A0A096M6Z9_POEFO Loading...

RING-type E3 ubiquitin transferase

AlphaFold DB , UniProt , Accession A0A096M6Z9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 270 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.3	Very low	58.9	Low	250 Å²	250	113.3 Å²	113.3	100%	1.232	68%	0.683	S	S	*	*				0	94.6	0	-70.6	-177.9	177.7	0	0	107.8
2	A	39.2	Very low	61.7	Low	101 Å²	101	111 Å²	111	84%	0.835	66%	0.66	S	S	*	*			trans	-89.6	108.3	174	0	0	0	0	0	107.2	S4	A2-S4 PolarHBondContact O-N 3.24Å
3	G	44.7	Very low	64.1	Low	75 Å²	75	109.9 Å²	109.9	77%	0.773	64%	0.644	S	S	*	*			trans	-65.1	112.7	171.2	0	0	0	0	0	108.7
4	S	43.6	Very low	66.3	Low	108 Å²	108	103.1 Å²	103.1	76%	0.755	60%	0.603	S	S	*	*			trans	-53.5	130.1	171.9	-51.8	0	0	0	0	109.3	A2 E6	A2-S4 PolarHBondContact O-N 3.24Å; S4-E6 PolarHBondContact O-N 3.14Å
5	P	47	Very low	68.2	Low	118 Å²	118	98.6 Å²	98.6	77%	0.766	57%	0.573	S	S	*	*			trans	-63.6	113.9	171.1	25	-30	0	0	0	107.6	K7	P5-K7 PolarHBondContact O-N 2.97Å
6	E	53.9	Low	69.9	Low	188 Å²	188	97.4 Å²	97.4	88%	0.879	56%	0.561	S	S	*	*			trans	-55	108.6	168.1	-75.6	-168.6	162.1	0	0	107	S4 S8	S4-E6 PolarHBondContact O-N 3.14Å; E6-S8 VanDerWaalsContact C-N 3.33Å; E6-S8 PolarHBondContact O-N 3.46Å
7	K	57.2	Low	71.4	Confident	197 Å²	197	97 Å²	97	86%	0.857	55%	0.553	S	S	*	*			trans	-58.2	102.6	171.3	-74.5	-179.9	178.2	179.8	0	106.4	P5 S9	P5-K7 PolarHBondContact O-N 2.97Å; K7-S9 PolarHBondContact O-N 3.03Å
8	S	65.1	Low	72.8	Confident	71 Å²	71	91.6 Å²	91.6	50%	0.497	52%	0.522	S	S	.	.			trans	-58.2	104.4	176.5	170.1	0	0	0	0	108	E6 T10 R40	E6-S8 VanDerWaalsContact C-N 3.33Å; E6-S8 PolarHBondContact O-N 3.46Å; S8-T10 PolarHBondContact O-N 2.99Å; S8-R40 PolarHBondContact OG-NH2 3.44Å
9	S	77.4	Confident	74	Confident	51 Å²	51	90 Å²	90	36%	0.357	51%	0.512	S	S	.	.			trans	-56.9	137.9	-178.7	-53.3	0	0	0	0	110.6	K7 E13	K7-S9 PolarHBondContact O-N 3.03Å; S9-E13 WeakPolarHBondContact CA-OE2 3.28Å; S9-E13 WeakPolarHBondContact CB-OE2 3.37Å
10	T	90.8	Very high	75.2	Confident	72 Å²	72	93.9 Å²	93.9	44%	0.442	52%	0.518	S	S	.	.			trans	-68.4	158.1	-179.5	64.5	0	0	0	0	110.8	S8 Q12 E13 L14	S8-T10 PolarHBondContact O-N 2.99Å; T10-Q12 PolarHBondContact O-N 3.07Å; T10-Q12 VanDerWaalsContact O-N 3.17Å; T10-E13 PolarHBondContact N-OE2 3.23Å; T10-E13 PolarHBondContact O-N 3.24Å; T10-E13 VanDerWaalsContact O-N 3.11Å; T10-E13 VanDerWaalsContact OG1-CD 3.31Å; T10-E13 VanDerWaalsContact OG1-CG 3.27Å; T10-E13 WeakPolarHBondContact OG1-CG 3.43Å; T10-E13 PolarHBondContact OG1-N 3.33Å; T10-L14 WeakPolarHBondContact O-CG 3.39Å; T10-L14 PolarHBondContact O-N 3.05Å
11	A	90.3	Very high	76.2	Confident	15 Å²	15	90.9 Å²	90.9	12%	0.124	50%	0.501	C	S	.	.	H	α-helix	trans	-56.3	-33.7	177.1	0	0	0	0	0	112.1	K15 R40 N41 Y47	A11-K15 PolarHBondContact O-N 3.01Å; A11-R40 HydrophobicContact CB-CB 3.91Å; A11-N41 HydrophobicContact CB-CB 4.14Å; A11-Y47 HydrophobicContact CB-CE2 4.14Å
12	Q	91.5	Very high	78.9	Confident	86 Å²	86	81.1 Å²	81.1	40%	0.402	45%	0.451	S	S	.	.	H	α-helix	trans	-68.6	-45	175.9	-177.6	71.4	-5.2	0	0	112.5	T10 L14 K15 E16	T10-Q12 PolarHBondContact O-N 3.07Å; T10-Q12 VanDerWaalsContact O-N 3.17Å; Q12-L14 VanDerWaalsContact C-N 3.31Å; Q12-L14 PolarHBondContact O-N 3.29Å; Q12-K15 WeakPolarHBondContact O-CB 3.33Å; Q12-K15 PolarHBondContact O-N 3.24Å; Q12-E16 WeakPolarHBondContact O-CG 3.33Å; Q12-E16 PolarHBondContact O-N 3.1Å
13	E	93.8	Very high	81.6	Confident	97 Å²	97	83.1 Å²	83.1	45%	0.453	45%	0.447	S	S	.	.	H	α-helix	trans	-61.6	-40.5	175.5	-74.6	163.7	-168.2	0	0	111.5	S9 T10 K15 E16 Q17	S9-E13 WeakPolarHBondContact CA-OE2 3.28Å; S9-E13 WeakPolarHBondContact CB-OE2 3.37Å; T10-E13 PolarHBondContact N-OE2 3.23Å; T10-E13 PolarHBondContact O-N 3.24Å; T10-E13 VanDerWaalsContact O-N 3.11Å; T10-E13 VanDerWaalsContact OG1-CD 3.31Å; T10-E13 VanDerWaalsContact OG1-CG 3.27Å; T10-E13 WeakPolarHBondContact OG1-CG 3.43Å; T10-E13 PolarHBondContact OG1-N 3.33Å; E13-K15 VanDerWaalsContact C-N 3.33Å; E13-K15 PolarHBondContact O-N 2.87Å; E13-E16 PolarHBondContact O-N 2.93Å; E13-Q17 WeakPolarHBondContact O-CB 3.39Å; E13-Q17 PolarHBondContact O-N 3.36Å
14	L	94.6	Very high	84.1	Confident	14 Å²	14	83.8 Å²	83.8	7%	0.073	44%	0.439	C	S	.	.	H	α-helix	trans	-63.5	-38.6	175.9	-71.1	167.4	0	0	0	111.9	T10 Q12 Q17 G18 K36 A37 R40	T10-L14 WeakPolarHBondContact O-CG 3.39Å; T10-L14 PolarHBondContact O-N 3.05Å; Q12-L14 VanDerWaalsContact C-N 3.31Å; Q12-L14 PolarHBondContact O-N 3.29Å; L14-Q17 PolarHBondContact O-N 3.43Å; L14-G18 PolarHBondContact O-N 3.39Å; L14-K36 HydrophobicContact CD1-CB 3.93Å; L14-K36 HydrophobicContact CD2-CB 4.16Å; L14-K36 HydrophobicContact CD2-CD 4.4Å; L14-A37 HydrophobicContact CB-CB 3.87Å; L14-R40 HydrophobicContact CD1-CG 4.07Å
15	K	94.7	Very high	86.5	Confident	36 Å²	36	88.1 Å²	88.1	16%	0.157	44%	0.439	C	S	.	.	H	α-helix	trans	-62.3	-46.4	171.7	-179.1	-152.7	66.1	-170	0	111	A11 Q12 E13 Q17 G18 N19 Y34 Y47	A11-K15 PolarHBondContact O-N 3.01Å; Q12-K15 WeakPolarHBondContact O-CB 3.33Å; Q12-K15 PolarHBondContact O-N 3.24Å; E13-K15 VanDerWaalsContact C-N 3.33Å; E13-K15 PolarHBondContact O-N 2.87Å; K15-Q17 VanDerWaalsContact C-N 3.34Å; K15-Q17 PolarHBondContact O-N 2.79Å; K15-G18 PolarHBondContact O-N 2.63Å; K15-N19 PolarHBondContact O-N 3.5Å; K15-N19 PolarHBondContact O-OD1 3.01Å; K15-Y34 HydrophobicContact CG-CE1 4.12Å; K15-Y47 HydrophobicContact CB-CD1 4.09Å; K15-Y47 HydrophobicContact CB-CE1 3.73Å; K15-Y47 HydrophobicContact CD-CD1 4.26Å; K15-Y47 HydrophobicContact CD-CE1 3.91Å; K15-Y47 HydrophobicContact CG-CD1 4.03Å; K15-Y47 HydrophobicContact CG-CE1 3.95Å
16	E	95.9	Very high	88.9	Confident	79 Å²	79	87.1 Å²	87.1	37%	0.369	42%	0.422	S	S	.	.	H	α-helix	trans	-64.5	-38.5	179.2	-72.2	174.3	-162.2	0	0	112.4	Q12 E13 N19 R20	Q12-E16 WeakPolarHBondContact O-CG 3.33Å; Q12-E16 PolarHBondContact O-N 3.1Å; E13-E16 PolarHBondContact O-N 2.93Å; E16-N19 WeakPolarHBondContact O-CB 3.2Å; E16-N19 PolarHBondContact O-N 3.08Å; E16-R20 WeakPolarHBondContact O-CG 3.36Å; E16-R20 PolarHBondContact O-N 2.73Å
17	Q	95.3	Very high	91	Very high	91 Å²	91	80.7 Å²	80.7	43%	0.425	39%	0.39	S	S	.	.	H	α-helix	trans	-61.6	-44.8	171.5	-171.5	-178.6	15.3	0	0	111.3	E13 L14 K15 N19 R20 L21	E13-Q17 WeakPolarHBondContact O-CB 3.39Å; E13-Q17 PolarHBondContact O-N 3.36Å; L14-Q17 PolarHBondContact O-N 3.43Å; K15-Q17 VanDerWaalsContact C-N 3.34Å; K15-Q17 PolarHBondContact O-N 2.79Å; Q17-N19 VanDerWaalsContact C-N 3.32Å; Q17-N19 PolarHBondContact O-N 2.9Å; Q17-R20 PolarHBondContact O-N 3.24Å; Q17-L21 HydrophobicContact CG-CD1 4.31Å; Q17-L21 WeakPolarHBondContact O-CG 3.47Å; Q17-L21 PolarHBondContact O-N 2.9Å
18	G	96.2	Very high	92.8	Very high	0 Å²	0	78.3 Å²	78.3	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-57.7	-42.9	173.2	0	0	0	0	0	112.4	L14 K15 R20 L21 F22 A30 Y34	L14-G18 PolarHBondContact O-N 3.39Å; K15-G18 PolarHBondContact O-N 2.63Å; G18-R20 PolarHBondContact O-N 3.05Å; G18-L21 PolarHBondContact O-N 3.27Å; G18-F22 WeakPolarHBondContact O-CB 3.48Å; G18-F22 PolarHBondContact O-N 3.31Å; G18-A30 WeakPolarHBondContact O-CB 3.34Å; G18-Y34 PolarHBondContact O-OH 3.48Å
19	N	96.2	Very high	94.3	Very high	61 Å²	61	79.2 Å²	79.2	33%	0.326	38%	0.379	S	S	.	.	H	α-helix	trans	-61.6	-43.2	176.8	-70.2	-6.9	0	0	0	111.6	K15 E16 Q17 F22 L23 Y34 N50	K15-N19 PolarHBondContact O-N 3.5Å; K15-N19 PolarHBondContact O-OD1 3.01Å; E16-N19 WeakPolarHBondContact O-CB 3.2Å; E16-N19 PolarHBondContact O-N 3.08Å; Q17-N19 VanDerWaalsContact C-N 3.32Å; Q17-N19 PolarHBondContact O-N 2.9Å; N19-F22 WeakPolarHBondContact O-CB 3.35Å; N19-F22 PolarHBondContact O-N 3.37Å; N19-L23 WeakPolarHBondContact O-CG 3.44Å; N19-L23 PolarHBondContact O-N 2.9Å; N19-Y34 WeakPolarHBondContact CA-OH 3.31Å; N19-Y34 PolarHBondContact N-OH 3.27Å; N19-Y34 PolarHBondContact OD1-OH 3.27Å; N19-N50 PolarHBondContact OD1-ND2 3.41Å
20	R	97.1	Very high	95.2	Very high	168 Å²	168	76.8 Å²	76.8	63%	0.634	36%	0.362	S	S	*	.	H	α-helix	trans	-62.3	-46.4	176.8	-67.1	174.4	-158.8	174.5	7	111.3	E16 Q17 G18 F22 L23 C24	E16-R20 WeakPolarHBondContact O-CG 3.36Å; E16-R20 PolarHBondContact O-N 2.73Å; Q17-R20 PolarHBondContact O-N 3.24Å; G18-R20 PolarHBondContact O-N 3.05Å; R20-F22 VanDerWaalsContact C-N 3.3Å; R20-F22 PolarHBondContact O-N 3.5Å; R20-L23 PolarHBondContact O-N 3.31Å; R20-C24 PolarHBondContact O-N 2.81Å; R20-C24 PolarHBondContact O-SG 3.35Å; R20-C24 VanDerWaalsContact O-SG 3.35Å
21	L	96.5	Very high	95.5	Very high	30 Å²	30	73.8 Å²	73.8	16%	0.157	34%	0.344	C	S	.	.	H	α-helix	trans	-63.5	-37.6	177.6	-70.4	168.2	0	0	0	112.1	Q17 G18 C24 R25 K26 E29 A30 C33	Q17-L21 HydrophobicContact CG-CD1 4.31Å; Q17-L21 WeakPolarHBondContact O-CG 3.47Å; Q17-L21 PolarHBondContact O-N 2.9Å; G18-L21 PolarHBondContact O-N 3.27Å; L21-C24 CarbonylContact O-C 3.38Å; L21-C24 PolarHBondContact O-N 2.9Å; L21-R25 PolarHBondContact O-N 3.25Å; L21-K26 HydrophobicContact CB-CB 4.39Å; L21-K26 HydrophobicContact CD2-CB 4.31Å; L21-K26 HydrophobicContact CD2-CD 3.9Å; L21-K26 PolarHBondContact O-N 3.48Å; L21-E29 HydrophobicContact CD1-CB 3.96Å; L21-E29 HydrophobicContact CD2-CB 4.31Å; L21-E29 WeakPolarHBondContact CD2-OE2 3.4Å; L21-A30 HydrophobicContact CB-CB 3.86Å; L21-C33 HydrophobicContact CD1-CB 4.47Å; L21-C33 VanDerWaalsContact CD1-SG 3.52Å
22	F	96.4	Very high	95.8	Very high	45 Å²	45	75.9 Å²	75.9	20%	0.197	36%	0.358	C	S	.	.	H	α-helix	trans	-61.7	-45.1	175.1	-175	-93.2	0	0	0	111.7	G18 N19 R20 C24 R25 Y27 A30 L53 C54 K57	G18-F22 WeakPolarHBondContact O-CB 3.48Å; G18-F22 PolarHBondContact O-N 3.31Å; N19-F22 WeakPolarHBondContact O-CB 3.35Å; N19-F22 PolarHBondContact O-N 3.37Å; R20-F22 VanDerWaalsContact C-N 3.3Å; R20-F22 PolarHBondContact O-N 3.5Å; F22-C24 VanDerWaalsContact C-N 3.27Å; F22-C24 PolarHBondContact O-N 2.87Å; F22-R25 WeakPolarHBondContact O-CA 3.41Å; F22-R25 PolarHBondContact O-N 3.38Å; F22-Y27 AromaticContact CD2-CD1 3.65Å; F22-Y27 HydrophobicContact CD2-CD1 3.65Å; F22-Y27 AromaticContact CD2-CE1 3.92Å; F22-Y27 HydrophobicContact CD2-CE1 3.92Å; F22-Y27 AromaticContact CE2-CD1 3.68Å; F22-Y27 HydrophobicContact CE2-CD1 3.68Å; F22-Y27 AromaticContact CE2-CE1 3.73Å; F22-Y27 HydrophobicContact CE2-CE1 3.73Å; F22-Y27 HydrophobicContact CZ-CE1 4.16Å; F22-A30 HydrophobicContact CB-CB 4.24Å; F22-L53 HydrophobicContact CE1-CD2 4.06Å; F22-L53 HydrophobicContact CE2-CD2 3.97Å; F22-L53 HydrophobicContact CE2-CG 3.78Å; F22-L53 HydrophobicContact CZ-CD1 4.35Å; F22-L53 HydrophobicContact CZ-CD2 3.47Å; F22-L53 VanDerWaalsContact CZ-CD2 3.47Å; F22-L53 HydrophobicContact CZ-CG 3.63Å; F22-C54 VanDerWaalsContact CD2-SG 3.54Å; F22-K57 HydrophobicContact CE2-CG 4.27Å; F22-K57 HydrophobicContact CZ-CG 4.43Å
23	L	96.4	Very high	96	Very high	143 Å²	143	72.2 Å²	72.2	75%	0.749	34%	0.342	S	S	*	.	H	α-helix	trans	-62.5	-34.8	174.9	-68.4	171.9	0	0	0	112	N19 R20 R25	N19-L23 WeakPolarHBondContact O-CG 3.44Å; N19-L23 PolarHBondContact O-N 2.9Å; R20-L23 PolarHBondContact O-N 3.31Å; L23-R25 PolarHBondContact O-N 3.41Å
24	C	96.4	Very high	96.2	Very high	89 Å²	89	67.8 Å²	67.8	60%	0.601	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	8.4	172.1	-63.1	0	0	0	0	114.2	R20 L21 F22 K26	R20-C24 PolarHBondContact O-N 2.81Å; R20-C24 PolarHBondContact O-SG 3.35Å; R20-C24 VanDerWaalsContact O-SG 3.35Å; L21-C24 CarbonylContact O-C 3.38Å; L21-C24 PolarHBondContact O-N 2.9Å; F22-C24 VanDerWaalsContact C-N 3.27Å; F22-C24 PolarHBondContact O-N 2.87Å; C24-K26 HydrophobicContact CB-CD 4.25Å; C24-K26 HydrophobicContact CB-CG 4.42Å; C24-K26 PolarHBondContact O-N 3.07Å; C24-K26 VanDerWaalsContact O-N 3.15Å
25	R	94.8	Very high	96.3	Very high	200 Å²	200	68.7 Å²	68.7	76%	0.755	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	17.1	-177	-53.8	-177.5	177.2	-164	-0.5	114.7	L21 F22 L23 Y27	L21-R25 PolarHBondContact O-N 3.25Å; F22-R25 WeakPolarHBondContact O-CA 3.41Å; F22-R25 PolarHBondContact O-N 3.38Å; L23-R25 PolarHBondContact O-N 3.41Å; R25-Y27 VanDerWaalsContact C-N 3.3Å; R25-Y27 HydrophobicContact CB-CE2 4.22Å; R25-Y27 WeakPolarHBondContact O-CD2 3.24Å; R25-Y27 PolarHBondContact O-N 2.92Å; R25-Y27 VanDerWaalsContact O-N 3.14Å
26	K	96.8	Very high	96.3	Very high	96 Å²	96	72.5 Å²	72.5	42%	0.417	35%	0.345	S	S	.	.			trans	-88.5	66.4	176.5	-70	170	149.5	-117.6	0	110.1	L21 C24 Q28 E29 A30	L21-K26 HydrophobicContact CB-CB 4.39Å; L21-K26 HydrophobicContact CD2-CB 4.31Å; L21-K26 HydrophobicContact CD2-CD 3.9Å; L21-K26 PolarHBondContact O-N 3.48Å; C24-K26 HydrophobicContact CB-CD 4.25Å; C24-K26 HydrophobicContact CB-CG 4.42Å; C24-K26 PolarHBondContact O-N 3.07Å; C24-K26 VanDerWaalsContact O-N 3.15Å; K26-Q28 VanDerWaalsContact C-N 3.34Å; K26-Q28 PolarHBondContact O-N 2.85Å; K26-E29 HydrophobicContact CB-CB 4.25Å; K26-E29 HydrophobicContact CB-CG 4.45Å; K26-E29 WeakPolarHBondContact CD-OE2 2.89Å; K26-E29 VanDerWaalsContact NZ-CD 3.29Å; K26-E29 IonicContact NZ-OE1 3.64Å; K26-E29 PolarHBondContact NZ-OE1 3.36Å; K26-E29 IonicContact NZ-OE2 3.79Å; K26-E29 PolarHBondContact NZ-OE2 3.08Å; K26-E29 PolarHBondContact O-N 2.98Å; K26-A30 WeakPolarHBondContact O-CB 3.31Å; K26-A30 PolarHBondContact O-N 3.45Å
27	Y	96.6	Very high	96.3	Very high	53 Å²	53	68.7 Å²	68.7	21%	0.208	33%	0.327	C	S	.	.	H	α-helix	trans	-63.8	-35.3	-169.6	-52.6	-59	0	0	0	113.9	F22 R25 A30 A31 K57	F22-Y27 AromaticContact CD2-CD1 3.65Å; F22-Y27 HydrophobicContact CD2-CD1 3.65Å; F22-Y27 AromaticContact CD2-CE1 3.92Å; F22-Y27 HydrophobicContact CD2-CE1 3.92Å; F22-Y27 AromaticContact CE2-CD1 3.68Å; F22-Y27 HydrophobicContact CE2-CD1 3.68Å; F22-Y27 AromaticContact CE2-CE1 3.73Å; F22-Y27 HydrophobicContact CE2-CE1 3.73Å; F22-Y27 HydrophobicContact CZ-CE1 4.16Å; R25-Y27 VanDerWaalsContact C-N 3.3Å; R25-Y27 HydrophobicContact CB-CE2 4.22Å; R25-Y27 WeakPolarHBondContact O-CD2 3.24Å; R25-Y27 PolarHBondContact O-N 2.92Å; R25-Y27 VanDerWaalsContact O-N 3.14Å; Y27-A30 PolarHBondContact O-N 3.05Å; Y27-A31 WeakPolarHBondContact O-CB 3.47Å; Y27-A31 PolarHBondContact O-N 3.12Å; Y27-K57 HydrophobicContact CD1-CB 3.97Å; Y27-K57 HydrophobicContact CD1-CG 4.21Å; Y27-K57 HydrophobicContact CD2-CB 3.83Å; Y27-K57 HydrophobicContact CE1-CB 4.08Å; Y27-K57 HydrophobicContact CE1-CG 3.97Å; Y27-K57 HydrophobicContact CE2-CB 3.94Å; Y27-K57 HydrophobicContact CE2-CG 4.47Å; Y27-K57 HydrophobicContact CG-CB 3.84Å
28	Q	96.6	Very high	96.3	Very high	148 Å²	148	64.9 Å²	64.9	69%	0.692	31%	0.309	S	S	*	.	H	α-helix	trans	-70.6	-41.6	179.5	-168.6	168.1	0.3	0	0	112.1	K26 A31 S32 L58	K26-Q28 VanDerWaalsContact C-N 3.34Å; K26-Q28 PolarHBondContact O-N 2.85Å; Q28-A31 PolarHBondContact O-N 3.37Å; Q28-S32 PolarHBondContact O-N 3.41Å; Q28-S32 VanDerWaalsContact O-N 3.14Å; Q28-L58 HydrophobicContact CB-CD1 4.32Å
29	E	96	Very high	96.3	Very high	90 Å²	90	71.3 Å²	71.3	42%	0.421	34%	0.344	S	S	.	.	H	α-helix	trans	-65.3	-41.9	173.7	-60.8	174.8	-148.5	0	0	110.6	L21 K26 A31 S32 C33	L21-E29 HydrophobicContact CD1-CB 3.96Å; L21-E29 HydrophobicContact CD2-CB 4.31Å; L21-E29 WeakPolarHBondContact CD2-OE2 3.4Å; K26-E29 HydrophobicContact CB-CB 4.25Å; K26-E29 HydrophobicContact CB-CG 4.45Å; K26-E29 WeakPolarHBondContact CD-OE2 2.89Å; K26-E29 VanDerWaalsContact NZ-CD 3.29Å; K26-E29 IonicContact NZ-OE1 3.64Å; K26-E29 PolarHBondContact NZ-OE1 3.36Å; K26-E29 IonicContact NZ-OE2 3.79Å; K26-E29 PolarHBondContact NZ-OE2 3.08Å; K26-E29 PolarHBondContact O-N 2.98Å; E29-A31 PolarHBondContact O-N 2.96Å; E29-S32 WeakPolarHBondContact O-CB 3.46Å; E29-S32 PolarHBondContact O-N 2.89Å; E29-C33 PolarHBondContact O-N 3.27Å
30	A	96.9	Very high	96.2	Very high	0 Å²	0	76 Å²	76	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-60.5	-44.8	175.8	0	0	0	0	0	112.1	G18 L21 F22 K26 Y27 S32 C33 Y34	G18-A30 WeakPolarHBondContact O-CB 3.34Å; L21-A30 HydrophobicContact CB-CB 3.86Å; F22-A30 HydrophobicContact CB-CB 4.24Å; K26-A30 WeakPolarHBondContact O-CB 3.31Å; K26-A30 PolarHBondContact O-N 3.45Å; Y27-A30 PolarHBondContact O-N 3.05Å; A30-S32 VanDerWaalsContact C-N 3.27Å; A30-S32 PolarHBondContact O-N 3.28Å; A30-C33 WeakPolarHBondContact O-CB 3.39Å; A30-C33 PolarHBondContact O-N 2.9Å; A30-C33 VanDerWaalsContact O-N 3.15Å; A30-Y34 HydrophobicContact CB-CE2 4.17Å; A30-Y34 WeakPolarHBondContact O-CD2 3.38Å; A30-Y34 PolarHBondContact O-N 3.07Å
31	A	96.9	Very high	95.9	Very high	8 Å²	8	70.6 Å²	70.6	7%	0.066	34%	0.341	C	S	.	.	H	α-helix	trans	-61	-35.9	175.8	0	0	0	0	0	112.5	Y27 Q28 E29 S35 R51 C54	Y27-A31 WeakPolarHBondContact O-CB 3.47Å; Y27-A31 PolarHBondContact O-N 3.12Å; Q28-A31 PolarHBondContact O-N 3.37Å; E29-A31 PolarHBondContact O-N 2.96Å; A31-S35 WeakPolarHBondContact O-CB 3.48Å; A31-S35 PolarHBondContact O-N 3.33Å; A31-S35 PolarHBondContact O-OG 3.44Å; A31-R51 HydrophobicContact CB-CG 4.28Å; A31-C54 HydrophobicContact CB-CB 4.02Å
32	S	96.6	Very high	95.8	Very high	60 Å²	60	72.8 Å²	72.8	42%	0.42	36%	0.357	S	S	.	.	H	α-helix	trans	-65.7	-44.4	173.4	-175.1	0	0	0	0	111.5	Q28 E29 A30 Y34 S35 K36	Q28-S32 PolarHBondContact O-N 3.41Å; Q28-S32 VanDerWaalsContact O-N 3.14Å; E29-S32 WeakPolarHBondContact O-CB 3.46Å; E29-S32 PolarHBondContact O-N 2.89Å; A30-S32 VanDerWaalsContact C-N 3.27Å; A30-S32 PolarHBondContact O-N 3.28Å; S32-Y34 PolarHBondContact O-N 2.91Å; S32-S35 WeakPolarHBondContact O-CB 3.45Å; S32-S35 PolarHBondContact O-N 3.42Å; S32-K36 WeakPolarHBondContact O-CG 3.23Å; S32-K36 PolarHBondContact O-N 3.01Å
33	C	96.2	Very high	95.7	Very high	8 Å²	8	74.5 Å²	74.5	5%	0.054	37%	0.374	C	S	.	.	H	α-helix	trans	-60.3	-44.3	174.4	-75.2	0	0	0	0	112.6	L21 E29 A30 S35 K36 A37	L21-C33 HydrophobicContact CD1-CB 4.47Å; L21-C33 VanDerWaalsContact CD1-SG 3.52Å; E29-C33 PolarHBondContact O-N 3.27Å; A30-C33 WeakPolarHBondContact O-CB 3.39Å; A30-C33 PolarHBondContact O-N 2.9Å; A30-C33 VanDerWaalsContact O-N 3.15Å; C33-S35 VanDerWaalsContact C-N 3.33Å; C33-S35 PolarHBondContact O-N 3.44Å; C33-K36 WeakPolarHBondContact O-CB 3.32Å; C33-K36 PolarHBondContact O-N 3.24Å; C33-A37 PolarHBondContact O-N 3Å
34	Y	96.8	Very high	95.6	Very high	4 Å²	4	69.4 Å²	69.4	2%	0.016	35%	0.349	C	S	.	.	H	α-helix	trans	-65.6	-36.3	174.9	-62.3	-50.9	0	0	0	112.4	K15 G18 N19 A30 S32 K36 A37 I38 N50 R51 C54	K15-Y34 HydrophobicContact CG-CE1 4.12Å; G18-Y34 PolarHBondContact O-OH 3.48Å; N19-Y34 WeakPolarHBondContact CA-OH 3.31Å; N19-Y34 PolarHBondContact N-OH 3.27Å; N19-Y34 PolarHBondContact OD1-OH 3.27Å; A30-Y34 HydrophobicContact CB-CE2 4.17Å; A30-Y34 WeakPolarHBondContact O-CD2 3.38Å; A30-Y34 PolarHBondContact O-N 3.07Å; S32-Y34 PolarHBondContact O-N 2.91Å; Y34-K36 VanDerWaalsContact C-N 3.33Å; Y34-K36 PolarHBondContact O-N 3.05Å; Y34-A37 WeakPolarHBondContact O-CB 3.38Å; Y34-A37 PolarHBondContact O-N 3.37Å; Y34-A37 VanDerWaalsContact O-N 3.11Å; Y34-I38 VanDerWaalsContact O-CG1 3.31Å; Y34-I38 WeakPolarHBondContact O-CG1 3.46Å; Y34-I38 PolarHBondContact O-N 2.92Å; Y34-N50 HydrophobicContact CD1-CB 4.06Å; Y34-N50 HydrophobicContact CD2-CB 4.12Å; Y34-N50 HydrophobicContact CE1-CB 3.77Å; Y34-N50 HydrophobicContact CE2-CB 3.83Å; Y34-N50 HydrophobicContact CG-CB 4.24Å; Y34-R51 HydrophobicContact CD2-CB 4.36Å; Y34-C54 VanDerWaalsContact CE2-SG 3.55Å
35	S	96.9	Very high	95.5	Very high	33 Å²	33	65.8 Å²	65.8	23%	0.231	33%	0.326	C	S	.	.	H	α-helix	trans	-63.7	-39.6	174.6	-58.6	0	0	0	0	111.8	A31 S32 C33 A37 I38 N39 R51	A31-S35 WeakPolarHBondContact O-CB 3.48Å; A31-S35 PolarHBondContact O-N 3.33Å; A31-S35 PolarHBondContact O-OG 3.44Å; S32-S35 WeakPolarHBondContact O-CB 3.45Å; S32-S35 PolarHBondContact O-N 3.42Å; C33-S35 VanDerWaalsContact C-N 3.33Å; C33-S35 PolarHBondContact O-N 3.44Å; S35-A37 VanDerWaalsContact C-N 3.32Å; S35-A37 PolarHBondContact O-N 2.94Å; S35-I38 PolarHBondContact O-N 2.68Å; S35-N39 VanDerWaalsContact O-CG 3.27Å; S35-N39 PolarHBondContact O-N 3.25Å; S35-R51 VanDerWaalsContact OG-CD 3.24Å; S35-R51 WeakPolarHBondContact OG-CD 3.5Å; S35-R51 PolarHBondContact OG-NH1 3.47Å
36	K	95.8	Very high	95.6	Very high	116 Å²	116	59.9 Å²	59.9	50%	0.504	31%	0.311	S	S	.	.	H	α-helix	trans	-62.3	-39.7	171.1	-67.6	176.8	-177.5	-178	0	111.6	L14 S32 C33 Y34 N39 R40	L14-K36 HydrophobicContact CD1-CB 3.93Å; L14-K36 HydrophobicContact CD2-CB 4.16Å; L14-K36 HydrophobicContact CD2-CD 4.4Å; S32-K36 WeakPolarHBondContact O-CG 3.23Å; S32-K36 PolarHBondContact O-N 3.01Å; C33-K36 WeakPolarHBondContact O-CB 3.32Å; C33-K36 PolarHBondContact O-N 3.24Å; Y34-K36 VanDerWaalsContact C-N 3.33Å; Y34-K36 PolarHBondContact O-N 3.05Å; K36-N39 PolarHBondContact O-N 2.97Å; K36-R40 WeakPolarHBondContact O-CG 3.37Å; K36-R40 PolarHBondContact O-N 2.85Å
37	A	95	Very high	95.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.7	-42.8	175.7	0	0	0	0	0	112.1	L14 C33 Y34 S35 R40 N41 Y47	L14-A37 HydrophobicContact CB-CB 3.87Å; C33-A37 PolarHBondContact O-N 3Å; Y34-A37 WeakPolarHBondContact O-CB 3.38Å; Y34-A37 PolarHBondContact O-N 3.37Å; Y34-A37 VanDerWaalsContact O-N 3.11Å; S35-A37 VanDerWaalsContact C-N 3.32Å; S35-A37 PolarHBondContact O-N 2.94Å; A37-R40 PolarHBondContact O-N 3.26Å; A37-R40 VanDerWaalsContact O-N 3.16Å; A37-N41 PolarHBondContact O-N 3.15Å; A37-Y47 HydrophobicContact CB-CD1 4.39Å; A37-Y47 HydrophobicContact CB-CD2 4.17Å; A37-Y47 HydrophobicContact CB-CE2 4.3Å; A37-Y47 HydrophobicContact CB-CG 4.23Å
38	I	95.8	Very high	95.6	Very high	10 Å²	10	54.5 Å²	54.5	5%	0.051	29%	0.288	C	S	.	.	H	α-helix	trans	-61.5	-45.2	175.8	-69.3	164.1	0	0	0	111	Y34 S35 R40 N41 P42 Y47 Y48 R51	Y34-I38 VanDerWaalsContact O-CG1 3.31Å; Y34-I38 WeakPolarHBondContact O-CG1 3.46Å; Y34-I38 PolarHBondContact O-N 2.92Å; S35-I38 PolarHBondContact O-N 2.68Å; I38-R40 PolarHBondContact O-N 2.97Å; I38-N41 CarbonylContact O-C 3.46Å; I38-N41 PolarHBondContact O-N 2.89Å; I38-P42 WeakPolarHBondContact O-CA 3.49Å; I38-P42 VanDerWaalsContact O-N 3.08Å; I38-Y47 HydrophobicContact CG1-CD2 4.4Å; I38-Y47 HydrophobicContact CG1-CG 4.47Å; I38-Y48 HydrophobicContact CD1-CD1 4.01Å; I38-Y48 HydrophobicContact CD1-CE1 4.08Å; I38-Y48 HydrophobicContact CD1-CG 4.28Å; I38-Y48 HydrophobicContact CG1-CE1 4.47Å; I38-Y48 HydrophobicContact CG1-CE2 4.32Å; I38-Y48 HydrophobicContact CG2-CE1 4.06Å; I38-Y48 HydrophobicContact CG2-CE2 4.37Å; I38-Y48 WeakPolarHBondContact CG2-OH 3.32Å; I38-R51 VanDerWaalsContact CD1-CZ 3.43Å
39	N	95.3	Very high	95.6	Very high	136 Å²	136	47.7 Å²	47.7	73%	0.727	26%	0.257	S	S	*	.	H	α-helix	trans	-61.7	-27.4	177.3	-70.4	-11.5	0	0	0	112.8	S35 K36	S35-N39 VanDerWaalsContact O-CG 3.27Å; S35-N39 PolarHBondContact O-N 3.25Å; K36-N39 PolarHBondContact O-N 2.97Å
40	R	93.8	Very high	95.6	Very high	159 Å²	159	44.6 Å²	44.6	60%	0.6	24%	0.243	S	C	*	.	H	α-helix	trans	-82.5	-40	176.1	-68.1	-64.7	-174.3	177.4	0.1	112.3	S8 A11 L14 K36 A37 I38	S8-R40 PolarHBondContact OG-NH2 3.44Å; A11-R40 HydrophobicContact CB-CB 3.91Å; L14-R40 HydrophobicContact CD1-CG 4.07Å; K36-R40 WeakPolarHBondContact O-CG 3.37Å; K36-R40 PolarHBondContact O-N 2.85Å; A37-R40 PolarHBondContact O-N 3.26Å; A37-R40 VanDerWaalsContact O-N 3.16Å; I38-R40 PolarHBondContact O-N 2.97Å
41	N	92.4	Very high	95.6	Very high	55 Å²	55	46.6 Å²	46.6	29%	0.294	25%	0.251	S	S	.	.			trans	-146	100.3	175.6	-174.6	-1.5	0	0	0	110.8	A11 A37 I38 S43 V44 Y47	A11-N41 HydrophobicContact CB-CB 4.14Å; A37-N41 PolarHBondContact O-N 3.15Å; I38-N41 CarbonylContact O-C 3.46Å; I38-N41 PolarHBondContact O-N 2.89Å; N41-S43 VanDerWaalsContact C-N 3.3Å; N41-S43 PolarHBondContact O-N 2.88Å; N41-S43 PolarHBondContact OD1-N 3.42Å; N41-S43 VanDerWaalsContact OD1-N 3.13Å; N41-S43 PolarHBondContact OD1-OG 3.26Å; N41-V44 WeakPolarHBondContact ND2-CG2 3.36Å; N41-Y47 HydrophobicContact CB-CE2 4.33Å; N41-Y47 WeakPolarHBondContact O-CD2 3.37Å
42	P	93.5	Very high	95.6	Very high	76 Å²	76	46.2 Å²	46.2	49%	0.494	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-6.4	-177.7	32.2	-35.6	0	0	0	113.5	I38 V44 Y48 L74	I38-P42 WeakPolarHBondContact O-CA 3.49Å; I38-P42 VanDerWaalsContact O-N 3.08Å; P42-V44 VanDerWaalsContact C-N 3.27Å; P42-V44 PolarHBondContact O-N 3.48Å; P42-Y48 WeakPolarHBondContact O-CE2 3.37Å; P42-Y48 PolarHBondContact O-OH 3.5Å; P42-L74 WeakPolarHBondContact O-CD1 3.49Å
43	S	93.9	Very high	95.6	Very high	80 Å²	80	45.2 Å²	45.2	56%	0.559	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-1.2	-176.4	66	0	0	0	0	114.4	N41	N41-S43 VanDerWaalsContact C-N 3.3Å; N41-S43 PolarHBondContact O-N 2.88Å; N41-S43 PolarHBondContact OD1-N 3.42Å; N41-S43 VanDerWaalsContact OD1-N 3.13Å; N41-S43 PolarHBondContact OD1-OG 3.26Å
44	V	94.3	Very high	95.7	Very high	37 Å²	37	44.8 Å²	44.8	22%	0.224	24%	0.235	C	C	.	.			trans	-103.4	104.4	-171.9	-178.6	0	0	0	0	110.9	N41 P42 V46 Y47 Y48	N41-V44 WeakPolarHBondContact ND2-CG2 3.36Å; P42-V44 VanDerWaalsContact C-N 3.27Å; P42-V44 PolarHBondContact O-N 3.48Å; V44-V46 HydrophobicContact CG1-CB 4.09Å; V44-V46 HydrophobicContact CG1-CG2 4.49Å; V44-V46 PolarHBondContact O-N 3.42Å; V44-V46 VanDerWaalsContact O-N 3.14Å; V44-Y47 HydrophobicContact CB-CD2 3.63Å; V44-Y47 HydrophobicContact CB-CE2 3.5Å; V44-Y47 HydrophobicContact CB-CG 4.2Å; V44-Y47 HydrophobicContact CG1-CD1 4.13Å; V44-Y47 HydrophobicContact CG1-CD2 4.03Å; V44-Y47 HydrophobicContact CG1-CE1 3.97Å; V44-Y47 HydrophobicContact CG1-CE2 3.88Å; V44-Y47 HydrophobicContact CG1-CG 4.15Å; V44-Y47 HydrophobicContact CG2-CD2 4.38Å; V44-Y47 HydrophobicContact CG2-CE2 3.78Å; V44-Y47 PolarHBondContact O-N 2.94Å; V44-Y48 WeakPolarHBondContact O-CD2 3.38Å
45	A	95.3	Very high	95.7	Very high	13 Å²	13	45.6 Å²	45.6	11%	0.107	24%	0.238	C	C	.	.	H	α-helix	trans	-54.4	-34.3	180	0	0	0	0	0	113.8	Y47 Y48 T49 L74 D75	A45-Y47 VanDerWaalsContact C-N 3.27Å; A45-Y47 PolarHBondContact O-N 2.93Å; A45-Y48 WeakPolarHBondContact O-CB 3.19Å; A45-Y48 PolarHBondContact O-N 3.4Å; A45-Y48 VanDerWaalsContact O-N 3.14Å; A45-T49 PolarHBondContact O-N 3.32Å; A45-T49 VanDerWaalsContact O-N 3.11Å; A45-L74 HydrophobicContact CB-CB 3.91Å; A45-L74 HydrophobicContact CB-CD1 4.46Å; A45-D75 HydrophobicContact CB-CB 3.8Å
46	V	95.3	Very high	95.6	Very high	75 Å²	75	44.6 Å²	44.6	46%	0.455	23%	0.231	S	C	.	.	H	α-helix	trans	-57.6	-38.4	-178.3	179.4	0	0	0	0	112	V44 Y48 T49 N50	V44-V46 HydrophobicContact CG1-CB 4.09Å; V44-V46 HydrophobicContact CG1-CG2 4.49Å; V44-V46 PolarHBondContact O-N 3.42Å; V44-V46 VanDerWaalsContact O-N 3.14Å; V46-Y48 VanDerWaalsContact C-N 3.32Å; V46-Y48 PolarHBondContact O-N 3.43Å; V46-T49 PolarHBondContact O-N 2.91Å; V46-T49 PolarHBondContact O-OG1 3.46Å; V46-N50 WeakPolarHBondContact O-CB 3.4Å; V46-N50 PolarHBondContact O-N 3.07Å
47	Y	96.3	Very high	95.6	Very high	12 Å²	12	44.3 Å²	44.3	5%	0.047	23%	0.23	C	C	.	.	H	α-helix	trans	-64.5	-39.4	-179.2	-55.8	-28.5	0	0	0	111.9	A11 K15 A37 I38 N41 V44 A45 N50 R51	A11-Y47 HydrophobicContact CB-CE2 4.14Å; K15-Y47 HydrophobicContact CB-CD1 4.09Å; K15-Y47 HydrophobicContact CB-CE1 3.73Å; K15-Y47 HydrophobicContact CD-CD1 4.26Å; K15-Y47 HydrophobicContact CD-CE1 3.91Å; K15-Y47 HydrophobicContact CG-CD1 4.03Å; K15-Y47 HydrophobicContact CG-CE1 3.95Å; A37-Y47 HydrophobicContact CB-CD1 4.39Å; A37-Y47 HydrophobicContact CB-CD2 4.17Å; A37-Y47 HydrophobicContact CB-CE2 4.3Å; A37-Y47 HydrophobicContact CB-CG 4.23Å; I38-Y47 HydrophobicContact CG1-CD2 4.4Å; I38-Y47 HydrophobicContact CG1-CG 4.47Å; N41-Y47 HydrophobicContact CB-CE2 4.33Å; N41-Y47 WeakPolarHBondContact O-CD2 3.37Å; V44-Y47 HydrophobicContact CB-CD2 3.63Å; V44-Y47 HydrophobicContact CB-CE2 3.5Å; V44-Y47 HydrophobicContact CB-CG 4.2Å; V44-Y47 HydrophobicContact CG1-CD1 4.13Å; V44-Y47 HydrophobicContact CG1-CD2 4.03Å; V44-Y47 HydrophobicContact CG1-CE1 3.97Å; V44-Y47 HydrophobicContact CG1-CE2 3.88Å; V44-Y47 HydrophobicContact CG1-CG 4.15Å; V44-Y47 HydrophobicContact CG2-CD2 4.38Å; V44-Y47 HydrophobicContact CG2-CE2 3.78Å; V44-Y47 PolarHBondContact O-N 2.94Å; A45-Y47 VanDerWaalsContact C-N 3.27Å; A45-Y47 PolarHBondContact O-N 2.93Å; Y47-N50 PolarHBondContact O-N 3.28Å; Y47-R51 WeakPolarHBondContact O-CB 3.45Å; Y47-R51 PolarHBondContact O-N 2.99Å
48	Y	97.6	Very high	95.6	Very high	24 Å²	24	46.9 Å²	46.9	9%	0.094	24%	0.243	C	C	.	.	H	α-helix	trans	-65.9	-46.2	175.4	-64.3	-89.7	0	0	0	111.3	I38 P42 V44 A45 V46 N50 R51 A52 H70 L74	I38-Y48 HydrophobicContact CD1-CD1 4.01Å; I38-Y48 HydrophobicContact CD1-CE1 4.08Å; I38-Y48 HydrophobicContact CD1-CG 4.28Å; I38-Y48 HydrophobicContact CG1-CE1 4.47Å; I38-Y48 HydrophobicContact CG1-CE2 4.32Å; I38-Y48 HydrophobicContact CG2-CE1 4.06Å; I38-Y48 HydrophobicContact CG2-CE2 4.37Å; I38-Y48 WeakPolarHBondContact CG2-OH 3.32Å; P42-Y48 WeakPolarHBondContact O-CE2 3.37Å; P42-Y48 PolarHBondContact O-OH 3.5Å; V44-Y48 WeakPolarHBondContact O-CD2 3.38Å; A45-Y48 WeakPolarHBondContact O-CB 3.19Å; A45-Y48 PolarHBondContact O-N 3.4Å; A45-Y48 VanDerWaalsContact O-N 3.14Å; V46-Y48 VanDerWaalsContact C-N 3.32Å; V46-Y48 PolarHBondContact O-N 3.43Å; Y48-N50 VanDerWaalsContact C-N 3.32Å; Y48-N50 PolarHBondContact O-N 2.98Å; Y48-R51 PolarHBondContact O-N 3.42Å; Y48-A52 WeakPolarHBondContact O-CB 3.28Å; Y48-A52 PolarHBondContact O-N 2.84Å; Y48-H70 HydrophobicContact CD1-CB 3.99Å; Y48-H70 HydrophobicContact CE1-CB 4.09Å; Y48-L74 HydrophobicContact CD2-CD1 3.8Å; Y48-L74 HydrophobicContact CE2-CD1 3.52Å
49	T	97.1	Very high	95.6	Very high	5 Å²	5	53.3 Å²	53.3	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-62.5	-37	177.6	62.1	0	0	0	0	113.1	A45 V46 L53 A71 A81	A45-T49 PolarHBondContact O-N 3.32Å; A45-T49 VanDerWaalsContact O-N 3.11Å; V46-T49 PolarHBondContact O-N 2.91Å; V46-T49 PolarHBondContact O-OG1 3.46Å; T49-L53 PolarHBondContact O-N 3.45Å; T49-A71 HydrophobicContact CG2-CB 3.65Å; T49-A81 HydrophobicContact CG2-CB 3.88Å
50	N	96.5	Very high	95.6	Very high	25 Å²	25	50.1 Å²	50.1	13%	0.134	25%	0.254	C	S	.	.	H	α-helix	trans	-70.2	-38.1	176.9	-76.6	1.5	0	0	0	112.2	N19 Y34 V46 Y47 Y48 C54	N19-N50 PolarHBondContact OD1-ND2 3.41Å; Y34-N50 HydrophobicContact CD1-CB 4.06Å; Y34-N50 HydrophobicContact CD2-CB 4.12Å; Y34-N50 HydrophobicContact CE1-CB 3.77Å; Y34-N50 HydrophobicContact CE2-CB 3.83Å; Y34-N50 HydrophobicContact CG-CB 4.24Å; V46-N50 WeakPolarHBondContact O-CB 3.4Å; V46-N50 PolarHBondContact O-N 3.07Å; Y47-N50 PolarHBondContact O-N 3.28Å; Y48-N50 VanDerWaalsContact C-N 3.32Å; Y48-N50 PolarHBondContact O-N 2.98Å; N50-C54 PolarHBondContact O-N 2.96Å; N50-C54 PolarHBondContact O-SG 2.88Å
51	R	97.3	Very high	95.7	Very high	43 Å²	43	44.7 Å²	44.7	16%	0.162	23%	0.234	C	C	.	.	H	α-helix	trans	-68.9	-41.5	174	-168.9	172.7	68.7	-176.8	-1.5	111.5	A31 Y34 S35 I38 Y47 Y48 L53 C54 H55 D67	A31-R51 HydrophobicContact CB-CG 4.28Å; Y34-R51 HydrophobicContact CD2-CB 4.36Å; S35-R51 VanDerWaalsContact OG-CD 3.24Å; S35-R51 WeakPolarHBondContact OG-CD 3.5Å; S35-R51 PolarHBondContact OG-NH1 3.47Å; I38-R51 VanDerWaalsContact CD1-CZ 3.43Å; Y47-R51 WeakPolarHBondContact O-CB 3.45Å; Y47-R51 PolarHBondContact O-N 2.99Å; Y48-R51 PolarHBondContact O-N 3.42Å; R51-L53 VanDerWaalsContact C-N 3.31Å; R51-L53 PolarHBondContact O-N 3.13Å; R51-C54 WeakPolarHBondContact O-CA 3.4Å; R51-C54 VanDerWaalsContact O-CB 3.3Å; R51-C54 WeakPolarHBondContact O-CB 3.36Å; R51-C54 PolarHBondContact O-N 3.3Å; R51-H55 PolarHBondContact O-CD2 3.36Å; R51-H55 PolarHBondContact O-N 3.37Å; R51-D67 WeakPolarHBondContact CB-OD2 3.47Å; R51-D67 WeakPolarHBondContact CG-OD2 3.35Å; R51-D67 IonicContact CZ-OD1 2.81Å; R51-D67 IonicContact CZ-OD2 2.83Å; R51-D67 IonicContact NE-OD1 3.97Å; R51-D67 PolarHBondContact NE-OD1 2.84Å; R51-D67 IonicContact NE-OD2 3.85Å; R51-D67 PolarHBondContact NE-OD2 2.58Å; R51-D67 IonicContact NH2-OD1 3.03Å; R51-D67 PolarHBondContact NH2-OD1 3.49Å; R51-D67 IonicContact NH2-OD2 3.83Å
52	A	97.1	Very high	95.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-56.3	-44.8	173.3	0	0	0	0	0	111.5	Y48 C54 H55 V56 A64 D67	Y48-A52 WeakPolarHBondContact O-CB 3.28Å; Y48-A52 PolarHBondContact O-N 2.84Å; A52-C54 VanDerWaalsContact C-N 3.29Å; A52-C54 PolarHBondContact O-N 3.29Å; A52-H55 CarbonylContact O-C 3.42Å; A52-H55 WeakPolarHBondContact O-CA 3.39Å; A52-H55 WeakPolarHBondContact O-CB 3.39Å; A52-H55 PolarHBondContact O-N 3.19Å; A52-H55 VanDerWaalsContact O-N 3.08Å; A52-V56 WeakPolarHBondContact O-CG2 3.39Å; A52-V56 PolarHBondContact O-N 3.49Å; A52-A64 HydrophobicContact CB-CB 4.4Å; A52-D67 HydrophobicContact CB-CB 3.78Å
53	L	96.3	Very high	95.9	Very high	38 Å²	38	49.8 Å²	49.8	20%	0.199	25%	0.251	C	S	.	.	H	α-helix	trans	-60.3	-38.3	176	177.9	59	0	0	0	112.4	F22 T49 R51 V56 K57 F84	F22-L53 HydrophobicContact CE1-CD2 4.06Å; F22-L53 HydrophobicContact CE2-CD2 3.97Å; F22-L53 HydrophobicContact CE2-CG 3.78Å; F22-L53 HydrophobicContact CZ-CD1 4.35Å; F22-L53 HydrophobicContact CZ-CD2 3.47Å; F22-L53 VanDerWaalsContact CZ-CD2 3.47Å; F22-L53 HydrophobicContact CZ-CG 3.63Å; T49-L53 PolarHBondContact O-N 3.45Å; R51-L53 VanDerWaalsContact C-N 3.31Å; R51-L53 PolarHBondContact O-N 3.13Å; L53-V56 PolarHBondContact O-N 3.43Å; L53-K57 WeakPolarHBondContact O-CG 3.33Å; L53-K57 PolarHBondContact O-N 2.89Å; L53-K57 VanDerWaalsContact O-N 3.09Å; L53-F84 HydrophobicContact CB-CE1 4.49Å; L53-F84 HydrophobicContact CB-CE2 4.16Å; L53-F84 HydrophobicContact CB-CZ 4.06Å; L53-F84 HydrophobicContact CD1-CD1 4.46Å; L53-F84 HydrophobicContact CD1-CE1 3.74Å; L53-F84 HydrophobicContact CD1-CZ 3.95Å; L53-F84 HydrophobicContact CD2-CZ 4.06Å; L53-F84 HydrophobicContact CG-CZ 4.23Å
54	C	97.1	Very high	96.1	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.9	-43.4	173.5	-63.9	0	0	0	0	111.4	F22 A31 Y34 N50 R51 A52 K57 L58	F22-C54 VanDerWaalsContact CD2-SG 3.54Å; A31-C54 HydrophobicContact CB-CB 4.02Å; Y34-C54 VanDerWaalsContact CE2-SG 3.55Å; N50-C54 PolarHBondContact O-N 2.96Å; N50-C54 PolarHBondContact O-SG 2.88Å; R51-C54 WeakPolarHBondContact O-CA 3.4Å; R51-C54 VanDerWaalsContact O-CB 3.3Å; R51-C54 WeakPolarHBondContact O-CB 3.36Å; R51-C54 PolarHBondContact O-N 3.3Å; A52-C54 VanDerWaalsContact C-N 3.29Å; A52-C54 PolarHBondContact O-N 3.29Å; C54-K57 PolarHBondContact O-N 2.99Å; C54-L58 VanDerWaalsContact O-CG 3.32Å; C54-L58 WeakPolarHBondContact O-CG 3.42Å; C54-L58 PolarHBondContact O-N 3.29Å
55	H	97.1	Very high	96.2	Very high	20 Å²	20	45 Å²	45	9%	0.093	22%	0.218	C	C	.	.	H	α-helix	trans	-63.6	-39.2	176.4	-72.9	-49.2	0	0	0	112.6	R51 A52 K57 L58 Q59 Q60 K63 A64 D67	R51-H55 PolarHBondContact O-CD2 3.36Å; R51-H55 PolarHBondContact O-N 3.37Å; A52-H55 CarbonylContact O-C 3.42Å; A52-H55 WeakPolarHBondContact O-CA 3.39Å; A52-H55 WeakPolarHBondContact O-CB 3.39Å; A52-H55 PolarHBondContact O-N 3.19Å; A52-H55 VanDerWaalsContact O-N 3.08Å; H55-K57 VanDerWaalsContact C-N 3.35Å; H55-K57 PolarHBondContact O-N 2.93Å; H55-L58 CarbonylContact O-C 3.12Å; H55-L58 WeakPolarHBondContact O-CA 3.41Å; H55-L58 PolarHBondContact O-N 2.87Å; H55-L58 VanDerWaalsContact O-N 3.1Å; H55-Q59 PolarHBondContact O-N 3.41Å; H55-Q60 HydrophobicContact CB-CB 4.15Å; H55-Q60 PolarHBondContact CE1-OE1 3.32Å; H55-Q60 PolarHBondContact ND1-OE1 3.01Å; H55-Q60 PolarHBondContact O-N 3.14Å; H55-K63 HydrophobicContact CB-CB 4.46Å; H55-A64 HydrophobicContact CB-CB 3.77Å; H55-D67 IonicContact CD2-OD2 3.58Å; H55-D67 PolarHBondContact CD2-OD2 2.68Å; H55-D67 IonicContact NE2-OD2 2.93Å
56	V	95.1	Very high	96.2	Very high	12 Å²	12	46.7 Å²	46.7	7%	0.073	23%	0.232	C	C	.	.	H	α-helix	trans	-59.1	-45.1	172	170.6	0	0	0	0	110.9	A52 L53 L58 Q59 A64 C88	A52-V56 WeakPolarHBondContact O-CG2 3.39Å; A52-V56 PolarHBondContact O-N 3.49Å; L53-V56 PolarHBondContact O-N 3.43Å; V56-L58 PolarHBondContact O-N 2.9Å; V56-Q59 PolarHBondContact O-N 3.37Å; V56-Q59 VanDerWaalsContact O-N 3.09Å; V56-A64 HydrophobicContact CG2-CB 3.87Å; V56-C88 VanDerWaalsContact CG2-SG 3.56Å
57	K	95.1	Very high	96.3	Very high	111 Å²	111	43.6 Å²	43.6	48%	0.483	21%	0.212	S	C	.	.	H	α-helix	trans	-66.1	-24.5	176.4	-66.2	-60.5	-178.2	-173.1	0	113.5	F22 Y27 L53 C54 H55	F22-K57 HydrophobicContact CE2-CG 4.27Å; F22-K57 HydrophobicContact CZ-CG 4.43Å; Y27-K57 HydrophobicContact CD1-CB 3.97Å; Y27-K57 HydrophobicContact CD1-CG 4.21Å; Y27-K57 HydrophobicContact CD2-CB 3.83Å; Y27-K57 HydrophobicContact CE1-CB 4.08Å; Y27-K57 HydrophobicContact CE1-CG 3.97Å; Y27-K57 HydrophobicContact CE2-CB 3.94Å; Y27-K57 HydrophobicContact CE2-CG 4.47Å; Y27-K57 HydrophobicContact CG-CB 3.84Å; L53-K57 WeakPolarHBondContact O-CG 3.33Å; L53-K57 PolarHBondContact O-N 2.89Å; L53-K57 VanDerWaalsContact O-N 3.09Å; C54-K57 PolarHBondContact O-N 2.99Å; H55-K57 VanDerWaalsContact C-N 3.35Å; H55-K57 PolarHBondContact O-N 2.93Å
58	L	95.7	Very high	96.4	Very high	53 Å²	53	43 Å²	43	28%	0.277	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	4.5	174.9	-67	170.3	0	0	0	113.3	Q28 C54 H55 V56 Q60	Q28-L58 HydrophobicContact CB-CD1 4.32Å; C54-L58 VanDerWaalsContact O-CG 3.32Å; C54-L58 WeakPolarHBondContact O-CG 3.42Å; C54-L58 PolarHBondContact O-N 3.29Å; H55-L58 CarbonylContact O-C 3.12Å; H55-L58 WeakPolarHBondContact O-CA 3.41Å; H55-L58 PolarHBondContact O-N 2.87Å; H55-L58 VanDerWaalsContact O-N 3.1Å; V56-L58 PolarHBondContact O-N 2.9Å; L58-Q60 HydrophobicContact CB-CG 4.16Å; L58-Q60 PolarHBondContact O-N 2.7Å
59	Q	95.1	Very high	96.3	Very high	146 Å²	146	47.2 Å²	47.2	68%	0.682	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.4	26.2	-175.6	-54.5	177.5	1.2	0	0	114	H55 V56 Y61	H55-Q59 PolarHBondContact O-N 3.41Å; V56-Q59 PolarHBondContact O-N 3.37Å; V56-Q59 VanDerWaalsContact O-N 3.09Å; Q59-Y61 HydrophobicContact CB-CE2 4.19Å; Q59-Y61 PolarHBondContact O-N 2.82Å
60	Q	96.2	Very high	96.3	Very high	68 Å²	68	51.1 Å²	51.1	32%	0.318	25%	0.247	S	C	.	.			trans	-96	66.2	177.7	-66.4	176.2	0.6	0	0	110	H55 L58 D62 K63 A64	H55-Q60 HydrophobicContact CB-CB 4.15Å; H55-Q60 PolarHBondContact CE1-OE1 3.32Å; H55-Q60 PolarHBondContact ND1-OE1 3.01Å; H55-Q60 PolarHBondContact O-N 3.14Å; L58-Q60 HydrophobicContact CB-CG 4.16Å; L58-Q60 PolarHBondContact O-N 2.7Å; Q60-D62 PolarHBondContact O-N 3.17Å; Q60-K63 HydrophobicContact CB-CB 4.42Å; Q60-K63 HydrophobicContact CB-CD 4.38Å; Q60-K63 PolarHBondContact O-N 3.38Å; Q60-A64 PolarHBondContact O-N 2.97Å; Q60-A64 VanDerWaalsContact O-N 3.08Å
61	Y	95.8	Very high	96.3	Very high	46 Å²	46	49.9 Å²	49.9	18%	0.18	24%	0.24	C	C	.	.	H	α-helix	trans	-64.4	-36.5	-169.3	-54.2	-58.2	0	0	0	113.6	Q59 K63 A64 L65 E91	Q59-Y61 HydrophobicContact CB-CE2 4.19Å; Q59-Y61 PolarHBondContact O-N 2.82Å; Y61-K63 VanDerWaalsContact C-N 3.33Å; Y61-K63 PolarHBondContact O-N 3.3Å; Y61-A64 PolarHBondContact O-N 3.2Å; Y61-L65 WeakPolarHBondContact O-CG 3.42Å; Y61-L65 PolarHBondContact O-N 3.46Å; Y61-E91 HydrophobicContact CD1-CB 3.95Å; Y61-E91 HydrophobicContact CD1-CG 4.31Å; Y61-E91 HydrophobicContact CD2-CB 3.95Å; Y61-E91 HydrophobicContact CE1-CB 3.69Å; Y61-E91 HydrophobicContact CE1-CG 3.68Å; Y61-E91 HydrophobicContact CE2-CB 3.66Å; Y61-E91 HydrophobicContact CE2-CG 4.33Å; Y61-E91 HydrophobicContact CG-CB 4.08Å
62	D	95	Very high	96.3	Very high	119 Å²	119	49.2 Å²	49.2	64%	0.636	24%	0.24	S	C	*	.	H	α-helix	trans	-62.5	-40.2	177.9	-58.5	-47	0	0	0	112.5	Q60 L65 A66	Q60-D62 PolarHBondContact O-N 3.17Å; D62-L65 PolarHBondContact O-N 3.4Å; D62-A66 PolarHBondContact O-N 3.32Å; D62-A66 VanDerWaalsContact O-N 3.14Å
63	K	95.9	Very high	96.3	Very high	118 Å²	118	55.9 Å²	55.9	51%	0.513	27%	0.271	S	S	.	.	H	α-helix	trans	-69.4	-40.7	176.2	-65	-176.4	-176.3	175.2	0	111.1	H55 Q60 Y61 L65 A66 D67	H55-K63 HydrophobicContact CB-CB 4.46Å; Q60-K63 HydrophobicContact CB-CB 4.42Å; Q60-K63 HydrophobicContact CB-CD 4.38Å; Q60-K63 PolarHBondContact O-N 3.38Å; Y61-K63 VanDerWaalsContact C-N 3.33Å; Y61-K63 PolarHBondContact O-N 3.3Å; K63-L65 VanDerWaalsContact C-N 3.33Å; K63-L65 PolarHBondContact O-N 3.23Å; K63-A66 PolarHBondContact O-N 3.35Å; K63-D67 PolarHBondContact O-N 3.15Å
64	A	96.8	Very high	96.3	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.9	-39.3	175.7	0	0	0	0	0	112	A52 H55 V56 Q60 Y61 D67 C68 C88	A52-A64 HydrophobicContact CB-CB 4.4Å; H55-A64 HydrophobicContact CB-CB 3.77Å; V56-A64 HydrophobicContact CG2-CB 3.87Å; Q60-A64 PolarHBondContact O-N 2.97Å; Q60-A64 VanDerWaalsContact O-N 3.08Å; Y61-A64 PolarHBondContact O-N 3.2Å; A64-D67 PolarHBondContact O-N 2.86Å; A64-C68 WeakPolarHBondContact O-CB 3.4Å; A64-C68 PolarHBondContact O-N 3.08Å; A64-C68 PolarHBondContact O-SG 3.47Å; A64-C88 WeakPolarHBondContact CB-SG 3.38Å
65	L	96.5	Very high	96.2	Very high	18 Å²	18	61.2 Å²	61.2	9%	0.094	30%	0.299	C	S	.	.	H	α-helix	trans	-60.3	-47.5	173.8	-79.7	-177.4	0	0	0	111.8	Y61 D62 K63 D67 C68 K69 L85 C88 L92	Y61-L65 WeakPolarHBondContact O-CG 3.42Å; Y61-L65 PolarHBondContact O-N 3.46Å; D62-L65 PolarHBondContact O-N 3.4Å; K63-L65 VanDerWaalsContact C-N 3.33Å; K63-L65 PolarHBondContact O-N 3.23Å; L65-D67 VanDerWaalsContact C-N 3.32Å; L65-D67 PolarHBondContact O-N 3.38Å; L65-C68 PolarHBondContact O-N 3.13Å; L65-K69 WeakPolarHBondContact O-CG 3.38Å; L65-K69 PolarHBondContact O-N 2.98Å; L65-L85 HydrophobicContact CD2-CD1 3.47Å; L65-L85 VanDerWaalsContact CD2-CD1 3.47Å; L65-L85 HydrophobicContact CD2-CG 4.47Å; L65-C88 HydrophobicContact CD2-CB 3.51Å; L65-C88 HydrophobicContact CG-CB 3.82Å; L65-L92 HydrophobicContact CD1-CD1 3.31Å; L65-L92 HydrophobicContact CG-CD1 4.09Å
66	A	96.8	Very high	96.1	Very high	48 Å²	48	63.6 Å²	63.6	40%	0.397	32%	0.318	S	S	.	.	H	α-helix	trans	-59.5	-45	178.3	0	0	0	0	0	111.3	D62 K63 K69 H70	D62-A66 PolarHBondContact O-N 3.32Å; D62-A66 VanDerWaalsContact O-N 3.14Å; K63-A66 PolarHBondContact O-N 3.35Å; A66-K69 PolarHBondContact O-N 2.9Å; A66-H70 PolarHBondContact O-N 3.46Å
67	D	97.2	Very high	96.1	Very high	9 Å²	9	67.5 Å²	67.5	5%	0.048	34%	0.335	C	S	.	.	H	α-helix	trans	-64	-40.8	176.5	-80.5	-11.7	0	0	0	112.7	R51 A52 H55 K63 A64 L65 H70 A71	R51-D67 WeakPolarHBondContact CB-OD2 3.47Å; R51-D67 WeakPolarHBondContact CG-OD2 3.35Å; R51-D67 IonicContact CZ-OD1 2.81Å; R51-D67 IonicContact CZ-OD2 2.83Å; R51-D67 IonicContact NE-OD1 3.97Å; R51-D67 PolarHBondContact NE-OD1 2.84Å; R51-D67 IonicContact NE-OD2 3.85Å; R51-D67 PolarHBondContact NE-OD2 2.58Å; R51-D67 IonicContact NH2-OD1 3.03Å; R51-D67 PolarHBondContact NH2-OD1 3.49Å; R51-D67 IonicContact NH2-OD2 3.83Å; A52-D67 HydrophobicContact CB-CB 3.78Å; H55-D67 IonicContact CD2-OD2 3.58Å; H55-D67 PolarHBondContact CD2-OD2 2.68Å; H55-D67 IonicContact NE2-OD2 2.93Å; K63-D67 PolarHBondContact O-N 3.15Å; A64-D67 PolarHBondContact O-N 2.86Å; L65-D67 VanDerWaalsContact C-N 3.32Å; L65-D67 PolarHBondContact O-N 3.38Å; D67-H70 PolarHBondContact O-N 2.63Å; D67-A71 WeakPolarHBondContact O-CB 3.36Å; D67-A71 PolarHBondContact O-N 3.5Å
68	C	97	Very high	96.1	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-66.1	-39.5	177	-67.4	0	0	0	0	111.8	A64 L65 A71 L72 F84 L85	A64-C68 WeakPolarHBondContact O-CB 3.4Å; A64-C68 PolarHBondContact O-N 3.08Å; A64-C68 PolarHBondContact O-SG 3.47Å; L65-C68 PolarHBondContact O-N 3.13Å; C68-A71 WeakPolarHBondContact O-CB 3.48Å; C68-A71 PolarHBondContact O-N 3.01Å; C68-L72 VanDerWaalsContact O-CG 3.32Å; C68-L72 WeakPolarHBondContact O-CG 3.24Å; C68-L72 PolarHBondContact O-N 2.99Å; C68-F84 VanDerWaalsContact SG-CB 3.59Å; C68-L85 HydrophobicContact CB-CB 4Å; C68-L85 HydrophobicContact CB-CD1 3.89Å
69	K	96.8	Very high	96.1	Very high	112 Å²	112	60.7 Å²	60.7	49%	0.487	31%	0.306	S	S	.	.	H	α-helix	trans	-62.4	-47.7	175.9	-74	176.3	-179.5	-179.1	0	111.3	L65 A66 A71 L72 E73 L85	L65-K69 WeakPolarHBondContact O-CG 3.38Å; L65-K69 PolarHBondContact O-N 2.98Å; A66-K69 PolarHBondContact O-N 2.9Å; K69-A71 VanDerWaalsContact C-N 3.33Å; K69-A71 PolarHBondContact O-N 3.44Å; K69-L72 WeakPolarHBondContact O-CB 3.47Å; K69-L72 PolarHBondContact O-N 3.41Å; K69-L72 VanDerWaalsContact O-N 3.09Å; K69-E73 WeakPolarHBondContact O-CG 3.5Å; K69-E73 PolarHBondContact O-N 3Å; K69-L85 HydrophobicContact CG-CD1 4.33Å
70	H	96.5	Very high	96.1	Very high	87 Å²	87	59 Å²	59	40%	0.403	30%	0.296	S	S	.	.	H	α-helix	trans	-63.8	-36.9	174.8	-75.3	3.6	0	0	0	112.9	Y48 A66 D67 L72 E73 L74	Y48-H70 HydrophobicContact CD1-CB 3.99Å; Y48-H70 HydrophobicContact CE1-CB 4.09Å; A66-H70 PolarHBondContact O-N 3.46Å; D67-H70 PolarHBondContact O-N 2.63Å; H70-L72 VanDerWaalsContact C-N 3.26Å; H70-L72 PolarHBondContact O-N 2.82Å; H70-E73 IonicContact CE1-OE1 2.69Å; H70-E73 IonicContact ND1-OE1 3.42Å; H70-E73 PolarHBondContact ND1-OE1 2.91Å; H70-E73 VanDerWaalsContact ND1-OE1 3.12Å; H70-E73 IonicContact ND1-OE2 3.74Å; H70-E73 PolarHBondContact ND1-OE2 2.71Å; H70-E73 PolarHBondContact O-N 3.45Å; H70-L74 WeakPolarHBondContact O-CG 3.38Å; H70-L74 PolarHBondContact O-N 3.49Å
71	A	97	Very high	96.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.5	-37.9	173	0	0	0	0	0	111.9	T49 D67 C68 K69 L74 D75 A81	T49-A71 HydrophobicContact CG2-CB 3.65Å; D67-A71 WeakPolarHBondContact O-CB 3.36Å; D67-A71 PolarHBondContact O-N 3.5Å; C68-A71 WeakPolarHBondContact O-CB 3.48Å; C68-A71 PolarHBondContact O-N 3.01Å; K69-A71 VanDerWaalsContact C-N 3.33Å; K69-A71 PolarHBondContact O-N 3.44Å; A71-L74 PolarHBondContact O-N 3.02Å; A71-D75 PolarHBondContact O-N 3.28Å; A71-A81 HydrophobicContact CB-CB 3.99Å
72	L	96.3	Very high	96.2	Very high	29 Å²	29	54.6 Å²	54.6	15%	0.152	28%	0.277	C	S	.	.	H	α-helix	trans	-75.6	-27.9	177.5	-70.9	172.6	0	0	0	113.8	C68 K69 H70 L74 D75 S76 A81 H82 L85	C68-L72 VanDerWaalsContact O-CG 3.32Å; C68-L72 WeakPolarHBondContact O-CG 3.24Å; C68-L72 PolarHBondContact O-N 2.99Å; K69-L72 WeakPolarHBondContact O-CB 3.47Å; K69-L72 PolarHBondContact O-N 3.41Å; K69-L72 VanDerWaalsContact O-N 3.09Å; H70-L72 VanDerWaalsContact C-N 3.26Å; H70-L72 PolarHBondContact O-N 2.82Å; L72-L74 VanDerWaalsContact C-N 3.28Å; L72-D75 WeakPolarHBondContact CA-O 3.37Å; L72-D75 CarbonylContact O-C 3.47Å; L72-S76 VanDerWaalsContact O-CA 3.27Å; L72-S76 WeakPolarHBondContact O-CA 3.5Å; L72-S76 PolarHBondContact O-N 3.36Å; L72-S76 VanDerWaalsContact O-N 3.15Å; L72-A81 HydrophobicContact CD2-CB 3.65Å; L72-A81 HydrophobicContact CG-CB 3.79Å; L72-H82 VanDerWaalsContact CD2-NE2 3.32Å; L72-H82 WeakPolarHBondContact CD2-NE2 3.3Å; L72-L85 HydrophobicContact CD1-CD2 3.7Å
73	E	96.8	Very high	96.3	Very high	140 Å²	140	50.8 Å²	50.8	65%	0.654	26%	0.255	S	S	*	.	H	α-helix	trans	-64.6	-35.8	169.7	-71.3	164	-144.5	0	0	111.2	K69 H70	K69-E73 WeakPolarHBondContact O-CG 3.5Å; K69-E73 PolarHBondContact O-N 3Å; H70-E73 IonicContact CE1-OE1 2.69Å; H70-E73 IonicContact ND1-OE1 3.42Å; H70-E73 PolarHBondContact ND1-OE1 2.91Å; H70-E73 VanDerWaalsContact ND1-OE1 3.12Å; H70-E73 IonicContact ND1-OE2 3.74Å; H70-E73 PolarHBondContact ND1-OE2 2.71Å; H70-E73 PolarHBondContact O-N 3.45Å
74	L	95.9	Very high	96.3	Very high	82 Å²	82	46.2 Å²	46.2	43%	0.429	24%	0.235	S	C	.	.	H	α-helix	trans	-82.7	-40.3	177.2	-65.2	173.1	0	0	0	112.9	P42 A45 Y48 H70 A71 L72	P42-L74 WeakPolarHBondContact O-CD1 3.49Å; A45-L74 HydrophobicContact CB-CB 3.91Å; A45-L74 HydrophobicContact CB-CD1 4.46Å; Y48-L74 HydrophobicContact CD2-CD1 3.8Å; Y48-L74 HydrophobicContact CE2-CD1 3.52Å; H70-L74 WeakPolarHBondContact O-CG 3.38Å; H70-L74 PolarHBondContact O-N 3.49Å; A71-L74 PolarHBondContact O-N 3.02Å; L72-L74 VanDerWaalsContact C-N 3.28Å
75	D	95	Very high	96.3	Very high	67 Å²	67	46.7 Å²	46.7	36%	0.358	24%	0.238	S	C	.	.			trans	-139.9	92.4	179.4	176.4	12.8	0	0	0	110.3	A45 A71 L72 Q77 S78	A45-D75 HydrophobicContact CB-CB 3.8Å; A71-D75 PolarHBondContact O-N 3.28Å; L72-D75 WeakPolarHBondContact CA-O 3.37Å; L72-D75 CarbonylContact O-C 3.47Å; D75-Q77 PolarHBondContact O-N 3.21Å; D75-Q77 PolarHBondContact OD1-N 3.47Å; D75-S78 WeakPolarHBondContact O-CB 3.49Å; D75-S78 PolarHBondContact O-N 3.08Å; D75-S78 PolarHBondContact OD1-N 2.99Å; D75-S78 WeakPolarHBondContact OD2-CB 3.49Å
76	S	94.9	Very high	96.3	Very high	70 Å²	70	45.9 Å²	45.9	49%	0.49	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-19	-179.2	71.1	0	0	0	0	113.4	L72 H82	L72-S76 VanDerWaalsContact O-CA 3.27Å; L72-S76 WeakPolarHBondContact O-CA 3.5Å; L72-S76 PolarHBondContact O-N 3.36Å; L72-S76 VanDerWaalsContact O-N 3.15Å; S76-H82 PolarHBondContact O-NE2 2.96Å
77	Q	95.1	Very high	96.2	Very high	94 Å²	94	46.4 Å²	46.4	44%	0.439	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	6.7	-177.5	-57.3	-60	-28.1	0	0	111.9	D75 V79 Q112	D75-Q77 PolarHBondContact O-N 3.21Å; D75-Q77 PolarHBondContact OD1-N 3.47Å; Q77-V79 PolarHBondContact O-N 3.12Å; Q77-Q112 PolarHBondContact O-NE2 3.22Å
78	S	95.5	Very high	96.2	Very high	16 Å²	16	46 Å²	46	11%	0.112	23%	0.225	C	C	.	.			trans	-67.9	107.6	-179.4	-171	0	0	0	0	112	D75 K80 A81 H82	D75-S78 WeakPolarHBondContact O-CB 3.49Å; D75-S78 PolarHBondContact O-N 3.08Å; D75-S78 PolarHBondContact OD1-N 2.99Å; D75-S78 WeakPolarHBondContact OD2-CB 3.49Å; S78-K80 VanDerWaalsContact C-N 3.29Å; S78-K80 PolarHBondContact O-N 3.48Å; S78-A81 PolarHBondContact O-N 3.05Å; S78-A81 PolarHBondContact OG-N 3.31Å; S78-H82 PolarHBondContact O-CD2 3.37Å; S78-H82 VanDerWaalsContact O-CD2 3.31Å; S78-H82 PolarHBondContact O-N 2.83Å; S78-H82 VanDerWaalsContact O-N 3.16Å
79	V	96.2	Very high	96.1	Very high	5 Å²	5	47 Å²	47	3%	0.03	23%	0.231	C	C	.	.	H	α-helix	trans	-57	-44.1	175.8	177.4	0	0	0	0	111.4	Q77 A81 H82 F83 A105 L108 A109 L114 F116 I120	Q77-V79 PolarHBondContact O-N 3.12Å; V79-A81 PolarHBondContact O-N 3.5Å; V79-H82 PolarHBondContact O-N 3.41Å; V79-F83 WeakPolarHBondContact O-CB 3.44Å; V79-F83 PolarHBondContact O-N 2.65Å; V79-A105 HydrophobicContact CG1-CB 4.3Å; V79-L108 HydrophobicContact CG2-CB 3.7Å; V79-A109 HydrophobicContact CG1-CB 4.04Å; V79-A109 HydrophobicContact CG2-CB 4.33Å; V79-L114 HydrophobicContact CG2-CD1 4Å; V79-F116 HydrophobicContact CB-CE2 4.31Å; V79-F116 HydrophobicContact CB-CZ 4.35Å; V79-F116 HydrophobicContact CG1-CD2 4.37Å; V79-F116 HydrophobicContact CG1-CE2 3.57Å; V79-F116 HydrophobicContact CG1-CZ 3.82Å; V79-I120 HydrophobicContact CG1-CD1 4.07Å
80	K	95.3	Very high	96.1	Very high	111 Å²	111	42.3 Å²	42.3	48%	0.483	21%	0.21	S	C	.	.	H	α-helix	trans	-65.7	-38.9	-179	-70.5	-176.6	179.4	179.6	0	111.9	S78 F83 F84	S78-K80 VanDerWaalsContact C-N 3.29Å; S78-K80 PolarHBondContact O-N 3.48Å; K80-F83 PolarHBondContact O-N 2.65Å; K80-F84 HydrophobicContact CB-CD2 4.45Å; K80-F84 HydrophobicContact CB-CE2 4.12Å; K80-F84 WeakPolarHBondContact O-CD2 3.48Å; K80-F84 WeakPolarHBondContact O-CG 3.45Å; K80-F84 PolarHBondContact O-N 3.34Å
81	A	96.2	Very high	96	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.6	-45.9	178.6	0	0	0	0	0	111.3	T49 A71 L72 S78 V79 F83 F84 L85	T49-A81 HydrophobicContact CG2-CB 3.88Å; A71-A81 HydrophobicContact CB-CB 3.99Å; L72-A81 HydrophobicContact CD2-CB 3.65Å; L72-A81 HydrophobicContact CG-CB 3.79Å; S78-A81 PolarHBondContact O-N 3.05Å; S78-A81 PolarHBondContact OG-N 3.31Å; V79-A81 PolarHBondContact O-N 3.5Å; A81-F83 VanDerWaalsContact C-N 3.33Å; A81-F83 PolarHBondContact O-N 3.14Å; A81-F84 PolarHBondContact O-N 2.95Å; A81-L85 WeakPolarHBondContact O-CB 3.43Å; A81-L85 PolarHBondContact O-N 3.32Å
82	H	97.3	Very high	95.9	Very high	21 Å²	21	44.3 Å²	44.3	10%	0.097	22%	0.222	C	C	.	.	H	α-helix	trans	-61.7	-39.9	173.9	-76.2	-68	0	0	0	112.3	L72 S76 S78 V79 L85 G86 A105 L108	L72-H82 VanDerWaalsContact CD2-NE2 3.32Å; L72-H82 WeakPolarHBondContact CD2-NE2 3.3Å; S76-H82 PolarHBondContact O-NE2 2.96Å; S78-H82 PolarHBondContact O-CD2 3.37Å; S78-H82 VanDerWaalsContact O-CD2 3.31Å; S78-H82 PolarHBondContact O-N 2.83Å; S78-H82 VanDerWaalsContact O-N 3.16Å; V79-H82 PolarHBondContact O-N 3.41Å; H82-L85 PolarHBondContact O-N 2.87Å; H82-G86 PolarHBondContact O-N 3.29Å; H82-A105 HydrophobicContact CB-CB 3.82Å; H82-L108 WeakPolarHBondContact CD2-CD1 3.36Å
83	F	96.8	Very high	95.8	Very high	40 Å²	40	49.5 Å²	49.5	18%	0.175	25%	0.245	C	C	.	.	H	α-helix	trans	-63.3	-50.3	177.8	178.9	-96.8	0	0	0	112.2	V79 K80 A81 L85 G86 Q87 L102 A105 I120 A123	V79-F83 WeakPolarHBondContact O-CB 3.44Å; V79-F83 PolarHBondContact O-N 2.65Å; K80-F83 PolarHBondContact O-N 2.65Å; A81-F83 VanDerWaalsContact C-N 3.33Å; A81-F83 PolarHBondContact O-N 3.14Å; F83-L85 VanDerWaalsContact C-N 3.35Å; F83-L85 PolarHBondContact O-N 2.93Å; F83-G86 PolarHBondContact O-N 3.39Å; F83-Q87 PolarHBondContact O-N 3.46Å; F83-L102 HydrophobicContact CD2-CD2 3.66Å; F83-L102 HydrophobicContact CE2-CD2 4.01Å; F83-L102 HydrophobicContact CG-CD2 4.43Å; F83-A105 HydrophobicContact CB-CB 4.13Å; F83-I120 HydrophobicContact CD2-CG1 4.06Å; F83-I120 HydrophobicContact CD2-CG2 4.49Å; F83-I120 HydrophobicContact CE2-CG1 4.34Å; F83-A123 HydrophobicContact CE2-CB 3.78Å; F83-A123 HydrophobicContact CZ-CB 4.33Å
84	F	96.2	Very high	95.8	Very high	22 Å²	22	46.2 Å²	46.2	10%	0.096	23%	0.232	C	C	.	.	H	α-helix	trans	-67.4	-35.5	178	-64.4	-39.4	0	0	0	112.3	L53 C68 K80 A81 Q87 C88	L53-F84 HydrophobicContact CB-CE1 4.49Å; L53-F84 HydrophobicContact CB-CE2 4.16Å; L53-F84 HydrophobicContact CB-CZ 4.06Å; L53-F84 HydrophobicContact CD1-CD1 4.46Å; L53-F84 HydrophobicContact CD1-CE1 3.74Å; L53-F84 HydrophobicContact CD1-CZ 3.95Å; L53-F84 HydrophobicContact CD2-CZ 4.06Å; L53-F84 HydrophobicContact CG-CZ 4.23Å; C68-F84 VanDerWaalsContact SG-CB 3.59Å; K80-F84 HydrophobicContact CB-CD2 4.45Å; K80-F84 HydrophobicContact CB-CE2 4.12Å; K80-F84 WeakPolarHBondContact O-CD2 3.48Å; K80-F84 WeakPolarHBondContact O-CG 3.45Å; K80-F84 PolarHBondContact O-N 3.34Å; A81-F84 PolarHBondContact O-N 2.95Å; F84-Q87 PolarHBondContact O-N 3.04Å; F84-C88 PolarHBondContact O-N 3.26Å; F84-C88 PolarHBondContact O-SG 3.48Å
85	L	96.4	Very high	95.8	Very high	10 Å²	10	44 Å²	44	5%	0.052	22%	0.218	C	C	.	.	H	α-helix	trans	-59.7	-48.3	173.1	-173.2	70.6	0	0	0	110.7	L65 C68 K69 L72 A81 H82 F83 Q87 C88 H89 N101	L65-L85 HydrophobicContact CD2-CD1 3.47Å; L65-L85 VanDerWaalsContact CD2-CD1 3.47Å; L65-L85 HydrophobicContact CD2-CG 4.47Å; C68-L85 HydrophobicContact CB-CB 4Å; C68-L85 HydrophobicContact CB-CD1 3.89Å; K69-L85 HydrophobicContact CG-CD1 4.33Å; L72-L85 HydrophobicContact CD1-CD2 3.7Å; A81-L85 WeakPolarHBondContact O-CB 3.43Å; A81-L85 PolarHBondContact O-N 3.32Å; H82-L85 PolarHBondContact O-N 2.87Å; F83-L85 VanDerWaalsContact C-N 3.35Å; F83-L85 PolarHBondContact O-N 2.93Å; L85-Q87 VanDerWaalsContact C-N 3.34Å; L85-Q87 PolarHBondContact O-N 3.2Å; L85-C88 PolarHBondContact O-N 3.07Å; L85-H89 PolarHBondContact O-CD2 3.14Å; L85-H89 VanDerWaalsContact O-CD2 3.22Å; L85-H89 PolarHBondContact O-N 2.64Å; L85-N101 WeakPolarHBondContact CD2-OD1 3.4Å
86	G	96.5	Very high	95.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.3	-40.2	175.5	0	0	0	0	0	113	H82 F83 H89 L90 A98	H82-G86 PolarHBondContact O-N 3.29Å; F83-G86 PolarHBondContact O-N 3.39Å; G86-H89 PolarHBondContact O-N 3.14Å; G86-L90 WeakPolarHBondContact O-CB 3.34Å; G86-L90 PolarHBondContact O-N 3.16Å; G86-A98 WeakPolarHBondContact O-CB 3.44Å
87	Q	95.6	Very high	95.8	Very high	59 Å²	59	46.8 Å²	46.8	28%	0.276	22%	0.224	S	C	.	.	H	α-helix	trans	-64.4	-40.5	174.9	-171.6	174.5	10.6	0	0	112.4	F83 F84 L85 L90 E91	F83-Q87 PolarHBondContact O-N 3.46Å; F84-Q87 PolarHBondContact O-N 3.04Å; L85-Q87 VanDerWaalsContact C-N 3.34Å; L85-Q87 PolarHBondContact O-N 3.2Å; Q87-L90 WeakPolarHBondContact O-CB 3.3Å; Q87-L90 PolarHBondContact O-N 3.42Å; Q87-E91 PolarHBondContact O-N 3.15Å
88	C	96.3	Very high	95.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.1	-43.6	176.7	-64.8	0	0	0	0	111.5	V56 A64 L65 F84 L85 L90 E91 L92	V56-C88 VanDerWaalsContact CG2-SG 3.56Å; A64-C88 WeakPolarHBondContact CB-SG 3.38Å; L65-C88 HydrophobicContact CD2-CB 3.51Å; L65-C88 HydrophobicContact CG-CB 3.82Å; F84-C88 PolarHBondContact O-N 3.26Å; F84-C88 PolarHBondContact O-SG 3.48Å; L85-C88 PolarHBondContact O-N 3.07Å; C88-L90 VanDerWaalsContact C-N 3.25Å; C88-L90 PolarHBondContact O-N 3.38Å; C88-E91 PolarHBondContact O-N 3.01Å; C88-L92 WeakPolarHBondContact O-CG 3.33Å; C88-L92 PolarHBondContact O-N 3.05Å
89	H	96.8	Very high	96	Very high	23 Å²	23	42.3 Å²	42.3	11%	0.106	20%	0.202	C	C	.	.	H	α-helix	trans	-61.6	-35.1	174.9	-82.1	-71	0	0	0	112.4	L85 G86 E91 L92 E93 N94 E97 A98	L85-H89 PolarHBondContact O-CD2 3.14Å; L85-H89 VanDerWaalsContact O-CD2 3.22Å; L85-H89 PolarHBondContact O-N 2.64Å; G86-H89 PolarHBondContact O-N 3.14Å; H89-E91 VanDerWaalsContact C-N 3.33Å; H89-E91 PolarHBondContact O-N 3.18Å; H89-L92 CarbonylContact O-C 3.53Å; H89-L92 PolarHBondContact O-N 3.17Å; H89-E93 PolarHBondContact O-N 3.12Å; H89-N94 HydrophobicContact CB-CB 4.18Å; H89-N94 PolarHBondContact O-N 2.89Å; H89-E97 HydrophobicContact CB-CB 4.43Å; H89-A98 HydrophobicContact CB-CB 3.82Å
90	L	95.4	Very high	96	Very high	12 Å²	12	43.2 Å²	43.2	6%	0.063	21%	0.213	C	C	.	.	H	α-helix	trans	-63.7	-37.9	176.8	-175.6	63.9	0	0	0	112.8	G86 Q87 C88 Y95 A98 I126 A127 K130	G86-L90 WeakPolarHBondContact O-CB 3.34Å; G86-L90 PolarHBondContact O-N 3.16Å; Q87-L90 WeakPolarHBondContact O-CB 3.3Å; Q87-L90 PolarHBondContact O-N 3.42Å; C88-L90 VanDerWaalsContact C-N 3.25Å; C88-L90 PolarHBondContact O-N 3.38Å; L90-Y95 HydrophobicContact CD1-CD1 3.96Å; L90-Y95 HydrophobicContact CD1-CE1 4.3Å; L90-A98 HydrophobicContact CB-CB 4.05Å; L90-I126 HydrophobicContact CD2-CG2 4.25Å; L90-A127 HydrophobicContact CD1-CB 3.77Å; L90-A127 HydrophobicContact CD2-CB 4.43Å; L90-K130 HydrophobicContact CD1-CB 4.26Å; L90-K130 HydrophobicContact CD1-CD 3.81Å; L90-K130 HydrophobicContact CD1-CG 4.46Å; L90-K130 HydrophobicContact CG-CD 4.17Å
91	E	94.5	Very high	96.1	Very high	75 Å²	75	38.9 Å²	38.9	35%	0.35	20%	0.195	S	C	.	.	H	α-helix	trans	-78.8	-23.2	177	-62.9	-56	136.7	0	0	112.6	Y61 Q87 C88 H89 E93 K130	Y61-E91 HydrophobicContact CD1-CB 3.95Å; Y61-E91 HydrophobicContact CD1-CG 4.31Å; Y61-E91 HydrophobicContact CD2-CB 3.95Å; Y61-E91 HydrophobicContact CE1-CB 3.69Å; Y61-E91 HydrophobicContact CE1-CG 3.68Å; Y61-E91 HydrophobicContact CE2-CB 3.66Å; Y61-E91 HydrophobicContact CE2-CG 4.33Å; Y61-E91 HydrophobicContact CG-CB 4.08Å; Q87-E91 PolarHBondContact O-N 3.15Å; C88-E91 PolarHBondContact O-N 3.01Å; H89-E91 VanDerWaalsContact C-N 3.33Å; H89-E91 PolarHBondContact O-N 3.18Å; E91-E93 VanDerWaalsContact C-N 3.28Å; E91-K130 IonicContact OE1-NZ 3.26Å; E91-K130 PolarHBondContact OE1-NZ 3.27Å; E91-K130 IonicContact OE2-NZ 2.58Å
92	L	94.8	Very high	96.1	Very high	55 Å²	55	39 Å²	39	29%	0.288	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	12.5	172.2	-67.1	169.2	0	0	0	113.3	L65 C88 H89 N94	L65-L92 HydrophobicContact CD1-CD1 3.31Å; L65-L92 HydrophobicContact CG-CD1 4.09Å; C88-L92 WeakPolarHBondContact O-CG 3.33Å; C88-L92 PolarHBondContact O-N 3.05Å; H89-L92 CarbonylContact O-C 3.53Å; H89-L92 PolarHBondContact O-N 3.17Å; L92-N94 PolarHBondContact O-N 3.27Å
93	E	94.9	Very high	96.1	Very high	138 Å²	138	42.2 Å²	42.2	65%	0.645	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	14	179	-54.2	-176.4	171	0	0	115.6	H89 E91 Y95	H89-E93 PolarHBondContact O-N 3.12Å; E91-E93 VanDerWaalsContact C-N 3.28Å; E93-Y95 VanDerWaalsContact C-N 3.32Å; E93-Y95 HydrophobicContact CB-CE1 4.36Å; E93-Y95 HydrophobicContact CB-CE2 4.22Å; E93-Y95 WeakPolarHBondContact O-CD2 3.24Å; E93-Y95 WeakPolarHBondContact O-CE2 3.24Å; E93-Y95 PolarHBondContact O-N 3.4Å; E93-Y95 VanDerWaalsContact O-N 3.08Å
94	N	95.9	Very high	96	Very high	71 Å²	71	45.9 Å²	45.9	38%	0.38	23%	0.226	S	C	.	.			trans	-86.6	73.6	174.5	-67.7	-42.1	0	0	0	109.6	H89 L92 D96 A98	H89-N94 HydrophobicContact CB-CB 4.18Å; H89-N94 PolarHBondContact O-N 2.89Å; L92-N94 PolarHBondContact O-N 3.27Å; N94-D96 PolarHBondContact O-N 3.28Å; N94-A98 VanDerWaalsContact O-CB 3.3Å; N94-A98 WeakPolarHBondContact O-CB 3.47Å; N94-A98 PolarHBondContact O-N 3.43Å
95	Y	95.9	Very high	96	Very high	36 Å²	36	44.8 Å²	44.8	14%	0.141	22%	0.222	C	C	.	.	H	α-helix	trans	-70	-33.1	-167.2	-53.5	-59.3	0	0	0	114.5	L90 E93 A98 I99 K130 R131 S134	L90-Y95 HydrophobicContact CD1-CD1 3.96Å; L90-Y95 HydrophobicContact CD1-CE1 4.3Å; E93-Y95 VanDerWaalsContact C-N 3.32Å; E93-Y95 HydrophobicContact CB-CE1 4.36Å; E93-Y95 HydrophobicContact CB-CE2 4.22Å; E93-Y95 WeakPolarHBondContact O-CD2 3.24Å; E93-Y95 WeakPolarHBondContact O-CE2 3.24Å; E93-Y95 PolarHBondContact O-N 3.4Å; E93-Y95 VanDerWaalsContact O-N 3.08Å; Y95-A98 PolarHBondContact O-N 3.5Å; Y95-I99 VanDerWaalsContact O-CG1 3.3Å; Y95-I99 WeakPolarHBondContact O-CG1 3.42Å; Y95-I99 PolarHBondContact O-N 3.17Å; Y95-K130 HydrophobicContact CD1-CB 4.03Å; Y95-K130 HydrophobicContact CE1-CB 3.68Å; Y95-K130 HydrophobicContact CE1-CD 4.19Å; Y95-R131 HydrophobicContact CG-CB 4.14Å; Y95-S134 WeakPolarHBondContact CE2-OG 3.32Å
96	D	95	Very high	96	Very high	98 Å²	98	48.2 Å²	48.2	52%	0.524	23%	0.234	S	C	.	.	H	α-helix	trans	-68.6	-46.2	-179.1	-69.4	-47.8	0	0	0	110.7	N94 A98 I99 G100 R131	N94-D96 PolarHBondContact O-N 3.28Å; D96-A98 VanDerWaalsContact C-N 3.34Å; D96-A98 PolarHBondContact O-N 2.96Å; D96-I99 PolarHBondContact O-N 2.93Å; D96-G100 PolarHBondContact O-N 3.38Å; D96-R131 IonicContact OD1-CZ 2.8Å; D96-R131 IonicContact OD1-NE 3.4Å; D96-R131 PolarHBondContact OD1-NE 3.09Å; D96-R131 IonicContact OD1-NH2 3.72Å; D96-R131 PolarHBondContact OD1-NH2 2.99Å
97	E	95.9	Very high	95.9	Very high	96 Å²	96	52.3 Å²	52.3	45%	0.449	26%	0.256	S	S	.	.	H	α-helix	trans	-65.2	-38.1	173.9	-64.2	81.9	177.5	0	0	111.6	H89 G100 N101	H89-E97 HydrophobicContact CB-CB 4.43Å; E97-G100 PolarHBondContact O-N 3.33Å; E97-N101 WeakPolarHBondContact O-CB 3.21Å; E97-N101 PolarHBondContact O-N 2.98Å; E97-N101 PolarHBondContact O-ND2 3.42Å
98	A	96.9	Very high	95.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.1	-51	176.6	0	0	0	0	0	111.4	G86 H89 L90 N94 Y95 D96 G100 N101 L102	G86-A98 WeakPolarHBondContact O-CB 3.44Å; H89-A98 HydrophobicContact CB-CB 3.82Å; L90-A98 HydrophobicContact CB-CB 4.05Å; N94-A98 VanDerWaalsContact O-CB 3.3Å; N94-A98 WeakPolarHBondContact O-CB 3.47Å; N94-A98 PolarHBondContact O-N 3.43Å; Y95-A98 PolarHBondContact O-N 3.5Å; D96-A98 VanDerWaalsContact C-N 3.34Å; D96-A98 PolarHBondContact O-N 2.96Å; A98-G100 PolarHBondContact O-N 3.29Å; A98-N101 PolarHBondContact O-N 3.43Å; A98-L102 WeakPolarHBondContact O-CB 3.23Å; A98-L102 VanDerWaalsContact O-CG 3.25Å; A98-L102 WeakPolarHBondContact O-CG 3.45Å; A98-L102 PolarHBondContact O-N 2.96Å
99	I	96.7	Very high	95.8	Very high	16 Å²	16	50.4 Å²	50.4	8%	0.082	25%	0.248	C	C	.	.	H	α-helix	trans	-63.2	-44.3	179	-67.6	167.7	0	0	0	110.5	Y95 D96 N101 L102 Q103 L124 A127 K128 R131	Y95-I99 VanDerWaalsContact O-CG1 3.3Å; Y95-I99 WeakPolarHBondContact O-CG1 3.42Å; Y95-I99 PolarHBondContact O-N 3.17Å; D96-I99 PolarHBondContact O-N 2.93Å; I99-N101 PolarHBondContact O-N 3.47Å; I99-L102 PolarHBondContact O-N 3.49Å; I99-Q103 HydrophobicContact CG2-CG 4.18Å; I99-Q103 WeakPolarHBondContact O-CB 3.43Å; I99-Q103 VanDerWaalsContact O-CG 3.26Å; I99-Q103 WeakPolarHBondContact O-CG 3.29Å; I99-Q103 PolarHBondContact O-N 2.92Å; I99-L124 HydrophobicContact CG2-CD2 4.3Å; I99-A127 HydrophobicContact CG1-CB 3.8Å; I99-K128 HydrophobicContact CD1-CG 3.94Å; I99-K128 HydrophobicContact CG1-CG 4.41Å; I99-R131 HydrophobicContact CD1-CB 4.2Å; I99-R131 VanDerWaalsContact CD1-CD 3.46Å; I99-R131 HydrophobicContact CD1-CG 4.48Å
100	G	96.6	Very high	95.5	Very high	25 Å²	25	56.4 Å²	56.4	26%	0.258	27%	0.274	S	S	.	.	H	α-helix	trans	-59.3	-43.6	179.5	0	0	0	0	0	112.9	D96 E97 A98 K104	D96-G100 PolarHBondContact O-N 3.38Å; E97-G100 PolarHBondContact O-N 3.33Å; A98-G100 PolarHBondContact O-N 3.29Å; G100-K104 WeakPolarHBondContact O-CG 3.32Å; G100-K104 PolarHBondContact O-N 3.43Å
101	N	96.9	Very high	95.5	Very high	20 Å²	20	62.5 Å²	62.5	11%	0.107	30%	0.302	C	S	.	.	H	α-helix	trans	-71.4	-40	177.8	-72.5	-58.5	0	0	0	112.6	L85 E97 A98 I99 Q103 K104 A105	L85-N101 WeakPolarHBondContact CD2-OD1 3.4Å; E97-N101 WeakPolarHBondContact O-CB 3.21Å; E97-N101 PolarHBondContact O-N 2.98Å; E97-N101 PolarHBondContact O-ND2 3.42Å; A98-N101 PolarHBondContact O-N 3.43Å; I99-N101 PolarHBondContact O-N 3.47Å; N101-Q103 VanDerWaalsContact C-N 3.32Å; N101-Q103 PolarHBondContact O-N 3.08Å; N101-K104 WeakPolarHBondContact O-CB 3.27Å; N101-K104 PolarHBondContact O-N 2.88Å; N101-A105 PolarHBondContact O-N 3.49Å
102	L	96.9	Very high	95.5	Very high	2 Å²	2	63 Å²	63	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-65.1	-35.7	175.2	-70.5	172.4	0	0	0	112.2	F83 A98 I99 A105 Y106 A123 L124 A127	F83-L102 HydrophobicContact CD2-CD2 3.66Å; F83-L102 HydrophobicContact CE2-CD2 4.01Å; F83-L102 HydrophobicContact CG-CD2 4.43Å; A98-L102 WeakPolarHBondContact O-CB 3.23Å; A98-L102 VanDerWaalsContact O-CG 3.25Å; A98-L102 WeakPolarHBondContact O-CG 3.45Å; A98-L102 PolarHBondContact O-N 2.96Å; I99-L102 PolarHBondContact O-N 3.49Å; L102-A105 PolarHBondContact O-N 3.03Å; L102-Y106 PolarHBondContact O-N 2.91Å; L102-A123 HydrophobicContact CD1-CB 4.13Å; L102-A123 HydrophobicContact CD2-CB 4.07Å; L102-L124 HydrophobicContact CB-CD2 3.44Å; L102-L124 VanDerWaalsContact CB-CD2 3.44Å; L102-L124 HydrophobicContact CB-CG 3.81Å; L102-L124 HydrophobicContact CD1-CD2 4.36Å; L102-A127 HydrophobicContact CD1-CB 3.93Å
103	Q	96.4	Very high	95.4	Very high	89 Å²	89	71.4 Å²	71.4	42%	0.416	33%	0.333	S	S	.	.	H	α-helix	trans	-65.8	-42.9	173.1	-77.2	176.3	-29.8	0	0	111.6	I99 N101 Y106 N107 L124	I99-Q103 HydrophobicContact CG2-CG 4.18Å; I99-Q103 WeakPolarHBondContact O-CB 3.43Å; I99-Q103 VanDerWaalsContact O-CG 3.26Å; I99-Q103 WeakPolarHBondContact O-CG 3.29Å; I99-Q103 PolarHBondContact O-N 2.92Å; N101-Q103 VanDerWaalsContact C-N 3.32Å; N101-Q103 PolarHBondContact O-N 3.08Å; Q103-Y106 WeakPolarHBondContact O-CB 3.36Å; Q103-Y106 PolarHBondContact O-N 3.34Å; Q103-N107 VanDerWaalsContact O-CG 3.31Å; Q103-N107 PolarHBondContact O-N 2.88Å; Q103-N107 PolarHBondContact O-ND2 3.25Å; Q103-L124 HydrophobicContact CG-CD1 4.49Å; Q103-L124 HydrophobicContact CG-CD2 3.83Å
104	K	96.1	Very high	95.3	Very high	116 Å²	116	68.7 Å²	68.7	50%	0.504	32%	0.322	S	S	.	.	H	α-helix	trans	-59.1	-47.4	172.6	-73.8	175	-177	178.1	0	111	G100 N101 Y106 N107 L108	G100-K104 WeakPolarHBondContact O-CG 3.32Å; G100-K104 PolarHBondContact O-N 3.43Å; N101-K104 WeakPolarHBondContact O-CB 3.27Å; N101-K104 PolarHBondContact O-N 2.88Å; K104-Y106 VanDerWaalsContact C-N 3.29Å; K104-Y106 PolarHBondContact O-N 3.31Å; K104-N107 PolarHBondContact O-N 3.31Å; K104-L108 WeakPolarHBondContact O-CB 3.49Å; K104-L108 VanDerWaalsContact O-CG 3.23Å; K104-L108 WeakPolarHBondContact O-CG 3.26Å; K104-L108 PolarHBondContact O-N 2.99Å
105	A	96.3	Very high	95	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-56.8	-42.7	176.1	0	0	0	0	0	112.2	V79 H82 F83 N101 L102 A109	V79-A105 HydrophobicContact CG1-CB 4.3Å; H82-A105 HydrophobicContact CB-CB 3.82Å; F83-A105 HydrophobicContact CB-CB 4.13Å; N101-A105 PolarHBondContact O-N 3.49Å; L102-A105 PolarHBondContact O-N 3.03Å; A105-A109 VanDerWaalsContact O-CB 3.32Å; A105-A109 WeakPolarHBondContact O-CB 3.48Å; A105-A109 PolarHBondContact O-N 2.97Å
106	Y	94.9	Very high	94.7	Very high	82 Å²	82	73.6 Å²	73.6	32%	0.322	35%	0.348	S	S	.	.	H	α-helix	trans	-62.6	-46.7	176.8	-179.7	-100.5	0	0	0	112.6	L102 Q103 K104 A109 K110 I120 P121	L102-Y106 PolarHBondContact O-N 2.91Å; Q103-Y106 WeakPolarHBondContact O-CB 3.36Å; Q103-Y106 PolarHBondContact O-N 3.34Å; K104-Y106 VanDerWaalsContact C-N 3.29Å; K104-Y106 PolarHBondContact O-N 3.31Å; Y106-A109 PolarHBondContact O-N 3.28Å; Y106-K110 PolarHBondContact O-N 3.44Å; Y106-K110 VanDerWaalsContact O-N 3.11Å; Y106-I120 HydrophobicContact CD2-CG2 4.33Å; Y106-P121 HydrophobicContact CD2-CG 4.26Å; Y106-P121 HydrophobicContact CE2-CG 4.03Å
107	N	94.5	Very high	94.4	Very high	85 Å²	85	71.5 Å²	71.5	46%	0.455	35%	0.35	S	S	.	.	H	α-helix	trans	-64.4	-44.4	179.2	-67.4	-19.8	0	0	0	111.4	Q103 K104 A109 K110 E111	Q103-N107 VanDerWaalsContact O-CG 3.31Å; Q103-N107 PolarHBondContact O-N 2.88Å; Q103-N107 PolarHBondContact O-ND2 3.25Å; K104-N107 PolarHBondContact O-N 3.31Å; N107-A109 PolarHBondContact O-N 3.45Å; N107-K110 WeakPolarHBondContact O-CB 3.5Å; N107-K110 PolarHBondContact O-N 2.92Å; N107-K110 VanDerWaalsContact O-N 3.17Å; N107-E111 WeakPolarHBondContact O-CG 3.32Å; N107-E111 PolarHBondContact O-N 2.88Å
108	L	95.3	Very high	94	Very high	14 Å²	14	71 Å²	71	7%	0.073	35%	0.35	C	S	.	.	H	α-helix	trans	-64.2	-39.7	177.4	-68.7	177.6	0	0	0	112.4	V79 H82 K104 K110 E111 Q112	V79-L108 HydrophobicContact CG2-CB 3.7Å; H82-L108 WeakPolarHBondContact CD2-CD1 3.36Å; K104-L108 WeakPolarHBondContact O-CB 3.49Å; K104-L108 VanDerWaalsContact O-CG 3.23Å; K104-L108 WeakPolarHBondContact O-CG 3.26Å; K104-L108 PolarHBondContact O-N 2.99Å; L108-K110 VanDerWaalsContact C-N 3.27Å; L108-K110 PolarHBondContact O-N 3.5Å; L108-E111 PolarHBondContact O-N 3.32Å; L108-Q112 WeakPolarHBondContact O-CB 3.43Å; L108-Q112 VanDerWaalsContact O-CG 3.3Å; L108-Q112 WeakPolarHBondContact O-CG 3.25Å; L108-Q112 PolarHBondContact O-N 2.66Å
109	A	94.9	Very high	93.7	Very high	5 Å²	5	75.9 Å²	75.9	4%	0.041	38%	0.376	C	S	.	.	H	α-helix	trans	-58.9	-42.3	173.7	0	0	0	0	0	111.4	V79 A105 Y106 N107 R113 L114 F116 I120	V79-A109 HydrophobicContact CG1-CB 4.04Å; V79-A109 HydrophobicContact CG2-CB 4.33Å; A105-A109 VanDerWaalsContact O-CB 3.32Å; A105-A109 WeakPolarHBondContact O-CB 3.48Å; A105-A109 PolarHBondContact O-N 2.97Å; Y106-A109 PolarHBondContact O-N 3.28Å; N107-A109 PolarHBondContact O-N 3.45Å; A109-R113 PolarHBondContact O-N 3.37Å; A109-L114 PolarHBondContact O-N 3.32Å; A109-F116 HydrophobicContact CB-CD2 3.72Å; A109-F116 HydrophobicContact CB-CE2 3.8Å; A109-I120 HydrophobicContact CB-CD1 3.89Å
110	K	91.5	Very high	93.5	Very high	150 Å²	150	75.4 Å²	75.4	65%	0.652	37%	0.374	S	S	*	.	H	α-helix	trans	-65.7	-45.1	177.2	-173.5	176.8	179.8	172.7	0	112.1	Y106 N107 L108 R113	Y106-K110 PolarHBondContact O-N 3.44Å; Y106-K110 VanDerWaalsContact O-N 3.11Å; N107-K110 WeakPolarHBondContact O-CB 3.5Å; N107-K110 PolarHBondContact O-N 2.92Å; N107-K110 VanDerWaalsContact O-N 3.17Å; L108-K110 VanDerWaalsContact C-N 3.27Å; L108-K110 PolarHBondContact O-N 3.5Å; K110-R113 PolarHBondContact O-N 3.33Å
111	E	94.3	Very high	93.3	Very high	140 Å²	140	75.8 Å²	75.8	65%	0.654	37%	0.372	S	S	*	.	H	α-helix	trans	-61.8	-43.5	177.6	-73.3	173.1	-169.5	0	0	111.9	N107 L108 R113	N107-E111 WeakPolarHBondContact O-CG 3.32Å; N107-E111 PolarHBondContact O-N 2.88Å; L108-E111 PolarHBondContact O-N 3.32Å; E111-R113 PolarHBondContact O-N 3.31Å
112	Q	94.1	Very high	93	Very high	84 Å²	84	76.4 Å²	76.4	39%	0.393	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-1	178.5	-63.9	172.4	26.3	0	0	113.3	Q77 L108 L114	Q77-Q112 PolarHBondContact O-NE2 3.22Å; L108-Q112 WeakPolarHBondContact O-CB 3.43Å; L108-Q112 VanDerWaalsContact O-CG 3.3Å; L108-Q112 WeakPolarHBondContact O-CG 3.25Å; L108-Q112 PolarHBondContact O-N 2.66Å; Q112-L114 HydrophobicContact CB-CD1 4.03Å; Q112-L114 HydrophobicContact CB-CG 3.86Å; Q112-L114 PolarHBondContact O-N 3.46Å
113	R	93.3	Very high	92.9	Very high	233 Å²	233	77.1 Å²	77.1	88%	0.879	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	34.5	-176.3	-54.5	-179.1	-178.7	-175.6	-0.5	113.2	A109 K110 E111	A109-R113 PolarHBondContact O-N 3.37Å; K110-R113 PolarHBondContact O-N 3.33Å; E111-R113 PolarHBondContact O-N 3.31Å
114	L	92.8	Very high	92.8	Very high	81 Å²	81	74 Å²	74	42%	0.424	37%	0.37	S	S	.	.			trans	-84.3	132.7	174.7	-63.6	176	0	0	0	109.7	V79 A109 Q112 F116	V79-L114 HydrophobicContact CG2-CD1 4Å; A109-L114 PolarHBondContact O-N 3.32Å; Q112-L114 HydrophobicContact CB-CD1 4.03Å; Q112-L114 HydrophobicContact CB-CG 3.86Å; Q112-L114 PolarHBondContact O-N 3.46Å; L114-F116 HydrophobicContact CB-CD2 4.07Å; L114-F116 HydrophobicContact CB-CE2 3.47Å; L114-F116 VanDerWaalsContact CB-CE2 3.47Å; L114-F116 HydrophobicContact CB-CZ 4.22Å; L114-F116 HydrophobicContact CD1-CE2 3.89Å; L114-F116 HydrophobicContact CD1-CZ 4.08Å; L114-F116 HydrophobicContact CG-CE2 4.34Å
115	N	90.1	Very high	92.5	Very high	152 Å²	152	72.9 Å²	72.9	81%	0.813	36%	0.363	S	S	*	.			trans	-99.9	109.2	177.6	-172.7	7.4	0	0	0	110.6	G117	N115-G117 PolarHBondContact OD1-N 3.04Å
116	F	89.2	Confident	92.4	Very high	57 Å²	57	77.1 Å²	77.1	25%	0.25	38%	0.384	C	S	.	.			trans	-105.7	10	173	-65.5	-83.4	0	0	0	112.6	V79 A109 L114 D118 D119 I120	V79-F116 HydrophobicContact CB-CE2 4.31Å; V79-F116 HydrophobicContact CB-CZ 4.35Å; V79-F116 HydrophobicContact CG1-CD2 4.37Å; V79-F116 HydrophobicContact CG1-CE2 3.57Å; V79-F116 HydrophobicContact CG1-CZ 3.82Å; A109-F116 HydrophobicContact CB-CD2 3.72Å; A109-F116 HydrophobicContact CB-CE2 3.8Å; L114-F116 HydrophobicContact CB-CD2 4.07Å; L114-F116 HydrophobicContact CB-CE2 3.47Å; L114-F116 VanDerWaalsContact CB-CE2 3.47Å; L114-F116 HydrophobicContact CB-CZ 4.22Å; L114-F116 HydrophobicContact CD1-CE2 3.89Å; L114-F116 HydrophobicContact CD1-CZ 4.08Å; L114-F116 HydrophobicContact CG-CE2 4.34Å; F116-D118 PolarHBondContact O-N 3.4Å; F116-D119 HydrophobicContact CB-CB 4.44Å; F116-D119 WeakPolarHBondContact O-CB 3.42Å; F116-D119 PolarHBondContact O-N 3.33Å; F116-I120 HydrophobicContact CB-CD1 4.04Å; F116-I120 HydrophobicContact CB-CG1 4.06Å; F116-I120 HydrophobicContact CD2-CD1 3.66Å; F116-I120 HydrophobicContact CE2-CD1 4.29Å; F116-I120 HydrophobicContact CG-CD1 3.92Å; F116-I120 HydrophobicContact CG-CG1 4.3Å
117	G	88.1	Confident	92.4	Very high	55 Å²	55	73.2 Å²	73.2	57%	0.567	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	-123.4	-176	0	0	0	0	0	112.1	N115	N115-G117 PolarHBondContact OD1-N 3.04Å
118	D	87.8	Confident	92.4	Very high	85 Å²	85	74.9 Å²	74.9	46%	0.455	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	7.3	-179.8	-166	43.7	0	0	0	113.6	F116 S122 R125	F116-D118 PolarHBondContact O-N 3.4Å; D118-S122 WeakPolarHBondContact O-CA 3.46Å; D118-S122 WeakPolarHBondContact O-CB 3.45Å; D118-S122 PolarHBondContact O-N 3.22Å; D118-S122 PolarHBondContact O-OG 3.24Å; D118-R125 VanDerWaalsContact CG-NH2 3.29Å; D118-R125 IonicContact OD1-CZ 3.87Å; D118-R125 IonicContact OD1-NH1 2.71Å; D118-R125 PolarHBondContact OD1-NH1 2.92Å; D118-R125 IonicContact OD1-NH2 3.2Å; D118-R125 PolarHBondContact OD1-NH2 3.48Å; D118-R125 VanDerWaalsContact OD1-NH2 3.1Å; D118-R125 IonicContact OD2-CZ 2.68Å; D118-R125 IonicContact OD2-NH1 2.91Å; D118-R125 IonicContact OD2-NH2 3.54Å; D118-R125 PolarHBondContact OD2-NH2 3.38Å
119	D	90.7	Very high	92.2	Very high	103 Å²	103	81 Å²	81	55%	0.551	40%	0.398	S	S	*	.	H	α-helix	trans	-64	-50.5	-176.8	-69	-19.2	0	0	0	112.4	F116 S122 A123	F116-D119 HydrophobicContact CB-CB 4.44Å; F116-D119 WeakPolarHBondContact O-CB 3.42Å; F116-D119 PolarHBondContact O-N 3.33Å; D119-S122 PolarHBondContact O-OG 3.49Å; D119-A123 WeakPolarHBondContact O-CB 3.37Å; D119-A123 PolarHBondContact O-N 2.83Å
120	I	93.2	Very high	92.2	Very high	6 Å²	6	84.1 Å²	84.1	3%	0.031	41%	0.411	C	S	.	.	H	α-helix	trans	-71.9	-47.1	179.4	-50.5	173.8	0	0	0	111.2	V79 F83 Y106 A109 F116 S122 A123 L124	V79-I120 HydrophobicContact CG1-CD1 4.07Å; F83-I120 HydrophobicContact CD2-CG1 4.06Å; F83-I120 HydrophobicContact CD2-CG2 4.49Å; F83-I120 HydrophobicContact CE2-CG1 4.34Å; Y106-I120 HydrophobicContact CD2-CG2 4.33Å; A109-I120 HydrophobicContact CB-CD1 3.89Å; F116-I120 HydrophobicContact CB-CD1 4.04Å; F116-I120 HydrophobicContact CB-CG1 4.06Å; F116-I120 HydrophobicContact CD2-CD1 3.66Å; F116-I120 HydrophobicContact CE2-CD1 4.29Å; F116-I120 HydrophobicContact CG-CD1 3.92Å; F116-I120 HydrophobicContact CG-CG1 4.3Å; I120-S122 PolarHBondContact O-N 3.4Å; I120-A123 PolarHBondContact O-N 3.23Å; I120-L124 PolarHBondContact O-N 3.28Å
121	P	91.8	Very high	92.4	Very high	32 Å²	32	81.7 Å²	81.7	21%	0.208	40%	0.398	C	S	.	.	H	α-helix	trans	-62.2	-38.1	177.3	-23.6	35	0	0	0	113.5	Y106 L124 R125	Y106-P121 HydrophobicContact CD2-CG 4.26Å; Y106-P121 HydrophobicContact CE2-CG 4.03Å; P121-L124 WeakPolarHBondContact O-CB 3.45Å; P121-L124 PolarHBondContact O-N 3.39Å; P121-R125 WeakPolarHBondContact O-CG 3.46Å; P121-R125 PolarHBondContact O-N 3.24Å
122	S	91.4	Very high	92.3	Very high	34 Å²	34	83.1 Å²	83.1	24%	0.238	40%	0.397	C	S	.	.	H	α-helix	trans	-64.2	-43.7	175.6	65.7	0	0	0	0	111.8	D118 D119 I120 L124 R125 I126	D118-S122 WeakPolarHBondContact O-CA 3.46Å; D118-S122 WeakPolarHBondContact O-CB 3.45Å; D118-S122 PolarHBondContact O-N 3.22Å; D118-S122 PolarHBondContact O-OG 3.24Å; D119-S122 PolarHBondContact O-OG 3.49Å; I120-S122 PolarHBondContact O-N 3.4Å; S122-L124 VanDerWaalsContact C-N 3.3Å; S122-L124 PolarHBondContact O-N 3.33Å; S122-R125 PolarHBondContact O-N 3.21Å; S122-R125 VanDerWaalsContact O-N 3.16Å; S122-I126 WeakPolarHBondContact O-CG1 3.37Å; S122-I126 PolarHBondContact O-N 3.04Å
123	A	93.9	Very high	92.2	Very high	17 Å²	17	83 Å²	83	14%	0.14	40%	0.399	C	S	.	.	H	α-helix	trans	-58.7	-41.5	173.8	0	0	0	0	0	111.8	F83 L102 D119 I120 I126 A127	F83-A123 HydrophobicContact CE2-CB 3.78Å; F83-A123 HydrophobicContact CZ-CB 4.33Å; L102-A123 HydrophobicContact CD1-CB 4.13Å; L102-A123 HydrophobicContact CD2-CB 4.07Å; D119-A123 WeakPolarHBondContact O-CB 3.37Å; D119-A123 PolarHBondContact O-N 2.83Å; I120-A123 PolarHBondContact O-N 3.23Å; A123-I126 PolarHBondContact O-N 3.38Å; A123-A127 WeakPolarHBondContact O-CB 3.48Å; A123-A127 PolarHBondContact O-N 3.08Å
124	L	94.3	Very high	92.2	Very high	24 Å²	24	72.9 Å²	72.9	13%	0.126	36%	0.364	C	S	.	.	H	α-helix	trans	-62.5	-42.4	174.5	-82.4	170	0	0	0	112.9	I99 L102 Q103 I120 P121 S122 A127 K128	I99-L124 HydrophobicContact CG2-CD2 4.3Å; L102-L124 HydrophobicContact CB-CD2 3.44Å; L102-L124 VanDerWaalsContact CB-CD2 3.44Å; L102-L124 HydrophobicContact CB-CG 3.81Å; L102-L124 HydrophobicContact CD1-CD2 4.36Å; Q103-L124 HydrophobicContact CG-CD1 4.49Å; Q103-L124 HydrophobicContact CG-CD2 3.83Å; I120-L124 PolarHBondContact O-N 3.28Å; P121-L124 WeakPolarHBondContact O-CB 3.45Å; P121-L124 PolarHBondContact O-N 3.39Å; S122-L124 VanDerWaalsContact C-N 3.3Å; S122-L124 PolarHBondContact O-N 3.33Å; L124-A127 PolarHBondContact O-N 2.85Å; L124-K128 WeakPolarHBondContact O-CB 3.36Å; L124-K128 WeakPolarHBondContact O-CG 3.4Å; L124-K128 PolarHBondContact O-N 3.41Å
125	R	90.8	Very high	92.1	Very high	92 Å²	92	73.1 Å²	73.1	35%	0.347	37%	0.365	S	S	.	.	H	α-helix	trans	-63	-44.1	176.8	-70.2	-171.9	-57.7	-91.7	6.3	111.1	D118 P121 S122 K128 K129	D118-R125 VanDerWaalsContact CG-NH2 3.29Å; D118-R125 IonicContact OD1-CZ 3.87Å; D118-R125 IonicContact OD1-NH1 2.71Å; D118-R125 PolarHBondContact OD1-NH1 2.92Å; D118-R125 IonicContact OD1-NH2 3.2Å; D118-R125 PolarHBondContact OD1-NH2 3.48Å; D118-R125 VanDerWaalsContact OD1-NH2 3.1Å; D118-R125 IonicContact OD2-CZ 2.68Å; D118-R125 IonicContact OD2-NH1 2.91Å; D118-R125 IonicContact OD2-NH2 3.54Å; D118-R125 PolarHBondContact OD2-NH2 3.38Å; P121-R125 WeakPolarHBondContact O-CG 3.46Å; P121-R125 PolarHBondContact O-N 3.24Å; S122-R125 PolarHBondContact O-N 3.21Å; S122-R125 VanDerWaalsContact O-N 3.16Å; R125-K128 PolarHBondContact O-N 2.62Å; R125-K129 WeakPolarHBondContact O-CB 3.17Å; R125-K129 PolarHBondContact O-N 2.91Å
126	I	93	Very high	92.1	Very high	89 Å²	89	67.6 Å²	67.6	46%	0.456	33%	0.334	S	S	.	.	H	α-helix	trans	-62.2	-45.2	176.6	-65.2	166	0	0	0	110.2	L90 S122 A123 K129 K130	L90-I126 HydrophobicContact CD2-CG2 4.25Å; S122-I126 WeakPolarHBondContact O-CG1 3.37Å; S122-I126 PolarHBondContact O-N 3.04Å; A123-I126 PolarHBondContact O-N 3.38Å; I126-K129 PolarHBondContact O-N 3.23Å; I126-K130 PolarHBondContact O-N 3.44Å
127	A	95.4	Very high	92.2	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-62.1	-46.8	179	0	0	0	0	0	112.8	L90 I99 L102 A123 L124 K129 K130 R131	L90-A127 HydrophobicContact CD1-CB 3.77Å; L90-A127 HydrophobicContact CD2-CB 4.43Å; I99-A127 HydrophobicContact CG1-CB 3.8Å; L102-A127 HydrophobicContact CD1-CB 3.93Å; A123-A127 WeakPolarHBondContact O-CB 3.48Å; A123-A127 PolarHBondContact O-N 3.08Å; L124-A127 PolarHBondContact O-N 2.85Å; A127-K129 VanDerWaalsContact C-N 3.32Å; A127-K129 PolarHBondContact O-N 2.97Å; A127-K130 PolarHBondContact O-N 3.44Å; A127-R131 WeakPolarHBondContact O-CB 3.42Å; A127-R131 PolarHBondContact O-N 3.31Å
128	K	93.9	Very high	92.5	Very high	120 Å²	120	75.2 Å²	75.2	52%	0.522	35%	0.354	S	S	.	.	H	α-helix	trans	-60.8	-40.9	175	-74.3	-178.8	175.1	-169.3	0	112.2	I99 L124 R125 R131 W132	I99-K128 HydrophobicContact CD1-CG 3.94Å; I99-K128 HydrophobicContact CG1-CG 4.41Å; L124-K128 WeakPolarHBondContact O-CB 3.36Å; L124-K128 WeakPolarHBondContact O-CG 3.4Å; L124-K128 PolarHBondContact O-N 3.41Å; R125-K128 PolarHBondContact O-N 2.62Å; K128-R131 PolarHBondContact O-N 2.79Å; K128-W132 WeakPolarHBondContact O-CB 3.41Å; K128-W132 PolarHBondContact O-N 2.88Å
129	K	92.6	Very high	92.6	Very high	143 Å²	143	75.1 Å²	75.1	62%	0.622	35%	0.347	S	S	*	.	H	α-helix	trans	-64.4	-46.5	176.4	-175.2	178.8	178.6	-179	0	111.8	R125 I126 A127 R131 W132 N133	R125-K129 WeakPolarHBondContact O-CB 3.17Å; R125-K129 PolarHBondContact O-N 2.91Å; I126-K129 PolarHBondContact O-N 3.23Å; A127-K129 VanDerWaalsContact C-N 3.32Å; A127-K129 PolarHBondContact O-N 2.97Å; K129-R131 PolarHBondContact O-N 3.19Å; K129-W132 PolarHBondContact O-N 3.41Å; K129-N133 VanDerWaalsContact O-CG 3.24Å; K129-N133 PolarHBondContact O-N 3.26Å; K129-N133 PolarHBondContact O-OD1 2.96Å
130	K	94.1	Very high	92.6	Very high	69 Å²	69	72.8 Å²	72.8	30%	0.3	33%	0.334	S	S	.	.	H	α-helix	trans	-60.9	-43.8	176.1	-76.3	-163.7	-179.8	178.6	0	111.5	L90 E91 Y95 I126 A127 W132 N133 S134	L90-K130 HydrophobicContact CD1-CB 4.26Å; L90-K130 HydrophobicContact CD1-CD 3.81Å; L90-K130 HydrophobicContact CD1-CG 4.46Å; L90-K130 HydrophobicContact CG-CD 4.17Å; E91-K130 IonicContact OE1-NZ 3.26Å; E91-K130 PolarHBondContact OE1-NZ 3.27Å; E91-K130 IonicContact OE2-NZ 2.58Å; Y95-K130 HydrophobicContact CD1-CB 4.03Å; Y95-K130 HydrophobicContact CE1-CB 3.68Å; Y95-K130 HydrophobicContact CE1-CD 4.19Å; I126-K130 PolarHBondContact O-N 3.44Å; A127-K130 PolarHBondContact O-N 3.44Å; K130-W132 PolarHBondContact O-N 3.34Å; K130-N133 PolarHBondContact O-N 3.05Å; K130-S134 PolarHBondContact O-N 3.18Å
131	R	95.4	Very high	92.7	Very high	100 Å²	100	77.2 Å²	77.2	38%	0.377	36%	0.358	S	S	.	.	H	α-helix	trans	-56.7	-50.1	174.5	-174.4	177.9	179.8	-116.6	8	112.2	Y95 D96 I99 A127 K128 K129 N133 S134 I135	Y95-R131 HydrophobicContact CG-CB 4.14Å; D96-R131 IonicContact OD1-CZ 2.8Å; D96-R131 IonicContact OD1-NE 3.4Å; D96-R131 PolarHBondContact OD1-NE 3.09Å; D96-R131 IonicContact OD1-NH2 3.72Å; D96-R131 PolarHBondContact OD1-NH2 2.99Å; I99-R131 HydrophobicContact CD1-CB 4.2Å; I99-R131 VanDerWaalsContact CD1-CD 3.46Å; I99-R131 HydrophobicContact CD1-CG 4.48Å; A127-R131 WeakPolarHBondContact O-CB 3.42Å; A127-R131 PolarHBondContact O-N 3.31Å; K128-R131 PolarHBondContact O-N 2.79Å; K129-R131 PolarHBondContact O-N 3.19Å; R131-N133 PolarHBondContact O-N 2.77Å; R131-S134 PolarHBondContact O-N 3.05Å; R131-I135 HydrophobicContact CG-CD1 3.98Å; R131-I135 WeakPolarHBondContact O-CG1 3.06Å; R131-I135 PolarHBondContact O-N 2.88Å
132	W	92.1	Very high	92.8	Very high	169 Å²	169	81.9 Å²	81.9	64%	0.64	38%	0.377	S	S	*	.	H	α-helix	trans	-58	-49.4	178.2	178	-93.1	0	0	0	111.1	K128 K129 K130 S134 I135 E136	K128-W132 WeakPolarHBondContact O-CB 3.41Å; K128-W132 PolarHBondContact O-N 2.88Å; K129-W132 PolarHBondContact O-N 3.41Å; K130-W132 PolarHBondContact O-N 3.34Å; W132-S134 VanDerWaalsContact C-N 3.32Å; W132-S134 PolarHBondContact O-N 2.85Å; W132-I135 PolarHBondContact O-N 2.81Å; W132-E136 VanDerWaalsContact O-CB 3.24Å; W132-E136 WeakPolarHBondContact O-CB 3.42Å; W132-E136 PolarHBondContact O-N 3.46Å
133	N	92.1	Very high	92.8	Very high	83 Å²	83	82 Å²	82	44%	0.444	37%	0.374	S	S	.	.	H	α-helix	trans	-59.4	-41.5	179.1	-69.6	-0	0	0	0	112.2	K129 K130 R131 E136 E137	K129-N133 VanDerWaalsContact O-CG 3.24Å; K129-N133 PolarHBondContact O-N 3.26Å; K129-N133 PolarHBondContact O-OD1 2.96Å; K130-N133 PolarHBondContact O-N 3.05Å; R131-N133 PolarHBondContact O-N 2.77Å; N133-E136 PolarHBondContact O-N 3.41Å; N133-E137 VanDerWaalsContact O-CB 3.24Å; N133-E137 WeakPolarHBondContact O-CB 3.24Å; N133-E137 PolarHBondContact O-N 3.49Å
134	S	93.1	Very high	92.7	Very high	20 Å²	20	85.5 Å²	85.5	14%	0.14	39%	0.39	C	S	.	.	H	α-helix	trans	-66.5	-41.3	178.7	-179.4	0	0	0	0	113	Y95 K130 R131 W132 K138	Y95-S134 WeakPolarHBondContact CE2-OG 3.32Å; K130-S134 PolarHBondContact O-N 3.18Å; R131-S134 PolarHBondContact O-N 3.05Å; W132-S134 VanDerWaalsContact C-N 3.32Å; W132-S134 PolarHBondContact O-N 2.85Å; S134-K138 WeakPolarHBondContact O-CG 3.3Å; S134-K138 PolarHBondContact O-N 3.46Å; S134-K138 VanDerWaalsContact O-N 3.15Å
135	I	91.3	Very high	92.8	Very high	86 Å²	86	90.6 Å²	90.6	44%	0.441	41%	0.413	S	S	.	.	H	α-helix	trans	-65.9	-44.2	175.6	-66.5	168.4	0	0	0	110	R131 W132 K138 R139	R131-I135 HydrophobicContact CG-CD1 3.98Å; R131-I135 WeakPolarHBondContact O-CG1 3.06Å; R131-I135 PolarHBondContact O-N 2.88Å; W132-I135 PolarHBondContact O-N 2.81Å; I135-K138 PolarHBondContact O-N 3.16Å; I135-R139 WeakPolarHBondContact O-CB 3.31Å; I135-R139 PolarHBondContact O-N 3.45Å
136	E	90.7	Very high	93.1	Very high	35 Å²	35	90.4 Å²	90.4	16%	0.164	42%	0.418	C	S	.	.	H	α-helix	trans	-65	-41.4	-179.6	-175	63.4	-178.4	0	0	111.7	W132 N133 K138 R139 I140	W132-E136 VanDerWaalsContact O-CB 3.24Å; W132-E136 WeakPolarHBondContact O-CB 3.42Å; W132-E136 PolarHBondContact O-N 3.46Å; N133-E136 PolarHBondContact O-N 3.41Å; E136-K138 PolarHBondContact O-N 3.25Å; E136-R139 VanDerWaalsContact CD-NH2 3.31Å; E136-R139 WeakPolarHBondContact O-CB 3.1Å; E136-R139 PolarHBondContact O-N 3.37Å; E136-R139 IonicContact OE1-CZ 3.21Å; E136-R139 IonicContact OE1-NE 3.59Å; E136-R139 IonicContact OE1-NH2 3.86Å; E136-R139 PolarHBondContact OE1-NH2 2.88Å; E136-R139 IonicContact OE2-CZ 2.79Å; E136-R139 IonicContact OE2-NE 3.42Å; E136-R139 PolarHBondContact OE2-NE 3.3Å; E136-R139 IonicContact OE2-NH2 3.01Å; E136-R139 PolarHBondContact OE2-NH2 3.39Å; E136-R139 VanDerWaalsContact OE2-NH2 3.14Å; E136-I140 HydrophobicContact CG-CD1 3.93Å; E136-I140 HydrophobicContact CG-CG1 4.5Å; E136-I140 WeakPolarHBondContact O-CB 3.32Å; E136-I140 VanDerWaalsContact O-CG1 3.24Å; E136-I140 WeakPolarHBondContact O-CG1 3.41Å; E136-I140 PolarHBondContact O-N 3.16Å
137	E	90.9	Very high	93.2	Very high	137 Å²	137	89 Å²	89	64%	0.64	41%	0.41	S	S	*	.	H	α-helix	trans	-60.9	-44.6	175.1	-177.1	174.8	-165.3	0	0	111.7	N133 R139 I140 N141	N133-E137 VanDerWaalsContact O-CB 3.24Å; N133-E137 WeakPolarHBondContact O-CB 3.24Å; N133-E137 PolarHBondContact O-N 3.49Å; E137-R139 VanDerWaalsContact C-N 3.34Å; E137-R139 PolarHBondContact O-N 3.49Å; E137-I140 PolarHBondContact O-N 2.97Å; E137-N141 WeakPolarHBondContact O-CB 3.36Å; E137-N141 PolarHBondContact O-N 2.65Å
138	K	93.1	Very high	93.3	Very high	136 Å²	136	91.8 Å²	91.8	59%	0.591	43%	0.433	S	S	*	.	H	α-helix	trans	-61.1	-42.4	174.5	-73.4	175.2	-178.2	176.7	0	112	S134 I135 E136 N141 Q142	S134-K138 WeakPolarHBondContact O-CG 3.3Å; S134-K138 PolarHBondContact O-N 3.46Å; S134-K138 VanDerWaalsContact O-N 3.15Å; I135-K138 PolarHBondContact O-N 3.16Å; E136-K138 PolarHBondContact O-N 3.25Å; K138-N141 PolarHBondContact O-N 3.35Å; K138-Q142 WeakPolarHBondContact O-CG 3.23Å; K138-Q142 PolarHBondContact O-N 2.94Å
139	R	91.9	Very high	93.4	Very high	83 Å²	83	92.6 Å²	92.6	31%	0.313	43%	0.434	S	S	.	.	H	α-helix	trans	-62.6	-48	177.6	-173.1	179.3	75.3	98.9	-8.5	111.2	I135 E136 E137 N141 Q142 E143	I135-R139 WeakPolarHBondContact O-CB 3.31Å; I135-R139 PolarHBondContact O-N 3.45Å; E136-R139 VanDerWaalsContact CD-NH2 3.31Å; E136-R139 WeakPolarHBondContact O-CB 3.1Å; E136-R139 PolarHBondContact O-N 3.37Å; E136-R139 IonicContact OE1-CZ 3.21Å; E136-R139 IonicContact OE1-NE 3.59Å; E136-R139 IonicContact OE1-NH2 3.86Å; E136-R139 PolarHBondContact OE1-NH2 2.88Å; E136-R139 IonicContact OE2-CZ 2.79Å; E136-R139 IonicContact OE2-NE 3.42Å; E136-R139 PolarHBondContact OE2-NE 3.3Å; E136-R139 IonicContact OE2-NH2 3.01Å; E136-R139 PolarHBondContact OE2-NH2 3.39Å; E136-R139 VanDerWaalsContact OE2-NH2 3.14Å; E137-R139 VanDerWaalsContact C-N 3.34Å; E137-R139 PolarHBondContact O-N 3.49Å; R139-N141 VanDerWaalsContact C-N 3.3Å; R139-N141 PolarHBondContact O-N 2.93Å; R139-Q142 PolarHBondContact O-N 3.36Å; R139-E143 WeakPolarHBondContact CG-OE1 3.49Å; R139-E143 IonicContact CZ-OE1 2.63Å; R139-E143 IonicContact NE-OE1 3.64Å; R139-E143 IonicContact NH1-OE1 3.25Å; R139-E143 PolarHBondContact NH1-OE1 3.01Å; R139-E143 WeakPolarHBondContact O-CG 3.48Å; R139-E143 PolarHBondContact O-N 3.39Å
140	I	90	Very high	93.6	Very high	53 Å²	53	88.4 Å²	88.4	27%	0.272	42%	0.418	S	S	.	.	H	α-helix	trans	-60	-42.7	176.7	-67.5	166	0	0	0	110.6	E136 E137 E143 N144	E136-I140 HydrophobicContact CG-CD1 3.93Å; E136-I140 HydrophobicContact CG-CG1 4.5Å; E136-I140 WeakPolarHBondContact O-CB 3.32Å; E136-I140 VanDerWaalsContact O-CG1 3.24Å; E136-I140 WeakPolarHBondContact O-CG1 3.41Å; E136-I140 PolarHBondContact O-N 3.16Å; E137-I140 PolarHBondContact O-N 2.97Å; I140-E143 PolarHBondContact O-N 3.19Å; I140-N144 WeakPolarHBondContact O-CB 3.49Å; I140-N144 PolarHBondContact O-N 3.14Å; I140-N144 PolarHBondContact O-ND2 3.36Å
141	N	94	Very high	93.8	Very high	100 Å²	100	86.6 Å²	86.6	54%	0.535	41%	0.413	S	S	.	.	H	α-helix	trans	-63	-43.6	179.1	-170.6	73	0	0	0	112.3	E137 K138 R139 N144 E145	E137-N141 WeakPolarHBondContact O-CB 3.36Å; E137-N141 PolarHBondContact O-N 2.65Å; K138-N141 PolarHBondContact O-N 3.35Å; R139-N141 VanDerWaalsContact C-N 3.3Å; R139-N141 PolarHBondContact O-N 2.93Å; N141-N144 PolarHBondContact O-N 3.13Å; N141-E145 WeakPolarHBondContact O-CB 3.32Å; N141-E145 PolarHBondContact O-N 3.45Å
142	Q	93.9	Very high	93.9	Very high	129 Å²	129	89.3 Å²	89.3	60%	0.603	43%	0.427	S	S	*	.	H	α-helix	trans	-62.6	-42.2	175.4	-73	175.2	-14.7	0	0	112.2	K138 R139 E145 L146	K138-Q142 WeakPolarHBondContact O-CG 3.23Å; K138-Q142 PolarHBondContact O-N 2.94Å; R139-Q142 PolarHBondContact O-N 3.36Å; Q142-E145 PolarHBondContact O-N 3.32Å; Q142-L146 WeakPolarHBondContact O-CB 3.35Å; Q142-L146 PolarHBondContact O-N 3.14Å
143	E	91.7	Very high	94.1	Very high	38 Å²	38	84.8 Å²	84.8	18%	0.178	42%	0.415	C	S	.	.	H	α-helix	trans	-65.1	-41.5	177.5	-70.9	179.3	-148.8	0	0	111.1	R139 I140 L146 H147 F196 V199 R203	R139-E143 WeakPolarHBondContact CG-OE1 3.49Å; R139-E143 IonicContact CZ-OE1 2.63Å; R139-E143 IonicContact NE-OE1 3.64Å; R139-E143 IonicContact NH1-OE1 3.25Å; R139-E143 PolarHBondContact NH1-OE1 3.01Å; R139-E143 WeakPolarHBondContact O-CG 3.48Å; R139-E143 PolarHBondContact O-N 3.39Å; I140-E143 PolarHBondContact O-N 3.19Å; E143-L146 PolarHBondContact O-N 3.24Å; E143-H147 WeakPolarHBondContact O-CB 3.4Å; E143-H147 PolarHBondContact O-N 2.91Å; E143-F196 HydrophobicContact CB-CE1 4.4Å; E143-F196 WeakPolarHBondContact O-CE1 3.44Å; E143-V199 WeakPolarHBondContact OE2-CG1 3.5Å; E143-R203 VanDerWaalsContact CD-NH2 3.28Å; E143-R203 IonicContact OE1-NH2 2.84Å; E143-R203 IonicContact OE2-CZ 3.14Å; E143-R203 IonicContact OE2-NE 3.97Å; E143-R203 IonicContact OE2-NH2 2.82Å; E143-R203 PolarHBondContact OE2-NH2 3.25Å
144	N	92.9	Very high	94.3	Very high	90 Å²	90	82.3 Å²	82.3	48%	0.481	40%	0.402	S	S	.	.	H	α-helix	trans	-66	-40.6	176	-71.2	-14.9	0	0	0	112.6	I140 N141 H147 A148	I140-N144 WeakPolarHBondContact O-CB 3.49Å; I140-N144 PolarHBondContact O-N 3.14Å; I140-N144 PolarHBondContact O-ND2 3.36Å; N141-N144 PolarHBondContact O-N 3.13Å; N144-H147 PolarHBondContact O-N 3.13Å; N144-A148 WeakPolarHBondContact O-CB 3.35Å; N144-A148 PolarHBondContact O-N 3.29Å
145	E	96.7	Very high	94.3	Very high	131 Å²	131	85.1 Å²	85.1	61%	0.612	42%	0.415	S	S	*	.	H	α-helix	trans	-63.6	-44.6	176.1	-174.5	176	-173	0	0	111	N141 Q142 A148 Y149	N141-E145 WeakPolarHBondContact O-CB 3.32Å; N141-E145 PolarHBondContact O-N 3.45Å; Q142-E145 PolarHBondContact O-N 3.32Å; E145-A148 PolarHBondContact O-N 3.11Å; E145-Y149 WeakPolarHBondContact O-CB 3.35Å; E145-Y149 PolarHBondContact O-N 3.32Å
146	L	96	Very high	94.6	Very high	87 Å²	87	82.3 Å²	82.3	46%	0.455	40%	0.404	S	S	.	.	H	α-helix	trans	-62.2	-45.8	175.2	179.9	61.9	0	0	0	111.5	Q142 E143 A148 Y149 L150 F196	Q142-L146 WeakPolarHBondContact O-CB 3.35Å; Q142-L146 PolarHBondContact O-N 3.14Å; E143-L146 PolarHBondContact O-N 3.24Å; L146-A148 PolarHBondContact O-N 2.89Å; L146-Y149 PolarHBondContact O-N 3.47Å; L146-L150 HydrophobicContact CD1-CD1 4.01Å; L146-L150 HydrophobicContact CD1-CD2 4.48Å; L146-L150 HydrophobicContact CD1-CG 4Å; L146-L150 HydrophobicContact CG-CD1 3.95Å; L146-L150 HydrophobicContact CG-CG 4.33Å; L146-L150 WeakPolarHBondContact O-CB 3.35Å; L146-L150 VanDerWaalsContact O-CG 3.31Å; L146-L150 WeakPolarHBondContact O-CG 3.36Å; L146-L150 PolarHBondContact O-N 2.92Å; L146-F196 HydrophobicContact CD2-CZ 4.3Å; L146-F196 HydrophobicContact CG-CZ 4.26Å
147	H	95.4	Very high	94.8	Very high	59 Å²	59	84.3 Å²	84.3	27%	0.273	41%	0.413	S	S	.	.	H	α-helix	trans	-57.4	-49	176.6	177.3	-92.8	0	0	0	111.5	E143 N144 Y149 L150 T151 M192 F196	E143-H147 WeakPolarHBondContact O-CB 3.4Å; E143-H147 PolarHBondContact O-N 2.91Å; N144-H147 PolarHBondContact O-N 3.13Å; H147-Y149 VanDerWaalsContact C-N 3.33Å; H147-Y149 PolarHBondContact O-N 3.5Å; H147-L150 PolarHBondContact O-N 3.23Å; H147-T151 WeakPolarHBondContact O-CB 3.47Å; H147-T151 PolarHBondContact O-N 3.11Å; H147-T151 PolarHBondContact O-OG1 2.87Å; H147-T151 VanDerWaalsContact O-OG1 3.07Å; H147-M192 PolarHBondContact CD2-SD 2.91Å; H147-F196 HydrophobicContact CB-CD1 4.17Å; H147-F196 HydrophobicContact CB-CE1 3.82Å; H147-F196 HydrophobicContact CB-CE2 4.27Å; H147-F196 HydrophobicContact CB-CZ 3.87Å; H147-F196 AromaticContact CD2-CD2 3.7Å; H147-F196 AromaticContact CD2-CG 3.83Å
148	A	96.6	Very high	94.9	Very high	59 Å²	59	79.7 Å²	79.7	49%	0.488	39%	0.391	S	S	.	.	H	α-helix	trans	-62.1	-40.4	178	0	0	0	0	0	112.3	N144 E145 L146 K152	N144-A148 WeakPolarHBondContact O-CB 3.35Å; N144-A148 PolarHBondContact O-N 3.29Å; E145-A148 PolarHBondContact O-N 3.11Å; L146-A148 PolarHBondContact O-N 2.89Å; A148-K152 WeakPolarHBondContact O-CB 3.17Å; A148-K152 PolarHBondContact O-N 3.34Å
149	Y	97.7	Very high	95	Very high	137 Å²	137	79.7 Å²	79.7	54%	0.537	39%	0.393	S	S	.	.	H	α-helix	trans	-63.5	-48.8	177.2	175.8	-106.3	0	0	0	112.3	E145 L146 H147 K152 L153	E145-Y149 WeakPolarHBondContact O-CB 3.35Å; E145-Y149 PolarHBondContact O-N 3.32Å; L146-Y149 PolarHBondContact O-N 3.47Å; H147-Y149 VanDerWaalsContact C-N 3.33Å; H147-Y149 PolarHBondContact O-N 3.5Å; Y149-K152 WeakPolarHBondContact O-CB 3.36Å; Y149-K152 PolarHBondContact O-N 2.8Å; Y149-L153 HydrophobicContact CD1-CD1 4.1Å; Y149-L153 HydrophobicContact CE1-CD1 3.43Å; Y149-L153 VanDerWaalsContact CE1-CD1 3.43Å; Y149-L153 HydrophobicContact CE1-CG 4.17Å; Y149-L153 HydrophobicContact CE2-CD1 4.37Å; Y149-L153 HydrophobicContact CE2-CD2 4.45Å; Y149-L153 HydrophobicContact CE2-CG 4.32Å; Y149-L153 PolarHBondContact O-N 3.4Å
150	L	96.5	Very high	95	Very high	56 Å²	56	81.4 Å²	81.4	29%	0.293	40%	0.4	S	S	.	.	H	α-helix	trans	-63.8	-43.6	179.4	-69.1	176.1	0	0	0	111.6	L146 H147 K152 L153 I154 F196	L146-L150 HydrophobicContact CD1-CD1 4.01Å; L146-L150 HydrophobicContact CD1-CD2 4.48Å; L146-L150 HydrophobicContact CD1-CG 4Å; L146-L150 HydrophobicContact CG-CD1 3.95Å; L146-L150 HydrophobicContact CG-CG 4.33Å; L146-L150 WeakPolarHBondContact O-CB 3.35Å; L146-L150 VanDerWaalsContact O-CG 3.31Å; L146-L150 WeakPolarHBondContact O-CG 3.36Å; L146-L150 PolarHBondContact O-N 2.92Å; H147-L150 PolarHBondContact O-N 3.23Å; L150-K152 VanDerWaalsContact C-N 3.29Å; L150-K152 PolarHBondContact O-N 2.92Å; L150-L153 PolarHBondContact O-N 3.2Å; L150-L153 VanDerWaalsContact O-N 3.12Å; L150-I154 WeakPolarHBondContact O-CG1 3.41Å; L150-I154 PolarHBondContact O-N 3.16Å; L150-F196 HydrophobicContact CD1-CE2 4.29Å; L150-F196 HydrophobicContact CD1-CZ 4.46Å
151	T	96.8	Very high	95.1	Very high	31 Å²	31	81 Å²	81	19%	0.19	40%	0.397	C	S	.	.	H	α-helix	trans	-56.6	-45.1	174.2	-68	0	0	0	0	111.3	H147 L153 I154 L155 L189 M192	H147-T151 WeakPolarHBondContact O-CB 3.47Å; H147-T151 PolarHBondContact O-N 3.11Å; H147-T151 PolarHBondContact O-OG1 2.87Å; H147-T151 VanDerWaalsContact O-OG1 3.07Å; T151-L153 VanDerWaalsContact C-N 3.34Å; T151-L153 PolarHBondContact O-N 3.23Å; T151-I154 PolarHBondContact O-N 3.21Å; T151-L155 HydrophobicContact CG2-CD1 3.96Å; T151-L155 HydrophobicContact CG2-CG 4.46Å; T151-L155 WeakPolarHBondContact O-CB 3.45Å; T151-L155 WeakPolarHBondContact O-CG 3.5Å; T151-L155 PolarHBondContact O-N 2.86Å; T151-L189 HydrophobicContact CG2-CD1 4.25Å; T151-M192 WeakPolarHBondContact OG1-CE 3.32Å
152	K	97.6	Very high	94.8	Very high	156 Å²	156	78.3 Å²	78.3	68%	0.678	38%	0.382	S	S	*	.	H	α-helix	trans	-62.1	-40.6	176.8	-173.8	179.2	179.1	-179.8	0	112.3	A148 Y149 L150 A156	A148-K152 WeakPolarHBondContact O-CB 3.17Å; A148-K152 PolarHBondContact O-N 3.34Å; Y149-K152 WeakPolarHBondContact O-CB 3.36Å; Y149-K152 PolarHBondContact O-N 2.8Å; L150-K152 VanDerWaalsContact C-N 3.29Å; L150-K152 PolarHBondContact O-N 2.92Å; K152-A156 WeakPolarHBondContact O-CB 3.49Å; K152-A156 PolarHBondContact O-N 3.38Å
153	L	97.3	Very high	94.6	Very high	74 Å²	74	78 Å²	78	39%	0.387	38%	0.381	S	S	.	.	H	α-helix	trans	-64.2	-45.5	177	-72.6	-178.3	0	0	0	112.2	Y149 L150 T151 L155 A156 E157	Y149-L153 HydrophobicContact CD1-CD1 4.1Å; Y149-L153 HydrophobicContact CE1-CD1 3.43Å; Y149-L153 VanDerWaalsContact CE1-CD1 3.43Å; Y149-L153 HydrophobicContact CE1-CG 4.17Å; Y149-L153 HydrophobicContact CE2-CD1 4.37Å; Y149-L153 HydrophobicContact CE2-CD2 4.45Å; Y149-L153 HydrophobicContact CE2-CG 4.32Å; Y149-L153 PolarHBondContact O-N 3.4Å; L150-L153 PolarHBondContact O-N 3.2Å; L150-L153 VanDerWaalsContact O-N 3.12Å; T151-L153 VanDerWaalsContact C-N 3.34Å; T151-L153 PolarHBondContact O-N 3.23Å; L153-L155 PolarHBondContact O-N 3.35Å; L153-A156 PolarHBondContact O-N 2.8Å; L153-E157 WeakPolarHBondContact O-CB 3.41Å; L153-E157 PolarHBondContact O-N 3.03Å
154	I	95.3	Very high	94.4	Very high	32 Å²	32	81 Å²	81	16%	0.164	40%	0.395	C	S	.	.	H	α-helix	trans	-62.6	-44.4	179.7	-66.1	168.3	0	0	0	110.3	L150 T151 E157 K158 H185 L189 M192	L150-I154 WeakPolarHBondContact O-CG1 3.41Å; L150-I154 PolarHBondContact O-N 3.16Å; T151-I154 PolarHBondContact O-N 3.21Å; I154-E157 PolarHBondContact O-N 3.08Å; I154-K158 WeakPolarHBondContact O-CB 3.49Å; I154-K158 PolarHBondContact O-N 2.96Å; I154-H185 HydrophobicContact CG2-CB 4.39Å; I154-L189 HydrophobicContact CG2-CD1 4.25Å; I154-M192 HydrophobicContact CD1-CB 4.44Å
155	L	94.9	Very high	93.9	Very high	78 Å²	78	78.2 Å²	78.2	41%	0.408	38%	0.378	S	S	.	.	H	α-helix	trans	-68	-41.1	178.5	-67.3	177	0	0	0	112.1	T151 L153 K158 E159 L189	T151-L155 HydrophobicContact CG2-CD1 3.96Å; T151-L155 HydrophobicContact CG2-CG 4.46Å; T151-L155 WeakPolarHBondContact O-CB 3.45Å; T151-L155 WeakPolarHBondContact O-CG 3.5Å; T151-L155 PolarHBondContact O-N 2.86Å; L153-L155 PolarHBondContact O-N 3.35Å; L155-K158 WeakPolarHBondContact O-CB 3.34Å; L155-K158 PolarHBondContact O-N 3Å; L155-E159 WeakPolarHBondContact O-CG 3.42Å; L155-E159 PolarHBondContact O-N 2.76Å; L155-L189 HydrophobicContact CD2-CD1 4.35Å
156	A	96.1	Very high	93.3	Very high	27 Å²	27	78.2 Å²	78.2	22%	0.223	38%	0.376	C	S	.	.	H	α-helix	trans	-66.8	-36.6	176.9	0	0	0	0	0	112.3	K152 L153 R160	K152-A156 WeakPolarHBondContact O-CB 3.49Å; K152-A156 PolarHBondContact O-N 3.38Å; L153-A156 PolarHBondContact O-N 2.8Å; A156-R160 WeakPolarHBondContact O-CG 3.31Å; A156-R160 PolarHBondContact O-N 3.35Å; A156-R160 PolarHBondContact O-NH1 3.46Å
157	E	95.9	Very high	92.6	Very high	77 Å²	77	80.6 Å²	80.6	36%	0.36	39%	0.385	S	S	.	.	H	α-helix	trans	-67.6	-42.2	173	-171.4	64.3	-166.4	0	0	111.3	L153 I154 E159 R160 E161	L153-E157 WeakPolarHBondContact O-CB 3.41Å; L153-E157 PolarHBondContact O-N 3.03Å; I154-E157 PolarHBondContact O-N 3.08Å; E157-E159 VanDerWaalsContact C-N 3.32Å; E157-E159 PolarHBondContact O-N 2.84Å; E157-R160 PolarHBondContact O-N 3.44Å; E157-R160 IonicContact OE2-CZ 3.24Å; E157-R160 IonicContact OE2-NE 3.95Å; E157-R160 PolarHBondContact OE2-NE 3.49Å; E157-R160 IonicContact OE2-NH2 2.87Å; E157-R160 PolarHBondContact OE2-NH2 2.92Å; E157-E161 PolarHBondContact O-N 3.33Å
158	K	93.4	Very high	91.7	Very high	40 Å²	40	84.2 Å²	84.2	17%	0.174	40%	0.399	C	S	.	.	H	α-helix	trans	-55.4	-48.6	173	-178.2	-177.7	175.9	166.4	0	111	I154 L155 L162 S182 H185 E186	I154-K158 WeakPolarHBondContact O-CB 3.49Å; I154-K158 PolarHBondContact O-N 2.96Å; L155-K158 WeakPolarHBondContact O-CB 3.34Å; L155-K158 PolarHBondContact O-N 3Å; K158-L162 VanDerWaalsContact O-CB 3.24Å; K158-L162 WeakPolarHBondContact O-CB 3.47Å; K158-L162 PolarHBondContact O-N 3.44Å; K158-L162 VanDerWaalsContact O-N 3.08Å; K158-S182 VanDerWaalsContact CE-OG 3.23Å; K158-S182 WeakPolarHBondContact CE-OG 3.47Å; K158-S182 PolarHBondContact NZ-OG 3.32Å; K158-H185 HydrophobicContact CB-CB 3.91Å; K158-H185 HydrophobicContact CD-CB 3.88Å; K158-H185 HydrophobicContact CG-CB 3.92Å; K158-E186 IonicContact NZ-OE1 3.67Å; K158-E186 PolarHBondContact NZ-OE1 3.5Å
159	E	93.6	Very high	90.3	Very high	136 Å²	136	84.9 Å²	84.9	64%	0.636	39%	0.392	S	S	*	.	H	α-helix	trans	-60.9	-45.5	178.7	-76.3	175.3	176.1	0	0	111.8	L155 E157 L162 E163	L155-E159 WeakPolarHBondContact O-CG 3.42Å; L155-E159 PolarHBondContact O-N 2.76Å; E157-E159 VanDerWaalsContact C-N 3.32Å; E157-E159 PolarHBondContact O-N 2.84Å; E159-L162 PolarHBondContact O-N 3.47Å; E159-E163 WeakPolarHBondContact O-CB 3.42Å; E159-E163 PolarHBondContact O-N 3.36Å
160	R	93.4	Very high	88.3	Confident	119 Å²	119	85.8 Å²	85.8	45%	0.449	41%	0.407	S	S	.	.	H	α-helix	trans	-58.8	-52.8	176.2	-77.2	-171.2	-69	-86.8	5.5	112.7	A156 E157 L162 E163 E164	A156-R160 WeakPolarHBondContact O-CG 3.31Å; A156-R160 PolarHBondContact O-N 3.35Å; A156-R160 PolarHBondContact O-NH1 3.46Å; E157-R160 PolarHBondContact O-N 3.44Å; E157-R160 IonicContact OE2-CZ 3.24Å; E157-R160 IonicContact OE2-NE 3.95Å; E157-R160 PolarHBondContact OE2-NE 3.49Å; E157-R160 IonicContact OE2-NH2 2.87Å; E157-R160 PolarHBondContact OE2-NH2 2.92Å; R160-L162 PolarHBondContact O-N 3.05Å; R160-E163 PolarHBondContact O-N 3.16Å; R160-E164 PolarHBondContact O-N 3.27Å
161	E	90.7	Very high	86.5	Confident	46 Å²	46	90 Å²	90	22%	0.215	43%	0.43	C	S	.	.	H	α-helix	trans	-60.4	-35.1	-179.8	-74.7	-166.3	-168.3	0	0	111.3	E157 Y165 I181 K184 H185	E157-E161 PolarHBondContact O-N 3.33Å; E161-Y165 WeakPolarHBondContact O-CB 3.35Å; E161-Y165 PolarHBondContact O-N 2.96Å; E161-Y165 VanDerWaalsContact O-N 3.1Å; E161-I181 HydrophobicContact CB-CG2 3.84Å; E161-K184 IonicContact OE1-NZ 3.98Å; E161-K184 PolarHBondContact OE1-NZ 3.05Å; E161-K184 IonicContact OE2-NZ 2.66Å; E161-K184 PolarHBondContact OE2-NZ 3.09Å; E161-H185 VanDerWaalsContact CD-CE1 3.47Å; E161-H185 IonicContact OE1-CE1 3.82Å; E161-H185 IonicContact OE1-NE2 3.92Å; E161-H185 IonicContact OE2-CE1 3.38Å; E161-H185 PolarHBondContact OE2-CE1 3.31Å; E161-H185 VanDerWaalsContact OE2-CE1 3.24Å
162	L	88.5	Confident	84.6	Confident	42 Å²	42	94.9 Å²	94.9	22%	0.22	46%	0.455	C	S	.	.	H	α-helix	trans	-76.9	-33.2	-178.6	-143.9	154.9	0	0	0	111.9	K158 E159 R160 K166	K158-L162 VanDerWaalsContact O-CB 3.24Å; K158-L162 WeakPolarHBondContact O-CB 3.47Å; K158-L162 PolarHBondContact O-N 3.44Å; K158-L162 VanDerWaalsContact O-N 3.08Å; E159-L162 PolarHBondContact O-N 3.47Å; R160-L162 PolarHBondContact O-N 3.05Å; L162-K166 HydrophobicContact CD2-CD 4.42Å; L162-K166 WeakPolarHBondContact O-CG 3.5Å; L162-K166 PolarHBondContact O-N 3.1Å
163	E	88.9	Confident	82.6	Confident	124 Å²	124	96.8 Å²	96.8	58%	0.579	47%	0.466	S	S	*	.	H	α-helix	trans	-70.2	-47.2	173.6	-166.5	155.5	-142	0	0	111.6	E159 R160 Y165 K166 E167	E159-E163 WeakPolarHBondContact O-CB 3.42Å; E159-E163 PolarHBondContact O-N 3.36Å; R160-E163 PolarHBondContact O-N 3.16Å; E163-Y165 PolarHBondContact O-N 2.99Å; E163-K166 WeakPolarHBondContact O-CB 3.24Å; E163-K166 PolarHBondContact O-N 3.09Å; E163-E167 PolarHBondContact O-N 2.86Å
164	E	87.4	Confident	80.5	Confident	100 Å²	100	99.5 Å²	99.5	47%	0.467	48%	0.481	S	S	.	.	H	α-helix	trans	-57.3	-36	172.3	-73.6	-172.9	-165.8	0	0	112.5	R160 K168	R160-E164 PolarHBondContact O-N 3.27Å; E164-K168 WeakPolarHBondContact O-CD 3.41Å; E164-K168 VanDerWaalsContact O-CG 3.28Å; E164-K168 WeakPolarHBondContact O-CG 3.5Å; E164-K168 PolarHBondContact O-N 3Å; E164-K168 IonicContact OE2-NZ 3.46Å; E164-K168 PolarHBondContact OE2-NZ 3.35Å
165	Y	83.8	Confident	78.6	Confident	32 Å²	32	101.3 Å²	101.3	13%	0.125	51%	0.508	C	S	.	.	H	α-helix	trans	-68.6	-40.5	175.9	178.4	-94	0	0	0	112.2	E161 E163 K168 Q169 N174 D177 A178 I181	E161-Y165 WeakPolarHBondContact O-CB 3.35Å; E161-Y165 PolarHBondContact O-N 2.96Å; E161-Y165 VanDerWaalsContact O-N 3.1Å; E163-Y165 PolarHBondContact O-N 2.99Å; Y165-K168 PolarHBondContact O-N 3.45Å; Y165-Q169 HydrophobicContact CD1-CG 4.42Å; Y165-Q169 HydrophobicContact CE1-CG 3.73Å; Y165-Q169 PolarHBondContact O-N 3.33Å; Y165-Q169 PolarHBondContact OH-NE2 3.19Å; Y165-N174 PolarHBondContact OH-O 2.9Å; Y165-D177 HydrophobicContact CD2-CB 4.18Å; Y165-D177 HydrophobicContact CE2-CB 3.29Å; Y165-D177 PolarHBondContact OH-N 3.48Å; Y165-A178 HydrophobicContact CD1-CB 3.87Å; Y165-A178 HydrophobicContact CE1-CB 3.61Å; Y165-I181 HydrophobicContact CD2-CD1 4.13Å; Y165-I181 HydrophobicContact CG-CD1 4.12Å
166	K	83.5	Confident	77	Confident	130 Å²	130	99.9 Å²	99.9	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-62.1	-45	175.8	-76.2	170.4	-179.5	173.5	0	111.4	L162 E163 K168 Q169 D170	L162-K166 HydrophobicContact CD2-CD 4.42Å; L162-K166 WeakPolarHBondContact O-CG 3.5Å; L162-K166 PolarHBondContact O-N 3.1Å; E163-K166 WeakPolarHBondContact O-CB 3.24Å; E163-K166 PolarHBondContact O-N 3.09Å; K166-K168 VanDerWaalsContact C-N 3.25Å; K166-K168 PolarHBondContact O-N 2.9Å; K166-Q169 PolarHBondContact O-N 2.92Å; K166-D170 PolarHBondContact O-N 3.26Å
167	E	82.1	Confident	75.8	Confident	138 Å²	138	102.3 Å²	102.3	65%	0.645	52%	0.521	S	S	*	.	H	α-helix	trans	-58.7	-38.1	176.6	-69.5	-179	167.2	0	0	111.9	E163	E163-E167 PolarHBondContact O-N 2.86Å
168	K	76.4	Confident	74.9	Confident	134 Å²	134	100 Å²	100	58%	0.583	51%	0.514	S	S	*	.	H	α-helix	trans	-75.8	-22.1	176.6	-68.6	164.8	-171.2	155.6	0	113.6	E164 Y165 K166	E164-K168 WeakPolarHBondContact O-CD 3.41Å; E164-K168 VanDerWaalsContact O-CG 3.28Å; E164-K168 WeakPolarHBondContact O-CG 3.5Å; E164-K168 PolarHBondContact O-N 3Å; E164-K168 IonicContact OE2-NZ 3.46Å; E164-K168 PolarHBondContact OE2-NZ 3.35Å; Y165-K168 PolarHBondContact O-N 3.45Å; K166-K168 VanDerWaalsContact C-N 3.25Å; K166-K168 PolarHBondContact O-N 2.9Å
169	Q	66.1	Low	74.4	Confident	73 Å²	73	100.4 Å²	100.4	34%	0.341	53%	0.53	S	S	.	.	H	α-helix	trans	-79.6	-24.7	-178	-111.9	-161.9	-5.9	0	0	113.9	Y165 K166 D171 N172 N174	Y165-Q169 HydrophobicContact CD1-CG 4.42Å; Y165-Q169 HydrophobicContact CE1-CG 3.73Å; Y165-Q169 PolarHBondContact O-N 3.33Å; Y165-Q169 PolarHBondContact OH-NE2 3.19Å; K166-Q169 PolarHBondContact O-N 2.92Å; Q169-D171 PolarHBondContact O-N 3.17Å; Q169-D171 VanDerWaalsContact O-N 3.14Å; Q169-N172 PolarHBondContact O-N 3.11Å; Q169-N174 PolarHBondContact NE2-O 3.4Å
170	D	57.2	Low	74.1	Confident	156 Å²	156	100.3 Å²	100.3	83%	0.834	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.7	172.7	-91.3	-22.7	0	0	0	112.3	K166	K166-D170 PolarHBondContact O-N 3.26Å
171	D	57.9	Low	73.7	Confident	145 Å²	145	96 Å²	96	78%	0.775	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-13.9	178.2	-78.4	-33.3	0	0	0	115.2	Q169	Q169-D171 PolarHBondContact O-N 3.17Å; Q169-D171 VanDerWaalsContact O-N 3.14Å
172	N	55.9	Low	73.6	Confident	134 Å²	134	95 Å²	95	72%	0.717	51%	0.511	S	S	*	.	S	Bend	trans	-162.1	128.5	179.3	-131.6	-16.7	0	0	0	114.4	Q169 N174	Q169-N172 PolarHBondContact O-N 3.11Å; N172-N174 PolarHBondContact O-N 2.86Å
173	Q	55.6	Low	73.8	Confident	195 Å²	195	96.3 Å²	96.3	91%	0.911	52%	0.524	S	S	*	.			trans	-68.6	100.5	179	-77.3	-179.4	-6.5	0	0	112
174	N	53.7	Low	74.1	Confident	131 Å²	131	94.2 Å²	94.2	70%	0.701	51%	0.513	S	S	*	.			trans	-150.8	106.3	160	-137.5	0.3	0	0	0	111	Y165 Q169 N172 G176	Y165-N174 PolarHBondContact OH-O 2.9Å; Q169-N174 PolarHBondContact NE2-O 3.4Å; N172-N174 PolarHBondContact O-N 2.86Å; N174-G176 PolarHBondContact O-N 3.04Å
175	G	55.1	Low	74.4	Confident	71 Å²	71	89.8 Å²	89.8	73%	0.732	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	4.6	-169.5	0	0	0	0	0	117
176	G	61.5	Low	74.9	Confident	47 Å²	47	92.8 Å²	92.8	49%	0.485	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-14.3	-165.1	0	0	0	0	0	117.6	N174	N174-G176 PolarHBondContact O-N 3.04Å
177	D	72.1	Confident	75.5	Confident	79 Å²	79	92.4 Å²	92.4	42%	0.422	51%	0.506	S	S	.	.	H	α-helix	trans	-92.8	-29	-169.4	-102.4	-2.2	0	0	0	114.3	Y165 G179 K180 I181	Y165-D177 HydrophobicContact CD2-CB 4.18Å; Y165-D177 HydrophobicContact CE2-CB 3.29Å; Y165-D177 PolarHBondContact OH-N 3.48Å; D177-G179 VanDerWaalsContact C-N 3.27Å; D177-G179 PolarHBondContact O-N 2.76Å; D177-K180 WeakPolarHBondContact O-CB 3.3Å; D177-K180 PolarHBondContact O-N 3.28Å; D177-K180 WeakPolarHBondContact OD1-CD 3.48Å; D177-K180 IonicContact OD1-NZ 3.39Å; D177-K180 PolarHBondContact OD1-NZ 2.85Å; D177-I181 PolarHBondContact O-N 2.91Å; D177-I181 VanDerWaalsContact O-N 3.08Å
178	A	77	Confident	76.1	Confident	27 Å²	27	91 Å²	91	22%	0.223	50%	0.496	C	S	.	.	H	α-helix	trans	-58.2	-38.3	175.3	0	0	0	0	0	112.9	Y165 K180 I181 S182	Y165-A178 HydrophobicContact CD1-CB 3.87Å; Y165-A178 HydrophobicContact CE1-CB 3.61Å; A178-K180 VanDerWaalsContact C-N 3.32Å; A178-K180 PolarHBondContact O-N 3.4Å; A178-I181 PolarHBondContact O-N 3.19Å; A178-S182 PolarHBondContact O-N 2.98Å
179	G	82.1	Confident	77	Confident	49 Å²	49	86.4 Å²	86.4	51%	0.505	48%	0.477	S	S	.	.	H	α-helix	trans	-64.3	-35.2	176.2	0	0	0	0	0	112.9	D177 S183	D177-G179 VanDerWaalsContact C-N 3.27Å; D177-G179 PolarHBondContact O-N 2.76Å; G179-S183 VanDerWaalsContact O-CB 3.31Å; G179-S183 WeakPolarHBondContact O-CB 3.48Å; G179-S183 PolarHBondContact O-N 2.7Å
180	K	86.5	Confident	78.4	Confident	134 Å²	134	89.1 Å²	89.1	58%	0.583	49%	0.491	S	S	*	.	H	α-helix	trans	-70.8	-40.6	176.4	-60.7	-178.4	-161.4	150.5	0	111.6	D177 A178 S182 S183 K184	D177-K180 WeakPolarHBondContact O-CB 3.3Å; D177-K180 PolarHBondContact O-N 3.28Å; D177-K180 WeakPolarHBondContact OD1-CD 3.48Å; D177-K180 IonicContact OD1-NZ 3.39Å; D177-K180 PolarHBondContact OD1-NZ 2.85Å; A178-K180 VanDerWaalsContact C-N 3.32Å; A178-K180 PolarHBondContact O-N 3.4Å; K180-S182 VanDerWaalsContact C-N 3.35Å; K180-S183 PolarHBondContact O-N 3.23Å; K180-K184 WeakPolarHBondContact O-CB 3.04Å; K180-K184 PolarHBondContact O-N 2.97Å
181	I	86.6	Confident	80.2	Confident	28 Å²	28	86.2 Å²	86.2	14%	0.144	47%	0.473	C	S	.	.	H	α-helix	trans	-61.1	-45.3	174.9	-64.7	169	0	0	0	110	E161 Y165 D177 A178 K184 H185	E161-I181 HydrophobicContact CB-CG2 3.84Å; Y165-I181 HydrophobicContact CD2-CD1 4.13Å; Y165-I181 HydrophobicContact CG-CD1 4.12Å; D177-I181 PolarHBondContact O-N 2.91Å; D177-I181 VanDerWaalsContact O-N 3.08Å; A178-I181 PolarHBondContact O-N 3.19Å; I181-K184 PolarHBondContact O-N 3.44Å; I181-H185 PolarHBondContact O-N 3.1Å; I181-H185 PolarHBondContact O-ND1 3.43Å
182	S	88.8	Confident	82	Confident	25 Å²	25	80.1 Å²	80.1	18%	0.175	44%	0.44	C	S	.	.	H	α-helix	trans	-61.8	-47.3	176.6	-162.5	0	0	0	0	111.7	K158 A178 K180 K184 H185 E186	K158-S182 VanDerWaalsContact CE-OG 3.23Å; K158-S182 WeakPolarHBondContact CE-OG 3.47Å; K158-S182 PolarHBondContact NZ-OG 3.32Å; A178-S182 PolarHBondContact O-N 2.98Å; K180-S182 VanDerWaalsContact C-N 3.35Å; S182-K184 VanDerWaalsContact C-N 3.35Å; S182-K184 PolarHBondContact O-N 2.86Å; S182-H185 PolarHBondContact O-N 2.81Å; S182-E186 WeakPolarHBondContact O-CB 3.49Å; S182-E186 WeakPolarHBondContact O-CG 3.4Å; S182-E186 PolarHBondContact O-N 3Å; S182-E186 PolarHBondContact OG-OE1 3.26Å
183	S	92.6	Very high	83.9	Confident	70 Å²	70	78.4 Å²	78.4	49%	0.49	43%	0.427	S	S	.	.	H	α-helix	trans	-63.5	-37.4	-179.5	-176.8	0	0	0	0	112.8	G179 K180 K187	G179-S183 VanDerWaalsContact O-CB 3.31Å; G179-S183 WeakPolarHBondContact O-CB 3.48Å; G179-S183 PolarHBondContact O-N 2.7Å; K180-S183 PolarHBondContact O-N 3.23Å; S183-K187 WeakPolarHBondContact O-CB 3.47Å; S183-K187 PolarHBondContact O-N 2.97Å
184	K	93.9	Very high	85.7	Confident	81 Å²	81	74.1 Å²	74.1	35%	0.352	41%	0.407	S	S	.	.	H	α-helix	trans	-58.5	-49.6	174	174.1	-170.7	162.2	-157	0	111.5	E161 K180 I181 S182 K187 Y188	E161-K184 IonicContact OE1-NZ 3.98Å; E161-K184 PolarHBondContact OE1-NZ 3.05Å; E161-K184 IonicContact OE2-NZ 2.66Å; E161-K184 PolarHBondContact OE2-NZ 3.09Å; K180-K184 WeakPolarHBondContact O-CB 3.04Å; K180-K184 PolarHBondContact O-N 2.97Å; I181-K184 PolarHBondContact O-N 3.44Å; S182-K184 VanDerWaalsContact C-N 3.35Å; S182-K184 PolarHBondContact O-N 2.86Å; K184-K187 WeakPolarHBondContact O-CB 3.36Å; K184-K187 PolarHBondContact O-N 2.69Å; K184-Y188 HydrophobicContact CD-CE2 4.28Å; K184-Y188 HydrophobicContact CG-CD2 4.37Å; K184-Y188 HydrophobicContact CG-CE2 3.77Å; K184-Y188 PolarHBondContact O-N 3.26Å
185	H	93.6	Very high	87.6	Confident	6 Å²	6	73 Å²	73	3%	0.028	40%	0.401	C	S	.	.	H	α-helix	trans	-73	-35.1	-178.7	-69.6	87.9	0	0	0	112.9	I154 K158 E161 I181 S182 K187 Y188 L189	I154-H185 HydrophobicContact CG2-CB 4.39Å; K158-H185 HydrophobicContact CB-CB 3.91Å; K158-H185 HydrophobicContact CD-CB 3.88Å; K158-H185 HydrophobicContact CG-CB 3.92Å; E161-H185 VanDerWaalsContact CD-CE1 3.47Å; E161-H185 IonicContact OE1-CE1 3.82Å; E161-H185 IonicContact OE1-NE2 3.92Å; E161-H185 IonicContact OE2-CE1 3.38Å; E161-H185 PolarHBondContact OE2-CE1 3.31Å; E161-H185 VanDerWaalsContact OE2-CE1 3.24Å; I181-H185 PolarHBondContact O-N 3.1Å; I181-H185 PolarHBondContact O-ND1 3.43Å; S182-H185 PolarHBondContact O-N 2.81Å; H185-K187 VanDerWaalsContact C-N 3.28Å; H185-K187 PolarHBondContact O-N 2.88Å; H185-Y188 PolarHBondContact O-N 2.95Å; H185-L189 WeakPolarHBondContact O-CB 3.39Å; H185-L189 PolarHBondContact O-N 2.98Å
186	E	94.3	Very high	89.4	Confident	96 Å²	96	71.6 Å²	71.6	45%	0.449	38%	0.375	S	S	.	.	H	α-helix	trans	-60	-41.5	170.7	-77.7	159.8	-149.5	0	0	110.9	K158 S182 L189 M190	K158-E186 IonicContact NZ-OE1 3.67Å; K158-E186 PolarHBondContact NZ-OE1 3.5Å; S182-E186 WeakPolarHBondContact O-CB 3.49Å; S182-E186 WeakPolarHBondContact O-CG 3.4Å; S182-E186 PolarHBondContact O-N 3Å; S182-E186 PolarHBondContact OG-OE1 3.26Å; E186-L189 PolarHBondContact O-N 3.11Å; E186-M190 WeakPolarHBondContact O-CG 3.3Å; E186-M190 PolarHBondContact O-N 3.27Å
187	K	96.1	Very high	90.7	Very high	122 Å²	122	72 Å²	72	53%	0.53	37%	0.37	S	S	.	.	H	α-helix	trans	-62.3	-44.2	174.3	-177.2	175.9	170.9	178.1	0	112.3	S183 K184 H185 L189 M190 E191	S183-K187 WeakPolarHBondContact O-CB 3.47Å; S183-K187 PolarHBondContact O-N 2.97Å; K184-K187 WeakPolarHBondContact O-CB 3.36Å; K184-K187 PolarHBondContact O-N 2.69Å; H185-K187 VanDerWaalsContact C-N 3.28Å; H185-K187 PolarHBondContact O-N 2.88Å; K187-L189 VanDerWaalsContact C-N 3.31Å; K187-L189 PolarHBondContact O-N 2.98Å; K187-M190 PolarHBondContact O-N 2.94Å; K187-E191 WeakPolarHBondContact CE-OE1 3.4Å; K187-E191 HydrophobicContact CG-CG 4.48Å; K187-E191 IonicContact NZ-OE1 3.78Å; K187-E191 WeakPolarHBondContact O-CB 3.34Å; K187-E191 WeakPolarHBondContact O-CG 3.39Å; K187-E191 PolarHBondContact O-N 3.21Å
188	Y	95	Very high	91.6	Very high	109 Å²	109	72.7 Å²	72.7	43%	0.427	37%	0.37	S	S	.	.	H	α-helix	trans	-62.8	-38.6	175.3	-66.6	-31.2	0	0	0	112.8	K184 H185 E191 M192	K184-Y188 HydrophobicContact CD-CE2 4.28Å; K184-Y188 HydrophobicContact CG-CD2 4.37Å; K184-Y188 HydrophobicContact CG-CE2 3.77Å; K184-Y188 PolarHBondContact O-N 3.26Å; H185-Y188 PolarHBondContact O-N 2.95Å; Y188-E191 PolarHBondContact O-N 2.93Å; Y188-M192 VanDerWaalsContact O-CB 3.28Å; Y188-M192 WeakPolarHBondContact O-CB 3.23Å; Y188-M192 PolarHBondContact O-N 2.92Å
189	L	95.6	Very high	92	Very high	37 Å²	37	73.8 Å²	73.8	19%	0.194	37%	0.374	C	S	.	.	H	α-helix	trans	-63.9	-45.9	176	-158.4	112.6	0	0	0	110.7	T151 I154 L155 H185 E186 K187 M192 E193	T151-L189 HydrophobicContact CG2-CD1 4.25Å; I154-L189 HydrophobicContact CG2-CD1 4.25Å; L155-L189 HydrophobicContact CD2-CD1 4.35Å; H185-L189 WeakPolarHBondContact O-CB 3.39Å; H185-L189 PolarHBondContact O-N 2.98Å; E186-L189 PolarHBondContact O-N 3.11Å; K187-L189 VanDerWaalsContact C-N 3.31Å; K187-L189 PolarHBondContact O-N 2.98Å; L189-M192 PolarHBondContact O-N 3.49Å; L189-E193 WeakPolarHBondContact CD2-OE1 3.4Å; L189-E193 WeakPolarHBondContact O-CG 3.33Å; L189-E193 PolarHBondContact O-N 3.47Å
190	M	95.7	Very high	92	Very high	129 Å²	129	75.3 Å²	75.3	64%	0.635	37%	0.371	S	S	*	.	H	α-helix	trans	-61.8	-44.5	176.1	-72.2	179.8	68.3	0	0	112.7	E186 K187 M192 E193 E194	E186-M190 WeakPolarHBondContact O-CG 3.3Å; E186-M190 PolarHBondContact O-N 3.27Å; K187-M190 PolarHBondContact O-N 2.94Å; M190-M192 VanDerWaalsContact C-N 3.29Å; M190-M192 PolarHBondContact O-N 3.45Å; M190-E193 PolarHBondContact O-N 3.48Å; M190-E194 WeakPolarHBondContact O-CB 3.34Å; M190-E194 PolarHBondContact O-N 3.15Å
191	E	95.7	Very high	91.7	Very high	96 Å²	96	73.8 Å²	73.8	45%	0.449	37%	0.366	S	S	.	.	H	α-helix	trans	-62.7	-37.9	176.7	-74.6	175.4	-178	0	0	111.5	K187 Y188 L195	K187-E191 WeakPolarHBondContact CE-OE1 3.4Å; K187-E191 HydrophobicContact CG-CG 4.48Å; K187-E191 IonicContact NZ-OE1 3.78Å; K187-E191 WeakPolarHBondContact O-CB 3.34Å; K187-E191 WeakPolarHBondContact O-CG 3.39Å; K187-E191 PolarHBondContact O-N 3.21Å; Y188-E191 PolarHBondContact O-N 2.93Å; E191-L195 WeakPolarHBondContact O-CG 3.5Å; E191-L195 PolarHBondContact O-N 3.49Å; E191-L195 VanDerWaalsContact O-N 3.15Å
192	M	95.1	Very high	91.3	Very high	17 Å²	17	80.2 Å²	80.2	8%	0.084	39%	0.393	C	S	.	.	H	α-helix	trans	-68.6	-46.7	175.9	-175.1	-79	-58.7	0	0	111.5	H147 T151 I154 Y188 L189 M190 E194 L195 F196	H147-M192 PolarHBondContact CD2-SD 2.91Å; T151-M192 WeakPolarHBondContact OG1-CE 3.32Å; I154-M192 HydrophobicContact CD1-CB 4.44Å; Y188-M192 VanDerWaalsContact O-CB 3.28Å; Y188-M192 WeakPolarHBondContact O-CB 3.23Å; Y188-M192 PolarHBondContact O-N 2.92Å; L189-M192 PolarHBondContact O-N 3.49Å; M190-M192 VanDerWaalsContact C-N 3.29Å; M190-M192 PolarHBondContact O-N 3.45Å; M192-E194 VanDerWaalsContact C-N 3.29Å; M192-E194 PolarHBondContact O-N 3.01Å; M192-L195 WeakPolarHBondContact O-CB 3.02Å; M192-L195 PolarHBondContact O-N 2.99Å; M192-L195 VanDerWaalsContact O-N 3.13Å; M192-F196 HydrophobicContact CG-CD2 4.34Å; M192-F196 HydrophobicContact CG-CE2 4.2Å; M192-F196 WeakPolarHBondContact O-CD2 3.41Å; M192-F196 PolarHBondContact O-N 2.94Å; M192-F196 HydrophobicContact SD-CD2 3.52Å; M192-F196 VanDerWaalsContact SD-CD2 3.52Å; M192-F196 HydrophobicContact SD-CE2 3.58Å; M192-F196 VanDerWaalsContact SD-CE2 3.58Å
193	E	94.6	Very high	90.6	Very high	97 Å²	97	82.3 Å²	82.3	45%	0.453	40%	0.397	S	S	.	.	H	α-helix	trans	-58.3	-41.5	175.1	-75.2	-180	173.6	0	0	111.9	L189 M190 L195 F196 S197	L189-E193 WeakPolarHBondContact CD2-OE1 3.4Å; L189-E193 WeakPolarHBondContact O-CG 3.33Å; L189-E193 PolarHBondContact O-N 3.47Å; M190-E193 PolarHBondContact O-N 3.48Å; E193-L195 VanDerWaalsContact C-N 3.35Å; E193-L195 PolarHBondContact O-N 3.19Å; E193-F196 PolarHBondContact O-N 3.47Å; E193-S197 WeakPolarHBondContact O-CB 3.47Å; E193-S197 PolarHBondContact O-N 3.36Å
194	E	94.8	Very high	89.7	Confident	106 Å²	106	84.9 Å²	84.9	50%	0.495	40%	0.399	S	S	.	.	H	α-helix	trans	-60.6	-41.4	175.4	177.1	58.6	-148	0	0	111.9	M190 M192 F196 S197 Q198	M190-E194 WeakPolarHBondContact O-CB 3.34Å; M190-E194 PolarHBondContact O-N 3.15Å; M192-E194 VanDerWaalsContact C-N 3.29Å; M192-E194 PolarHBondContact O-N 3.01Å; E194-F196 PolarHBondContact O-N 3.34Å; E194-S197 PolarHBondContact O-N 3.22Å; E194-Q198 WeakPolarHBondContact O-CG 3.46Å; E194-Q198 PolarHBondContact O-N 3.09Å; E194-Q198 PolarHBondContact OE1-NE2 3.26Å
195	L	92.6	Very high	88.4	Confident	108 Å²	108	91 Å²	91	57%	0.565	43%	0.426	S	S	*	.	H	α-helix	trans	-61	-44.3	176.2	-73.2	170.5	0	0	0	112.2	E191 M192 E193 Q198 V199	E191-L195 WeakPolarHBondContact O-CG 3.5Å; E191-L195 PolarHBondContact O-N 3.49Å; E191-L195 VanDerWaalsContact O-N 3.15Å; M192-L195 WeakPolarHBondContact O-CB 3.02Å; M192-L195 PolarHBondContact O-N 2.99Å; M192-L195 VanDerWaalsContact O-N 3.13Å; E193-L195 VanDerWaalsContact C-N 3.35Å; E193-L195 PolarHBondContact O-N 3.19Å; L195-Q198 PolarHBondContact O-N 3.14Å; L195-V199 PolarHBondContact O-N 3.02Å
196	F	92.4	Very high	87.7	Confident	41 Å²	41	101.1 Å²	101.1	18%	0.18	46%	0.464	C	S	.	.	H	α-helix	trans	-70.3	-34.9	177.3	-79.6	-91.3	0	0	0	111.9	E143 L146 H147 L150 M192 E193 E194 Q198 V199 D200	E143-F196 HydrophobicContact CB-CE1 4.4Å; E143-F196 WeakPolarHBondContact O-CE1 3.44Å; L146-F196 HydrophobicContact CD2-CZ 4.3Å; L146-F196 HydrophobicContact CG-CZ 4.26Å; H147-F196 HydrophobicContact CB-CD1 4.17Å; H147-F196 HydrophobicContact CB-CE1 3.82Å; H147-F196 HydrophobicContact CB-CE2 4.27Å; H147-F196 HydrophobicContact CB-CZ 3.87Å; H147-F196 AromaticContact CD2-CD2 3.7Å; H147-F196 AromaticContact CD2-CG 3.83Å; L150-F196 HydrophobicContact CD1-CE2 4.29Å; L150-F196 HydrophobicContact CD1-CZ 4.46Å; M192-F196 HydrophobicContact CG-CD2 4.34Å; M192-F196 HydrophobicContact CG-CE2 4.2Å; M192-F196 WeakPolarHBondContact O-CD2 3.41Å; M192-F196 PolarHBondContact O-N 2.94Å; M192-F196 HydrophobicContact SD-CD2 3.52Å; M192-F196 VanDerWaalsContact SD-CD2 3.52Å; M192-F196 HydrophobicContact SD-CE2 3.58Å; M192-F196 VanDerWaalsContact SD-CE2 3.58Å; E193-F196 PolarHBondContact O-N 3.47Å; E194-F196 PolarHBondContact O-N 3.34Å; F196-Q198 PolarHBondContact O-N 3.34Å; F196-V199 WeakPolarHBondContact O-CB 3.38Å; F196-V199 PolarHBondContact O-N 3.29Å; F196-D200 PolarHBondContact O-N 3.03Å; F196-D200 VanDerWaalsContact O-N 3.08Å
197	S	90.3	Very high	87	Confident	55 Å²	55	105.3 Å²	105.3	39%	0.385	48%	0.483	S	S	.	.	H	α-helix	trans	-61.2	-42.1	174	-168.6	0	0	0	0	112.4	E193 E194 V199 D200 E201	E193-S197 WeakPolarHBondContact O-CB 3.47Å; E193-S197 PolarHBondContact O-N 3.36Å; E194-S197 PolarHBondContact O-N 3.22Å; S197-V199 VanDerWaalsContact C-N 3.26Å; S197-V199 PolarHBondContact O-N 3.49Å; S197-D200 WeakPolarHBondContact O-CB 3.1Å; S197-D200 PolarHBondContact O-N 3.41Å; S197-D200 VanDerWaalsContact O-N 3.13Å; S197-E201 PolarHBondContact O-N 3.34Å
198	Q	89.3	Confident	86.3	Confident	93 Å²	93	103.6 Å²	103.6	44%	0.435	48%	0.479	S	S	.	.	H	α-helix	trans	-62.6	-32.1	175.6	-71.1	172.9	20.9	0	0	113	E194 L195 F196 K202	E194-Q198 WeakPolarHBondContact O-CG 3.46Å; E194-Q198 PolarHBondContact O-N 3.09Å; E194-Q198 PolarHBondContact OE1-NE2 3.26Å; L195-Q198 PolarHBondContact O-N 3.14Å; F196-Q198 PolarHBondContact O-N 3.34Å; Q198-K202 PolarHBondContact O-N 3.33Å
199	V	85.6	Confident	86	Confident	50 Å²	50	100.9 Å²	100.9	30%	0.303	48%	0.475	S	S	.	.	H	α-helix	trans	-70.2	-41.1	174.3	176.8	0	0	0	0	110.6	E143 L195 F196 S197 K202 R203	E143-V199 WeakPolarHBondContact OE2-CG1 3.5Å; L195-V199 PolarHBondContact O-N 3.02Å; F196-V199 WeakPolarHBondContact O-CB 3.38Å; F196-V199 PolarHBondContact O-N 3.29Å; S197-V199 VanDerWaalsContact C-N 3.26Å; S197-V199 PolarHBondContact O-N 3.49Å; V199-K202 WeakPolarHBondContact O-CB 3.34Å; V199-K202 PolarHBondContact O-N 2.85Å; V199-R203 PolarHBondContact O-N 3.01Å
200	D	82.4	Confident	85.6	Confident	81 Å²	81	105.4 Å²	105.4	43%	0.433	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-39.2	176.1	-81.9	-23.3	0	0	0	113	F196 S197 K202 R203	F196-D200 PolarHBondContact O-N 3.03Å; F196-D200 VanDerWaalsContact O-N 3.08Å; S197-D200 WeakPolarHBondContact O-CB 3.1Å; S197-D200 PolarHBondContact O-N 3.41Å; S197-D200 VanDerWaalsContact O-N 3.13Å; D200-K202 VanDerWaalsContact C-N 3.28Å; D200-K202 PolarHBondContact O-N 3.03Å; D200-R203 VanDerWaalsContact O-CB 3.32Å; D200-R203 WeakPolarHBondContact O-CB 3.39Å; D200-R203 PolarHBondContact O-N 3.5Å; D200-R203 IonicContact OD1-CZ 2.7Å; D200-R203 VanDerWaalsContact OD1-CZ 3.26Å; D200-R203 IonicContact OD1-NE 3.51Å; D200-R203 IonicContact OD1-NH1 3.71Å; D200-R203 PolarHBondContact OD1-NH1 3.23Å
201	E	81.1	Confident	85.1	Confident	103 Å²	103	106.9 Å²	106.9	48%	0.481	50%	0.499	S	S	.	.	H	α-helix	trans	-59.3	-39.4	173.4	-74.7	-62.1	138.2	0	0	111.9	S197 R203 K204	S197-E201 PolarHBondContact O-N 3.34Å; E201-R203 PolarHBondContact O-N 3.14Å; E201-K204 WeakPolarHBondContact O-CB 3.46Å; E201-K204 PolarHBondContact O-N 2.94Å; E201-K204 VanDerWaalsContact OE1-CE 3.23Å; E201-K204 WeakPolarHBondContact OE1-CE 3.32Å; E201-K204 IonicContact OE1-NZ 3.88Å; E201-K204 PolarHBondContact OE1-NZ 3.38Å; E201-K204 WeakPolarHBondContact OE2-CD 3.42Å; E201-K204 WeakPolarHBondContact OE2-CE 3.45Å; E201-K204 IonicContact OE2-NZ 3.1Å; E201-K204 PolarHBondContact OE2-NZ 3.25Å
202	K	77.2	Confident	84.7	Confident	162 Å²	162	103.7 Å²	103.7	70%	0.704	49%	0.485	S	S	*	.	H	α-helix	trans	-68.8	-15.7	174.9	-71.7	177.5	-179.4	173.1	0	113.9	Q198 V199 D200	Q198-K202 PolarHBondContact O-N 3.33Å; V199-K202 WeakPolarHBondContact O-CB 3.34Å; V199-K202 PolarHBondContact O-N 2.85Å; D200-K202 VanDerWaalsContact C-N 3.28Å; D200-K202 PolarHBondContact O-N 3.03Å
203	R	73.8	Confident	84.4	Confident	69 Å²	69	103.7 Å²	103.7	26%	0.26	49%	0.486	S	S	.	.	H	α-helix	trans	-82.5	-15.4	174.7	-64.8	176.6	-175.9	173.5	-11.1	113	E143 V199 D200 E201	E143-R203 VanDerWaalsContact CD-NH2 3.28Å; E143-R203 IonicContact OE1-NH2 2.84Å; E143-R203 IonicContact OE2-CZ 3.14Å; E143-R203 IonicContact OE2-NE 3.97Å; E143-R203 IonicContact OE2-NH2 2.82Å; E143-R203 PolarHBondContact OE2-NH2 3.25Å; V199-R203 PolarHBondContact O-N 3.01Å; D200-R203 VanDerWaalsContact O-CB 3.32Å; D200-R203 WeakPolarHBondContact O-CB 3.39Å; D200-R203 PolarHBondContact O-N 3.5Å; D200-R203 IonicContact OD1-CZ 2.7Å; D200-R203 VanDerWaalsContact OD1-CZ 3.26Å; D200-R203 IonicContact OD1-NE 3.51Å; D200-R203 IonicContact OD1-NH1 3.71Å; D200-R203 PolarHBondContact OD1-NH1 3.23Å; E201-R203 PolarHBondContact O-N 3.14Å
204	K	74.9	Confident	84	Confident	124 Å²	124	99.1 Å²	99.1	54%	0.539	47%	0.465	S	S	.	.	S	Bend	trans	-55.9	149.1	177.3	-71.5	-178	-179.8	168.2	0	110.6	E201 R206	E201-K204 WeakPolarHBondContact O-CB 3.46Å; E201-K204 PolarHBondContact O-N 2.94Å; E201-K204 VanDerWaalsContact OE1-CE 3.23Å; E201-K204 WeakPolarHBondContact OE1-CE 3.32Å; E201-K204 IonicContact OE1-NZ 3.88Å; E201-K204 PolarHBondContact OE1-NZ 3.38Å; E201-K204 WeakPolarHBondContact OE2-CD 3.42Å; E201-K204 WeakPolarHBondContact OE2-CE 3.45Å; E201-K204 IonicContact OE2-NZ 3.1Å; E201-K204 PolarHBondContact OE2-NZ 3.25Å; K204-R206 PolarHBondContact O-N 2.6Å; K204-R206 VanDerWaalsContact O-N 3.08Å
205	K	66.2	Low	83.7	Confident	209 Å²	209	99.1 Å²	99.1	91%	0.909	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-47.8	120.7	-178.4	-77	-177	179.1	177.8	0	109.5
206	R	78.6	Confident	83.4	Confident	220 Å²	220	96.9 Å²	96.9	83%	0.83	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-73.9	138.6	177.6	-62.3	-178	-178.1	-168.7	0.9	109.4	K204	K204-R206 PolarHBondContact O-N 2.6Å; K204-R206 VanDerWaalsContact O-N 3.08Å
207	E	79	Confident	83	Confident	183 Å²	183	96.7 Å²	96.7	86%	0.855	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-77	133.1	164.6	-64.7	-171	167.1	0	0	108.7	P209	E207-P209 WeakPolarHBondContact O-CD 3.4Å
208	I	82.9	Confident	82.8	Confident	86 Å²	86	101.9 Å²	101.9	44%	0.441	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-83	124	177.8	-57.4	176.4	0	0	0	106.8	D210 L212 L220	I208-D210 PolarHBondContact O-N 3.07Å; I208-L212 HydrophobicContact CG2-CB 4.23Å; I208-L220 HydrophobicContact CD1-CB 4.22Å; I208-L220 HydrophobicContact CG2-CB 4.49Å; I208-L220 HydrophobicContact CG2-CD1 3.79Å
209	P	87.7	Confident	82.6	Confident	52 Å²	52	103.1 Å²	103.1	34%	0.338	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-57.3	135.6	178.5	-24.8	31.9	0	0	0	113.2	E207 Y211 L212	E207-P209 WeakPolarHBondContact O-CD 3.4Å; P209-Y211 HydrophobicContact CB-CD1 3.73Å; P209-Y211 HydrophobicContact CB-CE1 3.23Å; P209-Y211 HydrophobicContact CB-CE2 4.31Å; P209-Y211 HydrophobicContact CB-CG 4.44Å; P209-Y211 HydrophobicContact CG-CE1 4.13Å; P209-Y211 PolarHBondContact O-N 2.97Å; P209-L212 HydrophobicContact CG-CD1 4.33Å; P209-L212 WeakPolarHBondContact O-CB 3.44Å; P209-L212 PolarHBondContact O-N 3.05Å
210	D	87.2	Confident	82.7	Confident	132 Å²	132	103.9 Å²	103.9	71%	0.706	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-23.7	-174.9	-66.8	-6.2	0	0	0	115.5	I208 L212 C213 K215	I208-D210 PolarHBondContact O-N 3.07Å; D210-L212 VanDerWaalsContact C-N 3.34Å; D210-C213 PolarHBondContact O-N 2.92Å; D210-K215 PolarHBondContact O-NZ 3.2Å
211	Y	86.6	Confident	82.9	Confident	160 Å²	160	100.1 Å²	100.1	63%	0.627	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-16.7	177.6	62.2	-97.6	0	0	0	113.1	P209 M221	P209-Y211 HydrophobicContact CB-CD1 3.73Å; P209-Y211 HydrophobicContact CB-CE1 3.23Å; P209-Y211 HydrophobicContact CB-CE2 4.31Å; P209-Y211 HydrophobicContact CB-CG 4.44Å; P209-Y211 HydrophobicContact CG-CE1 4.13Å; P209-Y211 PolarHBondContact O-N 2.97Å; Y211-M221 WeakPolarHBondContact O-CE 3.48Å
212	L	87.2	Confident	83	Confident	30 Å²	30	102 Å²	102	16%	0.157	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-10.5	171.5	-58.7	179.5	0	0	0	112.2	I208 P209 D210 L220 M221 V267 V268	I208-L212 HydrophobicContact CG2-CB 4.23Å; P209-L212 HydrophobicContact CG-CD1 4.33Å; P209-L212 WeakPolarHBondContact O-CB 3.44Å; P209-L212 PolarHBondContact O-N 3.05Å; D210-L212 VanDerWaalsContact C-N 3.34Å; L212-L220 HydrophobicContact CB-CD1 3.69Å; L212-L220 HydrophobicContact CD1-CD1 4.4Å; L212-M221 WeakPolarHBondContact O-CE 3.43Å; L212-M221 WeakPolarHBondContact O-CG 3.32Å; L212-M221 PolarHBondContact O-N 2.97Å; L212-V267 HydrophobicContact CD2-CG1 3.95Å; L212-V268 HydrophobicContact CD2-CG2 4.03Å
213	C	87.6	Confident	83.4	Confident	17 Å²	17	97.2 Å²	97.2	12%	0.115	44%	0.442	C	S	.	.	B	Isolated β-bridge	trans	-90.1	138.2	179.9	-63.4	0	0	0	0	111.7	D210 E219	D210-C213 PolarHBondContact O-N 2.92Å; C213-E219 CarbonylContact C-O 3.59Å; C213-E219 VanDerWaalsContact CA-O 3.23Å; C213-E219 WeakPolarHBondContact CA-O 3.27Å
214	G	87.2	Confident	84.1	Confident	1 Å²	1	94.2 Å²	94.2	1%	0.01	43%	0.431	C	S	.	.			trans	-65.4	139.4	174.1	0	0	0	0	0	110.4	I216 F218 E219 M221	G214-I216 PolarHBondContact O-N 3.28Å; G214-F218 VanDerWaalsContact O-CA 3.28Å; G214-F218 WeakPolarHBondContact O-CA 3.18Å; G214-F218 PolarHBondContact O-N 3.11Å; G214-E219 PolarHBondContact N-O 3.06Å; G214-M221 VanDerWaalsContact N-CG 3.3Å
215	K	88.8	Confident	84.7	Confident	106 Å²	106	88.3 Å²	88.3	46%	0.461	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-11	-179.2	-55.4	-53.1	-179.1	-164.9	0	114.2	D210 I231 Y233	D210-K215 PolarHBondContact O-NZ 3.2Å; K215-I231 HydrophobicContact CG-CG2 4.28Å; K215-Y233 HydrophobicContact CB-CD1 3.99Å; K215-Y233 HydrophobicContact CB-CE1 3.71Å; K215-Y233 HydrophobicContact CG-CE1 4.3Å
216	I	86.3	Confident	85.8	Confident	61 Å²	61	80.9 Å²	80.9	31%	0.313	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-55.5	178.6	-61.3	167.3	0	0	0	110.1	G214 F218 Y233 D237 I238 H241	G214-I216 PolarHBondContact O-N 3.28Å; I216-F218 VanDerWaalsContact O-CD2 3.25Å; I216-F218 WeakPolarHBondContact O-CD2 3.42Å; I216-F218 WeakPolarHBondContact O-CE2 3.06Å; I216-Y233 HydrophobicContact CD1-CD1 3.78Å; I216-Y233 HydrophobicContact CD1-CE1 4.18Å; I216-Y233 HydrophobicContact CG1-CD1 3.91Å; I216-Y233 HydrophobicContact CG1-CE1 4.14Å; I216-D237 HydrophobicContact CB-CB 3.9Å; I216-D237 HydrophobicContact CD1-CB 4.18Å; I216-D237 HydrophobicContact CG2-CB 3.92Å; I216-I238 HydrophobicContact CD1-CB 4.34Å; I216-I238 HydrophobicContact CD1-CD1 3.96Å; I216-H241 HydrophobicContact CD1-CB 4.05Å
217	S	83.4	Confident	86.2	Confident	36 Å²	36	71.2 Å²	71.2	25%	0.252	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-24.9	179.7	40.5	0	0	0	0	114.4	E219 D237	S217-E219 PolarHBondContact O-N 3.17Å; S217-E219 VanDerWaalsContact O-N 3.07Å; S217-D237 WeakPolarHBondContact CB-OD2 3.45Å; S217-D237 PolarHBondContact OG-OD2 2.85Å
218	F	86.1	Confident	86.5	Confident	165 Å²	165	67.9 Å²	67.9	72%	0.724	34%	0.335	S	S	*	.			trans	55.4	17.4	-167.3	-56.4	-85.5	0	0	0	113.4	G214 I216	G214-F218 VanDerWaalsContact O-CA 3.28Å; G214-F218 WeakPolarHBondContact O-CA 3.18Å; G214-F218 PolarHBondContact O-N 3.11Å; I216-F218 VanDerWaalsContact O-CD2 3.25Å; I216-F218 WeakPolarHBondContact O-CD2 3.42Å; I216-F218 WeakPolarHBondContact O-CE2 3.06Å
219	E	85.8	Confident	86.6	Confident	118 Å²	118	68.7 Å²	68.7	55%	0.551	35%	0.348	S	S	*	.	S	Bend	trans	-106.5	164	174.8	-65.6	-170.7	-179.6	0	0	110.5	C213 G214 S217 M221	C213-E219 CarbonylContact C-O 3.59Å; C213-E219 VanDerWaalsContact CA-O 3.23Å; C213-E219 WeakPolarHBondContact CA-O 3.27Å; G214-E219 PolarHBondContact N-O 3.06Å; S217-E219 PolarHBondContact O-N 3.17Å; S217-E219 VanDerWaalsContact O-N 3.07Å; E219-M221 PolarHBondContact O-N 3.2Å
220	L	86.9	Confident	86.5	Confident	66 Å²	66	68.9 Å²	68.9	35%	0.346	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-56.2	122.4	173.6	-175.9	70.3	0	0	0	111.1	I208 L212 R222 V268	I208-L220 HydrophobicContact CD1-CB 4.22Å; I208-L220 HydrophobicContact CG2-CB 4.49Å; I208-L220 HydrophobicContact CG2-CD1 3.79Å; L212-L220 HydrophobicContact CB-CD1 3.69Å; L212-L220 HydrophobicContact CD1-CD1 4.4Å; L220-R222 PolarHBondContact O-N 3.48Å; L220-V268 HydrophobicContact CD1-CG1 3.78Å; L220-V268 HydrophobicContact CD2-CG1 3.97Å; L220-V268 HydrophobicContact CG-CG1 3.7Å
221	M	86.7	Confident	86.5	Confident	3 Å²	3	65.8 Å²	65.8	2%	0.015	34%	0.342	C	S	.	.			trans	-63.7	119.7	-176.6	-65.9	-178	-75.3	0	0	111.8	Y211 L212 G214 E219 P224 T232 V268	Y211-M221 WeakPolarHBondContact O-CE 3.48Å; L212-M221 WeakPolarHBondContact O-CE 3.43Å; L212-M221 WeakPolarHBondContact O-CG 3.32Å; L212-M221 PolarHBondContact O-N 2.97Å; G214-M221 VanDerWaalsContact N-CG 3.3Å; E219-M221 PolarHBondContact O-N 3.2Å; M221-P224 HydrophobicContact CB-CB 4.37Å; M221-P224 HydrophobicContact SD-CB 4.33Å; M221-T232 HydrophobicContact CE-CG2 3.98Å; M221-T232 HydrophobicContact SD-CG2 3.54Å; M221-T232 VanDerWaalsContact SD-CG2 3.54Å; M221-V268 WeakPolarHBondContact O-CG1 3.41Å
222	R	83.5	Confident	86.6	Confident	142 Å²	142	59 Å²	59	54%	0.536	32%	0.317	S	S	.	.	S	Bend	trans	-84.1	-42.6	178.2	-58.3	179.9	-172.5	-87.1	-5.3	111.4	L220 D234	L220-R222 PolarHBondContact O-N 3.48Å; R222-D234 PolarHBondContact N-OD2 2.99Å
223	E	84.2	Confident	86.7	Confident	62 Å²	62	59.8 Å²	59.8	29%	0.29	32%	0.319	S	S	.	.	S	Bend	trans	-125.8	77.3	179.8	-65.5	-165.1	-178.7	0	0	110.4	C225 R235 R265	E223-C225 PolarHBondContact O-N 3.19Å; E223-R235 HydrophobicContact CB-CB 3.88Å; E223-R235 WeakPolarHBondContact O-CB 2.97Å; E223-R235 PolarHBondContact O-N 2.86Å; E223-R265 IonicContact OE1-NH2 3.79Å
224	P	89.2	Confident	86.7	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.032	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	125.9	-178	25.6	-33.3	0	0	0	111	M221 T232 Y233 S261 E264 R265	M221-P224 HydrophobicContact CB-CB 4.37Å; M221-P224 HydrophobicContact SD-CB 4.33Å; P224-T232 HydrophobicContact CB-CG2 3.65Å; P224-Y233 WeakPolarHBondContact CA-O 3.28Å; P224-S261 PolarHBondContact O-N 3.02Å; P224-S261 VanDerWaalsContact O-N 3.16Å; P224-E264 HydrophobicContact CB-CB 4.06Å; P224-E264 HydrophobicContact CG-CB 4.02Å; P224-R265 HydrophobicContact CG-CB 3.99Å
225	C	88.6	Confident	86.7	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136.7	174.7	71.6	0	0	0	0	110.2	E223 T232 Y233 R235 I238 F258 R259	E223-C225 PolarHBondContact O-N 3.19Å; C225-T232 WeakPolarHBondContact O-CA 3.41Å; C225-Y233 PolarHBondContact N-O 3.35Å; C225-Y233 PolarHBondContact O-N 3.45Å; C225-Y233 PolarHBondContact SG-O 3.22Å; C225-Y233 VanDerWaalsContact SG-O 3.41Å; C225-R235 HydrophobicContact CB-CB 4.39Å; C225-I238 VanDerWaalsContact SG-CG2 3.6Å; C225-F258 HydrophobicContact CB-CB 4.45Å; C225-R259 WeakPolarHBondContact CA-O 2.9Å
226	I	88.9	Confident	86.6	Confident	53 Å²	53	63.3 Å²	63.3	27%	0.272	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129.7	-177.4	-67.7	164.6	0	0	0	108.6	T232 R259 S261	I226-T232 HydrophobicContact CG1-CG2 4.32Å; I226-T232 WeakPolarHBondContact CG1-OG1 3.38Å; I226-R259 PolarHBondContact N-O 3.22Å; I226-R259 PolarHBondContact O-N 3.49Å; I226-S261 WeakPolarHBondContact CD1-OG 3.27Å
227	T	87.2	Confident	86.6	Confident	17 Å²	17	61.9 Å²	61.9	10%	0.104	32%	0.324	C	S	.	.			trans	-78.9	159.2	170.9	68.8	0	0	0	0	110.6	S229 G230 I231 Y233 F258	T227-S229 PolarHBondContact O-N 3.41Å; T227-G230 PolarHBondContact O-N 3.46Å; T227-I231 PolarHBondContact N-O 3.47Å; T227-I231 PolarHBondContact OG1-N 3.46Å; T227-I231 PolarHBondContact OG1-O 2.81Å; T227-Y233 HydrophobicContact CG2-CD2 3.63Å; T227-Y233 HydrophobicContact CG2-CE2 3.6Å; T227-F258 HydrophobicContact CG2-CD1 3.99Å; T227-F258 HydrophobicContact CG2-CE1 3.65Å
228	P	85.3	Confident	86.8	Confident	114 Å²	114	60.8 Å²	60.8	74%	0.74	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-23.4	173.5	-27.9	36.2	0	0	0	114.4	G230	P228-G230 PolarHBondContact O-N 3.17Å
229	S	84.1	Confident	86.8	Confident	102 Å²	102	56 Å²	56	71%	0.713	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-4.7	174.5	-49.4	0	0	0	0	113.9	T227	T227-S229 PolarHBondContact O-N 3.41Å
230	G	85.3	Confident	86.8	Confident	56 Å²	56	54.9 Å²	54.9	58%	0.577	29%	0.29	S	S	*	.	S	Bend	trans	81.7	12	-179.4	0	0	0	0	0	114.7	T227 P228	T227-G230 PolarHBondContact O-N 3.46Å; P228-G230 PolarHBondContact O-N 3.17Å
231	I	87.1	Confident	86.7	Confident	68 Å²	68	55.1 Å²	55.1	35%	0.349	29%	0.289	S	S	.	.			trans	-96.9	130.6	178.8	-52.7	171.7	0	0	0	109.3	K215 T227 Y233	K215-I231 HydrophobicContact CG-CG2 4.28Å; T227-I231 PolarHBondContact N-O 3.47Å; T227-I231 PolarHBondContact OG1-N 3.46Å; T227-I231 PolarHBondContact OG1-O 2.81Å; I231-Y233 HydrophobicContact CB-CD2 4.45Å; I231-Y233 HydrophobicContact CB-CE2 3.64Å; I231-Y233 HydrophobicContact CG2-CD2 4.1Å; I231-Y233 HydrophobicContact CG2-CE1 4.27Å; I231-Y233 HydrophobicContact CG2-CE2 3.37Å; I231-Y233 VanDerWaalsContact CG2-CZ 3.47Å
232	T	88.6	Confident	86.6	Confident	18 Å²	18	57.7 Å²	57.7	11%	0.11	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	131.7	176.4	-46.9	0	0	0	0	111.1	M221 P224 C225 I226 E264	M221-T232 HydrophobicContact CE-CG2 3.98Å; M221-T232 HydrophobicContact SD-CG2 3.54Å; M221-T232 VanDerWaalsContact SD-CG2 3.54Å; P224-T232 HydrophobicContact CB-CG2 3.65Å; C225-T232 WeakPolarHBondContact O-CA 3.41Å; I226-T232 HydrophobicContact CG1-CG2 4.32Å; I226-T232 WeakPolarHBondContact CG1-OG1 3.38Å; T232-E264 WeakPolarHBondContact CG2-OE2 3.37Å; T232-E264 VanDerWaalsContact OG1-CD 3.32Å; T232-E264 PolarHBondContact OG1-OE1 3.45Å; T232-E264 PolarHBondContact OG1-OE2 3.4Å; T232-E264 VanDerWaalsContact OG1-OE2 3.09Å
233	Y	89.3	Confident	86.4	Confident	46 Å²	46	57.9 Å²	57.9	18%	0.18	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	161.8	172.5	-60.2	-93.3	0	0	0	110	K215 I216 P224 C225 T227 I231 R235 I238	K215-Y233 HydrophobicContact CB-CD1 3.99Å; K215-Y233 HydrophobicContact CB-CE1 3.71Å; K215-Y233 HydrophobicContact CG-CE1 4.3Å; I216-Y233 HydrophobicContact CD1-CD1 3.78Å; I216-Y233 HydrophobicContact CD1-CE1 4.18Å; I216-Y233 HydrophobicContact CG1-CD1 3.91Å; I216-Y233 HydrophobicContact CG1-CE1 4.14Å; P224-Y233 WeakPolarHBondContact CA-O 3.28Å; C225-Y233 PolarHBondContact N-O 3.35Å; C225-Y233 PolarHBondContact O-N 3.45Å; C225-Y233 PolarHBondContact SG-O 3.22Å; C225-Y233 VanDerWaalsContact SG-O 3.41Å; T227-Y233 HydrophobicContact CG2-CD2 3.63Å; T227-Y233 HydrophobicContact CG2-CE2 3.6Å; I231-Y233 HydrophobicContact CB-CD2 4.45Å; I231-Y233 HydrophobicContact CB-CE2 3.64Å; I231-Y233 HydrophobicContact CG2-CD2 4.1Å; I231-Y233 HydrophobicContact CG2-CE1 4.27Å; I231-Y233 HydrophobicContact CG2-CE2 3.37Å; I231-Y233 VanDerWaalsContact CG2-CZ 3.47Å; Y233-R235 PolarHBondContact O-N 3.49Å; Y233-I238 HydrophobicContact CD1-CD1 4.33Å; Y233-I238 HydrophobicContact CD2-CD1 4.28Å; Y233-I238 HydrophobicContact CD2-CG1 4.4Å; Y233-I238 HydrophobicContact CE1-CD1 4.5Å; Y233-I238 HydrophobicContact CE2-CD1 4.45Å; Y233-I238 HydrophobicContact CG-CB 4.27Å; Y233-I238 HydrophobicContact CG-CD1 4.22Å; Y233-I238 HydrophobicContact CG-CG1 4.35Å
234	D	89.3	Confident	86.1	Confident	13 Å²	13	60.5 Å²	60.5	7%	0.07	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	130.3	161	-159.9	-45	0	0	0	108.7	R222 K236 D237 I238	R222-D234 PolarHBondContact N-OD2 2.99Å; D234-K236 PolarHBondContact O-N 3.28Å; D234-K236 PolarHBondContact OD1-N 3.32Å; D234-D237 WeakPolarHBondContact CB-OD2 3.47Å; D234-D237 PolarHBondContact O-N 2.97Å; D234-I238 WeakPolarHBondContact O-CG2 3.5Å; D234-I238 PolarHBondContact O-N 2.88Å; D234-I238 VanDerWaalsContact O-N 3.14Å
235	R	86.9	Confident	84.9	Confident	56 Å²	56	66.6 Å²	66.6	21%	0.211	36%	0.357	C	S	.	.	H	α-helix	trans	-51	-44.6	-177.7	176.3	176.9	-73.6	-83.5	-2	112.3	E223 C225 Y233 I238 E239 T260	E223-R235 HydrophobicContact CB-CB 3.88Å; E223-R235 WeakPolarHBondContact O-CB 2.97Å; E223-R235 PolarHBondContact O-N 2.86Å; C225-R235 HydrophobicContact CB-CB 4.39Å; Y233-R235 PolarHBondContact O-N 3.49Å; R235-I238 WeakPolarHBondContact O-CG2 3.41Å; R235-E239 WeakPolarHBondContact CD-OE1 3.34Å; R235-E239 VanDerWaalsContact CG-CD 3.49Å; R235-E239 HydrophobicContact CG-CG 4.27Å; R235-E239 WeakPolarHBondContact CG-OE1 3.4Å; R235-E239 IonicContact CZ-OE1 3.47Å; R235-E239 IonicContact NH1-OE1 3.12Å; R235-E239 PolarHBondContact NH1-OE1 3.44Å; R235-E239 VanDerWaalsContact O-CB 3.27Å; R235-E239 WeakPolarHBondContact O-CB 3.18Å; R235-E239 WeakPolarHBondContact O-CG 3.45Å; R235-E239 PolarHBondContact O-N 2.92Å; R235-T260 VanDerWaalsContact NH2-CG2 3.33Å
236	K	85.1	Confident	83.3	Confident	128 Å²	128	69.9 Å²	69.9	56%	0.557	38%	0.378	S	S	*	.	H	α-helix	trans	-64	-47.4	-176.3	-175.1	-175.7	170.7	-169.3	0	111.1	D234 I238 E239 E240	D234-K236 PolarHBondContact O-N 3.28Å; D234-K236 PolarHBondContact OD1-N 3.32Å; K236-I238 PolarHBondContact O-N 3.01Å; K236-E239 PolarHBondContact O-N 2.96Å; K236-E240 WeakPolarHBondContact CE-OE1 3.47Å; K236-E240 IonicContact NZ-OE1 3.05Å; K236-E240 WeakPolarHBondContact O-CG 3.48Å; K236-E240 PolarHBondContact O-N 3.43Å
237	D	87.9	Confident	81.6	Confident	32 Å²	32	72.5 Å²	72.5	17%	0.171	40%	0.398	C	S	.	.	H	α-helix	trans	-66.3	-41.5	-175.3	-56.4	-27.2	0	0	0	111.7	I216 S217 D234 H241	I216-D237 HydrophobicContact CB-CB 3.9Å; I216-D237 HydrophobicContact CD1-CB 4.18Å; I216-D237 HydrophobicContact CG2-CB 3.92Å; S217-D237 WeakPolarHBondContact CB-OD2 3.45Å; S217-D237 PolarHBondContact OG-OD2 2.85Å; D234-D237 WeakPolarHBondContact CB-OD2 3.47Å; D234-D237 PolarHBondContact O-N 2.97Å; D237-H241 WeakPolarHBondContact O-CB 3.41Å; D237-H241 PolarHBondContact O-N 3.46Å
238	I	86.8	Confident	79.6	Confident	12 Å²	12	79.3 Å²	79.3	6%	0.062	43%	0.434	C	S	.	.	H	α-helix	trans	-71.4	-37.4	179.1	-167.4	62.1	0	0	0	111.6	I216 C225 Y233 D234 R235 K236 H241 L242 F258	I216-I238 HydrophobicContact CD1-CB 4.34Å; I216-I238 HydrophobicContact CD1-CD1 3.96Å; C225-I238 VanDerWaalsContact SG-CG2 3.6Å; Y233-I238 HydrophobicContact CD1-CD1 4.33Å; Y233-I238 HydrophobicContact CD2-CD1 4.28Å; Y233-I238 HydrophobicContact CD2-CG1 4.4Å; Y233-I238 HydrophobicContact CE1-CD1 4.5Å; Y233-I238 HydrophobicContact CE2-CD1 4.45Å; Y233-I238 HydrophobicContact CG-CB 4.27Å; Y233-I238 HydrophobicContact CG-CD1 4.22Å; Y233-I238 HydrophobicContact CG-CG1 4.35Å; D234-I238 WeakPolarHBondContact O-CG2 3.5Å; D234-I238 PolarHBondContact O-N 2.88Å; D234-I238 VanDerWaalsContact O-N 3.14Å; R235-I238 WeakPolarHBondContact O-CG2 3.41Å; K236-I238 PolarHBondContact O-N 3.01Å; I238-H241 PolarHBondContact O-N 3.24Å; I238-L242 HydrophobicContact CD1-CD1 4.37Å; I238-L242 HydrophobicContact CD1-CG 4.36Å; I238-L242 HydrophobicContact CG1-CD1 3.93Å; I238-L242 HydrophobicContact CG1-CG 4.38Å; I238-L242 WeakPolarHBondContact O-CB 3.48Å; I238-L242 WeakPolarHBondContact O-CD1 3.47Å; I238-L242 WeakPolarHBondContact O-CG 3.5Å; I238-L242 PolarHBondContact O-N 3.39Å; I238-F258 HydrophobicContact CG1-CE1 4.33Å; I238-F258 HydrophobicContact CG1-CZ 4.38Å
239	E	85.6	Confident	77.7	Confident	64 Å²	64	83.4 Å²	83.4	30%	0.299	43%	0.434	S	S	.	.	H	α-helix	trans	-63.8	-42.3	175.4	-75.6	174.7	-175.1	0	0	111.2	R235 K236 Q243	R235-E239 WeakPolarHBondContact CD-OE1 3.34Å; R235-E239 VanDerWaalsContact CG-CD 3.49Å; R235-E239 HydrophobicContact CG-CG 4.27Å; R235-E239 WeakPolarHBondContact CG-OE1 3.4Å; R235-E239 IonicContact CZ-OE1 3.47Å; R235-E239 IonicContact NH1-OE1 3.12Å; R235-E239 PolarHBondContact NH1-OE1 3.44Å; R235-E239 VanDerWaalsContact O-CB 3.27Å; R235-E239 WeakPolarHBondContact O-CB 3.18Å; R235-E239 WeakPolarHBondContact O-CG 3.45Å; R235-E239 PolarHBondContact O-N 2.92Å; K236-E239 PolarHBondContact O-N 2.96Å; E239-Q243 WeakPolarHBondContact O-CG 3.36Å; E239-Q243 PolarHBondContact O-N 3.3Å
240	E	85.9	Confident	75.7	Confident	96 Å²	96	90 Å²	90	45%	0.449	44%	0.444	S	S	.	.	H	α-helix	trans	-66.8	-45.8	175.2	-74	179.2	-174.7	0	0	111.9	K236 L242 Q243 V244	K236-E240 WeakPolarHBondContact CE-OE1 3.47Å; K236-E240 IonicContact NZ-OE1 3.05Å; K236-E240 WeakPolarHBondContact O-CG 3.48Å; K236-E240 PolarHBondContact O-N 3.43Å; E240-L242 PolarHBondContact O-N 3.15Å; E240-Q243 PolarHBondContact O-N 3.21Å; E240-V244 WeakPolarHBondContact O-CG2 3.42Å; E240-V244 PolarHBondContact O-N 3.34Å
241	H	85.2	Confident	73.5	Confident	71 Å²	71	96.7 Å²	96.7	33%	0.329	45%	0.451	S	S	.	.	H	α-helix	trans	-58.8	-45.1	179.2	178.9	71.3	0	0	0	112.2	I216 D237 I238 Q243 V244 E245	I216-H241 HydrophobicContact CD1-CB 4.05Å; D237-H241 WeakPolarHBondContact O-CB 3.41Å; D237-H241 PolarHBondContact O-N 3.46Å; I238-H241 PolarHBondContact O-N 3.24Å; H241-Q243 VanDerWaalsContact C-N 3.35Å; H241-Q243 PolarHBondContact O-N 3.05Å; H241-V244 PolarHBondContact O-N 2.82Å; H241-E245 IonicContact CE1-OE1 3.31Å; H241-E245 PolarHBondContact CE1-OE1 2.94Å; H241-E245 IonicContact CE1-OE2 3.38Å; H241-E245 IonicContact ND1-OE1 3.81Å; H241-E245 IonicContact NE2-OE1 2.65Å; H241-E245 IonicContact NE2-OE2 2.65Å; H241-E245 PolarHBondContact O-N 3.14Å
242	L	84.1	Confident	71.3	Confident	57 Å²	57	99.5 Å²	99.5	30%	0.298	48%	0.477	S	S	.	.	H	α-helix	trans	-66.6	-35.5	178.9	-69.1	166.5	0	0	0	112.8	I238 E240 V244 T246 F258	I238-L242 HydrophobicContact CD1-CD1 4.37Å; I238-L242 HydrophobicContact CD1-CG 4.36Å; I238-L242 HydrophobicContact CG1-CD1 3.93Å; I238-L242 HydrophobicContact CG1-CG 4.38Å; I238-L242 WeakPolarHBondContact O-CB 3.48Å; I238-L242 WeakPolarHBondContact O-CD1 3.47Å; I238-L242 WeakPolarHBondContact O-CG 3.5Å; I238-L242 PolarHBondContact O-N 3.39Å; E240-L242 PolarHBondContact O-N 3.15Å; L242-V244 VanDerWaalsContact C-N 3.34Å; L242-T246 PolarHBondContact O-N 2.93Å; L242-T246 PolarHBondContact O-OG1 3.41Å; L242-F258 HydrophobicContact CD1-CE1 4.45Å; L242-F258 HydrophobicContact CD1-CE2 3.74Å; L242-F258 HydrophobicContact CD1-CZ 3.36Å
243	Q	81.1	Confident	69.2	Low	145 Å²	145	101.9 Å²	101.9	68%	0.678	50%	0.495	S	S	*	.	H	α-helix	trans	-67.3	-34.9	175.7	-74.7	172.7	28.8	0	0	112.2	E239 E240 H241	E239-Q243 WeakPolarHBondContact O-CG 3.36Å; E239-Q243 PolarHBondContact O-N 3.3Å; E240-Q243 PolarHBondContact O-N 3.21Å; H241-Q243 VanDerWaalsContact C-N 3.35Å; H241-Q243 PolarHBondContact O-N 3.05Å
244	V	77.2	Confident	67.2	Low	118 Å²	118	105 Å²	105	72%	0.715	52%	0.515	S	S	*	.	H	α-helix	trans	-78.8	-41.6	180	174.2	0	0	0	0	111.9	E240 H241 L242	E240-V244 WeakPolarHBondContact O-CG2 3.42Å; E240-V244 PolarHBondContact O-N 3.34Å; H241-V244 PolarHBondContact O-N 2.82Å; L242-V244 VanDerWaalsContact C-N 3.34Å
245	E	64.6	Low	65.3	Low	132 Å²	132	109.3 Å²	109.3	62%	0.617	54%	0.541	S	S	*	.	H	α-helix	trans	-81.8	-22.8	-174.5	-67.8	-151	161.3	0	0	114.7	H241	H241-E245 IonicContact CE1-OE1 3.31Å; H241-E245 PolarHBondContact CE1-OE1 2.94Å; H241-E245 IonicContact CE1-OE2 3.38Å; H241-E245 IonicContact ND1-OE1 3.81Å; H241-E245 IonicContact NE2-OE1 2.65Å; H241-E245 IonicContact NE2-OE2 2.65Å; H241-E245 PolarHBondContact O-N 3.14Å
246	T	54.7	Low	63.6	Low	70 Å²	70	110 Å²	110	43%	0.429	57%	0.566	S	S	.	*			trans	-130.5	64.8	-175.1	58.6	0	0	0	0	114.7	L242 D248	L242-T246 PolarHBondContact O-N 2.93Å; L242-T246 PolarHBondContact O-OG1 3.41Å; T246-D248 PolarHBondContact O-N 2.83Å
247	P	52.7	Low	62.4	Low	107 Å²	107	105.1 Å²	105.1	70%	0.695	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-24.2	177.6	22.5	-30	0	0	0	113.9
248	D	44.9	Very low	61.6	Low	160 Å²	160	105.3 Å²	105.3	86%	0.856	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	-8.2	-168.8	-130.1	0.4	0	0	0	115.1	T246 R250	T246-D248 PolarHBondContact O-N 2.83Å; D248-R250 PolarHBondContact O-N 3.47Å
249	R	45.4	Very low	61.1	Low	201 Å²	201	114.6 Å²	114.6	76%	0.758	59%	0.585	S	S	*	*			trans	-95.6	73.5	174.1	-78.1	-171.9	179.8	-175	3.3	110.6	R251	R249-R251 PolarHBondContact O-N 2.97Å
250	R	42.7	Very low	60.8	Low	240 Å²	240	116 Å²	116	91%	0.906	60%	0.598	S	S	*	*			trans	-67.9	76.7	159.9	-67.7	-172.8	-170.2	-175.7	3.9	109.9	D248	D248-R250 PolarHBondContact O-N 3.47Å
251	R	38.8	Very low	60.3	Low	196 Å²	196	111.8 Å²	111.8	74%	0.74	58%	0.579	S	S	*	*			trans	-117.8	111.2	152.4	-75	-168.3	-176.6	-160.9	1.8	107.3	R249 S253	R249-R251 PolarHBondContact O-N 2.97Å; R251-S253 PolarHBondContact O-N 3.38Å
252	S	41.6	Very low	59.8	Low	127 Å²	127	112.6 Å²	112.6	89%	0.888	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.9	12.3	171.8	49.5	0	0	0	0	114.8
253	S	42.5	Very low	59.3	Low	69 Å²	69	113.7 Å²	113.7	48%	0.483	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.1	-29.4	-177.1	53.5	0	0	0	0	114	R251	R251-S253 PolarHBondContact O-N 3.38Å
254	D	48	Very low	58.9	Low	112 Å²	112	109.3 Å²	109.3	60%	0.599	59%	0.585	S	S	*	*	S	Bend	trans	-90.5	-28.2	-168.9	-63.3	-8.4	0	0	0	112.7	G256	D254-G256 PolarHBondContact O-N 3.46Å
255	V	50.4	Low	58.7	Low	102 Å²	102	109.7 Å²	109.7	62%	0.618	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-73	-19.4	172.3	-169.4	0	0	0	0	111.8	G257 F258	V255-G257 VanDerWaalsContact C-N 3.32Å; V255-G257 PolarHBondContact O-N 3.01Å; V255-F258 WeakPolarHBondContact O-CD2 3.21Å
256	G	49.6	Very low	58.8	Low	71 Å²	71	106.6 Å²	106.6	73%	0.732	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-82.1	-2.2	179	0	0	0	0	0	115.1	D254	D254-G256 PolarHBondContact O-N 3.46Å
257	G	61.2	Low	59.7	Low	26 Å²	26	107 Å²	107	27%	0.268	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-90.1	-11.9	-174.9	0	0	0	0	0	115.7	V255 R259	V255-G257 VanDerWaalsContact C-N 3.32Å; V255-G257 PolarHBondContact O-N 3.01Å; G257-R259 PolarHBondContact O-N 2.9Å
258	F	70.3	Confident	60	Low	35 Å²	35	103 Å²	103	15%	0.154	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-77.5	116.7	-174.8	-56.2	-59.9	0	0	0	111.8	C225 T227 I238 L242 V255	C225-F258 HydrophobicContact CB-CB 4.45Å; T227-F258 HydrophobicContact CG2-CD1 3.99Å; T227-F258 HydrophobicContact CG2-CE1 3.65Å; I238-F258 HydrophobicContact CG1-CE1 4.33Å; I238-F258 HydrophobicContact CG1-CZ 4.38Å; L242-F258 HydrophobicContact CD1-CE1 4.45Å; L242-F258 HydrophobicContact CD1-CE2 3.74Å; L242-F258 HydrophobicContact CD1-CZ 3.36Å; V255-F258 WeakPolarHBondContact O-CD2 3.21Å
259	R	77.2	Confident	60.3	Low	207 Å²	207	100.1 Å²	100.1	78%	0.781	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	133.2	171.8	-64.6	-174.8	178.8	-155.8	0.1	109.2	C225 I226 G257 S261	C225-R259 WeakPolarHBondContact CA-O 2.9Å; I226-R259 PolarHBondContact N-O 3.22Å; I226-R259 PolarHBondContact O-N 3.49Å; G257-R259 PolarHBondContact O-N 2.9Å; R259-S261 PolarHBondContact O-N 3.26Å
260	T	78.1	Confident	60.2	Low	94 Å²	94	97.9 Å²	97.9	58%	0.577	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.3	124.9	168.9	48	0	0	0	0	109.1	R235 S262	R235-T260 VanDerWaalsContact NH2-CG2 3.33Å; T260-S262 PolarHBondContact O-N 2.84Å
261	S	76.4	Confident	61	Low	7 Å²	7	90.8 Å²	90.8	5%	0.049	53%	0.531	C	S	.	.			trans	-85.4	89.5	177.3	-174.1	0	0	0	0	110.2	P224 I226 R259 S263 E264 R265	P224-S261 PolarHBondContact O-N 3.02Å; P224-S261 VanDerWaalsContact O-N 3.16Å; I226-S261 WeakPolarHBondContact CD1-OG 3.27Å; R259-S261 PolarHBondContact O-N 3.26Å; S261-S263 VanDerWaalsContact C-N 3.26Å; S261-S263 PolarHBondContact O-N 3.03Å; S261-E264 WeakPolarHBondContact CB-OE2 3.41Å; S261-E264 PolarHBondContact O-N 3.35Å; S261-E264 VanDerWaalsContact OG-CB 3.31Å; S261-E264 WeakPolarHBondContact OG-CB 3.47Å; S261-E264 VanDerWaalsContact OG-CD 3.29Å; S261-E264 VanDerWaalsContact OG-CG 3.3Å; S261-E264 WeakPolarHBondContact OG-CG 3.39Å; S261-E264 PolarHBondContact OG-N 3.23Å; S261-E264 PolarHBondContact OG-OE2 3.21Å; S261-R265 VanDerWaalsContact O-CB 3.24Å; S261-R265 WeakPolarHBondContact O-CB 3.44Å; S261-R265 PolarHBondContact O-N 3.04Å
262	S	73.4	Confident	62.2	Low	89 Å²	89	85.3 Å²	85.3	62%	0.622	52%	0.52	S	S	*	.	H	α-helix	trans	-62.3	-34.2	179.7	-54.7	0	0	0	0	112.5	T260 S266	T260-S262 PolarHBondContact O-N 2.84Å; S262-S266 PolarHBondContact O-N 2.91Å
263	S	74.5	Confident	63.3	Low	79 Å²	79	82.9 Å²	82.9	55%	0.552	50%	0.5	S	S	*	.	H	α-helix	trans	-66	-52.9	177	46.8	0	0	0	0	111.3	S261 R265 S266 V267	S261-S263 VanDerWaalsContact C-N 3.26Å; S261-S263 PolarHBondContact O-N 3.03Å; S263-R265 VanDerWaalsContact C-N 3.29Å; S263-R265 PolarHBondContact O-N 3.19Å; S263-S266 PolarHBondContact O-N 2.8Å; S263-S266 PolarHBondContact O-OG 3.33Å; S263-V267 WeakPolarHBondContact O-CG2 3.25Å; S263-V267 PolarHBondContact O-N 3.23Å; S263-V267 VanDerWaalsContact O-N 3.14Å
264	E	73.4	Confident	64.6	Low	53 Å²	53	83.8 Å²	83.8	25%	0.248	50%	0.501	C	S	.	.	H	α-helix	trans	-67.3	-33.4	178.8	-66.3	169	140.4	0	0	111.5	P224 T232 S261 S266 V267 V268	P224-E264 HydrophobicContact CB-CB 4.06Å; P224-E264 HydrophobicContact CG-CB 4.02Å; T232-E264 WeakPolarHBondContact CG2-OE2 3.37Å; T232-E264 VanDerWaalsContact OG1-CD 3.32Å; T232-E264 PolarHBondContact OG1-OE1 3.45Å; T232-E264 PolarHBondContact OG1-OE2 3.4Å; T232-E264 VanDerWaalsContact OG1-OE2 3.09Å; S261-E264 WeakPolarHBondContact CB-OE2 3.41Å; S261-E264 PolarHBondContact O-N 3.35Å; S261-E264 VanDerWaalsContact OG-CB 3.31Å; S261-E264 WeakPolarHBondContact OG-CB 3.47Å; S261-E264 VanDerWaalsContact OG-CD 3.29Å; S261-E264 VanDerWaalsContact OG-CG 3.3Å; S261-E264 WeakPolarHBondContact OG-CG 3.39Å; S261-E264 PolarHBondContact OG-N 3.23Å; S261-E264 PolarHBondContact OG-OE2 3.21Å; E264-S266 VanDerWaalsContact C-N 3.28Å; E264-S266 PolarHBondContact O-N 3.26Å; E264-V267 PolarHBondContact O-N 2.85Å; E264-V267 VanDerWaalsContact O-N 3.14Å; E264-V268 VanDerWaalsContact O-CG2 3.32Å; E264-V268 WeakPolarHBondContact O-CG2 3.2Å; E264-V268 PolarHBondContact O-N 3.23Å
265	R	72.2	Confident	65.6	Low	127 Å²	127	82 Å²	82	48%	0.479	50%	0.495	S	S	.	.	H	α-helix	trans	-61.4	-38.7	174.3	-163.5	177.9	-148.7	-153.8	7.3	112	E223 P224 S261 S263 C269	E223-R265 IonicContact OE1-NH2 3.79Å; P224-R265 HydrophobicContact CG-CB 3.99Å; S261-R265 VanDerWaalsContact O-CB 3.24Å; S261-R265 WeakPolarHBondContact O-CB 3.44Å; S261-R265 PolarHBondContact O-N 3.04Å; S263-R265 VanDerWaalsContact C-N 3.29Å; S263-R265 PolarHBondContact O-N 3.19Å; R265-C269 VanDerWaalsContact O-CB 3.29Å; R265-C269 WeakPolarHBondContact O-CB 3.17Å; R265-C269 PolarHBondContact O-N 3.05Å; R265-C269 VanDerWaalsContact O-N 3.12Å; R265-C269 PolarHBondContact O-SG 2.96Å
266	S	67.5	Low	66.6	Low	66 Å²	66	80.7 Å²	80.7	46%	0.462	49%	0.486	S	S	.	.	H	α-helix	trans	-65.6	-41	174.2	71.4	0	0	0	0	111.9	S262 S263 E264 C269 S270	S262-S266 PolarHBondContact O-N 2.91Å; S263-S266 PolarHBondContact O-N 2.8Å; S263-S266 PolarHBondContact O-OG 3.33Å; E264-S266 VanDerWaalsContact C-N 3.28Å; E264-S266 PolarHBondContact O-N 3.26Å; S266-C269 PolarHBondContact O-N 3.05Å; S266-S270 WeakPolarHBondContact O-CB 3.34Å; S266-S270 PolarHBondContact O-N 2.81Å; S266-S270 VanDerWaalsContact O-N 3.16Å; S266-S270 PolarHBondContact O-OG 3.25Å
267	V	72.4	Confident	67.8	Low	78 Å²	78	81.4 Å²	81.4	47%	0.473	47%	0.469	S	S	.	.	H	α-helix	trans	-66.7	-40.4	179.2	176.6	0	0	0	0	112	L212 S263 E264	L212-V267 HydrophobicContact CD2-CG1 3.95Å; S263-V267 WeakPolarHBondContact O-CG2 3.25Å; S263-V267 PolarHBondContact O-N 3.23Å; S263-V267 VanDerWaalsContact O-N 3.14Å; E264-V267 PolarHBondContact O-N 2.85Å; E264-V267 VanDerWaalsContact O-N 3.14Å
268	V	60.1	Low	68.3	Low	23 Å²	23	85.6 Å²	85.6	14%	0.139	48%	0.484	C	S	.	.	H	α-helix	trans	-75.9	-26.7	179.8	-178.8	0	0	0	0	112.7	L212 L220 M221 E264	L212-V268 HydrophobicContact CD2-CG2 4.03Å; L220-V268 HydrophobicContact CD1-CG1 3.78Å; L220-V268 HydrophobicContact CD2-CG1 3.97Å; L220-V268 HydrophobicContact CG-CG1 3.7Å; M221-V268 WeakPolarHBondContact O-CG1 3.41Å; E264-V268 VanDerWaalsContact O-CG2 3.32Å; E264-V268 WeakPolarHBondContact O-CG2 3.2Å; E264-V268 PolarHBondContact O-N 3.23Å
269	C	51.3	Low	68.2	Low	101 Å²	101	89.8 Å²	89.8	68%	0.682	51%	0.512	S	S	*	.	H	α-helix	trans	-87.8	-7.7	178.2	-66.4	0	0	0	0	114.1	R265 S266	R265-C269 VanDerWaalsContact O-CB 3.29Å; R265-C269 WeakPolarHBondContact O-CB 3.17Å; R265-C269 PolarHBondContact O-N 3.05Å; R265-C269 VanDerWaalsContact O-N 3.12Å; R265-C269 PolarHBondContact O-SG 2.96Å; S266-C269 PolarHBondContact O-N 3.05Å
270	S	41.6	Very low	67.4	Low	154 Å²	154	79.2 Å²	79.2	100%	1.077	49%	0.487	S	S	*	.			trans	-85.1	0	176.8	-58.8	0	0	0	0	111	S266	S266-S270 WeakPolarHBondContact O-CB 3.34Å; S266-S270 PolarHBondContact O-N 2.81Å; S266-S270 VanDerWaalsContact O-N 3.16Å; S266-S270 PolarHBondContact O-OG 3.25Å

Retrieved 270 of 270 residues in 137.3 ms (Link to these results)

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