B5DG16_SALSA Loading...

Sine oculis homeobox homolog 1a

AlphaFold DB , UniProt , Accession B5DG16, Species SALSA (Salmo salar, Atlantic salmon), Gene six1, Length 284 aa.

Structure Viewer

Loading PAE data...

(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	32.6	Very low	56.5	Low	236 Å²	236	110.7 Å²	110.7	100%	1.163	64%	0.642	S	S	*	*				0	110	0	-62.8	-177.1	-161.8	0	0	107.4	I3	M1-I3 PolarHBondContact O-N 3.41Å
2	S	37.7	Very low	59	Low	118 Å²	118	112.1 Å²	112.1	83%	0.825	64%	0.638	S	S	*	*			trans	-77.5	105.9	175.3	44.5	0	0	0	0	108.8	L4	S2-L4 PolarHBondContact O-N 3.39Å; S2-L4 VanDerWaalsContact O-N 3.16Å
3	I	39.6	Very low	61.3	Low	161 Å²	161	110.2 Å²	110.2	83%	0.826	62%	0.621	S	S	*	*			trans	-67.9	106.5	174.1	-60.3	166.3	0	0	0	106.7	M1	M1-I3 PolarHBondContact O-N 3.41Å
4	L	43.3	Very low	63.4	Low	107 Å²	107	102.4 Å²	102.4	56%	0.56	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-72.2	126.1	168.7	-76.2	165.7	0	0	0	107.5	S2	S2-L4 PolarHBondContact O-N 3.39Å; S2-L4 VanDerWaalsContact O-N 3.16Å
5	P	49.1	Very low	65.2	Low	107 Å²	107	96.4 Å²	96.4	70%	0.695	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-62.7	146.2	180	26	-32.2	0	0	0	110.3	F7	P5-F7 PolarHBondContact O-N 3.4Å
6	S	50.8	Low	66.8	Low	124 Å²	124	95.1 Å²	95.1	87%	0.867	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-48.1	121.7	175.3	-173.9	0	0	0	0	110.3	G8	S6-G8 PolarHBondContact O-N 3.17Å; S6-G8 VanDerWaalsContact O-N 3.12Å
7	F	61	Low	68.3	Low	71 Å²	71	92.2 Å²	92.2	31%	0.311	53%	0.527	S	S	.	.			trans	-69	108	-169.3	-160.3	-92.2	0	0	0	110.6	P5 F9 V14 L37 P38 L43	P5-F7 PolarHBondContact O-N 3.4Å; F7-F9 HydrophobicContact CE1-CB 4.02Å; F7-F9 HydrophobicContact CE1-CD2 4.49Å; F7-F9 HydrophobicContact CE2-CD2 4.4Å; F7-F9 HydrophobicContact CZ-CB 4.33Å; F7-F9 HydrophobicContact CZ-CD2 4.18Å; F7-V14 HydrophobicContact CE1-CG2 4.14Å; F7-V14 HydrophobicContact CZ-CG2 4.06Å; F7-L37 HydrophobicContact CE1-CD2 4.43Å; F7-L37 HydrophobicContact CE2-CD2 3.81Å; F7-L37 HydrophobicContact CZ-CD2 3.35Å; F7-P38 HydrophobicContact CB-CG 4.44Å; F7-P38 VanDerWaalsContact CD1-CD 3.43Å; F7-P38 HydrophobicContact CD1-CG 3.51Å; F7-P38 HydrophobicContact CD2-CG 4.35Å; F7-P38 HydrophobicContact CE1-CG 3.77Å; F7-P38 VanDerWaalsContact CE2-CD 3.47Å; F7-P38 HydrophobicContact CG-CG 3.84Å; F7-P38 HydrophobicContact CZ-CG 4.32Å; F7-L43 HydrophobicContact CE1-CD2 4.46Å
8	G	65	Low	69.7	Low	67 Å²	67	87.1 Å²	87.1	69%	0.691	50%	0.498	S	S	*	.			trans	-110.9	21.1	-172.2	0	0	0	0	0	115.4	S6	S6-G8 PolarHBondContact O-N 3.17Å; S6-G8 VanDerWaalsContact O-N 3.12Å
9	F	72.6	Confident	70.8	Confident	111 Å²	111	85 Å²	85	49%	0.487	48%	0.484	S	S	.	.			trans	-99.6	136.9	-178.9	-66.2	-72.7	0	0	0	112.7	F7 Q13 V14	F7-F9 HydrophobicContact CE1-CB 4.02Å; F7-F9 HydrophobicContact CE1-CD2 4.49Å; F7-F9 HydrophobicContact CE2-CD2 4.4Å; F7-F9 HydrophobicContact CZ-CB 4.33Å; F7-F9 HydrophobicContact CZ-CD2 4.18Å; F9-Q13 VanDerWaalsContact CA-OE1 3.29Å; F9-Q13 HydrophobicContact CB-CB 4.3Å; F9-Q13 HydrophobicContact CD1-CB 4.05Å; F9-V14 HydrophobicContact CB-CG2 3.72Å
10	T	85.2	Confident	72	Confident	66 Å²	66	85.2 Å²	85.2	41%	0.405	49%	0.486	S	S	.	.			trans	-73.7	165.6	167.6	81.9	0	0	0	0	111	E12 Q13 V14	T10-E12 VanDerWaalsContact C-N 3.29Å; T10-E12 VanDerWaalsContact CB-OE2 3.29Å; T10-E12 WeakPolarHBondContact CB-OE2 3.48Å; T10-E12 PolarHBondContact O-N 3.3Å; T10-E12 PolarHBondContact OG1-N 3.48Å; T10-E12 PolarHBondContact OG1-OE2 3.09Å; T10-Q13 PolarHBondContact O-N 3.09Å; T10-Q13 WeakPolarHBondContact OG1-CG 3.14Å; T10-Q13 PolarHBondContact OG1-N 3.05Å; T10-V14 WeakPolarHBondContact O-CG2 3.47Å; T10-V14 PolarHBondContact O-N 3.36Å
11	Q	84.4	Confident	73	Confident	50 Å²	50	82.2 Å²	82.2	23%	0.234	47%	0.469	C	S	.	.	H	α-helix	trans	-61.1	-39.1	179	-173.1	179.9	8	0	0	112	V14 A15 H42 L43 N46	Q11-V14 PolarHBondContact O-N 3.26Å; Q11-A15 WeakPolarHBondContact O-CB 3.37Å; Q11-A15 PolarHBondContact O-N 2.88Å; Q11-H42 PolarHBondContact OE1-CD2 3.47Å; Q11-H42 VanDerWaalsContact OE1-CD2 3.23Å; Q11-H42 PolarHBondContact OE1-NE2 3.45Å; Q11-L43 HydrophobicContact CB-CD1 4.43Å; Q11-L43 HydrophobicContact CG-CD1 4.13Å; Q11-N46 HydrophobicContact CG-CB 4.3Å; Q11-N46 PolarHBondContact NE2-ND2 3.3Å; Q11-N46 VanDerWaalsContact NE2-ND2 3.19Å
12	E	86.2	Confident	75.8	Confident	127 Å²	127	72.5 Å²	72.5	59%	0.593	42%	0.42	S	S	*	.	H	α-helix	trans	-66.3	-39.9	177.7	-57	72	-154.2	0	0	110.9	T10 A15 C16	T10-E12 VanDerWaalsContact C-N 3.29Å; T10-E12 VanDerWaalsContact CB-OE2 3.29Å; T10-E12 WeakPolarHBondContact CB-OE2 3.48Å; T10-E12 PolarHBondContact O-N 3.3Å; T10-E12 PolarHBondContact OG1-N 3.48Å; T10-E12 PolarHBondContact OG1-OE2 3.09Å; E12-A15 PolarHBondContact O-N 2.7Å; E12-C16 VanDerWaalsContact O-CB 3.29Å; E12-C16 WeakPolarHBondContact O-CB 3.43Å; E12-C16 PolarHBondContact O-N 3.49Å
13	Q	89.5	Confident	78.3	Confident	88 Å²	88	74.4 Å²	74.4	41%	0.411	42%	0.416	S	S	.	.	H	α-helix	trans	-65.5	-43.8	175.6	-68.9	172.4	-19.2	0	0	111.1	F9 T10 A15 C16 V17	F9-Q13 VanDerWaalsContact CA-OE1 3.29Å; F9-Q13 HydrophobicContact CB-CB 4.3Å; F9-Q13 HydrophobicContact CD1-CB 4.05Å; T10-Q13 PolarHBondContact O-N 3.09Å; T10-Q13 WeakPolarHBondContact OG1-CG 3.14Å; T10-Q13 PolarHBondContact OG1-N 3.05Å; Q13-A15 VanDerWaalsContact C-N 3.35Å; Q13-A15 PolarHBondContact O-N 2.74Å; Q13-C16 PolarHBondContact O-N 2.95Å; Q13-V17 VanDerWaalsContact O-CG2 3.29Å; Q13-V17 WeakPolarHBondContact O-CG2 3.4Å; Q13-V17 PolarHBondContact O-N 2.66Å
14	V	90.6	Very high	80.7	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-62.4	-43.1	175.5	175.2	0	0	0	0	111.1	F7 F9 T10 Q11 V17 C18 F33 L37 L43 V49	F7-V14 HydrophobicContact CE1-CG2 4.14Å; F7-V14 HydrophobicContact CZ-CG2 4.06Å; F9-V14 HydrophobicContact CB-CG2 3.72Å; T10-V14 WeakPolarHBondContact O-CG2 3.47Å; T10-V14 PolarHBondContact O-N 3.36Å; Q11-V14 PolarHBondContact O-N 3.26Å; V14-V17 PolarHBondContact O-N 2.91Å; V14-C18 PolarHBondContact O-N 3.42Å; V14-C18 PolarHBondContact O-SG 3.24Å; V14-F33 HydrophobicContact CB-CZ 4.4Å; V14-F33 HydrophobicContact CG1-CE1 3.91Å; V14-F33 HydrophobicContact CG1-CZ 3.98Å; V14-F33 HydrophobicContact CG2-CZ 4.31Å; V14-L37 HydrophobicContact CG1-CD1 3.99Å; V14-L37 HydrophobicContact CG1-CD2 3.81Å; V14-L37 HydrophobicContact CG2-CD2 4.2Å; V14-L43 HydrophobicContact CB-CD1 3.87Å; V14-L43 HydrophobicContact CG1-CD1 3.84Å; V14-L43 HydrophobicContact CG2-CD1 4.06Å; V14-L43 HydrophobicContact CG2-CD2 4.49Å; V14-V49 HydrophobicContact CG1-CG2 3.8Å
15	A	90	Very high	82.9	Confident	13 Å²	13	67.2 Å²	67.2	11%	0.107	41%	0.408	C	S	.	.	H	α-helix	trans	-60.4	-47.7	175.9	0	0	0	0	0	111.4	Q11 E12 Q13 V17 C18 E19	Q11-A15 WeakPolarHBondContact O-CB 3.37Å; Q11-A15 PolarHBondContact O-N 2.88Å; E12-A15 PolarHBondContact O-N 2.7Å; Q13-A15 VanDerWaalsContact C-N 3.35Å; Q13-A15 PolarHBondContact O-N 2.74Å; A15-V17 PolarHBondContact O-N 3.48Å; A15-C18 WeakPolarHBondContact O-CB 3.38Å; A15-C18 PolarHBondContact O-N 3.24Å; A15-C18 VanDerWaalsContact O-N 3.16Å; A15-E19 PolarHBondContact O-N 3.07Å
16	C	91.6	Very high	84.9	Confident	76 Å²	76	65.7 Å²	65.7	51%	0.514	39%	0.394	S	S	.	.	H	α-helix	trans	-58	-47.4	176.6	-177.4	0	0	0	0	112	E12 Q13 C18 E19 V20	E12-C16 VanDerWaalsContact O-CB 3.29Å; E12-C16 WeakPolarHBondContact O-CB 3.43Å; E12-C16 PolarHBondContact O-N 3.49Å; Q13-C16 PolarHBondContact O-N 2.95Å; C16-C18 VanDerWaalsContact C-N 3.3Å; C16-C18 PolarHBondContact O-N 2.92Å; C16-E19 PolarHBondContact O-N 3.4Å; C16-V20 WeakPolarHBondContact O-CG2 3.48Å; C16-V20 PolarHBondContact O-N 3.45Å
17	V	92.2	Very high	86.9	Confident	46 Å²	46	61.5 Å²	61.5	28%	0.279	36%	0.362	S	S	.	.	H	α-helix	trans	-60.6	-40.4	176.7	173.2	0	0	0	0	111.3	Q13 V14 A15 L21 F33	Q13-V17 VanDerWaalsContact O-CG2 3.29Å; Q13-V17 WeakPolarHBondContact O-CG2 3.4Å; Q13-V17 PolarHBondContact O-N 2.66Å; V14-V17 PolarHBondContact O-N 2.91Å; A15-V17 PolarHBondContact O-N 3.48Å; V17-L21 HydrophobicContact CG1-CD1 3.74Å; V17-L21 HydrophobicContact CG1-CG 4.22Å; V17-L21 WeakPolarHBondContact O-CB 3.44Å; V17-L21 VanDerWaalsContact O-CG 3.28Å; V17-L21 WeakPolarHBondContact O-CG 3.28Å; V17-L21 PolarHBondContact O-N 3.08Å; V17-F33 HydrophobicContact CB-CE1 3.96Å; V17-F33 HydrophobicContact CB-CZ 3.88Å; V17-F33 HydrophobicContact CG1-CD1 3.9Å; V17-F33 HydrophobicContact CG1-CD2 4.23Å; V17-F33 HydrophobicContact CG1-CE1 3.59Å; V17-F33 HydrophobicContact CG1-CE2 3.96Å; V17-F33 HydrophobicContact CG1-CG 4.2Å; V17-F33 HydrophobicContact CG1-CZ 3.62Å
18	C	92.9	Very high	88.4	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-60.5	-45.2	175.4	-71.1	0	0	0	0	111.9	V14 A15 C16 Q22 L30 A52	V14-C18 PolarHBondContact O-N 3.42Å; V14-C18 PolarHBondContact O-SG 3.24Å; A15-C18 WeakPolarHBondContact O-CB 3.38Å; A15-C18 PolarHBondContact O-N 3.24Å; A15-C18 VanDerWaalsContact O-N 3.16Å; C16-C18 VanDerWaalsContact C-N 3.3Å; C16-C18 PolarHBondContact O-N 2.92Å; C18-Q22 WeakPolarHBondContact O-CB 3.46Å; C18-Q22 WeakPolarHBondContact O-CG 3.47Å; C18-Q22 PolarHBondContact O-N 3.14Å; C18-Q22 VanDerWaalsContact O-N 3.1Å; C18-Q22 PolarHBondContact O-NE2 2.96Å; C18-L30 HydrophobicContact CB-CD1 4.46Å; C18-A52 HydrophobicContact CB-CB 3.94Å
19	E	91.1	Very high	89.7	Confident	47 Å²	47	66.6 Å²	66.6	22%	0.22	36%	0.361	C	S	.	.	H	α-helix	trans	-65.4	-46.8	179	-66.7	-55	128	0	0	111.9	A15 C16 L21 Q22 Q23 K51	A15-E19 PolarHBondContact O-N 3.07Å; C16-E19 PolarHBondContact O-N 3.4Å; E19-L21 PolarHBondContact O-N 3.41Å; E19-Q22 PolarHBondContact O-N 3.21Å; E19-Q22 PolarHBondContact OE1-NE2 3.09Å; E19-Q23 WeakPolarHBondContact O-CG 3.43Å; E19-Q23 PolarHBondContact O-N 3.31Å; E19-K51 WeakPolarHBondContact OE1-CE 3.37Å; E19-K51 IonicContact OE1-NZ 2.69Å; E19-K51 PolarHBondContact OE1-NZ 3.43Å; E19-K51 IonicContact OE2-NZ 3.17Å; E19-K51 PolarHBondContact OE2-NZ 2.88Å
20	V	94.2	Very high	90.7	Very high	88 Å²	88	61.3 Å²	61.3	53%	0.533	34%	0.338	S	S	.	.	H	α-helix	trans	-61.7	-45.2	-179.7	172.3	0	0	0	0	111.4	C16 Q22 Q23 G24	C16-V20 WeakPolarHBondContact O-CG2 3.48Å; C16-V20 PolarHBondContact O-N 3.45Å; V20-Q22 VanDerWaalsContact C-N 3.32Å; V20-Q22 PolarHBondContact O-N 2.87Å; V20-Q23 PolarHBondContact O-N 3.35Å; V20-G24 PolarHBondContact O-N 3.31Å
21	L	93	Very high	91	Very high	23 Å²	23	58.3 Å²	58.3	12%	0.12	32%	0.32	C	S	.	.	H	α-helix	trans	-66.9	-33.5	178.8	-71.1	177	0	0	0	112.5	V17 E19 G25 N26 R29 L30 F33	V17-L21 HydrophobicContact CG1-CD1 3.74Å; V17-L21 HydrophobicContact CG1-CG 4.22Å; V17-L21 WeakPolarHBondContact O-CB 3.44Å; V17-L21 VanDerWaalsContact O-CG 3.28Å; V17-L21 WeakPolarHBondContact O-CG 3.28Å; V17-L21 PolarHBondContact O-N 3.08Å; E19-L21 PolarHBondContact O-N 3.41Å; L21-G25 PolarHBondContact O-N 3.21Å; L21-N26 PolarHBondContact O-N 3.35Å; L21-R29 HydrophobicContact CD2-CB 4.43Å; L21-R29 HydrophobicContact CD2-CG 4.15Å; L21-L30 HydrophobicContact CB-CB 4.18Å; L21-L30 HydrophobicContact CB-CD1 4.01Å; L21-L30 HydrophobicContact CD1-CB 4.39Å; L21-L30 HydrophobicContact CD1-CD1 4.09Å; L21-F33 HydrophobicContact CD1-CB 4.26Å; L21-F33 HydrophobicContact CD1-CD1 4.45Å; L21-F33 HydrophobicContact CD1-CG 4.45Å
22	Q	91.2	Very high	91.5	Very high	32 Å²	32	63.5 Å²	63.5	15%	0.15	34%	0.338	C	S	.	.	H	α-helix	trans	-67.9	-45.8	173.5	-76.9	172.4	90	0	0	111.7	C18 E19 V20 G24 G25 L30	C18-Q22 WeakPolarHBondContact O-CB 3.46Å; C18-Q22 WeakPolarHBondContact O-CG 3.47Å; C18-Q22 PolarHBondContact O-N 3.14Å; C18-Q22 VanDerWaalsContact O-N 3.1Å; C18-Q22 PolarHBondContact O-NE2 2.96Å; E19-Q22 PolarHBondContact O-N 3.21Å; E19-Q22 PolarHBondContact OE1-NE2 3.09Å; V20-Q22 VanDerWaalsContact C-N 3.32Å; V20-Q22 PolarHBondContact O-N 2.87Å; Q22-G24 VanDerWaalsContact C-N 3.33Å; Q22-G24 PolarHBondContact O-N 3.1Å; Q22-G25 PolarHBondContact O-N 2.96Å; Q22-G25 VanDerWaalsContact O-N 3.15Å; Q22-L30 HydrophobicContact CG-CD2 3.51Å
23	Q	91	Very high	91.8	Very high	158 Å²	158	58.8 Å²	58.8	74%	0.738	32%	0.315	S	S	*	.	H	α-helix	trans	-64.3	-38.7	178.5	-71	176.7	16.6	0	0	111.9	E19 V20 G25	E19-Q23 WeakPolarHBondContact O-CG 3.43Å; E19-Q23 PolarHBondContact O-N 3.31Å; V20-Q23 PolarHBondContact O-N 3.35Å; Q23-G25 PolarHBondContact O-N 3.22Å
24	G	89.6	Confident	91.9	Very high	64 Å²	64	55.4 Å²	55.4	66%	0.66	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-1.5	175.2	0	0	0	0	0	114.9	V20 Q22 N26	V20-G24 PolarHBondContact O-N 3.31Å; Q22-G24 VanDerWaalsContact C-N 3.33Å; Q22-G24 PolarHBondContact O-N 3.1Å; G24-N26 PolarHBondContact O-N 3.16Å; G24-N26 VanDerWaalsContact O-N 3.15Å
25	G	89.4	Confident	91.8	Very high	53 Å²	53	65.3 Å²	65.3	55%	0.546	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	9.9	178.2	0	0	0	0	0	115.3	L21 Q22 Q23 L27	L21-G25 PolarHBondContact O-N 3.21Å; Q22-G25 PolarHBondContact O-N 2.96Å; Q22-G25 VanDerWaalsContact O-N 3.15Å; Q23-G25 PolarHBondContact O-N 3.22Å; G25-L27 VanDerWaalsContact C-N 3.3Å; G25-L27 PolarHBondContact O-N 3.01Å
26	N	91.1	Very high	91.8	Very high	76 Å²	76	66.6 Å²	66.6	41%	0.406	35%	0.346	S	S	.	.			trans	-87.8	68.7	-176	-160.1	-33.1	0	0	0	111.3	L21 G24 E28 R29 L30	L21-N26 PolarHBondContact O-N 3.35Å; G24-N26 PolarHBondContact O-N 3.16Å; G24-N26 VanDerWaalsContact O-N 3.15Å; N26-E28 VanDerWaalsContact C-N 3.3Å; N26-E28 PolarHBondContact O-N 3.06Å; N26-R29 HydrophobicContact CB-CB 4.34Å; N26-R29 PolarHBondContact O-N 3.26Å; N26-R29 WeakPolarHBondContact OD1-CB 3.33Å; N26-R29 PolarHBondContact OD1-N 3.39Å; N26-L30 PolarHBondContact O-N 3.48Å
27	L	92.3	Very high	91.6	Very high	36 Å²	36	63.6 Å²	63.6	19%	0.188	33%	0.325	C	S	.	.	H	α-helix	trans	-67.5	-28.6	-172.2	-57.5	-175.5	0	0	0	113.3	G25 L30 G31 V55 H59	G25-L27 VanDerWaalsContact C-N 3.3Å; G25-L27 PolarHBondContact O-N 3.01Å; L27-L30 HydrophobicContact CD2-CD2 4.26Å; L27-L30 PolarHBondContact O-N 3.35Å; L27-G31 PolarHBondContact O-N 2.85Å; L27-V55 HydrophobicContact CD1-CG1 4.24Å; L27-V55 HydrophobicContact CD2-CG1 3.58Å; L27-H59 HydrophobicContact CD1-CB 3.88Å
28	E	93.1	Very high	91.2	Very high	84 Å²	84	63.8 Å²	63.8	39%	0.393	33%	0.327	S	S	.	.	H	α-helix	trans	-70	-38.8	175.6	-72.3	-55.3	134.1	0	0	112.4	N26 R32 H59	N26-E28 VanDerWaalsContact C-N 3.3Å; N26-E28 PolarHBondContact O-N 3.06Å; E28-R32 PolarHBondContact O-N 3.37Å; E28-R32 PolarHBondContact O-NH1 2.93Å; E28-R32 VanDerWaalsContact O-NH1 3.08Å; E28-H59 IonicContact OE1-CE1 3.93Å; E28-H59 PolarHBondContact OE1-CE1 3.43Å; E28-H59 IonicContact OE1-ND1 3.66Å; E28-H59 PolarHBondContact OE1-ND1 2.96Å
29	R	92.5	Very high	90.4	Very high	160 Å²	160	68.8 Å²	68.8	60%	0.604	37%	0.368	S	S	*	.	H	α-helix	trans	-70.3	-39.6	173.3	-171.3	172.2	-176.8	171.5	0.9	111	L21 N26 G31 R32 F33	L21-R29 HydrophobicContact CD2-CB 4.43Å; L21-R29 HydrophobicContact CD2-CG 4.15Å; N26-R29 HydrophobicContact CB-CB 4.34Å; N26-R29 PolarHBondContact O-N 3.26Å; N26-R29 WeakPolarHBondContact OD1-CB 3.33Å; N26-R29 PolarHBondContact OD1-N 3.39Å; R29-G31 VanDerWaalsContact C-N 3.33Å; R29-G31 PolarHBondContact O-N 2.94Å; R29-R32 PolarHBondContact O-N 3.07Å; R29-F33 WeakPolarHBondContact O-CB 3.28Å; R29-F33 PolarHBondContact O-N 3.49Å
30	L	93.4	Very high	89.7	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-58.2	-45.4	173.6	-176.7	60	0	0	0	111.7	C18 L21 Q22 N26 L27 R32 F33 L34 A52 V56	C18-L30 HydrophobicContact CB-CD1 4.46Å; L21-L30 HydrophobicContact CB-CB 4.18Å; L21-L30 HydrophobicContact CB-CD1 4.01Å; L21-L30 HydrophobicContact CD1-CB 4.39Å; L21-L30 HydrophobicContact CD1-CD1 4.09Å; Q22-L30 HydrophobicContact CG-CD2 3.51Å; N26-L30 PolarHBondContact O-N 3.48Å; L27-L30 HydrophobicContact CD2-CD2 4.26Å; L27-L30 PolarHBondContact O-N 3.35Å; L30-R32 VanDerWaalsContact C-N 3.34Å; L30-R32 PolarHBondContact O-N 3.29Å; L30-F33 PolarHBondContact O-N 3.05Å; L30-L34 HydrophobicContact CD1-CD1 4.4Å; L30-L34 HydrophobicContact CD1-CG 4.29Å; L30-L34 HydrophobicContact CG-CD1 4.13Å; L30-L34 HydrophobicContact CG-CG 4.46Å; L30-L34 WeakPolarHBondContact O-CB 3.3Å; L30-L34 VanDerWaalsContact O-CG 3.29Å; L30-L34 WeakPolarHBondContact O-CG 3.48Å; L30-L34 PolarHBondContact O-N 3.07Å; L30-A52 HydrophobicContact CD1-CB 3.98Å; L30-A52 HydrophobicContact CD2-CB 4.04Å; L30-A52 HydrophobicContact CG-CB 4.31Å; L30-V56 HydrophobicContact CB-CG2 4.18Å; L30-V56 HydrophobicContact CD2-CG2 3.81Å; L30-V56 HydrophobicContact CG-CG2 3.79Å
31	G	92.8	Very high	88.9	Confident	3 Å²	3	71.2 Å²	71.2	3%	0.031	38%	0.383	C	S	.	.	H	α-helix	trans	-61.6	-38.4	177.7	0	0	0	0	0	113.6	L27 R29 W35	L27-G31 PolarHBondContact O-N 2.85Å; R29-G31 VanDerWaalsContact C-N 3.33Å; R29-G31 PolarHBondContact O-N 2.94Å; G31-W35 PolarHBondContact O-N 3.1Å
32	R	93.2	Very high	88.2	Confident	160 Å²	160	76 Å²	76	60%	0.604	41%	0.405	S	S	*	.	H	α-helix	trans	-69.6	-42.5	174.5	-69.7	-178.1	-173.8	85.5	-5.2	112	E28 R29 L30 W35 S36	E28-R32 PolarHBondContact O-N 3.37Å; E28-R32 PolarHBondContact O-NH1 2.93Å; E28-R32 VanDerWaalsContact O-NH1 3.08Å; R29-R32 PolarHBondContact O-N 3.07Å; L30-R32 VanDerWaalsContact C-N 3.34Å; L30-R32 PolarHBondContact O-N 3.29Å; R32-W35 PolarHBondContact O-N 3.1Å; R32-S36 PolarHBondContact O-N 3.28Å
33	F	92.3	Very high	87.8	Confident	27 Å²	27	75.1 Å²	75.1	12%	0.118	40%	0.401	C	S	.	.	H	α-helix	trans	-59.5	-48.6	176.8	176.1	-111.1	0	0	0	111.2	V14 V17 L21 R29 L30 W35 S36 L37	V14-F33 HydrophobicContact CB-CZ 4.4Å; V14-F33 HydrophobicContact CG1-CE1 3.91Å; V14-F33 HydrophobicContact CG1-CZ 3.98Å; V14-F33 HydrophobicContact CG2-CZ 4.31Å; V17-F33 HydrophobicContact CB-CE1 3.96Å; V17-F33 HydrophobicContact CB-CZ 3.88Å; V17-F33 HydrophobicContact CG1-CD1 3.9Å; V17-F33 HydrophobicContact CG1-CD2 4.23Å; V17-F33 HydrophobicContact CG1-CE1 3.59Å; V17-F33 HydrophobicContact CG1-CE2 3.96Å; V17-F33 HydrophobicContact CG1-CG 4.2Å; V17-F33 HydrophobicContact CG1-CZ 3.62Å; L21-F33 HydrophobicContact CD1-CB 4.26Å; L21-F33 HydrophobicContact CD1-CD1 4.45Å; L21-F33 HydrophobicContact CD1-CG 4.45Å; R29-F33 WeakPolarHBondContact O-CB 3.28Å; R29-F33 PolarHBondContact O-N 3.49Å; L30-F33 PolarHBondContact O-N 3.05Å; F33-W35 VanDerWaalsContact C-N 3.26Å; F33-W35 PolarHBondContact O-N 3.32Å; F33-S36 PolarHBondContact O-N 3.12Å; F33-S36 PolarHBondContact O-OG 2.61Å; F33-L37 HydrophobicContact CE1-CD2 4.02Å; F33-L37 HydrophobicContact CE2-CD2 4.12Å; F33-L37 HydrophobicContact CZ-CD2 3.8Å; F33-L37 WeakPolarHBondContact O-CG 3.45Å; F33-L37 PolarHBondContact O-N 2.69Å
34	L	91.6	Very high	87.5	Confident	17 Å²	17	70.2 Å²	70.2	9%	0.089	38%	0.378	C	S	.	.	H	α-helix	trans	-59.9	-35.1	176.9	-70.8	173.4	0	0	0	113	L30 L37 V49 A52 K53 V56	L30-L34 HydrophobicContact CD1-CD1 4.4Å; L30-L34 HydrophobicContact CD1-CG 4.29Å; L30-L34 HydrophobicContact CG-CD1 4.13Å; L30-L34 HydrophobicContact CG-CG 4.46Å; L30-L34 WeakPolarHBondContact O-CB 3.3Å; L30-L34 VanDerWaalsContact O-CG 3.29Å; L30-L34 WeakPolarHBondContact O-CG 3.48Å; L30-L34 PolarHBondContact O-N 3.07Å; L34-L37 HydrophobicContact CD2-CD1 3.92Å; L34-V49 HydrophobicContact CD2-CG1 3.98Å; L34-A52 HydrophobicContact CD1-CB 4.06Å; L34-A52 HydrophobicContact CD2-CB 4.18Å; L34-K53 HydrophobicContact CD1-CG 3.87Å; L34-K53 HydrophobicContact CD2-CG 4.18Å; L34-V56 HydrophobicContact CD1-CB 4.38Å; L34-V56 HydrophobicContact CD1-CG2 3.9Å
35	W	90.3	Very high	87.3	Confident	209 Å²	209	73.9 Å²	73.9	79%	0.792	38%	0.376	S	S	*	.	H	α-helix	trans	-72	-29.4	175.8	-175.2	81.2	0	0	0	112.8	G31 R32 F33 L37	G31-W35 PolarHBondContact O-N 3.1Å; R32-W35 PolarHBondContact O-N 3.1Å; F33-W35 VanDerWaalsContact C-N 3.26Å; F33-W35 PolarHBondContact O-N 3.32Å; W35-L37 VanDerWaalsContact C-N 3.3Å; W35-L37 PolarHBondContact O-N 3.44Å
36	S	89.5	Confident	87.3	Confident	39 Å²	39	72.8 Å²	72.8	27%	0.273	36%	0.357	S	S	.	.	H	α-helix	trans	-79.5	-7.3	177	70	0	0	0	0	114.5	R32 F33	R32-S36 PolarHBondContact O-N 3.28Å; F33-S36 PolarHBondContact O-N 3.12Å; F33-S36 PolarHBondContact O-OG 2.61Å
37	L	87.4	Confident	87.4	Confident	14 Å²	14	71 Å²	71	7%	0.073	35%	0.347	C	S	.	.	S	Bend	trans	-67.9	141.3	179.4	-61.3	-177	0	0	0	110.8	F7 V14 F33 L34 W35 L43 V49	F7-L37 HydrophobicContact CE1-CD2 4.43Å; F7-L37 HydrophobicContact CE2-CD2 3.81Å; F7-L37 HydrophobicContact CZ-CD2 3.35Å; V14-L37 HydrophobicContact CG1-CD1 3.99Å; V14-L37 HydrophobicContact CG1-CD2 3.81Å; V14-L37 HydrophobicContact CG2-CD2 4.2Å; F33-L37 HydrophobicContact CE1-CD2 4.02Å; F33-L37 HydrophobicContact CE2-CD2 4.12Å; F33-L37 HydrophobicContact CZ-CD2 3.8Å; F33-L37 WeakPolarHBondContact O-CG 3.45Å; F33-L37 PolarHBondContact O-N 2.69Å; L34-L37 HydrophobicContact CD2-CD1 3.92Å; W35-L37 VanDerWaalsContact C-N 3.3Å; W35-L37 PolarHBondContact O-N 3.44Å; L37-L43 HydrophobicContact CB-CD2 4.15Å; L37-L43 HydrophobicContact CD1-CD2 4.26Å; L37-L43 HydrophobicContact CD2-CD2 4.3Å; L37-L43 HydrophobicContact CG-CD2 4.46Å; L37-V49 HydrophobicContact CD1-CG1 4.05Å
38	P	84.3	Confident	87.4	Confident	50 Å²	50	70.4 Å²	70.4	33%	0.325	35%	0.346	S	S	.	.			trans	-67.9	153.2	177.1	30.6	-36.1	0	0	0	110.2	F7 C40 L43 H44	F7-P38 HydrophobicContact CB-CG 4.44Å; F7-P38 VanDerWaalsContact CD1-CD 3.43Å; F7-P38 HydrophobicContact CD1-CG 3.51Å; F7-P38 HydrophobicContact CD2-CG 4.35Å; F7-P38 HydrophobicContact CE1-CG 3.77Å; F7-P38 VanDerWaalsContact CE2-CD 3.47Å; F7-P38 HydrophobicContact CG-CG 3.84Å; F7-P38 HydrophobicContact CZ-CG 4.32Å; P38-C40 PolarHBondContact O-N 2.83Å; P38-L43 HydrophobicContact CG-CD2 4.24Å; P38-H44 PolarHBondContact O-CE1 3.25Å
39	A	75.1	Confident	87.5	Confident	104 Å²	104	66.4 Å²	66.4	86%	0.86	33%	0.327	S	S	*	.			trans	-73	59.4	177.1	0	0	0	0	0	112.2
40	C	76.9	Confident	87.6	Confident	62 Å²	62	59.3 Å²	59.3	42%	0.419	30%	0.301	S	S	.	.			trans	-99.9	118.7	173.6	-179.1	0	0	0	0	109.4	P38 H42 L43 H44	P38-C40 PolarHBondContact O-N 2.83Å; C40-H42 VanDerWaalsContact C-N 3.28Å; C40-H42 PolarHBondContact O-N 3.1Å; C40-L43 HydrophobicContact CB-CB 4.15Å; C40-L43 WeakPolarHBondContact O-CB 3.36Å; C40-L43 PolarHBondContact O-N 3.5Å; C40-H44 PolarHBondContact O-N 3.4Å; C40-H44 VanDerWaalsContact O-N 3.15Å; C40-H44 PolarHBondContact O-ND1 3.43Å
41	D	77.1	Confident	87.7	Confident	124 Å²	124	60.1 Å²	60.1	66%	0.663	31%	0.305	S	S	*	.	H	α-helix	trans	-58.5	-37.7	-177.3	-73	-19.1	0	0	0	113.1	L43 H44 K45	D41-L43 PolarHBondContact O-N 3.36Å; D41-H44 PolarHBondContact O-N 3.32Å; D41-K45 WeakPolarHBondContact O-CG 3.45Å; D41-K45 PolarHBondContact O-N 2.84Å; D41-K45 VanDerWaalsContact O-N 3.1Å
42	H	78.6	Confident	87.9	Confident	125 Å²	125	60 Å²	60	58%	0.579	30%	0.303	S	S	*	.	H	α-helix	trans	-67.4	-38.4	-178.6	-162.6	74.8	0	0	0	112	Q11 C40 H44 K45 N46	Q11-H42 PolarHBondContact OE1-CD2 3.47Å; Q11-H42 VanDerWaalsContact OE1-CD2 3.23Å; Q11-H42 PolarHBondContact OE1-NE2 3.45Å; C40-H42 VanDerWaalsContact C-N 3.28Å; C40-H42 PolarHBondContact O-N 3.1Å; H42-H44 VanDerWaalsContact C-N 3.32Å; H42-K45 PolarHBondContact O-N 3.08Å; H42-N46 PolarHBondContact O-N 2.9Å
43	L	83.1	Confident	88	Confident	13 Å²	13	54.7 Å²	54.7	7%	0.068	29%	0.285	C	S	.	.	H	α-helix	trans	-65.4	-39.1	174.5	-174.2	63.3	0	0	0	111.5	F7 Q11 V14 L37 P38 C40 D41 K45 N46 V49	F7-L43 HydrophobicContact CE1-CD2 4.46Å; Q11-L43 HydrophobicContact CB-CD1 4.43Å; Q11-L43 HydrophobicContact CG-CD1 4.13Å; V14-L43 HydrophobicContact CB-CD1 3.87Å; V14-L43 HydrophobicContact CG1-CD1 3.84Å; V14-L43 HydrophobicContact CG2-CD1 4.06Å; V14-L43 HydrophobicContact CG2-CD2 4.49Å; L37-L43 HydrophobicContact CB-CD2 4.15Å; L37-L43 HydrophobicContact CD1-CD2 4.26Å; L37-L43 HydrophobicContact CD2-CD2 4.3Å; L37-L43 HydrophobicContact CG-CD2 4.46Å; P38-L43 HydrophobicContact CG-CD2 4.24Å; C40-L43 HydrophobicContact CB-CB 4.15Å; C40-L43 WeakPolarHBondContact O-CB 3.36Å; C40-L43 PolarHBondContact O-N 3.5Å; D41-L43 PolarHBondContact O-N 3.36Å; L43-K45 VanDerWaalsContact C-N 3.26Å; L43-K45 PolarHBondContact O-N 3.33Å; L43-N46 VanDerWaalsContact O-CB 3.28Å; L43-N46 WeakPolarHBondContact O-CB 3.47Å; L43-N46 PolarHBondContact O-N 2.88Å; L43-V49 HydrophobicContact CD1-CG2 4.45Å
44	H	83.4	Confident	88.2	Confident	54 Å²	54	53.4 Å²	53.4	25%	0.25	28%	0.279	C	S	.	.	H	α-helix	trans	-73.1	-19.5	-177.6	-76.4	56.4	0	0	0	113.4	P38 C40 D41 H42 L50 K53	P38-H44 PolarHBondContact O-CE1 3.25Å; C40-H44 PolarHBondContact O-N 3.4Å; C40-H44 VanDerWaalsContact O-N 3.15Å; C40-H44 PolarHBondContact O-ND1 3.43Å; D41-H44 PolarHBondContact O-N 3.32Å; H42-H44 VanDerWaalsContact C-N 3.32Å; H44-L50 VanDerWaalsContact O-CD2 3.29Å; H44-L50 WeakPolarHBondContact O-CD2 3.27Å; H44-L50 WeakPolarHBondContact O-CG 3.42Å; H44-K53 PolarHBondContact CD2-NZ 2.99Å; H44-K53 PolarHBondContact NE2-NZ 3.16Å
45	K	85.3	Confident	88.4	Confident	141 Å²	141	53.3 Å²	53.3	61%	0.613	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-7.2	172.8	-69.9	173	-176.9	179.1	0	113.3	D41 H42 L43 E47	D41-K45 WeakPolarHBondContact O-CG 3.45Å; D41-K45 PolarHBondContact O-N 2.84Å; D41-K45 VanDerWaalsContact O-N 3.1Å; H42-K45 PolarHBondContact O-N 3.08Å; L43-K45 VanDerWaalsContact C-N 3.26Å; L43-K45 PolarHBondContact O-N 3.33Å; K45-E47 PolarHBondContact O-N 3.08Å
46	N	90.2	Very high	88.8	Confident	30 Å²	30	43.8 Å²	43.8	16%	0.16	24%	0.244	C	C	.	.			trans	-64.4	131.6	176.9	-172.9	-81.4	0	0	0	110.4	Q11 H42 L43 S48 V49 L50	Q11-N46 HydrophobicContact CG-CB 4.3Å; Q11-N46 PolarHBondContact NE2-ND2 3.3Å; Q11-N46 VanDerWaalsContact NE2-ND2 3.19Å; H42-N46 PolarHBondContact O-N 2.9Å; L43-N46 VanDerWaalsContact O-CB 3.28Å; L43-N46 WeakPolarHBondContact O-CB 3.47Å; L43-N46 PolarHBondContact O-N 2.88Å; N46-S48 VanDerWaalsContact C-N 3.31Å; N46-S48 PolarHBondContact O-N 2.86Å; N46-S48 WeakPolarHBondContact OD1-CB 3.18Å; N46-S48 PolarHBondContact OD1-N 3.41Å; N46-V49 HydrophobicContact CB-CB 4.27Å; N46-V49 HydrophobicContact CB-CG2 4.02Å; N46-V49 PolarHBondContact O-N 3.21Å; N46-V49 VanDerWaalsContact O-N 3.14Å; N46-L50 WeakPolarHBondContact O-CG 3.32Å; N46-L50 PolarHBondContact O-N 2.79Å
47	E	92.8	Very high	89.1	Confident	38 Å²	38	42.3 Å²	42.3	18%	0.178	23%	0.234	C	C	.	.	H	α-helix	trans	-61.4	-38.1	-174.1	-156.7	-174.8	160	0	0	113.1	K45 V49 L50 K51 F75 S76 N79	K45-E47 PolarHBondContact O-N 3.08Å; E47-V49 VanDerWaalsContact C-N 3.33Å; E47-V49 PolarHBondContact O-N 3.07Å; E47-L50 PolarHBondContact O-N 3.48Å; E47-K51 VanDerWaalsContact O-CB 3.29Å; E47-K51 WeakPolarHBondContact O-CB 3.41Å; E47-K51 PolarHBondContact O-N 3.36Å; E47-F75 HydrophobicContact CG-CD1 3.48Å; E47-F75 VanDerWaalsContact CG-CD1 3.48Å; E47-F75 HydrophobicContact CG-CE1 4.02Å; E47-F75 HydrophobicContact CG-CG 4.41Å; E47-F75 VanDerWaalsContact OE1-CA 3.3Å; E47-F75 WeakPolarHBondContact OE1-CA 3.38Å; E47-F75 WeakPolarHBondContact OE1-CB 3.46Å; E47-S76 WeakPolarHBondContact OE1-CB 3.41Å; E47-S76 PolarHBondContact OE1-N 3.45Å; E47-S76 VanDerWaalsContact OE2-CB 3.29Å; E47-S76 WeakPolarHBondContact OE2-CB 3.47Å; E47-S76 PolarHBondContact OE2-OG 3.23Å; E47-N79 PolarHBondContact OE1-ND2 3.48Å
48	S	93.4	Very high	89.6	Confident	25 Å²	25	44.2 Å²	44.2	18%	0.175	24%	0.242	C	C	.	.	H	α-helix	trans	-65.8	-38.4	178.5	-52.9	0	0	0	0	111.4	N46 A52	N46-S48 VanDerWaalsContact C-N 3.31Å; N46-S48 PolarHBondContact O-N 2.86Å; N46-S48 WeakPolarHBondContact OD1-CB 3.18Å; N46-S48 PolarHBondContact OD1-N 3.41Å; S48-A52 VanDerWaalsContact O-CB 3.31Å; S48-A52 WeakPolarHBondContact O-CB 3.45Å; S48-A52 PolarHBondContact O-N 3.18Å
49	V	94.1	Very high	90.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-69.4	-44	176.5	177.7	0	0	0	0	110.6	V14 L34 L37 L43 N46 E47 A52 K53	V14-V49 HydrophobicContact CG1-CG2 3.8Å; L34-V49 HydrophobicContact CD2-CG1 3.98Å; L37-V49 HydrophobicContact CD1-CG1 4.05Å; L43-V49 HydrophobicContact CD1-CG2 4.45Å; N46-V49 HydrophobicContact CB-CB 4.27Å; N46-V49 HydrophobicContact CB-CG2 4.02Å; N46-V49 PolarHBondContact O-N 3.21Å; N46-V49 VanDerWaalsContact O-N 3.14Å; E47-V49 VanDerWaalsContact C-N 3.33Å; E47-V49 PolarHBondContact O-N 3.07Å; V49-A52 PolarHBondContact O-N 3.04Å; V49-K53 HydrophobicContact CG1-CD 4.33Å; V49-K53 WeakPolarHBondContact O-CG 3.41Å; V49-K53 PolarHBondContact O-N 2.99Å
50	L	95.3	Very high	91.1	Very high	10 Å²	10	48.5 Å²	48.5	5%	0.052	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-44.5	176.3	-72.2	169.3	0	0	0	111.5	H44 N46 E47 K53 A54 I69 H73 F75	H44-L50 VanDerWaalsContact O-CD2 3.29Å; H44-L50 WeakPolarHBondContact O-CD2 3.27Å; H44-L50 WeakPolarHBondContact O-CG 3.42Å; N46-L50 WeakPolarHBondContact O-CG 3.32Å; N46-L50 PolarHBondContact O-N 2.79Å; E47-L50 PolarHBondContact O-N 3.48Å; L50-K53 PolarHBondContact O-N 3.3Å; L50-A54 PolarHBondContact O-N 2.96Å; L50-I69 HydrophobicContact CB-CG2 4.42Å; L50-I69 HydrophobicContact CD2-CG2 4.36Å; L50-H73 HydrophobicContact CD1-CB 3.82Å; L50-F75 HydrophobicContact CB-CE1 3.91Å; L50-F75 HydrophobicContact CB-CZ 4.01Å
51	K	95.4	Very high	91.9	Very high	17 Å²	17	47.5 Å²	47.5	7%	0.074	23%	0.234	C	C	.	.	H	α-helix	trans	-59.5	-47.2	174.3	-178.5	176.3	70.8	-177.2	0	111.3	E19 E47 K53 A54 V55 N79 L83	E19-K51 WeakPolarHBondContact OE1-CE 3.37Å; E19-K51 IonicContact OE1-NZ 2.69Å; E19-K51 PolarHBondContact OE1-NZ 3.43Å; E19-K51 IonicContact OE2-NZ 3.17Å; E19-K51 PolarHBondContact OE2-NZ 2.88Å; E47-K51 VanDerWaalsContact O-CB 3.29Å; E47-K51 WeakPolarHBondContact O-CB 3.41Å; E47-K51 PolarHBondContact O-N 3.36Å; K51-K53 VanDerWaalsContact C-N 3.34Å; K51-K53 PolarHBondContact O-N 3.49Å; K51-A54 WeakPolarHBondContact O-CB 3.37Å; K51-A54 PolarHBondContact O-N 3.03Å; K51-V55 WeakPolarHBondContact O-CG2 3.29Å; K51-V55 PolarHBondContact O-N 3.12Å; K51-N79 HydrophobicContact CD-CB 4.39Å; K51-N79 WeakPolarHBondContact CD-OD1 3.41Å; K51-N79 PolarHBondContact NZ-OD1 3.3Å; K51-L83 HydrophobicContact CB-CD2 4.49Å; K51-L83 HydrophobicContact CG-CD2 3.97Å
52	A	95.9	Very high	92.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60	-42.4	176.3	0	0	0	0	0	112.5	C18 L30 L34 S48 V49 V55 V56	C18-A52 HydrophobicContact CB-CB 3.94Å; L30-A52 HydrophobicContact CD1-CB 3.98Å; L30-A52 HydrophobicContact CD2-CB 4.04Å; L30-A52 HydrophobicContact CG-CB 4.31Å; L34-A52 HydrophobicContact CD1-CB 4.06Å; L34-A52 HydrophobicContact CD2-CB 4.18Å; S48-A52 VanDerWaalsContact O-CB 3.31Å; S48-A52 WeakPolarHBondContact O-CB 3.45Å; S48-A52 PolarHBondContact O-N 3.18Å; V49-A52 PolarHBondContact O-N 3.04Å; A52-V55 PolarHBondContact O-N 2.84Å; A52-V56 WeakPolarHBondContact O-CG2 3.48Å; A52-V56 PolarHBondContact O-N 3.4Å
53	K	95.6	Very high	93.8	Very high	50 Å²	50	41 Å²	41	22%	0.217	20%	0.201	C	C	.	.	H	α-helix	trans	-61	-43.6	174.4	-75	177	177.2	-176.3	0	111.9	L34 H44 V49 L50 K51 V55 V56 A57 I69	L34-K53 HydrophobicContact CD1-CG 3.87Å; L34-K53 HydrophobicContact CD2-CG 4.18Å; H44-K53 PolarHBondContact CD2-NZ 2.99Å; H44-K53 PolarHBondContact NE2-NZ 3.16Å; V49-K53 HydrophobicContact CG1-CD 4.33Å; V49-K53 WeakPolarHBondContact O-CG 3.41Å; V49-K53 PolarHBondContact O-N 2.99Å; L50-K53 PolarHBondContact O-N 3.3Å; K51-K53 VanDerWaalsContact C-N 3.34Å; K51-K53 PolarHBondContact O-N 3.49Å; K53-V55 PolarHBondContact O-N 2.9Å; K53-V56 PolarHBondContact O-N 2.9Å; K53-A57 VanDerWaalsContact O-CB 3.31Å; K53-A57 WeakPolarHBondContact O-CB 3.3Å; K53-A57 PolarHBondContact O-N 3.44Å; K53-I69 HydrophobicContact CB-CD1 3.78Å
54	A	97.2	Very high	94.4	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.1	-45.2	175.4	0	0	0	0	0	111.6	L50 K51 V56 A57 F58 L66 I69 L70 L83 L86	L50-A54 PolarHBondContact O-N 2.96Å; K51-A54 WeakPolarHBondContact O-CB 3.37Å; K51-A54 PolarHBondContact O-N 3.03Å; A54-V56 PolarHBondContact O-N 3.42Å; A54-A57 PolarHBondContact O-N 2.93Å; A54-F58 PolarHBondContact O-N 3.48Å; A54-L66 HydrophobicContact CB-CD1 3.71Å; A54-I69 HydrophobicContact CB-CG2 4.13Å; A54-L70 HydrophobicContact CB-CD2 4.2Å; A54-L83 HydrophobicContact CB-CD2 4.45Å; A54-L86 HydrophobicContact CB-CD1 4.4Å
55	V	96.6	Very high	95.1	Very high	14 Å²	14	51.6 Å²	51.6	9%	0.085	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-45.2	176.8	173.7	0	0	0	0	111.5	L27 K51 A52 K53 F58 H59 L86	L27-V55 HydrophobicContact CD1-CG1 4.24Å; L27-V55 HydrophobicContact CD2-CG1 3.58Å; K51-V55 WeakPolarHBondContact O-CG2 3.29Å; K51-V55 PolarHBondContact O-N 3.12Å; A52-V55 PolarHBondContact O-N 2.84Å; K53-V55 PolarHBondContact O-N 2.9Å; V55-F58 PolarHBondContact O-N 2.92Å; V55-H59 PolarHBondContact O-N 3.44Å; V55-L86 HydrophobicContact CG2-CD1 3.85Å
56	V	96.8	Very high	95.6	Very high	9 Å²	9	44.9 Å²	44.9	6%	0.055	21%	0.212	C	C	.	.	H	α-helix	trans	-66.4	-40.1	178.3	171.2	0	0	0	0	111.5	L30 L34 A52 K53 A54 F58 H59 R60	L30-V56 HydrophobicContact CB-CG2 4.18Å; L30-V56 HydrophobicContact CD2-CG2 3.81Å; L30-V56 HydrophobicContact CG-CG2 3.79Å; L34-V56 HydrophobicContact CD1-CB 4.38Å; L34-V56 HydrophobicContact CD1-CG2 3.9Å; A52-V56 WeakPolarHBondContact O-CG2 3.48Å; A52-V56 PolarHBondContact O-N 3.4Å; K53-V56 PolarHBondContact O-N 2.9Å; A54-V56 PolarHBondContact O-N 3.42Å; V56-F58 VanDerWaalsContact C-N 3.33Å; V56-F58 PolarHBondContact O-N 3.33Å; V56-H59 PolarHBondContact O-N 3.17Å; V56-R60 HydrophobicContact CG1-CG 4.46Å; V56-R60 WeakPolarHBondContact O-CG 3.45Å; V56-R60 PolarHBondContact O-N 3.12Å
57	A	96.9	Very high	96	Very high	9 Å²	9	44.7 Å²	44.7	7%	0.074	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-44	175.7	0	0	0	0	0	111.4	K53 A54 R60 G61 N62 E65 L66	K53-A57 VanDerWaalsContact O-CB 3.31Å; K53-A57 WeakPolarHBondContact O-CB 3.3Å; K53-A57 PolarHBondContact O-N 3.44Å; A54-A57 PolarHBondContact O-N 2.93Å; A57-R60 PolarHBondContact O-N 3.01Å; A57-G61 PolarHBondContact O-N 3.39Å; A57-N62 PolarHBondContact O-N 2.99Å; A57-E65 HydrophobicContact CB-CB 4.39Å; A57-E65 HydrophobicContact CB-CG 4.48Å; A57-L66 HydrophobicContact CB-CB 4.16Å
58	F	97.1	Very high	96.2	Very high	53 Å²	53	48.8 Å²	48.8	23%	0.232	23%	0.227	C	C	.	.	H	α-helix	trans	-60.6	-47.3	174	-179.4	-94.1	0	0	0	112.2	A54 V55 V56 R60 G61 F63 L66 L86 K89 A90	A54-F58 PolarHBondContact O-N 3.48Å; V55-F58 PolarHBondContact O-N 2.92Å; V56-F58 VanDerWaalsContact C-N 3.33Å; V56-F58 PolarHBondContact O-N 3.33Å; F58-R60 VanDerWaalsContact C-N 3.29Å; F58-R60 PolarHBondContact O-N 2.8Å; F58-G61 PolarHBondContact O-N 2.94Å; F58-F63 HydrophobicContact CD2-CD1 4.31Å; F58-F63 AromaticContact CD2-CE1 3.86Å; F58-F63 HydrophobicContact CD2-CE1 3.86Å; F58-F63 HydrophobicContact CE2-CE1 4.03Å; F58-L66 HydrophobicContact CB-CD2 4.15Å; F58-L66 HydrophobicContact CD2-CD2 3.89Å; F58-L86 HydrophobicContact CB-CD2 3.95Å; F58-L86 HydrophobicContact CD1-CD2 3.83Å; F58-L86 HydrophobicContact CD2-CD2 4.11Å; F58-L86 HydrophobicContact CE1-CD2 4.4Å; F58-L86 HydrophobicContact CG-CD2 3.67Å; F58-K89 HydrophobicContact CE2-CB 3.77Å; F58-K89 HydrophobicContact CZ-CB 3.78Å; F58-K89 HydrophobicContact CZ-CD 4.43Å; F58-A90 HydrophobicContact CD2-CB 4.04Å; F58-A90 HydrophobicContact CE2-CB 4.04Å
59	H	95.7	Very high	96.3	Very high	96 Å²	96	48 Å²	48	44%	0.444	22%	0.221	S	C	.	.	H	α-helix	trans	-59.9	-38.3	179.6	-177.6	-102.4	0	0	0	112.8	L27 E28 V55 V56 G61	L27-H59 HydrophobicContact CD1-CB 3.88Å; E28-H59 IonicContact OE1-CE1 3.93Å; E28-H59 PolarHBondContact OE1-CE1 3.43Å; E28-H59 IonicContact OE1-ND1 3.66Å; E28-H59 PolarHBondContact OE1-ND1 2.96Å; V55-H59 PolarHBondContact O-N 3.44Å; V56-H59 PolarHBondContact O-N 3.17Å; H59-G61 PolarHBondContact O-N 3.38Å
60	R	95	Very high	96.4	Very high	149 Å²	149	48 Å²	48	56%	0.562	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-1.9	178.1	-67.4	177.3	176.4	174.9	-0.4	113.7	V56 A57 F58 N62	V56-R60 HydrophobicContact CG1-CG 4.46Å; V56-R60 WeakPolarHBondContact O-CG 3.45Å; V56-R60 PolarHBondContact O-N 3.12Å; A57-R60 PolarHBondContact O-N 3.01Å; F58-R60 VanDerWaalsContact C-N 3.29Å; F58-R60 PolarHBondContact O-N 2.8Å; R60-N62 PolarHBondContact O-N 3.39Å
61	G	95.5	Very high	96.4	Very high	41 Å²	41	52.8 Å²	52.8	42%	0.423	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	15.3	-174.2	0	0	0	0	0	114.2	A57 F58 H59 F63	A57-G61 PolarHBondContact O-N 3.39Å; F58-G61 PolarHBondContact O-N 2.94Å; H59-G61 PolarHBondContact O-N 3.38Å; G61-F63 VanDerWaalsContact C-N 3.27Å; G61-F63 PolarHBondContact O-N 3.37Å
62	N	96.8	Very high	96.4	Very high	82 Å²	82	55.5 Å²	55.5	44%	0.439	26%	0.264	S	S	.	.			trans	-85.3	72.4	175	-172.6	-1.1	0	0	0	109.9	A57 R60 R64 E65 L66	A57-N62 PolarHBondContact O-N 2.99Å; R60-N62 PolarHBondContact O-N 3.39Å; N62-R64 VanDerWaalsContact C-N 3.29Å; N62-R64 PolarHBondContact O-N 3.02Å; N62-E65 PolarHBondContact O-N 3.14Å; N62-E65 PolarHBondContact OD1-N 2.97Å; N62-L66 PolarHBondContact O-N 3.48Å
63	F	97.4	Very high	96.3	Very high	29 Å²	29	58.7 Å²	58.7	13%	0.127	28%	0.279	C	S	.	.	H	α-helix	trans	-66.9	-29.8	-175.7	-57	-47	0	0	0	113.1	F58 G61 E65 L66 Y67 A90 V93 E94	F58-F63 HydrophobicContact CD2-CD1 4.31Å; F58-F63 AromaticContact CD2-CE1 3.86Å; F58-F63 HydrophobicContact CD2-CE1 3.86Å; F58-F63 HydrophobicContact CE2-CE1 4.03Å; G61-F63 VanDerWaalsContact C-N 3.27Å; G61-F63 PolarHBondContact O-N 3.37Å; F63-E65 VanDerWaalsContact C-N 3.34Å; F63-E65 PolarHBondContact O-N 2.98Å; F63-L66 HydrophobicContact CD1-CD2 4.34Å; F63-L66 WeakPolarHBondContact O-CB 3.16Å; F63-L66 PolarHBondContact O-N 3.09Å; F63-Y67 HydrophobicContact CB-CD2 4.5Å; F63-Y67 HydrophobicContact CB-CE2 3.73Å; F63-Y67 WeakPolarHBondContact O-CD2 3.37Å; F63-Y67 WeakPolarHBondContact O-CE2 3.27Å; F63-Y67 PolarHBondContact O-N 3.08Å; F63-A90 HydrophobicContact CB-CB 4.49Å; F63-A90 HydrophobicContact CD1-CB 3.51Å; F63-A90 HydrophobicContact CE1-CB 3.89Å; F63-A90 HydrophobicContact CG-CB 4.07Å; F63-V93 HydrophobicContact CE2-CB 4.35Å; F63-V93 HydrophobicContact CE2-CG1 3.93Å; F63-V93 HydrophobicContact CZ-CB 4.1Å; F63-V93 HydrophobicContact CZ-CG1 3.81Å; F63-E94 HydrophobicContact CD2-CG 3.46Å; F63-E94 VanDerWaalsContact CD2-CG 3.46Å; F63-E94 HydrophobicContact CE2-CG 3.9Å; F63-E94 HydrophobicContact CG-CG 4.32Å
64	R	97.2	Very high	96.1	Very high	216 Å²	216	62.2 Å²	62.2	82%	0.815	30%	0.296	S	S	*	.	H	α-helix	trans	-58.6	-45.5	175.8	-174.6	178.4	-177.5	-178.6	1.1	112.1	N62 K68	N62-R64 VanDerWaalsContact C-N 3.29Å; N62-R64 PolarHBondContact O-N 3.02Å; R64-K68 PolarHBondContact O-N 3.47Å; R64-K68 VanDerWaalsContact O-N 3.13Å
65	E	96.3	Very high	96	Very high	74 Å²	74	62.5 Å²	62.5	35%	0.346	30%	0.297	S	S	.	.	H	α-helix	trans	-70.1	-37.7	177.8	-174.7	60	-163.3	0	0	111.6	A57 N62 F63 Y67 K68 I69	A57-E65 HydrophobicContact CB-CB 4.39Å; A57-E65 HydrophobicContact CB-CG 4.48Å; N62-E65 PolarHBondContact O-N 3.14Å; N62-E65 PolarHBondContact OD1-N 2.97Å; F63-E65 VanDerWaalsContact C-N 3.34Å; F63-E65 PolarHBondContact O-N 2.98Å; E65-Y67 PolarHBondContact O-N 3.45Å; E65-K68 PolarHBondContact O-N 3.19Å; E65-I69 HydrophobicContact CG-CD1 4.01Å; E65-I69 VanDerWaalsContact O-CG1 3.32Å; E65-I69 WeakPolarHBondContact O-CG1 3.32Å; E65-I69 PolarHBondContact O-N 3.46Å
66	L	97.4	Very high	95.8	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-55.1	-51.8	172.6	170.4	66.9	0	0	0	111.1	A54 A57 F58 N62 F63 K68 I69 L70 L86 A90	A54-L66 HydrophobicContact CB-CD1 3.71Å; A57-L66 HydrophobicContact CB-CB 4.16Å; F58-L66 HydrophobicContact CB-CD2 4.15Å; F58-L66 HydrophobicContact CD2-CD2 3.89Å; N62-L66 PolarHBondContact O-N 3.48Å; F63-L66 HydrophobicContact CD1-CD2 4.34Å; F63-L66 WeakPolarHBondContact O-CB 3.16Å; F63-L66 PolarHBondContact O-N 3.09Å; L66-K68 VanDerWaalsContact C-N 3.34Å; L66-K68 PolarHBondContact O-N 3.16Å; L66-I69 PolarHBondContact O-N 2.93Å; L66-L70 HydrophobicContact CD1-CD1 3.71Å; L66-L70 HydrophobicContact CD1-CG 3.97Å; L66-L70 HydrophobicContact CG-CD1 4.06Å; L66-L70 VanDerWaalsContact O-CG 3.31Å; L66-L70 WeakPolarHBondContact O-CG 3.41Å; L66-L70 PolarHBondContact O-N 3.34Å; L66-L86 HydrophobicContact CD1-CB 4.26Å; L66-L86 HydrophobicContact CD1-CD1 4.46Å; L66-L86 HydrophobicContact CD2-CB 4.46Å; L66-A90 HydrophobicContact CD2-CB 3.58Å
67	Y	97.6	Very high	95.6	Very high	27 Å²	27	67.5 Å²	67.5	11%	0.106	33%	0.331	C	S	.	.	H	α-helix	trans	-60.3	-45.8	-179.8	-55.5	-37.1	0	0	0	111.4	F63 E65 I69 L70 E71 W87 A90 H91 E94	F63-Y67 HydrophobicContact CB-CD2 4.5Å; F63-Y67 HydrophobicContact CB-CE2 3.73Å; F63-Y67 WeakPolarHBondContact O-CD2 3.37Å; F63-Y67 WeakPolarHBondContact O-CE2 3.27Å; F63-Y67 PolarHBondContact O-N 3.08Å; E65-Y67 PolarHBondContact O-N 3.45Å; Y67-I69 VanDerWaalsContact C-N 3.34Å; Y67-I69 PolarHBondContact O-N 3.49Å; Y67-L70 PolarHBondContact O-N 2.95Å; Y67-E71 WeakPolarHBondContact O-CB 3.36Å; Y67-E71 VanDerWaalsContact O-CG 3.32Å; Y67-E71 WeakPolarHBondContact O-CG 3.35Å; Y67-E71 PolarHBondContact O-N 2.82Å; Y67-W87 HydrophobicContact CD1-CD2 4.45Å; Y67-W87 AromaticContact CD1-CE3 3.73Å; Y67-W87 HydrophobicContact CD1-CE3 3.73Å; Y67-W87 HydrophobicContact CD1-CH2 4.28Å; Y67-W87 AromaticContact CD1-CZ3 3.63Å; Y67-W87 HydrophobicContact CD1-CZ3 3.63Å; Y67-W87 HydrophobicContact CE1-CE3 4.33Å; Y67-W87 HydrophobicContact CE1-CZ3 4.5Å; Y67-W87 HydrophobicContact CG-CZ3 4.16Å; Y67-A90 HydrophobicContact CE1-CB 3.84Å; Y67-A90 WeakPolarHBondContact OH-CB 3.43Å; Y67-H91 AromaticContact CE1-CD2 3.97Å; Y67-H91 AromaticContact CE1-CE1 3.66Å; Y67-H91 AromaticContact CE1-NE2 3.57Å; Y67-H91 AromaticContact CE2-CE1 3.72Å; Y67-H91 AromaticContact CZ-CE1 3.33Å; Y67-H91 AromaticContact CZ-ND1 3.55Å; Y67-H91 AromaticContact CZ-NE2 3.75Å; Y67-H91 PolarHBondContact OH-CE1 3.19Å; Y67-H91 PolarHBondContact OH-N 2.94Å; Y67-H91 PolarHBondContact OH-ND1 3.41Å; Y67-H91 VanDerWaalsContact OH-ND1 3.1Å; Y67-E94 PolarHBondContact OH-OE2 2.92Å
68	K	97.1	Very high	95.3	Very high	123 Å²	123	73.6 Å²	73.6	54%	0.535	36%	0.358	S	S	.	.	H	α-helix	trans	-55.6	-47	176.4	-174.8	-175.7	177.2	-170.8	0	112.2	R64 E65 L66 S72	R64-K68 PolarHBondContact O-N 3.47Å; R64-K68 VanDerWaalsContact O-N 3.13Å; E65-K68 PolarHBondContact O-N 3.19Å; L66-K68 VanDerWaalsContact C-N 3.34Å; L66-K68 PolarHBondContact O-N 3.16Å; K68-S72 WeakPolarHBondContact O-CB 3.45Å; K68-S72 PolarHBondContact O-N 3.48Å; K68-S72 PolarHBondContact O-OG 3.12Å
69	I	95.9	Very high	95.2	Very high	9 Å²	9	71.4 Å²	71.4	5%	0.046	35%	0.349	C	S	.	.	H	α-helix	trans	-61.7	-48.5	179.1	-68.4	163.6	0	0	0	110.5	L50 K53 A54 E65 L66 Y67 E71 S72 H73 F75	L50-I69 HydrophobicContact CB-CG2 4.42Å; L50-I69 HydrophobicContact CD2-CG2 4.36Å; K53-I69 HydrophobicContact CB-CD1 3.78Å; A54-I69 HydrophobicContact CB-CG2 4.13Å; E65-I69 HydrophobicContact CG-CD1 4.01Å; E65-I69 VanDerWaalsContact O-CG1 3.32Å; E65-I69 WeakPolarHBondContact O-CG1 3.32Å; E65-I69 PolarHBondContact O-N 3.46Å; L66-I69 PolarHBondContact O-N 2.93Å; Y67-I69 VanDerWaalsContact C-N 3.34Å; Y67-I69 PolarHBondContact O-N 3.49Å; I69-E71 PolarHBondContact O-N 2.62Å; I69-S72 PolarHBondContact O-N 3.42Å; I69-H73 PolarHBondContact O-ND1 2.97Å; I69-F75 HydrophobicContact CG2-CZ 4.22Å
70	L	96.4	Very high	95.1	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-66.6	-35.2	-176.3	-64.6	-175.6	0	0	0	112.4	A54 L66 Y67 F75 L83 W87 T120 I121	A54-L70 HydrophobicContact CB-CD2 4.2Å; L66-L70 HydrophobicContact CD1-CD1 3.71Å; L66-L70 HydrophobicContact CD1-CG 3.97Å; L66-L70 HydrophobicContact CG-CD1 4.06Å; L66-L70 VanDerWaalsContact O-CG 3.31Å; L66-L70 WeakPolarHBondContact O-CG 3.41Å; L66-L70 PolarHBondContact O-N 3.34Å; Y67-L70 PolarHBondContact O-N 2.95Å; L70-F75 HydrophobicContact CD2-CE2 4.27Å; L70-F75 HydrophobicContact CD2-CZ 4.47Å; L70-L83 HydrophobicContact CD2-CB 3.96Å; L70-L83 HydrophobicContact CD2-CD1 4.17Å; L70-L83 HydrophobicContact CD2-CD2 3.82Å; L70-L83 HydrophobicContact CD2-CG 4.19Å; L70-W87 HydrophobicContact CB-CE3 4.25Å; L70-W87 HydrophobicContact CD1-CB 4.02Å; L70-W87 HydrophobicContact CD1-CE3 3.9Å; L70-T120 WeakPolarHBondContact O-CB 3.33Å; L70-T120 PolarHBondContact O-OG1 3.49Å; L70-I121 HydrophobicContact CD1-CD1 4.23Å; L70-I121 HydrophobicContact CD2-CG2 4.26Å
71	E	95.6	Very high	95.1	Very high	110 Å²	110	63.6 Å²	63.6	51%	0.514	33%	0.325	S	S	.	.	H	α-helix	trans	-83.3	-23.9	-179.2	-68.3	174.2	148.2	0	0	113.5	Y67 I69 W87 P118 T120	Y67-E71 WeakPolarHBondContact O-CB 3.36Å; Y67-E71 VanDerWaalsContact O-CG 3.32Å; Y67-E71 WeakPolarHBondContact O-CG 3.35Å; Y67-E71 PolarHBondContact O-N 2.82Å; I69-E71 PolarHBondContact O-N 2.62Å; E71-W87 HydrophobicContact CG-CH2 4.11Å; E71-W87 HydrophobicContact CG-CZ3 3.91Å; E71-W87 WeakPolarHBondContact OE1-CH2 3.41Å; E71-P118 HydrophobicContact CG-CB 4.1Å; E71-P118 HydrophobicContact CG-CG 4.17Å; E71-T120 WeakPolarHBondContact O-CG2 3.25Å
72	S	94.7	Very high	95.1	Very high	75 Å²	75	66.7 Å²	66.7	52%	0.524	33%	0.327	S	S	.	.	H	α-helix	trans	-91.3	-16.9	-171.3	-55.9	0	0	0	0	114.7	K68 I69	K68-S72 WeakPolarHBondContact O-CB 3.45Å; K68-S72 PolarHBondContact O-N 3.48Å; K68-S72 PolarHBondContact O-OG 3.12Å; I69-S72 PolarHBondContact O-N 3.42Å
73	H	93.3	Very high	95	Very high	66 Å²	66	62.8 Å²	62.8	31%	0.306	31%	0.306	S	S	.	.	S	Bend	trans	-132	135.9	-172.8	-57.5	84.9	0	0	0	110.9	L50 I69 F75 T120	L50-H73 HydrophobicContact CD1-CB 3.82Å; I69-H73 PolarHBondContact O-ND1 2.97Å; H73-F75 HydrophobicContact CB-CE2 4.16Å; H73-F75 HydrophobicContact CB-CZ 4.4Å; H73-F75 WeakPolarHBondContact O-CD2 3.43Å; H73-F75 WeakPolarHBondContact O-CE2 3.27Å; H73-T120 WeakPolarHBondContact O-CB 3.38Å; H73-T120 WeakPolarHBondContact O-CG2 3.14Å
74	Q	91.9	Very high	95	Very high	125 Å²	125	63.7 Å²	63.7	58%	0.584	31%	0.311	S	S	*	.			trans	-75	132.5	173.8	-168.7	65.8	50.7	0	0	110	R119 T120	Q74-R119 PolarHBondContact NE2-O 2.92Å; Q74-T120 PolarHBondContact NE2-O 3.35Å
75	F	94	Very high	94.9	Very high	6 Å²	6	58.2 Å²	58.2	3%	0.026	29%	0.294	C	S	.	.			trans	-107.6	150.5	174.9	-66.4	-91.4	0	0	0	110.3	E47 L50 I69 L70 H73 H80 L83 T120 I121	E47-F75 HydrophobicContact CG-CD1 3.48Å; E47-F75 VanDerWaalsContact CG-CD1 3.48Å; E47-F75 HydrophobicContact CG-CE1 4.02Å; E47-F75 HydrophobicContact CG-CG 4.41Å; E47-F75 VanDerWaalsContact OE1-CA 3.3Å; E47-F75 WeakPolarHBondContact OE1-CA 3.38Å; E47-F75 WeakPolarHBondContact OE1-CB 3.46Å; L50-F75 HydrophobicContact CB-CE1 3.91Å; L50-F75 HydrophobicContact CB-CZ 4.01Å; I69-F75 HydrophobicContact CG2-CZ 4.22Å; L70-F75 HydrophobicContact CD2-CE2 4.27Å; L70-F75 HydrophobicContact CD2-CZ 4.47Å; H73-F75 HydrophobicContact CB-CE2 4.16Å; H73-F75 HydrophobicContact CB-CZ 4.4Å; H73-F75 WeakPolarHBondContact O-CD2 3.43Å; H73-F75 WeakPolarHBondContact O-CE2 3.27Å; F75-H80 PolarHBondContact O-NE2 3.16Å; F75-L83 HydrophobicContact CB-CD1 3.77Å; F75-L83 HydrophobicContact CD1-CD1 3.27Å; F75-L83 HydrophobicContact CD2-CD1 3.65Å; F75-L83 HydrophobicContact CE1-CD1 3.67Å; F75-L83 HydrophobicContact CE2-CD1 4.02Å; F75-L83 HydrophobicContact CG-CD1 3.25Å; F75-L83 HydrophobicContact CZ-CD1 4.02Å; F75-T120 PolarHBondContact N-O 3.24Å; F75-I121 HydrophobicContact CB-CG2 4.39Å; F75-I121 HydrophobicContact CD2-CG2 3.57Å; F75-I121 HydrophobicContact CE2-CG2 4.2Å; F75-I121 HydrophobicContact CG-CG2 4.23Å
76	S	92.8	Very high	95	Very high	44 Å²	44	55.3 Å²	55.3	31%	0.308	28%	0.281	S	S	.	.			trans	-69.4	147	171.8	-60.3	0	0	0	0	110.9	E47 H78 N79 H80	E47-S76 WeakPolarHBondContact OE1-CB 3.41Å; E47-S76 PolarHBondContact OE1-N 3.45Å; E47-S76 VanDerWaalsContact OE2-CB 3.29Å; E47-S76 WeakPolarHBondContact OE2-CB 3.47Å; E47-S76 PolarHBondContact OE2-OG 3.23Å; S76-H78 WeakPolarHBondContact CB-CE1 3.43Å; S76-H78 VanDerWaalsContact CB-ND1 3.28Å; S76-H78 WeakPolarHBondContact CB-ND1 3.31Å; S76-H78 PolarHBondContact O-N 3.35Å; S76-N79 PolarHBondContact O-N 2.98Å; S76-H80 PolarHBondContact O-CD2 2.92Å; S76-H80 PolarHBondContact O-NE2 3.01Å
77	P	92.2	Very high	95	Very high	83 Å²	83	55.7 Å²	55.7	54%	0.539	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-53.9	-34	-175	-30	36.1	0	0	0	115.1	N79 H80 P81	P77-N79 PolarHBondContact O-N 3.42Å; P77-H80 WeakPolarHBondContact O-CB 3.49Å; P77-H80 PolarHBondContact O-N 3.2Å; P77-H80 VanDerWaalsContact O-N 3.1Å; P77-P81 WeakPolarHBondContact O-CD 3.43Å
78	H	92.2	Very high	95	Very high	138 Å²	138	56.3 Å²	56.3	64%	0.639	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-63.5	-25.3	179.2	68.2	-90.6	0	0	0	113.6	S76	S76-H78 WeakPolarHBondContact CB-CE1 3.43Å; S76-H78 VanDerWaalsContact CB-ND1 3.28Å; S76-H78 WeakPolarHBondContact CB-ND1 3.31Å; S76-H78 PolarHBondContact O-N 3.35Å
79	N	93.6	Very high	95	Very high	7 Å²	7	55.8 Å²	55.8	4%	0.037	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-89.2	-17.9	176.6	-71.6	-45.3	0	0	0	112.8	E47 K51 S76 P77 K82 L83	E47-N79 PolarHBondContact OE1-ND2 3.48Å; K51-N79 HydrophobicContact CD-CB 4.39Å; K51-N79 WeakPolarHBondContact CD-OD1 3.41Å; K51-N79 PolarHBondContact NZ-OD1 3.3Å; S76-N79 PolarHBondContact O-N 2.98Å; P77-N79 PolarHBondContact O-N 3.42Å; N79-K82 PolarHBondContact O-N 3.02Å; N79-L83 HydrophobicContact CB-CD1 4.2Å; N79-L83 WeakPolarHBondContact O-CG 3.31Å; N79-L83 PolarHBondContact O-N 3.24Å
80	H	94.3	Very high	95.1	Very high	6 Å²	6	55.4 Å²	55.4	3%	0.028	28%	0.283	C	S	.	.	H	α-helix	trans	-54.2	-48.8	-174.6	-69.3	-171.9	0	0	0	113.4	F75 S76 P77 K82 L83 Q84 I121 D123	F75-H80 PolarHBondContact O-NE2 3.16Å; S76-H80 PolarHBondContact O-CD2 2.92Å; S76-H80 PolarHBondContact O-NE2 3.01Å; P77-H80 WeakPolarHBondContact O-CB 3.49Å; P77-H80 PolarHBondContact O-N 3.2Å; P77-H80 VanDerWaalsContact O-N 3.1Å; H80-K82 PolarHBondContact O-N 3.41Å; H80-K82 VanDerWaalsContact O-N 3.15Å; H80-L83 PolarHBondContact O-N 2.94Å; H80-L83 VanDerWaalsContact O-N 3.1Å; H80-Q84 WeakPolarHBondContact O-CB 3.44Å; H80-Q84 WeakPolarHBondContact O-CG 3.2Å; H80-Q84 PolarHBondContact O-N 3.42Å; H80-I121 WeakPolarHBondContact CB-O 3.49Å; H80-I121 PolarHBondContact ND1-O 2.91Å; H80-D123 IonicContact CE1-OD1 3.85Å; H80-D123 PolarHBondContact CE1-OD1 3.37Å; H80-D123 IonicContact ND1-OD1 3.62Å
81	P	94.8	Very high	95.1	Very high	74 Å²	74	55.9 Å²	55.9	48%	0.481	29%	0.285	S	S	.	.	H	α-helix	trans	-57	-39.7	-176.1	-25.9	35.2	0	0	0	112.8	P77 Q85	P77-P81 WeakPolarHBondContact O-CD 3.43Å; P81-Q85 VanDerWaalsContact O-CG 3.25Å; P81-Q85 WeakPolarHBondContact O-CG 3.39Å; P81-Q85 PolarHBondContact O-N 3.44Å
82	K	94.9	Very high	95.2	Very high	107 Å²	107	52.1 Å²	52.1	47%	0.465	27%	0.267	S	S	.	.	H	α-helix	trans	-69.7	-44.3	179.2	-174.4	64.7	173.7	-169	0	111.6	N79 H80 Q85 L86	N79-K82 PolarHBondContact O-N 3.02Å; H80-K82 PolarHBondContact O-N 3.41Å; H80-K82 VanDerWaalsContact O-N 3.15Å; K82-Q85 WeakPolarHBondContact O-CB 3.41Å; K82-Q85 PolarHBondContact O-N 3.05Å; K82-L86 WeakPolarHBondContact O-CG 3.41Å; K82-L86 PolarHBondContact O-N 3.45Å; K82-L86 VanDerWaalsContact O-N 3.15Å
83	L	96.5	Very high	95.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-71.2	-38.7	-177.6	-61.3	179.7	0	0	0	112.1	K51 A54 L70 F75 N79 H80 Q85 L86 W87 I121	K51-L83 HydrophobicContact CB-CD2 4.49Å; K51-L83 HydrophobicContact CG-CD2 3.97Å; A54-L83 HydrophobicContact CB-CD2 4.45Å; L70-L83 HydrophobicContact CD2-CB 3.96Å; L70-L83 HydrophobicContact CD2-CD1 4.17Å; L70-L83 HydrophobicContact CD2-CD2 3.82Å; L70-L83 HydrophobicContact CD2-CG 4.19Å; F75-L83 HydrophobicContact CB-CD1 3.77Å; F75-L83 HydrophobicContact CD1-CD1 3.27Å; F75-L83 HydrophobicContact CD2-CD1 3.65Å; F75-L83 HydrophobicContact CE1-CD1 3.67Å; F75-L83 HydrophobicContact CE2-CD1 4.02Å; F75-L83 HydrophobicContact CG-CD1 3.25Å; F75-L83 HydrophobicContact CZ-CD1 4.02Å; N79-L83 HydrophobicContact CB-CD1 4.2Å; N79-L83 WeakPolarHBondContact O-CG 3.31Å; N79-L83 PolarHBondContact O-N 3.24Å; H80-L83 PolarHBondContact O-N 2.94Å; H80-L83 VanDerWaalsContact O-N 3.1Å; L83-Q85 VanDerWaalsContact C-N 3.3Å; L83-Q85 PolarHBondContact O-N 3.3Å; L83-L86 HydrophobicContact CD2-CD1 4.26Å; L83-L86 PolarHBondContact O-N 3.4Å; L83-L86 VanDerWaalsContact O-N 3.15Å; L83-W87 PolarHBondContact O-N 3.37Å; L83-I121 HydrophobicContact CB-CB 4.25Å; L83-I121 HydrophobicContact CB-CD1 4.3Å; L83-I121 HydrophobicContact CB-CG2 3.9Å; L83-I121 HydrophobicContact CD1-CG2 3.78Å
84	Q	96.1	Very high	95.5	Very high	48 Å²	48	52.1 Å²	52.1	22%	0.224	26%	0.262	C	S	.	.	H	α-helix	trans	-59.7	-42	172.4	-67.9	172.7	3.5	0	0	111	H80 L86 W87 L88 L117 I121	H80-Q84 WeakPolarHBondContact O-CB 3.44Å; H80-Q84 WeakPolarHBondContact O-CG 3.2Å; H80-Q84 PolarHBondContact O-N 3.42Å; Q84-L86 PolarHBondContact O-N 3.4Å; Q84-W87 PolarHBondContact O-N 3.08Å; Q84-L88 WeakPolarHBondContact O-CB 3.3Å; Q84-L88 VanDerWaalsContact O-CG 3.27Å; Q84-L88 WeakPolarHBondContact O-CG 3.39Å; Q84-L88 PolarHBondContact O-N 2.68Å; Q84-L117 HydrophobicContact CB-CD1 4.22Å; Q84-L117 HydrophobicContact CB-CD2 3.88Å; Q84-L117 HydrophobicContact CG-CD1 3.78Å; Q84-L117 HydrophobicContact CG-CD2 3.91Å; Q84-L117 HydrophobicContact CG-CG 4.41Å; Q84-I121 HydrophobicContact CG-CD1 4.29Å; Q84-I121 HydrophobicContact CG-CG1 4.25Å; Q84-I121 WeakPolarHBondContact CG-O 3.27Å; Q84-I121 PolarHBondContact NE2-O 3.47Å
85	Q	96.4	Very high	95.7	Very high	101 Å²	101	47.3 Å²	47.3	47%	0.472	24%	0.244	S	C	.	.	H	α-helix	trans	-61.4	-41.4	174.2	-76.4	177.1	2.5	0	0	112.5	P81 K82 L83 K89	P81-Q85 VanDerWaalsContact O-CG 3.25Å; P81-Q85 WeakPolarHBondContact O-CG 3.39Å; P81-Q85 PolarHBondContact O-N 3.44Å; K82-Q85 WeakPolarHBondContact O-CB 3.41Å; K82-Q85 PolarHBondContact O-N 3.05Å; L83-Q85 VanDerWaalsContact C-N 3.3Å; L83-Q85 PolarHBondContact O-N 3.3Å; Q85-K89 VanDerWaalsContact O-CB 3.25Å; Q85-K89 WeakPolarHBondContact O-CB 3.42Å; Q85-K89 VanDerWaalsContact O-CG 3.24Å; Q85-K89 WeakPolarHBondContact O-CG 3.45Å; Q85-K89 PolarHBondContact O-N 3.15Å
86	L	97.1	Very high	95.8	Very high	12 Å²	12	49.8 Å²	49.8	6%	0.063	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-47.2	177	-68	175.4	0	0	0	111.5	A54 V55 F58 L66 K82 L83 Q84 L88 K89 A90	A54-L86 HydrophobicContact CB-CD1 4.4Å; V55-L86 HydrophobicContact CG2-CD1 3.85Å; F58-L86 HydrophobicContact CB-CD2 3.95Å; F58-L86 HydrophobicContact CD1-CD2 3.83Å; F58-L86 HydrophobicContact CD2-CD2 4.11Å; F58-L86 HydrophobicContact CE1-CD2 4.4Å; F58-L86 HydrophobicContact CG-CD2 3.67Å; L66-L86 HydrophobicContact CD1-CB 4.26Å; L66-L86 HydrophobicContact CD1-CD1 4.46Å; L66-L86 HydrophobicContact CD2-CB 4.46Å; K82-L86 WeakPolarHBondContact O-CG 3.41Å; K82-L86 PolarHBondContact O-N 3.45Å; K82-L86 VanDerWaalsContact O-N 3.15Å; L83-L86 HydrophobicContact CD2-CD1 4.26Å; L83-L86 PolarHBondContact O-N 3.4Å; L83-L86 VanDerWaalsContact O-N 3.15Å; Q84-L86 PolarHBondContact O-N 3.4Å; L86-L88 PolarHBondContact O-N 3.06Å; L86-K89 PolarHBondContact O-N 3.22Å; L86-A90 VanDerWaalsContact O-CB 3.25Å; L86-A90 WeakPolarHBondContact O-CB 3.24Å; L86-A90 PolarHBondContact O-N 2.96Å
87	W	97.6	Very high	95.9	Very high	9 Å²	9	56.4 Å²	56.4	3%	0.034	28%	0.279	C	S	.	.	H	α-helix	trans	-54	-53.4	176.3	178.4	-88	0	0	0	111.8	Y67 L70 E71 L83 Q84 A90 H91 F115 P116 L117 P118 I121	Y67-W87 HydrophobicContact CD1-CD2 4.45Å; Y67-W87 AromaticContact CD1-CE3 3.73Å; Y67-W87 HydrophobicContact CD1-CE3 3.73Å; Y67-W87 HydrophobicContact CD1-CH2 4.28Å; Y67-W87 AromaticContact CD1-CZ3 3.63Å; Y67-W87 HydrophobicContact CD1-CZ3 3.63Å; Y67-W87 HydrophobicContact CE1-CE3 4.33Å; Y67-W87 HydrophobicContact CE1-CZ3 4.5Å; Y67-W87 HydrophobicContact CG-CZ3 4.16Å; L70-W87 HydrophobicContact CB-CE3 4.25Å; L70-W87 HydrophobicContact CD1-CB 4.02Å; L70-W87 HydrophobicContact CD1-CE3 3.9Å; E71-W87 HydrophobicContact CG-CH2 4.11Å; E71-W87 HydrophobicContact CG-CZ3 3.91Å; E71-W87 WeakPolarHBondContact OE1-CH2 3.41Å; L83-W87 PolarHBondContact O-N 3.37Å; Q84-W87 PolarHBondContact O-N 3.08Å; W87-A90 PolarHBondContact O-N 3.03Å; W87-H91 AromaticContact CD1-CD2 3.88Å; W87-H91 AromaticContact CE2-CD2 3.64Å; W87-H91 AromaticContact CE2-NE2 3.43Å; W87-H91 AromaticContact CH2-NE2 3.94Å; W87-H91 AromaticContact CZ2-NE2 3.39Å; W87-H91 WeakPolarHBondContact CZ2-NE2 3.28Å; W87-H91 AromaticContact NE1-CD2 3.5Å; W87-H91 AromaticContact NE1-NE2 3.77Å; W87-H91 PolarHBondContact O-CD2 2.83Å; W87-H91 PolarHBondContact O-N 3.21Å; W87-F115 HydrophobicContact CZ2-CB 4.44Å; W87-F115 PolarHBondContact NE1-O 3.29Å; W87-P116 PolarHBondContact NE1-O 3.15Å; W87-L117 HydrophobicContact CB-CD2 4.16Å; W87-L117 HydrophobicContact CG-CD2 3.99Å; W87-P118 HydrophobicContact CD2-CG 4.47Å; W87-P118 HydrophobicContact CE3-CG 4.07Å; W87-P118 HydrophobicContact CH2-CG 4.24Å; W87-P118 HydrophobicContact CZ3-CG 3.95Å; W87-I121 HydrophobicContact CB-CD1 4.19Å
88	L	97.1	Very high	95.9	Very high	40 Å²	40	59.8 Å²	59.8	21%	0.209	29%	0.292	C	S	.	.	H	α-helix	trans	-64.4	-47.2	-178	-68.6	177	0	0	0	112	Q84 L86 A90 H91 Y92 R112 L117	Q84-L88 WeakPolarHBondContact O-CB 3.3Å; Q84-L88 VanDerWaalsContact O-CG 3.27Å; Q84-L88 WeakPolarHBondContact O-CG 3.39Å; Q84-L88 PolarHBondContact O-N 2.68Å; L86-L88 PolarHBondContact O-N 3.06Å; L88-A90 VanDerWaalsContact C-N 3.32Å; L88-A90 PolarHBondContact O-N 3.32Å; L88-H91 PolarHBondContact O-N 3.32Å; L88-Y92 HydrophobicContact CB-CE2 4.05Å; L88-Y92 WeakPolarHBondContact O-CD1 3.24Å; L88-Y92 VanDerWaalsContact O-CD2 3.27Å; L88-Y92 WeakPolarHBondContact O-CD2 3.47Å; L88-Y92 PolarHBondContact O-N 3.46Å; L88-R112 HydrophobicContact CD2-CG 3.63Å; L88-L117 HydrophobicContact CD2-CD2 4.43Å; L88-L117 HydrophobicContact CG-CD2 4.25Å
89	K	97.2	Very high	96	Very high	112 Å²	112	59.6 Å²	59.6	49%	0.487	29%	0.285	S	S	.	.	H	α-helix	trans	-61.8	-41.4	179.1	-75.7	178.8	177.8	-178.4	0	111.5	F58 Q85 L86 Y92 V93	F58-K89 HydrophobicContact CE2-CB 3.77Å; F58-K89 HydrophobicContact CZ-CB 3.78Å; F58-K89 HydrophobicContact CZ-CD 4.43Å; Q85-K89 VanDerWaalsContact O-CB 3.25Å; Q85-K89 WeakPolarHBondContact O-CB 3.42Å; Q85-K89 VanDerWaalsContact O-CG 3.24Å; Q85-K89 WeakPolarHBondContact O-CG 3.45Å; Q85-K89 PolarHBondContact O-N 3.15Å; L86-K89 PolarHBondContact O-N 3.22Å; K89-Y92 PolarHBondContact O-N 3.23Å; K89-V93 WeakPolarHBondContact O-CG2 3.44Å; K89-V93 PolarHBondContact O-N 2.83Å
90	A	97.7	Very high	96	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-60.4	-50.4	179.5	0	0	0	0	0	110.9	F58 F63 L66 Y67 L86 W87 L88 Y92 V93 E94	F58-A90 HydrophobicContact CD2-CB 4.04Å; F58-A90 HydrophobicContact CE2-CB 4.04Å; F63-A90 HydrophobicContact CB-CB 4.49Å; F63-A90 HydrophobicContact CD1-CB 3.51Å; F63-A90 HydrophobicContact CE1-CB 3.89Å; F63-A90 HydrophobicContact CG-CB 4.07Å; L66-A90 HydrophobicContact CD2-CB 3.58Å; Y67-A90 HydrophobicContact CE1-CB 3.84Å; Y67-A90 WeakPolarHBondContact OH-CB 3.43Å; L86-A90 VanDerWaalsContact O-CB 3.25Å; L86-A90 WeakPolarHBondContact O-CB 3.24Å; L86-A90 PolarHBondContact O-N 2.96Å; W87-A90 PolarHBondContact O-N 3.03Å; L88-A90 VanDerWaalsContact C-N 3.32Å; L88-A90 PolarHBondContact O-N 3.32Å; A90-Y92 VanDerWaalsContact C-N 3.31Å; A90-Y92 PolarHBondContact O-N 3.24Å; A90-V93 PolarHBondContact O-N 3.31Å; A90-E94 PolarHBondContact O-N 3.41Å
91	H	98.1	Very high	96	Very high	10 Å²	10	70 Å²	70	5%	0.046	35%	0.346	C	S	.	.	H	α-helix	trans	-65.9	-31.2	177.2	-76.3	-53.4	0	0	0	113.7	Y67 W87 L88 E94 A95 V111 F115	Y67-H91 AromaticContact CE1-CD2 3.97Å; Y67-H91 AromaticContact CE1-CE1 3.66Å; Y67-H91 AromaticContact CE1-NE2 3.57Å; Y67-H91 AromaticContact CE2-CE1 3.72Å; Y67-H91 AromaticContact CZ-CE1 3.33Å; Y67-H91 AromaticContact CZ-ND1 3.55Å; Y67-H91 AromaticContact CZ-NE2 3.75Å; Y67-H91 PolarHBondContact OH-CE1 3.19Å; Y67-H91 PolarHBondContact OH-N 2.94Å; Y67-H91 PolarHBondContact OH-ND1 3.41Å; Y67-H91 VanDerWaalsContact OH-ND1 3.1Å; W87-H91 AromaticContact CD1-CD2 3.88Å; W87-H91 AromaticContact CE2-CD2 3.64Å; W87-H91 AromaticContact CE2-NE2 3.43Å; W87-H91 AromaticContact CH2-NE2 3.94Å; W87-H91 AromaticContact CZ2-NE2 3.39Å; W87-H91 WeakPolarHBondContact CZ2-NE2 3.28Å; W87-H91 AromaticContact NE1-CD2 3.5Å; W87-H91 AromaticContact NE1-NE2 3.77Å; W87-H91 PolarHBondContact O-CD2 2.83Å; W87-H91 PolarHBondContact O-N 3.21Å; L88-H91 PolarHBondContact O-N 3.32Å; H91-E94 IonicContact ND1-OE2 3.19Å; H91-A95 VanDerWaalsContact O-CB 3.24Å; H91-A95 WeakPolarHBondContact O-CB 3.33Å; H91-A95 PolarHBondContact O-N 3.07Å; H91-V111 HydrophobicContact CB-CG1 3.57Å; H91-F115 HydrophobicContact CB-CD2 4.38Å; H91-F115 AromaticContact CE1-CD1 3.75Å; H91-F115 AromaticContact CE1-CG 3.7Å; H91-F115 AromaticContact CG-CD2 3.99Å; H91-F115 AromaticContact ND1-CD2 3.86Å; H91-F115 AromaticContact ND1-CG 3.89Å; H91-F115 AromaticContact NE2-CG 3.77Å
92	Y	97.3	Very high	95.9	Very high	32 Å²	32	71.8 Å²	71.8	13%	0.125	36%	0.358	C	S	.	.	H	α-helix	trans	-64.1	-48.3	171.6	-62.2	-24.5	0	0	0	111.1	L88 K89 A90 E94 A95 E96 L103 K108 V111 R112	L88-Y92 HydrophobicContact CB-CE2 4.05Å; L88-Y92 WeakPolarHBondContact O-CD1 3.24Å; L88-Y92 VanDerWaalsContact O-CD2 3.27Å; L88-Y92 WeakPolarHBondContact O-CD2 3.47Å; L88-Y92 PolarHBondContact O-N 3.46Å; K89-Y92 PolarHBondContact O-N 3.23Å; A90-Y92 VanDerWaalsContact C-N 3.31Å; A90-Y92 PolarHBondContact O-N 3.24Å; Y92-E94 VanDerWaalsContact C-N 3.34Å; Y92-E94 PolarHBondContact O-N 3.34Å; Y92-A95 PolarHBondContact O-N 3.27Å; Y92-A95 VanDerWaalsContact O-N 3.16Å; Y92-E96 WeakPolarHBondContact O-CB 3.25Å; Y92-E96 VanDerWaalsContact O-CG 3.27Å; Y92-E96 WeakPolarHBondContact O-CG 3.27Å; Y92-E96 PolarHBondContact O-N 3.04Å; Y92-L103 HydrophobicContact CD1-CD2 4.26Å; Y92-K108 HydrophobicContact CD1-CB 4.36Å; Y92-K108 HydrophobicContact CD1-CG 4.11Å; Y92-K108 HydrophobicContact CD2-CD 4.42Å; Y92-K108 HydrophobicContact CD2-CG 4.43Å; Y92-K108 HydrophobicContact CE1-CB 3.77Å; Y92-K108 HydrophobicContact CE1-CG 3.97Å; Y92-K108 HydrophobicContact CE2-CD 4.2Å; Y92-K108 HydrophobicContact CE2-CG 4.3Å; Y92-K108 HydrophobicContact CG-CG 4.36Å; Y92-V111 HydrophobicContact CD1-CB 3.96Å; Y92-V111 HydrophobicContact CD1-CG1 3.71Å; Y92-V111 HydrophobicContact CD1-CG2 4.37Å; Y92-V111 HydrophobicContact CE1-CB 3.94Å; Y92-V111 HydrophobicContact CE1-CG1 3.85Å; Y92-R112 HydrophobicContact CE1-CG 4.38Å; Y92-R112 WeakPolarHBondContact OH-CD 3.49Å; Y92-R112 WeakPolarHBondContact OH-CG 3.37Å
93	V	96.6	Very high	95.9	Very high	61 Å²	61	67.3 Å²	67.3	37%	0.37	34%	0.339	S	S	.	.	H	α-helix	trans	-59.8	-44.5	179	171.8	0	0	0	0	111.2	F63 K89 A90 A95 E96 K97	F63-V93 HydrophobicContact CE2-CB 4.35Å; F63-V93 HydrophobicContact CE2-CG1 3.93Å; F63-V93 HydrophobicContact CZ-CB 4.1Å; F63-V93 HydrophobicContact CZ-CG1 3.81Å; K89-V93 WeakPolarHBondContact O-CG2 3.44Å; K89-V93 PolarHBondContact O-N 2.83Å; A90-V93 PolarHBondContact O-N 3.31Å; V93-A95 PolarHBondContact O-N 3.02Å; V93-E96 PolarHBondContact O-N 3.39Å; V93-K97 WeakPolarHBondContact O-CB 3.46Å; V93-K97 PolarHBondContact O-N 3.1Å
94	E	96.5	Very high	95.8	Very high	80 Å²	80	69.7 Å²	69.7	37%	0.374	36%	0.363	S	S	.	.	H	α-helix	trans	-61.3	-43.9	175.4	-70.3	-169.5	132.3	0	0	112.2	F63 Y67 A90 H91 Y92 K97 L98	F63-E94 HydrophobicContact CD2-CG 3.46Å; F63-E94 VanDerWaalsContact CD2-CG 3.46Å; F63-E94 HydrophobicContact CE2-CG 3.9Å; F63-E94 HydrophobicContact CG-CG 4.32Å; Y67-E94 PolarHBondContact OH-OE2 2.92Å; A90-E94 PolarHBondContact O-N 3.41Å; H91-E94 IonicContact ND1-OE2 3.19Å; Y92-E94 VanDerWaalsContact C-N 3.34Å; Y92-E94 PolarHBondContact O-N 3.34Å; E94-K97 PolarHBondContact O-N 3.38Å; E94-L98 WeakPolarHBondContact O-CB 3.44Å; E94-L98 PolarHBondContact O-N 3.03Å
95	A	96.2	Very high	95.7	Very high	23 Å²	23	70.2 Å²	70.2	19%	0.19	38%	0.376	C	S	.	.	H	α-helix	trans	-68	-36.3	179.1	0	0	0	0	0	112.8	H91 Y92 V93 R99 L103 V111	H91-A95 VanDerWaalsContact O-CB 3.24Å; H91-A95 WeakPolarHBondContact O-CB 3.33Å; H91-A95 PolarHBondContact O-N 3.07Å; Y92-A95 PolarHBondContact O-N 3.27Å; Y92-A95 VanDerWaalsContact O-N 3.16Å; V93-A95 PolarHBondContact O-N 3.02Å; A95-R99 WeakPolarHBondContact O-CB 3.31Å; A95-R99 WeakPolarHBondContact O-CG 3.24Å; A95-R99 PolarHBondContact O-N 3.15Å; A95-R99 VanDerWaalsContact O-N 3.12Å; A95-L103 HydrophobicContact CB-CD1 4.05Å; A95-L103 HydrophobicContact CB-CD2 3.89Å; A95-V111 HydrophobicContact CB-CG2 3.69Å
96	E	96.3	Very high	95.5	Very high	58 Å²	58	70 Å²	70	27%	0.271	38%	0.381	S	S	.	.	H	α-helix	trans	-66.9	-45.1	175.3	-74	-179.6	153.9	0	0	110.4	Y92 V93 L98 R99 G100 L103	Y92-E96 WeakPolarHBondContact O-CB 3.25Å; Y92-E96 VanDerWaalsContact O-CG 3.27Å; Y92-E96 WeakPolarHBondContact O-CG 3.27Å; Y92-E96 PolarHBondContact O-N 3.04Å; V93-E96 PolarHBondContact O-N 3.39Å; E96-L98 VanDerWaalsContact C-N 3.34Å; E96-L98 PolarHBondContact O-N 2.97Å; E96-R99 CarbonylContact O-C 3.49Å; E96-R99 PolarHBondContact O-N 3.42Å; E96-G100 PolarHBondContact O-N 3.37Å; E96-L103 HydrophobicContact CB-CD1 4.25Å; E96-L103 HydrophobicContact CG-CB 3.75Å; E96-L103 HydrophobicContact CG-CD1 3.45Å; E96-L103 VanDerWaalsContact CG-CD1 3.45Å; E96-L103 HydrophobicContact CG-CG 4.08Å; E96-L103 PolarHBondContact OE1-N 2.91Å
97	K	94.9	Very high	95.4	Very high	184 Å²	184	70.3 Å²	70.3	80%	0.8	39%	0.387	S	S	*	.	H	α-helix	trans	-60.1	-42.9	176.8	-171.8	175.5	-178.2	179	0	111.9	V93 E94 R99 G100	V93-K97 WeakPolarHBondContact O-CB 3.46Å; V93-K97 PolarHBondContact O-N 3.1Å; E94-K97 PolarHBondContact O-N 3.38Å; K97-R99 VanDerWaalsContact C-N 3.32Å; K97-R99 PolarHBondContact O-N 2.88Å; K97-G100 PolarHBondContact O-N 3.37Å
98	L	93.4	Very high	95.3	Very high	154 Å²	154	73.8 Å²	73.8	81%	0.806	40%	0.403	S	S	*	.	H	α-helix	trans	-67.8	-32.5	178	-170.6	148.1	0	0	0	112.4	E94 E96	E94-L98 WeakPolarHBondContact O-CB 3.44Å; E94-L98 PolarHBondContact O-N 3.03Å; E96-L98 VanDerWaalsContact C-N 3.34Å; E96-L98 PolarHBondContact O-N 2.97Å
99	R	93.6	Very high	95.1	Very high	133 Å²	133	76 Å²	76	50%	0.502	41%	0.409	S	S	.	.	H	α-helix	trans	-87.2	-16.6	179.6	-76.2	-177	164.9	-95.7	-3.6	114.3	A95 E96 K97 R101	A95-R99 WeakPolarHBondContact O-CB 3.31Å; A95-R99 WeakPolarHBondContact O-CG 3.24Å; A95-R99 PolarHBondContact O-N 3.15Å; A95-R99 VanDerWaalsContact O-N 3.12Å; E96-R99 CarbonylContact O-C 3.49Å; E96-R99 PolarHBondContact O-N 3.42Å; K97-R99 VanDerWaalsContact C-N 3.32Å; K97-R99 PolarHBondContact O-N 2.88Å; R99-R101 HydrophobicContact CB-CG 4.3Å; R99-R101 PolarHBondContact O-N 2.99Å
100	G	93.7	Very high	95	Very high	72 Å²	72	78.4 Å²	78.4	74%	0.742	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	14.7	-174.5	0	0	0	0	0	114.4	E96 K97	E96-G100 PolarHBondContact O-N 3.37Å; K97-G100 PolarHBondContact O-N 3.37Å
101	R	93.9	Very high	94.8	Very high	161 Å²	161	79.1 Å²	79.1	61%	0.608	42%	0.419	S	S	*	.	S	Bend	trans	-149.1	153.3	179.4	70.1	-176.7	-172.5	-172.3	1.1	111.9	R99	R99-R101 HydrophobicContact CB-CG 4.3Å; R99-R101 PolarHBondContact O-N 2.99Å
102	P	92.9	Very high	94.7	Very high	111 Å²	111	83.5 Å²	83.5	72%	0.721	44%	0.435	S	S	*	.			trans	-57.9	146	177.6	-24.3	34.3	0	0	0	113.2	G104	P102-G104 PolarHBondContact O-N 3.29Å
103	L	94.5	Very high	94.4	Very high	13 Å²	13	89.2 Å²	89.2	7%	0.068	46%	0.456	C	S	.	.			trans	-84.2	115.5	-179.3	-112.1	69.9	0	0	0	110.8	Y92 A95 E96 K108 V111	Y92-L103 HydrophobicContact CD1-CD2 4.26Å; A95-L103 HydrophobicContact CB-CD1 4.05Å; A95-L103 HydrophobicContact CB-CD2 3.89Å; E96-L103 HydrophobicContact CB-CD1 4.25Å; E96-L103 HydrophobicContact CG-CB 3.75Å; E96-L103 HydrophobicContact CG-CD1 3.45Å; E96-L103 VanDerWaalsContact CG-CD1 3.45Å; E96-L103 HydrophobicContact CG-CG 4.08Å; E96-L103 PolarHBondContact OE1-N 2.91Å; L103-K108 HydrophobicContact CB-CG 4.05Å; L103-K108 HydrophobicContact CD2-CG 4.29Å; L103-K108 VanDerWaalsContact O-CE 3.32Å; L103-K108 WeakPolarHBondContact O-CE 3.33Å; L103-V111 HydrophobicContact CD2-CG2 3.63Å
104	G	95.2	Very high	94.2	Very high	49 Å²	49	93.6 Å²	93.6	51%	0.505	47%	0.471	S	S	.	.			trans	-70.5	175.6	167	0	0	0	0	0	113.2	P102 V106 G107 K108	P102-G104 PolarHBondContact O-N 3.29Å; G104-V106 VanDerWaalsContact C-N 3.33Å; G104-V106 PolarHBondContact O-N 3.41Å; G104-G107 WeakPolarHBondContact O-CA 3.37Å; G104-G107 PolarHBondContact O-N 3.41Å; G104-K108 PolarHBondContact O-N 3.17Å
105	A	93.8	Very high	94.1	Very high	60 Å²	60	93.1 Å²	93.1	50%	0.496	47%	0.467	S	S	.	.	H	α-helix	trans	-53.5	-44.7	-176.6	0	0	0	0	0	113.6	G107 K108 Y109 P222	A105-G107 VanDerWaalsContact C-N 3.33Å; A105-G107 PolarHBondContact O-N 3.45Å; A105-K108 PolarHBondContact O-N 2.93Å; A105-Y109 PolarHBondContact O-N 3.2Å; A105-P222 HydrophobicContact CB-CG 3.98Å
106	V	92	Very high	93.9	Very high	96 Å²	96	95.9 Å²	95.9	58%	0.582	48%	0.484	S	S	*	.	H	α-helix	trans	-65.8	-37.5	177.6	-179.8	0	0	0	0	111.4	G104 Y109 R110	G104-V106 VanDerWaalsContact C-N 3.33Å; G104-V106 PolarHBondContact O-N 3.41Å; V106-Y109 PolarHBondContact O-N 3.2Å; V106-R110 VanDerWaalsContact O-CG 3.31Å; V106-R110 WeakPolarHBondContact O-CG 3.47Å; V106-R110 PolarHBondContact O-N 2.96Å
107	G	95.4	Very high	93.7	Very high	19 Å²	19	94.7 Å²	94.7	20%	0.196	48%	0.479	C	S	.	.	H	α-helix	trans	-61.2	-50.1	175.1	0	0	0	0	0	111.4	G104 A105 Y109 R110 V111	G104-G107 WeakPolarHBondContact O-CA 3.37Å; G104-G107 PolarHBondContact O-N 3.41Å; A105-G107 VanDerWaalsContact C-N 3.33Å; A105-G107 PolarHBondContact O-N 3.45Å; G107-Y109 VanDerWaalsContact C-N 3.31Å; G107-Y109 PolarHBondContact O-N 3.01Å; G107-R110 PolarHBondContact O-N 3.47Å; G107-R110 VanDerWaalsContact O-N 3.14Å; G107-V111 WeakPolarHBondContact O-CG2 3.47Å; G107-V111 PolarHBondContact O-N 3.44Å
108	K	95.3	Very high	93.6	Very high	82 Å²	82	86.9 Å²	86.9	36%	0.357	45%	0.447	S	S	.	.	H	α-helix	trans	-61.1	-38.3	176.5	-65.9	-178.1	178.9	172.3	0	112.3	Y92 L103 G104 A105 V111 R112	Y92-K108 HydrophobicContact CD1-CB 4.36Å; Y92-K108 HydrophobicContact CD1-CG 4.11Å; Y92-K108 HydrophobicContact CD2-CD 4.42Å; Y92-K108 HydrophobicContact CD2-CG 4.43Å; Y92-K108 HydrophobicContact CE1-CB 3.77Å; Y92-K108 HydrophobicContact CE1-CG 3.97Å; Y92-K108 HydrophobicContact CE2-CD 4.2Å; Y92-K108 HydrophobicContact CE2-CG 4.3Å; Y92-K108 HydrophobicContact CG-CG 4.36Å; L103-K108 HydrophobicContact CB-CG 4.05Å; L103-K108 HydrophobicContact CD2-CG 4.29Å; L103-K108 VanDerWaalsContact O-CE 3.32Å; L103-K108 WeakPolarHBondContact O-CE 3.33Å; G104-K108 PolarHBondContact O-N 3.17Å; A105-K108 PolarHBondContact O-N 2.93Å; K108-V111 PolarHBondContact O-N 3.47Å; K108-R112 WeakPolarHBondContact O-CG 2.97Å; K108-R112 PolarHBondContact O-N 3.37Å; K108-R112 PolarHBondContact O-NE 3Å
109	Y	92.7	Very high	93.5	Very high	86 Å²	86	87.3 Å²	87.3	34%	0.337	44%	0.438	S	S	.	.	H	α-helix	trans	-60.3	-47.2	172.6	173.2	-99.2	0	0	0	112.2	A105 V106 G107 V111 R112 R113 Y129	A105-Y109 PolarHBondContact O-N 3.2Å; V106-Y109 PolarHBondContact O-N 3.2Å; G107-Y109 VanDerWaalsContact C-N 3.31Å; G107-Y109 PolarHBondContact O-N 3.01Å; Y109-V111 VanDerWaalsContact C-N 3.31Å; Y109-V111 PolarHBondContact O-N 3.44Å; Y109-R112 PolarHBondContact O-N 3.18Å; Y109-R113 HydrophobicContact CE1-CG 4.12Å; Y109-R113 HydrophobicContact CE2-CG 4.11Å; Y109-R113 PolarHBondContact O-N 3.01Å; Y109-R113 VanDerWaalsContact OH-CD 3.31Å; Y109-R113 WeakPolarHBondContact OH-CD 3.48Å; Y109-Y129 HydrophobicContact CE2-CD1 4.09Å; Y109-Y129 HydrophobicContact CE2-CE1 4.37Å; Y109-Y129 HydrophobicContact CE2-CG 4.43Å
110	R	94.4	Very high	93.4	Very high	162 Å²	162	81.9 Å²	81.9	61%	0.611	42%	0.419	S	S	*	.	H	α-helix	trans	-62.3	-38.5	178.9	-69.3	172.7	102.3	165.9	6.6	112	V106 G107 R113 K114	V106-R110 VanDerWaalsContact O-CG 3.31Å; V106-R110 WeakPolarHBondContact O-CG 3.47Å; V106-R110 PolarHBondContact O-N 2.96Å; G107-R110 PolarHBondContact O-N 3.47Å; G107-R110 VanDerWaalsContact O-N 3.14Å; R110-R113 PolarHBondContact O-N 3.15Å; R110-K114 WeakPolarHBondContact O-CB 3.49Å; R110-K114 PolarHBondContact O-N 3.15Å
111	V	95.3	Very high	93.3	Very high	15 Å²	15	78.5 Å²	78.5	9%	0.091	38%	0.384	C	S	.	.	H	α-helix	trans	-63.4	-50	175.4	173.1	0	0	0	0	111.1	H91 Y92 A95 L103 G107 K108 Y109 R113 K114 F115	H91-V111 HydrophobicContact CB-CG1 3.57Å; Y92-V111 HydrophobicContact CD1-CB 3.96Å; Y92-V111 HydrophobicContact CD1-CG1 3.71Å; Y92-V111 HydrophobicContact CD1-CG2 4.37Å; Y92-V111 HydrophobicContact CE1-CB 3.94Å; Y92-V111 HydrophobicContact CE1-CG1 3.85Å; A95-V111 HydrophobicContact CB-CG2 3.69Å; L103-V111 HydrophobicContact CD2-CG2 3.63Å; G107-V111 WeakPolarHBondContact O-CG2 3.47Å; G107-V111 PolarHBondContact O-N 3.44Å; K108-V111 PolarHBondContact O-N 3.47Å; Y109-V111 VanDerWaalsContact C-N 3.31Å; Y109-V111 PolarHBondContact O-N 3.44Å; V111-R113 PolarHBondContact O-N 3.15Å; V111-K114 PolarHBondContact O-N 3.18Å; V111-F115 HydrophobicContact CG1-CD2 4.14Å; V111-F115 PolarHBondContact O-N 3.33Å
112	R	93.9	Very high	93	Very high	103 Å²	103	73.4 Å²	73.4	39%	0.389	37%	0.365	S	S	.	.	H	α-helix	trans	-55.8	-36.6	176.7	-76.9	-178.1	-75	178.6	-0.6	113.3	L88 Y92 K108 Y109 F115	L88-R112 HydrophobicContact CD2-CG 3.63Å; Y92-R112 HydrophobicContact CE1-CG 4.38Å; Y92-R112 WeakPolarHBondContact OH-CD 3.49Å; Y92-R112 WeakPolarHBondContact OH-CG 3.37Å; K108-R112 WeakPolarHBondContact O-CG 2.97Å; K108-R112 PolarHBondContact O-N 3.37Å; K108-R112 PolarHBondContact O-NE 3Å; Y109-R112 PolarHBondContact O-N 3.18Å; R112-F115 CarbonylContact O-C 3.52Å
113	R	91.2	Very high	92.3	Very high	151 Å²	151	73.8 Å²	73.8	57%	0.57	36%	0.361	S	S	*	.	H	α-helix	trans	-73.6	-33.7	176.4	-77	-135.4	60.8	170.8	1.3	113.7	Y109 R110 V111	Y109-R113 HydrophobicContact CE1-CG 4.12Å; Y109-R113 HydrophobicContact CE2-CG 4.11Å; Y109-R113 PolarHBondContact O-N 3.01Å; Y109-R113 VanDerWaalsContact OH-CD 3.31Å; Y109-R113 WeakPolarHBondContact OH-CD 3.48Å; R110-R113 PolarHBondContact O-N 3.15Å; V111-R113 PolarHBondContact O-N 3.15Å
114	K	93.6	Very high	91	Very high	154 Å²	154	73.8 Å²	73.8	67%	0.67	36%	0.364	S	S	*	.	H	α-helix	trans	-77.2	-34.7	179.2	-172.7	175.5	177.2	-174.8	0	111.8	R110 V111	R110-K114 WeakPolarHBondContact O-CB 3.49Å; R110-K114 PolarHBondContact O-N 3.15Å; V111-K114 PolarHBondContact O-N 3.18Å
115	F	94.1	Very high	89.7	Confident	69 Å²	69	79.1 Å²	79.1	30%	0.303	38%	0.376	S	S	.	.	S	Bend	trans	-127.4	76.6	-177.1	-54.1	-73.1	0	0	0	109.7	W87 H91 V111 R112	W87-F115 HydrophobicContact CZ2-CB 4.44Å; W87-F115 PolarHBondContact NE1-O 3.29Å; H91-F115 HydrophobicContact CB-CD2 4.38Å; H91-F115 AromaticContact CE1-CD1 3.75Å; H91-F115 AromaticContact CE1-CG 3.7Å; H91-F115 AromaticContact CG-CD2 3.99Å; H91-F115 AromaticContact ND1-CD2 3.86Å; H91-F115 AromaticContact ND1-CG 3.89Å; H91-F115 AromaticContact NE2-CG 3.77Å; V111-F115 HydrophobicContact CG1-CD2 4.14Å; V111-F115 PolarHBondContact O-N 3.33Å; R112-F115 CarbonylContact O-C 3.52Å
116	P	92.3	Very high	88.1	Confident	82 Å²	82	84.5 Å²	84.5	53%	0.532	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-61.6	156.8	177	28.7	-35	0	0	0	110.7	W87	W87-P116 PolarHBondContact NE1-O 3.15Å
117	L	92.6	Very high	86.6	Confident	32 Å²	32	83.5 Å²	83.5	17%	0.168	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-64.1	135.8	176.3	-63.4	165.4	0	0	0	109.7	Q84 W87 L88 I121 W122	Q84-L117 HydrophobicContact CB-CD1 4.22Å; Q84-L117 HydrophobicContact CB-CD2 3.88Å; Q84-L117 HydrophobicContact CG-CD1 3.78Å; Q84-L117 HydrophobicContact CG-CD2 3.91Å; Q84-L117 HydrophobicContact CG-CG 4.41Å; W87-L117 HydrophobicContact CB-CD2 4.16Å; W87-L117 HydrophobicContact CG-CD2 3.99Å; L88-L117 HydrophobicContact CD2-CD2 4.43Å; L88-L117 HydrophobicContact CG-CD2 4.25Å; L117-I121 HydrophobicContact CD2-CD1 4.28Å; L117-W122 HydrophobicContact CB-CB 4.08Å; L117-W122 HydrophobicContact CB-CD2 4.12Å; L117-W122 HydrophobicContact CB-CE3 3.55Å; L117-W122 HydrophobicContact CB-CG 4.41Å; L117-W122 HydrophobicContact CB-CZ3 4.19Å; L117-W122 HydrophobicContact CD1-CD2 4.25Å; L117-W122 HydrophobicContact CD1-CE3 4.28Å; L117-W122 HydrophobicContact CD1-CG 4.45Å; L117-W122 HydrophobicContact CG-CE3 4.42Å
118	P	92.9	Very high	85.2	Confident	20 Å²	20	86.5 Å²	86.5	13%	0.13	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-70.9	149.8	176.3	27	-30.7	0	0	0	111.1	E71 W87 T120 I121 W122	E71-P118 HydrophobicContact CG-CB 4.1Å; E71-P118 HydrophobicContact CG-CG 4.17Å; W87-P118 HydrophobicContact CD2-CG 4.47Å; W87-P118 HydrophobicContact CE3-CG 4.07Å; W87-P118 HydrophobicContact CH2-CG 4.24Å; W87-P118 HydrophobicContact CZ3-CG 3.95Å; P118-T120 WeakPolarHBondContact CB-OG1 3.39Å; P118-T120 PolarHBondContact O-N 2.9Å; P118-T120 VanDerWaalsContact O-N 3.09Å; P118-I121 HydrophobicContact CG-CD1 4Å; P118-I121 HydrophobicContact CG-CG1 3.91Å; P118-I121 PolarHBondContact O-N 3.36Å; P118-W122 PolarHBondContact O-N 3.21Å
119	R	89.6	Confident	84	Confident	164 Å²	164	88.4 Å²	88.4	62%	0.619	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-60.3	-20.5	-177.8	-64.5	-63.7	-162.9	-159.9	10.7	113.6	Q74 I121 W122 G124	Q74-R119 PolarHBondContact NE2-O 2.92Å; R119-I121 VanDerWaalsContact C-N 3.25Å; R119-I121 PolarHBondContact O-N 3.39Å; R119-W122 CarbonylContact C-O 3.49Å; R119-W122 WeakPolarHBondContact CA-O 3.46Å; R119-G124 PolarHBondContact NH1-O 3.49Å
120	T	91.9	Very high	83.4	Confident	19 Å²	19	87.5 Å²	87.5	12%	0.117	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-64.8	-24.7	174.9	43.6	0	0	0	0	114.5	L70 E71 H73 Q74 F75 P118	L70-T120 WeakPolarHBondContact O-CB 3.33Å; L70-T120 PolarHBondContact O-OG1 3.49Å; E71-T120 WeakPolarHBondContact O-CG2 3.25Å; H73-T120 WeakPolarHBondContact O-CB 3.38Å; H73-T120 WeakPolarHBondContact O-CG2 3.14Å; Q74-T120 PolarHBondContact NE2-O 3.35Å; F75-T120 PolarHBondContact N-O 3.24Å; P118-T120 WeakPolarHBondContact CB-OG1 3.39Å; P118-T120 PolarHBondContact O-N 2.9Å; P118-T120 VanDerWaalsContact O-N 3.09Å
121	I	91.1	Very high	83	Confident	0 Å²	0	82.5 Å²	82.5	0%	0	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-126.4	15.9	179	67.7	179	0	0	0	112	L70 F75 H80 L83 Q84 W87 L117 P118 R119	L70-I121 HydrophobicContact CD1-CD1 4.23Å; L70-I121 HydrophobicContact CD2-CG2 4.26Å; F75-I121 HydrophobicContact CB-CG2 4.39Å; F75-I121 HydrophobicContact CD2-CG2 3.57Å; F75-I121 HydrophobicContact CE2-CG2 4.2Å; F75-I121 HydrophobicContact CG-CG2 4.23Å; H80-I121 WeakPolarHBondContact CB-O 3.49Å; H80-I121 PolarHBondContact ND1-O 2.91Å; L83-I121 HydrophobicContact CB-CB 4.25Å; L83-I121 HydrophobicContact CB-CD1 4.3Å; L83-I121 HydrophobicContact CB-CG2 3.9Å; L83-I121 HydrophobicContact CD1-CG2 3.78Å; Q84-I121 HydrophobicContact CG-CD1 4.29Å; Q84-I121 HydrophobicContact CG-CG1 4.25Å; Q84-I121 WeakPolarHBondContact CG-O 3.27Å; Q84-I121 PolarHBondContact NE2-O 3.47Å; W87-I121 HydrophobicContact CB-CD1 4.19Å; L117-I121 HydrophobicContact CD2-CD1 4.28Å; P118-I121 HydrophobicContact CG-CD1 4Å; P118-I121 HydrophobicContact CG-CG1 3.91Å; P118-I121 PolarHBondContact O-N 3.36Å; R119-I121 VanDerWaalsContact C-N 3.25Å; R119-I121 PolarHBondContact O-N 3.39Å
122	W	88.6	Confident	82.6	Confident	55 Å²	55	90 Å²	90	21%	0.208	43%	0.429	C	S	.	.			trans	-152.4	123.1	179.9	-176.1	19.4	0	0	0	110.6	L117 P118 R119 G124 E125	L117-W122 HydrophobicContact CB-CB 4.08Å; L117-W122 HydrophobicContact CB-CD2 4.12Å; L117-W122 HydrophobicContact CB-CE3 3.55Å; L117-W122 HydrophobicContact CB-CG 4.41Å; L117-W122 HydrophobicContact CB-CZ3 4.19Å; L117-W122 HydrophobicContact CD1-CD2 4.25Å; L117-W122 HydrophobicContact CD1-CE3 4.28Å; L117-W122 HydrophobicContact CD1-CG 4.45Å; L117-W122 HydrophobicContact CG-CE3 4.42Å; P118-W122 PolarHBondContact O-N 3.21Å; R119-W122 CarbonylContact C-O 3.49Å; R119-W122 WeakPolarHBondContact CA-O 3.46Å; W122-G124 VanDerWaalsContact CD1-N 3.27Å; W122-G124 PolarHBondContact O-N 3.4Å; W122-E125 WeakPolarHBondContact CZ2-O 3.21Å
123	D	77.3	Confident	82.4	Confident	119 Å²	119	90.4 Å²	90.4	64%	0.636	44%	0.435	S	S	*	.			trans	-60.9	-9.4	176.3	-53.2	-33.7	0	0	0	113.6	H80	H80-D123 IonicContact CE1-OD1 3.85Å; H80-D123 PolarHBondContact CE1-OD1 3.37Å; H80-D123 IonicContact ND1-OD1 3.62Å
124	G	68.1	Low	82.5	Confident	13 Å²	13	91.8 Å²	91.8	13%	0.134	45%	0.445	C	S	.	.			trans	85.9	12.5	163.5	0	0	0	0	0	115.6	R119 W122 E126	R119-G124 PolarHBondContact NH1-O 3.49Å; W122-G124 VanDerWaalsContact CD1-N 3.27Å; W122-G124 PolarHBondContact O-N 3.4Å; G124-E126 PolarHBondContact O-N 3.24Å
125	E	66.9	Low	82.5	Confident	161 Å²	161	85 Å²	85	75%	0.752	42%	0.417	S	S	*	.			trans	-51.6	112	165.8	-68.3	-160.3	153.9	0	0	110	W122 T127	W122-E125 WeakPolarHBondContact CZ2-O 3.21Å; E125-T127 PolarHBondContact O-N 3.08Å; E125-T127 VanDerWaalsContact O-N 3.11Å
126	E	60	Low	82.4	Confident	173 Å²	173	85.9 Å²	85.9	81%	0.808	42%	0.419	S	S	*	.			trans	-71.4	111	-175.8	-169.9	173.6	-163.6	0	0	109.9	G124 S128	G124-E126 PolarHBondContact O-N 3.24Å; E126-S128 VanDerWaalsContact C-N 3.28Å; E126-S128 PolarHBondContact O-N 2.89Å
127	T	62	Low	82.6	Confident	74 Å²	74	83.2 Å²	83.2	45%	0.454	41%	0.405	S	S	.	.			trans	-71.3	90.3	166.2	-45.3	0	0	0	0	108.1	E125 Y129	E125-T127 PolarHBondContact O-N 3.08Å; E125-T127 VanDerWaalsContact O-N 3.11Å; T127-Y129 HydrophobicContact CG2-CD1 4.4Å; T127-Y129 HydrophobicContact CG2-CE1 3.89Å; T127-Y129 HydrophobicContact CG2-CE2 4.44Å; T127-Y129 WeakPolarHBondContact O-CD2 3.09Å; T127-Y129 WeakPolarHBondContact O-CE2 3.25Å; T127-Y129 PolarHBondContact O-N 3.46Å
128	S	65.5	Low	82.7	Confident	83 Å²	83	83.7 Å²	83.7	58%	0.58	41%	0.41	S	S	*	.			trans	-66.8	106	174	-176.3	0	0	0	0	109.6	E126 C130	E126-S128 VanDerWaalsContact C-N 3.28Å; E126-S128 PolarHBondContact O-N 2.89Å; S128-C130 PolarHBondContact O-N 3.45Å; S128-C130 PolarHBondContact OG-O 3.48Å
129	Y	70.7	Confident	82.9	Confident	121 Å²	121	82.8 Å²	82.8	48%	0.475	40%	0.404	S	S	.	.			trans	-76.9	-4.9	175.1	-59.9	-78.2	0	0	0	112.8	Y109 T127	Y109-Y129 HydrophobicContact CE2-CD1 4.09Å; Y109-Y129 HydrophobicContact CE2-CE1 4.37Å; Y109-Y129 HydrophobicContact CE2-CG 4.43Å; T127-Y129 HydrophobicContact CG2-CD1 4.4Å; T127-Y129 HydrophobicContact CG2-CE1 3.89Å; T127-Y129 HydrophobicContact CG2-CE2 4.44Å; T127-Y129 WeakPolarHBondContact O-CD2 3.09Å; T127-Y129 WeakPolarHBondContact O-CE2 3.25Å; T127-Y129 PolarHBondContact O-N 3.46Å
130	C	79.4	Confident	83.2	Confident	68 Å²	68	80.3 Å²	80.3	46%	0.459	40%	0.395	S	S	.	.	S	Bend	trans	-97.4	143.4	176	-72.4	0	0	0	0	109.3	S128	S128-C130 PolarHBondContact O-N 3.45Å; S128-C130 PolarHBondContact OG-O 3.48Å
131	F	85.8	Confident	83.4	Confident	57 Å²	57	85.6 Å²	85.6	25%	0.25	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-58	154.6	168.1	-53.8	-41.5	0	0	0	110.5	R136 L139 L163 Q167 W171	F131-R136 HydrophobicContact CB-CG 4.01Å; F131-R136 WeakPolarHBondContact O-CD 3.4Å; F131-R136 WeakPolarHBondContact O-CG 3.45Å; F131-L139 HydrophobicContact CD2-CD1 4.09Å; F131-L139 HydrophobicContact CE2-CD1 4.39Å; F131-L163 HydrophobicContact CB-CD1 4.42Å; F131-L163 HydrophobicContact CB-CD2 4.44Å; F131-L163 HydrophobicContact CD1-CD1 4.08Å; F131-L163 HydrophobicContact CD1-CD2 3.54Å; F131-L163 HydrophobicContact CD1-CG 4.49Å; F131-L163 HydrophobicContact CD2-CD1 3.59Å; F131-L163 HydrophobicContact CE1-CD1 4.22Å; F131-L163 HydrophobicContact CE1-CD2 3.84Å; F131-L163 HydrophobicContact CE2-CD1 3.73Å; F131-L163 HydrophobicContact CG-CD1 3.78Å; F131-L163 HydrophobicContact CG-CD2 3.94Å; F131-L163 HydrophobicContact CZ-CD1 4.07Å; F131-L163 HydrophobicContact CZ-CD2 4.47Å; F131-Q167 HydrophobicContact CE1-CB 4.23Å; F131-Q167 HydrophobicContact CE1-CG 4.18Å; F131-Q167 HydrophobicContact CZ-CB 3.8Å; F131-Q167 HydrophobicContact CZ-CG 4.12Å; F131-W171 AromaticContact CD2-CD1 3.9Å; F131-W171 HydrophobicContact CE2-CB 4.16Å; F131-W171 AromaticContact CE2-CD1 3.7Å; F131-W171 HydrophobicContact CE2-CG 4.25Å
132	K	87.5	Confident	83.6	Confident	172 Å²	172	89.2 Å²	89.2	75%	0.748	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-54.9	149.1	174.8	-67.4	-176.4	177.1	-179.9	0	110.5	K134 S135 R136	K132-K134 VanDerWaalsContact C-N 3.25Å; K132-K134 PolarHBondContact O-N 2.95Å; K132-S135 WeakPolarHBondContact O-CB 3.4Å; K132-S135 PolarHBondContact O-N 3.34Å; K132-R136 WeakPolarHBondContact O-CG 3.05Å; K132-R136 PolarHBondContact O-N 3.49Å
133	E	89.9	Confident	84	Confident	112 Å²	112	88.1 Å²	88.1	52%	0.523	43%	0.428	S	S	.	.	H	α-helix	trans	-59.7	-37.2	-174.5	-172	55.8	-157.1	0	0	112.3	S135 R136 G137 R140	E133-S135 PolarHBondContact O-N 3.38Å; E133-R136 WeakPolarHBondContact O-CB 3.37Å; E133-R136 PolarHBondContact O-N 2.97Å; E133-R136 WeakPolarHBondContact OE2-CD 3.31Å; E133-R136 IonicContact OE2-NE 3.59Å; E133-R136 PolarHBondContact OE2-NE 2.84Å; E133-R136 VanDerWaalsContact OE2-NE 3.08Å; E133-G137 PolarHBondContact O-N 3.48Å; E133-R140 IonicContact OE1-CZ 3.45Å; E133-R140 IonicContact OE1-NH2 2.87Å; E133-R140 PolarHBondContact OE1-NH2 3.45Å
134	K	91.8	Very high	84.9	Confident	180 Å²	180	87.8 Å²	87.8	78%	0.783	43%	0.43	S	S	*	.	H	α-helix	trans	-54.8	-52.3	172.1	-174.3	176.7	179.8	178.5	0	112.1	K132 R136 G137 V138	K132-K134 VanDerWaalsContact C-N 3.25Å; K132-K134 PolarHBondContact O-N 2.95Å; K134-R136 VanDerWaalsContact C-N 3.32Å; K134-R136 PolarHBondContact O-N 3.35Å; K134-G137 PolarHBondContact O-N 3.27Å; K134-V138 PolarHBondContact O-N 2.95Å
135	S	93.9	Very high	86.1	Confident	12 Å²	12	94.3 Å²	94.3	8%	0.084	46%	0.457	C	S	.	.	H	α-helix	trans	-62.1	-39.2	178	-50.1	0	0	0	0	111.6	K132 E133 L139 T161	K132-S135 WeakPolarHBondContact O-CB 3.4Å; K132-S135 PolarHBondContact O-N 3.34Å; E133-S135 PolarHBondContact O-N 3.38Å; S135-L139 VanDerWaalsContact O-CG 3.3Å; S135-L139 WeakPolarHBondContact O-CG 3.4Å; S135-L139 PolarHBondContact O-N 3.3Å; S135-T161 PolarHBondContact OG-O 2.84Å
136	R	93.4	Very high	87.4	Confident	87 Å²	87	88.9 Å²	88.9	33%	0.328	43%	0.433	S	S	.	.	H	α-helix	trans	-66.3	-34.9	176.3	-67.8	167.2	51.8	100.6	3	112.8	F131 K132 E133 K134 R140	F131-R136 HydrophobicContact CB-CG 4.01Å; F131-R136 WeakPolarHBondContact O-CD 3.4Å; F131-R136 WeakPolarHBondContact O-CG 3.45Å; K132-R136 WeakPolarHBondContact O-CG 3.05Å; K132-R136 PolarHBondContact O-N 3.49Å; E133-R136 WeakPolarHBondContact O-CB 3.37Å; E133-R136 PolarHBondContact O-N 2.97Å; E133-R136 WeakPolarHBondContact OE2-CD 3.31Å; E133-R136 IonicContact OE2-NE 3.59Å; E133-R136 PolarHBondContact OE2-NE 2.84Å; E133-R136 VanDerWaalsContact OE2-NE 3.08Å; K134-R136 VanDerWaalsContact C-N 3.32Å; K134-R136 PolarHBondContact O-N 3.35Å; R136-R140 WeakPolarHBondContact O-CB 3.47Å; R136-R140 WeakPolarHBondContact O-CG 3.34Å; R136-R140 PolarHBondContact O-N 2.83Å; R136-R140 VanDerWaalsContact O-N 3.09Å; R136-R140 PolarHBondContact O-NE 3.36Å
137	G	94.8	Very high	89.1	Confident	25 Å²	25	82.8 Å²	82.8	26%	0.258	41%	0.408	S	S	.	.	H	α-helix	trans	-60.2	-56.4	175.5	0	0	0	0	0	110.9	E133 K134 L139 R140 E141	E133-G137 PolarHBondContact O-N 3.48Å; K134-G137 PolarHBondContact O-N 3.27Å; G137-L139 VanDerWaalsContact C-N 3.33Å; G137-L139 PolarHBondContact O-N 3.01Å; G137-R140 PolarHBondContact O-N 3.01Å; G137-R140 VanDerWaalsContact O-N 3.08Å; G137-E141 PolarHBondContact O-N 2.9Å
138	V	95.9	Very high	90.8	Very high	43 Å²	43	86.1 Å²	86.1	26%	0.261	41%	0.413	S	S	.	.	H	α-helix	trans	-55.2	-46.3	179.1	176.8	0	0	0	0	111.7	K134 R140 E141 W142 L157 T161	K134-V138 PolarHBondContact O-N 2.95Å; V138-R140 PolarHBondContact O-N 3.45Å; V138-E141 PolarHBondContact O-N 3.1Å; V138-W142 WeakPolarHBondContact O-CB 3.37Å; V138-W142 PolarHBondContact O-N 3.2Å; V138-L157 HydrophobicContact CG1-CD2 4.05Å; V138-T161 HydrophobicContact CB-CG2 3.89Å; V138-T161 HydrophobicContact CG1-CG2 3.82Å
139	L	96.7	Very high	92.2	Very high	0 Å²	0	82.6 Å²	82.6	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-64.9	-37.7	179.4	-67.1	170.9	0	0	0	112.7	F131 S135 G137 Y143 L157 T161 L163 V168 W171 F172	F131-L139 HydrophobicContact CD2-CD1 4.09Å; F131-L139 HydrophobicContact CE2-CD1 4.39Å; S135-L139 VanDerWaalsContact O-CG 3.3Å; S135-L139 WeakPolarHBondContact O-CG 3.4Å; S135-L139 PolarHBondContact O-N 3.3Å; G137-L139 VanDerWaalsContact C-N 3.33Å; G137-L139 PolarHBondContact O-N 3.01Å; L139-Y143 VanDerWaalsContact O-CB 3.29Å; L139-Y143 WeakPolarHBondContact O-CB 3.2Å; L139-Y143 PolarHBondContact O-N 3.25Å; L139-L157 HydrophobicContact CD2-CD2 4.49Å; L139-T161 HydrophobicContact CD2-CG2 4.31Å; L139-T161 HydrophobicContact CG-CG2 4.15Å; L139-L163 HydrophobicContact CD1-CD1 3.9Å; L139-V168 HydrophobicContact CD2-CG1 4.08Å; L139-V168 HydrophobicContact CD2-CG2 4.41Å; L139-W171 HydrophobicContact CB-CD2 3.94Å; L139-W171 HydrophobicContact CB-CE3 3.93Å; L139-W171 HydrophobicContact CB-CH2 3.81Å; L139-W171 HydrophobicContact CB-CZ2 3.78Å; L139-W171 HydrophobicContact CB-CZ3 3.88Å; L139-W171 HydrophobicContact CD1-CB 4.34Å; L139-W171 HydrophobicContact CD1-CD2 3.87Å; L139-W171 HydrophobicContact CD1-CE3 4.45Å; L139-W171 HydrophobicContact CD1-CG 3.78Å; L139-W171 HydrophobicContact CD2-CE3 4.5Å; L139-W171 HydrophobicContact CG-CD2 4.39Å; L139-W171 VanDerWaalsContact O-CH2 3.31Å; L139-W171 WeakPolarHBondContact O-CH2 3.38Å; L139-W171 WeakPolarHBondContact O-CZ3 3.38Å; L139-F172 HydrophobicContact CD2-CE2 3.74Å
140	R	96.1	Very high	93.5	Very high	113 Å²	113	79 Å²	79	43%	0.426	38%	0.381	S	S	.	.	H	α-helix	trans	-68.4	-46.1	177.3	-81.7	-175.7	-68.6	159.4	-6.3	111.8	E133 R136 G137 V138 W142 Y143 T144 W171	E133-R140 IonicContact OE1-CZ 3.45Å; E133-R140 IonicContact OE1-NH2 2.87Å; E133-R140 PolarHBondContact OE1-NH2 3.45Å; R136-R140 WeakPolarHBondContact O-CB 3.47Å; R136-R140 WeakPolarHBondContact O-CG 3.34Å; R136-R140 PolarHBondContact O-N 2.83Å; R136-R140 VanDerWaalsContact O-N 3.09Å; R136-R140 PolarHBondContact O-NE 3.36Å; G137-R140 PolarHBondContact O-N 3.01Å; G137-R140 VanDerWaalsContact O-N 3.08Å; V138-R140 PolarHBondContact O-N 3.45Å; R140-W142 VanDerWaalsContact C-N 3.34Å; R140-Y143 WeakPolarHBondContact O-CB 3.4Å; R140-Y143 PolarHBondContact O-N 3.15Å; R140-T144 PolarHBondContact O-N 3.11Å; R140-W171 HydrophobicContact CG-CH2 4.25Å; R140-W171 HydrophobicContact CG-CZ2 4.03Å
141	E	96.5	Very high	94.3	Very high	129 Å²	129	80.5 Å²	80.5	60%	0.603	39%	0.39	S	S	*	.	H	α-helix	trans	-61.7	-43.2	177.8	-178.3	176.6	-165.7	0	0	111.2	G137 V138 Y143 T144 H145	G137-E141 PolarHBondContact O-N 2.9Å; V138-E141 PolarHBondContact O-N 3.1Å; E141-Y143 VanDerWaalsContact C-N 3.31Å; E141-Y143 PolarHBondContact O-N 3.41Å; E141-T144 PolarHBondContact O-N 3.05Å; E141-T144 PolarHBondContact O-OG1 3.23Å; E141-H145 PolarHBondContact O-ND1 3.26Å
142	W	95.9	Very high	94.8	Very high	77 Å²	77	85.5 Å²	85.5	29%	0.292	41%	0.407	S	S	.	.	H	α-helix	trans	-62	-42.4	174.7	-166.1	-76.7	0	0	0	111.9	V138 R140 T144 H145 N146 E153 L157 F172	V138-W142 WeakPolarHBondContact O-CB 3.37Å; V138-W142 PolarHBondContact O-N 3.2Å; R140-W142 VanDerWaalsContact C-N 3.34Å; W142-T144 VanDerWaalsContact C-N 3.29Å; W142-T144 PolarHBondContact O-N 2.96Å; W142-H145 PolarHBondContact O-N 3.1Å; W142-N146 PolarHBondContact O-N 3.34Å; W142-E153 HydrophobicContact CH2-CG 4.42Å; W142-E153 HydrophobicContact CZ2-CB 3.89Å; W142-E153 HydrophobicContact CZ2-CG 3.82Å; W142-L157 HydrophobicContact CB-CD2 4.01Å; W142-L157 HydrophobicContact CD2-CD1 4.03Å; W142-L157 HydrophobicContact CD2-CD2 3.79Å; W142-L157 HydrophobicContact CD2-CG 4.15Å; W142-L157 HydrophobicContact CE3-CD2 3.76Å; W142-L157 HydrophobicContact CE3-CG 4.33Å; W142-L157 HydrophobicContact CG-CD1 3.95Å; W142-L157 HydrophobicContact CG-CD2 3.9Å; W142-L157 HydrophobicContact CG-CG 4.42Å; W142-F172 HydrophobicContact CB-CZ 4.26Å; W142-F172 AromaticContact CD1-CE1 3.99Å; W142-F172 AromaticContact CD1-CZ 3.71Å; W142-F172 HydrophobicContact CG-CZ 4.2Å
143	Y	96.5	Very high	95.3	Very high	32 Å²	32	79.7 Å²	79.7	13%	0.125	38%	0.383	C	S	.	.	H	α-helix	trans	-62.4	-32.6	-176.4	-172.5	-92.1	0	0	0	113.6	L139 R140 E141 H145 P147 W171 F172 R175 R176 D179	L139-Y143 VanDerWaalsContact O-CB 3.29Å; L139-Y143 WeakPolarHBondContact O-CB 3.2Å; L139-Y143 PolarHBondContact O-N 3.25Å; R140-Y143 WeakPolarHBondContact O-CB 3.4Å; R140-Y143 PolarHBondContact O-N 3.15Å; E141-Y143 VanDerWaalsContact C-N 3.31Å; E141-Y143 PolarHBondContact O-N 3.41Å; Y143-H145 PolarHBondContact O-N 2.81Å; Y143-P147 HydrophobicContact CD2-CB 3.95Å; Y143-P147 HydrophobicContact CE1-CB 4.39Å; Y143-P147 HydrophobicContact CE2-CB 3.53Å; Y143-W171 AromaticContact CD2-CZ3 3.98Å; Y143-W171 HydrophobicContact CD2-CZ3 3.98Å; Y143-W171 HydrophobicContact CG-CH2 4.4Å; Y143-W171 HydrophobicContact CG-CZ3 4.22Å; Y143-F172 AromaticContact CD2-CD1 3.63Å; Y143-F172 HydrophobicContact CD2-CD1 3.63Å; Y143-F172 AromaticContact CD2-CE1 3.76Å; Y143-F172 HydrophobicContact CD2-CE1 3.76Å; Y143-F172 HydrophobicContact CE2-CD1 4.25Å; Y143-F172 HydrophobicContact CG-CE1 4.47Å; Y143-R175 HydrophobicContact CD1-CG 3.96Å; Y143-R175 HydrophobicContact CD2-CB 4.27Å; Y143-R175 HydrophobicContact CD2-CG 3.81Å; Y143-R175 HydrophobicContact CE1-CG 3.61Å; Y143-R175 HydrophobicContact CE2-CB 3.86Å; Y143-R175 HydrophobicContact CE2-CG 3.48Å; Y143-R175 VanDerWaalsContact CE2-CG 3.48Å; Y143-R175 HydrophobicContact CG-CG 4.03Å; Y143-R176 HydrophobicContact CE2-CG 3.8Å; Y143-R176 WeakPolarHBondContact OH-CA 3.35Å; Y143-R176 VanDerWaalsContact OH-CG 3.28Å; Y143-R176 WeakPolarHBondContact OH-CG 3.47Å; Y143-R176 PolarHBondContact OH-N 3.03Å; Y143-D179 WeakPolarHBondContact CE1-OD2 3.3Å; Y143-D179 VanDerWaalsContact CZ-OD2 3.26Å; Y143-D179 PolarHBondContact OH-OD2 3.45Å
144	T	95.1	Very high	95.7	Very high	112 Å²	112	77.1 Å²	77.1	69%	0.687	37%	0.37	S	S	*	.	H	α-helix	trans	-66.8	-27.3	176	57.5	0	0	0	0	112.3	R140 E141 W142	R140-T144 PolarHBondContact O-N 3.11Å; E141-T144 PolarHBondContact O-N 3.05Å; E141-T144 PolarHBondContact O-OG1 3.23Å; W142-T144 VanDerWaalsContact C-N 3.29Å; W142-T144 PolarHBondContact O-N 2.96Å
145	H	93.9	Very high	95.9	Very high	149 Å²	149	75.1 Å²	75.1	69%	0.69	36%	0.357	S	S	*	.	H	α-helix	trans	-88.4	-48.4	177.9	-63.2	88.6	0	0	0	111.7	E141 W142 Y143	E141-H145 PolarHBondContact O-ND1 3.26Å; W142-H145 PolarHBondContact O-N 3.1Å; Y143-H145 PolarHBondContact O-N 2.81Å
146	N	93.6	Very high	96.1	Very high	48 Å²	48	78.1 Å²	78.1	26%	0.257	37%	0.37	S	S	.	.			trans	-143.9	105.9	-178	-177.9	6.2	0	0	0	111.8	W142 Y148	W142-N146 PolarHBondContact O-N 3.34Å; N146-Y148 VanDerWaalsContact C-N 3.26Å; N146-Y148 PolarHBondContact O-N 2.65Å; N146-Y148 PolarHBondContact OD1-N 3.07Å; N146-Y148 PolarHBondContact OD1-O 3.34Å
147	P	95.8	Very high	96.2	Very high	44 Å²	44	74.1 Å²	74.1	29%	0.286	36%	0.355	S	S	.	.	S	Bend	trans	-77.4	-6.1	178.5	28.5	-31.5	0	0	0	114.1	Y143 R176	Y143-P147 HydrophobicContact CD2-CB 3.95Å; Y143-P147 HydrophobicContact CE1-CB 4.39Å; Y143-P147 HydrophobicContact CE2-CB 3.53Å; P147-R176 PolarHBondContact O-NH1 3.2Å
148	Y	97.3	Very high	96.3	Very high	144 Å²	144	73.4 Å²	73.4	57%	0.565	35%	0.347	S	S	*	.	S	Bend	trans	-127.3	70.9	-178.8	-63.2	-86.4	0	0	0	111.6	N146 R176	N146-Y148 VanDerWaalsContact C-N 3.26Å; N146-Y148 PolarHBondContact O-N 2.65Å; N146-Y148 PolarHBondContact OD1-N 3.07Å; N146-Y148 PolarHBondContact OD1-O 3.34Å; Y148-R176 WeakPolarHBondContact OH-CD 3.36Å
149	P	96.3	Very high	96.4	Very high	10 Å²	10	78.7 Å²	78.7	7%	0.065	37%	0.368	C	S	.	.			trans	-66.4	139.1	178.7	28.3	-35.6	0	0	0	111.6	E153 K154 L157 F172	P149-E153 HydrophobicContact CB-CB 3.93Å; P149-K154 HydrophobicContact CB-CG 4.12Å; P149-K154 HydrophobicContact CG-CG 3.99Å; P149-K154 VanDerWaalsContact O-CE 3.28Å; P149-K154 WeakPolarHBondContact O-CE 3.32Å; P149-L157 HydrophobicContact CB-CD1 4.26Å; P149-L157 HydrophobicContact CG-CD1 4.45Å; P149-F172 VanDerWaalsContact CD-CD1 3.45Å; P149-F172 HydrophobicContact CG-CD1 3.78Å; P149-F172 HydrophobicContact CG-CD2 4.01Å; P149-F172 HydrophobicContact CG-CE1 3.79Å; P149-F172 HydrophobicContact CG-CE2 4.03Å; P149-F172 HydrophobicContact CG-CG 3.9Å; P149-F172 HydrophobicContact CG-CZ 3.93Å
150	S	97.4	Very high	96.3	Very high	44 Å²	44	81.8 Å²	81.8	31%	0.308	39%	0.394	S	S	.	.			trans	-66.1	165.5	173.2	69.6	0	0	0	0	112.3	R152 E153 K154	S150-R152 PolarHBondContact O-N 3.19Å; S150-R152 VanDerWaalsContact O-N 3.17Å; S150-E153 WeakPolarHBondContact CA-OE2 3.48Å; S150-E153 WeakPolarHBondContact CB-OE2 3.14Å; S150-E153 PolarHBondContact N-OE2 3.13Å; S150-E153 PolarHBondContact O-N 3.27Å; S150-E153 WeakPolarHBondContact OG-CG 2.97Å; S150-E153 PolarHBondContact OG-N 3.44Å; S150-E153 PolarHBondContact OG-OE2 3.03Å; S150-K154 WeakPolarHBondContact O-CB 3.43Å; S150-K154 VanDerWaalsContact O-CG 3.3Å; S150-K154 WeakPolarHBondContact O-CG 3.17Å; S150-K154 PolarHBondContact O-N 3.24Å
151	P	96.8	Very high	96.3	Very high	100 Å²	100	77 Å²	77	65%	0.649	38%	0.377	S	S	*	.	H	α-helix	trans	-57.3	-28.8	176.7	-26.4	35.8	0	0	0	114.5	R155	P151-R155 PolarHBondContact O-N 3.3Å; P151-R155 PolarHBondContact O-NE 2.87Å
152	R	97	Very high	96.2	Very high	163 Å²	163	74.2 Å²	74.2	62%	0.615	38%	0.384	S	S	*	.	H	α-helix	trans	-74.4	-51.8	175.6	178.3	-177.9	165.3	178.2	-0.5	110.9	S150 K154 R155 E156	S150-R152 PolarHBondContact O-N 3.19Å; S150-R152 VanDerWaalsContact O-N 3.17Å; R152-K154 PolarHBondContact O-N 3.22Å; R152-R155 WeakPolarHBondContact O-CA 3.34Å; R152-R155 WeakPolarHBondContact O-CB 3.34Å; R152-R155 PolarHBondContact O-N 2.89Å; R152-E156 IonicContact CZ-OE1 3.08Å; R152-E156 IonicContact NE-OE1 2.68Å; R152-E156 PolarHBondContact NE-OE1 3.5Å; R152-E156 IonicContact NH2-OE1 3.83Å; R152-E156 PolarHBondContact NH2-OE1 3.03Å; R152-E156 PolarHBondContact O-N 2.91Å
153	E	97	Very high	96.2	Very high	49 Å²	49	71.8 Å²	71.8	23%	0.229	38%	0.376	C	S	.	.	H	α-helix	trans	-60.3	-34.1	178.6	-68	162.7	120.3	0	0	111.5	W142 P149 S150 R155 E156 L157	W142-E153 HydrophobicContact CH2-CG 4.42Å; W142-E153 HydrophobicContact CZ2-CB 3.89Å; W142-E153 HydrophobicContact CZ2-CG 3.82Å; P149-E153 HydrophobicContact CB-CB 3.93Å; S150-E153 WeakPolarHBondContact CA-OE2 3.48Å; S150-E153 WeakPolarHBondContact CB-OE2 3.14Å; S150-E153 PolarHBondContact N-OE2 3.13Å; S150-E153 PolarHBondContact O-N 3.27Å; S150-E153 WeakPolarHBondContact OG-CG 2.97Å; S150-E153 PolarHBondContact OG-N 3.44Å; S150-E153 PolarHBondContact OG-OE2 3.03Å; E153-R155 VanDerWaalsContact C-N 3.31Å; E153-R155 PolarHBondContact O-N 3.41Å; E153-E156 PolarHBondContact O-N 3.27Å; E153-L157 WeakPolarHBondContact O-CB 3.4Å; E153-L157 VanDerWaalsContact O-CG 3.3Å; E153-L157 WeakPolarHBondContact O-CG 3.47Å; E153-L157 PolarHBondContact O-N 3.44Å
154	K	97.4	Very high	96.2	Very high	58 Å²	58	73.8 Å²	73.8	25%	0.252	39%	0.392	S	S	.	.	H	α-helix	trans	-63.1	-33.5	172.6	-74.4	171.4	174.4	-172.2	0	113.5	P149 S150 R152 A158 V168 S169	P149-K154 HydrophobicContact CB-CG 4.12Å; P149-K154 HydrophobicContact CG-CG 3.99Å; P149-K154 VanDerWaalsContact O-CE 3.28Å; P149-K154 WeakPolarHBondContact O-CE 3.32Å; S150-K154 WeakPolarHBondContact O-CB 3.43Å; S150-K154 VanDerWaalsContact O-CG 3.3Å; S150-K154 WeakPolarHBondContact O-CG 3.17Å; S150-K154 PolarHBondContact O-N 3.24Å; R152-K154 PolarHBondContact O-N 3.22Å; K154-A158 VanDerWaalsContact O-CB 3.27Å; K154-A158 WeakPolarHBondContact O-CB 3.29Å; K154-A158 PolarHBondContact O-N 2.52Å; K154-V168 HydrophobicContact CG-CG1 4.49Å; K154-S169 WeakPolarHBondContact CD-OG 3.28Å; K154-S169 PolarHBondContact NZ-OG 3.18Å
155	R	97.4	Very high	96.2	Very high	139 Å²	139	71.4 Å²	71.4	53%	0.525	38%	0.377	S	S	.	.	H	α-helix	trans	-70.9	-45.2	173.8	-82.2	-179.7	-79.6	138	-10.9	110.7	P151 R152 E153 L157 A158 E159 T165	P151-R155 PolarHBondContact O-N 3.3Å; P151-R155 PolarHBondContact O-NE 2.87Å; R152-R155 WeakPolarHBondContact O-CA 3.34Å; R152-R155 WeakPolarHBondContact O-CB 3.34Å; R152-R155 PolarHBondContact O-N 2.89Å; E153-R155 VanDerWaalsContact C-N 3.31Å; E153-R155 PolarHBondContact O-N 3.41Å; R155-L157 VanDerWaalsContact C-N 3.32Å; R155-L157 PolarHBondContact O-N 3.48Å; R155-A158 WeakPolarHBondContact O-CB 3.43Å; R155-A158 PolarHBondContact O-N 2.88Å; R155-A158 VanDerWaalsContact O-N 3.12Å; R155-E159 WeakPolarHBondContact O-CG 3.47Å; R155-E159 PolarHBondContact O-N 3.27Å; R155-T165 HydrophobicContact CG-CG2 3.75Å
156	E	97.2	Very high	96.4	Very high	74 Å²	74	67.8 Å²	67.8	35%	0.346	37%	0.366	S	S	.	.	H	α-helix	trans	-60.3	-42.3	176.3	-65.7	169.4	-175.6	0	0	111.3	R152 E153 E159 A160	R152-E156 IonicContact CZ-OE1 3.08Å; R152-E156 IonicContact NE-OE1 2.68Å; R152-E156 PolarHBondContact NE-OE1 3.5Å; R152-E156 IonicContact NH2-OE1 3.83Å; R152-E156 PolarHBondContact NH2-OE1 3.03Å; R152-E156 PolarHBondContact O-N 2.91Å; E153-E156 PolarHBondContact O-N 3.27Å; E156-E159 PolarHBondContact O-N 3.2Å; E156-A160 WeakPolarHBondContact O-CB 3.32Å; E156-A160 PolarHBondContact O-N 2.91Å
157	L	96.6	Very high	96.4	Very high	3 Å²	3	69.1 Å²	69.1	2%	0.016	37%	0.371	C	S	.	.	H	α-helix	trans	-65.5	-39.2	173.8	-76.3	167.3	0	0	0	112.9	V138 L139 W142 P149 E153 R155 A160 T161 V168 F172	V138-L157 HydrophobicContact CG1-CD2 4.05Å; L139-L157 HydrophobicContact CD2-CD2 4.49Å; W142-L157 HydrophobicContact CB-CD2 4.01Å; W142-L157 HydrophobicContact CD2-CD1 4.03Å; W142-L157 HydrophobicContact CD2-CD2 3.79Å; W142-L157 HydrophobicContact CD2-CG 4.15Å; W142-L157 HydrophobicContact CE3-CD2 3.76Å; W142-L157 HydrophobicContact CE3-CG 4.33Å; W142-L157 HydrophobicContact CG-CD1 3.95Å; W142-L157 HydrophobicContact CG-CD2 3.9Å; W142-L157 HydrophobicContact CG-CG 4.42Å; P149-L157 HydrophobicContact CB-CD1 4.26Å; P149-L157 HydrophobicContact CG-CD1 4.45Å; E153-L157 WeakPolarHBondContact O-CB 3.4Å; E153-L157 VanDerWaalsContact O-CG 3.3Å; E153-L157 WeakPolarHBondContact O-CG 3.47Å; E153-L157 PolarHBondContact O-N 3.44Å; R155-L157 VanDerWaalsContact C-N 3.32Å; R155-L157 PolarHBondContact O-N 3.48Å; L157-A160 PolarHBondContact O-N 3.48Å; L157-T161 VanDerWaalsContact O-CB 3.28Å; L157-T161 WeakPolarHBondContact O-CB 3.44Å; L157-T161 VanDerWaalsContact O-CG2 3.24Å; L157-T161 WeakPolarHBondContact O-CG2 3.31Å; L157-T161 PolarHBondContact O-N 3.33Å; L157-T161 PolarHBondContact O-OG1 3.38Å; L157-V168 HydrophobicContact CB-CG1 3.96Å; L157-V168 HydrophobicContact CB-CG2 4.5Å; L157-V168 HydrophobicContact CD1-CG1 4.16Å; L157-F172 HydrophobicContact CD1-CE2 3.75Å; L157-F172 HydrophobicContact CD1-CZ 3.83Å
158	A	97.1	Very high	96.5	Very high	10 Å²	10	67 Å²	67	8%	0.083	36%	0.357	C	S	.	.	H	α-helix	trans	-61.4	-47	175.9	0	0	0	0	0	110.8	K154 R155 T161 G162 L163 T165 V168	K154-A158 VanDerWaalsContact O-CB 3.27Å; K154-A158 WeakPolarHBondContact O-CB 3.29Å; K154-A158 PolarHBondContact O-N 2.52Å; R155-A158 WeakPolarHBondContact O-CB 3.43Å; R155-A158 PolarHBondContact O-N 2.88Å; R155-A158 VanDerWaalsContact O-N 3.12Å; A158-T161 PolarHBondContact O-N 3.43Å; A158-T161 PolarHBondContact O-OG1 3.06Å; A158-G162 WeakPolarHBondContact O-CA 3.14Å; A158-G162 PolarHBondContact O-N 2.95Å; A158-L163 CarbonylContact C-O 3.59Å; A158-L163 WeakPolarHBondContact CA-O 3.33Å; A158-L163 WeakPolarHBondContact CB-O 3.31Å; A158-L163 PolarHBondContact O-N 3.06Å; A158-L163 VanDerWaalsContact O-N 3.12Å; A158-T165 HydrophobicContact CB-CG2 3.8Å; A158-V168 HydrophobicContact CB-CG2 4.19Å
159	E	96.8	Very high	96.5	Very high	154 Å²	154	61.8 Å²	61.8	72%	0.72	34%	0.342	S	S	*	.	H	α-helix	trans	-60.8	-49	175.2	-71.3	170.3	-167.5	0	0	111.7	R155 E156 T161	R155-E159 WeakPolarHBondContact O-CG 3.47Å; R155-E159 PolarHBondContact O-N 3.27Å; E156-E159 PolarHBondContact O-N 3.2Å; E159-T161 VanDerWaalsContact C-N 3.3Å; E159-T161 PolarHBondContact O-N 2.94Å
160	A	95.4	Very high	96.5	Very high	66 Å²	66	64.1 Å²	64.1	55%	0.545	35%	0.353	S	S	.	.	H	α-helix	trans	-65.5	-31	-179.1	0	0	0	0	0	113.7	E156 L157	E156-A160 WeakPolarHBondContact O-CB 3.32Å; E156-A160 PolarHBondContact O-N 2.91Å; L157-A160 PolarHBondContact O-N 3.48Å
161	T	95.2	Very high	96.4	Very high	11 Å²	11	63.4 Å²	63.4	7%	0.067	34%	0.344	C	S	.	.	H	α-helix	trans	-97.9	-11.6	-175.9	60.3	0	0	0	0	114.2	S135 V138 L139 L157 A158 E159 L163	S135-T161 PolarHBondContact OG-O 2.84Å; V138-T161 HydrophobicContact CB-CG2 3.89Å; V138-T161 HydrophobicContact CG1-CG2 3.82Å; L139-T161 HydrophobicContact CD2-CG2 4.31Å; L139-T161 HydrophobicContact CG-CG2 4.15Å; L157-T161 VanDerWaalsContact O-CB 3.28Å; L157-T161 WeakPolarHBondContact O-CB 3.44Å; L157-T161 VanDerWaalsContact O-CG2 3.24Å; L157-T161 WeakPolarHBondContact O-CG2 3.31Å; L157-T161 PolarHBondContact O-N 3.33Å; L157-T161 PolarHBondContact O-OG1 3.38Å; A158-T161 PolarHBondContact O-N 3.43Å; A158-T161 PolarHBondContact O-OG1 3.06Å; E159-T161 VanDerWaalsContact C-N 3.3Å; E159-T161 PolarHBondContact O-N 2.94Å; T161-L163 PolarHBondContact O-N 2.94Å; T161-L163 WeakPolarHBondContact OG1-CB 3.29Å; T161-L163 WeakPolarHBondContact OG1-CG 3.39Å; T161-L163 PolarHBondContact OG1-N 3.29Å
162	G	95.1	Very high	96.4	Very high	72 Å²	72	58.7 Å²	58.7	74%	0.742	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	22.4	-170.5	0	0	0	0	0	113.4	A158	A158-G162 WeakPolarHBondContact O-CA 3.14Å; A158-G162 PolarHBondContact O-N 2.95Å
163	L	95.2	Very high	96.4	Very high	25 Å²	25	55.2 Å²	55.2	13%	0.131	30%	0.302	C	S	.	.			trans	-102.1	161.9	178.3	-60.2	178.6	0	0	0	110.3	F131 L139 A158 T161 Q167 V168	F131-L163 HydrophobicContact CB-CD1 4.42Å; F131-L163 HydrophobicContact CB-CD2 4.44Å; F131-L163 HydrophobicContact CD1-CD1 4.08Å; F131-L163 HydrophobicContact CD1-CD2 3.54Å; F131-L163 HydrophobicContact CD1-CG 4.49Å; F131-L163 HydrophobicContact CD2-CD1 3.59Å; F131-L163 HydrophobicContact CE1-CD1 4.22Å; F131-L163 HydrophobicContact CE1-CD2 3.84Å; F131-L163 HydrophobicContact CE2-CD1 3.73Å; F131-L163 HydrophobicContact CG-CD1 3.78Å; F131-L163 HydrophobicContact CG-CD2 3.94Å; F131-L163 HydrophobicContact CZ-CD1 4.07Å; F131-L163 HydrophobicContact CZ-CD2 4.47Å; L139-L163 HydrophobicContact CD1-CD1 3.9Å; A158-L163 CarbonylContact C-O 3.59Å; A158-L163 WeakPolarHBondContact CA-O 3.33Å; A158-L163 WeakPolarHBondContact CB-O 3.31Å; A158-L163 PolarHBondContact O-N 3.06Å; A158-L163 VanDerWaalsContact O-N 3.12Å; T161-L163 PolarHBondContact O-N 2.94Å; T161-L163 WeakPolarHBondContact OG1-CB 3.29Å; T161-L163 WeakPolarHBondContact OG1-CG 3.39Å; T161-L163 PolarHBondContact OG1-N 3.29Å; L163-Q167 HydrophobicContact CB-CB 4.22Å; L163-V168 HydrophobicContact CB-CG2 4.06Å; L163-V168 HydrophobicContact CD1-CG2 4.49Å
164	T	96.3	Very high	96.3	Very high	75 Å²	75	56.2 Å²	56.2	46%	0.46	31%	0.31	S	S	.	.			trans	-74	151.3	169.3	62.5	0	0	0	0	111.1	T166 Q167 V168	T164-T166 PolarHBondContact O-N 3.25Å; T164-T166 VanDerWaalsContact O-N 3.16Å; T164-Q167 WeakPolarHBondContact O-CB 3.18Å; T164-Q167 PolarHBondContact O-N 3.37Å; T164-Q167 WeakPolarHBondContact OG1-CB 3.1Å; T164-Q167 VanDerWaalsContact OG1-CD 3.28Å; T164-Q167 WeakPolarHBondContact OG1-CG 3.21Å; T164-Q167 PolarHBondContact OG1-N 3.16Å; T164-Q167 PolarHBondContact OG1-OE1 3.09Å; T164-V168 PolarHBondContact O-N 2.88Å
165	T	96.3	Very high	96.2	Very high	61 Å²	61	57.4 Å²	57.4	37%	0.374	31%	0.312	S	S	.	.	H	α-helix	trans	-56	-32.4	174.9	52.6	0	0	0	0	112.8	R155 A158 S169	R155-T165 HydrophobicContact CG-CG2 3.75Å; A158-T165 HydrophobicContact CB-CG2 3.8Å; T165-S169 WeakPolarHBondContact O-CB 3.41Å; T165-S169 PolarHBondContact O-N 3.49Å; T165-S169 PolarHBondContact O-OG 2.75Å
166	T	96.5	Very high	96.2	Very high	74 Å²	74	53.1 Å²	53.1	45%	0.454	30%	0.296	S	S	.	.	H	α-helix	trans	-67	-45.5	173.2	-57.7	0	0	0	0	111.9	T164 V168 S169 N170	T164-T166 PolarHBondContact O-N 3.25Å; T164-T166 VanDerWaalsContact O-N 3.16Å; T166-V168 VanDerWaalsContact C-N 3.35Å; T166-V168 PolarHBondContact O-N 2.99Å; T166-S169 PolarHBondContact O-N 2.98Å; T166-N170 WeakPolarHBondContact O-CB 3.37Å; T166-N170 VanDerWaalsContact O-CG 3.29Å; T166-N170 PolarHBondContact O-N 2.82Å; T166-N170 PolarHBondContact O-ND2 2.79Å
167	Q	95.3	Very high	96.1	Very high	76 Å²	76	54 Å²	54	36%	0.355	30%	0.3	S	S	.	.	H	α-helix	trans	-61	-43.4	175.7	-79	165.5	-34.1	0	0	111.7	F131 L163 T164 N170 W171	F131-Q167 HydrophobicContact CE1-CB 4.23Å; F131-Q167 HydrophobicContact CE1-CG 4.18Å; F131-Q167 HydrophobicContact CZ-CB 3.8Å; F131-Q167 HydrophobicContact CZ-CG 4.12Å; L163-Q167 HydrophobicContact CB-CB 4.22Å; T164-Q167 WeakPolarHBondContact O-CB 3.18Å; T164-Q167 PolarHBondContact O-N 3.37Å; T164-Q167 WeakPolarHBondContact OG1-CB 3.1Å; T164-Q167 VanDerWaalsContact OG1-CD 3.28Å; T164-Q167 WeakPolarHBondContact OG1-CG 3.21Å; T164-Q167 PolarHBondContact OG1-N 3.16Å; T164-Q167 PolarHBondContact OG1-OE1 3.09Å; Q167-N170 PolarHBondContact O-N 2.97Å; Q167-W171 WeakPolarHBondContact O-CB 2.89Å; Q167-W171 PolarHBondContact O-N 3.19Å
168	V	96.7	Very high	96	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.1	-50.5	174.3	177	0	0	0	0	110.2	L139 K154 L157 A158 L163 T164 T166 N170 W171 F172	L139-V168 HydrophobicContact CD2-CG1 4.08Å; L139-V168 HydrophobicContact CD2-CG2 4.41Å; K154-V168 HydrophobicContact CG-CG1 4.49Å; L157-V168 HydrophobicContact CB-CG1 3.96Å; L157-V168 HydrophobicContact CB-CG2 4.5Å; L157-V168 HydrophobicContact CD1-CG1 4.16Å; A158-V168 HydrophobicContact CB-CG2 4.19Å; L163-V168 HydrophobicContact CB-CG2 4.06Å; L163-V168 HydrophobicContact CD1-CG2 4.49Å; T164-V168 PolarHBondContact O-N 2.88Å; T166-V168 VanDerWaalsContact C-N 3.35Å; T166-V168 PolarHBondContact O-N 2.99Å; V168-N170 VanDerWaalsContact C-N 3.3Å; V168-N170 PolarHBondContact O-N 2.72Å; V168-W171 WeakPolarHBondContact O-CB 3.38Å; V168-W171 PolarHBondContact O-N 3.09Å; V168-W171 VanDerWaalsContact O-N 3.08Å; V168-F172 HydrophobicContact CG1-CD2 3.92Å; V168-F172 HydrophobicContact CG1-CE2 3.87Å; V168-F172 WeakPolarHBondContact O-CD2 3.37Å; V168-F172 PolarHBondContact O-N 3.1Å; V168-F172 VanDerWaalsContact O-N 3.08Å
169	S	96.8	Very high	95.8	Very high	34 Å²	34	61 Å²	61	24%	0.238	33%	0.327	C	S	.	.	H	α-helix	trans	-55.9	-44.6	178.2	-67.4	0	0	0	0	112.6	K154 T165 T166 K173	K154-S169 WeakPolarHBondContact CD-OG 3.28Å; K154-S169 PolarHBondContact NZ-OG 3.18Å; T165-S169 WeakPolarHBondContact O-CB 3.41Å; T165-S169 PolarHBondContact O-N 3.49Å; T165-S169 PolarHBondContact O-OG 2.75Å; T166-S169 PolarHBondContact O-N 2.98Å; S169-K173 WeakPolarHBondContact O-CB 3.5Å; S169-K173 PolarHBondContact O-N 3Å
170	N	96.1	Very high	95.7	Very high	58 Å²	58	60 Å²	60	31%	0.31	32%	0.316	S	S	.	.	H	α-helix	trans	-66.2	-38.5	177.4	-75.2	-23.4	0	0	0	112.1	T166 Q167 V168 K173 N174	T166-N170 WeakPolarHBondContact O-CB 3.37Å; T166-N170 VanDerWaalsContact O-CG 3.29Å; T166-N170 PolarHBondContact O-N 2.82Å; T166-N170 PolarHBondContact O-ND2 2.79Å; Q167-N170 PolarHBondContact O-N 2.97Å; V168-N170 VanDerWaalsContact C-N 3.3Å; V168-N170 PolarHBondContact O-N 2.72Å; N170-K173 PolarHBondContact O-N 3.49Å; N170-N174 VanDerWaalsContact O-CB 3.27Å; N170-N174 WeakPolarHBondContact O-CB 3.29Å; N170-N174 PolarHBondContact O-N 2.96Å; N170-N174 PolarHBondContact O-ND2 3.16Å
171	W	96.4	Very high	95.5	Very high	30 Å²	30	59.3 Å²	59.3	11%	0.114	31%	0.311	C	S	.	.	H	α-helix	trans	-61.2	-48	177.5	-172.7	97.6	0	0	0	111.6	F131 L139 R140 Y143 Q167 V168 N174 R175	F131-W171 AromaticContact CD2-CD1 3.9Å; F131-W171 HydrophobicContact CE2-CB 4.16Å; F131-W171 AromaticContact CE2-CD1 3.7Å; F131-W171 HydrophobicContact CE2-CG 4.25Å; L139-W171 HydrophobicContact CB-CD2 3.94Å; L139-W171 HydrophobicContact CB-CE3 3.93Å; L139-W171 HydrophobicContact CB-CH2 3.81Å; L139-W171 HydrophobicContact CB-CZ2 3.78Å; L139-W171 HydrophobicContact CB-CZ3 3.88Å; L139-W171 HydrophobicContact CD1-CB 4.34Å; L139-W171 HydrophobicContact CD1-CD2 3.87Å; L139-W171 HydrophobicContact CD1-CE3 4.45Å; L139-W171 HydrophobicContact CD1-CG 3.78Å; L139-W171 HydrophobicContact CD2-CE3 4.5Å; L139-W171 HydrophobicContact CG-CD2 4.39Å; L139-W171 VanDerWaalsContact O-CH2 3.31Å; L139-W171 WeakPolarHBondContact O-CH2 3.38Å; L139-W171 WeakPolarHBondContact O-CZ3 3.38Å; R140-W171 HydrophobicContact CG-CH2 4.25Å; R140-W171 HydrophobicContact CG-CZ2 4.03Å; Y143-W171 AromaticContact CD2-CZ3 3.98Å; Y143-W171 HydrophobicContact CD2-CZ3 3.98Å; Y143-W171 HydrophobicContact CG-CH2 4.4Å; Y143-W171 HydrophobicContact CG-CZ3 4.22Å; Q167-W171 WeakPolarHBondContact O-CB 2.89Å; Q167-W171 PolarHBondContact O-N 3.19Å; V168-W171 WeakPolarHBondContact O-CB 3.38Å; V168-W171 PolarHBondContact O-N 3.09Å; V168-W171 VanDerWaalsContact O-N 3.08Å; W171-N174 PolarHBondContact O-N 3.22Å; W171-R175 HydrophobicContact CE3-CB 4.36Å; W171-R175 HydrophobicContact CH2-CB 4.38Å; W171-R175 HydrophobicContact CH2-CG 4.2Å; W171-R175 HydrophobicContact CZ3-CB 4.15Å; W171-R175 HydrophobicContact CZ3-CG 4.31Å; W171-R175 WeakPolarHBondContact O-CB 3.42Å; W171-R175 PolarHBondContact O-N 3.5Å
172	F	97.4	Very high	95.2	Very high	1 Å²	1	61 Å²	61	0%	0.004	33%	0.326	C	S	.	.	H	α-helix	trans	-65	-42.5	178.4	-83.9	-94.4	0	0	0	111.8	L139 W142 Y143 P149 L157 V168 N174 R175 R176	L139-F172 HydrophobicContact CD2-CE2 3.74Å; W142-F172 HydrophobicContact CB-CZ 4.26Å; W142-F172 AromaticContact CD1-CE1 3.99Å; W142-F172 AromaticContact CD1-CZ 3.71Å; W142-F172 HydrophobicContact CG-CZ 4.2Å; Y143-F172 AromaticContact CD2-CD1 3.63Å; Y143-F172 HydrophobicContact CD2-CD1 3.63Å; Y143-F172 AromaticContact CD2-CE1 3.76Å; Y143-F172 HydrophobicContact CD2-CE1 3.76Å; Y143-F172 HydrophobicContact CE2-CD1 4.25Å; Y143-F172 HydrophobicContact CG-CE1 4.47Å; P149-F172 VanDerWaalsContact CD-CD1 3.45Å; P149-F172 HydrophobicContact CG-CD1 3.78Å; P149-F172 HydrophobicContact CG-CD2 4.01Å; P149-F172 HydrophobicContact CG-CE1 3.79Å; P149-F172 HydrophobicContact CG-CE2 4.03Å; P149-F172 HydrophobicContact CG-CG 3.9Å; P149-F172 HydrophobicContact CG-CZ 3.93Å; L157-F172 HydrophobicContact CD1-CE2 3.75Å; L157-F172 HydrophobicContact CD1-CZ 3.83Å; V168-F172 HydrophobicContact CG1-CD2 3.92Å; V168-F172 HydrophobicContact CG1-CE2 3.87Å; V168-F172 WeakPolarHBondContact O-CD2 3.37Å; V168-F172 PolarHBondContact O-N 3.1Å; V168-F172 VanDerWaalsContact O-N 3.08Å; F172-N174 PolarHBondContact O-N 3.29Å; F172-R175 PolarHBondContact O-N 2.68Å; F172-R176 WeakPolarHBondContact O-CG 3.29Å; F172-R176 PolarHBondContact O-N 3.32Å; F172-R176 VanDerWaalsContact O-N 3.1Å
173	K	96.3	Very high	95	Very high	89 Å²	89	61.9 Å²	61.9	39%	0.387	31%	0.311	S	S	.	.	H	α-helix	trans	-56.4	-50.5	173.7	-179.5	-178.6	176.5	179.6	0	111.1	S169 N170 R175 R176 Q177	S169-K173 WeakPolarHBondContact O-CB 3.5Å; S169-K173 PolarHBondContact O-N 3Å; N170-K173 PolarHBondContact O-N 3.49Å; K173-R175 PolarHBondContact O-N 3.06Å; K173-R176 PolarHBondContact O-N 2.96Å; K173-Q177 WeakPolarHBondContact O-CG 3.37Å; K173-Q177 PolarHBondContact O-N 3.35Å; K173-Q177 VanDerWaalsContact O-N 3.12Å
174	N	95.3	Very high	94.7	Very high	71 Å²	71	62.9 Å²	62.9	38%	0.38	32%	0.323	S	S	.	.	H	α-helix	trans	-67.5	-35.6	-178.2	-69.3	-13.5	0	0	0	112.1	N170 W171 F172 Q177 R178	N170-N174 VanDerWaalsContact O-CB 3.27Å; N170-N174 WeakPolarHBondContact O-CB 3.29Å; N170-N174 PolarHBondContact O-N 2.96Å; N170-N174 PolarHBondContact O-ND2 3.16Å; W171-N174 PolarHBondContact O-N 3.22Å; F172-N174 PolarHBondContact O-N 3.29Å; N174-Q177 PolarHBondContact O-N 2.95Å; N174-R178 WeakPolarHBondContact O-CG 3.29Å; N174-R178 PolarHBondContact O-N 3.14Å; N174-R178 VanDerWaalsContact O-N 3.1Å
175	R	95.8	Very high	94.3	Very high	82 Å²	82	66.4 Å²	66.4	31%	0.309	33%	0.332	S	S	.	.	H	α-helix	trans	-62.2	-51	176.3	-176.5	64.5	178.9	138.5	-11	111	Y143 W171 F172 K173 Q177 R178 D179	Y143-R175 HydrophobicContact CD1-CG 3.96Å; Y143-R175 HydrophobicContact CD2-CB 4.27Å; Y143-R175 HydrophobicContact CD2-CG 3.81Å; Y143-R175 HydrophobicContact CE1-CG 3.61Å; Y143-R175 HydrophobicContact CE2-CB 3.86Å; Y143-R175 HydrophobicContact CE2-CG 3.48Å; Y143-R175 VanDerWaalsContact CE2-CG 3.48Å; Y143-R175 HydrophobicContact CG-CG 4.03Å; W171-R175 HydrophobicContact CE3-CB 4.36Å; W171-R175 HydrophobicContact CH2-CB 4.38Å; W171-R175 HydrophobicContact CH2-CG 4.2Å; W171-R175 HydrophobicContact CZ3-CB 4.15Å; W171-R175 HydrophobicContact CZ3-CG 4.31Å; W171-R175 WeakPolarHBondContact O-CB 3.42Å; W171-R175 PolarHBondContact O-N 3.5Å; F172-R175 PolarHBondContact O-N 2.68Å; K173-R175 PolarHBondContact O-N 3.06Å; R175-Q177 VanDerWaalsContact C-N 3.29Å; R175-Q177 PolarHBondContact O-N 3.46Å; R175-R178 WeakPolarHBondContact O-CB 3.32Å; R175-R178 PolarHBondContact O-N 3.31Å; R175-D179 IonicContact CZ-OD1 3.37Å; R175-D179 IonicContact NE-OD1 2.82Å; R175-D179 IonicContact NE-OD2 3.53Å; R175-D179 IonicContact NH1-OD1 3.15Å; R175-D179 PolarHBondContact NH1-OD1 2.93Å; R175-D179 IonicContact NH2-OD1 2.75Å; R175-D179 PolarHBondContact O-N 3.42Å
176	R	97.3	Very high	93.9	Very high	50 Å²	50	69.6 Å²	69.6	19%	0.189	34%	0.342	C	S	.	.	H	α-helix	trans	-60	-37.4	177.4	-66.7	-168.1	-56.9	-94	2.5	113	Y143 P147 Y148 F172 K173 D179 R180	Y143-R176 HydrophobicContact CE2-CG 3.8Å; Y143-R176 WeakPolarHBondContact OH-CA 3.35Å; Y143-R176 VanDerWaalsContact OH-CG 3.28Å; Y143-R176 WeakPolarHBondContact OH-CG 3.47Å; Y143-R176 PolarHBondContact OH-N 3.03Å; P147-R176 PolarHBondContact O-NH1 3.2Å; Y148-R176 WeakPolarHBondContact OH-CD 3.36Å; F172-R176 WeakPolarHBondContact O-CG 3.29Å; F172-R176 PolarHBondContact O-N 3.32Å; F172-R176 VanDerWaalsContact O-N 3.1Å; K173-R176 PolarHBondContact O-N 2.96Å; R176-D179 PolarHBondContact O-N 3.23Å; R176-R180 WeakPolarHBondContact O-CG 3.29Å; R176-R180 PolarHBondContact O-N 2.88Å; R176-R180 VanDerWaalsContact O-N 3.09Å
177	Q	95.2	Very high	93.3	Very high	91 Å²	91	73.8 Å²	73.8	43%	0.425	35%	0.35	S	S	.	.	H	α-helix	trans	-63.7	-40.2	175.1	-76.3	-180	-14.1	0	0	112.3	K173 N174 R175 A181	K173-Q177 WeakPolarHBondContact O-CG 3.37Å; K173-Q177 PolarHBondContact O-N 3.35Å; K173-Q177 VanDerWaalsContact O-N 3.12Å; N174-Q177 PolarHBondContact O-N 2.95Å; R175-Q177 VanDerWaalsContact C-N 3.29Å; R175-Q177 PolarHBondContact O-N 3.46Å; Q177-A181 WeakPolarHBondContact O-CB 3.24Å; Q177-A181 PolarHBondContact O-N 2.95Å; Q177-A181 VanDerWaalsContact O-N 3.1Å
178	R	94.1	Very high	92.6	Very high	126 Å²	126	76.5 Å²	76.5	48%	0.475	36%	0.362	S	S	.	.	H	α-helix	trans	-66.6	-40.2	176.5	-70.7	-174.4	-54	-112	3.9	112.2	N174 R175 A181 A182	N174-R178 WeakPolarHBondContact O-CG 3.29Å; N174-R178 PolarHBondContact O-N 3.14Å; N174-R178 VanDerWaalsContact O-N 3.1Å; R175-R178 WeakPolarHBondContact O-CB 3.32Å; R175-R178 PolarHBondContact O-N 3.31Å; R178-A181 PolarHBondContact O-N 3.37Å; R178-A182 PolarHBondContact O-N 3.49Å
179	D	93.3	Very high	91.6	Very high	35 Å²	35	81.4 Å²	81.4	19%	0.187	39%	0.389	C	S	.	.	H	α-helix	trans	-66.4	-46.8	-178.6	-61	-7.4	0	0	0	110.3	Y143 R175 R176 A181 A182 E183	Y143-D179 WeakPolarHBondContact CE1-OD2 3.3Å; Y143-D179 VanDerWaalsContact CZ-OD2 3.26Å; Y143-D179 PolarHBondContact OH-OD2 3.45Å; R175-D179 IonicContact CZ-OD1 3.37Å; R175-D179 IonicContact NE-OD1 2.82Å; R175-D179 IonicContact NE-OD2 3.53Å; R175-D179 IonicContact NH1-OD1 3.15Å; R175-D179 PolarHBondContact NH1-OD1 2.93Å; R175-D179 IonicContact NH2-OD1 2.75Å; R175-D179 PolarHBondContact O-N 3.42Å; R176-D179 PolarHBondContact O-N 3.23Å; D179-A181 VanDerWaalsContact C-N 3.29Å; D179-A181 PolarHBondContact O-N 3.35Å; D179-A182 WeakPolarHBondContact O-CB 3.45Å; D179-A182 PolarHBondContact O-N 2.88Å; D179-E183 WeakPolarHBondContact O-CG 3.48Å; D179-E183 PolarHBondContact O-N 3.39Å
180	R	94.7	Very high	90.5	Very high	132 Å²	132	83.5 Å²	83.5	50%	0.498	40%	0.404	S	S	.	.	H	α-helix	trans	-58.6	-38.3	172.8	-71.8	-168.2	-63.8	-109	6.8	113.4	R176 A182 A184	R176-R180 WeakPolarHBondContact O-CG 3.29Å; R176-R180 PolarHBondContact O-N 2.88Å; R176-R180 VanDerWaalsContact O-N 3.09Å; R180-A182 VanDerWaalsContact C-N 3.34Å; R180-A184 WeakPolarHBondContact O-CB 3.33Å; R180-A184 PolarHBondContact O-N 2.98Å
181	A	90.3	Very high	89	Confident	53 Å²	53	87.1 Å²	87.1	44%	0.438	42%	0.419	S	S	.	.	H	α-helix	trans	-70.5	-30.9	177.6	0	0	0	0	0	112.6	Q177 R178 D179 K185	Q177-A181 WeakPolarHBondContact O-CB 3.24Å; Q177-A181 PolarHBondContact O-N 2.95Å; Q177-A181 VanDerWaalsContact O-N 3.1Å; R178-A181 PolarHBondContact O-N 3.37Å; D179-A181 VanDerWaalsContact C-N 3.29Å; D179-A181 PolarHBondContact O-N 3.35Å; A181-K185 WeakPolarHBondContact O-CG 3.42Å; A181-K185 PolarHBondContact O-N 2.86Å
182	A	89.9	Confident	87.2	Confident	45 Å²	45	91.8 Å²	91.8	37%	0.372	45%	0.446	S	S	.	.	H	α-helix	trans	-70.8	-47.3	173.4	0	0	0	0	0	110.8	R178 D179 R180 A184 K185 E186	R178-A182 PolarHBondContact O-N 3.49Å; D179-A182 WeakPolarHBondContact O-CB 3.45Å; D179-A182 PolarHBondContact O-N 2.88Å; R180-A182 VanDerWaalsContact C-N 3.34Å; A182-A184 VanDerWaalsContact C-N 3.31Å; A182-A184 PolarHBondContact O-N 2.64Å; A182-K185 PolarHBondContact O-N 3.18Å; A182-K185 VanDerWaalsContact O-N 3.16Å; A182-E186 WeakPolarHBondContact O-CG 3.28Å; A182-E186 PolarHBondContact O-N 2.76Å
183	E	91	Very high	85.3	Confident	92 Å²	92	97.7 Å²	97.7	43%	0.43	48%	0.477	S	S	.	.	H	α-helix	trans	-58.5	-40.7	176.3	-70	168.6	-157.4	0	0	112.4	D179 E186 R187	D179-E183 WeakPolarHBondContact O-CG 3.48Å; D179-E183 PolarHBondContact O-N 3.39Å; E183-E186 PolarHBondContact O-N 3.11Å; E183-R187 WeakPolarHBondContact O-CG 3.4Å; E183-R187 PolarHBondContact O-N 3.15Å
184	A	88.6	Confident	83.3	Confident	46 Å²	46	100.2 Å²	100.2	38%	0.38	50%	0.495	S	S	.	.	H	α-helix	trans	-62.4	-43.2	176.7	0	0	0	0	0	112.1	R180 A182 R187 E188	R180-A184 WeakPolarHBondContact O-CB 3.33Å; R180-A184 PolarHBondContact O-N 2.98Å; A182-A184 VanDerWaalsContact C-N 3.31Å; A182-A184 PolarHBondContact O-N 2.64Å; A184-R187 PolarHBondContact O-N 2.69Å; A184-E188 WeakPolarHBondContact O-CG 3.28Å; A184-E188 PolarHBondContact O-N 3.27Å; A184-E188 VanDerWaalsContact O-N 3.1Å
185	K	88	Confident	81.2	Confident	149 Å²	149	100.9 Å²	100.9	65%	0.648	51%	0.505	S	S	*	.	H	α-helix	trans	-66.7	-37.2	176.6	-75.3	-177.5	175.4	-168.3	0	112.8	A181 A182 R187 N189	A181-K185 WeakPolarHBondContact O-CG 3.42Å; A181-K185 PolarHBondContact O-N 2.86Å; A182-K185 PolarHBondContact O-N 3.18Å; A182-K185 VanDerWaalsContact O-N 3.16Å; K185-R187 VanDerWaalsContact C-N 3.35Å; K185-N189 WeakPolarHBondContact O-CB 3.43Å; K185-N189 PolarHBondContact O-N 3.21Å; K185-N189 VanDerWaalsContact O-N 3.09Å
186	E	86.2	Confident	78.7	Confident	127 Å²	127	100.1 Å²	100.1	59%	0.593	52%	0.523	S	S	*	.	H	α-helix	trans	-64.2	-42.2	176.8	-74.8	172.9	-174.8	0	0	110.9	A182 E183 N189 S190	A182-E186 WeakPolarHBondContact O-CG 3.28Å; A182-E186 PolarHBondContact O-N 2.76Å; E183-E186 PolarHBondContact O-N 3.11Å; E186-N189 PolarHBondContact O-N 3.29Å; E186-S190 PolarHBondContact O-N 3.19Å; E186-S190 PolarHBondContact O-OG 2.9Å
187	R	84.3	Confident	76.3	Confident	163 Å²	163	105 Å²	105	62%	0.615	55%	0.553	S	S	*	*	H	α-helix	trans	-62	-47.6	174.7	-70.1	177.2	-169.2	170.5	5.9	112.6	E183 A184 K185 N189 S190 E191	E183-R187 WeakPolarHBondContact O-CG 3.4Å; E183-R187 PolarHBondContact O-N 3.15Å; A184-R187 PolarHBondContact O-N 2.69Å; K185-R187 VanDerWaalsContact C-N 3.35Å; R187-N189 VanDerWaalsContact C-N 3.26Å; R187-N189 PolarHBondContact O-N 3.12Å; R187-S190 PolarHBondContact O-N 3.4Å; R187-E191 WeakPolarHBondContact O-CG 3.29Å; R187-E191 PolarHBondContact O-N 3.46Å
188	E	81.2	Confident	74	Confident	132 Å²	132	107.8 Å²	107.8	62%	0.617	57%	0.571	S	S	*	*	H	α-helix	trans	-57.1	-39.7	176.3	-73.9	174.6	176.1	0	0	111.9	A184 N192	A184-E188 WeakPolarHBondContact O-CG 3.28Å; A184-E188 PolarHBondContact O-N 3.27Å; A184-E188 VanDerWaalsContact O-N 3.1Å; E188-N192 PolarHBondContact O-N 3.4Å
189	N	75.9	Confident	71.5	Confident	103 Å²	103	111.4 Å²	111.4	55%	0.551	59%	0.59	S	S	*	*	H	α-helix	trans	-73.9	-34.9	179.9	-161.5	43.8	0	0	0	112.8	K185 E186 R187 N193	K185-N189 WeakPolarHBondContact O-CB 3.43Å; K185-N189 PolarHBondContact O-N 3.21Å; K185-N189 VanDerWaalsContact O-N 3.09Å; E186-N189 PolarHBondContact O-N 3.29Å; R187-N189 VanDerWaalsContact C-N 3.26Å; R187-N189 PolarHBondContact O-N 3.12Å; N189-N193 PolarHBondContact O-N 3.42Å; N189-N193 VanDerWaalsContact O-N 3.14Å
190	S	73.7	Confident	69.1	Low	79 Å²	79	118.3 Å²	118.3	55%	0.552	62%	0.621	S	S	*	*	H	α-helix	trans	-69.1	-37.4	174.5	-69.5	0	0	0	0	112.7	E186 R187 N193 N194	E186-S190 PolarHBondContact O-N 3.19Å; E186-S190 PolarHBondContact O-OG 2.9Å; R187-S190 PolarHBondContact O-N 3.4Å; S190-N193 PolarHBondContact O-N 3.22Å; S190-N194 PolarHBondContact O-N 3.38Å; S190-N194 VanDerWaalsContact O-N 3.08Å
191	E	63.9	Low	66.4	Low	134 Å²	134	119.1 Å²	119.1	63%	0.626	64%	0.635	S	S	*	*	H	α-helix	trans	-68	-36	175.9	-72.6	176.8	171.2	0	0	112.4	R187 S195	R187-E191 WeakPolarHBondContact O-CG 3.29Å; R187-E191 PolarHBondContact O-N 3.46Å; E191-S195 PolarHBondContact O-N 3.49Å; E191-S195 PolarHBondContact O-OG 3.19Å; E191-S195 VanDerWaalsContact O-OG 3.09Å
192	N	59.7	Low	63.9	Low	127 Å²	127	125.1 Å²	125.1	68%	0.679	65%	0.654	S	S	*	*	H	α-helix	trans	-68.8	-36.9	173.6	-106.2	6.5	0	0	0	112.9	E188	E188-N192 PolarHBondContact O-N 3.4Å
193	N	57.5	Low	61.3	Low	125 Å²	125	130.2 Å²	130.2	67%	0.668	68%	0.675	S	S	*	*	H	α-helix	trans	-74.8	-27.2	178.1	-82.5	-21.7	0	0	0	113.4	N189 S190	N189-N193 PolarHBondContact O-N 3.42Å; N189-N193 VanDerWaalsContact O-N 3.14Å; S190-N193 PolarHBondContact O-N 3.22Å
194	N	52.9	Low	58.8	Low	142 Å²	142	131 Å²	131	76%	0.759	69%	0.69	S	S	*	*	H	α-helix	trans	-83.9	-11.4	177.2	-152.4	23.9	0	0	0	113.4	S190 G196	S190-N194 PolarHBondContact O-N 3.38Å; S190-N194 VanDerWaalsContact O-N 3.08Å; N194-G196 VanDerWaalsContact C-N 3.32Å
195	S	51	Low	57.3	Low	86 Å²	86	134 Å²	134	60%	0.601	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	0.4	173.6	-64	0	0	0	0	113.8	E191	E191-S195 PolarHBondContact O-N 3.49Å; E191-S195 PolarHBondContact O-OG 3.19Å; E191-S195 VanDerWaalsContact O-OG 3.09Å
196	G	44.7	Very low	54.9	Low	66 Å²	66	134.5 Å²	134.5	68%	0.68	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-6	-178.7	0	0	0	0	0	116.1	N194	N194-G196 VanDerWaalsContact C-N 3.32Å
197	N	45.8	Very low	52.4	Low	153 Å²	153	136.4 Å²	136.4	82%	0.818	73%	0.729	S	S	*	*	S	Bend	trans	-118	14.4	-170.9	-134.4	35.4	0	0	0	116.3
198	N	47.3	Very low	49.9	Very low	149 Å²	149	131.8 Å²	131.8	80%	0.797	73%	0.732	S	S	*	*			trans	-157.1	83.8	169.1	-135.5	0.1	0	0	0	113.6
199	K	42	Very low	47.6	Very low	202 Å²	202	128.7 Å²	128.7	88%	0.878	74%	0.735	S	S	*	*			trans	-139	77.2	158.5	-75.1	-168.6	178.9	174.9	0	110.5
200	Q	42.8	Very low	46.1	Very low	179 Å²	179	133.6 Å²	133.6	84%	0.836	75%	0.752	S	S	*	*			trans	-85.7	126.6	143.9	-101.5	178.6	-6.6	0	0	108.1
201	N	38.7	Very low	44.1	Very low	149 Å²	149	135.9 Å²	135.9	80%	0.797	77%	0.768	S	S	*	*			trans	46.1	108.9	152.7	-79.9	-5.7	0	0	0	119.2
202	Q	36.5	Very low	43.1	Very low	179 Å²	179	137.2 Å²	137.2	84%	0.836	78%	0.778	S	S	*	*				167.3	146.4	101.9	-80.4	-134.1	57.2	0	0	112.6
203	L	36.5	Very low	41.9	Very low	153 Å²	153	139.8 Å²	139.8	80%	0.801	79%	0.789	S	S	*	*			trans	-55	158.8	168.6	-61.6	118.7	0	0	0	111
204	S	37.2	Very low	40.7	Very low	108 Å²	108	138.1 Å²	138.1	76%	0.755	79%	0.787	S	S	*	*			cis	-170	-144.7	7.1	40.1	0	0	0	0	107.9
205	P	56.9	Low	39.6	Very low	108 Å²	108	137.1 Å²	137.1	70%	0.701	79%	0.791	S	S	*	*				-122.5	-177.9	-117.3	33.5	-10.6	0	0	0	117
206	L	37.8	Very low	38.8	Very low	160 Å²	160	137.8 Å²	137.8	84%	0.838	80%	0.796	S	S	*	*			trans	99	139.5	154.1	-90.2	135.8	0	0	0	121.6
207	D	33.6	Very low	38.5	Very low	167 Å²	167	143.9 Å²	143.9	89%	0.893	81%	0.806	S	S	*	*			trans	74.2	133.8	159.8	-131.8	32.2	0	0	0	116.7
208	G	32.3	Very low	37.9	Very low	66 Å²	66	144 Å²	144	68%	0.68	81%	0.807	S	S	*	*			cis	150.6	139.1	14.9	0	0	0	0	0	105.6
209	G	32.1	Very low	37.7	Very low	67 Å²	67	145.6 Å²	145.6	69%	0.691	81%	0.81	S	S	*	*			trans	129.9	82.8	166.4	0	0	0	0	0	118.7
210	K	45.5	Very low	37.3	Very low	207 Å²	207	143.9 Å²	143.9	90%	0.9	80%	0.802	S	S	*	*				6.8	127.7	128.8	38.4	173.7	174.5	178.8	0	117.8
211	S	30.7	Very low	37	Very low	127 Å²	127	139.6 Å²	139.6	89%	0.888	79%	0.792	S	S	*	*			trans	-150.5	125.3	136.1	-149.9	0	0	0	0	113
212	L	44	Very low	37.5	Very low	162 Å²	162	136.3 Å²	136.3	85%	0.848	78%	0.779	S	S	*	*			trans	-77.7	144.3	168.4	-69.6	148.7	0	0	0	109
213	M	33.4	Very low	37.8	Very low	181 Å²	181	132.4 Å²	132.4	89%	0.892	77%	0.769	S	S	*	*			trans	-169.9	119.5	133	-152.3	66.6	163.7	0	0	111.8
214	S	32.5	Very low	37.8	Very low	90 Å²	90	133.9 Å²	133.9	63%	0.629	77%	0.772	S	S	*	*			trans	38.6	117.3	134.1	-150.2	0	0	0	0	119.7
215	S	31	Very low	37.9	Very low	121 Å²	121	133 Å²	133	85%	0.846	77%	0.766	S	S	*	*			trans	-122.3	109.3	149.3	-77.8	0	0	0	0	108.5
216	S	33	Very low	37	Very low	100 Å²	100	134.1 Å²	134.1	70%	0.699	77%	0.773	S	S	*	*			trans	-57.9	147.5	176.6	-53.2	0	0	0	0	111.4	D218	S216-D218 PolarHBondContact O-N 3.3Å
217	E	38.2	Very low	37.1	Very low	194 Å²	194	133.3 Å²	133.3	91%	0.907	77%	0.77	S	S	*	*			trans	-81.3	103.9	-175.5	-46.9	-177.2	116	0	0	108.4
218	D	34.2	Very low	37.4	Very low	155 Å²	155	134 Å²	134	83%	0.829	77%	0.768	S	S	*	*			trans	-105.7	103.3	163.9	-83.4	-55.5	0	0	0	109	S216 F220	S216-D218 PolarHBondContact O-N 3.3Å; D218-F220 PolarHBondContact O-N 2.77Å
219	E	43.2	Very low	37.4	Very low	183 Å²	183	138.5 Å²	138.5	86%	0.855	78%	0.776	S	S	*	*			trans	-53.2	120.3	169	-151.6	-161.5	131	0	0	110.1
220	F	33.8	Very low	37.6	Very low	165 Å²	165	141 Å²	141	72%	0.724	78%	0.783	S	S	*	*			trans	-138	103.5	172.8	-156.6	-92.8	0	0	0	111.9	D218	D218-F220 PolarHBondContact O-N 2.77Å
221	S	35.9	Very low	36.9	Very low	90 Å²	90	138.8 Å²	138.8	63%	0.629	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-67.9	134.4	169.1	-73.5	0	0	0	0	111.5
222	P	50	Low	37.1	Very low	79 Å²	79	140.7 Å²	140.7	51%	0.513	78%	0.779	S	S	.	*	P	Polyproline II helix	trans	-84.6	155.4	167.9	31.6	-28.3	0	0	0	111.8	A105	A105-P222 HydrophobicContact CB-CG 3.98Å
223	P	41.5	Very low	36.7	Very low	98 Å²	98	140.6 Å²	140.6	64%	0.636	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-69.5	142.1	-172.1	28.4	-34.4	0	0	0	112.6	S225	P223-S225 PolarHBondContact O-N 3.1Å
224	Q	37.4	Very low	36.6	Very low	184 Å²	184	140.3 Å²	140.3	86%	0.86	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-59.4	129.2	169.3	-73.8	176.8	-39.9	0	0	110.3
225	S	39.8	Very low	36.5	Very low	90 Å²	90	145.6 Å²	145.6	63%	0.629	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-70.3	151.3	160.4	42	0	0	0	0	109.6	P223 D227	P223-S225 PolarHBondContact O-N 3.1Å; S225-D227 PolarHBondContact O-N 3.5Å; S225-D227 VanDerWaalsContact O-N 3.16Å
226	P	38.2	Very low	36.4	Very low	131 Å²	131	143 Å²	143	85%	0.851	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-65.9	117.5	-179.7	27.2	-31.6	0	0	0	109.5
227	D	39.6	Very low	36.2	Very low	143 Å²	143	145.3 Å²	145.3	77%	0.765	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-66.5	129.5	174.7	-75.8	-42.1	0	0	0	110.2	S225	S225-D227 PolarHBondContact O-N 3.5Å; S225-D227 VanDerWaalsContact O-N 3.16Å
228	Q	39.1	Very low	35.9	Very low	182 Å²	182	145.3 Å²	145.3	85%	0.85	79%	0.794	S	S	*	*			trans	-104.8	132.5	151.7	-73.2	-172.3	-5.2	0	0	108
229	N	32.8	Very low	35.8	Very low	159 Å²	159	142.3 Å²	142.3	85%	0.85	79%	0.786	S	S	*	*			trans	77.7	98	168.5	-69.7	-11.2	0	0	0	119.1
230	S	35.2	Very low	35.3	Very low	119 Å²	119	142.6 Å²	142.6	83%	0.832	79%	0.786	S	S	*	*			trans	-42.1	128.8	151.6	-54.7	0	0	0	0	113
231	L	31.7	Very low	35.6	Very low	161 Å²	161	140.5 Å²	140.5	84%	0.843	79%	0.789	S	S	*	*			trans	-124.9	101.6	151.6	-98.6	170.6	0	0	0	108.2	L233	L231-L233 PolarHBondContact O-N 3.23Å
232	L	34.3	Very low	35.3	Very low	168 Å²	168	140.1 Å²	140.1	88%	0.88	80%	0.8	S	S	*	*			trans	-58.8	116.6	159.8	-90.5	159	0	0	0	108.6
233	L	35.2	Very low	34.5	Very low	159 Å²	159	142.8 Å²	142.8	83%	0.832	81%	0.814	S	S	*	*			trans	-121.7	111.5	159.1	-103	155.2	0	0	0	108.4	L231 Q235	L231-L233 PolarHBondContact O-N 3.23Å; L233-Q235 PolarHBondContact O-N 3.32Å
234	L	32.8	Very low	34	Very low	175 Å²	175	143.7 Å²	143.7	92%	0.916	82%	0.823	S	S	*	*			trans	-46.9	120.9	173	-159.8	76.2	0	0	0	110.9
235	Q	29	Very low	33.7	Very low	201 Å²	201	139.1 Å²	139.1	94%	0.939	81%	0.812	S	S	*	*			trans	-124.4	113.7	168.5	-152.2	156.7	45	0	0	107.5	L233	L233-Q235 PolarHBondContact O-N 3.32Å
236	G	29	Very low	33.5	Very low	68 Å²	68	145.9 Å²	145.9	70%	0.701	83%	0.825	S	S	*	*			trans	-145.8	125.1	-179.4	0	0	0	0	0	111.2
237	N	29	Very low	33.8	Very low	148 Å²	148	145 Å²	145	79%	0.791	82%	0.819	S	S	*	*			trans	74	100.2	162	-80.5	30.5	0	0	0	120
238	M	33.3	Very low	33.4	Very low	193 Å²	193	146.4 Å²	146.4	95%	0.951	82%	0.823	S	S	*	*			trans	-123.9	121.2	134.3	-82.8	-67	179	0	0	109.2
239	S	30.1	Very low	33.2	Very low	93 Å²	93	144.9 Å²	144.9	65%	0.65	83%	0.826	S	S	*	*			trans	-93.5	133.4	-176.5	12	0	0	0	0	110.7
240	H	34.2	Very low	33.1	Very low	188 Å²	188	140.2 Å²	140.2	87%	0.87	82%	0.816	S	S	*	*			trans	-143.5	128.1	155.2	-88.2	-71.9	0	0	0	109.2
241	P	38.7	Very low	33	Very low	121 Å²	121	143.6 Å²	143.6	79%	0.786	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-91.6	127.1	171.7	33.2	-26.2	0	0	0	110.2
242	G	31.3	Very low	33	Very low	82 Å²	82	139.6 Å²	139.6	85%	0.845	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-97.9	119.7	167.5	0	0	0	0	0	109.9
243	V	32.2	Very low	32.9	Very low	135 Å²	135	135.3 Å²	135.3	82%	0.818	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-86.2	125.3	177.5	-178.2	0	0	0	0	109.1
244	S	31.8	Very low	32.9	Very low	117 Å²	117	132.9 Å²	132.9	82%	0.818	82%	0.821	S	S	*	*			trans	-168.6	125.7	140.4	-98.8	0	0	0	0	113.2
245	S	31.2	Very low	33	Very low	89 Å²	89	133.2 Å²	133.2	62%	0.622	82%	0.818	S	S	*	*			trans	-56	145.1	169.7	44.7	0	0	0	0	115.9
246	Y	35.5	Very low	33.9	Very low	232 Å²	232	128 Å²	128	91%	0.91	80%	0.801	S	S	*	*				-154.3	144.1	127	-75.2	-68.8	0	0	0	110.3
247	P	44.5	Very low	34.1	Very low	113 Å²	113	131.5 Å²	131.5	73%	0.734	80%	0.803	S	S	*	*			trans	-114.9	175.5	-172.9	42.1	-31.9	0	0	0	115.1
248	M	31.1	Very low	34.5	Very low	172 Å²	172	133.2 Å²	133.2	85%	0.847	81%	0.806	S	S	*	*			trans	86.7	110.4	154.2	-73.1	-63.3	-175.9	0	0	120.8
249	T	34.9	Very low	34.4	Very low	149 Å²	149	127.2 Å²	127.2	91%	0.914	79%	0.793	S	S	*	*				173.6	132.6	122.4	35.9	0	0	0	0	105.6
250	G	31.1	Very low	34.6	Very low	61 Å²	61	130.8 Å²	130.8	63%	0.629	80%	0.802	S	S	*	*			cis	142.6	126.6	12.9	0	0	0	0	0	107
251	L	33.1	Very low	34.6	Very low	191 Å²	191	130.9 Å²	130.9	100%	1	80%	0.802	S	S	*	*			trans	72.2	137.1	166.2	-58.9	142.8	0	0	0	116.7
252	G	31	Very low	34.2	Very low	77 Å²	77	128.7 Å²	128.7	79%	0.794	80%	0.802	S	S	*	*			cis	-176.1	136	0.6	0	0	0	0	0	105.1
253	G	31	Very low	34.3	Very low	78 Å²	78	133.9 Å²	133.9	80%	0.804	80%	0.804	S	S	*	*				122.8	145	91.3	0	0	0	0	0	110.3
254	A	35.4	Very low	35.3	Very low	108 Å²	108	132.4 Å²	132.4	89%	0.893	80%	0.797	S	S	*	*			trans	82.7	95.6	167.8	0	0	0	0	0	119.6
255	Q	34.8	Very low	35.3	Very low	182 Å²	182	134.3 Å²	134.3	85%	0.85	79%	0.793	S	S	*	*			trans	-78.4	-172.9	145.6	-95.1	-158.4	-3.8	0	0	110.6
256	P	49.7	Very low	35.4	Very low	92 Å²	92	137.8 Å²	137.8	60%	0.597	80%	0.799	S	S	*	*			cis	-136.8	179.9	-16.2	21.3	3.6	0	0	0	113.2
257	L	32.8	Very low	35.4	Very low	140 Å²	140	134.2 Å²	134.2	73%	0.733	80%	0.795	S	S	*	*				155.6	133.4	117.7	-83.8	150.9	0	0	0	113.9
258	H	36.2	Very low	34.9	Very low	185 Å²	185	136.3 Å²	136.3	86%	0.856	80%	0.795	S	S	*	*			trans	51	143.4	152.1	-78.3	-74.1	0	0	0	120.4
259	G	31.4	Very low	35	Very low	67 Å²	67	134.4 Å²	134.4	69%	0.691	79%	0.788	S	S	*	*			cis	-174.7	171.8	15.2	0	0	0	0	0	111.4
260	M	34.3	Very low	34.9	Very low	168 Å²	168	131.8 Å²	131.8	83%	0.828	78%	0.776	S	S	*	*			trans	-85.9	169.5	-171.9	-63.4	-105	79.7	0	0	113.8
261	H	33.8	Very low	35.2	Very low	189 Å²	189	136.3 Å²	136.3	88%	0.875	79%	0.785	S	S	*	*			trans	105.5	130.6	150.2	-75.3	84.1	0	0	0	120.1
262	G	30.9	Very low	35.4	Very low	76 Å²	76	135 Å²	135	78%	0.784	78%	0.778	S	S	*	*			trans	134.5	93.5	133.6	0	0	0	0	0	118.5
263	H	33.9	Very low	35.7	Very low	191 Å²	191	134.9 Å²	134.9	88%	0.884	78%	0.776	S	S	*	*			trans	-82.6	179.6	146.3	-95.5	-57.7	0	0	0	109.2
264	P	53	Low	36.9	Very low	104 Å²	104	136.9 Å²	136.9	68%	0.675	78%	0.775	S	S	*	*			cis	-139.5	-154.1	-19.6	32.3	-6.9	0	0	0	113.6
265	H	31.9	Very low	36.8	Very low	156 Å²	156	140.2 Å²	140.2	72%	0.722	78%	0.777	S	S	*	*			trans	89.7	119.8	169	-74.7	-76.9	0	0	0	117.7
266	Q	34.2	Very low	36.9	Very low	162 Å²	162	137.4 Å²	137.4	76%	0.757	77%	0.773	S	S	*	*			cis	91.9	124.3	47	-168.8	-173.3	57.6	0	0	112.3
267	L	34.9	Very low	36.2	Very low	157 Å²	157	138.1 Å²	138.1	82%	0.822	78%	0.78	S	S	*	*			trans	176.6	111	151.5	-87.8	178.3	0	0	0	106.4
268	Q	34.4	Very low	36.5	Very low	158 Å²	158	137.6 Å²	137.6	74%	0.738	79%	0.788	S	S	*	*				75.5	110.1	77.5	-161.7	139.3	11.2	0	0	114.3
269	D	32.1	Very low	36.4	Very low	132 Å²	132	135.9 Å²	135.9	71%	0.706	78%	0.784	S	S	*	*				167.7	128.6	113.6	-103.8	-51.1	0	0	0	115.3
270	S	33.8	Very low	36.9	Very low	93 Å²	93	138.7 Å²	138.7	65%	0.65	79%	0.788	S	S	*	*				43.7	122.9	129.9	-53.4	0	0	0	0	122.9
271	L	36.7	Very low	37.2	Very low	157 Å²	157	137.8 Å²	137.8	82%	0.822	79%	0.786	S	S	*	*				163.1	119	110.8	-85.1	163.7	0	0	0	114.6
272	L	37.8	Very low	37.4	Very low	163 Å²	163	136.5 Å²	136.5	85%	0.853	79%	0.785	S	S	*	*			trans	26.4	123.7	140	-60.4	169.3	0	0	0	122
273	G	35.9	Very low	37.8	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	78%	0.782	S	S	*	*				98.7	129.7	113.1	0	0	0	0	0	119.8
274	P	56.7	Low	38.2	Very low	120 Å²	120	136.9 Å²	136.9	78%	0.779	81%	0.808	S	S	*	*			trans	-99.6	163.2	-173.1	39.5	-33.4	0	0	0	113.4
275	L	34.4	Very low	37.5	Very low	179 Å²	179	138.6 Å²	138.6	94%	0.937	82%	0.815	S	S	*	*			trans	-136.3	134.6	164.3	-74.4	178.1	0	0	0	113.8
276	T	37.2	Very low	37.8	Very low	123 Å²	123	137.6 Å²	137.6	76%	0.755	82%	0.82	S	S	*	*			trans	-93.2	160.5	178.8	55.7	0	0	0	0	111.7
277	S	34.3	Very low	38	Very low	107 Å²	107	136.3 Å²	136.3	75%	0.748	82%	0.823	S	S	*	*			trans	73.3	128	146.6	-154.3	0	0	0	0	119.6
278	S	38.8	Very low	38.2	Very low	129 Å²	129	135.1 Å²	135.1	90%	0.902	82%	0.823	S	S	*	*			trans	-159.5	130.9	132.5	-84.9	0	0	0	0	111.4
279	L	34.1	Very low	38.4	Very low	149 Å²	149	133.6 Å²	133.6	78%	0.78	83%	0.828	S	S	*	*			trans	-97.5	166.3	174.1	-161.7	90.8	0	0	0	108.1
280	V	41.9	Very low	38.8	Very low	125 Å²	125	133.7 Å²	133.7	76%	0.758	84%	0.837	S	S	*	*			trans	69.5	144.7	165.7	-58.4	0	0	0	0	117.4
281	D	40.1	Very low	39.2	Very low	150 Å²	150	136.6 Å²	136.6	80%	0.802	85%	0.85	S	S	*	*			cis	-159.4	160.7	31.3	-162.1	12.6	0	0	0	113
282	L	38.3	Very low	39.4	Very low	162 Å²	162	135.1 Å²	135.1	85%	0.848	85%	0.852	S	S	*	*			trans	-78.9	156.9	168.7	-79	151	0	0	0	111.1
283	G	39.4	Very low	39.5	Very low	69 Å²	69	132.8 Å²	132.8	71%	0.711	85%	0.852	S	S	*	*			trans	137.1	96.5	147.3	0	0	0	0	0	116.6
284	S	43.2	Very low	39.9	Very low	206 Å²	206	138.1 Å²	138.1	100%	1.441	86%	0.86	S	S	*	*				-170.3	0	116.6	-74.1	0	0	0	0	109.6

Retrieved 284 of 284 residues in 168.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).