3.49Å
555	Y	90.8	Very high	88.5	Confident	21 Å²	21	53.9 Å²	53.9	8%	0.082	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-39.7	175.4	-74.8	-58.2	0	0	0	112.2	C390 E393 T539 K542 L551 I553 V558 S559	C390-Y555 VanDerWaalsContact SG-CZ 3.55Å; E393-Y555 PolarHBondContact OE2-OH 3.28Å; E393-Y555 VanDerWaalsContact OE2-OH 3.07Å; T539-Y555 HydrophobicContact CG2-CD1 4.16Å; T539-Y555 WeakPolarHBondContact CG2-O 3.24Å; K542-Y555 HydrophobicContact CB-CD1 4.22Å; K542-Y555 HydrophobicContact CB-CD2 4.04Å; K542-Y555 HydrophobicContact CB-CE1 4.38Å; K542-Y555 HydrophobicContact CB-CE2 4.22Å; K542-Y555 HydrophobicContact CB-CG 4.06Å; K542-Y555 HydrophobicContact CD-CD1 4.32Å; K542-Y555 HydrophobicContact CD-CE1 3.92Å; L551-Y555 HydrophobicContact CB-CE2 4.4Å; L551-Y555 WeakPolarHBondContact O-CD2 3.28Å; L551-Y555 PolarHBondContact O-N 3.1Å; I553-Y555 PolarHBondContact O-N 3.44Å; Y555-V558 PolarHBondContact O-N 3.13Å; Y555-S559 PolarHBondContact O-N 3.32Å; Y555-S559 PolarHBondContact O-OG 3.13Å
556	F	87.9	Confident	89	Confident	7 Å²	7	44.3 Å²	44.3	3%	0.031	22%	0.218	C	C	.	.	H	α-helix	trans	-63.6	-40.9	174	174.9	-93.7	0	0	0	112.3	L540 A552 I553 V558 S559 R560 V605 L609 F622 Y624	L540-F556 HydrophobicContact CD2-CD2 3.86Å; L540-F556 HydrophobicContact CD2-CE2 4.46Å; A552-F556 PolarHBondContact O-N 3.43Å; A552-F556 VanDerWaalsContact O-N 3.09Å; I553-F556 PolarHBondContact O-N 3.38Å; F556-V558 VanDerWaalsContact C-N 3.3Å; F556-V558 PolarHBondContact O-N 2.83Å; F556-S559 WeakPolarHBondContact CA-OG 3.41Å; F556-S559 PolarHBondContact O-N 3.37Å; F556-S559 PolarHBondContact O-OG 3.11Å; F556-R560 HydrophobicContact CE1-CB 4.36Å; F556-R560 HydrophobicContact CZ-CB 4.45Å; F556-R560 WeakPolarHBondContact O-CB 3.34Å; F556-R560 PolarHBondContact O-N 3.32Å; F556-V605 HydrophobicContact CD2-CG1 4.04Å; F556-V605 HydrophobicContact CE2-CG1 3.52Å; F556-V605 HydrophobicContact CE2-CG2 4.43Å; F556-V605 HydrophobicContact CZ-CG1 4.34Å; F556-L609 HydrophobicContact CB-CD1 4.25Å; F556-L609 HydrophobicContact CD2-CD1 3.77Å; F556-L609 HydrophobicContact CE2-CD1 4.4Å; F556-L609 HydrophobicContact CG-CD1 3.99Å; F556-F622 AromaticContact CD1-CD1 3.41Å; F556-F622 HydrophobicContact CD1-CD1 3.41Å; F556-F622 VanDerWaalsContact CD1-CD1 3.41Å; F556-F622 AromaticContact CD1-CE1 3.85Å; F556-F622 HydrophobicContact CD1-CE1 3.85Å; F556-F622 HydrophobicContact CD1-CG 4.39Å; F556-F622 HydrophobicContact CE1-CB 4.2Å; F556-F622 AromaticContact CE1-CD1 3.39Å; F556-F622 HydrophobicContact CE1-CD1 3.39Å; F556-F622 HydrophobicContact CE1-CE1 4.22Å; F556-F622 HydrophobicContact CE1-CG 4.23Å; F556-F622 HydrophobicContact CE2-CB 4.4Å; F556-F622 HydrophobicContact CG-CD1 4.13Å; F556-F622 HydrophobicContact CZ-CB 4.01Å; F556-F622 HydrophobicContact CZ-CD1 4.08Å; F556-Y624 HydrophobicContact CE2-CE1 4.41Å; F556-Y624 HydrophobicContact CE2-CE2 4.19Å; F556-Y624 AromaticContact CE2-CZ 3.9Å
557	E	89.9	Confident	89.4	Confident	83 Å²	83	43.5 Å²	43.5	39%	0.388	21%	0.212	S	C	.	.	H	α-helix	trans	-60.5	-40.8	175.3	-75.6	179	168.2	0	0	111.5	I553 R554 R560 T561	I553-E557 HydrophobicContact CG2-CG 4.23Å; I553-E557 WeakPolarHBondContact O-CG 3.47Å; I553-E557 PolarHBondContact O-N 3.37Å; R554-E557 IonicContact NH1-OE2 2.9Å; R554-E557 PolarHBondContact NH1-OE2 3.24Å; R554-E557 VanDerWaalsContact NH1-OE2 3.15Å; R554-E557 WeakPolarHBondContact O-CB 3.47Å; R554-E557 PolarHBondContact O-N 3.14Å; E557-R560 PolarHBondContact O-N 2.83Å; E557-T561 WeakPolarHBondContact O-CB 3.33Å; E557-T561 PolarHBondContact O-N 3.1Å; E557-T561 PolarHBondContact O-OG1 2.87Å
558	V	93.3	Very high	90	Very high	1 Å²	1	37 Å²	37	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-67.7	-43.4	177	170.6	0	0	0	0	111.7	C394 L397 I398 F401 T539 R554 Y555 F556 R560 T561 A562	C394-V558 HydrophobicContact CB-CG2 3.54Å; C394-V558 WeakPolarHBondContact SG-CG2 3.49Å; L397-V558 HydrophobicContact CB-CG1 4.02Å; L397-V558 HydrophobicContact CD1-CG1 4.28Å; I398-V558 HydrophobicContact CD1-CG2 4.35Å; I398-V558 HydrophobicContact CG1-CG1 4.25Å; F401-V558 HydrophobicContact CE2-CG1 4.23Å; T539-V558 HydrophobicContact CG2-CB 4.35Å; T539-V558 HydrophobicContact CG2-CG1 4.19Å; R554-V558 WeakPolarHBondContact O-CG2 3.09Å; R554-V558 PolarHBondContact O-N 3.49Å; Y555-V558 PolarHBondContact O-N 3.13Å; F556-V558 VanDerWaalsContact C-N 3.3Å; F556-V558 PolarHBondContact O-N 2.83Å; V558-R560 VanDerWaalsContact C-N 3.27Å; V558-R560 PolarHBondContact O-N 2.81Å; V558-T561 PolarHBondContact O-N 2.99Å; V558-A562 WeakPolarHBondContact O-CB 3.2Å; V558-A562 PolarHBondContact O-N 3.15Å
559	S	92.9	Very high	90.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.3	-38.2	176.8	63.4	0	0	0	0	111.5	L540 Y555 F556 A562 A563 Y624	L540-S559 WeakPolarHBondContact CD2-OG 3.33Å; Y555-S559 PolarHBondContact O-N 3.32Å; Y555-S559 PolarHBondContact O-OG 3.13Å; F556-S559 WeakPolarHBondContact CA-OG 3.41Å; F556-S559 PolarHBondContact O-N 3.37Å; F556-S559 PolarHBondContact O-OG 3.11Å; S559-A562 WeakPolarHBondContact O-CB 3.31Å; S559-A563 PolarHBondContact O-N 3.44Å; S559-Y624 WeakPolarHBondContact CB-OH 3.47Å; S559-Y624 PolarHBondContact OG-OH 3.4Å
560	R	91.3	Very high	91	Very high	50 Å²	50	32.2 Å²	32.2	19%	0.189	16%	0.163	C	C	.	.	H	α-helix	trans	-71.5	-37.3	173.4	-174.5	171.9	165.1	77.4	8	113.3	F556 E557 V558 A562 A563 W564 T623 Y624 D626 V627	F556-R560 HydrophobicContact CE1-CB 4.36Å; F556-R560 HydrophobicContact CZ-CB 4.45Å; F556-R560 WeakPolarHBondContact O-CB 3.34Å; F556-R560 PolarHBondContact O-N 3.32Å; E557-R560 PolarHBondContact O-N 2.83Å; V558-R560 VanDerWaalsContact C-N 3.27Å; V558-R560 PolarHBondContact O-N 2.81Å; R560-A562 VanDerWaalsContact C-N 3.32Å; R560-A563 PolarHBondContact O-N 3.39Å; R560-W564 PolarHBondContact O-N 3.5Å; R560-T623 PolarHBondContact NH1-O 2.86Å; R560-Y624 HydrophobicContact CB-CE1 3.94Å; R560-Y624 HydrophobicContact CG-CE1 4.28Å; R560-D626 IonicContact CZ-OD1 3.85Å; R560-D626 IonicContact CZ-OD2 2.94Å; R560-D626 IonicContact NH1-OD1 3.04Å; R560-D626 PolarHBondContact NH1-OD1 2.77Å; R560-D626 IonicContact NH1-OD2 3.93Å; R560-D626 IonicContact NH2-OD1 3.91Å; R560-D626 PolarHBondContact NH2-OD1 3.01Å; R560-D626 IonicContact NH2-OD2 3.95Å; R560-D626 PolarHBondContact NH2-OD2 3.4Å; R560-V627 VanDerWaalsContact NH1-CG2 3.3Å
561	T	93.1	Very high	91.5	Very high	59 Å²	59	35 Å²	35	36%	0.362	16%	0.164	S	C	.	.	H	α-helix	trans	-64.1	-38.6	174.2	-61.8	0	0	0	0	110.9	E557 V558 W564 L565	E557-T561 WeakPolarHBondContact O-CB 3.33Å; E557-T561 PolarHBondContact O-N 3.1Å; E557-T561 PolarHBondContact O-OG1 2.87Å; V558-T561 PolarHBondContact O-N 2.99Å; T561-W564 CarbonylContact O-C 3.57Å; T561-W564 WeakPolarHBondContact O-CB 3.46Å; T561-W564 PolarHBondContact O-N 2.95Å; T561-L565 HydrophobicContact CG2-CD1 4.2Å; T561-L565 HydrophobicContact CG2-CG 4.32Å; T561-L565 WeakPolarHBondContact O-CB 3.35Å; T561-L565 WeakPolarHBondContact O-CG 3.42Å; T561-L565 PolarHBondContact O-N 2.94Å
562	A	95.1	Very high	91.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59	-49.1	173.2	0	0	0	0	0	111.4	F401 Y532 I536 V558 S559 R560 W564 L565 A566	F401-A562 HydrophobicContact CB-CB 4.47Å; F401-A562 HydrophobicContact CD1-CB 3.87Å; F401-A562 HydrophobicContact CD2-CB 3.46Å; F401-A562 VanDerWaalsContact CD2-CB 3.46Å; F401-A562 HydrophobicContact CE1-CB 3.83Å; F401-A562 HydrophobicContact CE2-CB 3.45Å; F401-A562 VanDerWaalsContact CE2-CB 3.45Å; F401-A562 HydrophobicContact CG-CB 3.69Å; F401-A562 HydrophobicContact CZ-CB 3.64Å; Y532-A562 HydrophobicContact CE1-CB 4.45Å; Y532-A562 PolarHBondContact OH-O 2.82Å; I536-A562 HydrophobicContact CD1-CB 3.99Å; I536-A562 HydrophobicContact CG1-CB 3.86Å; V558-A562 WeakPolarHBondContact O-CB 3.2Å; V558-A562 PolarHBondContact O-N 3.15Å; S559-A562 WeakPolarHBondContact O-CB 3.31Å; R560-A562 VanDerWaalsContact C-N 3.32Å; A562-W564 VanDerWaalsContact C-N 3.26Å; A562-W564 PolarHBondContact O-N 3.45Å; A562-L565 WeakPolarHBondContact O-CB 3.45Å; A562-L565 PolarHBondContact O-N 3.38Å; A562-L565 VanDerWaalsContact O-N 3.14Å; A562-A566 PolarHBondContact O-N 2.81Å
563	A	93.4	Very high	91.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.7	-36.1	176	0	0	0	0	0	112.9	S559 R560 A566 L598 V627	S559-A563 PolarHBondContact O-N 3.44Å; R560-A563 PolarHBondContact O-N 3.39Å; A563-A566 PolarHBondContact O-N 3.39Å; A563-L598 HydrophobicContact CB-CD1 3.59Å; A563-L598 HydrophobicContact CB-CD2 4.24Å; A563-V627 HydrophobicContact CB-CG1 3.61Å
564	W	94.4	Very high	92.2	Very high	87 Å²	87	42.7 Å²	42.7	33%	0.33	20%	0.203	S	C	.	.	H	α-helix	trans	-69.7	-41.7	172.6	-92.6	110.4	0	0	0	113.8	R560 T561 A562 A566 I567 V568 V627 K630	R560-W564 PolarHBondContact O-N 3.5Å; T561-W564 CarbonylContact O-C 3.57Å; T561-W564 WeakPolarHBondContact O-CB 3.46Å; T561-W564 PolarHBondContact O-N 2.95Å; A562-W564 VanDerWaalsContact C-N 3.26Å; A562-W564 PolarHBondContact O-N 3.45Å; W564-A566 PolarHBondContact O-N 3.21Å; W564-I567 HydrophobicContact CD2-CD1 4.33Å; W564-I567 HydrophobicContact CE3-CD1 3.86Å; W564-I567 HydrophobicContact CZ3-CD1 4.18Å; W564-I567 WeakPolarHBondContact O-CB 3.3Å; W564-I567 PolarHBondContact O-N 2.77Å; W564-V568 PolarHBondContact O-N 3.43Å; W564-V627 HydrophobicContact CD2-CG2 4.49Å; W564-V627 HydrophobicContact CG-CG2 4.45Å; W564-V627 HydrophobicContact CZ2-CG2 4.45Å; W564-V627 VanDerWaalsContact NE1-CG2 3.34Å; W564-K630 HydrophobicContact CH2-CD 3.28Å; W564-K630 HydrophobicContact CZ2-CD 3.89Å; W564-K630 HydrophobicContact CZ3-CD 3.77Å
565	L	94.6	Very high	92.3	Very high	29 Å²	29	45.8 Å²	45.8	15%	0.152	22%	0.219	C	C	.	.	H	α-helix	trans	-57.5	-37	173.6	-77.5	169.6	0	0	0	110.4	I398 F401 Q402 T561 A562 I567 V568 L569	I398-L565 HydrophobicContact CG2-CD1 4.19Å; F401-L565 HydrophobicContact CB-CD1 4.45Å; Q402-L565 HydrophobicContact CG-CD1 4.31Å; T561-L565 HydrophobicContact CG2-CD1 4.2Å; T561-L565 HydrophobicContact CG2-CG 4.32Å; T561-L565 WeakPolarHBondContact O-CB 3.35Å; T561-L565 WeakPolarHBondContact O-CG 3.42Å; T561-L565 PolarHBondContact O-N 2.94Å; A562-L565 WeakPolarHBondContact O-CB 3.45Å; A562-L565 PolarHBondContact O-N 3.38Å; A562-L565 VanDerWaalsContact O-N 3.14Å; L565-I567 VanDerWaalsContact C-N 3.27Å; L565-I567 PolarHBondContact O-N 2.87Å; L565-V568 PolarHBondContact O-N 3.11Å; L565-L569 HydrophobicContact CB-CD1 4.49Å; L565-L569 VanDerWaalsContact O-CB 3.3Å; L565-L569 WeakPolarHBondContact O-CB 3.27Å; L565-L569 WeakPolarHBondContact O-CG 3.32Å; L565-L569 PolarHBondContact O-N 3.32Å
566	A	95.3	Very high	92.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.3	-36.7	176.5	0	0	0	0	0	113.4	F405 Y532 A562 A563 W564 G570 L594 L631	F405-A566 HydrophobicContact CE2-CB 3.96Å; F405-A566 HydrophobicContact CZ-CB 3.65Å; Y532-A566 HydrophobicContact CE1-CB 4.18Å; A562-A566 PolarHBondContact O-N 2.81Å; A563-A566 PolarHBondContact O-N 3.39Å; W564-A566 PolarHBondContact O-N 3.21Å; A566-G570 WeakPolarHBondContact O-CA 3.22Å; A566-G570 PolarHBondContact O-N 2.92Å; A566-L594 HydrophobicContact CB-CD2 3.54Å; A566-L631 HydrophobicContact CB-CD2 4.19Å
567	I	93.6	Very high	92.5	Very high	7 Å²	7	49.8 Å²	49.8	4%	0.036	24%	0.239	C	C	.	.	H	α-helix	trans	-68.9	-47.5	174.2	-61.2	163.2	0	0	0	110.8	W564 L565 K571 V627 K630 L631 L634	W564-I567 HydrophobicContact CD2-CD1 4.33Å; W564-I567 HydrophobicContact CE3-CD1 3.86Å; W564-I567 HydrophobicContact CZ3-CD1 4.18Å; W564-I567 WeakPolarHBondContact O-CB 3.3Å; W564-I567 PolarHBondContact O-N 2.77Å; L565-I567 VanDerWaalsContact C-N 3.27Å; L565-I567 PolarHBondContact O-N 2.87Å; I567-K571 WeakPolarHBondContact O-CG 3.25Å; I567-K571 PolarHBondContact O-N 3.39Å; I567-V627 HydrophobicContact CD1-CG1 3.77Å; I567-K630 HydrophobicContact CD1-CB 3.56Å; I567-K630 HydrophobicContact CD1-CD 4.35Å; I567-K630 HydrophobicContact CG1-CB 4.42Å; I567-L631 HydrophobicContact CD1-CD2 4.44Å; I567-L631 HydrophobicContact CD1-CG 4.13Å; I567-L631 HydrophobicContact CG1-CD2 3.58Å; I567-L631 HydrophobicContact CG1-CG 3.77Å; I567-L634 HydrophobicContact CG2-CD2 4.47Å
568	V	94.4	Very high	92.7	Very high	79 Å²	79	46.8 Å²	46.8	48%	0.479	23%	0.227	S	C	.	.	H	α-helix	trans	-67.2	-50.7	-175	174.5	0	0	0	0	111	W564 L565 K571	W564-V568 PolarHBondContact O-N 3.43Å; L565-V568 PolarHBondContact O-N 3.11Å; V568-K571 PolarHBondContact O-N 3.49Å
569	L	93.1	Very high	92.7	Very high	38 Å²	38	53.2 Å²	53.2	20%	0.199	26%	0.257	C	S	.	.	H	α-helix	trans	-69.6	-39.7	-179.9	-62.3	178.3	0	0	0	111	Q402 F405 L565 K571 N572 H573	Q402-L569 HydrophobicContact CG-CD1 4.39Å; F405-L569 HydrophobicContact CB-CB 4.22Å; F405-L569 HydrophobicContact CB-CD1 4.06Å; F405-L569 HydrophobicContact CD1-CB 3.63Å; F405-L569 HydrophobicContact CD2-CB 4.03Å; F405-L569 HydrophobicContact CD2-CD1 3.7Å; F405-L569 HydrophobicContact CE1-CB 4Å; F405-L569 HydrophobicContact CE2-CB 4.37Å; F405-L569 HydrophobicContact CE2-CD1 4.4Å; F405-L569 HydrophobicContact CG-CB 3.67Å; F405-L569 HydrophobicContact CG-CD1 3.88Å; F405-L569 HydrophobicContact CG-CG 4.43Å; F405-L569 HydrophobicContact CZ-CB 4.36Å; L565-L569 HydrophobicContact CB-CD1 4.49Å; L565-L569 VanDerWaalsContact O-CB 3.3Å; L565-L569 WeakPolarHBondContact O-CB 3.27Å; L565-L569 WeakPolarHBondContact O-CG 3.32Å; L565-L569 PolarHBondContact O-N 3.32Å; L569-K571 VanDerWaalsContact C-N 3.29Å; L569-K571 PolarHBondContact O-N 2.86Å; L569-N572 VanDerWaalsContact O-CB 3.3Å; L569-N572 WeakPolarHBondContact O-CB 3.35Å; L569-N572 PolarHBondContact O-N 3.45Å; L569-H573 PolarHBondContact O-CD2 3.41Å; L569-H573 VanDerWaalsContact O-CD2 3.29Å
570	G	92.6	Very high	92.7	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-56.3	-40.7	176	0	0	0	0	0	112.9	A566 N572 H573 Y638	A566-G570 WeakPolarHBondContact O-CA 3.22Å; A566-G570 PolarHBondContact O-N 2.92Å; G570-N572 PolarHBondContact O-N 3.33Å; G570-H573 PolarHBondContact O-N 3.38Å; G570-Y638 VanDerWaalsContact C-OH 3.26Å; G570-Y638 WeakPolarHBondContact CA-OH 3.48Å; G570-Y638 PolarHBondContact O-OH 3.46Å
571	K	92.8	Very high	92.9	Very high	123 Å²	123	53 Å²	53	54%	0.535	26%	0.263	S	S	.	.	H	α-helix	trans	-55.8	-29.7	175.4	-76.2	174.4	177.3	-172.9	0	113.8	I567 V568 L569 H573 L574 L634	I567-K571 WeakPolarHBondContact O-CG 3.25Å; I567-K571 PolarHBondContact O-N 3.39Å; V568-K571 PolarHBondContact O-N 3.49Å; L569-K571 VanDerWaalsContact C-N 3.29Å; L569-K571 PolarHBondContact O-N 2.86Å; K571-H573 PolarHBondContact O-N 2.9Å; K571-L574 HydrophobicContact CB-CD1 4.35Å; K571-L574 HydrophobicContact CG-CD1 4.4Å; K571-L574 WeakPolarHBondContact O-CB 3.49Å; K571-L574 WeakPolarHBondContact O-CD1 3.18Å; K571-L574 WeakPolarHBondContact O-CG 3.45Å; K571-L574 PolarHBondContact O-N 3.48Å; K571-L634 HydrophobicContact CG-CD1 3.87Å
572	N	90.3	Very high	92.9	Very high	121 Å²	121	53.1 Å²	53.1	65%	0.647	26%	0.258	S	S	*	.	H	α-helix	trans	-70.7	-20.2	178.8	-61.1	-21.3	0	0	0	112.8	L569 G570	L569-N572 VanDerWaalsContact O-CB 3.3Å; L569-N572 WeakPolarHBondContact O-CB 3.35Å; L569-N572 PolarHBondContact O-N 3.45Å; G570-N572 PolarHBondContact O-N 3.33Å
573	H	88.3	Confident	92.8	Very high	56 Å²	56	54.1 Å²	54.1	26%	0.259	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	0	178.6	-64.3	-86.9	0	0	0	113.6	L569 G570 K571 K575 E576 A577	L569-H573 PolarHBondContact O-CD2 3.41Å; L569-H573 VanDerWaalsContact O-CD2 3.29Å; G570-H573 PolarHBondContact O-N 3.38Å; K571-H573 PolarHBondContact O-N 2.9Å; H573-K575 VanDerWaalsContact C-N 3.28Å; H573-K575 PolarHBondContact O-N 3.34Å; H573-E576 IonicContact ND1-OE2 3.74Å; H573-E576 PolarHBondContact ND1-OE2 3.17Å; H573-E576 PolarHBondContact O-N 3.23Å; H573-A577 WeakPolarHBondContact O-CB 3.42Å; H573-A577 PolarHBondContact O-N 3.02Å
574	L	90.6	Very high	92.8	Very high	42 Å²	42	54.1 Å²	54.1	22%	0.22	26%	0.264	C	S	.	.	H	α-helix	trans	-55.9	-40.9	-178.4	-81.7	167.4	0	0	0	113	K571 S578 L634 T637 Y638	K571-L574 HydrophobicContact CB-CD1 4.35Å; K571-L574 HydrophobicContact CG-CD1 4.4Å; K571-L574 WeakPolarHBondContact O-CB 3.49Å; K571-L574 WeakPolarHBondContact O-CD1 3.18Å; K571-L574 WeakPolarHBondContact O-CG 3.45Å; K571-L574 PolarHBondContact O-N 3.48Å; L574-S578 WeakPolarHBondContact O-CB 3.37Å; L574-S578 PolarHBondContact O-N 3.2Å; L574-S578 PolarHBondContact O-OG 3.44Å; L574-L634 HydrophobicContact CD2-CD1 4.43Å; L574-T637 HydrophobicContact CD1-CG2 4.27Å; L574-T637 HydrophobicContact CD2-CG2 3.8Å; L574-Y638 HydrophobicContact CD2-CD1 3.53Å; L574-Y638 HydrophobicContact CD2-CE1 3.8Å; L574-Y638 HydrophobicContact CD2-CG 4.07Å; L574-Y638 HydrophobicContact CG-CD1 4.33Å; L574-Y638 HydrophobicContact CG-CE1 4.11Å
575	K	91.4	Very high	92.7	Very high	159 Å²	159	50 Å²	50	69%	0.691	25%	0.248	S	C	*	.	H	α-helix	trans	-65.4	-47.2	-179.8	-174.3	179.3	178.9	-177.4	0	111.6	H573 S578 Q579	H573-K575 VanDerWaalsContact C-N 3.28Å; H573-K575 PolarHBondContact O-N 3.34Å; K575-S578 PolarHBondContact O-N 3.03Å; K575-S578 PolarHBondContact O-OG 2.97Å; K575-Q579 WeakPolarHBondContact O-CG 3.37Å
576	E	90.8	Very high	92.5	Very high	112 Å²	112	48.6 Å²	48.6	52%	0.523	24%	0.241	S	C	.	.	H	α-helix	trans	-62.4	-48.1	177.6	-177.5	-176.5	-174.3	0	0	110.9	H573 S578 Q579 V583	H573-E576 IonicContact ND1-OE2 3.74Å; H573-E576 PolarHBondContact ND1-OE2 3.17Å; H573-E576 PolarHBondContact O-N 3.23Å; E576-S578 VanDerWaalsContact C-N 3.35Å; E576-S578 PolarHBondContact O-N 2.88Å; E576-Q579 PolarHBondContact O-N 3.48Å; E576-V583 HydrophobicContact CG-CG1 4.49Å
577	A	91.1	Very high	92.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.5	-46.9	177.1	0	0	0	0	0	111.6	H573 Q579 S580 V583 T584 Y638	H573-A577 WeakPolarHBondContact O-CB 3.42Å; H573-A577 PolarHBondContact O-N 3.02Å; A577-Q579 PolarHBondContact O-N 3.27Å; A577-S580 PolarHBondContact O-N 3.24Å; A577-V583 HydrophobicContact CB-CG1 4.02Å; A577-T584 VanDerWaalsContact C-OG1 3.26Å; A577-T584 PolarHBondContact O-OG1 3Å; A577-Y638 HydrophobicContact CB-CD1 3.38Å; A577-Y638 HydrophobicContact CB-CE1 3.64Å; A577-Y638 HydrophobicContact CB-CG 4.47Å
578	S	93.5	Very high	92.1	Very high	20 Å²	20	49 Å²	49	14%	0.14	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-15.4	-177.6	71.2	0	0	0	0	115.3	L574 K575 E576 F642	L574-S578 WeakPolarHBondContact O-CB 3.37Å; L574-S578 PolarHBondContact O-N 3.2Å; L574-S578 PolarHBondContact O-OG 3.44Å; K575-S578 PolarHBondContact O-N 3.03Å; K575-S578 PolarHBondContact O-OG 2.97Å; E576-S578 VanDerWaalsContact C-N 3.35Å; E576-S578 PolarHBondContact O-N 2.88Å; S578-F642 WeakPolarHBondContact O-CD2 3.45Å
579	Q	93.6	Very high	91.8	Very high	135 Å²	135	45.3 Å²	45.3	63%	0.631	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-11.2	-178.6	-63.9	178	-16.8	0	0	113.8	K575 E576 A577	K575-Q579 WeakPolarHBondContact O-CG 3.37Å; E576-Q579 PolarHBondContact O-N 3.48Å; A577-Q579 PolarHBondContact O-N 3.27Å
580	S	94.2	Very high	91.7	Very high	38 Å²	38	43.6 Å²	43.6	27%	0.266	21%	0.212	S	C	.	.			trans	-134.6	125.3	-176.4	170.2	0	0	0	0	111.6	A577 V583 T584	A577-S580 PolarHBondContact O-N 3.24Å; S580-V583 PolarHBondContact O-N 3.19Å; S580-V583 WeakPolarHBondContact OG-CG2 3.24Å; S580-V583 PolarHBondContact OG-N 2.83Å; S580-T584 WeakPolarHBondContact O-CB 3.22Å; S580-T584 PolarHBondContact O-N 3.08Å; S580-T584 PolarHBondContact O-OG1 3.36Å
581	A	94	Very high	91.5	Very high	7 Å²	7	43.8 Å²	43.8	6%	0.058	21%	0.213	C	C	.	.	H	α-helix	trans	-63	-43.9	178.6	0	0	0	0	0	110.9	T584 A585 F642 V686 E689 W690	A581-T584 PolarHBondContact O-N 3.03Å; A581-A585 WeakPolarHBondContact O-CB 3.22Å; A581-A585 PolarHBondContact O-N 3.12Å; A581-F642 HydrophobicContact CB-CE1 4.23Å; A581-F642 HydrophobicContact CB-CE2 3.95Å; A581-F642 HydrophobicContact CB-CZ 3.53Å; A581-F642 VanDerWaalsContact N-CE2 3.29Å; A581-V686 HydrophobicContact CB-CG1 4.26Å; A581-V686 HydrophobicContact CB-CG2 4.35Å; A581-E689 HydrophobicContact CB-CB 4.38Å; A581-E689 WeakPolarHBondContact CB-OE2 3.29Å; A581-W690 PolarHBondContact O-NE1 3.03Å
582	Y	93.5	Very high	91.2	Very high	63 Å²	63	38.7 Å²	38.7	25%	0.247	19%	0.193	C	C	.	.	H	α-helix	trans	-56.7	-54.4	173.7	179.2	-93.4	0	0	0	112.8	L409 V412 T584 A585 L586 E689 L693	L409-Y582 HydrophobicContact CB-CE1 4.41Å; V412-Y582 WeakPolarHBondContact CG2-OH 3.39Å; Y582-T584 VanDerWaalsContact C-N 3.31Å; Y582-T584 PolarHBondContact O-N 2.8Å; Y582-A585 PolarHBondContact O-N 3.4Å; Y582-L586 HydrophobicContact CD1-CD1 4.13Å; Y582-L586 HydrophobicContact CE1-CD1 3.43Å; Y582-L586 VanDerWaalsContact CE1-CD1 3.43Å; Y582-L586 HydrophobicContact CE1-CG 4.46Å; Y582-L586 HydrophobicContact CE2-CD1 4Å; Y582-L586 PolarHBondContact O-N 3.34Å; Y582-L586 WeakPolarHBondContact OH-CD1 3.33Å; Y582-E689 WeakPolarHBondContact CB-OE2 3.46Å; Y582-E689 PolarHBondContact N-OE2 3.32Å; Y582-L693 HydrophobicContact CD2-CD1 3.72Å; Y582-L693 HydrophobicContact CE2-CD1 4.3Å; Y582-L693 HydrophobicContact CE2-CD2 4.49Å; Y582-L693 HydrophobicContact CG-CD1 4.46Å
583	V	93.4	Very high	90.9	Very high	21 Å²	21	34.4 Å²	34.4	13%	0.127	17%	0.168	C	C	.	.	H	α-helix	trans	-62.7	-40.5	-179.1	178	0	0	0	0	110.5	L409 E576 A577 S580 S587	L409-V583 HydrophobicContact CD1-CB 4.16Å; L409-V583 HydrophobicContact CD1-CG1 3.89Å; L409-V583 HydrophobicContact CD1-CG2 4.04Å; E576-V583 HydrophobicContact CG-CG1 4.49Å; A577-V583 HydrophobicContact CB-CG1 4.02Å; S580-V583 PolarHBondContact O-N 3.19Å; S580-V583 WeakPolarHBondContact OG-CG2 3.24Å; S580-V583 PolarHBondContact OG-N 2.83Å; V583-S587 WeakPolarHBondContact O-CB 3.43Å; V583-S587 PolarHBondContact O-N 3.14Å; V583-S587 PolarHBondContact O-OG 3.34Å
584	T	93.9	Very high	90.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61	-47.7	176.1	-67.9	0	0	0	0	111.8	A577 S580 A581 Y582 S587 F588 L639 F642	A577-T584 VanDerWaalsContact C-OG1 3.26Å; A577-T584 PolarHBondContact O-OG1 3Å; S580-T584 WeakPolarHBondContact O-CB 3.22Å; S580-T584 PolarHBondContact O-N 3.08Å; S580-T584 PolarHBondContact O-OG1 3.36Å; A581-T584 PolarHBondContact O-N 3.03Å; Y582-T584 VanDerWaalsContact C-N 3.31Å; Y582-T584 PolarHBondContact O-N 2.8Å; T584-S587 PolarHBondContact O-N 3.49Å; T584-F588 WeakPolarHBondContact O-CB 3.4Å; T584-F588 PolarHBondContact O-N 3.48Å; T584-L639 HydrophobicContact CG2-CD2 3.88Å; T584-L639 HydrophobicContact CG2-CG 4.43Å; T584-F642 HydrophobicContact CG2-CB 3.75Å; T584-F642 HydrophobicContact CG2-CG 4.17Å; T584-F642 WeakPolarHBondContact OG1-CB 3.14Å
585	A	91.1	Very high	90.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.2	-46	-176.9	0	0	0	0	0	111.9	A581 Y582 F588 N589 L693 L694	A581-A585 WeakPolarHBondContact O-CB 3.22Å; A581-A585 PolarHBondContact O-N 3.12Å; Y582-A585 PolarHBondContact O-N 3.4Å; A585-F588 PolarHBondContact O-N 2.86Å; A585-N589 WeakPolarHBondContact O-CB 3.36Å; A585-N589 VanDerWaalsContact O-CG 3.26Å; A585-N589 PolarHBondContact O-N 3.46Å; A585-L693 HydrophobicContact CB-CB 3.82Å; A585-L693 HydrophobicContact CB-CD1 3.84Å; A585-L693 HydrophobicContact CB-CG 4.48Å; A585-L694 HydrophobicContact CB-CD1 4.41Å; A585-L694 HydrophobicContact CB-CD2 3.86Å; A585-L694 HydrophobicContact CB-CG 3.83Å
586	L	91.1	Very high	89.8	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65.8	-40.1	175.5	-71.8	-176.9	0	0	0	112	L409 V412 L525 Y582 F588 N589 N590 L693	L409-L586 HydrophobicContact CB-CD1 3.91Å; L409-L586 HydrophobicContact CD1-CB 4.31Å; L409-L586 HydrophobicContact CD1-CD1 4.18Å; L409-L586 HydrophobicContact CD2-CB 4.33Å; L409-L586 HydrophobicContact CD2-CD1 4.48Å; L409-L586 HydrophobicContact CG-CD1 4.43Å; V412-L586 HydrophobicContact CG1-CD2 3.97Å; V412-L586 HydrophobicContact CG2-CD1 3.88Å; V412-L586 HydrophobicContact CG2-CD2 4.27Å; L525-L586 HydrophobicContact CB-CD2 4.48Å; L525-L586 WeakPolarHBondContact O-CD2 3.4Å; Y582-L586 HydrophobicContact CD1-CD1 4.13Å; Y582-L586 HydrophobicContact CE1-CD1 3.43Å; Y582-L586 VanDerWaalsContact CE1-CD1 3.43Å; Y582-L586 HydrophobicContact CE1-CG 4.46Å; Y582-L586 HydrophobicContact CE2-CD1 4Å; Y582-L586 PolarHBondContact O-N 3.34Å; Y582-L586 WeakPolarHBondContact OH-CD1 3.33Å; L586-F588 VanDerWaalsContact C-N 3.33Å; L586-F588 PolarHBondContact O-N 3.43Å; L586-N589 PolarHBondContact O-N 3.49Å; L586-N590 VanDerWaalsContact O-CB 3.32Å; L586-N590 WeakPolarHBondContact O-CB 3.26Å; L586-N590 PolarHBondContact O-N 2.8Å; L586-N590 PolarHBondContact O-OD1 2.85Å; L586-L693 HydrophobicContact CD2-CD2 3.94Å; L586-L693 HydrophobicContact CG-CD2 4.44Å
587	S	91.9	Very high	89.4	Confident	10 Å²	10	19.8 Å²	19.8	7%	0.07	10%	0.1	C	C	.	.	H	α-helix	trans	-62.8	-42	177	-60.3	0	0	0	0	111.7	V583 T584 M591	V583-S587 WeakPolarHBondContact O-CB 3.43Å; V583-S587 PolarHBondContact O-N 3.14Å; V583-S587 PolarHBondContact O-OG 3.34Å; T584-S587 PolarHBondContact O-N 3.49Å; S587-M591 WeakPolarHBondContact O-CG 3.19Å; S587-M591 PolarHBondContact O-N 2.85Å
588	F	88.6	Confident	88.9	Confident	4 Å²	4	19.8 Å²	19.8	2%	0.018	10%	0.1	C	C	.	.	H	α-helix	trans	-59.6	-51.2	172.7	170.4	-90	0	0	0	111.3	F485 T584 A585 L586 N590 M591 C592 A635 L639 L694 V698	F485-F588 AromaticContact CE1-CE2 3.88Å; F485-F588 HydrophobicContact CE1-CE2 3.88Å; F485-F588 AromaticContact CE1-CZ 3.65Å; F485-F588 HydrophobicContact CE1-CZ 3.65Å; F485-F588 HydrophobicContact CZ-CE2 4.4Å; F485-F588 HydrophobicContact CZ-CZ 4.06Å; T584-F588 WeakPolarHBondContact O-CB 3.4Å; T584-F588 PolarHBondContact O-N 3.48Å; A585-F588 PolarHBondContact O-N 2.86Å; L586-F588 VanDerWaalsContact C-N 3.33Å; L586-F588 PolarHBondContact O-N 3.43Å; F588-N590 PolarHBondContact O-N 3.48Å; F588-M591 PolarHBondContact O-N 3.43Å; F588-C592 VanDerWaalsContact CZ-SG 3.54Å; F588-C592 WeakPolarHBondContact O-CB 3.15Å; F588-C592 PolarHBondContact O-N 3.02Å; F588-C592 PolarHBondContact O-SG 3.41Å; F588-A635 HydrophobicContact CD2-CB 3.67Å; F588-A635 WeakPolarHBondContact CD2-O 3.2Å; F588-A635 HydrophobicContact CE2-CB 4.01Å; F588-A635 HydrophobicContact CG-CB 4.37Å; F588-L639 HydrophobicContact CB-CG 4.26Å; F588-L639 HydrophobicContact CD1-CD1 4.49Å; F588-L639 HydrophobicContact CD2-CD1 3.26Å; F588-L639 HydrophobicContact CD2-CG 3.74Å; F588-L639 HydrophobicContact CE2-CD1 3.47Å; F588-L639 VanDerWaalsContact CE2-CD1 3.47Å; F588-L639 HydrophobicContact CE2-CG 4.42Å; F588-L639 HydrophobicContact CG-CD1 3.86Å; F588-L639 HydrophobicContact CG-CG 4.1Å; F588-L639 HydrophobicContact CZ-CD1 4.2Å; F588-L694 HydrophobicContact CB-CD2 4.45Å; F588-L694 HydrophobicContact CD1-CD2 3.54Å; F588-L694 HydrophobicContact CE1-CD2 4.16Å; F588-L694 HydrophobicContact CG-CD2 4.22Å; F588-V698 HydrophobicContact CE1-CG1 3.97Å; F588-V698 HydrophobicContact CE1-CG2 4.36Å; F588-V698 HydrophobicContact CE2-CG1 4.27Å; F588-V698 HydrophobicContact CZ-CB 4.49Å; F588-V698 HydrophobicContact CZ-CG1 3.77Å; F588-V698 HydrophobicContact CZ-CG2 4.04Å
589	N	88.7	Confident	88	Confident	3 Å²	3	20.6 Å²	20.6	2%	0.016	10%	0.102	C	C	.	.	H	α-helix	trans	-62.2	-44.3	-178.8	-74	-13.2	0	0	0	111.8	L525 V526 A585 L586 M591 C592 F593 L693	L525-N589 WeakPolarHBondContact O-CB 3.27Å; L525-N589 PolarHBondContact O-ND2 2.79Å; V526-N589 HydrophobicContact CG1-CB 4.06Å; A585-N589 WeakPolarHBondContact O-CB 3.36Å; A585-N589 VanDerWaalsContact O-CG 3.26Å; A585-N589 PolarHBondContact O-N 3.46Å; L586-N589 PolarHBondContact O-N 3.49Å; N589-M591 PolarHBondContact O-N 3.45Å; N589-C592 PolarHBondContact O-N 3.26Å; N589-F593 VanDerWaalsContact O-CB 3.24Å; N589-F593 WeakPolarHBondContact O-CB 3.36Å; N589-F593 PolarHBondContact O-N 3.15Å; N589-L693 PolarHBondContact ND2-O 3.3Å
590	N	90.2	Very high	87	Confident	2 Å²	2	18.4 Å²	18.4	1%	0.011	9%	0.092	C	C	.	.	H	α-helix	trans	-58.6	-48.3	178.6	-72.8	-7.8	0	0	0	111.5	V526 S527 I529 L586 F588 C592 F593 L594	V526-N590 WeakPolarHBondContact CB-OD1 3.13Å; S527-N590 PolarHBondContact N-OD1 2.97Å; I529-N590 HydrophobicContact CB-CB 3.9Å; I529-N590 HydrophobicContact CD1-CB 4.39Å; I529-N590 HydrophobicContact CG1-CB 4.01Å; I529-N590 HydrophobicContact CG2-CB 4.04Å; I529-N590 WeakPolarHBondContact CG2-OD1 3.43Å; L586-N590 VanDerWaalsContact O-CB 3.32Å; L586-N590 WeakPolarHBondContact O-CB 3.26Å; L586-N590 PolarHBondContact O-N 2.8Å; L586-N590 PolarHBondContact O-OD1 2.85Å; F588-N590 PolarHBondContact O-N 3.48Å; N590-C592 PolarHBondContact O-N 2.98Å; N590-F593 PolarHBondContact O-N 3.26Å; N590-L594 PolarHBondContact O-N 3.14Å
591	M	89.6	Confident	86.1	Confident	3 Å²	3	18.1 Å²	18.1	2%	0.015	9%	0.085	C	C	.	.	H	α-helix	trans	-66.6	-38.9	179.7	-65.8	-55.7	106.8	0	0	112.2	F405 S587 F588 N589 A595 L631 L634 A635 Y638	F405-M591 HydrophobicContact CZ-CE 4.38Å; S587-M591 WeakPolarHBondContact O-CG 3.19Å; S587-M591 PolarHBondContact O-N 2.85Å; F588-M591 PolarHBondContact O-N 3.43Å; N589-M591 PolarHBondContact O-N 3.45Å; M591-A595 VanDerWaalsContact O-CB 3.31Å; M591-A595 WeakPolarHBondContact O-CB 3.32Å; M591-A595 PolarHBondContact O-N 3.04Å; M591-L631 HydrophobicContact SD-CD2 3.71Å; M591-L634 HydrophobicContact CG-CD2 4.29Å; M591-L634 HydrophobicContact CG-CG 4.34Å; M591-L634 HydrophobicContact SD-CD2 3.89Å; M591-A635 HydrophobicContact CB-CB 3.77Å; M591-Y638 HydrophobicContact CG-CD2 4.46Å; M591-Y638 HydrophobicContact CG-CE2 3.97Å
592	C	84.9	Confident	85.1	Confident	17 Å²	17	17.9 Å²	17.9	12%	0.115	8%	0.083	C	C	.	.	H	α-helix	trans	-66.2	-40.6	175.1	-76.3	0	0	0	0	112.3	F588 N589 N590 A595 R596 A635	F588-C592 VanDerWaalsContact CZ-SG 3.54Å; F588-C592 WeakPolarHBondContact O-CB 3.15Å; F588-C592 PolarHBondContact O-N 3.02Å; F588-C592 PolarHBondContact O-SG 3.41Å; N589-C592 PolarHBondContact O-N 3.26Å; N590-C592 PolarHBondContact O-N 2.98Å; C592-A595 PolarHBondContact O-N 2.75Å; C592-R596 WeakPolarHBondContact O-CB 3.43Å; C592-R596 PolarHBondContact O-N 3.06Å; C592-A635 VanDerWaalsContact SG-CB 3.57Å
593	F	85.1	Confident	83.7	Confident	30 Å²	30	19.2 Å²	19.2	13%	0.132	9%	0.093	C	C	.	.	H	α-helix	trans	-63.3	-50.3	177.5	-179.3	-108	0	0	0	110.9	V415 V526 I529 V530 V533 N589 N590 A595 R596 S597	V415-F593 HydrophobicContact CB-CE2 4.29Å; V415-F593 HydrophobicContact CG1-CD2 4.24Å; V415-F593 HydrophobicContact CG1-CE2 3.52Å; V415-F593 HydrophobicContact CG1-CZ 4.1Å; V415-F593 HydrophobicContact CG2-CE2 4.45Å; V526-F593 HydrophobicContact CG1-CB 3.97Å; V526-F593 HydrophobicContact CG1-CG 4.21Å; I529-F593 HydrophobicContact CG1-CD1 4.31Å; I529-F593 HydrophobicContact CG2-CD1 3.79Å; I529-F593 HydrophobicContact CG2-CE1 4.47Å; V530-F593 HydrophobicContact CG2-CE1 4.42Å; V533-F593 HydrophobicContact CB-CE1 4.02Å; V533-F593 HydrophobicContact CG1-CE1 4.08Å; V533-F593 HydrophobicContact CG1-CZ 4.49Å; V533-F593 HydrophobicContact CG2-CD1 3.93Å; V533-F593 HydrophobicContact CG2-CE1 3.76Å; N589-F593 VanDerWaalsContact O-CB 3.24Å; N589-F593 WeakPolarHBondContact O-CB 3.36Å; N589-F593 PolarHBondContact O-N 3.15Å; N590-F593 PolarHBondContact O-N 3.26Å; F593-A595 PolarHBondContact O-N 3.47Å; F593-R596 WeakPolarHBondContact O-CB 3.43Å; F593-R596 PolarHBondContact O-N 3.24Å; F593-R596 VanDerWaalsContact O-N 3.14Å; F593-S597 PolarHBondContact O-N 2.96Å; F593-S597 PolarHBondContact O-OG 3.25Å
594	L	88.5	Confident	82.6	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.3	-46.8	175.5	177	59.6	0	0	0	111.7	I529 Y532 V533 I536 A566 N590 R596 S597 L598 L631	I529-L594 HydrophobicContact CD1-CB 4.14Å; I529-L594 HydrophobicContact CD1-CD2 4.28Å; I529-L594 HydrophobicContact CG1-CB 4.23Å; Y532-L594 HydrophobicContact CD1-CD2 4.47Å; Y532-L594 HydrophobicContact CE1-CD2 4.29Å; V533-L594 HydrophobicContact CG2-CB 4.36Å; V533-L594 HydrophobicContact CG2-CD1 3.71Å; I536-L594 HydrophobicContact CD1-CD1 3.72Å; A566-L594 HydrophobicContact CB-CD2 3.54Å; N590-L594 PolarHBondContact O-N 3.14Å; L594-R596 PolarHBondContact O-N 3.4Å; L594-S597 PolarHBondContact O-N 3.33Å; L594-L598 HydrophobicContact CD1-CD1 4.1Å; L594-L598 HydrophobicContact CD1-CD2 4.4Å; L594-L598 HydrophobicContact CD1-CG 4.03Å; L594-L598 HydrophobicContact CG-CD1 4.08Å; L594-L598 HydrophobicContact CG-CG 4.44Å; L594-L598 VanDerWaalsContact O-CG 3.24Å; L594-L598 WeakPolarHBondContact O-CG 3.26Å; L594-L598 PolarHBondContact O-N 3.03Å; L594-L631 HydrophobicContact CB-CD1 4.44Å; L594-L631 HydrophobicContact CD2-CD1 3.85Å; L594-L631 HydrophobicContact CD2-CD2 3.89Å; L594-L631 HydrophobicContact CG-CD1 3.76Å
595	A	80.3	Confident	81.4	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-57.6	-38.3	177.6	0	0	0	0	0	112.1	M591 C592 F593 L599 A628 L631 R632	M591-A595 VanDerWaalsContact O-CB 3.31Å; M591-A595 WeakPolarHBondContact O-CB 3.32Å; M591-A595 PolarHBondContact O-N 3.04Å; C592-A595 PolarHBondContact O-N 2.75Å; F593-A595 PolarHBondContact O-N 3.47Å; A595-L599 VanDerWaalsContact O-CG 3.26Å; A595-L599 WeakPolarHBondContact O-CG 3.5Å; A595-L599 PolarHBondContact O-N 3.24Å; A595-A628 HydrophobicContact CB-CB 4.29Å; A595-L631 HydrophobicContact CB-CB 3.85Å; A595-L631 HydrophobicContact CB-CD1 4.33Å; A595-R632 HydrophobicContact CB-CG 3.81Å
596	R	77.9	Confident	80.2	Confident	59 Å²	59	22.6 Å²	22.6	22%	0.223	11%	0.109	C	C	.	.	H	α-helix	trans	-65.7	-53.1	175.9	173.9	-175.3	170	177.4	-6.2	111.6	C592 F593 L594 L598 L599 E600	C592-R596 WeakPolarHBondContact O-CB 3.43Å; C592-R596 PolarHBondContact O-N 3.06Å; F593-R596 WeakPolarHBondContact O-CB 3.43Å; F593-R596 PolarHBondContact O-N 3.24Å; F593-R596 VanDerWaalsContact O-N 3.14Å; L594-R596 PolarHBondContact O-N 3.4Å; R596-L598 PolarHBondContact O-N 2.75Å; R596-L599 WeakPolarHBondContact O-CB 3.31Å; R596-L599 PolarHBondContact O-N 2.93Å; R596-E600 HydrophobicContact CG-CG 4.44Å; R596-E600 IonicContact CZ-OE1 3.89Å; R596-E600 VanDerWaalsContact CZ-OE1 3.3Å; R596-E600 IonicContact NE-OE1 2.88Å; R596-E600 PolarHBondContact NE-OE1 3.12Å; R596-E600 IonicContact NH2-OE1 2.92Å; R596-E600 PolarHBondContact NH2-OE1 3.31Å; R596-E600 PolarHBondContact O-N 3.3Å
597	S	81.9	Confident	79.2	Confident	4 Å²	4	25.9 Å²	25.9	3%	0.028	12%	0.124	C	C	.	.	H	α-helix	trans	-56.1	-40.9	-178.6	-55.6	0	0	0	0	111.4	V533 F593 L594 L599 E600 W601	V533-S597 WeakPolarHBondContact CG1-OG 3.37Å; F593-S597 PolarHBondContact O-N 2.96Å; F593-S597 PolarHBondContact O-OG 3.25Å; L594-S597 PolarHBondContact O-N 3.33Å; S597-L599 PolarHBondContact O-N 3.41Å; S597-E600 PolarHBondContact O-N 2.93Å; S597-W601 VanDerWaalsContact O-CG 3.25Å; S597-W601 PolarHBondContact O-N 2.94Å
598	L	81.7	Confident	78.3	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-64.3	-37	176.5	-67.2	175.9	0	0	0	113.5	I536 A563 L594 R596 W601 N602 Y624 V627 L631	I536-L598 HydrophobicContact CG2-CD2 4.25Å; A563-L598 HydrophobicContact CB-CD1 3.59Å; A563-L598 HydrophobicContact CB-CD2 4.24Å; L594-L598 HydrophobicContact CD1-CD1 4.1Å; L594-L598 HydrophobicContact CD1-CD2 4.4Å; L594-L598 HydrophobicContact CD1-CG 4.03Å; L594-L598 HydrophobicContact CG-CD1 4.08Å; L594-L598 HydrophobicContact CG-CG 4.44Å; L594-L598 VanDerWaalsContact O-CG 3.24Å; L594-L598 WeakPolarHBondContact O-CG 3.26Å; L594-L598 PolarHBondContact O-N 3.03Å; R596-L598 PolarHBondContact O-N 2.75Å; L598-W601 HydrophobicContact CD2-CE3 4.01Å; L598-W601 HydrophobicContact CD2-CZ3 4.01Å; L598-N602 PolarHBondContact O-N 2.82Å; L598-Y624 HydrophobicContact CB-CD2 4.33Å; L598-Y624 HydrophobicContact CB-CG 4.01Å; L598-Y624 HydrophobicContact CD1-CD1 4.47Å; L598-Y624 HydrophobicContact CD2-CD1 3.8Å; L598-Y624 HydrophobicContact CD2-CD2 4.12Å; L598-Y624 HydrophobicContact CD2-CE1 3.86Å; L598-Y624 HydrophobicContact CD2-CE2 4.15Å; L598-Y624 HydrophobicContact CD2-CG 3.94Å; L598-Y624 HydrophobicContact CG-CD1 4.49Å; L598-Y624 HydrophobicContact CG-CG 4.43Å; L598-Y624 WeakPolarHBondContact O-CD2 3.45Å; L598-V627 HydrophobicContact CD1-CG1 4.39Å; L598-L631 HydrophobicContact CD1-CD1 3.56Å
599	L	74.7	Confident	77.5	Confident	36 Å²	36	28.9 Å²	28.9	19%	0.188	14%	0.136	C	C	.	.	H	α-helix	trans	-71	-38.6	176.1	-70.4	172.7	0	0	0	112.2	A595 R596 S597 W601 N602 L625 A628 R632	A595-L599 VanDerWaalsContact O-CG 3.26Å; A595-L599 WeakPolarHBondContact O-CG 3.5Å; A595-L599 PolarHBondContact O-N 3.24Å; R596-L599 WeakPolarHBondContact O-CB 3.31Å; R596-L599 PolarHBondContact O-N 2.93Å; S597-L599 PolarHBondContact O-N 3.41Å; L599-W601 VanDerWaalsContact C-N 3.3Å; L599-W601 PolarHBondContact O-N 3.01Å; L599-N602 WeakPolarHBondContact O-CB 3.32Å; L599-N602 PolarHBondContact O-N 3.2Å; L599-L625 HydrophobicContact CD2-CD2 3.45Å; L599-L625 VanDerWaalsContact CD2-CD2 3.45Å; L599-A628 HydrophobicContact CD1-CB 4.23Å; L599-A628 HydrophobicContact CD2-CB 3.77Å; L599-A628 HydrophobicContact CG-CB 3.75Å; L599-R632 VanDerWaalsContact CD1-CZ 3.46Å
600	E	72.1	Confident	76.4	Confident	90 Å²	90	29.7 Å²	29.7	42%	0.421	14%	0.143	S	C	.	.	H	α-helix	trans	-59.7	-44.2	174.2	-71.3	176.1	174.9	0	0	110.2	R596 S597	R596-E600 HydrophobicContact CG-CG 4.44Å; R596-E600 IonicContact CZ-OE1 3.89Å; R596-E600 VanDerWaalsContact CZ-OE1 3.3Å; R596-E600 IonicContact NE-OE1 2.88Å; R596-E600 PolarHBondContact NE-OE1 3.12Å; R596-E600 IonicContact NH2-OE1 2.92Å; R596-E600 PolarHBondContact NH2-OE1 3.31Å; R596-E600 PolarHBondContact O-N 3.3Å; S597-E600 PolarHBondContact O-N 2.93Å
601	W	74.8	Confident	75.4	Confident	31 Å²	31	34.9 Å²	34.9	12%	0.117	18%	0.175	C	C	.	.	H	α-helix	trans	-76.7	-19.2	177.7	-55.6	-33.8	0	0	0	114.7	V533 I536 E537 L540 S597 L598 L599 I603 D604 V605	V533-W601 HydrophobicContact CB-CH2 4.34Å; V533-W601 HydrophobicContact CG1-CH2 3.4Å; V533-W601 HydrophobicContact CG1-CZ2 3.77Å; V533-W601 HydrophobicContact CG1-CZ3 4.45Å; V533-W601 VanDerWaalsContact O-CH2 3.31Å; V533-W601 WeakPolarHBondContact O-CH2 3.47Å; I536-W601 HydrophobicContact CB-CH2 4.38Å; I536-W601 HydrophobicContact CB-CZ3 4.04Å; I536-W601 HydrophobicContact CG2-CE3 4.26Å; I536-W601 HydrophobicContact CG2-CH2 4.34Å; I536-W601 HydrophobicContact CG2-CZ3 3.55Å; E537-W601 HydrophobicContact CB-CH2 3.76Å; E537-W601 HydrophobicContact CB-CZ2 3.53Å; E537-W601 HydrophobicContact CG-CH2 4.4Å; E537-W601 HydrophobicContact CG-CZ2 3.73Å; L540-W601 HydrophobicContact CD1-CB 4.26Å; L540-W601 HydrophobicContact CD1-CD2 4.14Å; L540-W601 HydrophobicContact CD1-CE3 3.71Å; L540-W601 HydrophobicContact CD1-CG 4.4Å; L540-W601 HydrophobicContact CD1-CZ3 4.38Å; S597-W601 VanDerWaalsContact O-CG 3.25Å; S597-W601 PolarHBondContact O-N 2.94Å; L598-W601 HydrophobicContact CD2-CE3 4.01Å; L598-W601 HydrophobicContact CD2-CZ3 4.01Å; L599-W601 VanDerWaalsContact C-N 3.3Å; L599-W601 PolarHBondContact O-N 3.01Å; W601-I603 PolarHBondContact O-N 3.18Å; W601-D604 WeakPolarHBondContact O-CB 3.5Å; W601-D604 PolarHBondContact O-N 3.4Å; W601-D604 VanDerWaalsContact O-N 3.08Å; W601-V605 WeakPolarHBondContact O-CB 3.48Å; W601-V605 VanDerWaalsContact O-CG2 3.29Å; W601-V605 WeakPolarHBondContact O-CG2 3.29Å; W601-V605 PolarHBondContact O-N 2.71Å
602	N	72.2	Confident	74.3	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.011	19%	0.189	C	C	.	.	H	α-helix	trans	-56.8	-36.4	-178.5	-171.6	86.9	0	0	0	111.9	L598 L599 E606 T623 Y624	L598-N602 PolarHBondContact O-N 2.82Å; L599-N602 WeakPolarHBondContact O-CB 3.32Å; L599-N602 PolarHBondContact O-N 3.2Å; N602-E606 PolarHBondContact ND2-OE1 2.95Å; N602-E606 PolarHBondContact O-N 2.92Å; N602-E606 VanDerWaalsContact O-N 3.14Å; N602-T623 WeakPolarHBondContact OD1-CA 3.49Å; N602-T623 PolarHBondContact OD1-OG1 3.12Å; N602-Y624 PolarHBondContact OD1-N 2.86Å
603	I	66	Low	73.4	Confident	91 Å²	91	36.3 Å²	36.3	47%	0.467	19%	0.186	S	C	.	.	H	α-helix	trans	-62.7	-49.8	177.1	-58.8	173.7	0	0	0	110.1	W601 Q607	W601-I603 PolarHBondContact O-N 3.18Å; I603-Q607 WeakPolarHBondContact O-CG 3.2Å; I603-Q607 PolarHBondContact O-N 2.7Å
604	D	68.5	Low	72.5	Confident	40 Å²	40	43.6 Å²	43.6	21%	0.214	22%	0.22	C	C	.	.	H	α-helix	trans	-64	-40.9	178.8	-89.4	13.3	0	0	0	112.4	W601 Q607 K608	W601-D604 WeakPolarHBondContact O-CB 3.5Å; W601-D604 PolarHBondContact O-N 3.4Å; W601-D604 VanDerWaalsContact O-N 3.08Å; D604-Q607 PolarHBondContact O-N 2.68Å; D604-K608 HydrophobicContact CB-CD 4.26Å; D604-K608 WeakPolarHBondContact O-CB 3.39Å; D604-K608 WeakPolarHBondContact O-CG 2.76Å; D604-K608 PolarHBondContact O-N 3.42Å; D604-K608 IonicContact OD1-NZ 3.43Å; D604-K608 IonicContact OD2-NZ 2.88Å; D604-K608 PolarHBondContact OD2-NZ 3.38Å
605	V	69.7	Low	70.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61	-51.8	-180	165.5	0	0	0	0	110.7	L540 F544 F556 W601 Q607 L609 F622 Y624	L540-V605 HydrophobicContact CD1-CG2 4.34Å; L540-V605 HydrophobicContact CD2-CG2 3.91Å; F544-V605 HydrophobicContact CE1-CG2 4.13Å; F544-V605 HydrophobicContact CZ-CB 4.49Å; F544-V605 HydrophobicContact CZ-CG2 3.77Å; F556-V605 HydrophobicContact CD2-CG1 4.04Å; F556-V605 HydrophobicContact CE2-CG1 3.52Å; F556-V605 HydrophobicContact CE2-CG2 4.43Å; F556-V605 HydrophobicContact CZ-CG1 4.34Å; W601-V605 WeakPolarHBondContact O-CB 3.48Å; W601-V605 VanDerWaalsContact O-CG2 3.29Å; W601-V605 WeakPolarHBondContact O-CG2 3.29Å; W601-V605 PolarHBondContact O-N 2.71Å; V605-Q607 VanDerWaalsContact C-N 3.25Å; V605-Q607 PolarHBondContact O-N 2.77Å; V605-L609 HydrophobicContact CG1-CD1 3.75Å; V605-L609 HydrophobicContact CG1-CG 4.48Å; V605-L609 VanDerWaalsContact O-CB 3.22Å; V605-L609 WeakPolarHBondContact O-CB 3.4Å; V605-L609 WeakPolarHBondContact O-CG 3.39Å; V605-L609 PolarHBondContact O-N 3.38Å; V605-F622 HydrophobicContact CG1-CB 4.08Å; V605-Y624 HydrophobicContact CG2-CD2 4.45Å; V605-Y624 HydrophobicContact CG2-CE2 3.87Å
606	E	66.3	Low	69.5	Low	52 Å²	52	48 Å²	48	24%	0.243	25%	0.25	C	S	.	.	H	α-helix	trans	-58	-41.5	-179.6	-76	177.1	-165.7	0	0	110.9	N602 A610 P617	N602-E606 PolarHBondContact ND2-OE1 2.95Å; N602-E606 PolarHBondContact O-N 2.92Å; N602-E606 VanDerWaalsContact O-N 3.14Å; E606-A610 WeakPolarHBondContact O-CB 3.3Å; E606-A610 PolarHBondContact O-N 2.61Å; E606-P617 HydrophobicContact CB-CB 4.29Å; E606-P617 WeakPolarHBondContact O-CB 3.28Å
607	Q	69	Low	68.1	Low	69 Å²	69	47.2 Å²	47.2	32%	0.322	25%	0.253	S	S	.	.	H	α-helix	trans	-76.7	-53.4	-177.7	-64.5	171.1	18.3	0	0	112.8	W429 I603 D604 V605 L609 A610 V611	W429-Q607 HydrophobicContact CH2-CG 4.36Å; W429-Q607 HydrophobicContact CZ3-CG 4.01Å; I603-Q607 WeakPolarHBondContact O-CG 3.2Å; I603-Q607 PolarHBondContact O-N 2.7Å; D604-Q607 PolarHBondContact O-N 2.68Å; V605-Q607 VanDerWaalsContact C-N 3.25Å; V605-Q607 PolarHBondContact O-N 2.77Å; Q607-L609 PolarHBondContact O-N 3.47Å; Q607-A610 PolarHBondContact O-N 2.77Å; Q607-V611 WeakPolarHBondContact O-CG2 3.1Å; Q607-V611 PolarHBondContact O-N 2.91Å; Q607-V611 VanDerWaalsContact O-N 3.13Å
608	K	74	Confident	66.5	Low	77 Å²	77	52.2 Å²	52.2	34%	0.335	29%	0.287	S	S	.	.	H	α-helix	trans	-69.1	-36	-173.1	-68	173.6	179.2	165.2	0	111.6	F544 D604 A612	F544-K608 HydrophobicContact CD1-CB 3.74Å; F544-K608 HydrophobicContact CD1-CD 4.49Å; F544-K608 HydrophobicContact CD2-CB 4.5Å; F544-K608 HydrophobicContact CD2-CD 3.74Å; F544-K608 HydrophobicContact CE1-CB 3.99Å; F544-K608 HydrophobicContact CE2-CD 3.87Å; F544-K608 HydrophobicContact CG-CB 4.02Å; F544-K608 HydrophobicContact CG-CD 4.08Å; F544-K608 HydrophobicContact CZ-CB 4.45Å; F544-K608 HydrophobicContact CZ-CD 4.31Å; D604-K608 HydrophobicContact CB-CD 4.26Å; D604-K608 WeakPolarHBondContact O-CB 3.39Å; D604-K608 WeakPolarHBondContact O-CG 2.76Å; D604-K608 PolarHBondContact O-N 3.42Å; D604-K608 IonicContact OD1-NZ 3.43Å; D604-K608 IonicContact OD2-NZ 2.88Å; D604-K608 PolarHBondContact OD2-NZ 3.38Å; K608-A612 WeakPolarHBondContact O-CB 3.31Å; K608-A612 PolarHBondContact O-N 3.06Å
609	L	70.8	Confident	64.8	Low	1 Å²	1	58.5 Å²	58.5	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-75.2	-35.7	175.3	-68	-179	0	0	0	112.6	A543 F544 F556 V605 Q607 V611 A612 F613 F622	A543-L609 HydrophobicContact CB-CD2 4.43Å; F544-L609 HydrophobicContact CD1-CD2 3.89Å; F544-L609 HydrophobicContact CD1-CG 4.15Å; F544-L609 HydrophobicContact CE1-CD2 4.15Å; F544-L609 HydrophobicContact CE1-CG 3.96Å; F556-L609 HydrophobicContact CB-CD1 4.25Å; F556-L609 HydrophobicContact CD2-CD1 3.77Å; F556-L609 HydrophobicContact CE2-CD1 4.4Å; F556-L609 HydrophobicContact CG-CD1 3.99Å; V605-L609 HydrophobicContact CG1-CD1 3.75Å; V605-L609 HydrophobicContact CG1-CG 4.48Å; V605-L609 VanDerWaalsContact O-CB 3.22Å; V605-L609 WeakPolarHBondContact O-CB 3.4Å; V605-L609 WeakPolarHBondContact O-CG 3.39Å; V605-L609 PolarHBondContact O-N 3.38Å; Q607-L609 PolarHBondContact O-N 3.47Å; L609-V611 VanDerWaalsContact C-N 3.25Å; L609-V611 PolarHBondContact O-N 2.91Å; L609-A612 PolarHBondContact O-N 3.33Å; L609-A612 VanDerWaalsContact O-N 3.14Å; L609-F613 HydrophobicContact CB-CD2 3.99Å; L609-F613 HydrophobicContact CB-CE2 3.71Å; L609-F613 HydrophobicContact CD1-CE2 4.29Å; L609-F613 HydrophobicContact CD2-CE2 3.93Å; L609-F613 HydrophobicContact CD2-CZ 4.13Å; L609-F613 HydrophobicContact CG-CE2 4.18Å; L609-F613 WeakPolarHBondContact O-CB 3.43Å; L609-F613 WeakPolarHBondContact O-CD2 3.43Å; L609-F613 WeakPolarHBondContact O-CG 3.35Å; L609-F613 PolarHBondContact O-N 2.68Å; L609-F622 HydrophobicContact CB-CD2 4.28Å; L609-F622 HydrophobicContact CD1-CB 4.1Å; L609-F622 HydrophobicContact CD1-CD1 4.38Å; L609-F622 HydrophobicContact CD1-CD2 4.07Å; L609-F622 HydrophobicContact CD1-CG 3.93Å
610	A	66.7	Low	63.8	Low	20 Å²	20	61.6 Å²	61.6	17%	0.165	33%	0.332	C	S	.	.	H	α-helix	trans	-57.9	-41.6	172.7	0	0	0	0	0	111.8	E606 Q607 H614 C615 P617	E606-A610 WeakPolarHBondContact O-CB 3.3Å; E606-A610 PolarHBondContact O-N 2.61Å; Q607-A610 PolarHBondContact O-N 2.77Å; A610-H614 PolarHBondContact O-N 2.98Å; A610-H614 VanDerWaalsContact O-N 3.1Å; A610-C615 PolarHBondContact O-N 3.49Å; A610-P617 HydrophobicContact CB-CB 4.01Å; A610-P617 HydrophobicContact CB-CG 3.82Å
611	V	68.3	Low	63.4	Low	111 Å²	111	59.4 Å²	59.4	67%	0.673	33%	0.334	S	S	*	.	H	α-helix	trans	-64.1	-45.2	173.9	174.4	0	0	0	0	111.1	Q607 L609 F613	Q607-V611 WeakPolarHBondContact O-CG2 3.1Å; Q607-V611 PolarHBondContact O-N 2.91Å; Q607-V611 VanDerWaalsContact O-N 3.13Å; L609-V611 VanDerWaalsContact C-N 3.25Å; L609-V611 PolarHBondContact O-N 2.91Å; V611-F613 VanDerWaalsContact C-N 3.29Å; V611-F613 PolarHBondContact O-N 3.34Å
612	A	66.8	Low	63.3	Low	37 Å²	37	58.7 Å²	58.7	31%	0.306	33%	0.331	S	S	.	.	H	α-helix	trans	-64.2	-30.9	-179.4	0	0	0	0	0	113.6	K608 L609	K608-A612 WeakPolarHBondContact O-CB 3.31Å; K608-A612 PolarHBondContact O-N 3.06Å; L609-A612 PolarHBondContact O-N 3.33Å; L609-A612 VanDerWaalsContact O-N 3.14Å
613	F	66.4	Low	63.4	Low	13 Å²	13	60.1 Å²	60.1	6%	0.057	34%	0.34	C	S	.	.	H	α-helix	trans	-99.9	-5.3	-176.3	-61.1	-46.8	0	0	0	114.8	Q549 A552 I553 L609 V611 C615 F622	Q549-F613 HydrophobicContact CB-CD1 3.82Å; Q549-F613 HydrophobicContact CB-CE1 3.94Å; Q549-F613 HydrophobicContact CG-CD1 3.41Å; Q549-F613 VanDerWaalsContact CG-CD1 3.41Å; Q549-F613 HydrophobicContact CG-CE1 3.55Å; Q549-F613 WeakPolarHBondContact O-CE1 3.38Å; A552-F613 HydrophobicContact CB-CE1 3.71Å; A552-F613 HydrophobicContact CB-CZ 3.76Å; I553-F613 HydrophobicContact CD1-CE1 4.29Å; I553-F613 HydrophobicContact CD1-CZ 4.38Å; I553-F613 HydrophobicContact CG1-CE1 3.72Å; I553-F613 HydrophobicContact CG1-CE2 4.29Å; I553-F613 HydrophobicContact CG1-CZ 3.45Å; I553-F613 VanDerWaalsContact CG1-CZ 3.45Å; L609-F613 HydrophobicContact CB-CD2 3.99Å; L609-F613 HydrophobicContact CB-CE2 3.71Å; L609-F613 HydrophobicContact CD1-CE2 4.29Å; L609-F613 HydrophobicContact CD2-CE2 3.93Å; L609-F613 HydrophobicContact CD2-CZ 4.13Å; L609-F613 HydrophobicContact CG-CE2 4.18Å; L609-F613 WeakPolarHBondContact O-CB 3.43Å; L609-F613 WeakPolarHBondContact O-CD2 3.43Å; L609-F613 WeakPolarHBondContact O-CG 3.35Å; L609-F613 PolarHBondContact O-N 2.68Å; V611-F613 VanDerWaalsContact C-N 3.29Å; V611-F613 PolarHBondContact O-N 3.34Å; F613-C615 HydrophobicContact CB-CB 4.37Å; F613-C615 WeakPolarHBondContact CB-SG 3.41Å; F613-C615 PolarHBondContact O-N 3.48Å; F613-C615 VanDerWaalsContact O-N 3.08Å; F613-F622 HydrophobicContact CD2-CD2 4.26Å; F613-F622 AromaticContact CD2-CE2 3.47Å; F613-F622 HydrophobicContact CD2-CE2 3.47Å; F613-F622 VanDerWaalsContact CD2-CE2 3.47Å; F613-F622 HydrophobicContact CD2-CZ 4.15Å; F613-F622 AromaticContact CE2-CD2 3.95Å; F613-F622 HydrophobicContact CE2-CD2 3.95Å; F613-F622 AromaticContact CE2-CE2 3.15Å; F613-F622 HydrophobicContact CE2-CE2 3.15Å; F613-F622 AromaticContact CE2-CZ 3.49Å; F613-F622 HydrophobicContact CE2-CZ 3.49Å; F613-F622 VanDerWaalsContact CE2-CZ 3.49Å; F613-F622 HydrophobicContact CZ-CE2 4.17Å; F613-F622 HydrophobicContact CZ-CZ 4.09Å
614	H	65.1	Low	64.1	Low	182 Å²	182	55.8 Å²	55.8	84%	0.843	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	29.7	-171.4	-56.7	-62.8	0	0	0	113.3	A610	A610-H614 PolarHBondContact O-N 2.98Å; A610-H614 VanDerWaalsContact O-N 3.1Å
615	C	56	Low	64.4	Low	34 Å²	34	54.3 Å²	54.3	23%	0.23	31%	0.31	C	S	.	.	S	Bend	trans	-131.3	158.9	-177.2	76	0	0	0	0	111.4	A610 F613 F620	A610-C615 PolarHBondContact O-N 3.49Å; F613-C615 HydrophobicContact CB-CB 4.37Å; F613-C615 WeakPolarHBondContact CB-SG 3.41Å; F613-C615 PolarHBondContact O-N 3.48Å; F613-C615 VanDerWaalsContact O-N 3.08Å; C615-F620 HydrophobicContact CB-CE2 4.28Å; C615-F620 WeakPolarHBondContact SG-CE2 3.47Å
616	S	51.4	Low	64.7	Low	59 Å²	59	57 Å²	57	41%	0.413	32%	0.324	S	S	.	.			trans	-63.4	130.4	175.5	-179.1	0	0	0	0	110.8	C618 L619	S616-C618 PolarHBondContact O-N 3.15Å; S616-C618 VanDerWaalsContact O-N 3.1Å; S616-C618 PolarHBondContact OG-SG 3.45Å; S616-C618 VanDerWaalsContact OG-SG 3.33Å; S616-L619 PolarHBondContact O-N 3.05Å; S616-L619 VanDerWaalsContact O-N 3.16Å
617	P	48.8	Very low	65.5	Low	43 Å²	43	54.5 Å²	54.5	28%	0.279	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-59.8	-25.2	-177.1	14	-21.1	0	0	0	113.4	E606 A610 L619	E606-P617 HydrophobicContact CB-CB 4.29Å; E606-P617 WeakPolarHBondContact O-CB 3.28Å; A610-P617 HydrophobicContact CB-CB 4.01Å; A610-P617 HydrophobicContact CB-CG 3.82Å; P617-L619 PolarHBondContact O-N 3.37Å
618	C	48.3	Very low	65.9	Low	108 Å²	108	51.2 Å²	51.2	73%	0.73	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-64.1	-26.8	-179.5	-33.7	0	0	0	0	113.2	S616 F620	S616-C618 PolarHBondContact O-N 3.15Å; S616-C618 VanDerWaalsContact O-N 3.1Å; S616-C618 PolarHBondContact OG-SG 3.45Å; S616-C618 VanDerWaalsContact OG-SG 3.33Å; C618-F620 VanDerWaalsContact C-N 3.32Å; C618-F620 PolarHBondContact O-N 3.11Å
619	L	44.6	Very low	66.1	Low	132 Å²	132	52.2 Å²	52.2	69%	0.691	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-75	-19.2	-168.6	-79.2	160.1	0	0	0	114	S616 P617	S616-L619 PolarHBondContact O-N 3.05Å; S616-L619 VanDerWaalsContact O-N 3.16Å; P617-L619 PolarHBondContact O-N 3.37Å
620	F	53.9	Low	66.8	Low	101 Å²	101	56.8 Å²	56.8	44%	0.443	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119	1.1	-172.6	-71.3	-81.4	0	0	0	114.5	C615 C618 F622	C615-F620 HydrophobicContact CB-CE2 4.28Å; C615-F620 WeakPolarHBondContact SG-CE2 3.47Å; C618-F620 VanDerWaalsContact C-N 3.32Å; C618-F620 PolarHBondContact O-N 3.11Å; F620-F622 HydrophobicContact CB-CD1 4.26Å; F620-F622 HydrophobicContact CB-CD2 3.67Å; F620-F622 HydrophobicContact CB-CE1 3.93Å; F620-F622 HydrophobicContact CB-CE2 3.22Å; F620-F622 HydrophobicContact CB-CG 4.17Å; F620-F622 HydrophobicContact CB-CZ 3.39Å; F620-F622 HydrophobicContact CD1-CZ 4.34Å; F620-F622 HydrophobicContact CD2-CE2 4.16Å; F620-F622 AromaticContact CG-CE2 3.8Å; F620-F622 HydrophobicContact CG-CE2 3.8Å; F620-F622 AromaticContact CG-CZ 3.9Å; F620-F622 HydrophobicContact CG-CZ 3.9Å; F620-F622 PolarHBondContact O-N 3.49Å
621	G	63.9	Low	67.7	Low	45 Å²	45	55.9 Å²	55.9	46%	0.464	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	29.3	176.6	0	0	0	0	0	113.8	T623	G621-T623 VanDerWaalsContact C-N 3.26Å; G621-T623 PolarHBondContact O-N 2.73Å
622	F	72	Confident	68.4	Low	16 Å²	16	52.2 Å²	52.2	7%	0.07	29%	0.288	C	S	.	.			trans	-71.7	81.8	176.2	-60	-45	0	0	0	110.7	I553 F556 V605 L609 F613 F620	I553-F622 HydrophobicContact CG1-CZ 4.07Å; F556-F622 AromaticContact CD1-CD1 3.41Å; F556-F622 HydrophobicContact CD1-CD1 3.41Å; F556-F622 VanDerWaalsContact CD1-CD1 3.41Å; F556-F622 AromaticContact CD1-CE1 3.85Å; F556-F622 HydrophobicContact CD1-CE1 3.85Å; F556-F622 HydrophobicContact CD1-CG 4.39Å; F556-F622 HydrophobicContact CE1-CB 4.2Å; F556-F622 AromaticContact CE1-CD1 3.39Å; F556-F622 HydrophobicContact CE1-CD1 3.39Å; F556-F622 HydrophobicContact CE1-CE1 4.22Å; F556-F622 HydrophobicContact CE1-CG 4.23Å; F556-F622 HydrophobicContact CE2-CB 4.4Å; F556-F622 HydrophobicContact CG-CD1 4.13Å; F556-F622 HydrophobicContact CZ-CB 4.01Å; F556-F622 HydrophobicContact CZ-CD1 4.08Å; V605-F622 HydrophobicContact CG1-CB 4.08Å; L609-F622 HydrophobicContact CB-CD2 4.28Å; L609-F622 HydrophobicContact CD1-CB 4.1Å; L609-F622 HydrophobicContact CD1-CD1 4.38Å; L609-F622 HydrophobicContact CD1-CD2 4.07Å; L609-F622 HydrophobicContact CD1-CG 3.93Å; F613-F622 HydrophobicContact CD2-CD2 4.26Å; F613-F622 AromaticContact CD2-CE2 3.47Å; F613-F622 HydrophobicContact CD2-CE2 3.47Å; F613-F622 VanDerWaalsContact CD2-CE2 3.47Å; F613-F622 HydrophobicContact CD2-CZ 4.15Å; F613-F622 AromaticContact CE2-CD2 3.95Å; F613-F622 HydrophobicContact CE2-CD2 3.95Å; F613-F622 AromaticContact CE2-CE2 3.15Å; F613-F622 HydrophobicContact CE2-CE2 3.15Å; F613-F622 AromaticContact CE2-CZ 3.49Å; F613-F622 HydrophobicContact CE2-CZ 3.49Å; F613-F622 VanDerWaalsContact CE2-CZ 3.49Å; F613-F622 HydrophobicContact CZ-CE2 4.17Å; F613-F622 HydrophobicContact CZ-CZ 4.09Å; F620-F622 HydrophobicContact CB-CD1 4.26Å; F620-F622 HydrophobicContact CB-CD2 3.67Å; F620-F622 HydrophobicContact CB-CE1 3.93Å; F620-F622 HydrophobicContact CB-CE2 3.22Å; F620-F622 HydrophobicContact CB-CG 4.17Å; F620-F622 HydrophobicContact CB-CZ 3.39Å; F620-F622 HydrophobicContact CD1-CZ 4.34Å; F620-F622 HydrophobicContact CD2-CE2 4.16Å; F620-F622 AromaticContact CG-CE2 3.8Å; F620-F622 HydrophobicContact CG-CE2 3.8Å; F620-F622 AromaticContact CG-CZ 3.9Å; F620-F622 HydrophobicContact CG-CZ 3.9Å; F620-F622 PolarHBondContact O-N 3.49Å
623	T	75.4	Confident	69.2	Low	31 Å²	31	56.7 Å²	56.7	19%	0.19	30%	0.302	C	S	.	.			trans	-141.5	159.5	-179.1	-176.5	0	0	0	0	110.6	R560 N602 G621 L625	R560-T623 PolarHBondContact NH1-O 2.86Å; N602-T623 WeakPolarHBondContact OD1-CA 3.49Å; N602-T623 PolarHBondContact OD1-OG1 3.12Å; G621-T623 VanDerWaalsContact C-N 3.26Å; G621-T623 PolarHBondContact O-N 2.73Å; T623-L625 VanDerWaalsContact OG1-CG 3.24Å; T623-L625 WeakPolarHBondContact OG1-CG 3.49Å; T623-L625 PolarHBondContact OG1-N 3.32Å; T623-L625 VanDerWaalsContact OG1-N 3.13Å
624	Y	80	Confident	70.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.301	C	S	.	.			trans	-112.1	-1.1	167.5	-68.6	-62.4	0	0	0	113.5	L540 F556 S559 R560 L598 N602 V605 D626 V627 A628	L540-Y624 HydrophobicContact CD1-CE2 3.88Å; L540-Y624 WeakPolarHBondContact CD1-OH 3.05Å; L540-Y624 HydrophobicContact CD2-CE2 4.37Å; L540-Y624 VanDerWaalsContact CD2-OH 3.28Å; L540-Y624 WeakPolarHBondContact CD2-OH 3.38Å; F556-Y624 HydrophobicContact CE2-CE1 4.41Å; F556-Y624 HydrophobicContact CE2-CE2 4.19Å; F556-Y624 AromaticContact CE2-CZ 3.9Å; S559-Y624 WeakPolarHBondContact CB-OH 3.47Å; S559-Y624 PolarHBondContact OG-OH 3.4Å; R560-Y624 HydrophobicContact CB-CE1 3.94Å; R560-Y624 HydrophobicContact CG-CE1 4.28Å; L598-Y624 HydrophobicContact CB-CD2 4.33Å; L598-Y624 HydrophobicContact CB-CG 4.01Å; L598-Y624 HydrophobicContact CD1-CD1 4.47Å; L598-Y624 HydrophobicContact CD2-CD1 3.8Å; L598-Y624 HydrophobicContact CD2-CD2 4.12Å; L598-Y624 HydrophobicContact CD2-CE1 3.86Å; L598-Y624 HydrophobicContact CD2-CE2 4.15Å; L598-Y624 HydrophobicContact CD2-CG 3.94Å; L598-Y624 HydrophobicContact CG-CD1 4.49Å; L598-Y624 HydrophobicContact CG-CG 4.43Å; L598-Y624 WeakPolarHBondContact O-CD2 3.45Å; N602-Y624 PolarHBondContact OD1-N 2.86Å; V605-Y624 HydrophobicContact CG2-CD2 4.45Å; V605-Y624 HydrophobicContact CG2-CE2 3.87Å; Y624-D626 VanDerWaalsContact C-N 3.29Å; Y624-D626 PolarHBondContact O-N 2.83Å; Y624-V627 PolarHBondContact O-N 2.98Å; Y624-V627 VanDerWaalsContact O-N 3.1Å; Y624-A628 WeakPolarHBondContact O-CB 3.48Å; Y624-A628 PolarHBondContact O-N 3.16Å
625	L	75.5	Confident	71.1	Confident	9 Å²	9	47.7 Å²	47.7	5%	0.047	26%	0.261	C	S	.	.	H	α-helix	trans	-57.5	-41.9	-170.6	-64.8	176.9	0	0	0	112.7	T473 I474 L599 T623 K629	T473-L625 HydrophobicContact CG2-CB 4.17Å; T473-L625 HydrophobicContact CG2-CD1 3.68Å; I474-L625 HydrophobicContact CG1-CD1 4.02Å; I474-L625 HydrophobicContact CG1-CD2 3.63Å; L599-L625 HydrophobicContact CD2-CD2 3.45Å; L599-L625 VanDerWaalsContact CD2-CD2 3.45Å; T623-L625 VanDerWaalsContact OG1-CG 3.24Å; T623-L625 WeakPolarHBondContact OG1-CG 3.49Å; T623-L625 PolarHBondContact OG1-N 3.32Å; T623-L625 VanDerWaalsContact OG1-N 3.13Å; L625-K629 PolarHBondContact O-N 3.03Å; L625-K629 VanDerWaalsContact O-N 3.14Å
626	D	76.3	Confident	72.5	Confident	56 Å²	56	47.3 Å²	47.3	30%	0.299	26%	0.257	S	S	.	.	H	α-helix	trans	-69	-37.5	179.1	67.6	-47.9	0	0	0	112.8	R560 Y624 K630	R560-D626 IonicContact CZ-OD1 3.85Å; R560-D626 IonicContact CZ-OD2 2.94Å; R560-D626 IonicContact NH1-OD1 3.04Å; R560-D626 PolarHBondContact NH1-OD1 2.77Å; R560-D626 IonicContact NH1-OD2 3.93Å; R560-D626 IonicContact NH2-OD1 3.91Å; R560-D626 PolarHBondContact NH2-OD1 3.01Å; R560-D626 IonicContact NH2-OD2 3.95Å; R560-D626 PolarHBondContact NH2-OD2 3.4Å; Y624-D626 VanDerWaalsContact C-N 3.29Å; Y624-D626 PolarHBondContact O-N 2.83Å; D626-K630 WeakPolarHBondContact O-CG 3.4Å; D626-K630 PolarHBondContact O-N 3.4Å
627	V	82	Confident	74.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-73.9	-43.2	178.8	-176.4	0	0	0	0	110.6	R560 A563 W564 I567 L598 Y624 K629 K630 L631	R560-V627 VanDerWaalsContact NH1-CG2 3.3Å; A563-V627 HydrophobicContact CB-CG1 3.61Å; W564-V627 HydrophobicContact CD2-CG2 4.49Å; W564-V627 HydrophobicContact CG-CG2 4.45Å; W564-V627 HydrophobicContact CZ2-CG2 4.45Å; W564-V627 VanDerWaalsContact NE1-CG2 3.34Å; I567-V627 HydrophobicContact CD1-CG1 3.77Å; L598-V627 HydrophobicContact CD1-CG1 4.39Å; Y624-V627 PolarHBondContact O-N 2.98Å; Y624-V627 VanDerWaalsContact O-N 3.1Å; V627-K629 VanDerWaalsContact C-N 3.3Å; V627-K629 PolarHBondContact O-N 3.41Å; V627-K630 PolarHBondContact O-N 3.23Å; V627-K630 VanDerWaalsContact O-N 3.1Å; V627-L631 HydrophobicContact CG1-CD1 4.13Å; V627-L631 HydrophobicContact CG1-CG 4.5Å; V627-L631 WeakPolarHBondContact O-CG 3.44Å; V627-L631 PolarHBondContact O-N 3.35Å
628	A	78.7	Confident	76.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58.8	-41.2	175.6	0	0	0	0	0	111.8	A595 L599 Y624 K630 L631 R632	A595-A628 HydrophobicContact CB-CB 4.29Å; L599-A628 HydrophobicContact CD1-CB 4.23Å; L599-A628 HydrophobicContact CD2-CB 3.77Å; L599-A628 HydrophobicContact CG-CB 3.75Å; Y624-A628 WeakPolarHBondContact O-CB 3.48Å; Y624-A628 PolarHBondContact O-N 3.16Å; A628-K630 PolarHBondContact O-N 3.29Å; A628-L631 PolarHBondContact O-N 2.92Å; A628-R632 WeakPolarHBondContact O-CG 3.36Å; A628-R632 PolarHBondContact O-N 3.38Å
629	K	77.9	Confident	78.1	Confident	98 Å²	98	39.9 Å²	39.9	43%	0.426	21%	0.205	S	C	.	.	H	α-helix	trans	-58.8	-46.4	173.2	175.9	174.8	171.8	163.7	0	111.8	E480 L625 V627 R632 H633	E480-K629 IonicContact OE1-NZ 2.85Å; E480-K629 PolarHBondContact OE1-NZ 2.71Å; E480-K629 WeakPolarHBondContact OE2-CD 3.49Å; E480-K629 WeakPolarHBondContact OE2-CE 3.24Å; E480-K629 IonicContact OE2-NZ 3Å; E480-K629 PolarHBondContact OE2-NZ 2.97Å; L625-K629 PolarHBondContact O-N 3.03Å; L625-K629 VanDerWaalsContact O-N 3.14Å; V627-K629 VanDerWaalsContact C-N 3.3Å; V627-K629 PolarHBondContact O-N 3.41Å; K629-R632 PolarHBondContact O-N 3.36Å; K629-H633 PolarHBondContact O-N 3.49Å
630	K	84.6	Confident	80.3	Confident	98 Å²	98	36.4 Å²	36.4	43%	0.426	19%	0.187	S	C	.	.	H	α-helix	trans	-67.5	-36.2	179.4	-71.6	172	-175.2	-81.5	0	112.8	W564 I567 D626 V627 A628 H633 L634	W564-K630 HydrophobicContact CH2-CD 3.28Å; W564-K630 HydrophobicContact CZ2-CD 3.89Å; W564-K630 HydrophobicContact CZ3-CD 3.77Å; I567-K630 HydrophobicContact CD1-CB 3.56Å; I567-K630 HydrophobicContact CD1-CD 4.35Å; I567-K630 HydrophobicContact CG1-CB 4.42Å; D626-K630 WeakPolarHBondContact O-CG 3.4Å; D626-K630 PolarHBondContact O-N 3.4Å; V627-K630 PolarHBondContact O-N 3.23Å; V627-K630 VanDerWaalsContact O-N 3.1Å; A628-K630 PolarHBondContact O-N 3.29Å; K630-H633 PolarHBondContact O-N 3.12Å; K630-L634 PolarHBondContact O-N 2.87Å
631	L	85	Confident	82.2	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.5	-45.9	174.2	-76.9	165	0	0	0	111.8	A566 I567 M591 L594 A595 L598 V627 A628 H633 L634 A635	A566-L631 HydrophobicContact CB-CD2 4.19Å; I567-L631 HydrophobicContact CD1-CD2 4.44Å; I567-L631 HydrophobicContact CD1-CG 4.13Å; I567-L631 HydrophobicContact CG1-CD2 3.58Å; I567-L631 HydrophobicContact CG1-CG 3.77Å; M591-L631 HydrophobicContact SD-CD2 3.71Å; L594-L631 HydrophobicContact CB-CD1 4.44Å; L594-L631 HydrophobicContact CD2-CD1 3.85Å; L594-L631 HydrophobicContact CD2-CD2 3.89Å; L594-L631 HydrophobicContact CG-CD1 3.76Å; A595-L631 HydrophobicContact CB-CB 3.85Å; A595-L631 HydrophobicContact CB-CD1 4.33Å; L598-L631 HydrophobicContact CD1-CD1 3.56Å; V627-L631 HydrophobicContact CG1-CD1 4.13Å; V627-L631 HydrophobicContact CG1-CG 4.5Å; V627-L631 WeakPolarHBondContact O-CG 3.44Å; V627-L631 PolarHBondContact O-N 3.35Å; A628-L631 PolarHBondContact O-N 2.92Å; L631-H633 VanDerWaalsContact C-N 3.32Å; L631-H633 PolarHBondContact O-N 3.32Å; L631-L634 WeakPolarHBondContact O-CB 3.31Å; L631-L634 PolarHBondContact O-N 3.22Å; L631-A635 PolarHBondContact O-N 2.98Å
632	R	82.9	Confident	83.7	Confident	35 Å²	35	31 Å²	31	13%	0.132	16%	0.155	C	C	.	.	H	α-helix	trans	-61.2	-41.9	174.9	-72.9	177.1	175.2	164.9	-1	112.1	T481 A595 L599 A628 K629 L634 A635 V636	T481-R632 VanDerWaalsContact OG1-CD 3.29Å; T481-R632 WeakPolarHBondContact OG1-CD 3.49Å; T481-R632 PolarHBondContact OG1-NH1 2.73Å; A595-R632 HydrophobicContact CB-CG 3.81Å; L599-R632 VanDerWaalsContact CD1-CZ 3.46Å; A628-R632 WeakPolarHBondContact O-CG 3.36Å; A628-R632 PolarHBondContact O-N 3.38Å; K629-R632 PolarHBondContact O-N 3.36Å; R632-L634 VanDerWaalsContact C-N 3.33Å; R632-L634 PolarHBondContact O-N 3.36Å; R632-A635 WeakPolarHBondContact O-CB 2.86Å; R632-A635 PolarHBondContact O-N 3.42Å; R632-V636 WeakPolarHBondContact O-CG2 3.31Å; R632-V636 PolarHBondContact O-N 2.81Å
633	H	83.8	Confident	84.7	Confident	131 Å²	131	30.3 Å²	30.3	61%	0.606	15%	0.153	S	C	*	.	H	α-helix	trans	-61	-42.5	174.4	-179.4	72.4	0	0	0	111.9	K629 K630 L631 A635 V636 T637	K629-H633 PolarHBondContact O-N 3.49Å; K630-H633 PolarHBondContact O-N 3.12Å; L631-H633 VanDerWaalsContact C-N 3.32Å; L631-H633 PolarHBondContact O-N 3.32Å; H633-A635 VanDerWaalsContact C-N 3.34Å; H633-A635 PolarHBondContact O-N 3.39Å; H633-V636 PolarHBondContact O-N 2.84Å; H633-T637 WeakPolarHBondContact O-CB 3.4Å; H633-T637 PolarHBondContact O-N 3.42Å; H633-T637 PolarHBondContact O-OG1 3.46Å
634	L	87.8	Confident	85.6	Confident	5 Å²	5	35.4 Å²	35.4	3%	0.026	17%	0.174	C	C	.	.	H	α-helix	trans	-62.1	-41.3	174.5	179.8	59.3	0	0	0	111.8	I567 K571 L574 M591 K630 L631 R632 V636 T637 Y638	I567-L634 HydrophobicContact CG2-CD2 4.47Å; K571-L634 HydrophobicContact CG-CD1 3.87Å; L574-L634 HydrophobicContact CD2-CD1 4.43Å; M591-L634 HydrophobicContact CG-CD2 4.29Å; M591-L634 HydrophobicContact CG-CG 4.34Å; M591-L634 HydrophobicContact SD-CD2 3.89Å; K630-L634 PolarHBondContact O-N 2.87Å; L631-L634 WeakPolarHBondContact O-CB 3.31Å; L631-L634 PolarHBondContact O-N 3.22Å; R632-L634 VanDerWaalsContact C-N 3.33Å; R632-L634 PolarHBondContact O-N 3.36Å; L634-V636 PolarHBondContact O-N 3.41Å; L634-T637 WeakPolarHBondContact O-CB 3.15Å; L634-T637 PolarHBondContact O-N 3.25Å; L634-T637 VanDerWaalsContact O-N 3.12Å; L634-Y638 HydrophobicContact CD1-CE2 4.14Å; L634-Y638 HydrophobicContact CD2-CE2 4.41Å; L634-Y638 HydrophobicContact CG-CD2 4.31Å; L634-Y638 HydrophobicContact CG-CE2 3.87Å; L634-Y638 VanDerWaalsContact O-CD2 3.27Å; L634-Y638 WeakPolarHBondContact O-CD2 3.46Å; L634-Y638 PolarHBondContact O-N 3.21Å
635	A	84.7	Confident	86.2	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-54.8	-52.1	173.8	0	0	0	0	0	111.3	F588 M591 C592 L631 R632 H633 T637 Y638 L639	F588-A635 HydrophobicContact CD2-CB 3.67Å; F588-A635 WeakPolarHBondContact CD2-O 3.2Å; F588-A635 HydrophobicContact CE2-CB 4.01Å; F588-A635 HydrophobicContact CG-CB 4.37Å; M591-A635 HydrophobicContact CB-CB 3.77Å; C592-A635 VanDerWaalsContact SG-CB 3.57Å; L631-A635 PolarHBondContact O-N 2.98Å; R632-A635 WeakPolarHBondContact O-CB 2.86Å; R632-A635 PolarHBondContact O-N 3.42Å; H633-A635 VanDerWaalsContact C-N 3.34Å; H633-A635 PolarHBondContact O-N 3.39Å; A635-T637 VanDerWaalsContact C-N 3.26Å; A635-T637 PolarHBondContact O-N 3.24Å; A635-Y638 WeakPolarHBondContact O-CB 3.31Å; A635-Y638 PolarHBondContact O-N 2.93Å; A635-L639 PolarHBondContact O-N 3.27Å
636	V	85	Confident	87.1	Confident	26 Å²	26	38.2 Å²	38.2	16%	0.158	19%	0.192	C	C	.	.	H	α-helix	trans	-62.6	-34.2	177.4	174.1	0	0	0	0	111.7	F485 R632 H633 L634 Y638 L639 N640	F485-V636 HydrophobicContact CE1-CG2 4.47Å; R632-V636 WeakPolarHBondContact O-CG2 3.31Å; R632-V636 PolarHBondContact O-N 2.81Å; H633-V636 PolarHBondContact O-N 2.84Å; L634-V636 PolarHBondContact O-N 3.41Å; V636-Y638 VanDerWaalsContact C-N 3.34Å; V636-Y638 PolarHBondContact O-N 3.25Å; V636-L639 PolarHBondContact O-N 3.41Å; V636-N640 WeakPolarHBondContact O-CB 3.43Å; V636-N640 PolarHBondContact O-N 2.74Å
637	T	89.1	Confident	88	Confident	41 Å²	41	36.6 Å²	36.6	25%	0.252	19%	0.185	S	C	.	.	H	α-helix	trans	-62.7	-40.3	176.6	-54.7	0	0	0	0	111.5	L574 H633 L634 A635 N640 A641	L574-T637 HydrophobicContact CD1-CG2 4.27Å; L574-T637 HydrophobicContact CD2-CG2 3.8Å; H633-T637 WeakPolarHBondContact O-CB 3.4Å; H633-T637 PolarHBondContact O-N 3.42Å; H633-T637 PolarHBondContact O-OG1 3.46Å; L634-T637 WeakPolarHBondContact O-CB 3.15Å; L634-T637 PolarHBondContact O-N 3.25Å; L634-T637 VanDerWaalsContact O-N 3.12Å; A635-T637 VanDerWaalsContact C-N 3.26Å; A635-T637 PolarHBondContact O-N 3.24Å; T637-N640 PolarHBondContact O-N 2.94Å; T637-A641 WeakPolarHBondContact O-CB 3.49Å; T637-A641 PolarHBondContact O-N 2.87Å
638	Y	89.2	Confident	88.4	Confident	6 Å²	6	40.9 Å²	40.9	2%	0.024	21%	0.211	C	C	.	.	H	α-helix	trans	-58.7	-50.7	173.8	-76.1	-65.9	0	0	0	112.1	G570 L574 A577 M591 L634 A635 V636 N640 A641 F642	G570-Y638 VanDerWaalsContact C-OH 3.26Å; G570-Y638 WeakPolarHBondContact CA-OH 3.48Å; G570-Y638 PolarHBondContact O-OH 3.46Å; L574-Y638 HydrophobicContact CD2-CD1 3.53Å; L574-Y638 HydrophobicContact CD2-CE1 3.8Å; L574-Y638 HydrophobicContact CD2-CG 4.07Å; L574-Y638 HydrophobicContact CG-CD1 4.33Å; L574-Y638 HydrophobicContact CG-CE1 4.11Å; A577-Y638 HydrophobicContact CB-CD1 3.38Å; A577-Y638 HydrophobicContact CB-CE1 3.64Å; A577-Y638 HydrophobicContact CB-CG 4.47Å; M591-Y638 HydrophobicContact CG-CD2 4.46Å; M591-Y638 HydrophobicContact CG-CE2 3.97Å; L634-Y638 HydrophobicContact CD1-CE2 4.14Å; L634-Y638 HydrophobicContact CD2-CE2 4.41Å; L634-Y638 HydrophobicContact CG-CD2 4.31Å; L634-Y638 HydrophobicContact CG-CE2 3.87Å; L634-Y638 VanDerWaalsContact O-CD2 3.27Å; L634-Y638 WeakPolarHBondContact O-CD2 3.46Å; L634-Y638 PolarHBondContact O-N 3.21Å; A635-Y638 WeakPolarHBondContact O-CB 3.31Å; A635-Y638 PolarHBondContact O-N 2.93Å; V636-Y638 VanDerWaalsContact C-N 3.34Å; V636-Y638 PolarHBondContact O-N 3.25Å; Y638-N640 PolarHBondContact O-N 3.03Å; Y638-A641 PolarHBondContact O-N 3.41Å; Y638-F642 PolarHBondContact O-N 3Å; Y638-F642 VanDerWaalsContact O-N 3.09Å
639	L	88.8	Confident	89	Confident	8 Å²	8	44.8 Å²	44.8	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-59.3	-47.6	177.6	-76.6	173	0	0	0	111	T584 F588 A635 V636 A641 F642 L643 W690 L694 V698	T584-L639 HydrophobicContact CG2-CD2 3.88Å; T584-L639 HydrophobicContact CG2-CG 4.43Å; F588-L639 HydrophobicContact CB-CG 4.26Å; F588-L639 HydrophobicContact CD1-CD1 4.49Å; F588-L639 HydrophobicContact CD2-CD1 3.26Å; F588-L639 HydrophobicContact CD2-CG 3.74Å; F588-L639 HydrophobicContact CE2-CD1 3.47Å; F588-L639 VanDerWaalsContact CE2-CD1 3.47Å; F588-L639 HydrophobicContact CE2-CG 4.42Å; F588-L639 HydrophobicContact CG-CD1 3.86Å; F588-L639 HydrophobicContact CG-CG 4.1Å; F588-L639 HydrophobicContact CZ-CD1 4.2Å; A635-L639 PolarHBondContact O-N 3.27Å; V636-L639 PolarHBondContact O-N 3.41Å; L639-A641 PolarHBondContact O-N 2.85Å; L639-F642 PolarHBondContact O-N 3.04Å; L639-L643 WeakPolarHBondContact O-CB 3.46Å; L639-L643 WeakPolarHBondContact O-CG 3.29Å; L639-L643 PolarHBondContact O-N 2.9Å; L639-W690 HydrophobicContact CD2-CH2 4.29Å; L639-W690 HydrophobicContact CD2-CZ2 4.18Å; L639-L694 HydrophobicContact CD2-CD1 4.13Å; L639-V698 HydrophobicContact CD1-CG1 3.58Å
640	N	89.7	Confident	89.5	Confident	59 Å²	59	40.2 Å²	40.2	32%	0.316	21%	0.21	S	C	.	.	H	α-helix	trans	-61.4	-43.8	-179.2	-76.7	-21.5	0	0	0	112.7	V636 T637 Y638 F642 L643 E644 R705	V636-N640 WeakPolarHBondContact O-CB 3.43Å; V636-N640 PolarHBondContact O-N 2.74Å; T637-N640 PolarHBondContact O-N 2.94Å; Y638-N640 PolarHBondContact O-N 3.03Å; N640-F642 PolarHBondContact O-N 2.9Å; N640-L643 PolarHBondContact O-N 2.81Å; N640-E644 WeakPolarHBondContact O-CB 3.26Å; N640-E644 PolarHBondContact O-N 3.39Å; N640-R705 PolarHBondContact OD1-NH1 2.97Å; N640-R705 PolarHBondContact OD1-NH2 2.94Å
641	A	93	Very high	89.7	Confident	28 Å²	28	37.1 Å²	37.1	23%	0.231	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-43.2	178.5	0	0	0	0	0	111.7	T637 Y638 L639 C645	T637-A641 WeakPolarHBondContact O-CB 3.49Å; T637-A641 PolarHBondContact O-N 2.87Å; Y638-A641 PolarHBondContact O-N 3.41Å; L639-A641 PolarHBondContact O-N 2.85Å; A641-C645 WeakPolarHBondContact O-CB 3.49Å; A641-C645 PolarHBondContact O-N 3.36Å; A641-C645 VanDerWaalsContact O-N 3.08Å
642	F	95.4	Very high	89.7	Confident	3 Å²	3	41.5 Å²	41.5	1%	0.013	22%	0.219	C	C	.	.	H	α-helix	trans	-62.8	-48.6	174	178.4	-93.9	0	0	0	111.7	S578 A581 T584 Y638 L639 N640 E644 C645 Q646 V686 W690	S578-F642 WeakPolarHBondContact O-CD2 3.45Å; A581-F642 HydrophobicContact CB-CE1 4.23Å; A581-F642 HydrophobicContact CB-CE2 3.95Å; A581-F642 HydrophobicContact CB-CZ 3.53Å; A581-F642 VanDerWaalsContact N-CE2 3.29Å; T584-F642 HydrophobicContact CG2-CB 3.75Å; T584-F642 HydrophobicContact CG2-CG 4.17Å; T584-F642 WeakPolarHBondContact OG1-CB 3.14Å; Y638-F642 PolarHBondContact O-N 3Å; Y638-F642 VanDerWaalsContact O-N 3.09Å; L639-F642 PolarHBondContact O-N 3.04Å; N640-F642 PolarHBondContact O-N 2.9Å; F642-E644 VanDerWaalsContact C-N 3.32Å; F642-E644 PolarHBondContact O-N 2.97Å; F642-C645 PolarHBondContact O-N 3Å; F642-Q646 HydrophobicContact CD1-CG 3.85Å; F642-Q646 HydrophobicContact CD2-CG 4.16Å; F642-Q646 HydrophobicContact CE1-CB 4.43Å; F642-Q646 HydrophobicContact CE1-CG 3.38Å; F642-Q646 HydrophobicContact CE2-CG 3.68Å; F642-Q646 HydrophobicContact CG-CG 4.22Å; F642-Q646 HydrophobicContact CZ-CG 3.27Å; F642-Q646 WeakPolarHBondContact O-CB 3.49Å; F642-Q646 VanDerWaalsContact O-CG 3.31Å; F642-Q646 WeakPolarHBondContact O-CG 3.33Å; F642-Q646 PolarHBondContact O-N 3.18Å; F642-V686 HydrophobicContact CE1-CG1 3.97Å; F642-V686 HydrophobicContact CE1-CG2 4.27Å; F642-V686 HydrophobicContact CZ-CG1 4.31Å; F642-V686 HydrophobicContact CZ-CG2 3.94Å; F642-W690 AromaticContact CD1-CH2 3.6Å; F642-W690 HydrophobicContact CD1-CH2 3.6Å; F642-W690 AromaticContact CD1-CZ2 3.34Å; F642-W690 HydrophobicContact CD1-CZ2 3.34Å; F642-W690 AromaticContact CE1-CH2 3.62Å; F642-W690 HydrophobicContact CE1-CH2 3.62Å; F642-W690 AromaticContact CE1-CZ2 3.31Å; F642-W690 HydrophobicContact CE1-CZ2 3.31Å; F642-W690 HydrophobicContact CG-CZ2 4.29Å; F642-W690 HydrophobicContact CZ-CZ2 4.27Å
643	L	93.9	Very high	89.7	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-59.8	-42.4	-179.7	-70.2	172.5	0	0	0	111.7	L639 N640 Q646 S647 W690 S702 L706	L639-L643 WeakPolarHBondContact O-CB 3.46Å; L639-L643 WeakPolarHBondContact O-CG 3.29Å; L639-L643 PolarHBondContact O-N 2.9Å; N640-L643 PolarHBondContact O-N 2.81Å; L643-Q646 PolarHBondContact O-N 3.42Å; L643-S647 WeakPolarHBondContact O-CB 3.13Å; L643-S647 PolarHBondContact O-N 3.16Å; L643-S647 PolarHBondContact O-OG 2.87Å; L643-S647 VanDerWaalsContact O-OG 3.11Å; L643-W690 HydrophobicContact CD2-CH2 3.83Å; L643-W690 HydrophobicContact CD2-CZ3 4.23Å; L643-W690 HydrophobicContact CG-CH2 4.46Å; L643-S702 VanDerWaalsContact CD2-O 3.26Å; L643-S702 WeakPolarHBondContact CD2-O 3.35Å; L643-L706 HydrophobicContact CB-CD2 4.49Å; L643-L706 HydrophobicContact CD2-CD1 3.92Å; L643-L706 HydrophobicContact CD2-CD2 3.58Å; L643-L706 HydrophobicContact CD2-CG 3.46Å; L643-L706 VanDerWaalsContact CD2-CG 3.46Å
644	E	93.4	Very high	89.5	Confident	138 Å²	138	35.3 Å²	35.3	65%	0.645	19%	0.193	S	C	*	.	H	α-helix	trans	-63.6	-44.9	176.6	-176	174	-173.8	0	0	112	N640 F642 T648	N640-E644 WeakPolarHBondContact O-CB 3.26Å; N640-E644 PolarHBondContact O-N 3.39Å; F642-E644 VanDerWaalsContact C-N 3.32Å; F642-E644 PolarHBondContact O-N 2.97Å; E644-T648 WeakPolarHBondContact O-CB 3.48Å; E644-T648 PolarHBondContact O-N 3.24Å; E644-T648 PolarHBondContact O-OG1 2.76Å
645	C	94.3	Very high	88.9	Confident	51 Å²	51	41.9 Å²	41.9	35%	0.345	22%	0.222	S	C	.	.	H	α-helix	trans	-62	-48.4	176.6	-172	0	0	0	0	111.4	A641 F642 T648 Q649	A641-C645 WeakPolarHBondContact O-CB 3.49Å; A641-C645 PolarHBondContact O-N 3.36Å; A641-C645 VanDerWaalsContact O-N 3.08Å; F642-C645 PolarHBondContact O-N 3Å; C645-T648 PolarHBondContact O-N 3.42Å; C645-Q649 PolarHBondContact O-N 2.93Å
646	Q	94	Very high	87.7	Confident	17 Å²	17	47.3 Å²	47.3	8%	0.079	25%	0.25	C	S	.	.	H	α-helix	trans	-66.1	-43.5	179.4	-69.1	-55.2	-60.8	0	0	112.3	F642 L643 T648 Q649 L650 L706	F642-Q646 HydrophobicContact CD1-CG 3.85Å; F642-Q646 HydrophobicContact CD2-CG 4.16Å; F642-Q646 HydrophobicContact CE1-CB 4.43Å; F642-Q646 HydrophobicContact CE1-CG 3.38Å; F642-Q646 HydrophobicContact CE2-CG 3.68Å; F642-Q646 HydrophobicContact CG-CG 4.22Å; F642-Q646 HydrophobicContact CZ-CG 3.27Å; F642-Q646 WeakPolarHBondContact O-CB 3.49Å; F642-Q646 VanDerWaalsContact O-CG 3.31Å; F642-Q646 WeakPolarHBondContact O-CG 3.33Å; F642-Q646 PolarHBondContact O-N 3.18Å; L643-Q646 PolarHBondContact O-N 3.42Å; Q646-T648 VanDerWaalsContact C-N 3.31Å; Q646-T648 PolarHBondContact O-N 3.29Å; Q646-Q649 PolarHBondContact O-N 2.73Å; Q646-L650 VanDerWaalsContact O-CG 3.3Å; Q646-L650 WeakPolarHBondContact O-CG 3.21Å; Q646-L650 PolarHBondContact O-N 2.9Å; Q646-L706 HydrophobicContact CB-CD2 3.73Å
647	S	93.9	Very high	86.3	Confident	22 Å²	22	47 Å²	47	15%	0.154	25%	0.25	C	C	.	.	H	α-helix	trans	-57.8	-45	173.7	-80.6	0	0	0	0	111.5	L643 Q649 L650 V651 S709	L643-S647 WeakPolarHBondContact O-CB 3.13Å; L643-S647 PolarHBondContact O-N 3.16Å; L643-S647 PolarHBondContact O-OG 2.87Å; L643-S647 VanDerWaalsContact O-OG 3.11Å; S647-Q649 VanDerWaalsContact C-N 3.32Å; S647-Q649 PolarHBondContact O-N 3.05Å; S647-L650 PolarHBondContact O-N 2.94Å; S647-V651 WeakPolarHBondContact O-CB 3.5Å; S647-V651 WeakPolarHBondContact O-CG2 3.24Å; S647-V651 PolarHBondContact O-N 3.08Å; S647-S709 VanDerWaalsContact CB-OG 3.27Å; S647-S709 WeakPolarHBondContact CB-OG 3Å; S647-S709 VanDerWaalsContact OG-CB 3.26Å; S647-S709 WeakPolarHBondContact OG-CB 3.38Å; S647-S709 PolarHBondContact OG-OG 3.3Å
648	T	92.2	Very high	84.5	Confident	89 Å²	89	48 Å²	48	55%	0.546	26%	0.259	S	S	.	.	H	α-helix	trans	-61.8	-42.4	177.3	-58.9	0	0	0	0	111.2	E644 C645 Q646 V651 H652	E644-T648 WeakPolarHBondContact O-CB 3.48Å; E644-T648 PolarHBondContact O-N 3.24Å; E644-T648 PolarHBondContact O-OG1 2.76Å; C645-T648 PolarHBondContact O-N 3.42Å; Q646-T648 VanDerWaalsContact C-N 3.31Å; Q646-T648 PolarHBondContact O-N 3.29Å; T648-V651 PolarHBondContact O-N 3.33Å; T648-H652 WeakPolarHBondContact O-CB 3.47Å; T648-H652 PolarHBondContact O-N 2.82Å
649	Q	90	Very high	82.9	Confident	83 Å²	83	48.2 Å²	48.2	39%	0.388	26%	0.263	S	S	.	.	H	α-helix	trans	-64.5	-47.5	176.7	-174	175.5	-4.4	0	0	112.1	C645 Q646 S647 V651 H652 D653	C645-Q649 PolarHBondContact O-N 2.93Å; Q646-Q649 PolarHBondContact O-N 2.73Å; S647-Q649 VanDerWaalsContact C-N 3.32Å; S647-Q649 PolarHBondContact O-N 3.05Å; Q649-V651 VanDerWaalsContact C-N 3.33Å; Q649-V651 PolarHBondContact O-N 3.4Å; Q649-H652 WeakPolarHBondContact O-CB 3.39Å; Q649-H652 PolarHBondContact O-N 2.88Å; Q649-H652 VanDerWaalsContact O-N 3.15Å; Q649-D653 WeakPolarHBondContact O-CB 3.34Å; Q649-D653 PolarHBondContact O-N 3.21Å
650	L	89.3	Confident	81.5	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-57.5	-46.2	176.6	-71.6	168.8	0	0	0	111.4	Q646 S647 D653 L654 C679 Q682 L683	Q646-L650 VanDerWaalsContact O-CG 3.3Å; Q646-L650 WeakPolarHBondContact O-CG 3.21Å; Q646-L650 PolarHBondContact O-N 2.9Å; S647-L650 PolarHBondContact O-N 2.94Å; L650-D653 PolarHBondContact O-N 3.49Å; L650-L654 WeakPolarHBondContact O-CG 3.26Å; L650-L654 PolarHBondContact O-N 2.77Å; L650-L654 VanDerWaalsContact O-N 3.12Å; L650-C679 HydrophobicContact CD2-CB 3.82Å; L650-Q682 HydrophobicContact CD2-CB 4.36Å; L650-Q682 HydrophobicContact CD2-CG 4.36Å; L650-L683 HydrophobicContact CD1-CD2 3.99Å; L650-L683 HydrophobicContact CD1-CG 4.5Å
651	V	87.5	Confident	80	Confident	34 Å²	34	48.6 Å²	48.6	21%	0.206	27%	0.273	C	S	.	.	H	α-helix	trans	-65	-41.6	177	173.4	0	0	0	0	111	S647 T648 Q649 L654 K655 A713	S647-V651 WeakPolarHBondContact O-CB 3.5Å; S647-V651 WeakPolarHBondContact O-CG2 3.24Å; S647-V651 PolarHBondContact O-N 3.08Å; T648-V651 PolarHBondContact O-N 3.33Å; Q649-V651 VanDerWaalsContact C-N 3.33Å; Q649-V651 PolarHBondContact O-N 3.4Å; V651-L654 PolarHBondContact O-N 2.88Å; V651-K655 HydrophobicContact CG1-CD 4Å; V651-K655 HydrophobicContact CG1-CG 4.35Å; V651-K655 WeakPolarHBondContact O-CB 3.37Å; V651-K655 WeakPolarHBondContact O-CG 3.35Å; V651-K655 PolarHBondContact O-N 3.13Å; V651-A713 HydrophobicContact CG2-CB 4.04Å
652	H	86.2	Confident	78.2	Confident	92 Å²	92	55.2 Å²	55.2	43%	0.426	30%	0.297	S	S	.	.	H	α-helix	trans	-64.7	-43.7	178.3	171.4	-94.7	0	0	0	111.9	T648 Q649 L654 K655 L656	T648-H652 WeakPolarHBondContact O-CB 3.47Å; T648-H652 PolarHBondContact O-N 2.82Å; Q649-H652 WeakPolarHBondContact O-CB 3.39Å; Q649-H652 PolarHBondContact O-N 2.88Å; Q649-H652 VanDerWaalsContact O-N 3.15Å; H652-L654 VanDerWaalsContact C-N 3.25Å; H652-L654 PolarHBondContact O-N 3.05Å; H652-K655 CarbonylContact O-C 3.45Å; H652-K655 PolarHBondContact O-N 3.2Å; H652-L656 WeakPolarHBondContact CE1-CD1 3.49Å; H652-L656 VanDerWaalsContact CE1-CG 3.47Å; H652-L656 WeakPolarHBondContact CE1-CG 3.41Å; H652-L656 PolarHBondContact O-N 3.03Å
653	D	81.5	Confident	76.3	Confident	30 Å²	30	55.7 Å²	55.7	16%	0.16	30%	0.301	C	S	.	.	H	α-helix	trans	-67	-30.7	179.9	-68.7	-9.9	0	0	0	111.5	Q649 L650	Q649-D653 WeakPolarHBondContact O-CB 3.34Å; Q649-D653 PolarHBondContact O-N 3.21Å; L650-D653 PolarHBondContact O-N 3.49Å
654	L	81.4	Confident	74.5	Confident	6 Å²	6	61.1 Å²	61.1	3%	0.031	33%	0.334	C	S	.	.	H	α-helix	trans	-71.9	-37	166.7	-73	177.7	0	0	0	113.3	L650 V651 H652 A657 K675 L710 A713 V714	L650-L654 WeakPolarHBondContact O-CG 3.26Å; L650-L654 PolarHBondContact O-N 2.77Å; L650-L654 VanDerWaalsContact O-N 3.12Å; V651-L654 PolarHBondContact O-N 2.88Å; H652-L654 VanDerWaalsContact C-N 3.25Å; H652-L654 PolarHBondContact O-N 3.05Å; L654-A657 WeakPolarHBondContact O-CB 3.49Å; L654-K675 HydrophobicContact CD2-CB 4.31Å; L654-L710 HydrophobicContact CD1-CD1 3.62Å; L654-L710 HydrophobicContact CG-CD1 4.38Å; L654-A713 HydrophobicContact CD1-CB 3.56Å; L654-V714 HydrophobicContact CD1-CG2 3.92Å
655	K	75.3	Confident	72.8	Confident	142 Å²	142	61.4 Å²	61.4	62%	0.617	34%	0.339	S	S	*	.	H	α-helix	trans	-77	-40.8	-178.6	-81.2	-179.5	-179.7	177.9	0	113.9	V651 H652 A657 S658	V651-K655 HydrophobicContact CG1-CD 4Å; V651-K655 HydrophobicContact CG1-CG 4.35Å; V651-K655 WeakPolarHBondContact O-CB 3.37Å; V651-K655 WeakPolarHBondContact O-CG 3.35Å; V651-K655 PolarHBondContact O-N 3.13Å; H652-K655 CarbonylContact O-C 3.45Å; H652-K655 PolarHBondContact O-N 3.2Å; K655-A657 PolarHBondContact O-N 3.3Å; K655-S658 PolarHBondContact O-N 3.45Å
656	L	58.9	Low	71.2	Confident	114 Å²	114	60.6 Å²	60.6	60%	0.597	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-19.2	172.8	-80.6	-171.9	0	0	0	111.9	H652 S658	H652-L656 WeakPolarHBondContact CE1-CD1 3.49Å; H652-L656 VanDerWaalsContact CE1-CG 3.47Å; H652-L656 WeakPolarHBondContact CE1-CG 3.41Å; H652-L656 PolarHBondContact O-N 3.03Å; L656-S658 PolarHBondContact O-N 3.34Å
657	A	55.4	Low	69.9	Low	19 Å²	19	60.7 Å²	60.7	16%	0.157	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-34.6	170.2	0	0	0	0	0	112	L654 K655 G659 K675	L654-A657 WeakPolarHBondContact O-CB 3.49Å; K655-A657 PolarHBondContact O-N 3.3Å; A657-G659 WeakPolarHBondContact O-CA 3.36Å; A657-G659 PolarHBondContact O-N 2.65Å; A657-G659 VanDerWaalsContact O-N 3.11Å; A657-K675 HydrophobicContact CB-CG 4.31Å
658	S	52.2	Low	68.7	Low	64 Å²	64	61.5 Å²	61.5	45%	0.448	34%	0.344	S	S	.	.			trans	51.6	22.7	-174.6	70	0	0	0	0	116.5	K655 L656 K662	K655-S658 PolarHBondContact O-N 3.45Å; L656-S658 PolarHBondContact O-N 3.34Å; S658-K662 VanDerWaalsContact O-CB 3.26Å; S658-K662 WeakPolarHBondContact O-CB 3.45Å; S658-K662 WeakPolarHBondContact O-CG 3.44Å; S658-K662 PolarHBondContact O-N 2.76Å
659	G	53.8	Low	67.6	Low	10 Å²	10	58 Å²	58	10%	0.103	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn		-141.7	-25.3	-88.4	0	0	0	0	0	112.2	A657	A657-G659 WeakPolarHBondContact O-CA 3.36Å; A657-G659 PolarHBondContact O-N 2.65Å; A657-G659 VanDerWaalsContact O-N 3.11Å
660	F	59.4	Low	66.8	Low	12 Å²	12	59.6 Å²	59.6	5%	0.053	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-54.1	158	-52.2	-25.7	0	0	0	109.4	K662 A663 R668 C672 N717 V718 L721	F660-K662 PolarHBondContact O-N 2.98Å; F660-A663 PolarHBondContact O-N 3.5Å; F660-R668 WeakPolarHBondContact O-CD 3.22Å; F660-R668 WeakPolarHBondContact O-CG 3.27Å; F660-R668 PolarHBondContact O-NE 3.46Å; F660-C672 HydrophobicContact CD1-CB 3.97Å; F660-C672 HydrophobicContact CE1-CB 3.2Å; F660-C672 VanDerWaalsContact CE1-SG 3.53Å; F660-C672 HydrophobicContact CZ-CB 3.66Å; F660-C672 WeakPolarHBondContact CZ-SG 3.43Å; F660-N717 HydrophobicContact CD2-CB 3.71Å; F660-N717 HydrophobicContact CE2-CB 3.47Å; F660-N717 VanDerWaalsContact CE2-CB 3.47Å; F660-V718 HydrophobicContact CE2-CG2 4.42Å; F660-L721 HydrophobicContact CB-CD1 3.89Å; F660-L721 HydrophobicContact CB-CD2 3.28Å; F660-L721 HydrophobicContact CB-CG 3.91Å; F660-L721 HydrophobicContact CD2-CD1 4.3Å; F660-L721 HydrophobicContact CG-CD1 4.4Å; F660-L721 HydrophobicContact CG-CD2 4.5Å
661	A	58.6	Low	66.1	Low	62 Å²	62	62.6 Å²	62.6	51%	0.512	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-46.2	-176.5	0	0	0	0	0	114.3	R668	A661-R668 PolarHBondContact O-NH2 2.83Å
662	K	54.8	Low	65.6	Low	167 Å²	167	61 Å²	61	73%	0.726	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-13.1	-176.2	-69.9	-176.4	-174.5	177.8	0	115.9	S658 F660 T664	S658-K662 VanDerWaalsContact O-CB 3.26Å; S658-K662 WeakPolarHBondContact O-CB 3.45Å; S658-K662 WeakPolarHBondContact O-CG 3.44Å; S658-K662 PolarHBondContact O-N 2.76Å; F660-K662 PolarHBondContact O-N 2.98Å; K662-T664 PolarHBondContact O-N 3.37Å
663	A	55.6	Low	65.3	Low	13 Å²	13	60.3 Å²	60.3	11%	0.107	34%	0.337	C	S	.	.	S	Bend	trans	-67.7	139.5	178.2	0	0	0	0	0	109.6	F660 R668 I671	F660-A663 PolarHBondContact O-N 3.5Å; A663-R668 HydrophobicContact CB-CB 4.28Å; A663-R668 HydrophobicContact CB-CG 3.54Å; A663-R668 PolarHBondContact O-NE 3.36Å; A663-I671 HydrophobicContact CB-CD1 3.56Å
664	T	57.6	Low	65.4	Low	117 Å²	117	64.3 Å²	64.3	72%	0.718	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-50	143.3	170.2	37.4	0	0	0	0	110.5	K662 G666 G667	K662-T664 PolarHBondContact O-N 3.37Å; T664-G666 PolarHBondContact O-N 2.82Å; T664-G666 VanDerWaalsContact O-N 3.12Å; T664-G667 PolarHBondContact O-N 3.27Å
665	I	56.5	Low	65.4	Low	145 Å²	145	67.3 Å²	67.3	74%	0.744	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.7	118.3	179.2	-60.9	168.6	0	0	0	109.3	T725	I665-T725 HydrophobicContact CG2-CG2 4.16Å
666	G	60.5	Low	66	Low	33 Å²	33	61 Å²	61	34%	0.34	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	95	-9.7	-178.6	0	0	0	0	0	116.6	T664 E728	T664-G666 PolarHBondContact O-N 2.82Å; T664-G666 VanDerWaalsContact O-N 3.12Å; G666-E728 PolarHBondContact N-OE1 3.46Å
667	G	67.3	Low	67.3	Low	19 Å²	19	61.2 Å²	61.2	20%	0.196	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-13.8	176.8	0	0	0	0	0	114.8	T664 S669 N670 I671	T664-G667 PolarHBondContact O-N 3.27Å; G667-S669 PolarHBondContact O-N 2.91Å; G667-N670 PolarHBondContact O-N 3.43Å; G667-I671 PolarHBondContact O-N 3.19Å
668	R	68.4	Low	68.8	Low	40 Å²	40	64 Å²	64	15%	0.151	35%	0.348	C	S	.	.	H	α-helix	trans	-60.5	-43.2	-172.4	-61.5	179.5	176.2	166.2	-11.4	113	F660 A661 A663 N670 I671 C672 D723 E728	F660-R668 WeakPolarHBondContact O-CD 3.22Å; F660-R668 WeakPolarHBondContact O-CG 3.27Å; F660-R668 PolarHBondContact O-NE 3.46Å; A661-R668 PolarHBondContact O-NH2 2.83Å; A663-R668 HydrophobicContact CB-CB 4.28Å; A663-R668 HydrophobicContact CB-CG 3.54Å; A663-R668 PolarHBondContact O-NE 3.36Å; R668-N670 VanDerWaalsContact C-N 3.31Å; R668-N670 PolarHBondContact O-N 2.94Å; R668-I671 PolarHBondContact O-N 3.38Å; R668-C672 WeakPolarHBondContact O-CB 3.26Å; R668-C672 PolarHBondContact O-N 2.85Å; R668-D723 PolarHBondContact NH1-O 3.42Å; R668-E728 WeakPolarHBondContact CD-OE1 3.29Å; R668-E728 IonicContact NH1-OE2 3.15Å
669	S	69.1	Low	70.6	Confident	16 Å²	16	60.9 Å²	60.9	11%	0.112	33%	0.327	C	S	.	.	H	α-helix	trans	-59.5	-40.9	178.8	-171.3	0	0	0	0	112.1	G667 C672 H673 G731	G667-S669 PolarHBondContact O-N 2.91Å; S669-C672 WeakPolarHBondContact O-CB 3.26Å; S669-C672 PolarHBondContact O-N 2.87Å; S669-H673 WeakPolarHBondContact O-CB 3.42Å; S669-H673 PolarHBondContact O-N 3.4Å; S669-G731 VanDerWaalsContact OG-CA 3.29Å; S669-G731 WeakPolarHBondContact OG-CA 3.34Å; S669-G731 PolarHBondContact OG-O 3.22Å
670	N	74	Confident	72.4	Confident	115 Å²	115	61.1 Å²	61.1	62%	0.615	33%	0.326	S	S	*	.	H	α-helix	trans	-69.2	-41.8	-179.7	-70.2	-2.6	0	0	0	111.5	G667 R668 C672 H673 E674	G667-N670 PolarHBondContact O-N 3.43Å; R668-N670 VanDerWaalsContact C-N 3.31Å; R668-N670 PolarHBondContact O-N 2.94Å; N670-C672 VanDerWaalsContact C-N 3.31Å; N670-C672 PolarHBondContact O-N 3.24Å; N670-H673 PolarHBondContact O-N 3.2Å; N670-E674 WeakPolarHBondContact O-CG 3.32Å; N670-E674 PolarHBondContact O-N 2.87Å
671	I	74.6	Confident	73.9	Confident	65 Å²	65	67.2 Å²	67.2	33%	0.333	35%	0.352	S	S	.	.	H	α-helix	trans	-63.3	-41.5	175.4	-61.1	-177.9	0	0	0	110.4	A663 G667 R668 K675	A663-I671 HydrophobicContact CB-CD1 3.56Å; G667-I671 PolarHBondContact O-N 3.19Å; R668-I671 PolarHBondContact O-N 3.38Å; I671-K675 HydrophobicContact CG2-CG 4.47Å; I671-K675 WeakPolarHBondContact O-CB 3.35Å; I671-K675 VanDerWaalsContact O-CG 3.28Å; I671-K675 WeakPolarHBondContact O-CG 3.37Å; I671-K675 PolarHBondContact O-N 3.07Å; I671-K675 VanDerWaalsContact O-N 3.12Å
672	C	76	Confident	75.4	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-56.6	-53.9	173	-170.4	0	0	0	0	111.9	F660 R668 S669 N670 E674 K675 I676 L732	F660-C672 HydrophobicContact CD1-CB 3.97Å; F660-C672 HydrophobicContact CE1-CB 3.2Å; F660-C672 VanDerWaalsContact CE1-SG 3.53Å; F660-C672 HydrophobicContact CZ-CB 3.66Å; F660-C672 WeakPolarHBondContact CZ-SG 3.43Å; R668-C672 WeakPolarHBondContact O-CB 3.26Å; R668-C672 PolarHBondContact O-N 2.85Å; S669-C672 WeakPolarHBondContact O-CB 3.26Å; S669-C672 PolarHBondContact O-N 2.87Å; N670-C672 VanDerWaalsContact C-N 3.31Å; N670-C672 PolarHBondContact O-N 3.24Å; C672-E674 PolarHBondContact O-N 2.95Å; C672-K675 PolarHBondContact O-N 3.44Å; C672-I676 WeakPolarHBondContact O-CB 3.44Å; C672-I676 WeakPolarHBondContact O-CG1 3Å; C672-I676 PolarHBondContact O-N 3.42Å; C672-I676 WeakPolarHBondContact SG-CD1 3.39Å; C672-L732 HydrophobicContact CB-CD2 3.85Å; C672-L732 WeakPolarHBondContact SG-CD2 3.49Å
673	H	80.6	Confident	77.2	Confident	77 Å²	77	57.8 Å²	57.8	36%	0.356	30%	0.3	S	S	.	.	H	α-helix	trans	-56.1	-50.5	-179	-172.5	83.1	0	0	0	112	S669 N670 K675 I676 K677 S735	S669-H673 WeakPolarHBondContact O-CB 3.42Å; S669-H673 PolarHBondContact O-N 3.4Å; N670-H673 PolarHBondContact O-N 3.2Å; H673-K675 VanDerWaalsContact C-N 3.33Å; H673-K675 PolarHBondContact O-N 2.88Å; H673-I676 PolarHBondContact O-N 3.17Å; H673-K677 VanDerWaalsContact O-CB 3.26Å; H673-K677 WeakPolarHBondContact O-CB 3.4Å; H673-K677 PolarHBondContact O-N 3.45Å; H673-S735 PolarHBondContact ND1-OG 3.02Å
674	E	83.3	Confident	78.9	Confident	115 Å²	115	60.7 Å²	60.7	54%	0.537	31%	0.313	S	S	.	.	H	α-helix	trans	-61.8	-38.5	-180	-73.5	-62.4	130.3	0	0	112.7	N670 C672 L678	N670-E674 WeakPolarHBondContact O-CG 3.32Å; N670-E674 PolarHBondContact O-N 2.87Å; C672-E674 PolarHBondContact O-N 2.95Å; E674-L678 PolarHBondContact O-N 2.96Å
675	K	82.7	Confident	80.5	Confident	69 Å²	69	58.1 Å²	58.1	30%	0.3	30%	0.299	S	S	.	.	H	α-helix	trans	-76.3	-39.5	179.6	-67.1	-63.4	-178	-179.4	0	113	L654 A657 I671 C672 H673 K677 L678 C679	L654-K675 HydrophobicContact CD2-CB 4.31Å; A657-K675 HydrophobicContact CB-CG 4.31Å; I671-K675 HydrophobicContact CG2-CG 4.47Å; I671-K675 WeakPolarHBondContact O-CB 3.35Å; I671-K675 VanDerWaalsContact O-CG 3.28Å; I671-K675 WeakPolarHBondContact O-CG 3.37Å; I671-K675 PolarHBondContact O-N 3.07Å; I671-K675 VanDerWaalsContact O-N 3.12Å; C672-K675 PolarHBondContact O-N 3.44Å; H673-K675 VanDerWaalsContact C-N 3.33Å; H673-K675 PolarHBondContact O-N 2.88Å; K675-K677 VanDerWaalsContact C-N 3.26Å; K675-K677 PolarHBondContact O-N 3.31Å; K675-L678 WeakPolarHBondContact O-CB 3.47Å; K675-L678 PolarHBondContact O-N 2.92Å; K675-C679 PolarHBondContact O-N 3.5Å; K675-C679 PolarHBondContact O-SG 3.29Å
676	I	86	Confident	82.3	Confident	8 Å²	8	51.6 Å²	51.6	4%	0.041	27%	0.266	C	S	.	.	H	α-helix	trans	-57.9	-45	170.7	-75.6	175.8	0	0	0	109.6	C672 H673 L678 C679 L680 L736 L739	C672-I676 WeakPolarHBondContact O-CB 3.44Å; C672-I676 WeakPolarHBondContact O-CG1 3Å; C672-I676 PolarHBondContact O-N 3.42Å; C672-I676 WeakPolarHBondContact SG-CD1 3.39Å; H673-I676 PolarHBondContact O-N 3.17Å; I676-L678 VanDerWaalsContact C-N 3.33Å; I676-L678 PolarHBondContact O-N 2.83Å; I676-C679 PolarHBondContact O-N 3.35Å; I676-L680 WeakPolarHBondContact O-CB 3.46Å; I676-L680 PolarHBondContact O-N 3.22Å; I676-L736 HydrophobicContact CD1-CD2 3.79Å; I676-L739 HydrophobicContact CD1-CD2 4.46Å; I676-L739 HydrophobicContact CG2-CB 3.9Å; I676-L739 HydrophobicContact CG2-CD1 3.85Å; I676-L739 HydrophobicContact CG2-CD2 3.78Å; I676-L739 HydrophobicContact CG2-CG 4.03Å
677	K	86.9	Confident	83.8	Confident	119 Å²	119	51.1 Å²	51.1	52%	0.517	26%	0.255	S	S	.	.	H	α-helix	trans	-62.1	-38.4	177.6	-170.7	176.7	-177.6	177.5	0	112.6	H673 K675 K681	H673-K677 VanDerWaalsContact O-CB 3.26Å; H673-K677 WeakPolarHBondContact O-CB 3.4Å; H673-K677 PolarHBondContact O-N 3.45Å; K675-K677 VanDerWaalsContact C-N 3.26Å; K675-K677 PolarHBondContact O-N 3.31Å; K677-K681 WeakPolarHBondContact O-CB 3.27Å; K677-K681 PolarHBondContact O-N 2.9Å
678	L	87.5	Confident	84.9	Confident	77 Å²	77	53.8 Å²	53.8	40%	0.403	27%	0.271	S	S	.	.	H	α-helix	trans	-63.2	-47.5	173.2	-178.9	64.4	0	0	0	111.8	E674 K675 I676 L680 K681 Q682	E674-L678 PolarHBondContact O-N 2.96Å; K675-L678 WeakPolarHBondContact O-CB 3.47Å; K675-L678 PolarHBondContact O-N 2.92Å; I676-L678 VanDerWaalsContact C-N 3.33Å; I676-L678 PolarHBondContact O-N 2.83Å; L678-L680 VanDerWaalsContact C-N 3.33Å; L678-L680 PolarHBondContact O-N 3.45Å; L678-K681 WeakPolarHBondContact O-CB 3.43Å; L678-K681 PolarHBondContact O-N 3.41Å; L678-Q682 PolarHBondContact O-N 3.35Å
679	C	90.4	Very high	85.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62	-42.4	177.3	-64.9	0	0	0	0	111.5	L650 K675 I676 Q682 L683 L710	L650-C679 HydrophobicContact CD2-CB 3.82Å; K675-C679 PolarHBondContact O-N 3.5Å; K675-C679 PolarHBondContact O-SG 3.29Å; I676-C679 PolarHBondContact O-N 3.35Å; C679-Q682 WeakPolarHBondContact O-CB 3.43Å; C679-Q682 PolarHBondContact O-N 3.48Å; C679-L683 WeakPolarHBondContact O-CB 3.44Å; C679-L683 WeakPolarHBondContact O-CG 3.31Å; C679-L683 PolarHBondContact O-N 3.02Å; C679-L710 HydrophobicContact CB-CD1 3.63Å; C679-L710 HydrophobicContact CB-CD2 4.02Å
680	L	89.7	Confident	86.9	Confident	14 Å²	14	54.5 Å²	54.5	7%	0.073	27%	0.274	C	S	.	.	H	α-helix	trans	-62.3	-42.7	175.8	178.8	63.5	0	0	0	111.2	I676 L678 Q682 L683 L684 L739 D742 V743	I676-L680 WeakPolarHBondContact O-CB 3.46Å; I676-L680 PolarHBondContact O-N 3.22Å; L678-L680 VanDerWaalsContact C-N 3.33Å; L678-L680 PolarHBondContact O-N 3.45Å; L680-Q682 VanDerWaalsContact C-N 3.32Å; L680-Q682 PolarHBondContact O-N 2.93Å; L680-L683 WeakPolarHBondContact O-CB 3.46Å; L680-L683 PolarHBondContact O-N 3.26Å; L680-L684 HydrophobicContact CD1-CD1 4.4Å; L680-L684 HydrophobicContact CD1-CG 4.3Å; L680-L684 HydrophobicContact CG-CD1 4Å; L680-L684 HydrophobicContact CG-CG 4.37Å; L680-L684 WeakPolarHBondContact O-CB 3.43Å; L680-L684 VanDerWaalsContact O-CG 3.27Å; L680-L684 WeakPolarHBondContact O-CG 3.29Å; L680-L684 PolarHBondContact O-N 2.98Å; L680-L739 HydrophobicContact CB-CD1 4.37Å; L680-L739 HydrophobicContact CD1-CD1 4.26Å; L680-D742 HydrophobicContact CD1-CB 4.01Å; L680-D742 HydrophobicContact CD2-CB 3.74Å; L680-D742 WeakPolarHBondContact CD2-OD2 3.38Å; L680-V743 HydrophobicContact CD1-CG2 4.34Å
681	K	90.9	Very high	87.4	Confident	140 Å²	140	56 Å²	56	61%	0.609	28%	0.275	S	S	*	.	H	α-helix	trans	-58.8	-44.3	175.4	-175.1	-179.2	177.6	-176.7	0	111.4	K677 L678 L684 C685	K677-K681 WeakPolarHBondContact O-CB 3.27Å; K677-K681 PolarHBondContact O-N 2.9Å; L678-K681 WeakPolarHBondContact O-CB 3.43Å; L678-K681 PolarHBondContact O-N 3.41Å; K681-L684 PolarHBondContact O-N 3.07Å; K681-C685 PolarHBondContact O-N 2.94Å; K681-C685 PolarHBondContact O-SG 2.93Å
682	Q	90.9	Very high	87.8	Confident	30 Å²	30	57.4 Å²	57.4	14%	0.14	29%	0.287	C	S	.	.	H	α-helix	trans	-62.2	-46.3	176.1	-177.5	177.4	-3	0	0	111.7	L650 L678 C679 L680 L684 C685 V686	L650-Q682 HydrophobicContact CD2-CB 4.36Å; L650-Q682 HydrophobicContact CD2-CG 4.36Å; L678-Q682 PolarHBondContact O-N 3.35Å; C679-Q682 WeakPolarHBondContact O-CB 3.43Å; C679-Q682 PolarHBondContact O-N 3.48Å; L680-Q682 VanDerWaalsContact C-N 3.32Å; L680-Q682 PolarHBondContact O-N 2.93Å; Q682-L684 VanDerWaalsContact C-N 3.31Å; Q682-L684 PolarHBondContact O-N 2.81Å; Q682-C685 WeakPolarHBondContact O-CB 3.21Å; Q682-C685 PolarHBondContact O-N 2.83Å; Q682-V686 PolarHBondContact O-N 3.35Å; Q682-V686 VanDerWaalsContact O-N 3.12Å
683	L	92.4	Very high	88.2	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-59.4	-39.5	174.7	-77.4	-175.4	0	0	0	112.3	L650 C679 L680 H687 Y703 L706 V707 L710	L650-L683 HydrophobicContact CD1-CD2 3.99Å; L650-L683 HydrophobicContact CD1-CG 4.5Å; C679-L683 WeakPolarHBondContact O-CB 3.44Å; C679-L683 WeakPolarHBondContact O-CG 3.31Å; C679-L683 PolarHBondContact O-N 3.02Å; L680-L683 WeakPolarHBondContact O-CB 3.46Å; L680-L683 PolarHBondContact O-N 3.26Å; L683-H687 WeakPolarHBondContact O-CB 3.37Å; L683-H687 PolarHBondContact O-N 3.19Å; L683-Y703 VanDerWaalsContact C-OH 3.23Å; L683-Y703 HydrophobicContact CB-CE2 4.4Å; L683-Y703 WeakPolarHBondContact CB-OH 3.28Å; L683-Y703 HydrophobicContact CD2-CE2 4.26Å; L683-Y703 VanDerWaalsContact O-CE2 3.22Å; L683-Y703 WeakPolarHBondContact O-CE2 3.48Å; L683-Y703 PolarHBondContact O-OH 3.41Å; L683-L706 HydrophobicContact CD2-CB 3.64Å; L683-L706 HydrophobicContact CD2-CD1 4.17Å; L683-V707 HydrophobicContact CD1-CG2 4.37Å; L683-L710 HydrophobicContact CD1-CD2 3.48Å; L683-L710 VanDerWaalsContact CD1-CD2 3.48Å
684	L	91.9	Very high	88.3	Confident	74 Å²	74	54.6 Å²	54.6	39%	0.387	28%	0.275	S	S	.	.	H	α-helix	trans	-66	-40.4	176.7	-75.7	168	0	0	0	112	L680 K681 Q682 H687 S688 L746	L680-L684 HydrophobicContact CD1-CD1 4.4Å; L680-L684 HydrophobicContact CD1-CG 4.3Å; L680-L684 HydrophobicContact CG-CD1 4Å; L680-L684 HydrophobicContact CG-CG 4.37Å; L680-L684 WeakPolarHBondContact O-CB 3.43Å; L680-L684 VanDerWaalsContact O-CG 3.27Å; L680-L684 WeakPolarHBondContact O-CG 3.29Å; L680-L684 PolarHBondContact O-N 2.98Å; K681-L684 PolarHBondContact O-N 3.07Å; Q682-L684 VanDerWaalsContact C-N 3.31Å; Q682-L684 PolarHBondContact O-N 2.81Å; L684-H687 PolarHBondContact O-N 3.41Å; L684-S688 WeakPolarHBondContact O-CB 3.23Å; L684-S688 PolarHBondContact O-N 2.8Å; L684-S688 PolarHBondContact O-OG 3.5Å; L684-L746 HydrophobicContact CD2-CD1 3.56Å; L684-L746 HydrophobicContact CD2-CD2 3.53Å; L684-L746 HydrophobicContact CD2-CG 4.11Å; L684-L746 HydrophobicContact CG-CD1 4.34Å
685	C	91.9	Very high	87.9	Confident	63 Å²	63	49.9 Å²	49.9	43%	0.426	25%	0.254	S	S	.	.	H	α-helix	trans	-59.1	-51.4	174.8	-70.2	0	0	0	0	111	K681 Q682 H687 S688 E689	K681-C685 PolarHBondContact O-N 2.94Å; K681-C685 PolarHBondContact O-SG 2.93Å; Q682-C685 WeakPolarHBondContact O-CB 3.21Å; Q682-C685 PolarHBondContact O-N 2.83Å; C685-H687 VanDerWaalsContact C-N 3.34Å; C685-H687 PolarHBondContact O-N 2.82Å; C685-S688 PolarHBondContact O-N 3.38Å; C685-S688 PolarHBondContact O-OG 2.98Å; C685-E689 PolarHBondContact O-N 2.95Å
686	V	93.5	Very high	87.6	Confident	8 Å²	8	47.8 Å²	47.8	5%	0.048	25%	0.252	C	S	.	.	H	α-helix	trans	-58.8	-46.2	177.6	176.3	0	0	0	0	111.4	A581 F642 Q682 S688 E689 W690 L706	A581-V686 HydrophobicContact CB-CG1 4.26Å; A581-V686 HydrophobicContact CB-CG2 4.35Å; F642-V686 HydrophobicContact CE1-CG1 3.97Å; F642-V686 HydrophobicContact CE1-CG2 4.27Å; F642-V686 HydrophobicContact CZ-CG1 4.31Å; F642-V686 HydrophobicContact CZ-CG2 3.94Å; Q682-V686 PolarHBondContact O-N 3.35Å; Q682-V686 VanDerWaalsContact O-N 3.12Å; V686-S688 VanDerWaalsContact C-N 3.33Å; V686-S688 PolarHBondContact O-N 3.37Å; V686-E689 PolarHBondContact O-N 2.69Å; V686-W690 HydrophobicContact CG1-CD2 3.71Å; V686-W690 HydrophobicContact CG1-CE3 3.71Å; V686-W690 HydrophobicContact CG1-CG 4.35Å; V686-W690 HydrophobicContact CG1-CH2 4.06Å; V686-W690 HydrophobicContact CG1-CZ2 4.08Å; V686-W690 HydrophobicContact CG1-CZ3 3.87Å; V686-W690 WeakPolarHBondContact O-CB 3.38Å; V686-W690 PolarHBondContact O-N 3.22Å; V686-L706 HydrophobicContact CG1-CD1 4.06Å
687	H	91.8	Very high	87.1	Confident	24 Å²	24	49.3 Å²	49.3	11%	0.111	26%	0.258	C	S	.	.	H	α-helix	trans	-59.2	-43.9	177.7	176.8	-81.4	0	0	0	112.1	L683 L684 C685 E689 W690 K691 M699 Y703 L746	L683-H687 WeakPolarHBondContact O-CB 3.37Å; L683-H687 PolarHBondContact O-N 3.19Å; L684-H687 PolarHBondContact O-N 3.41Å; C685-H687 VanDerWaalsContact C-N 3.34Å; C685-H687 PolarHBondContact O-N 2.82Å; H687-E689 VanDerWaalsContact C-N 3.32Å; H687-E689 PolarHBondContact O-N 3.5Å; H687-W690 PolarHBondContact O-N 2.82Å; H687-K691 VanDerWaalsContact O-CB 3.26Å; H687-K691 WeakPolarHBondContact O-CB 3.44Å; H687-K691 PolarHBondContact O-N 2.98Å; H687-M699 WeakPolarHBondContact CD2-CE 2.97Å; H687-M699 VanDerWaalsContact NE2-CE 3.32Å; H687-M699 WeakPolarHBondContact NE2-CE 3.47Å; H687-Y703 HydrophobicContact CB-CD2 4.36Å; H687-Y703 HydrophobicContact CB-CE2 3.66Å; H687-L746 PolarHBondContact NE2-O 3.21Å; H687-L746 VanDerWaalsContact NE2-O 3.12Å
688	S	90	Very high	86.7	Confident	74 Å²	74	44.3 Å²	44.3	52%	0.517	24%	0.238	S	C	.	.	H	α-helix	trans	-62.5	-38.2	-177.8	72.2	0	0	0	0	112.7	L684 C685 V686	L684-S688 WeakPolarHBondContact O-CB 3.23Å; L684-S688 PolarHBondContact O-N 2.8Å; L684-S688 PolarHBondContact O-OG 3.5Å; C685-S688 PolarHBondContact O-N 3.38Å; C685-S688 PolarHBondContact O-OG 2.98Å; V686-S688 VanDerWaalsContact C-N 3.33Å; V686-S688 PolarHBondContact O-N 3.37Å
689	E	89.6	Confident	86.5	Confident	72 Å²	72	41.1 Å²	41.1	34%	0.336	22%	0.221	S	C	.	.	H	α-helix	trans	-72.6	-45.7	175.7	-67.5	-179.1	-165.4	0	0	111.4	A581 Y582 C685 V686 H687 T692 L693	A581-E689 HydrophobicContact CB-CB 4.38Å; A581-E689 WeakPolarHBondContact CB-OE2 3.29Å; Y582-E689 WeakPolarHBondContact CB-OE2 3.46Å; Y582-E689 PolarHBondContact N-OE2 3.32Å; C685-E689 PolarHBondContact O-N 2.95Å; V686-E689 PolarHBondContact O-N 2.69Å; H687-E689 VanDerWaalsContact C-N 3.32Å; H687-E689 PolarHBondContact O-N 3.5Å; E689-T692 PolarHBondContact O-OG1 3.31Å; E689-L693 VanDerWaalsContact O-CD1 3.31Å; E689-L693 WeakPolarHBondContact O-CD1 3.25Å; E689-L693 VanDerWaalsContact O-CG 3.31Å; E689-L693 WeakPolarHBondContact O-CG 3.42Å
690	W	90	Very high	86.1	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-74.6	-28.1	-173.9	-75.5	0.9	0	0	0	114.7	A581 L639 F642 L643 V686 H687 T692 L693 L694 M699 L706	A581-W690 PolarHBondContact O-NE1 3.03Å; L639-W690 HydrophobicContact CD2-CH2 4.29Å; L639-W690 HydrophobicContact CD2-CZ2 4.18Å; F642-W690 AromaticContact CD1-CH2 3.6Å; F642-W690 HydrophobicContact CD1-CH2 3.6Å; F642-W690 AromaticContact CD1-CZ2 3.34Å; F642-W690 HydrophobicContact CD1-CZ2 3.34Å; F642-W690 AromaticContact CE1-CH2 3.62Å; F642-W690 HydrophobicContact CE1-CH2 3.62Å; F642-W690 AromaticContact CE1-CZ2 3.31Å; F642-W690 HydrophobicContact CE1-CZ2 3.31Å; F642-W690 HydrophobicContact CG-CZ2 4.29Å; F642-W690 HydrophobicContact CZ-CZ2 4.27Å; L643-W690 HydrophobicContact CD2-CH2 3.83Å; L643-W690 HydrophobicContact CD2-CZ3 4.23Å; L643-W690 HydrophobicContact CG-CH2 4.46Å; V686-W690 HydrophobicContact CG1-CD2 3.71Å; V686-W690 HydrophobicContact CG1-CE3 3.71Å; V686-W690 HydrophobicContact CG1-CG 4.35Å; V686-W690 HydrophobicContact CG1-CH2 4.06Å; V686-W690 HydrophobicContact CG1-CZ2 4.08Å; V686-W690 HydrophobicContact CG1-CZ3 3.87Å; V686-W690 WeakPolarHBondContact O-CB 3.38Å; V686-W690 PolarHBondContact O-N 3.22Å; H687-W690 PolarHBondContact O-N 2.82Å; W690-T692 PolarHBondContact O-N 2.95Å; W690-T692 VanDerWaalsContact O-N 3.16Å; W690-L693 PolarHBondContact O-N 3.26Å; W690-L694 HydrophobicContact CB-CD1 4Å; W690-L694 HydrophobicContact CB-CG 4.4Å; W690-L694 HydrophobicContact CD2-CD1 3.58Å; W690-L694 HydrophobicContact CE3-CD1 3.95Å; W690-L694 HydrophobicContact CG-CD1 3.63Å; W690-L694 HydrophobicContact CG-CG 4.29Å; W690-L694 PolarHBondContact O-N 2.88Å; W690-M699 HydrophobicContact CB-CG 3.97Å; W690-L706 HydrophobicContact CZ3-CD1 4.48Å
691	K	85.7	Confident	85.8	Confident	146 Å²	146	43.7 Å²	43.7	64%	0.635	24%	0.235	S	C	*	.	H	α-helix	trans	-55.9	-33.6	-177.7	178.6	-177.4	176.6	-176	0	112.8	H687 M699	H687-K691 VanDerWaalsContact O-CB 3.26Å; H687-K691 WeakPolarHBondContact O-CB 3.44Å; H687-K691 PolarHBondContact O-N 2.98Å; K691-M699 HydrophobicContact CB-CE 4.07Å
692	T	82.5	Confident	85.5	Confident	95 Å²	95	37.4 Å²	37.4	58%	0.583	21%	0.208	S	C	*	.	H	α-helix	trans	-96.9	-22.3	-179	56.1	0	0	0	0	113	L525 E689 W690	L525-T692 WeakPolarHBondContact CD1-O 3.23Å; E689-T692 PolarHBondContact O-OG1 3.31Å; W690-T692 PolarHBondContact O-N 2.95Å; W690-T692 VanDerWaalsContact O-N 3.16Å
693	L	85.1	Confident	85.5	Confident	9 Å²	9	36 Å²	36	5%	0.047	20%	0.202	C	C	.	.	H	α-helix	trans	-94	-47.5	-174.1	-63.8	170.4	0	0	0	112.9	L525 Y582 A585 L586 N589 E689 W690	L525-L693 HydrophobicContact CB-CD2 3.86Å; L525-L693 HydrophobicContact CD1-CD2 3.68Å; L525-L693 HydrophobicContact CG-CD2 4.38Å; Y582-L693 HydrophobicContact CD2-CD1 3.72Å; Y582-L693 HydrophobicContact CE2-CD1 4.3Å; Y582-L693 HydrophobicContact CE2-CD2 4.49Å; Y582-L693 HydrophobicContact CG-CD1 4.46Å; A585-L693 HydrophobicContact CB-CB 3.82Å; A585-L693 HydrophobicContact CB-CD1 3.84Å; A585-L693 HydrophobicContact CB-CG 4.48Å; L586-L693 HydrophobicContact CD2-CD2 3.94Å; L586-L693 HydrophobicContact CG-CD2 4.44Å; N589-L693 PolarHBondContact ND2-O 3.3Å; E689-L693 VanDerWaalsContact O-CD1 3.31Å; E689-L693 WeakPolarHBondContact O-CD1 3.25Å; E689-L693 VanDerWaalsContact O-CG 3.31Å; E689-L693 WeakPolarHBondContact O-CG 3.42Å; W690-L693 PolarHBondContact O-N 3.26Å
694	L	81.4	Confident	85.4	Confident	9 Å²	9	36 Å²	36	5%	0.047	20%	0.201	C	C	.	.	S	Bend	trans	-90.7	150.8	-169.6	-73	179.8	0	0	0	112.6	A585 F588 L639 W690 G696 M699	A585-L694 HydrophobicContact CB-CD1 4.41Å; A585-L694 HydrophobicContact CB-CD2 3.86Å; A585-L694 HydrophobicContact CB-CG 3.83Å; F588-L694 HydrophobicContact CB-CD2 4.45Å; F588-L694 HydrophobicContact CD1-CD2 3.54Å; F588-L694 HydrophobicContact CE1-CD2 4.16Å; F588-L694 HydrophobicContact CG-CD2 4.22Å; L639-L694 HydrophobicContact CD2-CD1 4.13Å; W690-L694 HydrophobicContact CB-CD1 4Å; W690-L694 HydrophobicContact CB-CG 4.4Å; W690-L694 HydrophobicContact CD2-CD1 3.58Å; W690-L694 HydrophobicContact CE3-CD1 3.95Å; W690-L694 HydrophobicContact CG-CD1 3.63Å; W690-L694 HydrophobicContact CG-CG 4.29Å; W690-L694 PolarHBondContact O-N 2.88Å; L694-G696 PolarHBondContact O-N 3.09Å; L694-M699 HydrophobicContact CB-CB 3.98Å
695	P	76.2	Confident	85.3	Confident	15 Å²	15	38 Å²	38	10%	0.097	20%	0.204	C	C	.	.			trans	-56.5	135.3	166.9	-22.8	33.2	0	0	0	111	H697 V698 M699	P695-H697 VanDerWaalsContact C-N 3.29Å; P695-H697 PolarHBondContact O-N 2.85Å; P695-H697 VanDerWaalsContact O-N 3.09Å; P695-V698 HydrophobicContact CB-CB 4.4Å; P695-V698 HydrophobicContact CB-CG2 4.14Å; P695-V698 HydrophobicContact CG-CG2 4.36Å; P695-V698 WeakPolarHBondContact O-CB 3.5Å; P695-V698 PolarHBondContact O-N 3.12Å; P695-M699 PolarHBondContact O-N 2.85Å
696	G	75.6	Confident	85.4	Confident	25 Å²	25	35 Å²	35	26%	0.258	18%	0.184	S	C	.	.	H	α-helix	trans	-55	-38.1	-168	0	0	0	0	0	114.9	L694 R700	L694-G696 PolarHBondContact O-N 3.09Å; G696-R700 WeakPolarHBondContact O-CG 3.28Å; G696-R700 PolarHBondContact O-N 2.99Å; G696-R700 PolarHBondContact O-NH1 3.02Å
697	H	74.9	Confident	85.4	Confident	40 Å²	40	34.7 Å²	34.7	19%	0.185	18%	0.181	C	C	.	.	H	α-helix	trans	-67.9	-46.6	175.8	179.2	-92.8	0	0	0	112.5	F485 F487 P695 M699 R700 V701	F485-H697 PolarHBondContact O-CE1 3.44Å; F487-H697 AromaticContact CE1-CE1 3.65Å; F487-H697 AromaticContact CE1-NE2 3.56Å; F487-H697 AromaticContact CE2-CE1 3.82Å; F487-H697 AromaticContact CZ-CE1 3.38Å; F487-H697 WeakPolarHBondContact CZ-CE1 3.47Å; F487-H697 AromaticContact CZ-CG 3.96Å; F487-H697 AromaticContact CZ-ND1 3.54Å; F487-H697 AromaticContact CZ-NE2 3.74Å; P695-H697 VanDerWaalsContact C-N 3.29Å; P695-H697 PolarHBondContact O-N 2.85Å; P695-H697 VanDerWaalsContact O-N 3.09Å; H697-M699 VanDerWaalsContact C-N 3.25Å; H697-M699 PolarHBondContact O-N 2.81Å; H697-R700 PolarHBondContact O-N 2.95Å; H697-V701 VanDerWaalsContact CE1-CG2 3.47Å; H697-V701 WeakPolarHBondContact CE1-CG2 3.4Å; H697-V701 WeakPolarHBondContact O-CG2 3.3Å; H697-V701 PolarHBondContact O-N 2.97Å
698	V	78.9	Confident	85.4	Confident	15 Å²	15	35.4 Å²	35.4	9%	0.091	19%	0.186	C	C	.	.	H	α-helix	trans	-59.2	-42.8	178.4	177.7	0	0	0	0	110	F485 F588 L639 P695 S702	F485-V698 HydrophobicContact CD1-CG2 4.11Å; F485-V698 HydrophobicContact CE1-CG2 4.07Å; F588-V698 HydrophobicContact CE1-CG1 3.97Å; F588-V698 HydrophobicContact CE1-CG2 4.36Å; F588-V698 HydrophobicContact CE2-CG1 4.27Å; F588-V698 HydrophobicContact CZ-CB 4.49Å; F588-V698 HydrophobicContact CZ-CG1 3.77Å; F588-V698 HydrophobicContact CZ-CG2 4.04Å; L639-V698 HydrophobicContact CD1-CG1 3.58Å; P695-V698 HydrophobicContact CB-CB 4.4Å; P695-V698 HydrophobicContact CB-CG2 4.14Å; P695-V698 HydrophobicContact CG-CG2 4.36Å; P695-V698 WeakPolarHBondContact O-CB 3.5Å; P695-V698 PolarHBondContact O-N 3.12Å; V698-S702 WeakPolarHBondContact O-CB 3.36Å; V698-S702 PolarHBondContact O-N 3.09Å; V698-S702 PolarHBondContact O-OG 3.06Å
699	M	83.6	Confident	85.6	Confident	10 Å²	10	33.1 Å²	33.1	5%	0.049	17%	0.17	C	C	.	.	H	α-helix	trans	-59.6	-51.3	175.4	-177	-119.6	178.4	0	0	111.5	H687 W690 K691 L694 P695 H697 S702 Y703	H687-M699 WeakPolarHBondContact CD2-CE 2.97Å; H687-M699 VanDerWaalsContact NE2-CE 3.32Å; H687-M699 WeakPolarHBondContact NE2-CE 3.47Å; W690-M699 HydrophobicContact CB-CG 3.97Å; K691-M699 HydrophobicContact CB-CE 4.07Å; L694-M699 HydrophobicContact CB-CB 3.98Å; P695-M699 PolarHBondContact O-N 2.85Å; H697-M699 VanDerWaalsContact C-N 3.25Å; H697-M699 PolarHBondContact O-N 2.81Å; M699-S702 PolarHBondContact O-N 3.22Å; M699-Y703 WeakPolarHBondContact O-CB 3.2Å; M699-Y703 PolarHBondContact O-N 2.92Å
700	R	82.9	Confident	85.7	Confident	26 Å²	26	29.7 Å²	29.7	10%	0.098	15%	0.154	C	C	.	.	H	α-helix	trans	-63.8	-43.4	-179.5	-73.7	-170.8	-60.8	-88.8	12.2	113.7	G696 H697 G704 F747 E750 Y758	G696-R700 WeakPolarHBondContact O-CG 3.28Å; G696-R700 PolarHBondContact O-N 2.99Å; G696-R700 PolarHBondContact O-NH1 3.02Å; H697-R700 PolarHBondContact O-N 2.95Å; R700-G704 PolarHBondContact O-N 3.32Å; R700-F747 HydrophobicContact CB-CD1 4.47Å; R700-F747 HydrophobicContact CB-CE1 4.29Å; R700-F747 HydrophobicContact CG-CD1 4.19Å; R700-F747 HydrophobicContact CG-CE1 4.43Å; R700-E750 IonicContact CZ-OE1 3.33Å; R700-E750 IonicContact NE-OE1 2.7Å; R700-E750 PolarHBondContact NE-OE1 3.41Å; R700-E750 IonicContact NH2-OE1 2.66Å; R700-E750 PolarHBondContact NH2-OE1 3.15Å; R700-Y758 HydrophobicContact CB-CD1 4.13Å; R700-Y758 HydrophobicContact CB-CD2 4.19Å; R700-Y758 HydrophobicContact CB-CE1 3.99Å; R700-Y758 HydrophobicContact CB-CE2 4.07Å; R700-Y758 HydrophobicContact CB-CG 4.22Å; R700-Y758 PolarHBondContact NE-OH 3.15Å; R700-Y758 VanDerWaalsContact NE-OH 3.17Å
701	V	82.3	Confident	85.9	Confident	42 Å²	42	29.7 Å²	29.7	26%	0.255	15%	0.154	S	C	.	.	H	α-helix	trans	-62.8	-47.4	176.3	172.2	0	0	0	0	110.7	H697 Y703 G704 R705 Y758	H697-V701 VanDerWaalsContact CE1-CG2 3.47Å; H697-V701 WeakPolarHBondContact CE1-CG2 3.4Å; H697-V701 WeakPolarHBondContact O-CG2 3.3Å; H697-V701 PolarHBondContact O-N 2.97Å; V701-Y703 PolarHBondContact O-N 3.17Å; V701-G704 PolarHBondContact O-N 3.46Å; V701-R705 WeakPolarHBondContact O-CG 3.38Å; V701-R705 PolarHBondContact O-N 2.98Å; V701-Y758 HydrophobicContact CG2-CD1 3.77Å; V701-Y758 HydrophobicContact CG2-CE1 3.92Å
702	S	85.3	Confident	86.2	Confident	7 Å²	7	25.1 Å²	25.1	5%	0.049	14%	0.138	C	C	.	.	H	α-helix	trans	-64.8	-42.7	-179.3	-56.6	0	0	0	0	111.3	L643 V698 M699 R705 L706	L643-S702 VanDerWaalsContact CD2-O 3.26Å; L643-S702 WeakPolarHBondContact CD2-O 3.35Å; V698-S702 WeakPolarHBondContact O-CB 3.36Å; V698-S702 PolarHBondContact O-N 3.09Å; V698-S702 PolarHBondContact O-OG 3.06Å; M699-S702 PolarHBondContact O-N 3.22Å; S702-R705 WeakPolarHBondContact O-CB 3.49Å; S702-R705 PolarHBondContact O-N 2.9Å; S702-L706 PolarHBondContact O-N 2.7Å
703	Y	89.2	Confident	86.6	Confident	2 Å²	2	21 Å²	21	1%	0.008	12%	0.115	C	C	.	.	H	α-helix	trans	-67.6	-41.5	177.7	-162.3	-106.3	0	0	0	112.5	L683 H687 M699 V701 R705 L706 V707 L746 F747	L683-Y703 VanDerWaalsContact C-OH 3.23Å; L683-Y703 HydrophobicContact CB-CE2 4.4Å; L683-Y703 WeakPolarHBondContact CB-OH 3.28Å; L683-Y703 HydrophobicContact CD2-CE2 4.26Å; L683-Y703 VanDerWaalsContact O-CE2 3.22Å; L683-Y703 WeakPolarHBondContact O-CE2 3.48Å; L683-Y703 PolarHBondContact O-OH 3.41Å; H687-Y703 HydrophobicContact CB-CD2 4.36Å; H687-Y703 HydrophobicContact CB-CE2 3.66Å; M699-Y703 WeakPolarHBondContact O-CB 3.2Å; M699-Y703 PolarHBondContact O-N 2.92Å; V701-Y703 PolarHBondContact O-N 3.17Å; Y703-R705 PolarHBondContact O-N 2.89Å; Y703-L706 HydrophobicContact CD2-CD1 4.48Å; Y703-L706 WeakPolarHBondContact O-CB 3.46Å; Y703-L706 PolarHBondContact O-N 2.96Å; Y703-V707 HydrophobicContact CD1-CG2 4.03Å; Y703-V707 HydrophobicContact CE1-CG2 3.9Å; Y703-V707 WeakPolarHBondContact O-CG2 3.43Å; Y703-V707 PolarHBondContact O-N 3.48Å; Y703-L746 HydrophobicContact CE1-CB 4.13Å; Y703-L746 HydrophobicContact CE1-CD1 4.02Å; Y703-L746 WeakPolarHBondContact OH-CD1 3.36Å; Y703-F747 AromaticContact CD1-CE2 3.96Å; Y703-F747 HydrophobicContact CD1-CE2 3.96Å; Y703-F747 AromaticContact CD1-CZ 3.76Å; Y703-F747 HydrophobicContact CD1-CZ 3.76Å; Y703-F747 HydrophobicContact CE1-CE2 4.32Å
704	G	91	Very high	86.8	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-53.6	-40.2	173.6	0	0	0	0	0	112.4	R700 V701 V707 D708 Y758	R700-G704 PolarHBondContact O-N 3.32Å; V701-G704 PolarHBondContact O-N 3.46Å; G704-V707 PolarHBondContact O-N 3.21Å; G704-D708 VanDerWaalsContact O-CB 3.28Å; G704-D708 WeakPolarHBondContact O-CB 3.47Å; G704-D708 PolarHBondContact O-N 3.23Å; G704-Y758 CarbonylContact C-O 3.42Å; G704-Y758 WeakPolarHBondContact CA-O 3.35Å
705	R	90.8	Very high	87.3	Confident	116 Å²	116	20.3 Å²	20.3	44%	0.438	11%	0.111	S	C	.	.	H	α-helix	trans	-65	-37.7	174.9	-69.2	172.4	62	-168.4	-1.8	113.9	N640 V701 S702 Y703 D708 S709	N640-R705 PolarHBondContact OD1-NH1 2.97Å; N640-R705 PolarHBondContact OD1-NH2 2.94Å; V701-R705 WeakPolarHBondContact O-CG 3.38Å; V701-R705 PolarHBondContact O-N 2.98Å; S702-R705 WeakPolarHBondContact O-CB 3.49Å; S702-R705 PolarHBondContact O-N 2.9Å; Y703-R705 PolarHBondContact O-N 2.89Å; R705-D708 PolarHBondContact O-N 3.43Å; R705-S709 PolarHBondContact O-N 3.22Å
706	L	92.4	Very high	87.9	Confident	1 Å²	1	24 Å²	24	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-66.2	-43.8	174.8	-67.1	177.3	0	0	0	111.1	L643 Q646 L683 V686 W690 S702 Y703 D708 S709 L710	L643-L706 HydrophobicContact CB-CD2 4.49Å; L643-L706 HydrophobicContact CD2-CD1 3.92Å; L643-L706 HydrophobicContact CD2-CD2 3.58Å; L643-L706 HydrophobicContact CD2-CG 3.46Å; L643-L706 VanDerWaalsContact CD2-CG 3.46Å; Q646-L706 HydrophobicContact CB-CD2 3.73Å; L683-L706 HydrophobicContact CD2-CB 3.64Å; L683-L706 HydrophobicContact CD2-CD1 4.17Å; V686-L706 HydrophobicContact CG1-CD1 4.06Å; W690-L706 HydrophobicContact CZ3-CD1 4.48Å; S702-L706 PolarHBondContact O-N 2.7Å; Y703-L706 HydrophobicContact CD2-CD1 4.48Å; Y703-L706 WeakPolarHBondContact O-CB 3.46Å; Y703-L706 PolarHBondContact O-N 2.96Å; L706-D708 VanDerWaalsContact C-N 3.33Å; L706-S709 WeakPolarHBondContact O-CB 3.29Å; L706-S709 PolarHBondContact O-N 3.33Å; L706-L710 PolarHBondContact O-N 2.57Å
707	V	93.5	Very high	88.4	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.3	-44.1	175.4	175.4	0	0	0	0	110.5	L683 Y703 G704 S709 L710 F711 V743 F747 C759	L683-V707 HydrophobicContact CD1-CG2 4.37Å; Y703-V707 HydrophobicContact CD1-CG2 4.03Å; Y703-V707 HydrophobicContact CE1-CG2 3.9Å; Y703-V707 WeakPolarHBondContact O-CG2 3.43Å; Y703-V707 PolarHBondContact O-N 3.48Å; G704-V707 PolarHBondContact O-N 3.21Å; V707-S709 VanDerWaalsContact C-N 3.32Å; V707-S709 PolarHBondContact O-N 2.94Å; V707-L710 PolarHBondContact O-N 2.75Å; V707-L710 VanDerWaalsContact O-N 3.16Å; V707-F711 HydrophobicContact CG1-CD1 4.04Å; V707-F711 HydrophobicContact CG1-CD2 4.13Å; V707-F711 HydrophobicContact CG1-CE1 3.89Å; V707-F711 HydrophobicContact CG1-CE2 4Å; V707-F711 HydrophobicContact CG1-CG 4.17Å; V707-F711 HydrophobicContact CG1-CZ 3.87Å; V707-F711 WeakPolarHBondContact O-CB 3.34Å; V707-F711 WeakPolarHBondContact O-CG 3.32Å; V707-F711 PolarHBondContact O-N 3.29Å; V707-V743 HydrophobicContact CB-CG1 4.37Å; V707-V743 HydrophobicContact CG1-CG1 3.71Å; V707-V743 HydrophobicContact CG2-CG1 3.68Å; V707-F747 HydrophobicContact CG2-CE2 4.4Å; V707-C759 HydrophobicContact CG1-CB 4.34Å
708	D	93.1	Very high	89	Confident	39 Å²	39	22.6 Å²	22.6	21%	0.209	12%	0.117	C	C	.	.	H	α-helix	trans	-58.1	-44.8	178.5	-157.9	60.7	0	0	0	111.4	G704 R705 L706 F711 T712 H760 T761	G704-D708 VanDerWaalsContact O-CB 3.28Å; G704-D708 WeakPolarHBondContact O-CB 3.47Å; G704-D708 PolarHBondContact O-N 3.23Å; R705-D708 PolarHBondContact O-N 3.43Å; L706-D708 VanDerWaalsContact C-N 3.33Å; D708-F711 PolarHBondContact O-N 3.49Å; D708-T712 VanDerWaalsContact O-CB 3.25Å; D708-T712 WeakPolarHBondContact O-CB 3.04Å; D708-T712 PolarHBondContact O-N 3.49Å; D708-T712 PolarHBondContact O-OG1 2.54Å; D708-H760 PolarHBondContact OD1-N 3.38Å; D708-T761 VanDerWaalsContact OD1-CB 3.25Å; D708-T761 WeakPolarHBondContact OD1-CB 3.06Å; D708-T761 PolarHBondContact OD1-N 2.75Å; D708-T761 PolarHBondContact OD1-OG1 3.49Å
709	S	92.9	Very high	89.5	Confident	27 Å²	27	23 Å²	23	19%	0.189	12%	0.119	C	C	.	.	H	α-helix	trans	-62.1	-44.6	174.6	-174.2	0	0	0	0	112.4	S647 R705 L706 V707 A713	S647-S709 VanDerWaalsContact CB-OG 3.27Å; S647-S709 WeakPolarHBondContact CB-OG 3Å; S647-S709 VanDerWaalsContact OG-CB 3.26Å; S647-S709 WeakPolarHBondContact OG-CB 3.38Å; S647-S709 PolarHBondContact OG-OG 3.3Å; R705-S709 PolarHBondContact O-N 3.22Å; L706-S709 WeakPolarHBondContact O-CB 3.29Å; L706-S709 PolarHBondContact O-N 3.33Å; V707-S709 VanDerWaalsContact C-N 3.32Å; V707-S709 PolarHBondContact O-N 2.94Å; S709-A713 WeakPolarHBondContact O-CB 3.13Å; S709-A713 PolarHBondContact O-N 3.11Å; S709-A713 VanDerWaalsContact O-N 3.11Å
710	L	91.8	Very high	89.6	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64	-49.7	178	176.8	63	0	0	0	111	L654 C679 L683 L706 V707 T712 A713 V714 L739	L654-L710 HydrophobicContact CD1-CD1 3.62Å; L654-L710 HydrophobicContact CG-CD1 4.38Å; C679-L710 HydrophobicContact CB-CD1 3.63Å; C679-L710 HydrophobicContact CB-CD2 4.02Å; L683-L710 HydrophobicContact CD1-CD2 3.48Å; L683-L710 VanDerWaalsContact CD1-CD2 3.48Å; L706-L710 PolarHBondContact O-N 2.57Å; V707-L710 PolarHBondContact O-N 2.75Å; V707-L710 VanDerWaalsContact O-N 3.16Å; L710-T712 VanDerWaalsContact C-N 3.34Å; L710-T712 PolarHBondContact O-N 3.25Å; L710-A713 WeakPolarHBondContact O-CB 3.4Å; L710-A713 PolarHBondContact O-N 3.41Å; L710-A713 VanDerWaalsContact O-N 3.17Å; L710-V714 HydrophobicContact CD1-CG2 4.24Å; L710-V714 HydrophobicContact CG-CG2 4.48Å; L710-V714 WeakPolarHBondContact O-CG2 3.43Å; L710-V714 PolarHBondContact O-N 3.03Å; L710-L739 HydrophobicContact CD2-CD1 4.43Å
711	F	94.2	Very high	89.8	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.1	-42.5	-178	-80.3	16.1	0	0	0	111.2	V707 D708 A713 V714 I715 L739 M740 V743 T761 W762 M765	V707-F711 HydrophobicContact CG1-CD1 4.04Å; V707-F711 HydrophobicContact CG1-CD2 4.13Å; V707-F711 HydrophobicContact CG1-CE1 3.89Å; V707-F711 HydrophobicContact CG1-CE2 4Å; V707-F711 HydrophobicContact CG1-CG 4.17Å; V707-F711 HydrophobicContact CG1-CZ 3.87Å; V707-F711 WeakPolarHBondContact O-CB 3.34Å; V707-F711 WeakPolarHBondContact O-CG 3.32Å; V707-F711 PolarHBondContact O-N 3.29Å; D708-F711 PolarHBondContact O-N 3.49Å; F711-A713 VanDerWaalsContact C-N 3.31Å; F711-A713 PolarHBondContact O-N 2.94Å; F711-V714 PolarHBondContact O-N 3.01Å; F711-I715 WeakPolarHBondContact O-CB 3.36Å; F711-I715 WeakPolarHBondContact O-CD1 3.45Å; F711-I715 VanDerWaalsContact O-CG1 3.23Å; F711-I715 WeakPolarHBondContact O-CG1 3.39Å; F711-I715 PolarHBondContact O-N 3.34Å; F711-L739 HydrophobicContact CD1-CD2 4.34Å; F711-L739 HydrophobicContact CE1-CD2 3.83Å; F711-L739 HydrophobicContact CE1-CG 3.98Å; F711-M740 HydrophobicContact CE2-CE 4.29Å; F711-M740 HydrophobicContact CE2-CG 4.31Å; F711-M740 HydrophobicContact CZ-CG 4.09Å; F711-V743 HydrophobicContact CE1-CG2 4.34Å; F711-V743 HydrophobicContact CZ-CG2 4.39Å; F711-T761 HydrophobicContact CB-CG2 3.88Å; F711-W762 HydrophobicContact CD2-CE3 4.38Å; F711-W762 HydrophobicContact CE2-CD2 4.35Å; F711-W762 AromaticContact CE2-CE3 3.45Å; F711-W762 HydrophobicContact CE2-CE3 3.45Å; F711-W762 VanDerWaalsContact CE2-CE3 3.45Å; F711-W762 AromaticContact CE2-CZ3 3.71Å; F711-W762 HydrophobicContact CE2-CZ3 3.71Å; F711-W762 HydrophobicContact CZ-CE3 4.09Å; F711-W762 AromaticContact CZ-CZ3 3.85Å; F711-W762 HydrophobicContact CZ-CZ3 3.85Å; F711-M765 HydrophobicContact CB-CE 3.68Å; F711-M765 HydrophobicContact CD1-CE 3.74Å; F711-M765 HydrophobicContact CD2-CB 3.78Å; F711-M765 HydrophobicContact CD2-CE 4.04Å; F711-M765 HydrophobicContact CD2-CG 4.13Å; F711-M765 HydrophobicContact CE1-CE 4.35Å; F711-M765 HydrophobicContact CE2-CB 4.02Å; F711-M765 HydrophobicContact CE2-CG 4.11Å; F711-M765 HydrophobicContact CG-CB 4.47Å; F711-M765 HydrophobicContact CG-CE 3.56Å
712	T	92.8	Very high	89.8	Confident	49 Å²	49	32.2 Å²	32.2	30%	0.301	17%	0.168	S	C	.	.	H	α-helix	trans	-57.1	-47	173.9	-65.6	0	0	0	0	111	D708 L710 I715 L716 T761	D708-T712 VanDerWaalsContact O-CB 3.25Å; D708-T712 WeakPolarHBondContact O-CB 3.04Å; D708-T712 PolarHBondContact O-N 3.49Å; D708-T712 PolarHBondContact O-OG1 2.54Å; L710-T712 VanDerWaalsContact C-N 3.34Å; L710-T712 PolarHBondContact O-N 3.25Å; T712-I715 PolarHBondContact O-N 2.86Å; T712-L716 HydrophobicContact CG2-CD1 3.96Å; T712-L716 HydrophobicContact CG2-CG 4.46Å; T712-L716 WeakPolarHBondContact O-CB 3.32Å; T712-L716 VanDerWaalsContact O-CG 3.27Å; T712-L716 WeakPolarHBondContact O-CG 3.12Å; T712-L716 PolarHBondContact O-N 3.45Å; T712-T761 PolarHBondContact OG1-OG1 3.17Å
713	A	89.9	Confident	89.8	Confident	10 Å²	10	36.4 Å²	36.4	8%	0.083	19%	0.19	C	C	.	.	H	α-helix	trans	-64.3	-42.2	179.4	0	0	0	0	0	112.8	V651 L654 S709 L710 F711 L716 N717	V651-A713 HydrophobicContact CG2-CB 4.04Å; L654-A713 HydrophobicContact CD1-CB 3.56Å; S709-A713 WeakPolarHBondContact O-CB 3.13Å; S709-A713 PolarHBondContact O-N 3.11Å; S709-A713 VanDerWaalsContact O-N 3.11Å; L710-A713 WeakPolarHBondContact O-CB 3.4Å; L710-A713 PolarHBondContact O-N 3.41Å; L710-A713 VanDerWaalsContact O-N 3.17Å; F711-A713 VanDerWaalsContact C-N 3.31Å; F711-A713 PolarHBondContact O-N 2.94Å; A713-L716 PolarHBondContact O-N 3.42Å; A713-N717 WeakPolarHBondContact O-CB 3.35Å; A713-N717 VanDerWaalsContact O-CG 3.29Å; A713-N717 PolarHBondContact O-N 2.77Å; A713-N717 PolarHBondContact O-ND2 2.95Å
714	V	89.7	Confident	89.8	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	19%	0.19	C	C	.	.	H	α-helix	trans	-62.5	-48.4	176.4	170	0	0	0	0	111	L654 L710 F711 L716 N717 V718 L736 M765	L654-V714 HydrophobicContact CD1-CG2 3.92Å; L710-V714 HydrophobicContact CD1-CG2 4.24Å; L710-V714 HydrophobicContact CG-CG2 4.48Å; L710-V714 WeakPolarHBondContact O-CG2 3.43Å; L710-V714 PolarHBondContact O-N 3.03Å; F711-V714 PolarHBondContact O-N 3.01Å; V714-L716 PolarHBondContact O-N 2.89Å; V714-N717 PolarHBondContact O-N 2.88Å; V714-V718 WeakPolarHBondContact O-CG2 3.15Å; V714-V718 PolarHBondContact O-N 2.59Å; V714-L736 HydrophobicContact CG1-CD2 3.4Å; V714-L736 VanDerWaalsContact CG1-CD2 3.4Å; V714-M765 HydrophobicContact CB-CE 3.99Å; V714-M765 HydrophobicContact CG1-CE 3.85Å
715	I	92	Very high	89.5	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-60.2	-46.5	178.8	-69.7	160.6	0	0	0	110.5	F711 T712 N717 V718 L719 T761 R764 M765 L768 F794	F711-I715 WeakPolarHBondContact O-CB 3.36Å; F711-I715 WeakPolarHBondContact O-CD1 3.45Å; F711-I715 VanDerWaalsContact O-CG1 3.23Å; F711-I715 WeakPolarHBondContact O-CG1 3.39Å; F711-I715 PolarHBondContact O-N 3.34Å; T712-I715 PolarHBondContact O-N 2.86Å; I715-N717 VanDerWaalsContact C-N 3.31Å; I715-N717 PolarHBondContact O-N 3.16Å; I715-V718 PolarHBondContact O-N 3.17Å; I715-L719 HydrophobicContact CG2-CD1 3.76Å; I715-L719 HydrophobicContact CG2-CG 4.21Å; I715-L719 WeakPolarHBondContact O-CB 3.34Å; I715-L719 VanDerWaalsContact O-CG 3.29Å; I715-L719 WeakPolarHBondContact O-CG 3.46Å; I715-L719 PolarHBondContact O-N 3.18Å; I715-T761 HydrophobicContact CD1-CG2 3.39Å; I715-R764 HydrophobicContact CD1-CB 4.07Å; I715-R764 HydrophobicContact CD1-CG 3.94Å; I715-M765 HydrophobicContact CD1-CB 4.39Å; I715-M765 HydrophobicContact CD1-CE 4.17Å; I715-M765 HydrophobicContact CD1-SD 4.49Å; I715-M765 HydrophobicContact CG1-CE 3.91Å; I715-M765 HydrophobicContact CG1-SD 4.1Å; I715-L768 HydrophobicContact CB-CD2 4.34Å; I715-L768 HydrophobicContact CG1-CD2 3.79Å; I715-F794 HydrophobicContact CG2-CE1 4.13Å
716	L	89.6	Confident	89.2	Confident	92 Å²	92	37.1 Å²	37.1	48%	0.482	21%	0.211	S	C	.	.	H	α-helix	trans	-61.6	-39.3	177.7	-72.6	174.6	0	0	0	112.2	T712 A713 V714 L719 S720	T712-L716 HydrophobicContact CG2-CD1 3.96Å; T712-L716 HydrophobicContact CG2-CG 4.46Å; T712-L716 WeakPolarHBondContact O-CB 3.32Å; T712-L716 VanDerWaalsContact O-CG 3.27Å; T712-L716 WeakPolarHBondContact O-CG 3.12Å; T712-L716 PolarHBondContact O-N 3.45Å; A713-L716 PolarHBondContact O-N 3.42Å; V714-L716 PolarHBondContact O-N 2.89Å; L716-L719 PolarHBondContact O-N 3.12Å; L716-S720 WeakPolarHBondContact O-CB 3.4Å; L716-S720 PolarHBondContact O-N 2.72Å
717	N	86	Confident	88.8	Confident	36 Å²	36	45.2 Å²	45.2	19%	0.193	25%	0.246	C	C	.	.	H	α-helix	trans	-65.7	-41.3	176.3	-77.3	-18.3	0	0	0	111.9	F660 A713 V714 I715 S720	F660-N717 HydrophobicContact CD2-CB 3.71Å; F660-N717 HydrophobicContact CE2-CB 3.47Å; F660-N717 VanDerWaalsContact CE2-CB 3.47Å; A713-N717 WeakPolarHBondContact O-CB 3.35Å; A713-N717 VanDerWaalsContact O-CG 3.29Å; A713-N717 PolarHBondContact O-N 2.77Å; A713-N717 PolarHBondContact O-ND2 2.95Å; V714-N717 PolarHBondContact O-N 2.88Å; I715-N717 VanDerWaalsContact C-N 3.31Å; I715-N717 PolarHBondContact O-N 3.16Å; N717-S720 PolarHBondContact O-N 3.08Å; N717-S720 PolarHBondContact O-OG 2.94Å
718	V	87.9	Confident	88.4	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.006	25%	0.247	C	C	.	.	H	α-helix	trans	-66.1	-43.7	175.7	176.3	0	0	0	0	110.9	F660 V714 I715 S720 L721 I724 L768 L802	F660-V718 HydrophobicContact CE2-CG2 4.42Å; V714-V718 WeakPolarHBondContact O-CG2 3.15Å; V714-V718 PolarHBondContact O-N 2.59Å; I715-V718 PolarHBondContact O-N 3.17Å; V718-S720 PolarHBondContact O-N 3.25Å; V718-L721 WeakPolarHBondContact O-CB 3.37Å; V718-L721 PolarHBondContact O-N 2.86Å; V718-L721 VanDerWaalsContact O-N 3.13Å; V718-I724 HydrophobicContact CG1-CD1 4.38Å; V718-L768 HydrophobicContact CB-CD2 4.11Å; V718-L768 HydrophobicContact CG1-CD1 3.99Å; V718-L768 HydrophobicContact CG1-CD2 4.21Å; V718-L768 HydrophobicContact CG2-CD2 4.25Å; V718-L802 HydrophobicContact CG1-CD1 4.18Å
719	L	89	Confident	88.2	Confident	22 Å²	22	43.7 Å²	43.7	12%	0.115	24%	0.238	C	C	.	.	H	α-helix	trans	-64.3	-19.4	176.4	-71.3	175.2	0	0	0	113.7	I715 L716 L721 F794 E798 L802	I715-L719 HydrophobicContact CG2-CD1 3.76Å; I715-L719 HydrophobicContact CG2-CG 4.21Å; I715-L719 WeakPolarHBondContact O-CB 3.34Å; I715-L719 VanDerWaalsContact O-CG 3.29Å; I715-L719 WeakPolarHBondContact O-CG 3.46Å; I715-L719 PolarHBondContact O-N 3.18Å; L716-L719 PolarHBondContact O-N 3.12Å; L719-L721 VanDerWaalsContact C-N 3.33Å; L719-F794 HydrophobicContact CD1-CE1 4.25Å; L719-F794 HydrophobicContact CD2-CD1 4.49Å; L719-F794 HydrophobicContact CD2-CE1 4.28Å; L719-E798 HydrophobicContact CD1-CB 4.4Å; L719-E798 HydrophobicContact CD1-CG 4.08Å; L719-E798 HydrophobicContact CD2-CB 4.11Å; L719-L802 HydrophobicContact CD2-CB 4.4Å; L719-L802 HydrophobicContact CD2-CD2 4.49Å
720	S	85.9	Confident	87.9	Confident	73 Å²	73	46.6 Å²	46.6	51%	0.51	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-7.7	177.1	77.4	0	0	0	0	114	L716 N717 V718	L716-S720 WeakPolarHBondContact O-CB 3.4Å; L716-S720 PolarHBondContact O-N 2.72Å; N717-S720 PolarHBondContact O-N 3.08Å; N717-S720 PolarHBondContact O-OG 2.94Å; V718-S720 PolarHBondContact O-N 3.25Å
721	L	85.4	Confident	87.6	Confident	11 Å²	11	47.2 Å²	47.2	6%	0.058	26%	0.259	C	S	.	.			trans	-75.3	127.5	179.5	-70.4	171.3	0	0	0	111.2	F660 V718 L719 I724 L732 A805	F660-L721 HydrophobicContact CB-CD1 3.89Å; F660-L721 HydrophobicContact CB-CD2 3.28Å; F660-L721 HydrophobicContact CB-CG 3.91Å; F660-L721 HydrophobicContact CD2-CD1 4.3Å; F660-L721 HydrophobicContact CG-CD1 4.4Å; F660-L721 HydrophobicContact CG-CD2 4.5Å; V718-L721 WeakPolarHBondContact O-CB 3.37Å; V718-L721 PolarHBondContact O-N 2.86Å; V718-L721 VanDerWaalsContact O-N 3.13Å; L719-L721 VanDerWaalsContact C-N 3.33Å; L721-I724 HydrophobicContact CB-CD1 4.02Å; L721-I724 HydrophobicContact CB-CG1 3.8Å; L721-I724 HydrophobicContact CD1-CD1 3.92Å; L721-I724 HydrophobicContact CD1-CG1 3.85Å; L721-I724 HydrophobicContact CG-CG1 4.45Å; L721-L732 HydrophobicContact CD1-CD1 4.4Å; L721-A805 WeakPolarHBondContact O-CB 3.38Å
722	E	84.2	Confident	87.3	Confident	188 Å²	188	47.4 Å²	47.4	88%	0.879	26%	0.259	S	S	*	.	S	Bend	trans	-75.5	-34.8	177.4	-64.7	-177.5	170.5	0	0	112.7
723	D	84.5	Confident	87.2	Confident	96 Å²	96	46 Å²	46	51%	0.513	25%	0.25	S	S	.	.			trans	-145.9	138	-178.9	-170.4	15.4	0	0	0	109.8	R668	R668-D723 PolarHBondContact NH1-O 3.42Å
724	I	88.4	Confident	87.2	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	27%	0.273	C	S	.	.			trans	-135.3	107.5	-178.2	-57.7	173.3	0	0	0	106.7	V718 L721 E728 A729 L732 L802 A805 I806	V718-I724 HydrophobicContact CG1-CD1 4.38Å; L721-I724 HydrophobicContact CB-CD1 4.02Å; L721-I724 HydrophobicContact CB-CG1 3.8Å; L721-I724 HydrophobicContact CD1-CD1 3.92Å; L721-I724 HydrophobicContact CD1-CG1 3.85Å; L721-I724 HydrophobicContact CG-CG1 4.45Å; I724-E728 HydrophobicContact CG2-CB 3.93Å; I724-A729 HydrophobicContact CG2-CB 3.94Å; I724-L732 HydrophobicContact CG2-CD1 4.35Å; I724-L802 HydrophobicContact CD1-CD1 4.32Å; I724-A805 HydrophobicContact CD1-CB 4.06Å; I724-A805 HydrophobicContact CG1-CB 4.03Å; I724-A805 PolarHBondContact N-O 2.89Å; I724-I806 HydrophobicContact CB-CG1 4.21Å; I724-I806 HydrophobicContact CD1-CG1 4.04Å; I724-I806 HydrophobicContact CG2-CG1 4.48Å
725	T	85.7	Confident	87.1	Confident	46 Å²	46	51 Å²	51	28%	0.282	28%	0.276	S	S	.	.			trans	-64.8	155	176	62.9	0	0	0	0	110.8	I665 K727 E728 A729	I665-T725 HydrophobicContact CG2-CG2 4.16Å; T725-K727 PolarHBondContact O-N 3.12Å; T725-K727 VanDerWaalsContact O-N 3.12Å; T725-E728 PolarHBondContact N-OE2 2.95Å; T725-E728 CarbonylContact O-C 3.56Å; T725-E728 WeakPolarHBondContact O-CA 3.34Å; T725-E728 WeakPolarHBondContact O-CB 3.44Å; T725-E728 PolarHBondContact O-N 3.22Å; T725-E728 WeakPolarHBondContact OG1-CB 3.18Å; T725-E728 WeakPolarHBondContact OG1-CG 3.47Å; T725-E728 PolarHBondContact OG1-N 2.87Å; T725-E728 PolarHBondContact OG1-OE2 2.81Å; T725-A729 PolarHBondContact O-N 3.21Å
726	S	84.1	Confident	87.1	Confident	85 Å²	85	51 Å²	51	59%	0.594	28%	0.276	S	S	*	.	H	α-helix	trans	-56.4	-33.8	178.9	-47.9	0	0	0	0	113.1	A729 N730	S726-A729 PolarHBondContact O-N 2.88Å; S726-N730 VanDerWaalsContact O-CG 3.26Å; S726-N730 PolarHBondContact O-N 3.04Å; S726-N730 VanDerWaalsContact O-N 3.09Å; S726-N730 PolarHBondContact O-OD1 3.31Å
727	K	84.3	Confident	87.2	Confident	170 Å²	170	49.7 Å²	49.7	74%	0.739	27%	0.272	S	S	*	.	H	α-helix	trans	-67.2	-37.6	174.7	-173.1	-179.9	178.8	-176.6	0	112.1	T725 G731	T725-K727 PolarHBondContact O-N 3.12Å; T725-K727 VanDerWaalsContact O-N 3.12Å; K727-G731 PolarHBondContact O-N 3.36Å; K727-G731 VanDerWaalsContact O-N 3.12Å
728	E	85	Confident	87.5	Confident	5 Å²	5	50.1 Å²	50.1	2%	0.023	28%	0.28	C	S	.	.	H	α-helix	trans	-72.3	-37.8	175.6	-71.6	165	155.9	0	0	111.6	G666 R668 I724 T725 G731 L732	G666-E728 PolarHBondContact N-OE1 3.46Å; R668-E728 WeakPolarHBondContact CD-OE1 3.29Å; R668-E728 IonicContact NH1-OE2 3.15Å; I724-E728 HydrophobicContact CG2-CB 3.93Å; T725-E728 PolarHBondContact N-OE2 2.95Å; T725-E728 CarbonylContact O-C 3.56Å; T725-E728 WeakPolarHBondContact O-CA 3.34Å; T725-E728 WeakPolarHBondContact O-CB 3.44Å; T725-E728 PolarHBondContact O-N 3.22Å; T725-E728 WeakPolarHBondContact OG1-CB 3.18Å; T725-E728 WeakPolarHBondContact OG1-CG 3.47Å; T725-E728 PolarHBondContact OG1-N 2.87Å; T725-E728 PolarHBondContact OG1-OE2 2.81Å; E728-G731 PolarHBondContact O-N 3.25Å; E728-L732 VanDerWaalsContact O-CB 3.29Å; E728-L732 WeakPolarHBondContact O-CB 3.41Å; E728-L732 WeakPolarHBondContact O-CG 3.33Å; E728-L732 PolarHBondContact O-N 3.2Å
729	A	88.6	Confident	87.6	Confident	2 Å²	2	50.1 Å²	50.1	2%	0.017	28%	0.281	C	S	.	.	H	α-helix	trans	-59.4	-51	175.3	0	0	0	0	0	111	I724 T725 S726 G731 L732 D733 L772 I806	I724-A729 HydrophobicContact CG2-CB 3.94Å; T725-A729 PolarHBondContact O-N 3.21Å; S726-A729 PolarHBondContact O-N 2.88Å; A729-G731 PolarHBondContact O-N 3.47Å; A729-L732 PolarHBondContact O-N 2.91Å; A729-D733 PolarHBondContact O-N 3.3Å; A729-L772 HydrophobicContact CB-CD2 4.35Å; A729-I806 HydrophobicContact CB-CG2 4.35Å
730	N	87	Confident	87.9	Confident	88 Å²	88	49.7 Å²	49.7	47%	0.471	28%	0.278	S	S	.	.	H	α-helix	trans	-60	-46.7	177	-64.9	4.3	0	0	0	111.7	S726 L732 D733 D734	S726-N730 VanDerWaalsContact O-CG 3.26Å; S726-N730 PolarHBondContact O-N 3.04Å; S726-N730 VanDerWaalsContact O-N 3.09Å; S726-N730 PolarHBondContact O-OD1 3.31Å; N730-L732 VanDerWaalsContact C-N 3.3Å; N730-L732 PolarHBondContact O-N 3.39Å; N730-D733 PolarHBondContact O-N 3.33Å; N730-D734 PolarHBondContact O-N 3.3Å
731	G	85.8	Confident	88.1	Confident	14 Å²	14	48.8 Å²	48.8	14%	0.144	28%	0.275	C	S	.	.	H	α-helix	trans	-66.1	-31.2	179.5	0	0	0	0	0	113.9	S669 K727 E728 A729 S735	S669-G731 VanDerWaalsContact OG-CA 3.29Å; S669-G731 WeakPolarHBondContact OG-CA 3.34Å; S669-G731 PolarHBondContact OG-O 3.22Å; K727-G731 PolarHBondContact O-N 3.36Å; K727-G731 VanDerWaalsContact O-N 3.12Å; E728-G731 PolarHBondContact O-N 3.25Å; A729-G731 PolarHBondContact O-N 3.47Å; G731-S735 WeakPolarHBondContact O-CB 3.49Å; G731-S735 PolarHBondContact O-N 2.91Å; G731-S735 PolarHBondContact O-OG 3.34Å
732	L	88.4	Confident	88.4	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	29%	0.293	C	S	.	.	H	α-helix	trans	-70.3	-45.1	171.5	-75.2	173.1	0	0	0	111	C672 L721 I724 E728 A729 N730 D734 S735 L736 L772	C672-L732 HydrophobicContact CB-CD2 3.85Å; C672-L732 WeakPolarHBondContact SG-CD2 3.49Å; L721-L732 HydrophobicContact CD1-CD1 4.4Å; I724-L732 HydrophobicContact CG2-CD1 4.35Å; E728-L732 VanDerWaalsContact O-CB 3.29Å; E728-L732 WeakPolarHBondContact O-CB 3.41Å; E728-L732 WeakPolarHBondContact O-CG 3.33Å; E728-L732 PolarHBondContact O-N 3.2Å; A729-L732 PolarHBondContact O-N 2.91Å; N730-L732 VanDerWaalsContact C-N 3.3Å; N730-L732 PolarHBondContact O-N 3.39Å; L732-D734 VanDerWaalsContact C-N 3.34Å; L732-D734 PolarHBondContact O-N 3.5Å; L732-S735 PolarHBondContact O-N 2.99Å; L732-L736 WeakPolarHBondContact O-CB 3.48Å; L732-L736 WeakPolarHBondContact O-CG 3.43Å; L732-L736 PolarHBondContact O-N 2.88Å; L732-L772 HydrophobicContact CB-CD1 4.06Å
733	D	89.7	Confident	88.7	Confident	20 Å²	20	43.2 Å²	43.2	11%	0.107	25%	0.251	C	S	.	.	H	α-helix	trans	-57.6	-49	176.8	106.8	51.7	0	0	0	110.5	A729 N730 S735 L736 T737 L772	A729-D733 PolarHBondContact O-N 3.3Å; N730-D733 PolarHBondContact O-N 3.33Å; D733-S735 VanDerWaalsContact C-N 3.29Å; D733-S735 PolarHBondContact O-N 3.43Å; D733-L736 PolarHBondContact O-N 2.92Å; D733-T737 VanDerWaalsContact O-CB 3.28Å; D733-T737 WeakPolarHBondContact O-CB 3.25Å; D733-T737 PolarHBondContact O-N 2.92Å; D733-T737 PolarHBondContact O-OG1 3.36Å; D733-L772 HydrophobicContact CB-CB 3.98Å
734	D	89.2	Confident	89	Confident	107 Å²	107	42.1 Å²	42.1	57%	0.572	24%	0.243	S	C	*	.	H	α-helix	trans	-58.2	-45.9	-179	-78.8	-36.6	0	0	0	110.3	N730 L732 A738	N730-D734 PolarHBondContact O-N 3.3Å; L732-D734 VanDerWaalsContact C-N 3.34Å; L732-D734 PolarHBondContact O-N 3.5Å; D734-A738 WeakPolarHBondContact O-CB 3.15Å; D734-A738 PolarHBondContact O-N 2.87Å
735	S	87.8	Confident	88.8	Confident	9 Å²	9	48.7 Å²	48.7	6%	0.063	27%	0.272	C	S	.	.	H	α-helix	trans	-67.7	-40.1	-178.6	-62.9	0	0	0	0	112.6	H673 G731 L732 D733 L739	H673-S735 PolarHBondContact ND1-OG 3.02Å; G731-S735 WeakPolarHBondContact O-CB 3.49Å; G731-S735 PolarHBondContact O-N 2.91Å; G731-S735 PolarHBondContact O-OG 3.34Å; L732-S735 PolarHBondContact O-N 2.99Å; D733-S735 VanDerWaalsContact C-N 3.29Å; D733-S735 PolarHBondContact O-N 3.43Å; S735-L739 WeakPolarHBondContact O-CB 3.43Å; S735-L739 PolarHBondContact O-N 3.32Å
736	L	92	Very high	88.6	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-73.9	-38.4	179.7	-67	179.3	0	0	0	111.5	I676 V714 L732 D733 L739 M740 M765 L768 I769 L772	I676-L736 HydrophobicContact CD1-CD2 3.79Å; V714-L736 HydrophobicContact CG1-CD2 3.4Å; V714-L736 VanDerWaalsContact CG1-CD2 3.4Å; L732-L736 WeakPolarHBondContact O-CB 3.48Å; L732-L736 WeakPolarHBondContact O-CG 3.43Å; L732-L736 PolarHBondContact O-N 2.88Å; D733-L736 PolarHBondContact O-N 2.92Å; L736-L739 PolarHBondContact O-N 3Å; L736-M740 WeakPolarHBondContact O-CG 3.29Å; L736-M740 PolarHBondContact O-N 3.18Å; L736-M765 HydrophobicContact CD1-SD 4.27Å; L736-M765 HydrophobicContact CD2-SD 4.14Å; L736-L768 HydrophobicContact CD1-CD2 4.06Å; L736-L768 HydrophobicContact CD1-CG 4.44Å; L736-I769 HydrophobicContact CB-CD1 3.89Å; L736-I769 HydrophobicContact CB-CG1 3.71Å; L736-I769 HydrophobicContact CD1-CG1 4.39Å; L736-L772 HydrophobicContact CD1-CD1 3.77Å
737	T	93.4	Very high	88.6	Confident	65 Å²	65	43.2 Å²	43.2	40%	0.399	23%	0.234	S	C	.	.	H	α-helix	trans	-61.7	-45.5	173.9	-61.9	0	0	0	0	110.8	D733 M740 A741 I769	D733-T737 VanDerWaalsContact O-CB 3.28Å; D733-T737 WeakPolarHBondContact O-CB 3.25Å; D733-T737 PolarHBondContact O-N 2.92Å; D733-T737 PolarHBondContact O-OG1 3.36Å; T737-M740 PolarHBondContact O-N 2.64Å; T737-A741 PolarHBondContact O-N 3.21Å; T737-I769 WeakPolarHBondContact OG1-CG2 3.49Å
738	A	91	Very high	88	Confident	45 Å²	45	38.2 Å²	38.2	37%	0.372	22%	0.218	S	C	.	.	H	α-helix	trans	-60.2	-46.7	174.4	0	0	0	0	0	111.9	D734 M740 A741 D742	D734-A738 WeakPolarHBondContact O-CB 3.15Å; D734-A738 PolarHBondContact O-N 2.87Å; A738-M740 VanDerWaalsContact C-N 3.33Å; A738-M740 PolarHBondContact O-N 3.34Å; A738-A741 PolarHBondContact O-N 3Å; A738-D742 PolarHBondContact O-N 3.48Å
739	L	91.4	Very high	87.3	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-57.2	-45.2	175.7	172.9	63	0	0	0	112.1	I676 L680 L710 F711 S735 L736 D742 V743	I676-L739 HydrophobicContact CD1-CD2 4.46Å; I676-L739 HydrophobicContact CG2-CB 3.9Å; I676-L739 HydrophobicContact CG2-CD1 3.85Å; I676-L739 HydrophobicContact CG2-CD2 3.78Å; I676-L739 HydrophobicContact CG2-CG 4.03Å; L680-L739 HydrophobicContact CB-CD1 4.37Å; L680-L739 HydrophobicContact CD1-CD1 4.26Å; L710-L739 HydrophobicContact CD2-CD1 4.43Å; F711-L739 HydrophobicContact CD1-CD2 4.34Å; F711-L739 HydrophobicContact CE1-CD2 3.83Å; F711-L739 HydrophobicContact CE1-CG 3.98Å; S735-L739 WeakPolarHBondContact O-CB 3.43Å; S735-L739 PolarHBondContact O-N 3.32Å; L736-L739 PolarHBondContact O-N 3Å; L739-D742 PolarHBondContact O-N 3.48Å; L739-V743 HydrophobicContact CD1-CG2 4.03Å; L739-V743 VanDerWaalsContact O-CG2 3.32Å; L739-V743 WeakPolarHBondContact O-CG2 3.28Å; L739-V743 PolarHBondContact O-N 3.02Å
740	M	93.4	Very high	86	Confident	13 Å²	13	43 Å²	43	6%	0.064	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-44.4	178.1	-72.7	-156.9	67.8	0	0	111.5	F711 L736 T737 A738 D742 V743 E744 W762 M765 K766 I769	F711-M740 HydrophobicContact CE2-CE 4.29Å; F711-M740 HydrophobicContact CE2-CG 4.31Å; F711-M740 HydrophobicContact CZ-CG 4.09Å; L736-M740 WeakPolarHBondContact O-CG 3.29Å; L736-M740 PolarHBondContact O-N 3.18Å; T737-M740 PolarHBondContact O-N 2.64Å; A738-M740 VanDerWaalsContact C-N 3.33Å; A738-M740 PolarHBondContact O-N 3.34Å; M740-D742 PolarHBondContact O-N 3.48Å; M740-V743 PolarHBondContact O-N 3Å; M740-E744 WeakPolarHBondContact O-CB 3.2Å; M740-E744 PolarHBondContact O-N 3.01Å; M740-W762 HydrophobicContact CB-CH2 4.39Å; M740-W762 HydrophobicContact CE-CD2 3.53Å; M740-W762 HydrophobicContact CE-CE3 3.91Å; M740-W762 HydrophobicContact CE-CG 4.1Å; M740-W762 HydrophobicContact CE-CH2 3.81Å; M740-W762 HydrophobicContact CE-CZ2 3.44Å; M740-W762 VanDerWaalsContact CE-CZ2 3.44Å; M740-W762 HydrophobicContact CE-CZ3 4.03Å; M740-W762 VanDerWaalsContact O-CH2 3.31Å; M740-W762 WeakPolarHBondContact O-CH2 3.28Å; M740-M765 HydrophobicContact CE-CB 4.38Å; M740-M765 HydrophobicContact CE-CG 4.48Å; M740-M765 HydrophobicContact CG-CG 3.76Å; M740-M765 HydrophobicContact SD-CB 3.83Å; M740-M765 HydrophobicContact SD-CG 3.43Å; M740-M765 WeakPolarHBondContact SD-CG 3.26Å; M740-K766 HydrophobicContact CE-CD 4.38Å; M740-K766 HydrophobicContact CE-CG 3.54Å; M740-K766 HydrophobicContact SD-CG 3.86Å; M740-I769 HydrophobicContact CG-CD1 3.97Å; M740-I769 HydrophobicContact SD-CD1 3.5Å; M740-I769 WeakPolarHBondContact SD-CD1 3.16Å
741	A	92	Very high	84.9	Confident	54 Å²	54	48.6 Å²	48.6	45%	0.446	27%	0.269	S	S	.	.	H	α-helix	trans	-62.2	-43.6	177.7	0	0	0	0	0	112.2	T737 A738 V743 E744 F745	T737-A741 PolarHBondContact O-N 3.21Å; A738-A741 PolarHBondContact O-N 3Å; A741-V743 PolarHBondContact O-N 3.42Å; A741-E744 PolarHBondContact O-N 3.17Å; A741-F745 PolarHBondContact O-N 3.13Å
742	D	90.2	Very high	84.2	Confident	81 Å²	81	51.5 Å²	51.5	43%	0.433	29%	0.286	S	S	.	.	H	α-helix	trans	-62.5	-42.6	177.7	-75.1	-28.2	0	0	0	111.6	L680 A738 L739 M740 F745 L746	L680-D742 HydrophobicContact CD1-CB 4.01Å; L680-D742 HydrophobicContact CD2-CB 3.74Å; L680-D742 WeakPolarHBondContact CD2-OD2 3.38Å; A738-D742 PolarHBondContact O-N 3.48Å; L739-D742 PolarHBondContact O-N 3.48Å; M740-D742 PolarHBondContact O-N 3.48Å; D742-F745 WeakPolarHBondContact O-CB 3.43Å; D742-F745 PolarHBondContact O-N 3.2Å; D742-L746 WeakPolarHBondContact O-CG 3.31Å
743	V	91	Very high	83.5	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-68.4	-41.8	176.5	174	0	0	0	0	111.3	L680 V707 F711 L739 M740 A741 F745 L746 F747 W762	L680-V743 HydrophobicContact CD1-CG2 4.34Å; V707-V743 HydrophobicContact CB-CG1 4.37Å; V707-V743 HydrophobicContact CG1-CG1 3.71Å; V707-V743 HydrophobicContact CG2-CG1 3.68Å; F711-V743 HydrophobicContact CE1-CG2 4.34Å; F711-V743 HydrophobicContact CZ-CG2 4.39Å; L739-V743 HydrophobicContact CD1-CG2 4.03Å; L739-V743 VanDerWaalsContact O-CG2 3.32Å; L739-V743 WeakPolarHBondContact O-CG2 3.28Å; L739-V743 PolarHBondContact O-N 3.02Å; M740-V743 PolarHBondContact O-N 3Å; A741-V743 PolarHBondContact O-N 3.42Å; V743-F745 VanDerWaalsContact C-N 3.25Å; V743-F745 PolarHBondContact O-N 3.36Å; V743-L746 WeakPolarHBondContact O-CB 3.34Å; V743-L746 PolarHBondContact O-N 3.45Å; V743-F747 HydrophobicContact CG1-CD2 4.28Å; V743-F747 HydrophobicContact CG1-CE2 3.83Å; V743-F747 VanDerWaalsContact O-CD2 3.29Å; V743-F747 WeakPolarHBondContact O-CD2 3.38Å; V743-W762 HydrophobicContact CB-CH2 4.46Å; V743-W762 HydrophobicContact CB-CZ3 4.13Å; V743-W762 HydrophobicContact CG1-CH2 4.39Å; V743-W762 HydrophobicContact CG1-CZ3 3.73Å
744	E	90.3	Very high	83.1	Confident	73 Å²	73	58.1 Å²	58.1	34%	0.341	31%	0.314	S	S	.	.	H	α-helix	trans	-58.6	-39.1	177.3	-174.7	166.4	-158.1	0	0	111.7	M740 A741 L746 F747 P753 P755 W762	M740-E744 WeakPolarHBondContact O-CB 3.2Å; M740-E744 PolarHBondContact O-N 3.01Å; A741-E744 PolarHBondContact O-N 3.17Å; E744-L746 PolarHBondContact O-N 2.77Å; E744-F747 PolarHBondContact O-N 3.15Å; E744-P753 HydrophobicContact CG-CB 4.23Å; E744-P753 HydrophobicContact CG-CG 4.22Å; E744-P755 HydrophobicContact CG-CG 4.23Å; E744-W762 HydrophobicContact CB-CH2 3.82Å; E744-W762 HydrophobicContact CB-CZ2 4.07Å; E744-W762 HydrophobicContact CG-CZ2 4.47Å
745	F	85.7	Confident	82.8	Confident	141 Å²	141	53 Å²	53	62%	0.618	29%	0.287	S	S	*	.	H	α-helix	trans	-58	-29.6	175.8	-176.1	-101.4	0	0	0	112.7	A741 D742 V743 F747 T748	A741-F745 PolarHBondContact O-N 3.13Å; D742-F745 WeakPolarHBondContact O-CB 3.43Å; D742-F745 PolarHBondContact O-N 3.2Å; V743-F745 VanDerWaalsContact C-N 3.25Å; V743-F745 PolarHBondContact O-N 3.36Å; F745-F747 VanDerWaalsContact C-N 3.31Å; F745-F747 PolarHBondContact O-N 3.27Å; F745-T748 HydrophobicContact CD2-CG2 4.04Å; F745-T748 HydrophobicContact CG-CG2 4.48Å; F745-T748 VanDerWaalsContact O-CB 3.29Å; F745-T748 WeakPolarHBondContact O-CB 3.37Å; F745-T748 WeakPolarHBondContact O-CG2 3.29Å; F745-T748 PolarHBondContact O-N 2.63Å; F745-T748 PolarHBondContact O-OG1 3.43Å
746	L	81.4	Confident	82.7	Confident	15 Å²	15	58.2 Å²	58.2	8%	0.079	31%	0.311	C	S	.	.	H	α-helix	trans	-77.8	-17.4	179.2	-57.7	174.8	0	0	0	112.8	L684 H687 Y703 D742 V743 E744	L684-L746 HydrophobicContact CD2-CD1 3.56Å; L684-L746 HydrophobicContact CD2-CD2 3.53Å; L684-L746 HydrophobicContact CD2-CG 4.11Å; L684-L746 HydrophobicContact CG-CD1 4.34Å; H687-L746 PolarHBondContact NE2-O 3.21Å; H687-L746 VanDerWaalsContact NE2-O 3.12Å; Y703-L746 HydrophobicContact CE1-CB 4.13Å; Y703-L746 HydrophobicContact CE1-CD1 4.02Å; Y703-L746 WeakPolarHBondContact OH-CD1 3.36Å; D742-L746 WeakPolarHBondContact O-CG 3.31Å; V743-L746 WeakPolarHBondContact O-CB 3.34Å; V743-L746 PolarHBondContact O-N 3.45Å; E744-L746 PolarHBondContact O-N 2.77Å
747	F	83.1	Confident	82.2	Confident	1 Å²	1	61.4 Å²	61.4	0%	0.004	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	5.7	172.3	-69.1	-89.1	0	0	0	113.6	R700 Y703 V707 V743 E744 F745 S749 E750 P753 P755 Y758	R700-F747 HydrophobicContact CB-CD1 4.47Å; R700-F747 HydrophobicContact CB-CE1 4.29Å; R700-F747 HydrophobicContact CG-CD1 4.19Å; R700-F747 HydrophobicContact CG-CE1 4.43Å; Y703-F747 AromaticContact CD1-CE2 3.96Å; Y703-F747 HydrophobicContact CD1-CE2 3.96Å; Y703-F747 AromaticContact CD1-CZ 3.76Å; Y703-F747 HydrophobicContact CD1-CZ 3.76Å; Y703-F747 HydrophobicContact CE1-CE2 4.32Å; V707-F747 HydrophobicContact CG2-CE2 4.4Å; V743-F747 HydrophobicContact CG1-CD2 4.28Å; V743-F747 HydrophobicContact CG1-CE2 3.83Å; V743-F747 VanDerWaalsContact O-CD2 3.29Å; V743-F747 WeakPolarHBondContact O-CD2 3.38Å; E744-F747 PolarHBondContact O-N 3.15Å; F745-F747 VanDerWaalsContact C-N 3.31Å; F745-F747 PolarHBondContact O-N 3.27Å; F747-S749 PolarHBondContact O-N 3.49Å; F747-E750 PolarHBondContact O-N 3.24Å; F747-E750 VanDerWaalsContact O-N 3.13Å; F747-P753 HydrophobicContact CB-CB 4.5Å; F747-P755 HydrophobicContact CB-CB 4.41Å; F747-P755 HydrophobicContact CD2-CB 3.69Å; F747-P755 HydrophobicContact CE2-CB 4.06Å; F747-P755 HydrophobicContact CG-CB 3.99Å; F747-Y758 HydrophobicContact CD1-CD2 4Å; F747-Y758 AromaticContact CE1-CD2 3.95Å; F747-Y758 HydrophobicContact CE1-CD2 3.95Å; F747-Y758 HydrophobicContact CE1-CG 4.26Å
748	T	72.6	Confident	81.7	Confident	65 Å²	65	59.8 Å²	59.8	40%	0.399	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-8.2	-176.1	52.3	0	0	0	0	116.1	F745 E750	F745-T748 HydrophobicContact CD2-CG2 4.04Å; F745-T748 HydrophobicContact CG-CG2 4.48Å; F745-T748 VanDerWaalsContact O-CB 3.29Å; F745-T748 WeakPolarHBondContact O-CB 3.37Å; F745-T748 WeakPolarHBondContact O-CG2 3.29Å; F745-T748 PolarHBondContact O-N 2.63Å; F745-T748 PolarHBondContact O-OG1 3.43Å; T748-E750 CarbonylContact C-O 3.17Å; T748-E750 PolarHBondContact O-N 2.76Å
749	S	69	Low	81.5	Confident	82 Å²	82	57.7 Å²	57.7	57%	0.573	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.8	169.1	62.1	0	0	0	0	112.5	F747	F747-S749 PolarHBondContact O-N 3.49Å
750	E	61.2	Low	81.4	Confident	26 Å²	26	65.5 Å²	65.5	12%	0.121	34%	0.342	C	S	.	.	S	Bend	trans	-94.8	139.8	167.5	-68.6	-174.4	169.2	0	0	111.2	R700 F747 T748 P752 P753 Y758	R700-E750 IonicContact CZ-OE1 3.33Å; R700-E750 IonicContact NE-OE1 2.7Å; R700-E750 PolarHBondContact NE-OE1 3.41Å; R700-E750 IonicContact NH2-OE1 2.66Å; R700-E750 PolarHBondContact NH2-OE1 3.15Å; F747-E750 PolarHBondContact O-N 3.24Å; F747-E750 VanDerWaalsContact O-N 3.13Å; T748-E750 CarbonylContact C-O 3.17Å; T748-E750 PolarHBondContact O-N 2.76Å; E750-P752 CarbonylContact C-O 3.42Å; E750-P752 CarbonylContact O-C 3.54Å; E750-P753 WeakPolarHBondContact O-CA 3.39Å; E750-P753 VanDerWaalsContact O-N 3.08Å; E750-Y758 PolarHBondContact OE1-OH 3.04Å
751	K	64.6	Low	81.4	Confident	204 Å²	204	65.5 Å²	65.5	89%	0.887	34%	0.343	S	S	*	.	S	Bend	trans	-118.5	111.3	174	-70.6	-174.2	179.5	-179.1	0	109.5
752	P	72.1	Confident	81.5	Confident	76 Å²	76	63 Å²	63	49%	0.494	32%	0.322	S	S	.	.	S	Bend	cis	-72.1	158.4	-6	32.1	-35	0	0	0	112.2	E750 R754	E750-P752 CarbonylContact C-O 3.42Å; E750-P752 CarbonylContact O-C 3.54Å; P752-R754 PolarHBondContact O-N 3.28Å
753	P	72	Confident	81.7	Confident	43 Å²	43	66.7 Å²	66.7	28%	0.279	33%	0.33	S	S	.	.			trans	-61.7	130.8	172.6	24.2	-31.5	0	0	0	109.9	E744 F747 E750 P755	E744-P753 HydrophobicContact CG-CB 4.23Å; E744-P753 HydrophobicContact CG-CG 4.22Å; F747-P753 HydrophobicContact CB-CB 4.5Å; E750-P753 WeakPolarHBondContact O-CA 3.39Å; E750-P753 VanDerWaalsContact O-N 3.08Å; P753-P755 VanDerWaalsContact C-CD 3.43Å
754	R	81.4	Confident	81.9	Confident	118 Å²	118	69.5 Å²	69.5	45%	0.445	34%	0.341	S	S	.	.			trans	-127.7	63.5	-179.7	-66.6	178.5	-174.7	174.8	2.3	111.5	P752 E756 A757	P752-R754 PolarHBondContact O-N 3.28Å; R754-E756 PolarHBondContact O-N 3.18Å; R754-E756 VanDerWaalsContact O-N 3.16Å; R754-A757 HydrophobicContact CB-CB 4.36Å; R754-A757 WeakPolarHBondContact O-CB 3.44Å; R754-A757 PolarHBondContact O-N 3.21Å
755	P	83.3	Confident	82.2	Confident	1 Å²	1	66 Å²	66	1%	0.006	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-56.9	-31.4	178.3	23.5	-34.2	0	0	0	112.7	E744 F747 P753 A757 Y758 C759 W762	E744-P755 HydrophobicContact CG-CG 4.23Å; F747-P755 HydrophobicContact CB-CB 4.41Å; F747-P755 HydrophobicContact CD2-CB 3.69Å; F747-P755 HydrophobicContact CE2-CB 4.06Å; F747-P755 HydrophobicContact CG-CB 3.99Å; P753-P755 VanDerWaalsContact C-CD 3.43Å; P755-A757 PolarHBondContact O-N 2.92Å; P755-A757 VanDerWaalsContact O-N 3.16Å; P755-Y758 PolarHBondContact O-N 3.49Å; P755-C759 PolarHBondContact O-N 3.06Å; P755-W762 HydrophobicContact CB-CD2 3.93Å; P755-W762 HydrophobicContact CB-CE3 3.82Å; P755-W762 HydrophobicContact CB-CH2 3.92Å; P755-W762 HydrophobicContact CB-CZ2 4.01Å; P755-W762 HydrophobicContact CB-CZ3 3.82Å; P755-W762 HydrophobicContact CG-CD2 3.86Å; P755-W762 HydrophobicContact CG-CE3 4.15Å; P755-W762 HydrophobicContact CG-CH2 3.64Å; P755-W762 HydrophobicContact CG-CZ2 3.29Å; P755-W762 HydrophobicContact CG-CZ3 4.05Å
756	E	85.2	Confident	82.7	Confident	118 Å²	118	63.6 Å²	63.6	55%	0.551	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-60.5	-17.4	174.9	57.8	-160.8	-148.7	0	0	115.3	R754 Y758 W762	R754-E756 PolarHBondContact O-N 3.18Å; R754-E756 VanDerWaalsContact O-N 3.16Å; E756-Y758 VanDerWaalsContact C-N 3.3Å; E756-W762 HydrophobicContact CB-CB 4.36Å; E756-W762 HydrophobicContact CB-CG 4.18Å
757	A	81.8	Confident	83.4	Confident	67 Å²	67	63.3 Å²	63.3	55%	0.554	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-77	-18.8	172.1	0	0	0	0	0	112.9	R754 P755	R754-A757 HydrophobicContact CB-CB 4.36Å; R754-A757 WeakPolarHBondContact O-CB 3.44Å; R754-A757 PolarHBondContact O-N 3.21Å; P755-A757 PolarHBondContact O-N 2.92Å; P755-A757 VanDerWaalsContact O-N 3.16Å
758	Y	82.6	Confident	84	Confident	30 Å²	30	63.3 Å²	63.3	12%	0.118	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	-19.3	-173	-54.7	-73.8	0	0	0	113.3	R700 V701 G704 F747 E750 P755 E756	R700-Y758 HydrophobicContact CB-CD1 4.13Å; R700-Y758 HydrophobicContact CB-CD2 4.19Å; R700-Y758 HydrophobicContact CB-CE1 3.99Å; R700-Y758 HydrophobicContact CB-CE2 4.07Å; R700-Y758 HydrophobicContact CB-CG 4.22Å; R700-Y758 PolarHBondContact NE-OH 3.15Å; R700-Y758 VanDerWaalsContact NE-OH 3.17Å; V701-Y758 HydrophobicContact CG2-CD1 3.77Å; V701-Y758 HydrophobicContact CG2-CE1 3.92Å; G704-Y758 CarbonylContact C-O 3.42Å; G704-Y758 WeakPolarHBondContact CA-O 3.35Å; F747-Y758 HydrophobicContact CD1-CD2 4Å; F747-Y758 AromaticContact CE1-CD2 3.95Å; F747-Y758 HydrophobicContact CE1-CD2 3.95Å; F747-Y758 HydrophobicContact CE1-CG 4.26Å; E750-Y758 PolarHBondContact OE1-OH 3.04Å; P755-Y758 PolarHBondContact O-N 3.49Å; E756-Y758 VanDerWaalsContact C-N 3.3Å
759	C	88.4	Confident	85.1	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.014	30%	0.297	C	S	.	.			trans	-122.1	106.2	179.5	176.7	0	0	0	0	109.6	V707 P755 T761 W762	V707-C759 HydrophobicContact CG1-CB 4.34Å; P755-C759 PolarHBondContact O-N 3.06Å; C759-T761 VanDerWaalsContact C-N 3.28Å; C759-T761 PolarHBondContact O-N 3.44Å; C759-W762 HydrophobicContact CB-CB 4.22Å; C759-W762 WeakPolarHBondContact O-CB 3.49Å; C759-W762 PolarHBondContact O-N 2.88Å; C759-W762 PolarHBondContact SG-N 2.89Å
760	H	87.9	Confident	86.4	Confident	165 Å²	165	58.5 Å²	58.5	76%	0.764	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-32.8	-178.3	-63.6	90.2	0	0	0	111.7	D708 W762	D708-H760 PolarHBondContact OD1-N 3.38Å; H760-W762 PolarHBondContact O-N 3.07Å
761	T	92.9	Very high	88.1	Confident	13 Å²	13	57.3 Å²	57.3	8%	0.08	27%	0.27	C	S	.	.	H	α-helix	trans	-76.1	-6.4	-179.4	-40.1	0	0	0	0	112.6	D708 F711 T712 I715 C759 R763 R764 M765	D708-T761 VanDerWaalsContact OD1-CB 3.25Å; D708-T761 WeakPolarHBondContact OD1-CB 3.06Å; D708-T761 PolarHBondContact OD1-N 2.75Å; D708-T761 PolarHBondContact OD1-OG1 3.49Å; F711-T761 HydrophobicContact CB-CG2 3.88Å; T712-T761 PolarHBondContact OG1-OG1 3.17Å; I715-T761 HydrophobicContact CD1-CG2 3.39Å; C759-T761 VanDerWaalsContact C-N 3.28Å; C759-T761 PolarHBondContact O-N 3.44Å; T761-R763 PolarHBondContact O-N 3.02Å; T761-R764 HydrophobicContact CG2-CB 4.15Å; T761-R764 WeakPolarHBondContact O-CB 3.29Å; T761-R764 PolarHBondContact O-N 3.45Å; T761-M765 PolarHBondContact O-N 3.01Å
762	W	94.7	Very high	89.4	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.008	23%	0.229	C	C	.	.	H	α-helix	trans	-55.3	-50.4	-180	-171.6	-99.3	0	0	0	112.8	F711 M740 V743 E744 P755 E756 C759 H760 R764 M765 K766	F711-W762 HydrophobicContact CD2-CE3 4.38Å; F711-W762 HydrophobicContact CE2-CD2 4.35Å; F711-W762 AromaticContact CE2-CE3 3.45Å; F711-W762 HydrophobicContact CE2-CE3 3.45Å; F711-W762 VanDerWaalsContact CE2-CE3 3.45Å; F711-W762 AromaticContact CE2-CZ3 3.71Å; F711-W762 HydrophobicContact CE2-CZ3 3.71Å; F711-W762 HydrophobicContact CZ-CE3 4.09Å; F711-W762 AromaticContact CZ-CZ3 3.85Å; F711-W762 HydrophobicContact CZ-CZ3 3.85Å; M740-W762 HydrophobicContact CB-CH2 4.39Å; M740-W762 HydrophobicContact CE-CD2 3.53Å; M740-W762 HydrophobicContact CE-CE3 3.91Å; M740-W762 HydrophobicContact CE-CG 4.1Å; M740-W762 HydrophobicContact CE-CH2 3.81Å; M740-W762 HydrophobicContact CE-CZ2 3.44Å; M740-W762 VanDerWaalsContact CE-CZ2 3.44Å; M740-W762 HydrophobicContact CE-CZ3 4.03Å; M740-W762 VanDerWaalsContact O-CH2 3.31Å; M740-W762 WeakPolarHBondContact O-CH2 3.28Å; V743-W762 HydrophobicContact CB-CH2 4.46Å; V743-W762 HydrophobicContact CB-CZ3 4.13Å; V743-W762 HydrophobicContact CG1-CH2 4.39Å; V743-W762 HydrophobicContact CG1-CZ3 3.73Å; E744-W762 HydrophobicContact CB-CH2 3.82Å; E744-W762 HydrophobicContact CB-CZ2 4.07Å; E744-W762 HydrophobicContact CG-CZ2 4.47Å; P755-W762 HydrophobicContact CB-CD2 3.93Å; P755-W762 HydrophobicContact CB-CE3 3.82Å; P755-W762 HydrophobicContact CB-CH2 3.92Å; P755-W762 HydrophobicContact CB-CZ2 4.01Å; P755-W762 HydrophobicContact CB-CZ3 3.82Å; P755-W762 HydrophobicContact CG-CD2 3.86Å; P755-W762 HydrophobicContact CG-CE3 4.15Å; P755-W762 HydrophobicContact CG-CH2 3.64Å; P755-W762 HydrophobicContact CG-CZ2 3.29Å; P755-W762 HydrophobicContact CG-CZ3 4.05Å; E756-W762 HydrophobicContact CB-CB 4.36Å; E756-W762 HydrophobicContact CB-CG 4.18Å; C759-W762 HydrophobicContact CB-CB 4.22Å; C759-W762 WeakPolarHBondContact O-CB 3.49Å; C759-W762 PolarHBondContact O-N 2.88Å; C759-W762 PolarHBondContact SG-N 2.89Å; H760-W762 PolarHBondContact O-N 3.07Å; W762-R764 VanDerWaalsContact C-N 3.33Å; W762-R764 PolarHBondContact O-N 3.35Å; W762-M765 PolarHBondContact O-N 3.35Å; W762-K766 VanDerWaalsContact NE1-CE 3.31Å; W762-K766 PolarHBondContact O-N 3.11Å; W762-K766 VanDerWaalsContact O-N 3.15Å
763	R	94	Very high	90.4	Very high	159 Å²	159	50.4 Å²	50.4	60%	0.6	24%	0.235	S	C	*	.	H	α-helix	trans	-63.4	-42.1	178.5	-170.8	-177.2	-66.3	160.6	1.4	110.9	T761 M765 K766 E767	T761-R763 PolarHBondContact O-N 3.02Å; R763-M765 VanDerWaalsContact C-N 3.28Å; R763-M765 PolarHBondContact O-N 2.98Å; R763-K766 WeakPolarHBondContact O-CB 3.18Å; R763-K766 PolarHBondContact O-N 3.32Å; R763-K766 VanDerWaalsContact O-N 3.15Å; R763-E767 WeakPolarHBondContact O-CG 3.39Å; R763-E767 PolarHBondContact O-N 2.97Å
764	R	95.9	Very high	91.5	Very high	59 Å²	59	50.8 Å²	50.8	22%	0.223	23%	0.234	C	C	.	.	H	α-helix	trans	-61.3	-37.2	179.1	-163.9	177.2	-174.5	-177	0.8	112.2	I715 T761 W762 E767 L768 C793 F794 E798	I715-R764 HydrophobicContact CD1-CB 4.07Å; I715-R764 HydrophobicContact CD1-CG 3.94Å; T761-R764 HydrophobicContact CG2-CB 4.15Å; T761-R764 WeakPolarHBondContact O-CB 3.29Å; T761-R764 PolarHBondContact O-N 3.45Å; W762-R764 VanDerWaalsContact C-N 3.33Å; W762-R764 PolarHBondContact O-N 3.35Å; R764-E767 PolarHBondContact O-N 3.18Å; R764-L768 PolarHBondContact O-N 3.31Å; R764-C793 HydrophobicContact CB-CB 4.39Å; R764-C793 HydrophobicContact CG-CB 4.19Å; R764-C793 PolarHBondContact NE-O 2.91Å; R764-C793 VanDerWaalsContact NE-O 3.11Å; R764-F794 HydrophobicContact CG-CE1 4.16Å; R764-F794 HydrophobicContact CG-CE2 4.15Å; R764-F794 HydrophobicContact CG-CZ 3.78Å; R764-E798 IonicContact CZ-OE1 3.5Å; R764-E798 IonicContact NH2-OE1 3.48Å; R764-E798 PolarHBondContact NH2-OE1 3.31Å; R764-E798 IonicContact NH2-OE2 3.5Å; R764-E798 PolarHBondContact NH2-OE2 2.94Å
765	M	95.9	Very high	92	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.7	-45	173.5	-171.3	64.2	78.4	0	0	112	F711 V714 I715 L736 M740 T761 W762 R763 E767 L768 I769	F711-M765 HydrophobicContact CB-CE 3.68Å; F711-M765 HydrophobicContact CD1-CE 3.74Å; F711-M765 HydrophobicContact CD2-CB 3.78Å; F711-M765 HydrophobicContact CD2-CE 4.04Å; F711-M765 HydrophobicContact CD2-CG 4.13Å; F711-M765 HydrophobicContact CE1-CE 4.35Å; F711-M765 HydrophobicContact CE2-CB 4.02Å; F711-M765 HydrophobicContact CE2-CG 4.11Å; F711-M765 HydrophobicContact CG-CB 4.47Å; F711-M765 HydrophobicContact CG-CE 3.56Å; V714-M765 HydrophobicContact CB-CE 3.99Å; V714-M765 HydrophobicContact CG1-CE 3.85Å; I715-M765 HydrophobicContact CD1-CB 4.39Å; I715-M765 HydrophobicContact CD1-CE 4.17Å; I715-M765 HydrophobicContact CD1-SD 4.49Å; I715-M765 HydrophobicContact CG1-CE 3.91Å; I715-M765 HydrophobicContact CG1-SD 4.1Å; L736-M765 HydrophobicContact CD1-SD 4.27Å; L736-M765 HydrophobicContact CD2-SD 4.14Å; M740-M765 HydrophobicContact CE-CB 4.38Å; M740-M765 HydrophobicContact CE-CG 4.48Å; M740-M765 HydrophobicContact CG-CG 3.76Å; M740-M765 HydrophobicContact SD-CB 3.83Å; M740-M765 HydrophobicContact SD-CG 3.43Å; M740-M765 WeakPolarHBondContact SD-CG 3.26Å; T761-M765 PolarHBondContact O-N 3.01Å; W762-M765 PolarHBondContact O-N 3.35Å; R763-M765 VanDerWaalsContact C-N 3.28Å; R763-M765 PolarHBondContact O-N 2.98Å; M765-E767 VanDerWaalsContact C-N 3.27Å; M765-E767 PolarHBondContact O-N 3.49Å; M765-L768 WeakPolarHBondContact O-CB 3.27Å; M765-L768 PolarHBondContact O-N 3.15Å; M765-L768 VanDerWaalsContact O-N 3.11Å; M765-L768 HydrophobicContact SD-CD2 4.24Å; M765-I769 HydrophobicContact CG-CD1 4.33Å; M765-I769 WeakPolarHBondContact O-CG1 3.45Å; M765-I769 PolarHBondContact O-N 3.33Å
766	K	96.2	Very high	92.5	Very high	90 Å²	90	50 Å²	50	39%	0.391	24%	0.239	S	C	.	.	H	α-helix	trans	-57	-43	175	-71.7	-172.8	170.9	175.8	0	111.9	M740 W762 R763 I769 F770	M740-K766 HydrophobicContact CE-CD 4.38Å; M740-K766 HydrophobicContact CE-CG 3.54Å; M740-K766 HydrophobicContact SD-CG 3.86Å; W762-K766 VanDerWaalsContact NE1-CE 3.31Å; W762-K766 PolarHBondContact O-N 3.11Å; W762-K766 VanDerWaalsContact O-N 3.15Å; R763-K766 WeakPolarHBondContact O-CB 3.18Å; R763-K766 PolarHBondContact O-N 3.32Å; R763-K766 VanDerWaalsContact O-N 3.15Å; K766-I769 PolarHBondContact O-N 3.09Å; K766-F770 PolarHBondContact O-N 3.41Å
767	E	96.6	Very high	92.9	Very high	9 Å²	9	50.3 Å²	50.3	4%	0.042	24%	0.239	C	C	.	.	H	α-helix	trans	-70.3	-31.4	178.4	-65.2	-50.8	134.1	0	0	112.3	R763 R764 M765 F770 V771 R782 L790 C793 F794	R763-E767 WeakPolarHBondContact O-CG 3.39Å; R763-E767 PolarHBondContact O-N 2.97Å; R764-E767 PolarHBondContact O-N 3.18Å; M765-E767 VanDerWaalsContact C-N 3.27Å; M765-E767 PolarHBondContact O-N 3.49Å; E767-F770 PolarHBondContact O-N 3.47Å; E767-V771 WeakPolarHBondContact O-CG2 3.49Å; E767-V771 PolarHBondContact O-N 2.99Å; E767-R782 IonicContact OE1-CZ 2.91Å; E767-R782 IonicContact OE1-NE 2.77Å; E767-R782 PolarHBondContact OE1-NE 3.1Å; E767-R782 IonicContact OE1-NH2 2.59Å; E767-R782 PolarHBondContact OE1-NH2 3.34Å; E767-R782 IonicContact OE2-CZ 3.54Å; E767-R782 IonicContact OE2-NE 3.49Å; E767-R782 PolarHBondContact OE2-NE 3.02Å; E767-R782 IonicContact OE2-NH2 2.73Å; E767-R782 PolarHBondContact OE2-NH2 3.36Å; E767-L790 HydrophobicContact CB-CD2 3.91Å; E767-C793 HydrophobicContact CB-CB 4.22Å; E767-C793 HydrophobicContact CG-CB 4.08Å; E767-F794 HydrophobicContact CB-CD2 4.31Å; E767-F794 HydrophobicContact CB-CE2 3.77Å
768	L	96.2	Very high	93.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-48.6	171.4	-179.6	58.6	0	0	0	111.5	I715 V718 L736 R764 M765 F770 V771 L772 F794 L802	I715-L768 HydrophobicContact CB-CD2 4.34Å; I715-L768 HydrophobicContact CG1-CD2 3.79Å; V718-L768 HydrophobicContact CB-CD2 4.11Å; V718-L768 HydrophobicContact CG1-CD1 3.99Å; V718-L768 HydrophobicContact CG1-CD2 4.21Å; V718-L768 HydrophobicContact CG2-CD2 4.25Å; L736-L768 HydrophobicContact CD1-CD2 4.06Å; L736-L768 HydrophobicContact CD1-CG 4.44Å; R764-L768 PolarHBondContact O-N 3.31Å; M765-L768 WeakPolarHBondContact O-CB 3.27Å; M765-L768 PolarHBondContact O-N 3.15Å; M765-L768 VanDerWaalsContact O-N 3.11Å; M765-L768 HydrophobicContact SD-CD2 4.24Å; L768-F770 VanDerWaalsContact C-N 3.28Å; L768-F770 PolarHBondContact O-N 3.01Å; L768-V771 PolarHBondContact O-N 3.47Å; L768-V771 VanDerWaalsContact O-N 3.1Å; L768-L772 HydrophobicContact CG-CD1 4.19Å; L768-L772 WeakPolarHBondContact O-CG 3.46Å; L768-L772 PolarHBondContact O-N 3.09Å; L768-L772 VanDerWaalsContact O-N 3.1Å; L768-F794 HydrophobicContact CB-CZ 3.99Å; L768-F794 HydrophobicContact CD1-CZ 4.44Å; L768-L802 HydrophobicContact CD1-CD1 4.3Å; L768-L802 HydrophobicContact CD1-CD2 3.63Å
769	I	95.7	Very high	94.1	Very high	15 Å²	15	46.2 Å²	46.2	8%	0.077	21%	0.212	C	C	.	.	H	α-helix	trans	-57.7	-45.1	177.6	-66.8	167.7	0	0	0	109.9	L736 T737 M740 M765 K766 V771 L772 E773	L736-I769 HydrophobicContact CB-CD1 3.89Å; L736-I769 HydrophobicContact CB-CG1 3.71Å; L736-I769 HydrophobicContact CD1-CG1 4.39Å; T737-I769 WeakPolarHBondContact OG1-CG2 3.49Å; M740-I769 HydrophobicContact CG-CD1 3.97Å; M740-I769 HydrophobicContact SD-CD1 3.5Å; M740-I769 WeakPolarHBondContact SD-CD1 3.16Å; M765-I769 HydrophobicContact CG-CD1 4.33Å; M765-I769 WeakPolarHBondContact O-CG1 3.45Å; M765-I769 PolarHBondContact O-N 3.33Å; K766-I769 PolarHBondContact O-N 3.09Å; I769-V771 VanDerWaalsContact C-N 3.28Å; I769-V771 PolarHBondContact O-N 3.1Å; I769-L772 PolarHBondContact O-N 3.1Å; I769-L772 VanDerWaalsContact O-N 3.09Å; I769-E773 PolarHBondContact O-N 3.41Å
770	F	96.6	Very high	94.3	Very high	32 Å²	32	49.1 Å²	49.1	14%	0.14	23%	0.225	C	C	.	.	H	α-helix	trans	-55.3	-42.5	175.8	178.4	-87.1	0	0	0	112.5	K766 E767 L768 L772 N774 I779 R782 L790	K766-F770 PolarHBondContact O-N 3.41Å; E767-F770 PolarHBondContact O-N 3.47Å; L768-F770 VanDerWaalsContact C-N 3.28Å; L768-F770 PolarHBondContact O-N 3.01Å; F770-L772 VanDerWaalsContact C-N 3.35Å; F770-N774 HydrophobicContact CD1-CB 4.4Å; F770-N774 HydrophobicContact CE1-CB 4.03Å; F770-N774 HydrophobicContact CE2-CB 4.35Å; F770-N774 VanDerWaalsContact CE2-ND2 3.34Å; F770-N774 WeakPolarHBondContact CE2-ND2 3.32Å; F770-N774 HydrophobicContact CZ-CB 4.02Å; F770-N774 WeakPolarHBondContact CZ-ND2 3.35Å; F770-N774 WeakPolarHBondContact O-CB 3.42Å; F770-N774 PolarHBondContact O-N 3.03Å; F770-I779 HydrophobicContact CE1-CG1 4.4Å; F770-R782 HydrophobicContact CD1-CB 4.46Å; F770-R782 HydrophobicContact CD1-CG 4.47Å; F770-R782 VanDerWaalsContact CD2-NH1 3.28Å; F770-R782 HydrophobicContact CE1-CB 3.66Å; F770-R782 HydrophobicContact CE1-CG 4.07Å; F770-R782 HydrophobicContact CZ-CB 3.84Å; F770-R782 HydrophobicContact CZ-CG 4.23Å; F770-L790 HydrophobicContact CD1-CD1 4.23Å; F770-L790 HydrophobicContact CE1-CD1 4.23Å
771	V	95.9	Very high	94.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-69.4	-34	179.7	176.8	0	0	0	0	112	E767 L768 I769 I779 L790 L799 L802 I806	E767-V771 WeakPolarHBondContact O-CG2 3.49Å; E767-V771 PolarHBondContact O-N 2.99Å; L768-V771 PolarHBondContact O-N 3.47Å; L768-V771 VanDerWaalsContact O-N 3.1Å; I769-V771 VanDerWaalsContact C-N 3.28Å; I769-V771 PolarHBondContact O-N 3.1Å; V771-I779 HydrophobicContact CG1-CD1 3.93Å; V771-I779 HydrophobicContact CG1-CG1 4.43Å; V771-L790 HydrophobicContact CG2-CD1 4.21Å; V771-L790 HydrophobicContact CG2-CD2 3.48Å; V771-L790 VanDerWaalsContact CG2-CD2 3.48Å; V771-L799 HydrophobicContact CG1-CD1 4.37Å; V771-L799 HydrophobicContact CG2-CD1 4.02Å; V771-L802 HydrophobicContact CB-CD2 3.83Å; V771-L802 HydrophobicContact CG1-CD2 3.43Å; V771-L802 VanDerWaalsContact CG1-CD2 3.43Å; V771-L802 HydrophobicContact CG1-CG 3.76Å; V771-L802 HydrophobicContact CG2-CD2 4.32Å; V771-I806 HydrophobicContact CG1-CD1 3.94Å
772	L	92.7	Very high	94.7	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-69.7	-36.9	177.7	-68.2	167.3	0	0	0	112.4	A729 L732 D733 L736 L768 I769 F770 I806	A729-L772 HydrophobicContact CB-CD2 4.35Å; L732-L772 HydrophobicContact CB-CD1 4.06Å; D733-L772 HydrophobicContact CB-CB 3.98Å; L736-L772 HydrophobicContact CD1-CD1 3.77Å; L768-L772 HydrophobicContact CG-CD1 4.19Å; L768-L772 WeakPolarHBondContact O-CG 3.46Å; L768-L772 PolarHBondContact O-N 3.09Å; L768-L772 VanDerWaalsContact O-N 3.1Å; I769-L772 PolarHBondContact O-N 3.1Å; I769-L772 VanDerWaalsContact O-N 3.09Å; F770-L772 VanDerWaalsContact C-N 3.35Å; L772-I806 HydrophobicContact CD2-CD1 3.8Å; L772-I806 HydrophobicContact CD2-CG1 4.36Å
773	E	93.3	Very high	94.7	Very high	130 Å²	130	51.1 Å²	51.1	61%	0.607	23%	0.23	S	C	*	.	H	α-helix	trans	-84.8	-29.8	-176	-169.8	-169.7	171.4	0	0	113.1	I769	I769-E773 PolarHBondContact O-N 3.41Å
774	N	93.6	Very high	94.6	Very high	52 Å²	52	48.1 Å²	48.1	28%	0.278	23%	0.226	S	C	.	.	S	Bend	trans	-95.7	169.2	-167.7	-142.5	-65.9	0	0	0	113.9	F770 G778 I779 F807	F770-N774 HydrophobicContact CD1-CB 4.4Å; F770-N774 HydrophobicContact CE1-CB 4.03Å; F770-N774 HydrophobicContact CE2-CB 4.35Å; F770-N774 VanDerWaalsContact CE2-ND2 3.34Å; F770-N774 WeakPolarHBondContact CE2-ND2 3.32Å; F770-N774 HydrophobicContact CZ-CB 4.02Å; F770-N774 WeakPolarHBondContact CZ-ND2 3.35Å; F770-N774 WeakPolarHBondContact O-CB 3.42Å; F770-N774 PolarHBondContact O-N 3.03Å; N774-G778 WeakPolarHBondContact OD1-CA 3.47Å; N774-I779 HydrophobicContact CB-CG1 4.41Å; N774-F807 WeakPolarHBondContact O-CZ 3.44Å
775	N	93.8	Very high	94.2	Very high	93 Å²	93	48.6 Å²	48.6	50%	0.497	24%	0.242	S	C	.	.			trans	-93.3	169	175.5	66.4	46.9	0	0	0	111.9	K777 G778 I779	N775-K777 PolarHBondContact O-N 3.27Å; N775-K777 VanDerWaalsContact O-N 3.12Å; N775-K777 WeakPolarHBondContact OD1-CB 3.42Å; N775-K777 PolarHBondContact OD1-N 3.44Å; N775-G778 PolarHBondContact O-N 3.01Å; N775-G778 VanDerWaalsContact O-N 3.15Å; N775-G778 PolarHBondContact OD1-N 3.1Å; N775-I779 WeakPolarHBondContact O-CG1 3.29Å; N775-I779 PolarHBondContact O-N 3.15Å
776	L	93.7	Very high	93.8	Very high	9 Å²	9	49.9 Å²	49.9	5%	0.047	26%	0.256	C	S	.	.	H	α-helix	trans	-52.6	-35.8	-179.6	-75.2	173.3	0	0	0	114.1	E780 I803 F807 Q812 R813 V816	L776-E780 WeakPolarHBondContact O-CB 3.43Å; L776-E780 PolarHBondContact O-N 3.11Å; L776-I803 HydrophobicContact CD2-CG2 3.7Å; L776-F807 HydrophobicContact CD1-CB 4.48Å; L776-F807 HydrophobicContact CD1-CD1 4.26Å; L776-F807 HydrophobicContact CD1-CG 4.31Å; L776-F807 HydrophobicContact CD2-CB 4.31Å; L776-F807 HydrophobicContact CD2-CD1 4.19Å; L776-F807 HydrophobicContact CD2-CD2 3.6Å; L776-F807 HydrophobicContact CD2-CE1 4.45Å; L776-F807 HydrophobicContact CD2-CE2 3.9Å; L776-F807 HydrophobicContact CD2-CG 3.76Å; L776-F807 HydrophobicContact CD2-CZ 4.31Å; L776-F807 HydrophobicContact CG-CD1 3.79Å; L776-F807 HydrophobicContact CG-CD2 4.12Å; L776-F807 HydrophobicContact CG-CE1 3.97Å; L776-F807 HydrophobicContact CG-CE2 4.29Å; L776-F807 HydrophobicContact CG-CG 3.86Å; L776-F807 HydrophobicContact CG-CZ 4.22Å; L776-Q812 HydrophobicContact CD1-CB 4.43Å; L776-Q812 HydrophobicContact CD1-CG 4.13Å; L776-R813 HydrophobicContact CD1-CB 3.99Å; L776-V816 HydrophobicContact CB-CG2 4.31Å
777	K	93	Very high	93.5	Very high	125 Å²	125	52.1 Å²	52.1	54%	0.543	27%	0.272	S	S	.	.	H	α-helix	trans	-70.6	-47.1	-179.4	-176.7	-178.4	172.3	-174.7	0	110.9	N775 I779 E780 E781	N775-K777 PolarHBondContact O-N 3.27Å; N775-K777 VanDerWaalsContact O-N 3.12Å; N775-K777 WeakPolarHBondContact OD1-CB 3.42Å; N775-K777 PolarHBondContact OD1-N 3.44Å; K777-I779 VanDerWaalsContact C-N 3.3Å; K777-I779 PolarHBondContact O-N 3.16Å; K777-E780 PolarHBondContact O-N 3.47Å; K777-E781 WeakPolarHBondContact CE-OE1 3.42Å; K777-E781 IonicContact NZ-OE1 3.98Å; K777-E781 WeakPolarHBondContact O-CG 3.39Å; K777-E781 PolarHBondContact O-N 3.25Å
778	G	94.6	Very high	93.3	Very high	10 Å²	10	52 Å²	52	10%	0.103	27%	0.273	C	S	.	.	H	α-helix	trans	-65	-34.3	177.2	0	0	0	0	0	112.8	N774 N775 E781 R782	N774-G778 WeakPolarHBondContact OD1-CA 3.47Å; N775-G778 PolarHBondContact O-N 3.01Å; N775-G778 VanDerWaalsContact O-N 3.15Å; N775-G778 PolarHBondContact OD1-N 3.1Å; G778-E781 PolarHBondContact O-N 3.34Å; G778-R782 WeakPolarHBondContact O-CB 3.49Å; G778-R782 PolarHBondContact O-N 3.3Å
779	I	95.2	Very high	93.1	Very high	1 Å²	1	55 Å²	55	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-44.9	172.4	-64.3	162.7	0	0	0	111	F770 V771 N774 N775 K777 R782 W783 L790 L799 I803 F807	F770-I779 HydrophobicContact CE1-CG1 4.4Å; V771-I779 HydrophobicContact CG1-CD1 3.93Å; V771-I779 HydrophobicContact CG1-CG1 4.43Å; N774-I779 HydrophobicContact CB-CG1 4.41Å; N775-I779 WeakPolarHBondContact O-CG1 3.29Å; N775-I779 PolarHBondContact O-N 3.15Å; K777-I779 VanDerWaalsContact C-N 3.3Å; K777-I779 PolarHBondContact O-N 3.16Å; I779-R782 PolarHBondContact O-N 3.01Å; I779-W783 WeakPolarHBondContact O-CB 3.37Å; I779-W783 PolarHBondContact O-N 3Å; I779-L790 HydrophobicContact CG2-CD1 4.1Å; I779-L799 HydrophobicContact CG2-CD1 4.07Å; I779-L799 HydrophobicContact CG2-CD2 4.43Å; I779-I803 HydrophobicContact CG2-CD1 4.04Å; I779-I803 HydrophobicContact CG2-CG1 4.43Å; I779-F807 HydrophobicContact CD1-CE2 3.54Å; I779-F807 HydrophobicContact CD1-CZ 3.71Å
780	E	93.2	Very high	93	Very high	63 Å²	63	54.3 Å²	54.3	29%	0.294	29%	0.289	S	S	.	.	H	α-helix	trans	-61.1	-45.1	176.5	-166	-166.4	147.6	0	0	111.6	L776 K777 W783 N784 V816 K819	L776-E780 WeakPolarHBondContact O-CB 3.43Å; L776-E780 PolarHBondContact O-N 3.11Å; K777-E780 PolarHBondContact O-N 3.47Å; E780-W783 WeakPolarHBondContact O-CB 3.31Å; E780-W783 PolarHBondContact O-N 3.22Å; E780-N784 PolarHBondContact O-N 3.45Å; E780-N784 VanDerWaalsContact O-N 3.09Å; E780-V816 HydrophobicContact CB-CG1 4.35Å; E780-V816 HydrophobicContact CB-CG2 4.44Å; E780-K819 HydrophobicContact CG-CD 4.35Å; E780-K819 WeakPolarHBondContact OE1-CD 3.34Å; E780-K819 WeakPolarHBondContact OE1-CE 3.38Å; E780-K819 IonicContact OE1-NZ 3.38Å; E780-K819 PolarHBondContact OE1-NZ 3.38Å; E780-K819 IonicContact OE2-NZ 3.8Å; E780-K819 PolarHBondContact OE2-NZ 3.04Å
781	E	94.4	Very high	92.8	Very high	124 Å²	124	54 Å²	54	58%	0.579	29%	0.293	S	S	*	.	H	α-helix	trans	-62.8	-42.6	177.8	-73.5	172.6	-179.3	0	0	111.7	K777 G778 W783 N784	K777-E781 WeakPolarHBondContact CE-OE1 3.42Å; K777-E781 IonicContact NZ-OE1 3.98Å; K777-E781 WeakPolarHBondContact O-CG 3.39Å; K777-E781 PolarHBondContact O-N 3.25Å; G778-E781 PolarHBondContact O-N 3.34Å; E781-W783 VanDerWaalsContact C-N 3.33Å; E781-W783 PolarHBondContact O-N 3.09Å; E781-N784 WeakPolarHBondContact O-CB 3.46Å; E781-N784 PolarHBondContact O-N 2.98Å
782	R	94.6	Very high	92.5	Very high	85 Å²	85	57.8 Å²	57.8	32%	0.321	32%	0.319	S	S	.	.	H	α-helix	trans	-76.3	-18.5	178.7	-164	171.4	-176.5	131	-5.8	113.5	E767 F770 G778 I779 G788 P789 L790	E767-R782 IonicContact OE1-CZ 2.91Å; E767-R782 IonicContact OE1-NE 2.77Å; E767-R782 PolarHBondContact OE1-NE 3.1Å; E767-R782 IonicContact OE1-NH2 2.59Å; E767-R782 PolarHBondContact OE1-NH2 3.34Å; E767-R782 IonicContact OE2-CZ 3.54Å; E767-R782 IonicContact OE2-NE 3.49Å; E767-R782 PolarHBondContact OE2-NE 3.02Å; E767-R782 IonicContact OE2-NH2 2.73Å; E767-R782 PolarHBondContact OE2-NH2 3.36Å; F770-R782 HydrophobicContact CD1-CB 4.46Å; F770-R782 HydrophobicContact CD1-CG 4.47Å; F770-R782 VanDerWaalsContact CD2-NH1 3.28Å; F770-R782 HydrophobicContact CE1-CB 3.66Å; F770-R782 HydrophobicContact CE1-CG 4.07Å; F770-R782 HydrophobicContact CZ-CB 3.84Å; F770-R782 HydrophobicContact CZ-CG 4.23Å; G778-R782 WeakPolarHBondContact O-CB 3.49Å; G778-R782 PolarHBondContact O-N 3.3Å; I779-R782 PolarHBondContact O-N 3.01Å; R782-G788 CarbonylContact O-C 3.5Å; R782-G788 WeakPolarHBondContact O-CA 3.44Å; R782-P789 HydrophobicContact CG-CB 4.38Å; R782-P789 HydrophobicContact CG-CG 4.34Å; R782-P789 WeakPolarHBondContact O-CD 3.5Å; R782-L790 HydrophobicContact CB-CD1 3.73Å; R782-L790 HydrophobicContact CB-CG 4.23Å; R782-L790 HydrophobicContact CG-CD1 4.01Å; R782-L790 HydrophobicContact CG-CG 3.95Å; R782-L790 PolarHBondContact O-N 3.17Å
783	W	93.8	Very high	92.6	Very high	12 Å²	12	58.6 Å²	58.6	5%	0.045	33%	0.325	C	S	.	.	H	α-helix	trans	-72.3	-37	166.6	178.5	-104.2	0	0	0	112	I779 E780 E781 A785 G786 N787 G788 L790 A791 P796 L799 L820	I779-W783 WeakPolarHBondContact O-CB 3.37Å; I779-W783 PolarHBondContact O-N 3Å; E780-W783 WeakPolarHBondContact O-CB 3.31Å; E780-W783 PolarHBondContact O-N 3.22Å; E781-W783 VanDerWaalsContact C-N 3.33Å; E781-W783 PolarHBondContact O-N 3.09Å; W783-A785 PolarHBondContact O-N 2.77Å; W783-G786 VanDerWaalsContact NE1-N 3.1Å; W783-G786 PolarHBondContact O-N 3.31Å; W783-G786 VanDerWaalsContact O-N 3.08Å; W783-N787 PolarHBondContact O-N 2.86Å; W783-G788 WeakPolarHBondContact O-CA 3.38Å; W783-G788 PolarHBondContact O-N 3.4Å; W783-L790 HydrophobicContact CE3-CB 4.16Å; W783-A791 HydrophobicContact CD2-CB 4.14Å; W783-A791 HydrophobicContact CE3-CB 3.72Å; W783-A791 HydrophobicContact CH2-CB 3.82Å; W783-A791 HydrophobicContact CZ2-CB 4.22Å; W783-A791 HydrophobicContact CZ3-CB 3.58Å; W783-P796 HydrophobicContact CH2-CB 4.24Å; W783-P796 HydrophobicContact CH2-CG 3.79Å; W783-P796 HydrophobicContact CZ2-CB 4.34Å; W783-P796 HydrophobicContact CZ2-CG 3.95Å; W783-L799 HydrophobicContact CB-CD2 4.47Å; W783-L799 HydrophobicContact CD2-CD2 3.92Å; W783-L799 HydrophobicContact CE3-CD2 3.33Å; W783-L799 HydrophobicContact CG-CD2 4.41Å; W783-L799 HydrophobicContact CZ3-CD2 3.82Å; W783-L820 HydrophobicContact CB-CD2 4.34Å; W783-L820 VanDerWaalsContact CD1-CD2 3.43Å; W783-L820 HydrophobicContact CD2-CD2 3.51Å; W783-L820 VanDerWaalsContact CE2-CD2 3.46Å; W783-L820 HydrophobicContact CE3-CD2 4.24Å; W783-L820 HydrophobicContact CG-CD2 3.52Å; W783-L820 HydrophobicContact CZ2-CD2 4.16Å
784	N	91.7	Very high	92.6	Very high	97 Å²	97	52.6 Å²	52.6	52%	0.519	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	46	57.3	176.4	-174.1	32.5	0	0	0	113.5	E780 E781 G786 N787	E780-N784 PolarHBondContact O-N 3.45Å; E780-N784 VanDerWaalsContact O-N 3.09Å; E781-N784 WeakPolarHBondContact O-CB 3.46Å; E781-N784 PolarHBondContact O-N 2.98Å; N784-G786 PolarHBondContact O-N 3.16Å; N784-G786 VanDerWaalsContact O-N 3.08Å; N784-N787 WeakPolarHBondContact O-CB 3.46Å; N784-N787 PolarHBondContact O-N 3.23Å
785	A	87.2	Confident	92.6	Very high	69 Å²	69	53.4 Å²	53.4	57%	0.57	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	47.5	42.1	-178.8	0	0	0	0	0	113.4	W783 N787 T823	W783-A785 PolarHBondContact O-N 2.77Å; A785-N787 VanDerWaalsContact C-N 3.32Å; A785-N787 PolarHBondContact O-N 3.22Å; A785-T823 WeakPolarHBondContact O-CG2 3.41Å
786	G	87.6	Confident	92.5	Very high	27 Å²	27	50.4 Å²	50.4	28%	0.278	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	84.7	-0.4	176.5	0	0	0	0	0	114.8	W783 N784 A791	W783-G786 VanDerWaalsContact NE1-N 3.1Å; W783-G786 PolarHBondContact O-N 3.31Å; W783-G786 VanDerWaalsContact O-N 3.08Å; N784-G786 PolarHBondContact O-N 3.16Å; N784-G786 VanDerWaalsContact O-N 3.08Å; G786-A791 WeakPolarHBondContact O-CB 3.26Å
787	N	89.7	Confident	92.5	Very high	136 Å²	136	54 Å²	54	73%	0.727	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	1.4	-179	-61.4	-55.7	0	0	0	113.1	W783 N784 A785	W783-N787 PolarHBondContact O-N 2.86Å; N784-N787 WeakPolarHBondContact O-CB 3.46Å; N784-N787 PolarHBondContact O-N 3.23Å; A785-N787 VanDerWaalsContact C-N 3.32Å; A785-N787 PolarHBondContact O-N 3.22Å
788	G	92.5	Very high	92.5	Very high	7 Å²	7	50.1 Å²	50.1	7%	0.072	29%	0.292	C	S	.	.	S	Bend	trans	-87.4	171.3	-176.6	0	0	0	0	0	114.4	R782 W783 L790 A791 S792	R782-G788 CarbonylContact O-C 3.5Å; R782-G788 WeakPolarHBondContact O-CA 3.44Å; W783-G788 WeakPolarHBondContact O-CA 3.38Å; W783-G788 PolarHBondContact O-N 3.4Å; G788-L790 PolarHBondContact O-N 3.27Å; G788-A791 WeakPolarHBondContact O-CB 3.46Å; G788-A791 PolarHBondContact O-N 2.82Å; G788-S792 PolarHBondContact O-N 3.01Å
789	P	92	Very high	92.6	Very high	63 Å²	63	49.7 Å²	49.7	41%	0.409	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-39.1	176.7	-26.6	34.6	0	0	0	113.4	R782 A791 S792	R782-P789 HydrophobicContact CG-CB 4.38Å; R782-P789 HydrophobicContact CG-CG 4.34Å; R782-P789 WeakPolarHBondContact O-CD 3.5Å; P789-A791 VanDerWaalsContact C-N 3.33Å; P789-A791 PolarHBondContact O-N 3.45Å; P789-S792 PolarHBondContact O-N 3.34Å; P789-S792 PolarHBondContact O-OG 3.37Å
790	L	93.3	Very high	92.5	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-41.3	177	-81.8	170.4	0	0	0	112.1	E767 F770 V771 I779 R782 W783 G788 S792 C793 F794	E767-L790 HydrophobicContact CB-CD2 3.91Å; F770-L790 HydrophobicContact CD1-CD1 4.23Å; F770-L790 HydrophobicContact CE1-CD1 4.23Å; V771-L790 HydrophobicContact CG2-CD1 4.21Å; V771-L790 HydrophobicContact CG2-CD2 3.48Å; V771-L790 VanDerWaalsContact CG2-CD2 3.48Å; I779-L790 HydrophobicContact CG2-CD1 4.1Å; R782-L790 HydrophobicContact CB-CD1 3.73Å; R782-L790 HydrophobicContact CB-CG 4.23Å; R782-L790 HydrophobicContact CG-CD1 4.01Å; R782-L790 HydrophobicContact CG-CG 3.95Å; R782-L790 PolarHBondContact O-N 3.17Å; W783-L790 HydrophobicContact CE3-CB 4.16Å; G788-L790 PolarHBondContact O-N 3.27Å; L790-S792 PolarHBondContact O-N 3Å; L790-C793 PolarHBondContact O-N 3.47Å; L790-F794 HydrophobicContact CD2-CD2 4.21Å; L790-F794 PolarHBondContact O-N 3.24Å
791	A	92.2	Very high	92.5	Very high	27 Å²	27	55.4 Å²	55.4	22%	0.223	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-24.3	-179.5	0	0	0	0	0	113.3	W783 G786 G788 P789 C793	W783-A791 HydrophobicContact CD2-CB 4.14Å; W783-A791 HydrophobicContact CE3-CB 3.72Å; W783-A791 HydrophobicContact CH2-CB 3.82Å; W783-A791 HydrophobicContact CZ2-CB 4.22Å; W783-A791 HydrophobicContact CZ3-CB 3.58Å; G786-A791 WeakPolarHBondContact O-CB 3.26Å; G788-A791 WeakPolarHBondContact O-CB 3.46Å; G788-A791 PolarHBondContact O-N 2.82Å; P789-A791 VanDerWaalsContact C-N 3.33Å; P789-A791 PolarHBondContact O-N 3.45Å; A791-C793 VanDerWaalsContact C-N 3.26Å; A791-C793 PolarHBondContact O-N 3.29Å
792	S	91.2	Very high	92.4	Very high	79 Å²	79	49.6 Å²	49.6	55%	0.552	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-17.3	172.7	77.3	0	0	0	0	113.8	G788 P789 L790	G788-S792 PolarHBondContact O-N 3.01Å; P789-S792 PolarHBondContact O-N 3.34Å; P789-S792 PolarHBondContact O-OG 3.37Å; L790-S792 PolarHBondContact O-N 3Å
793	C	93.6	Very high	92.4	Very high	21 Å²	21	45.5 Å²	45.5	14%	0.142	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-26.2	-170.8	-70.7	0	0	0	0	113.8	R764 E767 L790 A791	R764-C793 HydrophobicContact CB-CB 4.39Å; R764-C793 HydrophobicContact CG-CB 4.19Å; R764-C793 PolarHBondContact NE-O 2.91Å; R764-C793 VanDerWaalsContact NE-O 3.11Å; E767-C793 HydrophobicContact CB-CB 4.22Å; E767-C793 HydrophobicContact CG-CB 4.08Å; L790-C793 PolarHBondContact O-N 3.47Å; A791-C793 VanDerWaalsContact C-N 3.26Å; A791-C793 PolarHBondContact O-N 3.29Å
794	F	94.6	Very high	92.5	Very high	5 Å²	5	50.2 Å²	50.2	2%	0.022	29%	0.285	C	S	.	.	S	Bend	trans	-129.2	140.5	-178.6	-68.9	-79.7	0	0	0	111.1	I715 L719 R764 E767 L768 L790 E798	I715-F794 HydrophobicContact CG2-CE1 4.13Å; L719-F794 HydrophobicContact CD1-CE1 4.25Å; L719-F794 HydrophobicContact CD2-CD1 4.49Å; L719-F794 HydrophobicContact CD2-CE1 4.28Å; R764-F794 HydrophobicContact CG-CE1 4.16Å; R764-F794 HydrophobicContact CG-CE2 4.15Å; R764-F794 HydrophobicContact CG-CZ 3.78Å; E767-F794 HydrophobicContact CB-CD2 4.31Å; E767-F794 HydrophobicContact CB-CE2 3.77Å; L768-F794 HydrophobicContact CB-CZ 3.99Å; L768-F794 HydrophobicContact CD1-CZ 4.44Å; L790-F794 HydrophobicContact CD2-CD2 4.21Å; L790-F794 PolarHBondContact O-N 3.24Å; F794-E798 HydrophobicContact CB-CB 4.46Å; F794-E798 HydrophobicContact CD1-CB 4.11Å
795	T	93.3	Very high	92.4	Very high	68 Å²	68	45.7 Å²	45.7	42%	0.417	26%	0.261	S	S	.	.			trans	-69	155.9	168.5	63.7	0	0	0	0	110.2	D797 E798 L799	T795-D797 PolarHBondContact O-N 3Å; T795-D797 VanDerWaalsContact O-N 3.15Å; T795-E798 PolarHBondContact N-OE2 3.14Å; T795-E798 PolarHBondContact O-N 2.96Å; T795-E798 WeakPolarHBondContact OG1-CB 3.48Å; T795-E798 WeakPolarHBondContact OG1-CG 3.11Å; T795-E798 PolarHBondContact OG1-N 3.46Å; T795-E798 PolarHBondContact OG1-OE2 3.18Å; T795-L799 PolarHBondContact O-N 3.5Å
796	P	91.3	Very high	92.7	Very high	30 Å²	30	43.2 Å²	43.2	20%	0.195	24%	0.238	C	C	.	.	H	α-helix	trans	-52.7	-36.7	173	-24.9	32.7	0	0	0	112.2	W783 R800 V824	W783-P796 HydrophobicContact CH2-CB 4.24Å; W783-P796 HydrophobicContact CH2-CG 3.79Å; W783-P796 HydrophobicContact CZ2-CB 4.34Å; W783-P796 HydrophobicContact CZ2-CG 3.95Å; P796-R800 WeakPolarHBondContact O-CB 3.49Å; P796-R800 WeakPolarHBondContact O-CG 3.41Å; P796-R800 PolarHBondContact O-N 3.37Å; P796-V824 HydrophobicContact CB-CG2 4.17Å; P796-V824 HydrophobicContact CG-CG2 3.62Å
797	D	92.7	Very high	92.9	Very high	86 Å²	86	44 Å²	44	46%	0.46	23%	0.234	S	C	.	.	H	α-helix	trans	-69.6	-43.8	-179.1	-71.3	-3.5	0	0	0	113.2	T795 L799 R800 K801	T795-D797 PolarHBondContact O-N 3Å; T795-D797 VanDerWaalsContact O-N 3.15Å; D797-L799 VanDerWaalsContact C-N 3.35Å; D797-R800 PolarHBondContact O-N 3.34Å; D797-R800 IonicContact OD1-CZ 3.63Å; D797-R800 IonicContact OD1-NE 3.28Å; D797-R800 PolarHBondContact OD1-NE 3.23Å; D797-R800 IonicContact OD1-NH2 3.65Å; D797-R800 PolarHBondContact OD1-NH2 3.31Å; D797-R800 IonicContact OD2-NH2 2.74Å; D797-K801 WeakPolarHBondContact O-CG 3.13Å; D797-K801 PolarHBondContact O-N 3.48Å
798	E	94.7	Very high	92.9	Very high	43 Å²	43	45.3 Å²	45.3	20%	0.201	24%	0.236	C	C	.	.	H	α-helix	trans	-61.3	-45.6	174.6	-72.7	169.1	152.4	0	0	110.7	L719 R764 F794 T795 R800 K801 L802	L719-E798 HydrophobicContact CD1-CB 4.4Å; L719-E798 HydrophobicContact CD1-CG 4.08Å; L719-E798 HydrophobicContact CD2-CB 4.11Å; R764-E798 IonicContact CZ-OE1 3.5Å; R764-E798 IonicContact NH2-OE1 3.48Å; R764-E798 PolarHBondContact NH2-OE1 3.31Å; R764-E798 IonicContact NH2-OE2 3.5Å; R764-E798 PolarHBondContact NH2-OE2 2.94Å; F794-E798 HydrophobicContact CB-CB 4.46Å; F794-E798 HydrophobicContact CD1-CB 4.11Å; T795-E798 PolarHBondContact N-OE2 3.14Å; T795-E798 PolarHBondContact O-N 2.96Å; T795-E798 WeakPolarHBondContact OG1-CB 3.48Å; T795-E798 WeakPolarHBondContact OG1-CG 3.11Å; T795-E798 PolarHBondContact OG1-N 3.46Å; T795-E798 PolarHBondContact OG1-OE2 3.18Å; E798-R800 PolarHBondContact O-N 3.34Å; E798-K801 PolarHBondContact O-N 3.42Å; E798-L802 WeakPolarHBondContact O-CB 3.11Å; E798-L802 PolarHBondContact O-N 2.65Å
799	L	95.1	Very high	92.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66	-39.8	179.3	-174.3	59	0	0	0	111.9	V771 I779 W783 T795 D797 K801 L802 I803 L820	V771-L799 HydrophobicContact CG1-CD1 4.37Å; V771-L799 HydrophobicContact CG2-CD1 4.02Å; I779-L799 HydrophobicContact CG2-CD1 4.07Å; I779-L799 HydrophobicContact CG2-CD2 4.43Å; W783-L799 HydrophobicContact CB-CD2 4.47Å; W783-L799 HydrophobicContact CD2-CD2 3.92Å; W783-L799 HydrophobicContact CE3-CD2 3.33Å; W783-L799 HydrophobicContact CG-CD2 4.41Å; W783-L799 HydrophobicContact CZ3-CD2 3.82Å; T795-L799 PolarHBondContact O-N 3.5Å; D797-L799 VanDerWaalsContact C-N 3.35Å; L799-K801 PolarHBondContact O-N 3.03Å; L799-L802 PolarHBondContact O-N 3.42Å; L799-I803 HydrophobicContact CD1-CD1 4.24Å; L799-I803 HydrophobicContact CD1-CG1 4.32Å; L799-I803 HydrophobicContact CG-CD1 3.96Å; L799-I803 HydrophobicContact CG-CG1 4.47Å; L799-I803 WeakPolarHBondContact O-CB 3.47Å; L799-I803 WeakPolarHBondContact O-CG1 3.46Å; L799-I803 PolarHBondContact O-N 2.74Å; L799-L820 HydrophobicContact CD2-CD1 4.08Å; L799-L820 HydrophobicContact CD2-CD2 3.82Å; L799-L820 HydrophobicContact CG-CD1 4.06Å
800	R	93.5	Very high	92.9	Very high	55 Å²	55	51.1 Å²	51.1	21%	0.208	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-42.6	174.2	-74.6	-176.3	-48.4	135.8	2.8	111.9	P796 D797 E798 R804 L817 L820	P796-R800 WeakPolarHBondContact O-CB 3.49Å; P796-R800 WeakPolarHBondContact O-CG 3.41Å; P796-R800 PolarHBondContact O-N 3.37Å; D797-R800 PolarHBondContact O-N 3.34Å; D797-R800 IonicContact OD1-CZ 3.63Å; D797-R800 IonicContact OD1-NE 3.28Å; D797-R800 PolarHBondContact OD1-NE 3.23Å; D797-R800 IonicContact OD1-NH2 3.65Å; D797-R800 PolarHBondContact OD1-NH2 3.31Å; D797-R800 IonicContact OD2-NH2 2.74Å; E798-R800 PolarHBondContact O-N 3.34Å; R800-R804 WeakPolarHBondContact O-CB 3.5Å; R800-R804 VanDerWaalsContact O-CG 3.28Å; R800-R804 WeakPolarHBondContact O-CG 3.5Å; R800-R804 PolarHBondContact O-N 2.73Å; R800-L817 HydrophobicContact CB-CD2 3.91Å; R800-L817 HydrophobicContact CG-CD2 3.8Å; R800-L820 HydrophobicContact CG-CB 4.08Å; R800-L820 HydrophobicContact CG-CD1 3.87Å
801	K	92.7	Very high	92.8	Very high	129 Å²	129	59.7 Å²	59.7	56%	0.561	30%	0.304	S	S	*	.	H	α-helix	trans	-61.2	-47.5	175.9	-75.6	175.6	-179.1	179.9	0	110.6	D797 E798 L799 I803 R804 A805	D797-K801 WeakPolarHBondContact O-CG 3.13Å; D797-K801 PolarHBondContact O-N 3.48Å; E798-K801 PolarHBondContact O-N 3.42Å; L799-K801 PolarHBondContact O-N 3.03Å; K801-I803 PolarHBondContact O-N 3.23Å; K801-R804 PolarHBondContact O-N 3.45Å; K801-A805 WeakPolarHBondContact O-CB 3.35Å; K801-A805 PolarHBondContact O-N 3.05Å
802	L	94.1	Very high	92.8	Very high	2 Å²	2	63.9 Å²	63.9	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-63	-43.9	-179.7	-168.2	59.3	0	0	0	112.3	V718 L719 I724 L768 V771 E798 L799 R804 A805 I806	V718-L802 HydrophobicContact CG1-CD1 4.18Å; L719-L802 HydrophobicContact CD2-CB 4.4Å; L719-L802 HydrophobicContact CD2-CD2 4.49Å; I724-L802 HydrophobicContact CD1-CD1 4.32Å; L768-L802 HydrophobicContact CD1-CD1 4.3Å; L768-L802 HydrophobicContact CD1-CD2 3.63Å; V771-L802 HydrophobicContact CB-CD2 3.83Å; V771-L802 HydrophobicContact CG1-CD2 3.43Å; V771-L802 VanDerWaalsContact CG1-CD2 3.43Å; V771-L802 HydrophobicContact CG1-CG 3.76Å; V771-L802 HydrophobicContact CG2-CD2 4.32Å; E798-L802 WeakPolarHBondContact O-CB 3.11Å; E798-L802 PolarHBondContact O-N 2.65Å; L799-L802 PolarHBondContact O-N 3.42Å; L802-R804 PolarHBondContact O-N 3.07Å; L802-A805 PolarHBondContact O-N 2.83Å; L802-I806 HydrophobicContact CD1-CD1 3.79Å; L802-I806 HydrophobicContact CD1-CG1 4.4Å; L802-I806 HydrophobicContact CG-CD1 3.76Å; L802-I806 WeakPolarHBondContact O-CG1 3.43Å; L802-I806 PolarHBondContact O-N 3.49Å
803	I	94.7	Very high	92.9	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.4	-41.2	175.2	-72.4	170.1	0	0	0	111.7	L776 I779 L799 K801 A805 I806 F807 R813 V816 L817 L820	L776-I803 HydrophobicContact CD2-CG2 3.7Å; I779-I803 HydrophobicContact CG2-CD1 4.04Å; I779-I803 HydrophobicContact CG2-CG1 4.43Å; L799-I803 HydrophobicContact CD1-CD1 4.24Å; L799-I803 HydrophobicContact CD1-CG1 4.32Å; L799-I803 HydrophobicContact CG-CD1 3.96Å; L799-I803 HydrophobicContact CG-CG1 4.47Å; L799-I803 WeakPolarHBondContact O-CB 3.47Å; L799-I803 WeakPolarHBondContact O-CG1 3.46Å; L799-I803 PolarHBondContact O-N 2.74Å; K801-I803 PolarHBondContact O-N 3.23Å; I803-A805 VanDerWaalsContact C-N 3.28Å; I803-A805 PolarHBondContact O-N 2.92Å; I803-I806 PolarHBondContact O-N 3.5Å; I803-F807 HydrophobicContact CG2-CD2 4.13Å; I803-F807 WeakPolarHBondContact O-CB 3.09Å; I803-F807 WeakPolarHBondContact O-CD2 3.37Å; I803-F807 PolarHBondContact O-N 3.48Å; I803-R813 HydrophobicContact CG2-CG 3.83Å; I803-V816 HydrophobicContact CD1-CG1 4.12Å; I803-L817 HydrophobicContact CB-CD2 4.11Å; I803-L817 HydrophobicContact CG2-CD2 3.85Å; I803-L817 HydrophobicContact CG2-CG 4.22Å; I803-L820 HydrophobicContact CD1-CD1 3.59Å
804	R	94.1	Very high	92.9	Very high	111 Å²	111	63.2 Å²	63.2	42%	0.419	31%	0.312	S	S	.	.	H	α-helix	trans	-65.3	-35.1	177	-75.8	177.3	-172.9	130.9	-0.9	112.1	R800 K801 L802 L817	R800-R804 WeakPolarHBondContact O-CB 3.5Å; R800-R804 VanDerWaalsContact O-CG 3.28Å; R800-R804 WeakPolarHBondContact O-CG 3.5Å; R800-R804 PolarHBondContact O-N 2.73Å; K801-R804 PolarHBondContact O-N 3.45Å; L802-R804 PolarHBondContact O-N 3.07Å; R804-L817 HydrophobicContact CG-CD1 3.94Å; R804-L817 HydrophobicContact CG-CD2 4.42Å
805	A	91.2	Very high	92.8	Very high	2 Å²	2	65.1 Å²	65.1	2%	0.017	33%	0.328	C	S	.	.	H	α-helix	trans	-72.1	-39.6	178.5	0	0	0	0	0	112	L721 I724 K801 L802 I803	L721-A805 WeakPolarHBondContact O-CB 3.38Å; I724-A805 HydrophobicContact CD1-CB 4.06Å; I724-A805 HydrophobicContact CG1-CB 4.03Å; I724-A805 PolarHBondContact N-O 2.89Å; K801-A805 WeakPolarHBondContact O-CB 3.35Å; K801-A805 PolarHBondContact O-N 3.05Å; L802-A805 PolarHBondContact O-N 2.83Å; I803-A805 VanDerWaalsContact C-N 3.28Å; I803-A805 PolarHBondContact O-N 2.92Å
806	I	92.3	Very high	92.7	Very high	16 Å²	16	62.1 Å²	62.1	8%	0.082	31%	0.31	C	S	.	.	H	α-helix	trans	-86.6	-36.4	-174	-62.4	164.7	0	0	0	113	I724 A729 V771 L772 L802 I803	I724-I806 HydrophobicContact CB-CG1 4.21Å; I724-I806 HydrophobicContact CD1-CG1 4.04Å; I724-I806 HydrophobicContact CG2-CG1 4.48Å; A729-I806 HydrophobicContact CB-CG2 4.35Å; V771-I806 HydrophobicContact CG1-CD1 3.94Å; L772-I806 HydrophobicContact CD2-CD1 3.8Å; L772-I806 HydrophobicContact CD2-CG1 4.36Å; L802-I806 HydrophobicContact CD1-CD1 3.79Å; L802-I806 HydrophobicContact CD1-CG1 4.4Å; L802-I806 HydrophobicContact CG-CD1 3.76Å; L802-I806 WeakPolarHBondContact O-CG1 3.43Å; L802-I806 PolarHBondContact O-N 3.49Å; I803-I806 PolarHBondContact O-N 3.5Å
807	F	93.1	Very high	92.8	Very high	43 Å²	43	61.5 Å²	61.5	19%	0.189	31%	0.305	C	S	.	.	S	Bend	trans	-109.5	137.3	-170	-61.9	-83.9	0	0	0	112.5	N774 L776 I779 I803 R813	N774-F807 WeakPolarHBondContact O-CZ 3.44Å; L776-F807 HydrophobicContact CD1-CB 4.48Å; L776-F807 HydrophobicContact CD1-CD1 4.26Å; L776-F807 HydrophobicContact CD1-CG 4.31Å; L776-F807 HydrophobicContact CD2-CB 4.31Å; L776-F807 HydrophobicContact CD2-CD1 4.19Å; L776-F807 HydrophobicContact CD2-CD2 3.6Å; L776-F807 HydrophobicContact CD2-CE1 4.45Å; L776-F807 HydrophobicContact CD2-CE2 3.9Å; L776-F807 HydrophobicContact CD2-CG 3.76Å; L776-F807 HydrophobicContact CD2-CZ 4.31Å; L776-F807 HydrophobicContact CG-CD1 3.79Å; L776-F807 HydrophobicContact CG-CD2 4.12Å; L776-F807 HydrophobicContact CG-CE1 3.97Å; L776-F807 HydrophobicContact CG-CE2 4.29Å; L776-F807 HydrophobicContact CG-CG 3.86Å; L776-F807 HydrophobicContact CG-CZ 4.22Å; I779-F807 HydrophobicContact CD1-CE2 3.54Å; I779-F807 HydrophobicContact CD1-CZ 3.71Å; I803-F807 HydrophobicContact CG2-CD2 4.13Å; I803-F807 WeakPolarHBondContact O-CB 3.09Å; I803-F807 WeakPolarHBondContact O-CD2 3.37Å; I803-F807 PolarHBondContact O-N 3.48Å; F807-R813 HydrophobicContact CB-CG 4.35Å; F807-R813 VanDerWaalsContact O-CD 3.27Å; F807-R813 WeakPolarHBondContact O-CD 3.39Å; F807-R813 PolarHBondContact O-NH1 3.21Å
808	Q	89.6	Confident	92.6	Very high	165 Å²	165	60.3 Å²	60.3	77%	0.771	30%	0.303	S	S	*	.			trans	-60.9	158.5	174.6	-66.2	-176.3	-3	0	0	112.8	T810 R813	Q808-T810 PolarHBondContact O-N 3.37Å; Q808-R813 VanDerWaalsContact O-CD 3.26Å; Q808-R813 WeakPolarHBondContact O-CD 3.35Å; Q808-R813 PolarHBondContact O-NE 3.48Å
809	N	90.7	Very high	92.3	Very high	131 Å²	131	63 Å²	63	70%	0.701	32%	0.315	S	S	*	.	S	Bend	trans	-71	92.1	179.9	-166.2	24.5	0	0	0	112.7	R813	N809-R813 PolarHBondContact OD1-NH2 3.24Å
810	T	93.7	Very high	91.8	Very high	61 Å²	61	63.2 Å²	63.2	37%	0.374	32%	0.316	S	S	.	.			trans	-120.7	161.9	177.1	65.8	0	0	0	0	111.6	Q808 Q812 R813 A814	Q808-T810 PolarHBondContact O-N 3.37Å; T810-Q812 PolarHBondContact O-N 3.33Å; T810-R813 WeakPolarHBondContact O-CB 3.43Å; T810-R813 PolarHBondContact O-N 3.31Å; T810-R813 PolarHBondContact OG1-N 3.41Å; T810-R813 VanDerWaalsContact OG1-N 3.14Å; T810-A814 PolarHBondContact O-N 3.27Å
811	E	91.5	Very high	90.8	Very high	179 Å²	179	64.3 Å²	64.3	84%	0.836	33%	0.328	S	S	*	.	H	α-helix	trans	-58.4	-38.9	173	-67	-174.3	171.5	0	0	111.8	R813 A814 A815	E811-R813 PolarHBondContact O-N 2.89Å; E811-A814 PolarHBondContact O-N 3.1Å; E811-A815 WeakPolarHBondContact O-CB 3.44Å; E811-A815 PolarHBondContact O-N 3.08Å
812	Q	90.9	Very high	89.3	Confident	115 Å²	115	67.5 Å²	67.5	54%	0.537	34%	0.337	S	S	.	.	H	α-helix	trans	-61.6	-44	176	-170.9	-178.9	8.4	0	0	111.6	L776 T810 A814 A815 V816	L776-Q812 HydrophobicContact CD1-CB 4.43Å; L776-Q812 HydrophobicContact CD1-CG 4.13Å; T810-Q812 PolarHBondContact O-N 3.33Å; Q812-A814 PolarHBondContact O-N 3.3Å; Q812-A815 PolarHBondContact O-N 3.46Å; Q812-V816 WeakPolarHBondContact O-CG2 3.47Å; Q812-V816 PolarHBondContact O-N 2.94Å
813	R	94.6	Very high	87.4	Confident	36 Å²	36	69.7 Å²	69.7	14%	0.136	35%	0.35	C	S	.	.	H	α-helix	trans	-60.9	-45.6	174.8	-171.4	-172.4	71.6	170.6	8.7	110.8	L776 I803 F807 Q808 N809 T810 E811 A815 V816 L817	L776-R813 HydrophobicContact CD1-CB 3.99Å; I803-R813 HydrophobicContact CG2-CG 3.83Å; F807-R813 HydrophobicContact CB-CG 4.35Å; F807-R813 VanDerWaalsContact O-CD 3.27Å; F807-R813 WeakPolarHBondContact O-CD 3.39Å; F807-R813 PolarHBondContact O-NH1 3.21Å; Q808-R813 VanDerWaalsContact O-CD 3.26Å; Q808-R813 WeakPolarHBondContact O-CD 3.35Å; Q808-R813 PolarHBondContact O-NE 3.48Å; N809-R813 PolarHBondContact OD1-NH2 3.24Å; T810-R813 WeakPolarHBondContact O-CB 3.43Å; T810-R813 PolarHBondContact O-N 3.31Å; T810-R813 PolarHBondContact OG1-N 3.41Å; T810-R813 VanDerWaalsContact OG1-N 3.14Å; E811-R813 PolarHBondContact O-N 2.89Å; R813-A815 VanDerWaalsContact C-N 3.3Å; R813-A815 PolarHBondContact O-N 3.37Å; R813-V816 PolarHBondContact O-N 3.41Å; R813-L817 HydrophobicContact CG-CD1 3.99Å; R813-L817 HydrophobicContact CG-CG 4.36Å; R813-L817 WeakPolarHBondContact O-CB 3.38Å; R813-L817 VanDerWaalsContact O-CG 3.26Å; R813-L817 WeakPolarHBondContact O-CG 3.37Å; R813-L817 PolarHBondContact O-N 3.5Å
814	A	92.7	Very high	85.2	Confident	51 Å²	51	75 Å²	75	42%	0.421	38%	0.383	S	S	.	.	H	α-helix	trans	-61	-39.1	178.4	0	0	0	0	0	112.3	T810 E811 Q812 L817 S818	T810-A814 PolarHBondContact O-N 3.27Å; E811-A814 PolarHBondContact O-N 3.1Å; Q812-A814 PolarHBondContact O-N 3.3Å; A814-L817 PolarHBondContact O-N 3.07Å; A814-S818 PolarHBondContact O-N 3.08Å
815	A	92	Very high	82.4	Confident	44 Å²	44	80.8 Å²	80.8	36%	0.364	41%	0.414	S	S	.	.	H	α-helix	trans	-65.3	-41.7	176.1	0	0	0	0	0	112.8	E811 Q812 R813 S818 K819	E811-A815 WeakPolarHBondContact O-CB 3.44Å; E811-A815 PolarHBondContact O-N 3.08Å; Q812-A815 PolarHBondContact O-N 3.46Å; R813-A815 VanDerWaalsContact C-N 3.3Å; R813-A815 PolarHBondContact O-N 3.37Å; A815-S818 PolarHBondContact O-OG 2.95Å; A815-K819 WeakPolarHBondContact O-CG 3.41Å; A815-K819 PolarHBondContact O-N 3.29Å
816	V	91.9	Very high	82	Confident	5 Å²	5	84.7 Å²	84.7	3%	0.03	43%	0.434	C	S	.	.	H	α-helix	trans	-67.5	-43.9	175.7	175.7	0	0	0	0	110.8	L776 E780 I803 Q812 R813 S818 K819 L820	L776-V816 HydrophobicContact CB-CG2 4.31Å; E780-V816 HydrophobicContact CB-CG1 4.35Å; E780-V816 HydrophobicContact CB-CG2 4.44Å; I803-V816 HydrophobicContact CD1-CG1 4.12Å; Q812-V816 WeakPolarHBondContact O-CG2 3.47Å; Q812-V816 PolarHBondContact O-N 2.94Å; R813-V816 PolarHBondContact O-N 3.41Å; V816-S818 VanDerWaalsContact C-N 3.3Å; V816-S818 PolarHBondContact O-N 3Å; V816-K819 PolarHBondContact O-N 2.92Å; V816-L820 WeakPolarHBondContact O-CG 3.48Å; V816-L820 PolarHBondContact O-N 2.93Å; V816-L820 VanDerWaalsContact O-N 3.1Å
817	L	93.2	Very high	81.5	Confident	17 Å²	17	88.3 Å²	88.3	9%	0.089	45%	0.453	C	S	.	.	H	α-helix	trans	-61.9	-35.4	178.5	-70.3	173.8	0	0	0	112.7	R800 I803 R804 R813 A814 L820 T821	R800-L817 HydrophobicContact CB-CD2 3.91Å; R800-L817 HydrophobicContact CG-CD2 3.8Å; I803-L817 HydrophobicContact CB-CD2 4.11Å; I803-L817 HydrophobicContact CG2-CD2 3.85Å; I803-L817 HydrophobicContact CG2-CG 4.22Å; R804-L817 HydrophobicContact CG-CD1 3.94Å; R804-L817 HydrophobicContact CG-CD2 4.42Å; R813-L817 HydrophobicContact CG-CD1 3.99Å; R813-L817 HydrophobicContact CG-CG 4.36Å; R813-L817 WeakPolarHBondContact O-CB 3.38Å; R813-L817 VanDerWaalsContact O-CG 3.26Å; R813-L817 WeakPolarHBondContact O-CG 3.37Å; R813-L817 PolarHBondContact O-N 3.5Å; A814-L817 PolarHBondContact O-N 3.07Å; L817-L820 HydrophobicContact CD2-CD1 4.49Å; L817-L820 PolarHBondContact O-N 3.22Å; L817-T821 PolarHBondContact O-N 3.43Å; L817-T821 PolarHBondContact O-OG1 2.94Å
818	S	89.1	Confident	80.8	Confident	61 Å²	61	90.8 Å²	90.8	43%	0.427	47%	0.467	S	S	.	.	H	α-helix	trans	-69.6	-37.9	176.9	71.1	0	0	0	0	112	A814 A815 V816 L820 T821 R822	A814-S818 PolarHBondContact O-N 3.08Å; A815-S818 PolarHBondContact O-OG 2.95Å; V816-S818 VanDerWaalsContact C-N 3.3Å; V816-S818 PolarHBondContact O-N 3Å; S818-L820 PolarHBondContact O-N 3.09Å; S818-T821 WeakPolarHBondContact O-CB 3.02Å; S818-T821 PolarHBondContact O-N 3.01Å; S818-R822 PolarHBondContact O-N 3.23Å
819	K	87	Confident	80.3	Confident	101 Å²	101	86.5 Å²	86.5	44%	0.439	45%	0.45	S	S	.	.	H	α-helix	trans	-62.6	-39.9	173.6	-69	173.9	-174.3	176.6	0	112.5	E780 A815 V816 T821 R822 T823	E780-K819 HydrophobicContact CG-CD 4.35Å; E780-K819 WeakPolarHBondContact OE1-CD 3.34Å; E780-K819 WeakPolarHBondContact OE1-CE 3.38Å; E780-K819 IonicContact OE1-NZ 3.38Å; E780-K819 PolarHBondContact OE1-NZ 3.38Å; E780-K819 IonicContact OE2-NZ 3.8Å; E780-K819 PolarHBondContact OE2-NZ 3.04Å; A815-K819 WeakPolarHBondContact O-CG 3.41Å; A815-K819 PolarHBondContact O-N 3.29Å; V816-K819 PolarHBondContact O-N 2.92Å; K819-T821 PolarHBondContact O-N 3.15Å; K819-R822 PolarHBondContact O-N 2.91Å; K819-T823 PolarHBondContact O-OG1 3.49Å
820	L	84.4	Confident	79.7	Confident	4 Å²	4	83.7 Å²	83.7	2%	0.021	43%	0.434	C	S	.	.	H	α-helix	trans	-63.3	-31.7	175	-66.8	176.9	0	0	0	112.8	W783 L799 R800 I803 V816 L817 S818 T823	W783-L820 HydrophobicContact CB-CD2 4.34Å; W783-L820 VanDerWaalsContact CD1-CD2 3.43Å; W783-L820 HydrophobicContact CD2-CD2 3.51Å; W783-L820 VanDerWaalsContact CE2-CD2 3.46Å; W783-L820 HydrophobicContact CE3-CD2 4.24Å; W783-L820 HydrophobicContact CG-CD2 3.52Å; W783-L820 HydrophobicContact CZ2-CD2 4.16Å; L799-L820 HydrophobicContact CD2-CD1 4.08Å; L799-L820 HydrophobicContact CD2-CD2 3.82Å; L799-L820 HydrophobicContact CG-CD1 4.06Å; R800-L820 HydrophobicContact CG-CB 4.08Å; R800-L820 HydrophobicContact CG-CD1 3.87Å; I803-L820 HydrophobicContact CD1-CD1 3.59Å; V816-L820 WeakPolarHBondContact O-CG 3.48Å; V816-L820 PolarHBondContact O-N 2.93Å; V816-L820 VanDerWaalsContact O-N 3.1Å; L817-L820 HydrophobicContact CD2-CD1 4.49Å; L817-L820 PolarHBondContact O-N 3.22Å; S818-L820 PolarHBondContact O-N 3.09Å; L820-T823 PolarHBondContact O-OG1 3.12Å
821	T	73	Confident	78.7	Confident	77 Å²	77	85.2 Å²	85.2	47%	0.472	44%	0.438	S	S	.	.	H	α-helix	trans	-72.9	-36.7	-179.2	-50.7	0	0	0	0	111.5	L817 S818 K819 T823	L817-T821 PolarHBondContact O-N 3.43Å; L817-T821 PolarHBondContact O-OG1 2.94Å; S818-T821 WeakPolarHBondContact O-CB 3.02Å; S818-T821 PolarHBondContact O-N 3.01Å; K819-T821 PolarHBondContact O-N 3.15Å; T821-T823 PolarHBondContact O-N 2.98Å
822	R	60.7	Low	77.8	Confident	197 Å²	197	78.5 Å²	78.5	74%	0.743	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-14.2	-179.8	-78.1	-176.3	168.1	167.3	-2.4	114.7	S818 K819 V824	S818-R822 PolarHBondContact O-N 3.23Å; K819-R822 PolarHBondContact O-N 2.91Å; R822-V824 VanDerWaalsContact C-N 3.31Å; R822-V824 PolarHBondContact O-N 2.59Å
823	T	55.6	Low	76.8	Confident	47 Å²	47	75.7 Å²	75.7	29%	0.288	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-7.8	-176.8	1	0	0	0	0	115.1	A785 K819 L820 T821	A785-T823 WeakPolarHBondContact O-CG2 3.41Å; K819-T823 PolarHBondContact O-OG1 3.49Å; L820-T823 PolarHBondContact O-OG1 3.12Å; T821-T823 PolarHBondContact O-N 2.98Å
824	V	47.4	Very low	75.3	Confident	113 Å²	113	79 Å²	79	69%	0.685	42%	0.422	S	S	*	.			trans	-105.5	-15.9	-177.6	-173.8	0	0	0	0	112.7	P796 R822	P796-V824 HydrophobicContact CB-CG2 4.17Å; P796-V824 HydrophobicContact CG-CG2 3.62Å; R822-V824 VanDerWaalsContact C-N 3.31Å; R822-V824 PolarHBondContact O-N 2.59Å
825	E	36.8	Very low	73.7	Confident	231 Å²	231	81.5 Å²	81.5	100%	1.079	42%	0.422	S	S	*	.			trans	-82.6	0	165.9	-71.4	-178.9	170.4	0	0	109.9

Retrieved 825 of 825 residues in 514.4 ms (Link to these results)

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