A0A087XFM9_POEFO Loading...

vitamin-K-epoxide reductase (warfarin-sensitive)

AlphaFold DB , UniProt , Accession A0A087XFM9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 171 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	V	36.8	Very low	55.8	Low	185 Å²	185	104.5 Å²	104.5	100%	1.121	61%	0.605	S	S	*	*				0	-10.2	0	-177.8	0	0	0	0	114
2	F	37.6	Very low	58.5	Low	190 Å²	190	116.4 Å²	116.4	83%	0.833	63%	0.633	S	S	*	*			trans	-116	64.4	165.2	-70.2	-79.3	0	0	0	111.5	M4	F2-M4 PolarHBondContact O-N 3.13Å
3	H	40	Very low	61	Low	194 Å²	194	115.8 Å²	115.8	90%	0.898	62%	0.616	S	S	*	*			trans	-75	82.4	156.3	-116.9	-41.8	0	0	0	106	A5	H3-A5 VanDerWaalsContact C-N 3.31Å; H3-A5 PolarHBondContact O-N 3.4Å
4	M	47.4	Very low	63.3	Low	78 Å²	78	107.6 Å²	107.6	38%	0.384	57%	0.572	S	S	.	*			trans	-57.8	107.9	161.2	-71.6	-174.4	120	0	0	105.1	F2 A6 P15 I19	F2-M4 PolarHBondContact O-N 3.13Å; M4-A6 PolarHBondContact O-N 3.44Å; M4-P15 HydrophobicContact CE-CB 4.07Å; M4-P15 HydrophobicContact SD-CB 3.39Å; M4-P15 WeakPolarHBondContact SD-CB 3.12Å; M4-P15 HydrophobicContact SD-CG 4.38Å; M4-I19 HydrophobicContact SD-CD1 4.27Å
5	A	43.5	Very low	65.1	Low	86 Å²	86	102.4 Å²	102.4	71%	0.711	55%	0.547	S	S	*	.			trans	-42.8	114.8	169.8	0	0	0	0	0	106.2	H3 A7	H3-A5 VanDerWaalsContact C-N 3.31Å; H3-A5 PolarHBondContact O-N 3.4Å; A5-A7 PolarHBondContact O-N 3.42Å
6	A	47.8	Very low	66.8	Low	92 Å²	92	101.9 Å²	101.9	76%	0.76	55%	0.549	S	S	*	.			trans	-61.4	85.8	171.8	0	0	0	0	0	105.8	M4 Q8	M4-A6 PolarHBondContact O-N 3.44Å; A6-Q8 VanDerWaalsContact C-N 3.35Å; A6-Q8 PolarHBondContact O-N 3.37Å
7	A	56.3	Low	68.5	Low	20 Å²	20	97.4 Å²	97.4	17%	0.165	53%	0.529	C	S	.	.			trans	-61.6	106	174.1	0	0	0	0	0	104.8	A5 G9 L10 L105	A5-A7 PolarHBondContact O-N 3.42Å; A7-G9 VanDerWaalsContact C-N 3.31Å; A7-G9 PolarHBondContact O-N 2.96Å; A7-L10 HydrophobicContact CB-CD1 4.02Å; A7-L10 HydrophobicContact CB-CG 4.35Å; A7-L10 PolarHBondContact O-N 3.09Å; A7-L10 VanDerWaalsContact O-N 3.1Å; A7-L105 HydrophobicContact CB-CD1 3.67Å; A7-L105 HydrophobicContact CB-CD2 3.71Å; A7-L105 HydrophobicContact CB-CG 4.37Å
8	Q	61.9	Low	70	Confident	187 Å²	187	92.4 Å²	92.4	87%	0.874	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	91.6	-174.4	-66.5	173.8	-10.5	0	0	108.9	A6	A6-Q8 VanDerWaalsContact C-N 3.35Å; A6-Q8 PolarHBondContact O-N 3.37Å
9	G	72.1	Confident	71.3	Confident	50 Å²	50	91.3 Å²	91.3	52%	0.515	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	140.1	-16.8	-178.7	0	0	0	0	0	116.4	A7 A162	A7-G9 VanDerWaalsContact C-N 3.31Å; A7-G9 PolarHBondContact O-N 2.96Å; G9-A162 VanDerWaalsContact O-CB 3.32Å; G9-A162 WeakPolarHBondContact O-CB 3.28Å
10	L	83.7	Confident	72.5	Confident	32 Å²	32	90.4 Å²	90.4	17%	0.168	49%	0.492	C	S	.	.	S	Bend	trans	-76.8	145.3	172.2	-72.1	175.3	0	0	0	111.4	A7 R12 L105 R159 A162 I163	A7-L10 HydrophobicContact CB-CD1 4.02Å; A7-L10 HydrophobicContact CB-CG 4.35Å; A7-L10 PolarHBondContact O-N 3.09Å; A7-L10 VanDerWaalsContact O-N 3.1Å; L10-R12 PolarHBondContact O-N 3.1Å; L10-L105 HydrophobicContact CD1-CD2 3.73Å; L10-R159 HydrophobicContact CD2-CB 4.32Å; L10-R159 HydrophobicContact CD2-CG 3.76Å; L10-A162 HydrophobicContact CD2-CB 3.89Å; L10-I163 HydrophobicContact CD2-CG1 4.4Å
11	P	87.2	Confident	73.7	Confident	35 Å²	35	87.4 Å²	87.4	23%	0.227	48%	0.475	C	S	.	.			trans	-57.5	133.1	171.2	-19.6	30.6	0	0	0	110.6	W13 E14 K158	P11-W13 HydrophobicContact CB-CD2 4.28Å; P11-W13 HydrophobicContact CB-CG 4.35Å; P11-W13 HydrophobicContact CB-CZ2 4.19Å; P11-W13 HydrophobicContact CG-CZ2 4.42Å; P11-W13 PolarHBondContact O-N 2.75Å; P11-W13 VanDerWaalsContact O-N 3.09Å; P11-E14 HydrophobicContact CB-CB 4.29Å; P11-E14 VanDerWaalsContact O-CB 3.28Å; P11-E14 WeakPolarHBondContact O-CB 3.32Å; P11-E14 PolarHBondContact O-N 2.89Å; P11-K158 HydrophobicContact CG-CB 4.4Å
12	R	88.1	Confident	76.6	Confident	248 Å²	248	78.6 Å²	78.6	94%	0.936	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-30.6	-177.1	-76	-177.4	142	138.9	-3.5	114.1	L10	L10-R12 PolarHBondContact O-N 3.1Å
13	W	90.7	Very high	79.4	Confident	108 Å²	108	73.6 Å²	73.6	41%	0.409	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-17.4	179.8	60.2	-100.6	0	0	0	113.6	P11 T16 A17 Y154 T155 K158	P11-W13 HydrophobicContact CB-CD2 4.28Å; P11-W13 HydrophobicContact CB-CG 4.35Å; P11-W13 HydrophobicContact CB-CZ2 4.19Å; P11-W13 HydrophobicContact CG-CZ2 4.42Å; P11-W13 PolarHBondContact O-N 2.75Å; P11-W13 VanDerWaalsContact O-N 3.09Å; W13-T16 PolarHBondContact O-N 3.47Å; W13-A17 HydrophobicContact CE3-CB 3.71Å; W13-A17 HydrophobicContact CZ3-CB 4.03Å; W13-A17 VanDerWaalsContact O-CB 3.28Å; W13-A17 WeakPolarHBondContact O-CB 3.42Å; W13-A17 PolarHBondContact O-N 3.27Å; W13-Y154 AromaticContact CH2-CD1 3.98Å; W13-Y154 HydrophobicContact CH2-CD1 3.98Å; W13-Y154 AromaticContact CH2-CE1 3.6Å; W13-Y154 HydrophobicContact CH2-CE1 3.6Å; W13-Y154 AromaticContact CZ2-CE1 3.95Å; W13-Y154 HydrophobicContact CZ2-CE1 3.95Å; W13-T155 HydrophobicContact CZ3-CG2 4.12Å; W13-K158 HydrophobicContact CH2-CB 4.33Å; W13-K158 HydrophobicContact CH2-CG 4.22Å; W13-K158 HydrophobicContact CZ2-CB 4.33Å; W13-K158 HydrophobicContact CZ2-CG 4.12Å
14	E	93.1	Very high	82.1	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.009	38%	0.383	C	S	.	.	H	α-helix	trans	-59.6	-46.8	-171.4	-176.2	-81.6	161.3	0	0	113.4	P11 A17 R18 T155 R159	P11-E14 HydrophobicContact CB-CB 4.29Å; P11-E14 VanDerWaalsContact O-CB 3.28Å; P11-E14 WeakPolarHBondContact O-CB 3.32Å; P11-E14 PolarHBondContact O-N 2.89Å; E14-A17 PolarHBondContact O-N 3.42Å; E14-R18 WeakPolarHBondContact O-CB 3.49Å; E14-R18 PolarHBondContact O-N 3.48Å; E14-R18 IonicContact OE1-CZ 2.92Å; E14-R18 VanDerWaalsContact OE1-CZ 3.31Å; E14-R18 IonicContact OE1-NE 3.54Å; E14-R18 PolarHBondContact OE1-NE 3.38Å; E14-R18 IonicContact OE1-NH2 2.83Å; E14-R18 PolarHBondContact OE1-NH2 3.06Å; E14-T155 HydrophobicContact CG-CG2 3.79Å; E14-R159 VanDerWaalsContact CD-NH1 3.3Å; E14-R159 HydrophobicContact CG-CB 4.41Å; E14-R159 IonicContact OE1-CZ 2.78Å; E14-R159 IonicContact OE1-NH1 3.04Å; E14-R159 PolarHBondContact OE1-NH1 3.37Å; E14-R159 IonicContact OE2-NH1 2.92Å; E14-R159 PolarHBondContact OE2-NH1 2.96Å
15	P	90.5	Very high	84.5	Confident	29 Å²	29	65 Å²	65	19%	0.188	37%	0.365	C	S	.	.	H	α-helix	trans	-69.1	-41.6	-175.7	-16.7	30.5	0	0	0	111.9	M4 R18 I19	M4-P15 HydrophobicContact CE-CB 4.07Å; M4-P15 HydrophobicContact SD-CB 3.39Å; M4-P15 WeakPolarHBondContact SD-CB 3.12Å; M4-P15 HydrophobicContact SD-CG 4.38Å; P15-R18 PolarHBondContact O-N 3.4Å; P15-I19 VanDerWaalsContact O-CG1 3.32Å; P15-I19 WeakPolarHBondContact O-CG1 3.38Å; P15-I19 PolarHBondContact O-N 2.96Å
16	T	92.8	Very high	87	Confident	94 Å²	94	63 Å²	63	58%	0.577	34%	0.342	S	S	*	.	H	α-helix	trans	-62	-47.7	175.1	-52.9	0	0	0	0	110.9	W13 R18 I19 V20	W13-T16 PolarHBondContact O-N 3.47Å; T16-R18 VanDerWaalsContact C-N 3.34Å; T16-R18 PolarHBondContact O-N 2.97Å; T16-I19 PolarHBondContact O-N 3.1Å; T16-V20 HydrophobicContact CG2-CG2 4.44Å; T16-V20 WeakPolarHBondContact O-CG2 3.38Å; T16-V20 PolarHBondContact O-N 3.05Å
17	A	94.9	Very high	89.4	Confident	26 Å²	26	63.3 Å²	63.3	22%	0.215	33%	0.334	C	S	.	.	H	α-helix	trans	-60	-43.8	177.6	0	0	0	0	0	111.6	W13 E14 I19 V20 L21	W13-A17 HydrophobicContact CE3-CB 3.71Å; W13-A17 HydrophobicContact CZ3-CB 4.03Å; W13-A17 VanDerWaalsContact O-CB 3.28Å; W13-A17 WeakPolarHBondContact O-CB 3.42Å; W13-A17 PolarHBondContact O-N 3.27Å; E14-A17 PolarHBondContact O-N 3.42Å; A17-I19 PolarHBondContact O-N 3.42Å; A17-V20 PolarHBondContact O-N 3.48Å; A17-L21 VanDerWaalsContact O-CB 3.23Å; A17-L21 WeakPolarHBondContact O-CB 3.5Å; A17-L21 WeakPolarHBondContact O-CD1 3.41Å; A17-L21 WeakPolarHBondContact O-CG 3.38Å; A17-L21 PolarHBondContact O-N 3.22Å
18	R	94.8	Very high	91.2	Very high	7 Å²	7	64.1 Å²	64.1	3%	0.026	34%	0.336	C	S	.	.	H	α-helix	trans	-59.2	-47.1	176.6	178.4	-179.9	-60.9	-76.1	-15.1	112.1	E14 P15 T16 G22 Q98 N156	E14-R18 WeakPolarHBondContact O-CB 3.49Å; E14-R18 PolarHBondContact O-N 3.48Å; E14-R18 IonicContact OE1-CZ 2.92Å; E14-R18 VanDerWaalsContact OE1-CZ 3.31Å; E14-R18 IonicContact OE1-NE 3.54Å; E14-R18 PolarHBondContact OE1-NE 3.38Å; E14-R18 IonicContact OE1-NH2 2.83Å; E14-R18 PolarHBondContact OE1-NH2 3.06Å; P15-R18 PolarHBondContact O-N 3.4Å; T16-R18 VanDerWaalsContact C-N 3.34Å; T16-R18 PolarHBondContact O-N 2.97Å; R18-G22 WeakPolarHBondContact O-CA 3.49Å; R18-G22 PolarHBondContact O-N 2.9Å; R18-Q98 PolarHBondContact NH1-O 3.25Å; R18-N156 PolarHBondContact NH1-OD1 3.24Å; R18-N156 VanDerWaalsContact NH1-OD1 3.13Å; R18-N156 PolarHBondContact NH2-OD1 3.48Å
19	I	94.9	Very high	92.7	Very high	71 Å²	71	55.6 Å²	55.6	36%	0.364	30%	0.296	S	S	.	.	H	α-helix	trans	-62.8	-49	-179.5	-69.8	166.4	0	0	0	109.9	M4 P15 T16 A17 G22 L23	M4-I19 HydrophobicContact SD-CD1 4.27Å; P15-I19 VanDerWaalsContact O-CG1 3.32Å; P15-I19 WeakPolarHBondContact O-CG1 3.38Å; P15-I19 PolarHBondContact O-N 2.96Å; T16-I19 PolarHBondContact O-N 3.1Å; A17-I19 PolarHBondContact O-N 3.42Å; I19-G22 PolarHBondContact O-N 3.41Å; I19-L23 HydrophobicContact CG2-CD1 3.77Å; I19-L23 HydrophobicContact CG2-CG 4.38Å; I19-L23 WeakPolarHBondContact O-CB 3.28Å; I19-L23 VanDerWaalsContact O-CG 3.26Å; I19-L23 WeakPolarHBondContact O-CG 3.39Å; I19-L23 PolarHBondContact O-N 2.96Å
20	V	96.8	Very high	93.8	Very high	74 Å²	74	56.8 Å²	56.8	45%	0.448	29%	0.293	S	S	.	.	H	α-helix	trans	-61.8	-51.6	-179.6	171.8	0	0	0	0	111	T16 A17 G22 L23 L24	T16-V20 HydrophobicContact CG2-CG2 4.44Å; T16-V20 WeakPolarHBondContact O-CG2 3.38Å; T16-V20 PolarHBondContact O-N 3.05Å; A17-V20 PolarHBondContact O-N 3.48Å; V20-G22 PolarHBondContact O-N 3.38Å; V20-L23 PolarHBondContact O-N 3.48Å; V20-L24 HydrophobicContact CG1-CD1 3.8Å; V20-L24 HydrophobicContact CG1-CG 4.4Å; V20-L24 WeakPolarHBondContact O-CB 3.47Å; V20-L24 VanDerWaalsContact O-CG 3.25Å; V20-L24 WeakPolarHBondContact O-CG 3.47Å; V20-L24 PolarHBondContact O-N 3.35Å
21	L	97.3	Very high	94.2	Very high	27 Å²	27	57.4 Å²	57.4	14%	0.141	29%	0.294	C	S	.	.	H	α-helix	trans	-62.9	-42	-180	-68.4	170.8	0	0	0	112	A17 G25 I148 A151 L152	A17-L21 VanDerWaalsContact O-CB 3.23Å; A17-L21 WeakPolarHBondContact O-CB 3.5Å; A17-L21 WeakPolarHBondContact O-CD1 3.41Å; A17-L21 WeakPolarHBondContact O-CG 3.38Å; A17-L21 PolarHBondContact O-N 3.22Å; L21-G25 PolarHBondContact O-N 2.89Å; L21-I148 HydrophobicContact CB-CG2 4.27Å; L21-I148 HydrophobicContact CD2-CG1 4.44Å; L21-I148 HydrophobicContact CD2-CG2 4.33Å; L21-I148 WeakPolarHBondContact O-CG2 3.29Å; L21-A151 HydrophobicContact CD1-CB 3.71Å; L21-A151 HydrophobicContact CD2-CB 3.75Å; L21-A151 HydrophobicContact CG-CB 4.4Å; L21-L152 HydrophobicContact CB-CD2 3.8Å; L21-L152 HydrophobicContact CB-CG 4Å; L21-L152 HydrophobicContact CD1-CD2 4.15Å; L21-L152 HydrophobicContact CD1-CG 4.28Å
22	G	96.9	Very high	94.3	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-64.2	-46	178.5	0	0	0	0	0	112.4	R18 I19 V20 G25 L26	R18-G22 WeakPolarHBondContact O-CA 3.49Å; R18-G22 PolarHBondContact O-N 2.9Å; I19-G22 PolarHBondContact O-N 3.41Å; V20-G22 PolarHBondContact O-N 3.38Å; G22-G25 PolarHBondContact O-N 3.38Å; G22-L26 VanDerWaalsContact O-CB 3.3Å; G22-L26 WeakPolarHBondContact O-CB 3.33Å; G22-L26 PolarHBondContact O-N 2.91Å
23	L	97.3	Very high	94.4	Very high	85 Å²	85	45.9 Å²	45.9	45%	0.445	25%	0.25	S	C	.	.	H	α-helix	trans	-66.5	-45.3	177.7	-71.4	175.5	0	0	0	112	I19 V20 G25 L26 V27 M99	I19-L23 HydrophobicContact CG2-CD1 3.77Å; I19-L23 HydrophobicContact CG2-CG 4.38Å; I19-L23 WeakPolarHBondContact O-CB 3.28Å; I19-L23 VanDerWaalsContact O-CG 3.26Å; I19-L23 WeakPolarHBondContact O-CG 3.39Å; I19-L23 PolarHBondContact O-N 2.96Å; V20-L23 PolarHBondContact O-N 3.48Å; L23-G25 VanDerWaalsContact C-N 3.34Å; L23-G25 PolarHBondContact O-N 3.41Å; L23-L26 PolarHBondContact O-N 3.28Å; L23-V27 WeakPolarHBondContact O-CB 3.48Å; L23-V27 VanDerWaalsContact O-CG2 3.32Å; L23-V27 WeakPolarHBondContact O-CG2 3.34Å; L23-V27 PolarHBondContact O-N 2.91Å; L23-M99 HydrophobicContact CD2-CE 4.17Å; L23-M99 HydrophobicContact CD2-SD 4.44Å; L23-M99 HydrophobicContact CG-CE 4.36Å
24	L	97.3	Very high	94.3	Very high	91 Å²	91	45.3 Å²	45.3	48%	0.476	25%	0.251	S	S	.	.	H	α-helix	trans	-60.2	-45.8	176.3	-72	175.2	0	0	0	111.3	V20 L26 V27 L28 I148	V20-L24 HydrophobicContact CG1-CD1 3.8Å; V20-L24 HydrophobicContact CG1-CG 4.4Å; V20-L24 WeakPolarHBondContact O-CB 3.47Å; V20-L24 VanDerWaalsContact O-CG 3.25Å; V20-L24 WeakPolarHBondContact O-CG 3.47Å; V20-L24 PolarHBondContact O-N 3.35Å; L24-L26 VanDerWaalsContact C-N 3.35Å; L24-L26 PolarHBondContact O-N 2.96Å; L24-V27 PolarHBondContact O-N 2.92Å; L24-L28 WeakPolarHBondContact O-CB 3.39Å; L24-L28 VanDerWaalsContact O-CG 3.32Å; L24-L28 WeakPolarHBondContact O-CG 3.25Å; L24-L28 PolarHBondContact O-N 3.42Å; L24-I148 HydrophobicContact CB-CD1 3.9Å
25	G	97.1	Very high	94	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61	-42.6	177.1	0	0	0	0	0	112.7	L21 G22 L23 S29 Y95	L21-G25 PolarHBondContact O-N 2.89Å; G22-G25 PolarHBondContact O-N 3.38Å; L23-G25 VanDerWaalsContact C-N 3.34Å; L23-G25 PolarHBondContact O-N 3.41Å; G25-S29 WeakPolarHBondContact O-CB 3.37Å; G25-S29 PolarHBondContact O-N 2.78Å; G25-S29 PolarHBondContact O-OG 2.92Å; G25-Y95 VanDerWaalsContact CA-CZ 3.46Å; G25-Y95 VanDerWaalsContact O-CD2 3.27Å; G25-Y95 WeakPolarHBondContact O-CD2 3.41Å; G25-Y95 WeakPolarHBondContact O-CE2 3.49Å
26	L	96.7	Very high	93.8	Very high	46 Å²	46	43.9 Å²	43.9	24%	0.241	24%	0.242	C	C	.	.	H	α-helix	trans	-63.9	-47.7	177.1	-175.2	63.9	0	0	0	111.6	G22 L23 L24 L28 S29 V30 I92	G22-L26 VanDerWaalsContact O-CB 3.3Å; G22-L26 WeakPolarHBondContact O-CB 3.33Å; G22-L26 PolarHBondContact O-N 2.91Å; L23-L26 PolarHBondContact O-N 3.28Å; L24-L26 VanDerWaalsContact C-N 3.35Å; L24-L26 PolarHBondContact O-N 2.96Å; L26-L28 PolarHBondContact O-N 2.92Å; L26-S29 PolarHBondContact O-N 3.49Å; L26-V30 HydrophobicContact CD1-CG2 4.49Å; L26-V30 WeakPolarHBondContact O-CG2 3.41Å; L26-V30 PolarHBondContact O-N 2.67Å; L26-I92 HydrophobicContact CD1-CB 4.28Å; L26-I92 HydrophobicContact CD1-CG1 4.27Å; L26-I92 HydrophobicContact CD1-CG2 3.92Å
27	V	96.8	Very high	93.4	Very high	97 Å²	97	43.6 Å²	43.6	59%	0.588	24%	0.236	S	C	*	.	H	α-helix	trans	-59.5	-46.7	177.8	168.9	0	0	0	0	111	L23 L24 S29 V30 Y31	L23-V27 WeakPolarHBondContact O-CB 3.48Å; L23-V27 VanDerWaalsContact O-CG2 3.32Å; L23-V27 WeakPolarHBondContact O-CG2 3.34Å; L23-V27 PolarHBondContact O-N 2.91Å; L24-V27 PolarHBondContact O-N 2.92Å; V27-S29 VanDerWaalsContact C-N 3.3Å; V27-S29 PolarHBondContact O-N 2.76Å; V27-V30 PolarHBondContact O-N 2.94Å; V27-Y31 WeakPolarHBondContact O-CB 3.15Å; V27-Y31 PolarHBondContact O-N 3.43Å
28	L	94.3	Very high	93	Very high	38 Å²	38	43.6 Å²	43.6	20%	0.199	24%	0.235	C	C	.	.	H	α-helix	trans	-63.1	-37.1	177.7	-70.7	175.2	0	0	0	112.2	L24 L26 Y31 A32 V141 T145 I148	L24-L28 WeakPolarHBondContact O-CB 3.39Å; L24-L28 VanDerWaalsContact O-CG 3.32Å; L24-L28 WeakPolarHBondContact O-CG 3.25Å; L24-L28 PolarHBondContact O-N 3.42Å; L26-L28 PolarHBondContact O-N 2.92Å; L28-Y31 PolarHBondContact O-N 3.45Å; L28-A32 WeakPolarHBondContact O-CB 3.23Å; L28-A32 PolarHBondContact O-N 3.04Å; L28-V141 HydrophobicContact CB-CG1 4.42Å; L28-V141 HydrophobicContact CD2-CG1 4.37Å; L28-T145 HydrophobicContact CB-CG2 3.93Å; L28-T145 HydrophobicContact CD1-CG2 4.05Å; L28-I148 HydrophobicContact CD1-CD1 3.61Å
29	S	93.9	Very high	92.2	Very high	7 Å²	7	45.2 Å²	45.2	5%	0.049	24%	0.241	C	C	.	.	H	α-helix	trans	-70	-42.1	178.4	-55.4	0	0	0	0	112.1	G25 L26 V27 Y31 A32 L33 S88 Y95	G25-S29 WeakPolarHBondContact O-CB 3.37Å; G25-S29 PolarHBondContact O-N 2.78Å; G25-S29 PolarHBondContact O-OG 2.92Å; L26-S29 PolarHBondContact O-N 3.49Å; V27-S29 VanDerWaalsContact C-N 3.3Å; V27-S29 PolarHBondContact O-N 2.76Å; S29-Y31 VanDerWaalsContact C-N 3.33Å; S29-A32 PolarHBondContact O-N 3Å; S29-L33 WeakPolarHBondContact O-CB 3.48Å; S29-L33 PolarHBondContact O-N 3.27Å; S29-S88 WeakPolarHBondContact O-CB 3.21Å; S29-Y95 WeakPolarHBondContact OG-CD2 3.34Å; S29-Y95 WeakPolarHBondContact OG-CE2 3.25Å
30	V	94.5	Very high	91.5	Very high	75 Å²	75	45.9 Å²	45.9	46%	0.455	24%	0.243	S	C	.	.	H	α-helix	trans	-63.2	-42.4	173.7	171.5	0	0	0	0	110.6	L26 V27 L33 H34 I92	L26-V30 HydrophobicContact CD1-CG2 4.49Å; L26-V30 WeakPolarHBondContact O-CG2 3.41Å; L26-V30 PolarHBondContact O-N 2.67Å; V27-V30 PolarHBondContact O-N 2.94Å; V30-L33 PolarHBondContact O-N 2.96Å; V30-H34 WeakPolarHBondContact O-CB 3.45Å; V30-H34 PolarHBondContact O-N 3.27Å; V30-I92 HydrophobicContact CG2-CD1 3.95Å; V30-I92 HydrophobicContact CG2-CG1 4.07Å
31	Y	92.1	Very high	90.9	Very high	45 Å²	45	53.3 Å²	53.3	18%	0.176	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-44.2	176.2	179.5	-111.9	0	0	0	112.1	V27 L28 S29 L33 H34 V35 M48 C49 V141	V27-Y31 WeakPolarHBondContact O-CB 3.15Å; V27-Y31 PolarHBondContact O-N 3.43Å; L28-Y31 PolarHBondContact O-N 3.45Å; S29-Y31 VanDerWaalsContact C-N 3.33Å; Y31-L33 VanDerWaalsContact C-N 3.33Å; Y31-L33 PolarHBondContact O-N 3.27Å; Y31-H34 WeakPolarHBondContact O-CB 3.3Å; Y31-H34 PolarHBondContact O-N 2.84Å; Y31-V35 HydrophobicContact CD1-CG2 4.44Å; Y31-V35 HydrophobicContact CD2-CG2 4.37Å; Y31-V35 HydrophobicContact CE1-CG2 3.92Å; Y31-V35 HydrophobicContact CE2-CG2 3.83Å; Y31-V35 WeakPolarHBondContact O-CG2 3.48Å; Y31-V35 PolarHBondContact O-N 3.42Å; Y31-M48 HydrophobicContact CD2-CE 4.49Å; Y31-M48 HydrophobicContact CE2-CE 3.54Å; Y31-M48 WeakPolarHBondContact OH-CB 3.4Å; Y31-M48 PolarHBondContact OH-N 3.46Å; Y31-C49 HydrophobicContact CE1-CB 4.36Å; Y31-V141 HydrophobicContact CD1-CG2 4.09Å; Y31-V141 HydrophobicContact CE1-CG2 4.08Å
32	A	89.3	Confident	90.2	Very high	6 Å²	6	55.7 Å²	55.7	5%	0.05	28%	0.275	C	S	.	.	H	α-helix	trans	-59.9	-43.2	175	0	0	0	0	0	111.6	L28 S29 H34 V35 E36 F61 V141	L28-A32 WeakPolarHBondContact O-CB 3.23Å; L28-A32 PolarHBondContact O-N 3.04Å; S29-A32 PolarHBondContact O-N 3Å; A32-H34 PolarHBondContact O-N 3.25Å; A32-V35 PolarHBondContact O-N 3.42Å; A32-E36 WeakPolarHBondContact O-CB 3.49Å; A32-E36 PolarHBondContact O-N 2.9Å; A32-F61 HydrophobicContact CB-CE1 4.4Å; A32-F61 HydrophobicContact CB-CE2 4Å; A32-F61 HydrophobicContact CB-CZ 3.79Å; A32-V141 HydrophobicContact CB-CG1 4.36Å
33	L	90.1	Very high	89.4	Confident	35 Å²	35	60.3 Å²	60.3	18%	0.183	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-42.6	175.6	-178.5	59.9	0	0	0	111.8	S29 V30 Y31 E36 L37 P86 S88 V89 I92	S29-L33 WeakPolarHBondContact O-CB 3.48Å; S29-L33 PolarHBondContact O-N 3.27Å; V30-L33 PolarHBondContact O-N 2.96Å; Y31-L33 VanDerWaalsContact C-N 3.33Å; Y31-L33 PolarHBondContact O-N 3.27Å; L33-E36 PolarHBondContact O-N 2.97Å; L33-L37 HydrophobicContact CD1-CD1 3.93Å; L33-L37 HydrophobicContact CD1-CG 4Å; L33-L37 HydrophobicContact CG-CD1 3.91Å; L33-L37 HydrophobicContact CG-CG 4.38Å; L33-L37 WeakPolarHBondContact O-CB 3.48Å; L33-L37 VanDerWaalsContact O-CG 3.29Å; L33-L37 WeakPolarHBondContact O-CG 3.44Å; L33-L37 PolarHBondContact O-N 3.34Å; L33-P86 HydrophobicContact CD1-CB 4.12Å; L33-P86 HydrophobicContact CD1-CG 4.13Å; L33-S88 WeakPolarHBondContact CA-OG 3.32Å; L33-V89 HydrophobicContact CD1-CG2 3.87Å; L33-V89 HydrophobicContact CD2-CG2 4.01Å; L33-I92 HydrophobicContact CD2-CD1 3.79Å
34	H	89.9	Confident	88.6	Confident	97 Å²	97	63.7 Å²	63.7	45%	0.449	32%	0.319	S	S	.	.	H	α-helix	trans	-59.9	-46.9	175.2	173.2	70	0	0	0	111.4	V30 Y31 A32 E36 L37 S38	V30-H34 WeakPolarHBondContact O-CB 3.45Å; V30-H34 PolarHBondContact O-N 3.27Å; Y31-H34 WeakPolarHBondContact O-CB 3.3Å; Y31-H34 PolarHBondContact O-N 2.84Å; A32-H34 PolarHBondContact O-N 3.25Å; H34-E36 PolarHBondContact O-N 3.46Å; H34-L37 PolarHBondContact O-N 3.28Å; H34-S38 PolarHBondContact CE1-OG 3.43Å; H34-S38 VanDerWaalsContact CE1-OG 3.25Å; H34-S38 WeakPolarHBondContact O-CB 3.44Å; H34-S38 PolarHBondContact O-N 2.88Å; H34-S38 PolarHBondContact O-OG 2.86Å
35	V	87.1	Confident	87.7	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-44.5	178.4	167.3	0	0	0	0	111.5	Y31 A32 S38 R39 Y45 A47 F61	Y31-V35 HydrophobicContact CD1-CG2 4.44Å; Y31-V35 HydrophobicContact CD2-CG2 4.37Å; Y31-V35 HydrophobicContact CE1-CG2 3.92Å; Y31-V35 HydrophobicContact CE2-CG2 3.83Å; Y31-V35 WeakPolarHBondContact O-CG2 3.48Å; Y31-V35 PolarHBondContact O-N 3.42Å; A32-V35 PolarHBondContact O-N 3.42Å; V35-S38 PolarHBondContact O-N 3.01Å; V35-R39 WeakPolarHBondContact O-CB 3.28Å; V35-R39 PolarHBondContact O-N 2.94Å; V35-Y45 HydrophobicContact CG1-CE1 4.44Å; V35-A47 HydrophobicContact CB-CB 4.4Å; V35-A47 HydrophobicContact CG1-CB 3.63Å; V35-A47 HydrophobicContact CG2-CB 3.83Å; V35-F61 HydrophobicContact CG1-CD2 4.08Å
36	E	84.3	Confident	86.7	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-61.4	-50.6	179	-171.1	173.5	167.8	0	0	111.2	A32 L33 H34 S38 R39 E40 F61 P86 S88	A32-E36 WeakPolarHBondContact O-CB 3.49Å; A32-E36 PolarHBondContact O-N 2.9Å; L33-E36 PolarHBondContact O-N 2.97Å; H34-E36 PolarHBondContact O-N 3.46Å; E36-S38 PolarHBondContact O-N 3.45Å; E36-R39 PolarHBondContact O-N 3.42Å; E36-E40 WeakPolarHBondContact O-CG 3.47Å; E36-E40 PolarHBondContact O-N 2.83Å; E36-F61 HydrophobicContact CB-CB 4.44Å; E36-F61 HydrophobicContact CG-CB 4.49Å; E36-P86 WeakPolarHBondContact OE1-CB 3.45Å; E36-P86 WeakPolarHBondContact OE2-CB 3.48Å; E36-S88 PolarHBondContact OE2-OG 2.9Å
37	L	84.8	Confident	85.7	Confident	87 Å²	87	69.7 Å²	69.7	46%	0.455	33%	0.334	S	S	.	.	H	α-helix	trans	-66.3	-37.8	178.4	-67.5	174.7	0	0	0	113	L33 H34 E40 R41	L33-L37 HydrophobicContact CD1-CD1 3.93Å; L33-L37 HydrophobicContact CD1-CG 4Å; L33-L37 HydrophobicContact CG-CD1 3.91Å; L33-L37 HydrophobicContact CG-CG 4.38Å; L33-L37 WeakPolarHBondContact O-CB 3.48Å; L33-L37 VanDerWaalsContact O-CG 3.29Å; L33-L37 WeakPolarHBondContact O-CG 3.44Å; L33-L37 PolarHBondContact O-N 3.34Å; H34-L37 PolarHBondContact O-N 3.28Å; L37-E40 PolarHBondContact O-N 3.47Å; L37-R41 PolarHBondContact O-N 3.34Å; L37-R41 VanDerWaalsContact O-N 3.12Å
38	S	86.3	Confident	84.5	Confident	26 Å²	26	72.2 Å²	72.2	18%	0.182	34%	0.341	C	S	.	.	H	α-helix	trans	-65	-43	176.5	-69.9	0	0	0	0	111.3	H34 V35 E36 R41 D42	H34-S38 PolarHBondContact CE1-OG 3.43Å; H34-S38 VanDerWaalsContact CE1-OG 3.25Å; H34-S38 WeakPolarHBondContact O-CB 3.44Å; H34-S38 PolarHBondContact O-N 2.88Å; H34-S38 PolarHBondContact O-OG 2.86Å; V35-S38 PolarHBondContact O-N 3.01Å; E36-S38 PolarHBondContact O-N 3.45Å; S38-R41 PolarHBondContact O-N 3.45Å; S38-D42 PolarHBondContact O-N 2.85Å
39	R	78.9	Confident	83.7	Confident	42 Å²	42	71 Å²	71	16%	0.158	34%	0.336	C	S	.	.	H	α-helix	trans	-67.5	-33.4	175.4	-95.8	-55.5	-172.3	-171.1	-22	113.6	V35 E36 R41 D42 P43 E44 Y45 T62	V35-R39 WeakPolarHBondContact O-CB 3.28Å; V35-R39 PolarHBondContact O-N 2.94Å; E36-R39 PolarHBondContact O-N 3.42Å; R39-R41 VanDerWaalsContact C-N 3.31Å; R39-D42 CarbonylContact O-C 3.29Å; R39-D42 VanDerWaalsContact O-C 3.29Å; R39-P43 PolarHBondContact NH1-O 2.91Å; R39-E44 PolarHBondContact NH1-O 3.28Å; R39-E44 PolarHBondContact NH2-O 3.32Å; R39-E44 VanDerWaalsContact NH2-O 3.1Å; R39-Y45 WeakPolarHBondContact CD-O 3.43Å; R39-Y45 HydrophobicContact CG-CD1 3.97Å; R39-Y45 PolarHBondContact NE-O 3.24Å; R39-Y45 VanDerWaalsContact NH1-N 3.16Å; R39-Y45 PolarHBondContact NH2-O 2.85Å; R39-T62 HydrophobicContact CB-CG2 3.38Å; R39-T62 HydrophobicContact CG-CG2 4.05Å
40	E	79.6	Confident	82.9	Confident	84 Å²	84	72.3 Å²	72.3	39%	0.393	34%	0.342	S	S	.	.	H	α-helix	trans	-65.7	-36.7	174.4	-78.4	176	-178	0	0	112.5	E36 L37 R68	E36-E40 WeakPolarHBondContact O-CG 3.47Å; E36-E40 PolarHBondContact O-N 2.83Å; L37-E40 PolarHBondContact O-N 3.47Å; E40-R68 VanDerWaalsContact CD-NH2 3.32Å; E40-R68 IonicContact OE1-CZ 2.6Å; E40-R68 IonicContact OE1-NH1 3.15Å; E40-R68 PolarHBondContact OE1-NH1 3.01Å; E40-R68 IonicContact OE1-NH2 3.03Å; E40-R68 PolarHBondContact OE1-NH2 2.75Å; E40-R68 IonicContact OE2-NH2 3.31Å; E40-R68 PolarHBondContact OE2-NH2 3.49Å; E40-R68 VanDerWaalsContact OE2-NH2 3.15Å
41	R	83.9	Confident	81.8	Confident	231 Å²	231	74.1 Å²	74.1	87%	0.872	35%	0.349	S	S	*	.	H	α-helix	trans	-76.4	-38	177.5	-174.4	179.9	-67.1	176.2	-1.2	112.2	L37 S38 R39	L37-R41 PolarHBondContact O-N 3.34Å; L37-R41 VanDerWaalsContact O-N 3.12Å; S38-R41 PolarHBondContact O-N 3.45Å; R39-R41 VanDerWaalsContact C-N 3.31Å
42	D	83.1	Confident	80.6	Confident	76 Å²	76	73.9 Å²	73.9	41%	0.406	36%	0.359	S	S	.	.			trans	-131.8	101.2	-177.3	179.4	6.4	0	0	0	110.5	S38 R39 E44 Y45	S38-D42 PolarHBondContact O-N 2.85Å; R39-D42 CarbonylContact O-C 3.29Å; R39-D42 VanDerWaalsContact O-C 3.29Å; D42-E44 PolarHBondContact O-N 3.03Å; D42-E44 WeakPolarHBondContact OD1-CB 3.43Å; D42-E44 PolarHBondContact OD1-N 3.42Å; D42-Y45 WeakPolarHBondContact O-CB 3.41Å; D42-Y45 PolarHBondContact O-N 3.47Å
43	P	79.2	Confident	79.4	Confident	98 Å²	98	81.9 Å²	81.9	64%	0.636	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	0.7	175.3	-23	34.5	0	0	0	115.5	R39	R39-P43 PolarHBondContact NH1-O 2.91Å
44	E	80.5	Confident	77.9	Confident	155 Å²	155	84 Å²	84	72%	0.724	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-13.9	170.9	-63.9	-60.8	126.2	0	0	113.5	R39 D42 R46	R39-E44 PolarHBondContact NH1-O 3.28Å; R39-E44 PolarHBondContact NH2-O 3.32Å; R39-E44 VanDerWaalsContact NH2-O 3.1Å; D42-E44 PolarHBondContact O-N 3.03Å; D42-E44 WeakPolarHBondContact OD1-CB 3.43Å; D42-E44 PolarHBondContact OD1-N 3.42Å; E44-R46 PolarHBondContact O-N 2.96Å; E44-R46 VanDerWaalsContact O-N 3.14Å
45	Y	79.1	Confident	76.7	Confident	53 Å²	53	80.9 Å²	80.9	21%	0.208	40%	0.401	C	S	.	.			trans	-57.6	104.8	-174.9	170.4	-98	0	0	0	116.3	V35 R39 D42 A47	V35-Y45 HydrophobicContact CG1-CE1 4.44Å; R39-Y45 WeakPolarHBondContact CD-O 3.43Å; R39-Y45 HydrophobicContact CG-CD1 3.97Å; R39-Y45 PolarHBondContact NE-O 3.24Å; R39-Y45 VanDerWaalsContact NH1-N 3.16Å; R39-Y45 PolarHBondContact NH2-O 2.85Å; D42-Y45 WeakPolarHBondContact O-CB 3.41Å; D42-Y45 PolarHBondContact O-N 3.47Å; Y45-A47 HydrophobicContact CE1-CB 4.34Å
46	R	75.4	Confident	75.8	Confident	205 Å²	205	81.2 Å²	81.2	77%	0.774	40%	0.404	S	S	*	.			trans	-82.2	130.8	175.3	-71.7	-176.1	171.9	-169.6	-3.5	112.9	E44	E44-R46 PolarHBondContact O-N 2.96Å; E44-R46 VanDerWaalsContact O-N 3.14Å
47	A	77.3	Confident	75	Confident	6 Å²	6	81.2 Å²	81.2	5%	0.05	40%	0.403	C	S	.	.			trans	-75.8	151.8	176.8	0	0	0	0	0	111.3	V35 Y45 C49 D50 S58	V35-A47 HydrophobicContact CB-CB 4.4Å; V35-A47 HydrophobicContact CG1-CB 3.63Å; V35-A47 HydrophobicContact CG2-CB 3.83Å; Y45-A47 HydrophobicContact CE1-CB 4.34Å; A47-C49 PolarHBondContact O-N 2.72Å; A47-D50 PolarHBondContact N-OD2 3.32Å; A47-D50 VanDerWaalsContact O-CB 3.31Å; A47-D50 WeakPolarHBondContact O-CB 3.38Å; A47-D50 PolarHBondContact O-N 3.13Å; A47-S58 VanDerWaalsContact CB-OG 3.26Å; A47-S58 WeakPolarHBondContact CB-OG 3.22Å; A47-S58 PolarHBondContact N-OG 3.49Å
48	M	71.8	Confident	73.9	Confident	150 Å²	150	77.1 Å²	77.1	74%	0.739	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-22.7	174.8	-59.3	-177.8	-78.6	0	0	113.1	Y31 D50	Y31-M48 HydrophobicContact CD2-CE 4.49Å; Y31-M48 HydrophobicContact CE2-CE 3.54Å; Y31-M48 WeakPolarHBondContact OH-CB 3.4Å; Y31-M48 PolarHBondContact OH-N 3.46Å; M48-D50 VanDerWaalsContact C-N 3.31Å
49	C	76.6	Confident	72.8	Confident	13 Å²	13	80.2 Å²	80.2	9%	0.088	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	9.3	174.4	65.2	0	0	0	0	114.1	Y31 A47 L51 C57 V141	Y31-C49 HydrophobicContact CE1-CB 4.36Å; A47-C49 PolarHBondContact O-N 2.72Å; C49-L51 PolarHBondContact O-N 3.07Å; C49-C57 HydrophobicContact CB-CB 4.26Å; C49-C57 WeakPolarHBondContact CB-SG 3.39Å; C49-C57 WeakPolarHBondContact SG-CB 3.4Å; C49-C57 CovalentContact SG-SG 2.04Å; C49-C57 PolarHBondContact SG-SG 3.05Å; C49-V141 HydrophobicContact CB-CG2 3.94Å; C49-V141 VanDerWaalsContact SG-CG2 3.52Å
50	D	76.4	Confident	72.3	Confident	34 Å²	34	78.7 Å²	78.7	18%	0.182	39%	0.388	C	S	.	.			trans	-81.5	96.3	164.8	-64.9	-25.4	0	0	0	109.2	A47 M48 V55 S56 C57 S58	A47-D50 PolarHBondContact N-OD2 3.32Å; A47-D50 VanDerWaalsContact O-CB 3.31Å; A47-D50 WeakPolarHBondContact O-CB 3.38Å; A47-D50 PolarHBondContact O-N 3.13Å; M48-D50 VanDerWaalsContact C-N 3.31Å; D50-V55 CarbonylContact C-O 3.47Å; D50-V55 VanDerWaalsContact CA-O 3.3Å; D50-V55 WeakPolarHBondContact CA-O 3.35Å; D50-S56 VanDerWaalsContact CG-OG 3.3Å; D50-S56 WeakPolarHBondContact OD1-CA 3.4Å; D50-S56 WeakPolarHBondContact OD1-CB 3.28Å; D50-S56 PolarHBondContact OD1-OG 2.85Å; D50-C57 PolarHBondContact OD1-N 2.89Å; D50-S58 PolarHBondContact OD1-N 2.79Å; D50-S58 WeakPolarHBondContact OD2-CB 3.32Å; D50-S58 PolarHBondContact OD2-OG 3.24Å; D50-S58 VanDerWaalsContact OD2-OG 3.14Å
51	L	72.5	Confident	71.3	Confident	113 Å²	113	76.1 Å²	76.1	59%	0.592	38%	0.375	S	S	*	.			trans	-97.3	1.8	-176.4	-59.9	175.3	0	0	0	113.5	C49 V55 M140	C49-L51 PolarHBondContact O-N 3.07Å; L51-V55 HydrophobicContact CB-CB 4.13Å; L51-V55 HydrophobicContact CB-CG1 3.86Å; L51-V55 HydrophobicContact CD1-CG1 4.26Å; L51-V55 HydrophobicContact CG-CG1 4.33Å; L51-V55 PolarHBondContact N-O 3.05Å; L51-M140 HydrophobicContact CD1-CE 3.53Å; L51-M140 HydrophobicContact CD1-SD 4.39Å
52	G	66.9	Low	70.1	Confident	39 Å²	39	68 Å²	68	40%	0.402	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	166	-179.2	179.2	0	0	0	0	0	111.8	S54 V55	G52-S54 PolarHBondContact O-N 2.95Å; G52-V55 CarbonylContact O-C 3.53Å; G52-V55 PolarHBondContact O-N 3.05Å
53	E	62.7	Low	68.8	Low	175 Å²	175	68.8 Å²	68.8	82%	0.818	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-27.1	-177.6	-69.5	-167.2	155	0	0	114.1	K59	E53-K59 PolarHBondContact O-NZ 3.14Å
54	S	60.2	Low	67.9	Low	78 Å²	78	64.8 Å²	64.8	55%	0.545	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	1.2	179.2	53.5	0	0	0	0	114.4	G52 F138	G52-S54 PolarHBondContact O-N 2.95Å; S54-F138 PolarHBondContact O-N 3.35Å
55	V	64.3	Low	67.3	Low	33 Å²	33	63.8 Å²	63.8	20%	0.2	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-128.1	70.5	178.1	-173.3	0	0	0	0	107.3	D50 L51 G52 F138	D50-V55 CarbonylContact C-O 3.47Å; D50-V55 VanDerWaalsContact CA-O 3.3Å; D50-V55 WeakPolarHBondContact CA-O 3.35Å; L51-V55 HydrophobicContact CB-CB 4.13Å; L51-V55 HydrophobicContact CB-CG1 3.86Å; L51-V55 HydrophobicContact CD1-CG1 4.26Å; L51-V55 HydrophobicContact CG-CG1 4.33Å; L51-V55 PolarHBondContact N-O 3.05Å; G52-V55 CarbonylContact O-C 3.53Å; G52-V55 PolarHBondContact O-N 3.05Å; V55-F138 WeakPolarHBondContact CA-O 3.4Å; V55-F138 HydrophobicContact CG1-CD1 4.33Å; V55-F138 WeakPolarHBondContact CG1-O 3.42Å; V55-F138 HydrophobicContact CG2-CB 4.41Å
56	S	67.7	Low	67.1	Low	7 Å²	7	62.9 Å²	62.9	5%	0.049	32%	0.323	C	S	.	.			trans	-122.5	112.8	-179.5	-179.4	0	0	0	0	112.5	D50 S58 K59 V60	D50-S56 VanDerWaalsContact CG-OG 3.3Å; D50-S56 WeakPolarHBondContact OD1-CA 3.4Å; D50-S56 WeakPolarHBondContact OD1-CB 3.28Å; D50-S56 PolarHBondContact OD1-OG 2.85Å; S56-S58 VanDerWaalsContact C-N 3.32Å; S56-S58 PolarHBondContact OG-N 3.05Å; S56-K59 PolarHBondContact OG-N 3.29Å; S56-K59 VanDerWaalsContact OG-N 3.09Å; S56-V60 WeakPolarHBondContact O-CG2 3.4Å; S56-V60 PolarHBondContact O-N 3.45Å
57	C	67.4	Low	67	Low	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-66.5	-37.8	167.6	-61.2	0	0	0	0	111.5	C49 D50 K59 V60 F61	C49-C57 HydrophobicContact CB-CB 4.26Å; C49-C57 WeakPolarHBondContact CB-SG 3.39Å; C49-C57 WeakPolarHBondContact SG-CB 3.4Å; C49-C57 CovalentContact SG-SG 2.04Å; C49-C57 PolarHBondContact SG-SG 3.05Å; D50-C57 PolarHBondContact OD1-N 2.89Å; C57-K59 PolarHBondContact O-N 2.95Å; C57-V60 PolarHBondContact O-N 3.4Å; C57-F61 HydrophobicContact CB-CD2 4.1Å; C57-F61 HydrophobicContact CB-CE2 3.87Å; C57-F61 WeakPolarHBondContact O-CD2 3.26Å; C57-F61 WeakPolarHBondContact O-CG 3.44Å; C57-F61 PolarHBondContact O-N 3Å
58	S	62.4	Low	67	Low	2 Å²	2	57.2 Å²	57.2	1%	0.014	30%	0.302	C	S	.	.	H	α-helix	trans	-60.5	-46.2	-178.7	-77.1	0	0	0	0	111.2	A47 D50 S56 V60 F61 T62	A47-S58 VanDerWaalsContact CB-OG 3.26Å; A47-S58 WeakPolarHBondContact CB-OG 3.22Å; A47-S58 PolarHBondContact N-OG 3.49Å; D50-S58 PolarHBondContact OD1-N 2.79Å; D50-S58 WeakPolarHBondContact OD2-CB 3.32Å; D50-S58 PolarHBondContact OD2-OG 3.24Å; D50-S58 VanDerWaalsContact OD2-OG 3.14Å; S56-S58 VanDerWaalsContact C-N 3.32Å; S56-S58 PolarHBondContact OG-N 3.05Å; S58-V60 PolarHBondContact O-N 2.91Å; S58-F61 PolarHBondContact O-N 2.79Å; S58-T62 PolarHBondContact O-N 2.78Å; S58-T62 VanDerWaalsContact O-N 3.09Å; S58-T62 PolarHBondContact O-OG1 3.43Å
59	K	63.6	Low	67.2	Low	91 Å²	91	50.1 Å²	50.1	40%	0.396	27%	0.267	S	S	.	.	H	α-helix	trans	-59.8	-46.2	174.7	-71.8	-178.5	-174.8	173.1	0	111.8	E53 S56 C57 F61 S63	E53-K59 PolarHBondContact O-NZ 3.14Å; S56-K59 PolarHBondContact OG-N 3.29Å; S56-K59 VanDerWaalsContact OG-N 3.09Å; C57-K59 PolarHBondContact O-N 2.95Å; K59-F61 PolarHBondContact O-N 3.4Å; K59-S63 WeakPolarHBondContact CA-OG 3.43Å; K59-S63 VanDerWaalsContact O-CA 3.3Å; K59-S63 WeakPolarHBondContact O-CA 3.48Å; K59-S63 WeakPolarHBondContact O-CB 3.5Å; K59-S63 PolarHBondContact O-N 2.93Å; K59-S63 PolarHBondContact O-OG 3.42Å
60	V	67.4	Low	67.3	Low	10 Å²	10	52.6 Å²	52.6	6%	0.061	28%	0.277	C	S	.	.	H	α-helix	trans	-61.2	-42.4	-178.9	167	0	0	0	0	112.6	S56 C57 S58 S64 L131 L135 D137 C139	S56-V60 WeakPolarHBondContact O-CG2 3.4Å; S56-V60 PolarHBondContact O-N 3.45Å; C57-V60 PolarHBondContact O-N 3.4Å; S58-V60 PolarHBondContact O-N 2.91Å; V60-S64 VanDerWaalsContact O-CB 3.23Å; V60-S64 WeakPolarHBondContact O-CB 3.3Å; V60-S64 PolarHBondContact O-OG 3.28Å; V60-L131 HydrophobicContact CB-CD2 4.21Å; V60-L131 HydrophobicContact CG1-CD2 3.62Å; V60-L131 HydrophobicContact CG2-CD2 3.48Å; V60-L131 VanDerWaalsContact CG2-CD2 3.48Å; V60-L135 HydrophobicContact CB-CD2 4.32Å; V60-L135 HydrophobicContact CG2-CD2 3.88Å; V60-D137 HydrophobicContact CG2-CB 3.82Å; V60-C139 HydrophobicContact CB-CB 4.42Å; V60-C139 HydrophobicContact CG1-CB 4.27Å; V60-C139 HydrophobicContact CG2-CB 4.14Å
61	F	59.2	Low	67.1	Low	29 Å²	29	51 Å²	51	13%	0.127	27%	0.268	C	S	.	.	H	α-helix	trans	-78	-33.9	-176.6	-65.3	-45.4	0	0	0	113.4	A32 V35 E36 C57 S58 K59 V141	A32-F61 HydrophobicContact CB-CE1 4.4Å; A32-F61 HydrophobicContact CB-CE2 4Å; A32-F61 HydrophobicContact CB-CZ 3.79Å; V35-F61 HydrophobicContact CG1-CD2 4.08Å; E36-F61 HydrophobicContact CB-CB 4.44Å; E36-F61 HydrophobicContact CG-CB 4.49Å; C57-F61 HydrophobicContact CB-CD2 4.1Å; C57-F61 HydrophobicContact CB-CE2 3.87Å; C57-F61 WeakPolarHBondContact O-CD2 3.26Å; C57-F61 WeakPolarHBondContact O-CG 3.44Å; C57-F61 PolarHBondContact O-N 3Å; S58-F61 PolarHBondContact O-N 2.79Å; K59-F61 PolarHBondContact O-N 3.4Å; F61-V141 HydrophobicContact CZ-CG1 4.39Å
62	T	58.8	Low	67	Low	62 Å²	62	49.7 Å²	49.7	38%	0.38	26%	0.261	S	S	.	.	H	α-helix	trans	-106.3	-26.9	-177.1	60.2	0	0	0	0	115.5	R39 S58 S64	R39-T62 HydrophobicContact CB-CG2 3.38Å; R39-T62 HydrophobicContact CG-CG2 4.05Å; S58-T62 PolarHBondContact O-N 2.78Å; S58-T62 VanDerWaalsContact O-N 3.09Å; S58-T62 PolarHBondContact O-OG1 3.43Å; T62-S64 VanDerWaalsContact C-N 3.3Å
63	S	56.1	Low	66.9	Low	92 Å²	92	49.6 Å²	49.6	64%	0.643	25%	0.253	S	S	*	.	S	Bend	trans	-88.1	-2.1	-176.9	-44.4	0	0	0	0	112.7	K59	K59-S63 WeakPolarHBondContact CA-OG 3.43Å; K59-S63 VanDerWaalsContact O-CA 3.3Å; K59-S63 WeakPolarHBondContact O-CA 3.48Å; K59-S63 WeakPolarHBondContact O-CB 3.5Å; K59-S63 PolarHBondContact O-N 2.93Å; K59-S63 PolarHBondContact O-OG 3.42Å
64	S	59.1	Low	66.9	Low	13 Å²	13	44.2 Å²	44.2	9%	0.091	23%	0.228	C	C	.	.			trans	-121.8	121.4	-171.2	107.1	0	0	0	0	109.2	V60 T62 W66 G67	V60-S64 VanDerWaalsContact O-CB 3.23Å; V60-S64 WeakPolarHBondContact O-CB 3.3Å; V60-S64 PolarHBondContact O-OG 3.28Å; T62-S64 VanDerWaalsContact C-N 3.3Å; S64-W66 PolarHBondContact O-N 3.2Å; S64-W66 PolarHBondContact OG-N 3.34Å; S64-G67 PolarHBondContact O-N 3.26Å; S64-G67 PolarHBondContact OG-N 3.33Å
65	R	69.4	Low	66.8	Low	134 Å²	134	46.9 Å²	46.9	51%	0.506	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-14.1	169.1	68.3	-178.9	-177.2	167.8	0.4	112.9	G71	R65-G71 WeakPolarHBondContact O-CA 3.36Å
66	W	73.9	Confident	66.5	Low	35 Å²	35	53.7 Å²	53.7	13%	0.133	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-11.7	-179.2	-58.6	-89.2	0	0	0	113.9	S64 R68 N87 Y126 L127 I130 V134 L135	S64-W66 PolarHBondContact O-N 3.2Å; S64-W66 PolarHBondContact OG-N 3.34Å; W66-R68 VanDerWaalsContact C-N 3.3Å; W66-R68 PolarHBondContact O-N 2.9Å; W66-N87 PolarHBondContact O-ND2 3.3Å; W66-Y126 VanDerWaalsContact CD1-OH 3.3Å; W66-Y126 PolarHBondContact NE1-OH 3.28Å; W66-L127 HydrophobicContact CB-CD2 4.33Å; W66-I130 HydrophobicContact CD2-CG2 3.85Å; W66-I130 HydrophobicContact CE3-CG2 4.18Å; W66-I130 HydrophobicContact CG-CG2 4.02Å; W66-I130 HydrophobicContact CZ2-CD1 4.41Å; W66-V134 HydrophobicContact CH2-CG1 3.77Å; W66-V134 HydrophobicContact CZ2-CG1 4.27Å; W66-V134 HydrophobicContact CZ3-CG1 4.37Å; W66-L135 HydrophobicContact CE3-CD1 4.1Å; W66-L135 HydrophobicContact CZ3-CD1 3.91Å
67	G	73.3	Confident	65.8	Low	5 Å²	5	55.7 Å²	55.7	5%	0.052	27%	0.269	C	S	.	.	S	Bend	trans	-66.4	-27.6	175.9	0	0	0	0	0	114.1	S64 N87	S64-G67 PolarHBondContact O-N 3.26Å; S64-G67 PolarHBondContact OG-N 3.33Å; G67-N87 WeakPolarHBondContact O-CB 3.18Å; G67-N87 PolarHBondContact O-N 2.89Å; G67-N87 PolarHBondContact O-ND2 2.93Å; G67-N87 PolarHBondContact O-OD1 3.47Å
68	R	77.8	Confident	65.1	Low	87 Å²	87	59.1 Å²	59.1	33%	0.328	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-110.3	136.8	172.5	-74.4	-166.1	161.7	86.8	0.7	111.8	E40 W66 F70 G71 Q85	E40-R68 VanDerWaalsContact CD-NH2 3.32Å; E40-R68 IonicContact OE1-CZ 2.6Å; E40-R68 IonicContact OE1-NH1 3.15Å; E40-R68 PolarHBondContact OE1-NH1 3.01Å; E40-R68 IonicContact OE1-NH2 3.03Å; E40-R68 PolarHBondContact OE1-NH2 2.75Å; E40-R68 IonicContact OE2-NH2 3.31Å; E40-R68 PolarHBondContact OE2-NH2 3.49Å; E40-R68 VanDerWaalsContact OE2-NH2 3.15Å; W66-R68 VanDerWaalsContact C-N 3.3Å; W66-R68 PolarHBondContact O-N 2.9Å; R68-F70 PolarHBondContact O-N 3.31Å; R68-G71 PolarHBondContact O-N 3.18Å; R68-Q85 WeakPolarHBondContact CA-O 3.5Å
69	G	75.8	Confident	64.7	Low	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	51.4	32.2	172.4	0	0	0	0	0	114.2	G71 L72 V73 Q85 N87	G69-G71 PolarHBondContact O-N 2.89Å; G69-L72 PolarHBondContact O-N 2.95Å; G69-L72 VanDerWaalsContact O-N 3.08Å; G69-V73 WeakPolarHBondContact O-CG2 3.35Å; G69-V73 PolarHBondContact O-N 3.06Å; G69-V73 VanDerWaalsContact O-N 3.13Å; G69-Q85 PolarHBondContact N-O 3.49Å; G69-N87 PolarHBondContact N-OD1 3.49Å
70	F	79.1	Confident	64.4	Low	66 Å²	66	69.5 Å²	69.5	29%	0.289	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	53.7	14.4	-171.9	-58.4	-90.4	0	0	0	114.9	R68 L72 N87 L90 Y126 L127	R68-F70 PolarHBondContact O-N 3.31Å; F70-L72 HydrophobicContact CB-CD1 4.48Å; F70-L72 PolarHBondContact O-N 3.33Å; F70-L72 VanDerWaalsContact O-N 3.15Å; F70-N87 PolarHBondContact N-OD1 2.92Å; F70-L90 HydrophobicContact CD2-CD1 4.1Å; F70-L90 HydrophobicContact CE2-CD1 3.46Å; F70-L90 VanDerWaalsContact CE2-CD1 3.46Å; F70-L90 HydrophobicContact CZ-CD1 4.28Å; F70-Y126 HydrophobicContact CB-CE1 4.3Å; F70-Y126 WeakPolarHBondContact O-CE1 3.4Å; F70-L127 HydrophobicContact CD1-CD1 3.81Å; F70-L127 HydrophobicContact CD1-CD2 4.16Å; F70-L127 HydrophobicContact CD1-CG 3.97Å; F70-L127 HydrophobicContact CE1-CD1 3.81Å; F70-L127 HydrophobicContact CE1-CG 4.36Å
71	G	71.9	Confident	64.1	Low	1 Å²	1	70.7 Å²	70.7	1%	0.01	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	66.5	6.2	-172	0	0	0	0	0	114.9	R65 R68 G69 Q74 F75	R65-G71 WeakPolarHBondContact O-CA 3.36Å; R68-G71 PolarHBondContact O-N 3.18Å; G69-G71 PolarHBondContact O-N 2.89Å; G71-Q74 PolarHBondContact O-NE2 3.15Å; G71-F75 VanDerWaalsContact O-CE2 3.3Å; G71-F75 WeakPolarHBondContact O-CE2 3.33Å
72	L	70.1	Confident	64.2	Low	84 Å²	84	74.9 Å²	74.9	44%	0.44	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-36.7	-178.6	-65.2	174.4	0	0	0	111.9	G69 F70 Q74 F75 Y126	G69-L72 PolarHBondContact O-N 2.95Å; G69-L72 VanDerWaalsContact O-N 3.08Å; F70-L72 HydrophobicContact CB-CD1 4.48Å; F70-L72 PolarHBondContact O-N 3.33Å; F70-L72 VanDerWaalsContact O-N 3.15Å; L72-Q74 PolarHBondContact O-N 3.4Å; L72-F75 PolarHBondContact O-N 3.38Å; L72-F75 VanDerWaalsContact O-N 3.11Å; L72-Y126 HydrophobicContact CD1-CE1 4.38Å
73	V	65.9	Low	64.3	Low	37 Å²	37	77.1 Å²	77.1	22%	0.224	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-62.6	-31.8	-174.9	175.8	0	0	0	0	112.2	G69 F75 F76 V77 L83	G69-V73 WeakPolarHBondContact O-CG2 3.35Å; G69-V73 PolarHBondContact O-N 3.06Å; G69-V73 VanDerWaalsContact O-N 3.13Å; V73-F75 PolarHBondContact O-N 3.25Å; V73-F75 VanDerWaalsContact O-N 3.13Å; V73-F76 PolarHBondContact O-N 2.93Å; V73-F76 VanDerWaalsContact O-N 3.1Å; V73-V77 HydrophobicContact CG1-CB 4.2Å; V73-V77 HydrophobicContact CG1-CG2 4.22Å; V73-V77 PolarHBondContact O-N 3.4Å; V73-L83 HydrophobicContact CG1-CB 4.03Å
74	Q	60.7	Low	65.1	Low	63 Å²	63	74.2 Å²	74.2	29%	0.294	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-61.6	-17.6	176.7	67.5	-174.7	-19.7	0	0	115.1	G71 L72	G71-Q74 PolarHBondContact O-NE2 3.15Å; L72-Q74 PolarHBondContact O-N 3.4Å
75	F	59.1	Low	66.1	Low	133 Å²	133	77 Å²	77	58%	0.583	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-86.1	-17.2	177.6	-69.1	-76.6	0	0	0	113.1	G71 L72 V73	G71-F75 VanDerWaalsContact O-CE2 3.3Å; G71-F75 WeakPolarHBondContact O-CE2 3.33Å; L72-F75 PolarHBondContact O-N 3.38Å; L72-F75 VanDerWaalsContact O-N 3.11Å; V73-F75 PolarHBondContact O-N 3.25Å; V73-F75 VanDerWaalsContact O-N 3.13Å
76	F	58.1	Low	66.8	Low	177 Å²	177	70.9 Å²	70.9	78%	0.776	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	-16.5	-174.4	-64.5	-80.5	0	0	0	113.3	V73	V73-F76 PolarHBondContact O-N 2.93Å; V73-F76 VanDerWaalsContact O-N 3.1Å
77	V	52.6	Low	67.5	Low	49 Å²	49	70.6 Å²	70.6	30%	0.297	36%	0.362	S	S	.	.	S	Bend	trans	-139.5	142.4	-173.4	-169.6	0	0	0	0	109.7	V73 S81	V73-V77 HydrophobicContact CG1-CB 4.2Å; V73-V77 HydrophobicContact CG1-CG2 4.22Å; V73-V77 PolarHBondContact O-N 3.4Å; V77-S81 WeakPolarHBondContact CG1-OG 3.4Å
78	A	53.8	Low	68.3	Low	71 Å²	71	70.8 Å²	70.8	59%	0.587	36%	0.363	S	S	*	.			trans	-51.2	141.8	175.5	0	0	0	0	0	111.2	D80 S81	A78-D80 PolarHBondContact O-N 3.16Å; A78-S81 WeakPolarHBondContact O-CB 3.44Å; A78-S81 PolarHBondContact O-N 3.23Å
79	K	54	Low	68.9	Low	154 Å²	154	68.8 Å²	68.8	67%	0.67	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-28.7	-174.7	-74.9	-177.3	176.6	179.4	0	113.6	S81 N84	K79-S81 VanDerWaalsContact C-N 3.33Å; K79-N84 PolarHBondContact O-ND2 3.37Å; K79-N84 VanDerWaalsContact O-ND2 3.11Å
80	D	56.3	Low	69.6	Low	158 Å²	158	71.6 Å²	71.6	85%	0.845	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	4.8	-177.4	-44.6	-41.9	0	0	0	113.3	A78	A78-D80 PolarHBondContact O-N 3.16Å
81	S	61.3	Low	70.2	Confident	35 Å²	35	69.2 Å²	69.2	25%	0.245	37%	0.369	C	S	.	.	S	Bend	trans	-72.8	144.3	179.6	-177.3	0	0	0	0	111.8	V77 A78 K79 L83 N84	V77-S81 WeakPolarHBondContact CG1-OG 3.4Å; A78-S81 WeakPolarHBondContact O-CB 3.44Å; A78-S81 PolarHBondContact O-N 3.23Å; K79-S81 VanDerWaalsContact C-N 3.33Å; S81-L83 PolarHBondContact O-N 3.29Å; S81-L83 PolarHBondContact OG-N 3.41Å; S81-N84 PolarHBondContact O-N 2.91Å
82	V	60.4	Low	71.3	Confident	116 Å²	116	71.1 Å²	71.1	70%	0.703	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-20.7	174.4	-177.7	0	0	0	0	112.2	Q85	V82-Q85 VanDerWaalsContact O-CG 3.23Å; V82-Q85 WeakPolarHBondContact O-CG 3.4Å; V82-Q85 PolarHBondContact O-NE2 2.77Å; V82-Q85 VanDerWaalsContact O-NE2 3.11Å
83	L	61.7	Low	72.5	Confident	110 Å²	110	72 Å²	72	58%	0.576	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-19.3	176.9	-85.4	75	0	0	0	114.4	V73 S81 Q85	V73-L83 HydrophobicContact CG1-CB 4.03Å; S81-L83 PolarHBondContact O-N 3.29Å; S81-L83 PolarHBondContact OG-N 3.41Å; L83-Q85 PolarHBondContact O-N 2.92Å
84	N	72.3	Confident	73.9	Confident	30 Å²	30	71.3 Å²	71.3	16%	0.16	38%	0.377	C	S	.	.			trans	-87.2	56.9	-179.8	-170.1	28.4	0	0	0	111.7	K79 S81	K79-N84 PolarHBondContact O-ND2 3.37Å; K79-N84 VanDerWaalsContact O-ND2 3.11Å; S81-N84 PolarHBondContact O-N 2.91Å
85	Q	80.8	Confident	75.7	Confident	72 Å²	72	68.6 Å²	68.6	34%	0.336	36%	0.364	S	S	.	.			trans	-85.6	155.7	179.7	-65.5	-60.9	-29.3	0	0	112	R68 G69 V82 L83 N87 V89	R68-Q85 WeakPolarHBondContact CA-O 3.5Å; G69-Q85 PolarHBondContact N-O 3.49Å; V82-Q85 VanDerWaalsContact O-CG 3.23Å; V82-Q85 WeakPolarHBondContact O-CG 3.4Å; V82-Q85 PolarHBondContact O-NE2 2.77Å; V82-Q85 VanDerWaalsContact O-NE2 3.11Å; L83-Q85 PolarHBondContact O-N 2.92Å; Q85-N87 PolarHBondContact O-N 3.46Å; Q85-V89 HydrophobicContact CB-CB 4.19Å; Q85-V89 HydrophobicContact CB-CG1 4.25Å; Q85-V89 HydrophobicContact CG-CG1 4.44Å
86	P	84.9	Confident	77.4	Confident	5 Å²	5	65.8 Å²	65.8	3%	0.032	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-45.2	136.8	161.9	-31.6	39.2	0	0	0	112.3	L33 E36 S88 V89 L90	L33-P86 HydrophobicContact CD1-CB 4.12Å; L33-P86 HydrophobicContact CD1-CG 4.13Å; E36-P86 WeakPolarHBondContact OE1-CB 3.45Å; E36-P86 WeakPolarHBondContact OE2-CB 3.48Å; P86-S88 VanDerWaalsContact CB-OG 3.23Å; P86-S88 WeakPolarHBondContact CB-OG 3.41Å; P86-S88 PolarHBondContact O-N 2.97Å; P86-S88 VanDerWaalsContact O-N 3.15Å; P86-V89 HydrophobicContact CB-CB 4.46Å; P86-V89 HydrophobicContact CB-CG2 4Å; P86-V89 HydrophobicContact CG-CG2 4.18Å; P86-V89 WeakPolarHBondContact O-CB 3.37Å; P86-V89 PolarHBondContact O-N 3.29Å; P86-L90 PolarHBondContact O-N 3.17Å
87	N	88.3	Confident	79.1	Confident	29 Å²	29	61.6 Å²	61.6	16%	0.155	34%	0.343	C	S	.	.	H	α-helix	trans	-59	-30	175.7	-67.3	-17.1	0	0	0	111.4	W66 G67 G69 F70 Q85 V89 L90 G91	W66-N87 PolarHBondContact O-ND2 3.3Å; G67-N87 WeakPolarHBondContact O-CB 3.18Å; G67-N87 PolarHBondContact O-N 2.89Å; G67-N87 PolarHBondContact O-ND2 2.93Å; G67-N87 PolarHBondContact O-OD1 3.47Å; G69-N87 PolarHBondContact N-OD1 3.49Å; F70-N87 PolarHBondContact N-OD1 2.92Å; Q85-N87 PolarHBondContact O-N 3.46Å; N87-V89 VanDerWaalsContact C-N 3.32Å; N87-V89 PolarHBondContact O-N 3.14Å; N87-L90 WeakPolarHBondContact O-CB 3.29Å; N87-L90 PolarHBondContact O-N 3.33Å; N87-G91 PolarHBondContact O-N 2.94Å
88	S	89.1	Confident	81.2	Confident	9 Å²	9	59.3 Å²	59.3	6%	0.063	33%	0.329	C	S	.	.	H	α-helix	trans	-59.6	-37.6	173.9	53.1	0	0	0	0	112.6	S29 L33 E36 P86 G91 I92	S29-S88 WeakPolarHBondContact O-CB 3.21Å; L33-S88 WeakPolarHBondContact CA-OG 3.32Å; E36-S88 PolarHBondContact OE2-OG 2.9Å; P86-S88 VanDerWaalsContact CB-OG 3.23Å; P86-S88 WeakPolarHBondContact CB-OG 3.41Å; P86-S88 PolarHBondContact O-N 2.97Å; P86-S88 VanDerWaalsContact O-N 3.15Å; S88-G91 PolarHBondContact O-N 3.39Å; S88-I92 WeakPolarHBondContact O-CG1 3.37Å; S88-I92 PolarHBondContact O-N 3.07Å
89	V	90.9	Very high	83.1	Confident	45 Å²	45	58.7 Å²	58.7	27%	0.273	32%	0.315	S	S	.	.	H	α-helix	trans	-66.8	-42.3	173.1	173.2	0	0	0	0	111.3	L33 Q85 P86 N87 G91 I92 L93	L33-V89 HydrophobicContact CD1-CG2 3.87Å; L33-V89 HydrophobicContact CD2-CG2 4.01Å; Q85-V89 HydrophobicContact CB-CB 4.19Å; Q85-V89 HydrophobicContact CB-CG1 4.25Å; Q85-V89 HydrophobicContact CG-CG1 4.44Å; P86-V89 HydrophobicContact CB-CB 4.46Å; P86-V89 HydrophobicContact CB-CG2 4Å; P86-V89 HydrophobicContact CG-CG2 4.18Å; P86-V89 WeakPolarHBondContact O-CB 3.37Å; P86-V89 PolarHBondContact O-N 3.29Å; N87-V89 VanDerWaalsContact C-N 3.32Å; N87-V89 PolarHBondContact O-N 3.14Å; V89-G91 VanDerWaalsContact C-N 3.25Å; V89-G91 PolarHBondContact O-N 2.95Å; V89-I92 PolarHBondContact O-N 3.06Å; V89-L93 PolarHBondContact O-N 3.36Å
90	L	89.9	Confident	85	Confident	60 Å²	60	53.3 Å²	53.3	31%	0.314	30%	0.303	S	S	.	.	H	α-helix	trans	-62.6	-36.4	174.8	-59.8	179.2	0	0	0	111.3	F70 P86 N87 F94	F70-L90 HydrophobicContact CD2-CD1 4.1Å; F70-L90 HydrophobicContact CE2-CD1 3.46Å; F70-L90 VanDerWaalsContact CE2-CD1 3.46Å; F70-L90 HydrophobicContact CZ-CD1 4.28Å; P86-L90 PolarHBondContact O-N 3.17Å; N87-L90 WeakPolarHBondContact O-CB 3.29Å; N87-L90 PolarHBondContact O-N 3.33Å; L90-F94 VanDerWaalsContact O-CB 3.27Å; L90-F94 WeakPolarHBondContact O-CB 3.44Å; L90-F94 PolarHBondContact O-N 3.48Å
91	G	93.1	Very high	86.7	Confident	15 Å²	15	48.6 Å²	48.6	16%	0.155	28%	0.277	C	S	.	.	H	α-helix	trans	-59.9	-51	171	0	0	0	0	0	112.6	N87 S88 V89 L93 F94 Y95	N87-G91 PolarHBondContact O-N 2.94Å; S88-G91 PolarHBondContact O-N 3.39Å; V89-G91 VanDerWaalsContact C-N 3.25Å; V89-G91 PolarHBondContact O-N 2.95Å; G91-L93 VanDerWaalsContact C-N 3.32Å; G91-L93 PolarHBondContact O-N 3.07Å; G91-F94 WeakPolarHBondContact O-CB 3.07Å; G91-F94 PolarHBondContact O-N 3.43Å; G91-F94 VanDerWaalsContact O-N 3.14Å; G91-Y95 WeakPolarHBondContact O-CD2 3.13Å; G91-Y95 PolarHBondContact O-N 2.87Å
92	I	95.3	Very high	88.1	Confident	42 Å²	42	47 Å²	47	22%	0.215	27%	0.267	C	S	.	.	H	α-helix	trans	-54.8	-48.6	176.9	-69.1	165.6	0	0	0	110.9	L26 V30 L33 S88 V89 F94 T96	L26-I92 HydrophobicContact CD1-CB 4.28Å; L26-I92 HydrophobicContact CD1-CG1 4.27Å; L26-I92 HydrophobicContact CD1-CG2 3.92Å; V30-I92 HydrophobicContact CG2-CD1 3.95Å; V30-I92 HydrophobicContact CG2-CG1 4.07Å; L33-I92 HydrophobicContact CD2-CD1 3.79Å; S88-I92 WeakPolarHBondContact O-CG1 3.37Å; S88-I92 PolarHBondContact O-N 3.07Å; V89-I92 PolarHBondContact O-N 3.06Å; I92-F94 PolarHBondContact O-N 3.33Å; I92-T96 WeakPolarHBondContact O-CB 3.03Å; I92-T96 PolarHBondContact O-N 3.44Å; I92-T96 PolarHBondContact O-OG1 3.21Å
93	L	94.3	Very high	89.5	Confident	102 Å²	102	47.8 Å²	47.8	53%	0.534	27%	0.266	S	S	.	.	H	α-helix	trans	-60.7	-46.8	177.8	-179.7	63.4	0	0	0	111.1	V89 G91 T96 L97	V89-L93 PolarHBondContact O-N 3.36Å; G91-L93 VanDerWaalsContact C-N 3.32Å; G91-L93 PolarHBondContact O-N 3.07Å; L93-T96 PolarHBondContact O-N 3.18Å; L93-L97 HydrophobicContact CD1-CD1 3.96Å; L93-L97 HydrophobicContact CD1-CG 4.17Å; L93-L97 HydrophobicContact CG-CD1 3.88Å; L93-L97 HydrophobicContact CG-CG 4.46Å; L93-L97 WeakPolarHBondContact O-CB 3.46Å; L93-L97 VanDerWaalsContact O-CG 3.25Å; L93-L97 WeakPolarHBondContact O-CG 3.41Å; L93-L97 PolarHBondContact O-N 3.34Å
94	F	95.8	Very high	90.8	Very high	23 Å²	23	44.8 Å²	44.8	10%	0.101	26%	0.255	C	S	.	.	H	α-helix	trans	-58.5	-52.6	179.2	168.6	-103	0	0	0	112.4	L90 G91 I92 T96 L97 Q98 C116 N149 L152	L90-F94 VanDerWaalsContact O-CB 3.27Å; L90-F94 WeakPolarHBondContact O-CB 3.44Å; L90-F94 PolarHBondContact O-N 3.48Å; G91-F94 WeakPolarHBondContact O-CB 3.07Å; G91-F94 PolarHBondContact O-N 3.43Å; G91-F94 VanDerWaalsContact O-N 3.14Å; I92-F94 PolarHBondContact O-N 3.33Å; F94-T96 VanDerWaalsContact C-N 3.33Å; F94-T96 PolarHBondContact O-N 3.41Å; F94-L97 PolarHBondContact O-N 3.15Å; F94-Q98 HydrophobicContact CD1-CG 4.37Å; F94-Q98 HydrophobicContact CD2-CG 4.07Å; F94-Q98 HydrophobicContact CE1-CG 4.01Å; F94-Q98 HydrophobicContact CE2-CG 3.7Å; F94-Q98 HydrophobicContact CG-CG 4.4Å; F94-Q98 HydrophobicContact CZ-CG 3.66Å; F94-Q98 WeakPolarHBondContact O-CB 3.37Å; F94-Q98 WeakPolarHBondContact O-CG 3.38Å; F94-Q98 PolarHBondContact O-N 2.85Å; F94-C116 HydrophobicContact CE2-CB 4.36Å; F94-C116 WeakPolarHBondContact CE2-O 3.44Å; F94-N149 VanDerWaalsContact CE1-OD1 3.25Å; F94-N149 WeakPolarHBondContact CE1-OD1 3.48Å; F94-L152 HydrophobicContact CE1-CD1 3.91Å; F94-L152 HydrophobicContact CZ-CD1 4.3Å
95	Y	97.3	Very high	91.4	Very high	5 Å²	5	47.6 Å²	47.6	2%	0.02	27%	0.27	C	S	.	.	H	α-helix	trans	-66.2	-36.7	-177.9	-66.6	-62.7	0	0	0	112	G25 S29 G91 Q98 M99 I148 N149 L152	G25-Y95 VanDerWaalsContact CA-CZ 3.46Å; G25-Y95 VanDerWaalsContact O-CD2 3.27Å; G25-Y95 WeakPolarHBondContact O-CD2 3.41Å; G25-Y95 WeakPolarHBondContact O-CE2 3.49Å; S29-Y95 WeakPolarHBondContact OG-CD2 3.34Å; S29-Y95 WeakPolarHBondContact OG-CE2 3.25Å; G91-Y95 WeakPolarHBondContact O-CD2 3.13Å; G91-Y95 PolarHBondContact O-N 2.87Å; Y95-Q98 PolarHBondContact O-N 3.38Å; Y95-M99 WeakPolarHBondContact O-CG 3.39Å; Y95-M99 PolarHBondContact O-N 3.25Å; Y95-I148 HydrophobicContact CE1-CG2 3.71Å; Y95-N149 PolarHBondContact OH-OD1 3.27Å; Y95-N149 VanDerWaalsContact OH-OD1 3.07Å; Y95-L152 HydrophobicContact CD1-CD1 3.78Å; Y95-L152 HydrophobicContact CE1-CD1 3.6Å
96	T	95.8	Very high	91.8	Very high	75 Å²	75	46.6 Å²	46.6	46%	0.46	27%	0.27	S	S	.	.	H	α-helix	trans	-63.3	-46.5	174.6	-55.4	0	0	0	0	111.3	I92 L93 F94 Q98 M99 G100	I92-T96 WeakPolarHBondContact O-CB 3.03Å; I92-T96 PolarHBondContact O-N 3.44Å; I92-T96 PolarHBondContact O-OG1 3.21Å; L93-T96 PolarHBondContact O-N 3.18Å; F94-T96 VanDerWaalsContact C-N 3.33Å; F94-T96 PolarHBondContact O-N 3.41Å; T96-Q98 PolarHBondContact O-N 2.94Å; T96-M99 PolarHBondContact O-N 3.04Å; T96-G100 PolarHBondContact O-N 3.06Å
97	L	94.3	Very high	92	Very high	89 Å²	89	50.6 Å²	50.6	47%	0.466	29%	0.287	S	S	.	.	H	α-helix	trans	-63.9	-39.3	176.2	-72.8	172.8	0	0	0	112.1	L93 F94 M99 G100 L101	L93-L97 HydrophobicContact CD1-CD1 3.96Å; L93-L97 HydrophobicContact CD1-CG 4.17Å; L93-L97 HydrophobicContact CG-CD1 3.88Å; L93-L97 HydrophobicContact CG-CG 4.46Å; L93-L97 WeakPolarHBondContact O-CB 3.46Å; L93-L97 VanDerWaalsContact O-CG 3.25Å; L93-L97 WeakPolarHBondContact O-CG 3.41Å; L93-L97 PolarHBondContact O-N 3.34Å; F94-L97 PolarHBondContact O-N 3.15Å; L97-M99 VanDerWaalsContact C-N 3.32Å; L97-M99 PolarHBondContact O-N 2.93Å; L97-G100 PolarHBondContact O-N 3.28Å; L97-L101 VanDerWaalsContact O-CB 3.29Å; L97-L101 WeakPolarHBondContact O-CB 3.21Å; L97-L101 WeakPolarHBondContact O-CG 3.2Å; L97-L101 PolarHBondContact O-N 3.36Å
98	Q	95.3	Very high	92.3	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-61	-38.8	176.5	-77.9	-76.5	-17.3	0	0	112.8	R18 F94 Y95 T96 G102 L113 C116 S117 N156	R18-Q98 PolarHBondContact NH1-O 3.25Å; F94-Q98 HydrophobicContact CD1-CG 4.37Å; F94-Q98 HydrophobicContact CD2-CG 4.07Å; F94-Q98 HydrophobicContact CE1-CG 4.01Å; F94-Q98 HydrophobicContact CE2-CG 3.7Å; F94-Q98 HydrophobicContact CG-CG 4.4Å; F94-Q98 HydrophobicContact CZ-CG 3.66Å; F94-Q98 WeakPolarHBondContact O-CB 3.37Å; F94-Q98 WeakPolarHBondContact O-CG 3.38Å; F94-Q98 PolarHBondContact O-N 2.85Å; Y95-Q98 PolarHBondContact O-N 3.38Å; T96-Q98 PolarHBondContact O-N 2.94Å; Q98-G102 PolarHBondContact O-N 3.05Å; Q98-L113 PolarHBondContact NE2-O 2.65Å; Q98-C116 PolarHBondContact NE2-SG 3.1Å; Q98-S117 PolarHBondContact NE2-OG 3.2Å; Q98-N156 PolarHBondContact NE2-ND2 2.86Å; Q98-N156 PolarHBondContact OE1-ND2 3.03Å
99	M	93.6	Very high	92.5	Very high	58 Å²	58	57.7 Å²	57.7	29%	0.286	32%	0.317	S	S	.	.	H	α-helix	trans	-71.9	-48.9	174.8	-69.7	-178.1	69	0	0	111.1	L23 Y95 T96 L97 G102 L103	L23-M99 HydrophobicContact CD2-CE 4.17Å; L23-M99 HydrophobicContact CD2-SD 4.44Å; L23-M99 HydrophobicContact CG-CE 4.36Å; Y95-M99 WeakPolarHBondContact O-CG 3.39Å; Y95-M99 PolarHBondContact O-N 3.25Å; T96-M99 PolarHBondContact O-N 3.04Å; L97-M99 VanDerWaalsContact C-N 3.32Å; L97-M99 PolarHBondContact O-N 2.93Å; M99-G102 WeakPolarHBondContact O-CA 3.47Å; M99-G102 PolarHBondContact O-N 2.95Å; M99-G102 VanDerWaalsContact O-N 3.15Å; M99-L103 PolarHBondContact O-N 2.98Å
100	G	93.5	Very high	92.6	Very high	41 Å²	41	55.6 Å²	55.6	42%	0.423	31%	0.305	S	S	.	.	H	α-helix	trans	-61.1	-49.5	-179.1	0	0	0	0	0	113.4	T96 L97 G102 L103	T96-G100 PolarHBondContact O-N 3.06Å; L97-G100 PolarHBondContact O-N 3.28Å; G100-G102 PolarHBondContact O-N 3.49Å; G100-L103 WeakPolarHBondContact O-CB 3.47Å; G100-L103 PolarHBondContact O-N 3.37Å
101	L	92.5	Very high	92.8	Very high	58 Å²	58	56.1 Å²	56.1	30%	0.304	31%	0.308	S	S	.	.	H	α-helix	trans	-66.1	-27.7	175.6	-68.8	175.1	0	0	0	112.3	L97 L103 S104 A109 A112 L113	L97-L101 VanDerWaalsContact O-CB 3.29Å; L97-L101 WeakPolarHBondContact O-CB 3.21Å; L97-L101 WeakPolarHBondContact O-CG 3.2Å; L97-L101 PolarHBondContact O-N 3.36Å; L101-L103 PolarHBondContact O-N 2.89Å; L101-S104 PolarHBondContact O-N 3.44Å; L101-A109 HydrophobicContact CD2-CB 4.48Å; L101-A112 HydrophobicContact CD1-CB 4.16Å; L101-L113 HydrophobicContact CB-CD1 4.24Å; L101-L113 HydrophobicContact CB-CD2 3.66Å; L101-L113 HydrophobicContact CB-CG 3.79Å; L101-L113 HydrophobicContact CD1-CD2 4.31Å; L101-L113 HydrophobicContact CD1-CG 4.39Å
102	G	90.2	Very high	92.9	Very high	3 Å²	3	57.3 Å²	57.3	3%	0.031	32%	0.316	C	S	.	.	H	α-helix	trans	-63.9	-19.4	174.7	0	0	0	0	0	114.3	Q98 M99 G100 S104 R159	Q98-G102 PolarHBondContact O-N 3.05Å; M99-G102 WeakPolarHBondContact O-CA 3.47Å; M99-G102 PolarHBondContact O-N 2.95Å; M99-G102 VanDerWaalsContact O-N 3.15Å; G100-G102 PolarHBondContact O-N 3.49Å; G102-S104 VanDerWaalsContact C-N 3.27Å; G102-R159 PolarHBondContact O-NH2 3.43Å
103	L	90.2	Very high	93	Very high	131 Å²	131	55.3 Å²	55.3	69%	0.686	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-19.5	173.4	-56.1	177.8	0	0	0	112.4	M99 G100 L101	M99-L103 PolarHBondContact O-N 2.98Å; G100-L103 WeakPolarHBondContact O-CB 3.47Å; G100-L103 PolarHBondContact O-N 3.37Å; L101-L103 PolarHBondContact O-N 2.89Å
104	S	88.8	Confident	93.1	Very high	48 Å²	48	50.7 Å²	50.7	34%	0.336	28%	0.281	S	S	.	.			trans	-91.5	139.4	-179.1	-171.6	0	0	0	0	112.5	L101 G102 S106 R159	L101-S104 PolarHBondContact O-N 3.44Å; G102-S104 VanDerWaalsContact C-N 3.27Å; S104-S106 WeakPolarHBondContact OG-CB 3.41Å; S104-S106 PolarHBondContact OG-N 2.83Å; S104-R159 PolarHBondContact O-NH2 3.49Å
105	L	86	Confident	93.1	Very high	89 Å²	89	54 Å²	54	47%	0.466	30%	0.3	S	S	.	.			trans	-94	12	171.2	-66.9	171.6	0	0	0	113.1	A7 L10	A7-L105 HydrophobicContact CB-CD1 3.67Å; A7-L105 HydrophobicContact CB-CD2 3.71Å; A7-L105 HydrophobicContact CB-CG 4.37Å; L10-L105 HydrophobicContact CD1-CD2 3.73Å
106	S	89.2	Confident	93.1	Very high	50 Å²	50	55.6 Å²	55.6	35%	0.35	31%	0.311	S	S	.	.			trans	-73.9	141.8	-179.2	177.6	0	0	0	0	112.7	S104 K108 A109 A110	S104-S106 WeakPolarHBondContact OG-CB 3.41Å; S104-S106 PolarHBondContact OG-N 2.83Å; S106-K108 VanDerWaalsContact C-N 3.25Å; S106-K108 PolarHBondContact O-N 3.23Å; S106-K108 PolarHBondContact OG-N 3.41Å; S106-A109 PolarHBondContact O-N 3.43Å; S106-A110 PolarHBondContact O-N 2.86Å
107	K	89.8	Confident	93.1	Very high	89 Å²	89	52 Å²	52	39%	0.387	29%	0.289	S	S	.	.	H	α-helix	trans	-56.7	-38.9	170.3	-75.8	-171.4	171.7	-166.1	0	112.4	A110 L111 I163 K167	K107-A110 PolarHBondContact O-N 3.44Å; K107-L111 WeakPolarHBondContact O-CB 3.41Å; K107-L111 PolarHBondContact O-N 3.45Å; K107-I163 HydrophobicContact CG-CG2 3.83Å; K107-K167 HydrophobicContact CD-CD 4.14Å
108	K	92.9	Very high	93.2	Very high	177 Å²	177	54.8 Å²	54.8	77%	0.77	29%	0.293	S	S	*	.	H	α-helix	trans	-64.7	-43.6	178.5	-65.9	-174.6	179.7	-177.9	0	110.7	S106 L111 A112	S106-K108 VanDerWaalsContact C-N 3.25Å; S106-K108 PolarHBondContact O-N 3.23Å; S106-K108 PolarHBondContact OG-N 3.41Å; K108-L111 PolarHBondContact O-N 2.93Å; K108-A112 WeakPolarHBondContact O-CB 3.28Å; K108-A112 PolarHBondContact O-N 3.33Å
109	A	92.9	Very high	93.2	Very high	10 Å²	10	59.5 Å²	59.5	8%	0.083	32%	0.322	C	S	.	.	H	α-helix	trans	-64.1	-44.1	176	0	0	0	0	0	111.7	L101 S106 L111 A112 L113	L101-A109 HydrophobicContact CD2-CB 4.48Å; S106-A109 PolarHBondContact O-N 3.43Å; A109-L111 VanDerWaalsContact C-N 3.33Å; A109-L111 PolarHBondContact O-N 2.96Å; A109-A112 PolarHBondContact O-N 3.4Å; A109-L113 WeakPolarHBondContact O-CB 3.48Å; A109-L113 VanDerWaalsContact O-CG 3.28Å; A109-L113 WeakPolarHBondContact O-CG 3.46Å; A109-L113 PolarHBondContact O-N 2.73Å
110	A	93.4	Very high	93.2	Very high	2 Å²	2	57.9 Å²	57.9	2%	0.017	32%	0.316	C	S	.	.	H	α-helix	trans	-62.2	-38.5	176.5	0	0	0	0	0	112.9	S106 K107 V114 R160 I163	S106-A110 PolarHBondContact O-N 2.86Å; K107-A110 PolarHBondContact O-N 3.44Å; A110-V114 WeakPolarHBondContact O-CG2 3.36Å; A110-V114 PolarHBondContact O-N 3.47Å; A110-R160 HydrophobicContact CB-CB 4.39Å; A110-I163 HydrophobicContact CB-CD1 3.82Å
111	L	94.8	Very high	93.4	Very high	71 Å²	71	56 Å²	56	37%	0.372	30%	0.297	S	S	.	.	H	α-helix	trans	-66.9	-47.2	174.2	179.8	62.5	0	0	0	111.3	K107 K108 A109 L113 V114 I115	K107-L111 WeakPolarHBondContact O-CB 3.41Å; K107-L111 PolarHBondContact O-N 3.45Å; K108-L111 PolarHBondContact O-N 2.93Å; A109-L111 VanDerWaalsContact C-N 3.33Å; A109-L111 PolarHBondContact O-N 2.96Å; L111-L113 VanDerWaalsContact C-N 3.32Å; L111-L113 PolarHBondContact O-N 2.97Å; L111-V114 PolarHBondContact O-N 3.15Å; L111-V114 VanDerWaalsContact O-N 3.16Å; L111-I115 HydrophobicContact CD1-CD1 3.99Å; L111-I115 HydrophobicContact CD1-CG1 4.23Å; L111-I115 HydrophobicContact CD2-CD1 4.42Å; L111-I115 HydrophobicContact CG-CD1 3.79Å; L111-I115 HydrophobicContact CG-CG1 4.42Å; L111-I115 WeakPolarHBondContact O-CG1 3.42Å; L111-I115 PolarHBondContact O-N 3.04Å
112	A	95.1	Very high	93.4	Very high	39 Å²	39	56 Å²	56	32%	0.322	31%	0.305	S	S	.	.	H	α-helix	trans	-57.4	-45.4	177.7	0	0	0	0	0	111.6	L101 K108 A109 V114 I115 C116	L101-A112 HydrophobicContact CD1-CB 4.16Å; K108-A112 WeakPolarHBondContact O-CB 3.28Å; K108-A112 PolarHBondContact O-N 3.33Å; A109-A112 PolarHBondContact O-N 3.4Å; A112-V114 VanDerWaalsContact C-N 3.34Å; A112-V114 PolarHBondContact O-N 2.91Å; A112-I115 PolarHBondContact O-N 2.94Å; A112-C116 PolarHBondContact O-N 3.08Å; A112-C116 PolarHBondContact O-SG 2.99Å
113	L	96.3	Very high	93.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-55.5	-44.5	174.8	-78	170.6	0	0	0	112.8	Q98 L101 A109 L111 C116 S117 N156	Q98-L113 PolarHBondContact NE2-O 2.65Å; L101-L113 HydrophobicContact CB-CD1 4.24Å; L101-L113 HydrophobicContact CB-CD2 3.66Å; L101-L113 HydrophobicContact CB-CG 3.79Å; L101-L113 HydrophobicContact CD1-CD2 4.31Å; L101-L113 HydrophobicContact CD1-CG 4.39Å; A109-L113 WeakPolarHBondContact O-CB 3.48Å; A109-L113 VanDerWaalsContact O-CG 3.28Å; A109-L113 WeakPolarHBondContact O-CG 3.46Å; A109-L113 PolarHBondContact O-N 2.73Å; L111-L113 VanDerWaalsContact C-N 3.32Å; L111-L113 PolarHBondContact O-N 2.97Å; L113-C116 PolarHBondContact O-SG 3.46Å; L113-S117 WeakPolarHBondContact O-CB 3.3Å; L113-S117 PolarHBondContact O-N 3.01Å; L113-S117 PolarHBondContact O-OG 2.04Å; L113-S117 VanDerWaalsContact O-OG 3.05Å; L113-N156 HydrophobicContact CB-CB 4.35Å; L113-N156 PolarHBondContact O-ND2 3.25Å
114	V	97.3	Very high	93.5	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.03	28%	0.28	C	S	.	.	H	α-helix	trans	-68.5	-43.9	178.1	169.2	0	0	0	0	111.3	A110 L111 A112 S117 W118 N156 L157 R160	A110-V114 WeakPolarHBondContact O-CG2 3.36Å; A110-V114 PolarHBondContact O-N 3.47Å; L111-V114 PolarHBondContact O-N 3.15Å; L111-V114 VanDerWaalsContact O-N 3.16Å; A112-V114 VanDerWaalsContact C-N 3.34Å; A112-V114 PolarHBondContact O-N 2.91Å; V114-S117 PolarHBondContact O-N 2.86Å; V114-W118 PolarHBondContact O-N 3.46Å; V114-N156 HydrophobicContact CG2-CB 3.86Å; V114-L157 HydrophobicContact CG1-CD2 3.92Å; V114-L157 HydrophobicContact CG2-CD2 4.27Å; V114-R160 HydrophobicContact CG2-CB 4.12Å
115	I	96.9	Very high	93.7	Very high	94 Å²	94	52.9 Å²	52.9	48%	0.482	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-50.1	179.7	-68.9	170.6	0	0	0	110.2	L111 A112 S117 W118 V119	L111-I115 HydrophobicContact CD1-CD1 3.99Å; L111-I115 HydrophobicContact CD1-CG1 4.23Å; L111-I115 HydrophobicContact CD2-CD1 4.42Å; L111-I115 HydrophobicContact CG-CD1 3.79Å; L111-I115 HydrophobicContact CG-CG1 4.42Å; L111-I115 WeakPolarHBondContact O-CG1 3.42Å; L111-I115 PolarHBondContact O-N 3.04Å; A112-I115 PolarHBondContact O-N 2.94Å; I115-S117 VanDerWaalsContact C-N 3.31Å; I115-S117 PolarHBondContact O-N 3.36Å; I115-W118 WeakPolarHBondContact O-CB 3.32Å; I115-W118 PolarHBondContact O-N 3.38Å; I115-W118 VanDerWaalsContact O-N 3.15Å; I115-V119 WeakPolarHBondContact O-CG2 3.31Å; I115-V119 PolarHBondContact O-N 2.93Å
116	C	95.3	Very high	93.9	Very high	38 Å²	38	52.2 Å²	52.2	26%	0.257	28%	0.28	S	S	.	.	H	α-helix	trans	-67.6	-31.9	-179.6	65.4	0	0	0	0	112.3	F94 Q98 A112 L113 V119 S120	F94-C116 HydrophobicContact CE2-CB 4.36Å; F94-C116 WeakPolarHBondContact CE2-O 3.44Å; Q98-C116 PolarHBondContact NE2-SG 3.1Å; A112-C116 PolarHBondContact O-N 3.08Å; A112-C116 PolarHBondContact O-SG 2.99Å; L113-C116 PolarHBondContact O-SG 3.46Å; C116-V119 PolarHBondContact O-N 3.17Å; C116-S120 WeakPolarHBondContact O-CB 3.01Å; C116-S120 PolarHBondContact O-N 2.89Å
117	S	96.8	Very high	93.8	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.3	-39.8	170.4	-73.1	0	0	0	0	112.9	Q98 L113 V114 I115 S120 V121 N156	Q98-S117 PolarHBondContact NE2-OG 3.2Å; L113-S117 WeakPolarHBondContact O-CB 3.3Å; L113-S117 PolarHBondContact O-N 3.01Å; L113-S117 PolarHBondContact O-OG 2.04Å; L113-S117 VanDerWaalsContact O-OG 3.05Å; V114-S117 PolarHBondContact O-N 2.86Å; I115-S117 VanDerWaalsContact C-N 3.31Å; I115-S117 PolarHBondContact O-N 3.36Å; S117-S120 PolarHBondContact O-N 2.99Å; S117-V121 WeakPolarHBondContact O-CG2 3.34Å; S117-V121 PolarHBondContact O-N 2.95Å; S117-N156 PolarHBondContact OG-ND2 3.17Å
118	W	96.9	Very high	93.7	Very high	146 Å²	146	48.3 Å²	48.3	55%	0.553	26%	0.264	S	S	*	.	H	α-helix	trans	-62.5	-45.2	175.1	-93	116.1	0	0	0	112.1	V114 I115 S120 V121 A122 L153	V114-W118 PolarHBondContact O-N 3.46Å; I115-W118 WeakPolarHBondContact O-CB 3.32Å; I115-W118 PolarHBondContact O-N 3.38Å; I115-W118 VanDerWaalsContact O-N 3.15Å; W118-S120 VanDerWaalsContact C-N 3.31Å; W118-S120 PolarHBondContact O-N 3.19Å; W118-V121 PolarHBondContact O-N 3.02Å; W118-A122 WeakPolarHBondContact O-CB 2.84Å; W118-A122 PolarHBondContact O-N 2.97Å; W118-L153 HydrophobicContact CD2-CD1 4.25Å; W118-L153 HydrophobicContact CD2-CD2 4.01Å; W118-L153 HydrophobicContact CE3-CD2 4.13Å; W118-L153 HydrophobicContact CG-CD1 4.07Å; W118-L153 HydrophobicContact CH2-CD2 4.33Å; W118-L153 HydrophobicContact CZ2-CD2 4.21Å; W118-L153 HydrophobicContact CZ3-CD2 4.29Å
119	V	94.3	Very high	93.4	Very high	101 Å²	101	42.8 Å²	42.8	61%	0.612	25%	0.247	S	C	*	.	H	α-helix	trans	-59.1	-45.1	175	174.2	0	0	0	0	110.6	I115 C116 V121 A122 G123	I115-V119 WeakPolarHBondContact O-CG2 3.31Å; I115-V119 PolarHBondContact O-N 2.93Å; C116-V119 PolarHBondContact O-N 3.17Å; V119-V121 PolarHBondContact O-N 2.65Å; V119-A122 PolarHBondContact O-N 3.4Å; V119-G123 PolarHBondContact O-N 2.88Å
120	S	94.6	Very high	93	Very high	23 Å²	23	43.4 Å²	43.4	16%	0.161	25%	0.249	C	C	.	.	H	α-helix	trans	-62.4	-42.2	178	-175.8	0	0	0	0	112.8	C116 S117 W118 G123 S124 N149	C116-S120 WeakPolarHBondContact O-CB 3.01Å; C116-S120 PolarHBondContact O-N 2.89Å; S117-S120 PolarHBondContact O-N 2.99Å; W118-S120 VanDerWaalsContact C-N 3.31Å; W118-S120 PolarHBondContact O-N 3.19Å; S120-G123 PolarHBondContact O-N 3.28Å; S120-S124 WeakPolarHBondContact O-CB 3.34Å; S120-S124 PolarHBondContact O-N 3.5Å; S120-S124 PolarHBondContact O-OG 3.05Å; S120-N149 PolarHBondContact OG-ND2 2.97Å; S120-N149 PolarHBondContact OG-OD1 3.3Å; S120-N149 VanDerWaalsContact OG-OD1 3.1Å
121	V	96.3	Very high	92.4	Very high	2 Å²	2	44 Å²	44	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-65.8	-43	175.5	165.6	0	0	0	0	111.5	S117 W118 V119 G123 S124 L125 N149 F150 L153	S117-V121 WeakPolarHBondContact O-CG2 3.34Å; S117-V121 PolarHBondContact O-N 2.95Å; W118-V121 PolarHBondContact O-N 3.02Å; V119-V121 PolarHBondContact O-N 2.65Å; V121-G123 PolarHBondContact O-N 2.87Å; V121-S124 WeakPolarHBondContact O-CB 3.34Å; V121-S124 PolarHBondContact O-N 2.72Å; V121-L125 HydrophobicContact CG1-CD1 4.22Å; V121-L125 HydrophobicContact CG1-CG 4.49Å; V121-L125 WeakPolarHBondContact O-CG 3.35Å; V121-L125 PolarHBondContact O-N 3.23Å; V121-N149 HydrophobicContact CG2-CB 4.26Å; V121-F150 HydrophobicContact CG1-CD1 4.24Å; V121-F150 HydrophobicContact CG1-CD2 4.33Å; V121-F150 HydrophobicContact CG1-CE1 3.66Å; V121-F150 HydrophobicContact CG1-CE2 3.77Å; V121-F150 HydrophobicContact CG1-CZ 3.4Å; V121-F150 VanDerWaalsContact CG1-CZ 3.4Å; V121-F150 HydrophobicContact CG2-CD1 4.31Å; V121-F150 HydrophobicContact CG2-CD2 4.33Å; V121-F150 HydrophobicContact CG2-CG 4.21Å; V121-L153 HydrophobicContact CB-CD2 4.43Å; V121-L153 HydrophobicContact CG2-CB 4.17Å; V121-L153 HydrophobicContact CG2-CD2 3.95Å
122	A	93.6	Very high	91.8	Very high	58 Å²	58	44 Å²	44	48%	0.479	26%	0.262	S	S	.	.	H	α-helix	trans	-60.8	-45.4	176	0	0	0	0	0	111.6	W118 V119 S124 L125 Y126	W118-A122 WeakPolarHBondContact O-CB 2.84Å; W118-A122 PolarHBondContact O-N 2.97Å; V119-A122 PolarHBondContact O-N 3.4Å; A122-S124 VanDerWaalsContact C-N 3.31Å; A122-S124 PolarHBondContact O-N 2.73Å; A122-L125 PolarHBondContact O-N 2.97Å; A122-Y126 PolarHBondContact O-N 3.36Å
123	G	90.7	Very high	91.2	Very high	15 Å²	15	50.4 Å²	50.4	16%	0.155	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-38.3	173.7	0	0	0	0	0	112.8	V119 S120 V121 Y126 L127	V119-G123 PolarHBondContact O-N 2.88Å; S120-G123 PolarHBondContact O-N 3.28Å; V121-G123 PolarHBondContact O-N 2.87Å; G123-Y126 PolarHBondContact O-N 2.9Å; G123-L127 WeakPolarHBondContact O-CG 3.12Å; G123-L127 PolarHBondContact O-N 3.14Å
124	S	92.3	Very high	90.4	Very high	6 Å²	6	54.4 Å²	54.4	4%	0.042	31%	0.307	C	S	.	.	H	α-helix	trans	-63.4	-44.9	175.9	-60.2	0	0	0	0	111.9	S120 V121 A122 Y126 L127 A128 Y146 N149	S120-S124 WeakPolarHBondContact O-CB 3.34Å; S120-S124 PolarHBondContact O-N 3.5Å; S120-S124 PolarHBondContact O-OG 3.05Å; V121-S124 WeakPolarHBondContact O-CB 3.34Å; V121-S124 PolarHBondContact O-N 2.72Å; A122-S124 VanDerWaalsContact C-N 3.31Å; A122-S124 PolarHBondContact O-N 2.73Å; S124-Y126 VanDerWaalsContact C-N 3.35Å; S124-L127 PolarHBondContact O-N 2.93Å; S124-A128 WeakPolarHBondContact O-CB 3.27Å; S124-A128 PolarHBondContact O-N 3.44Å; S124-Y146 WeakPolarHBondContact OG-CD1 3.44Å; S124-N149 PolarHBondContact OG-ND2 3.15Å
125	L	92.4	Very high	89.4	Confident	95 Å²	95	56.3 Å²	56.3	50%	0.497	32%	0.317	S	S	.	.	H	α-helix	trans	-64.6	-39.7	176.9	-70.4	173	0	0	0	112	V121 A122 S129 F150	V121-L125 HydrophobicContact CG1-CD1 4.22Å; V121-L125 HydrophobicContact CG1-CG 4.49Å; V121-L125 WeakPolarHBondContact O-CG 3.35Å; V121-L125 PolarHBondContact O-N 3.23Å; A122-L125 PolarHBondContact O-N 2.97Å; L125-S129 WeakPolarHBondContact O-CB 3Å; L125-S129 PolarHBondContact O-N 3.4Å; L125-S129 PolarHBondContact O-OG 2.9Å; L125-F150 HydrophobicContact CD1-CZ 4.38Å; L125-F150 HydrophobicContact CD2-CE2 4.15Å; L125-F150 HydrophobicContact CD2-CZ 4.14Å; L125-F150 HydrophobicContact CG-CE2 4.43Å; L125-F150 HydrophobicContact CG-CZ 4.36Å
126	Y	89.8	Confident	88.2	Confident	75 Å²	75	54.6 Å²	54.6	29%	0.294	32%	0.322	S	S	.	.	H	α-helix	trans	-59.7	-53.2	174	170.7	-105.3	0	0	0	111.3	W66 F70 L72 A122 G123 S124 A128 S129 I130	W66-Y126 VanDerWaalsContact CD1-OH 3.3Å; W66-Y126 PolarHBondContact NE1-OH 3.28Å; F70-Y126 HydrophobicContact CB-CE1 4.3Å; F70-Y126 WeakPolarHBondContact O-CE1 3.4Å; L72-Y126 HydrophobicContact CD1-CE1 4.38Å; A122-Y126 PolarHBondContact O-N 3.36Å; G123-Y126 PolarHBondContact O-N 2.9Å; S124-Y126 VanDerWaalsContact C-N 3.35Å; Y126-A128 VanDerWaalsContact C-N 3.35Å; Y126-A128 PolarHBondContact O-N 2.88Å; Y126-S129 WeakPolarHBondContact O-CB 3.32Å; Y126-S129 PolarHBondContact O-N 2.05Å; Y126-I130 HydrophobicContact CE1-CG1 4.34Å; Y126-I130 HydrophobicContact CE2-CD1 4.35Å; Y126-I130 HydrophobicContact CE2-CG1 4.23Å; Y126-I130 WeakPolarHBondContact O-CG1 3.36Å; Y126-I130 PolarHBondContact O-N 3.4Å; Y126-I130 VanDerWaalsContact O-N 3.08Å
127	L	86.9	Confident	87.3	Confident	24 Å²	24	54 Å²	54	13%	0.126	32%	0.316	C	S	.	.	H	α-helix	trans	-65.7	-36.6	179.9	-67.2	175.8	0	0	0	112.4	W66 F70 G123 S124 S129 I130 L131 Y146	W66-L127 HydrophobicContact CB-CD2 4.33Å; F70-L127 HydrophobicContact CD1-CD1 3.81Å; F70-L127 HydrophobicContact CD1-CD2 4.16Å; F70-L127 HydrophobicContact CD1-CG 3.97Å; F70-L127 HydrophobicContact CE1-CD1 3.81Å; F70-L127 HydrophobicContact CE1-CG 4.36Å; G123-L127 WeakPolarHBondContact O-CG 3.12Å; G123-L127 PolarHBondContact O-N 3.14Å; S124-L127 PolarHBondContact O-N 2.93Å; L127-S129 VanDerWaalsContact C-N 3.3Å; L127-S129 PolarHBondContact O-N 3.3Å; L127-I130 PolarHBondContact O-N 3.45Å; L127-L131 WeakPolarHBondContact O-CG 3.27Å; L127-L131 PolarHBondContact O-N 2.9Å; L127-Y146 HydrophobicContact CB-CE1 4.4Å; L127-Y146 WeakPolarHBondContact CB-OH 3.23Å
128	A	88.2	Confident	86.4	Confident	34 Å²	34	59.2 Å²	59.2	28%	0.281	34%	0.339	S	S	.	.	H	α-helix	trans	-61	-39.4	173.5	0	0	0	0	0	112	S124 Y126 L131 A132 Y146	S124-A128 WeakPolarHBondContact O-CB 3.27Å; S124-A128 PolarHBondContact O-N 3.44Å; Y126-A128 VanDerWaalsContact C-N 3.35Å; Y126-A128 PolarHBondContact O-N 2.88Å; A128-L131 PolarHBondContact O-N 3.01Å; A128-A132 WeakPolarHBondContact O-CB 3.39Å; A128-A132 PolarHBondContact O-N 3.29Å; A128-Y146 HydrophobicContact CB-CD2 3.98Å; A128-Y146 HydrophobicContact CB-CE2 3.68Å
129	S	86.5	Confident	85.8	Confident	60 Å²	60	52.3 Å²	52.3	42%	0.42	31%	0.313	S	S	.	.	H	α-helix	trans	-65.6	-41	176.1	-55.1	0	0	0	0	111.2	L125 Y126 L127 A132 F133	L125-S129 WeakPolarHBondContact O-CB 3Å; L125-S129 PolarHBondContact O-N 3.4Å; L125-S129 PolarHBondContact O-OG 2.9Å; Y126-S129 WeakPolarHBondContact O-CB 3.32Å; Y126-S129 PolarHBondContact O-N 2.05Å; L127-S129 VanDerWaalsContact C-N 3.3Å; L127-S129 PolarHBondContact O-N 3.3Å; S129-A132 PolarHBondContact O-N 3.36Å; S129-F133 WeakPolarHBondContact O-CB 3.34Å; S129-F133 VanDerWaalsContact O-CD2 3.28Å; S129-F133 WeakPolarHBondContact O-CD2 3.26Å; S129-F133 PolarHBondContact O-N 2.91Å
130	I	84.8	Confident	85.3	Confident	24 Å²	24	51.8 Å²	51.8	12%	0.123	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-43.8	174.9	-64.4	-62	0	0	0	111.2	W66 Y126 L127 A132 V134 L135	W66-I130 HydrophobicContact CD2-CG2 3.85Å; W66-I130 HydrophobicContact CE3-CG2 4.18Å; W66-I130 HydrophobicContact CG-CG2 4.02Å; W66-I130 HydrophobicContact CZ2-CD1 4.41Å; Y126-I130 HydrophobicContact CE1-CG1 4.34Å; Y126-I130 HydrophobicContact CE2-CD1 4.35Å; Y126-I130 HydrophobicContact CE2-CG1 4.23Å; Y126-I130 WeakPolarHBondContact O-CG1 3.36Å; Y126-I130 PolarHBondContact O-N 3.4Å; Y126-I130 VanDerWaalsContact O-N 3.08Å; L127-I130 PolarHBondContact O-N 3.45Å; I130-A132 PolarHBondContact O-N 3.02Å; I130-V134 HydrophobicContact CD1-CG2 3.83Å; I130-V134 HydrophobicContact CG2-CB 4.19Å; I130-V134 HydrophobicContact CG2-CG2 4.47Å; I130-V134 WeakPolarHBondContact O-CA 3.47Å; I130-V134 VanDerWaalsContact O-CB 3.28Å; I130-V134 WeakPolarHBondContact O-CB 3.35Å; I130-V134 PolarHBondContact O-N 3.3Å; I130-L135 HydrophobicContact CG2-CD1 3.97Å; I130-L135 PolarHBondContact O-N 3.22Å
131	L	81.2	Confident	85.1	Confident	15 Å²	15	51.1 Å²	51.1	8%	0.079	30%	0.3	C	S	.	.	I	π-helix	trans	-58.4	-48	175.9	-76.7	171.3	0	0	0	111.8	V60 L127 A128 L135 G136 C139 C142 Y146	V60-L131 HydrophobicContact CB-CD2 4.21Å; V60-L131 HydrophobicContact CG1-CD2 3.62Å; V60-L131 HydrophobicContact CG2-CD2 3.48Å; V60-L131 VanDerWaalsContact CG2-CD2 3.48Å; L127-L131 WeakPolarHBondContact O-CG 3.27Å; L127-L131 PolarHBondContact O-N 2.9Å; A128-L131 PolarHBondContact O-N 3.01Å; L131-L135 HydrophobicContact CD2-CD2 4.49Å; L131-G136 PolarHBondContact O-N 2.89Å; L131-C139 HydrophobicContact CD1-CB 4.23Å; L131-C139 HydrophobicContact CD2-CB 4.22Å; L131-C142 HydrophobicContact CD1-CB 3.91Å; L131-Y146 HydrophobicContact CD1-CE2 4.04Å; L131-Y146 WeakPolarHBondContact CD1-OH 3.25Å
132	A	81.5	Confident	84.6	Confident	69 Å²	69	51.4 Å²	51.4	57%	0.57	30%	0.302	S	S	*	.	I	π-helix	trans	-72.8	-42.6	-175.7	0	0	0	0	0	113.7	A128 S129 I130	A128-A132 WeakPolarHBondContact O-CB 3.39Å; A128-A132 PolarHBondContact O-N 3.29Å; S129-A132 PolarHBondContact O-N 3.36Å; I130-A132 PolarHBondContact O-N 3.02Å
133	F	83.2	Confident	84.5	Confident	175 Å²	175	51.1 Å²	51.1	77%	0.768	29%	0.294	S	S	*	.	I	π-helix	trans	-104.1	-22	-169.3	-63.9	-69	0	0	0	114.7	S129	S129-F133 WeakPolarHBondContact O-CB 3.34Å; S129-F133 VanDerWaalsContact O-CD2 3.28Å; S129-F133 WeakPolarHBondContact O-CD2 3.26Å; S129-F133 PolarHBondContact O-N 2.91Å
134	V	79.6	Confident	84.6	Confident	83 Å²	83	52.6 Å²	52.6	50%	0.503	30%	0.302	S	S	.	.	I	π-helix	trans	-109.9	-51.4	-174.2	-173.8	0	0	0	0	111.5	W66 I130	W66-V134 HydrophobicContact CH2-CG1 3.77Å; W66-V134 HydrophobicContact CZ2-CG1 4.27Å; W66-V134 HydrophobicContact CZ3-CG1 4.37Å; I130-V134 HydrophobicContact CD1-CG2 3.83Å; I130-V134 HydrophobicContact CG2-CB 4.19Å; I130-V134 HydrophobicContact CG2-CG2 4.47Å; I130-V134 WeakPolarHBondContact O-CA 3.47Å; I130-V134 VanDerWaalsContact O-CB 3.28Å; I130-V134 WeakPolarHBondContact O-CB 3.35Å; I130-V134 PolarHBondContact O-N 3.3Å
135	L	75.8	Confident	84.7	Confident	46 Å²	46	53.4 Å²	53.4	24%	0.241	31%	0.307	C	S	.	.	I	π-helix	trans	-84.2	-35.2	-177.9	-93.6	67.5	0	0	0	112.5	V60 W66 I130 L131 D137	V60-L135 HydrophobicContact CB-CD2 4.32Å; V60-L135 HydrophobicContact CG2-CD2 3.88Å; W66-L135 HydrophobicContact CE3-CD1 4.1Å; W66-L135 HydrophobicContact CZ3-CD1 3.91Å; I130-L135 HydrophobicContact CG2-CD1 3.97Å; I130-L135 PolarHBondContact O-N 3.22Å; L131-L135 HydrophobicContact CD2-CD2 4.49Å; L135-D137 HydrophobicContact CB-CB 4.46Å; L135-D137 PolarHBondContact O-N 3.5Å
136	G	72.5	Confident	84.8	Confident	57 Å²	57	50.2 Å²	50.2	59%	0.588	29%	0.289	S	S	*	.			trans	69.2	17.2	-175.2	0	0	0	0	0	113.6	L131	L131-G136 PolarHBondContact O-N 2.89Å
137	D	76.1	Confident	85.1	Confident	26 Å²	26	51.2 Å²	51.2	14%	0.139	30%	0.302	C	S	.	.			trans	-108.9	142	-179	-83.6	-40.3	0	0	0	111.2	V60 L135	V60-D137 HydrophobicContact CG2-CB 3.82Å; L135-D137 HydrophobicContact CB-CB 4.46Å; L135-D137 PolarHBondContact O-N 3.5Å
138	F	77.1	Confident	85.6	Confident	109 Å²	109	50.8 Å²	50.8	48%	0.478	30%	0.3	S	S	.	.			trans	-97.3	105.6	174.5	-171.4	-96.8	0	0	0	111.2	S54 V55 M140 V143	S54-F138 PolarHBondContact O-N 3.35Å; V55-F138 WeakPolarHBondContact CA-O 3.4Å; V55-F138 HydrophobicContact CG1-CD1 4.33Å; V55-F138 WeakPolarHBondContact CG1-O 3.42Å; V55-F138 HydrophobicContact CG2-CB 4.41Å; F138-M140 HydrophobicContact CE1-CB 4.47Å; F138-V143 HydrophobicContact CD2-CG2 4.4Å; F138-V143 HydrophobicContact CE2-CG2 3.79Å; F138-V143 HydrophobicContact CZ-CB 4.37Å; F138-V143 HydrophobicContact CZ-CG1 4.37Å; F138-V143 HydrophobicContact CZ-CG2 3.89Å
139	C	83.6	Confident	86.1	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.007	29%	0.289	C	S	.	.			trans	-92.6	101.6	175.6	172.6	0	0	0	0	111.4	V60 L131 V141 C142 V143	V60-C139 HydrophobicContact CB-CB 4.42Å; V60-C139 HydrophobicContact CG1-CB 4.27Å; V60-C139 HydrophobicContact CG2-CB 4.14Å; L131-C139 HydrophobicContact CD1-CB 4.23Å; L131-C139 HydrophobicContact CD2-CB 4.22Å; C139-V141 VanDerWaalsContact C-N 3.31Å; C139-V141 PolarHBondContact O-N 3.48Å; C139-C142 HydrophobicContact CB-CB 3.58Å; C139-C142 WeakPolarHBondContact CB-SG 3.47Å; C139-C142 WeakPolarHBondContact O-CB 3.49Å; C139-C142 PolarHBondContact O-N 3.34Å; C139-C142 VanDerWaalsContact O-N 3.14Å; C139-C142 WeakPolarHBondContact SG-CB 3.12Å; C139-C142 PolarHBondContact SG-N 3.14Å; C139-C142 CovalentContact SG-SG 2.05Å; C139-C142 PolarHBondContact SG-SG 3.37Å; C139-V143 WeakPolarHBondContact O-CG2 3.33Å; C139-V143 PolarHBondContact O-N 3.44Å
140	M	85.2	Confident	86.6	Confident	90 Å²	90	51.3 Å²	51.3	44%	0.443	29%	0.289	S	S	.	.	H	α-helix	trans	-58.8	-39.7	-179.5	-177.1	-178	-72	0	0	113	L51 F138 S144	L51-M140 HydrophobicContact CD1-CE 3.53Å; L51-M140 HydrophobicContact CD1-SD 4.39Å; F138-M140 HydrophobicContact CE1-CB 4.47Å; M140-S144 WeakPolarHBondContact O-CB 3.42Å; M140-S144 PolarHBondContact O-N 3.26Å; M140-S144 PolarHBondContact O-OG 3.39Å
141	V	88.8	Confident	87.2	Confident	10 Å²	10	51.7 Å²	51.7	6%	0.061	30%	0.295	C	S	.	.	H	α-helix	trans	-61.8	-47.1	176.3	173.4	0	0	0	0	110.3	L28 Y31 A32 C49 F61 C139 S144 T145	L28-V141 HydrophobicContact CB-CG1 4.42Å; L28-V141 HydrophobicContact CD2-CG1 4.37Å; Y31-V141 HydrophobicContact CD1-CG2 4.09Å; Y31-V141 HydrophobicContact CE1-CG2 4.08Å; A32-V141 HydrophobicContact CB-CG1 4.36Å; C49-V141 HydrophobicContact CB-CG2 3.94Å; C49-V141 VanDerWaalsContact SG-CG2 3.52Å; F61-V141 HydrophobicContact CZ-CG1 4.39Å; C139-V141 VanDerWaalsContact C-N 3.31Å; C139-V141 PolarHBondContact O-N 3.48Å; V141-S144 WeakPolarHBondContact O-CB 3.5Å; V141-S144 PolarHBondContact O-N 3.49Å; V141-T145 WeakPolarHBondContact O-CG2 3.36Å; V141-T145 PolarHBondContact O-N 3.29Å
142	C	87.6	Confident	88	Confident	8 Å²	8	51 Å²	51	5%	0.054	29%	0.292	C	S	.	.	H	α-helix	trans	-61.7	-50.2	180	-50.4	0	0	0	0	111.1	L131 C139 S144 T145 Y146	L131-C142 HydrophobicContact CD1-CB 3.91Å; C139-C142 HydrophobicContact CB-CB 3.58Å; C139-C142 WeakPolarHBondContact CB-SG 3.47Å; C139-C142 WeakPolarHBondContact O-CB 3.49Å; C139-C142 PolarHBondContact O-N 3.34Å; C139-C142 VanDerWaalsContact O-N 3.14Å; C139-C142 WeakPolarHBondContact SG-CB 3.12Å; C139-C142 PolarHBondContact SG-N 3.14Å; C139-C142 CovalentContact SG-SG 2.05Å; C139-C142 PolarHBondContact SG-SG 3.37Å; C142-S144 VanDerWaalsContact C-N 3.28Å; C142-S144 PolarHBondContact O-N 2.97Å; C142-T145 PolarHBondContact O-N 3.01Å; C142-T145 PolarHBondContact O-OG1 2.78Å; C142-Y146 HydrophobicContact CB-CE1 4.33Å; C142-Y146 HydrophobicContact CB-CE2 4.13Å; C142-Y146 WeakPolarHBondContact O-CD1 3.3Å; C142-Y146 WeakPolarHBondContact O-CD2 2.97Å; C142-Y146 WeakPolarHBondContact O-CE1 3.23Å; C142-Y146 PolarHBondContact O-N 3.39Å
143	V	89.9	Confident	88.8	Confident	51 Å²	51	48.2 Å²	48.2	31%	0.309	27%	0.267	S	S	.	.	H	α-helix	trans	-57.7	-43.4	177	175.4	0	0	0	0	111	F138 C139 T145 Y146 V147	F138-V143 HydrophobicContact CD2-CG2 4.4Å; F138-V143 HydrophobicContact CE2-CG2 3.79Å; F138-V143 HydrophobicContact CZ-CB 4.37Å; F138-V143 HydrophobicContact CZ-CG1 4.37Å; F138-V143 HydrophobicContact CZ-CG2 3.89Å; C139-V143 WeakPolarHBondContact O-CG2 3.33Å; C139-V143 PolarHBondContact O-N 3.44Å; V143-T145 VanDerWaalsContact C-N 3.34Å; V143-T145 PolarHBondContact O-N 3.48Å; V143-Y146 WeakPolarHBondContact O-CB 3.39Å; V143-Y146 PolarHBondContact O-N 2.84Å; V143-Y146 VanDerWaalsContact O-N 3.14Å; V143-V147 WeakPolarHBondContact O-CG2 3.46Å; V143-V147 PolarHBondContact O-N 3.09Å
144	S	93.4	Very high	89.5	Confident	46 Å²	46	45.6 Å²	45.6	32%	0.322	25%	0.253	S	S	.	.	H	α-helix	trans	-59.8	-43.8	176	-58.5	0	0	0	0	111.8	M140 V141 C142 Y146 V147 I148	M140-S144 WeakPolarHBondContact O-CB 3.42Å; M140-S144 PolarHBondContact O-N 3.26Å; M140-S144 PolarHBondContact O-OG 3.39Å; V141-S144 WeakPolarHBondContact O-CB 3.5Å; V141-S144 PolarHBondContact O-N 3.49Å; C142-S144 VanDerWaalsContact C-N 3.28Å; C142-S144 PolarHBondContact O-N 2.97Å; S144-Y146 VanDerWaalsContact C-N 3.32Å; S144-Y146 PolarHBondContact O-N 3.09Å; S144-V147 PolarHBondContact O-N 2.95Å; S144-I148 VanDerWaalsContact O-CG1 3.3Å; S144-I148 WeakPolarHBondContact O-CG1 3.49Å; S144-I148 PolarHBondContact O-N 2.91Å
145	T	94.7	Very high	90.3	Very high	23 Å²	23	41.8 Å²	41.8	14%	0.141	23%	0.23	C	C	.	.	H	α-helix	trans	-64.3	-35.1	175.8	62.1	0	0	0	0	112.7	L28 V141 C142 V143 I148 N149	L28-T145 HydrophobicContact CB-CG2 3.93Å; L28-T145 HydrophobicContact CD1-CG2 4.05Å; V141-T145 WeakPolarHBondContact O-CG2 3.36Å; V141-T145 PolarHBondContact O-N 3.29Å; C142-T145 PolarHBondContact O-N 3.01Å; C142-T145 PolarHBondContact O-OG1 2.78Å; V143-T145 VanDerWaalsContact C-N 3.34Å; V143-T145 PolarHBondContact O-N 3.48Å; T145-I148 PolarHBondContact O-N 3.44Å; T145-N149 WeakPolarHBondContact O-CB 3.4Å; T145-N149 PolarHBondContact O-N 3.21Å; T145-N149 PolarHBondContact O-ND2 3.02Å
146	Y	94.1	Very high	91.3	Very high	29 Å²	29	39.6 Å²	39.6	11%	0.114	22%	0.219	C	C	.	.	H	α-helix	trans	-65.7	-43	177.6	-53.9	-21.2	0	0	0	111.2	S124 L127 A128 L131 C142 V143 S144 I148 N149 F150	S124-Y146 WeakPolarHBondContact OG-CD1 3.44Å; L127-Y146 HydrophobicContact CB-CE1 4.4Å; L127-Y146 WeakPolarHBondContact CB-OH 3.23Å; A128-Y146 HydrophobicContact CB-CD2 3.98Å; A128-Y146 HydrophobicContact CB-CE2 3.68Å; L131-Y146 HydrophobicContact CD1-CE2 4.04Å; L131-Y146 WeakPolarHBondContact CD1-OH 3.25Å; C142-Y146 HydrophobicContact CB-CE1 4.33Å; C142-Y146 HydrophobicContact CB-CE2 4.13Å; C142-Y146 WeakPolarHBondContact O-CD1 3.3Å; C142-Y146 WeakPolarHBondContact O-CD2 2.97Å; C142-Y146 WeakPolarHBondContact O-CE1 3.23Å; C142-Y146 PolarHBondContact O-N 3.39Å; V143-Y146 WeakPolarHBondContact O-CB 3.39Å; V143-Y146 PolarHBondContact O-N 2.84Å; V143-Y146 VanDerWaalsContact O-N 3.14Å; S144-Y146 VanDerWaalsContact C-N 3.32Å; S144-Y146 PolarHBondContact O-N 3.09Å; Y146-I148 VanDerWaalsContact C-N 3.35Å; Y146-I148 PolarHBondContact O-N 2.83Å; Y146-N149 PolarHBondContact O-N 3.37Å; Y146-F150 WeakPolarHBondContact O-CD2 3.47Å; Y146-F150 PolarHBondContact O-N 2.99Å
147	V	96.7	Very high	92.4	Very high	96 Å²	96	39.8 Å²	39.8	58%	0.582	21%	0.206	S	C	*	.	H	α-helix	trans	-60.7	-45.3	174.7	174.4	0	0	0	0	110.8	V143 S144 N149 F150 A151	V143-V147 WeakPolarHBondContact O-CG2 3.46Å; V143-V147 PolarHBondContact O-N 3.09Å; S144-V147 PolarHBondContact O-N 2.95Å; V147-N149 VanDerWaalsContact C-N 3.35Å; V147-N149 PolarHBondContact O-N 3.46Å; V147-F150 PolarHBondContact O-N 3.46Å; V147-A151 WeakPolarHBondContact O-CB 3.3Å; V147-A151 PolarHBondContact O-N 3.26Å
148	I	97.8	Very high	93.3	Very high	14 Å²	14	42.4 Å²	42.4	7%	0.072	22%	0.216	C	C	.	.	H	α-helix	trans	-60.8	-43.5	177.1	-67.9	167.2	0	0	0	111.1	L21 L24 L28 Y95 S144 T145 Y146 F150 A151 L152	L21-I148 HydrophobicContact CB-CG2 4.27Å; L21-I148 HydrophobicContact CD2-CG1 4.44Å; L21-I148 HydrophobicContact CD2-CG2 4.33Å; L21-I148 WeakPolarHBondContact O-CG2 3.29Å; L24-I148 HydrophobicContact CB-CD1 3.9Å; L28-I148 HydrophobicContact CD1-CD1 3.61Å; Y95-I148 HydrophobicContact CE1-CG2 3.71Å; S144-I148 VanDerWaalsContact O-CG1 3.3Å; S144-I148 WeakPolarHBondContact O-CG1 3.49Å; S144-I148 PolarHBondContact O-N 2.91Å; T145-I148 PolarHBondContact O-N 3.44Å; Y146-I148 VanDerWaalsContact C-N 3.35Å; Y146-I148 PolarHBondContact O-N 2.83Å; I148-F150 PolarHBondContact O-N 3.15Å; I148-A151 PolarHBondContact O-N 2.91Å; I148-L152 HydrophobicContact CG2-CD1 4.06Å; I148-L152 HydrophobicContact CG2-CG 4.43Å; I148-L152 WeakPolarHBondContact O-CB 3.4Å; I148-L152 WeakPolarHBondContact O-CG 3.47Å; I148-L152 PolarHBondContact O-N 3.47Å
149	N	97.7	Very high	94.1	Very high	9 Å²	9	37.6 Å²	37.6	5%	0.048	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-43.3	178.8	-73.3	-26.6	0	0	0	112.3	F94 Y95 S120 V121 S124 T145 Y146 V147 L152 L153	F94-N149 VanDerWaalsContact CE1-OD1 3.25Å; F94-N149 WeakPolarHBondContact CE1-OD1 3.48Å; Y95-N149 PolarHBondContact OH-OD1 3.27Å; Y95-N149 VanDerWaalsContact OH-OD1 3.07Å; S120-N149 PolarHBondContact OG-ND2 2.97Å; S120-N149 PolarHBondContact OG-OD1 3.3Å; S120-N149 VanDerWaalsContact OG-OD1 3.1Å; V121-N149 HydrophobicContact CG2-CB 4.26Å; S124-N149 PolarHBondContact OG-ND2 3.15Å; T145-N149 WeakPolarHBondContact O-CB 3.4Å; T145-N149 PolarHBondContact O-N 3.21Å; T145-N149 PolarHBondContact O-ND2 3.02Å; Y146-N149 PolarHBondContact O-N 3.37Å; V147-N149 VanDerWaalsContact C-N 3.35Å; V147-N149 PolarHBondContact O-N 3.46Å; N149-L152 PolarHBondContact O-N 2.71Å; N149-L153 PolarHBondContact O-N 2.85Å
150	F	97.4	Very high	94.6	Very high	97 Å²	97	41.6 Å²	41.6	43%	0.425	21%	0.21	S	C	.	.	H	α-helix	trans	-63.3	-43.8	173.6	-93.2	-78.6	0	0	0	112.3	V121 L125 Y146 V147 I148 L152 L153 Y154	V121-F150 HydrophobicContact CG1-CD1 4.24Å; V121-F150 HydrophobicContact CG1-CD2 4.33Å; V121-F150 HydrophobicContact CG1-CE1 3.66Å; V121-F150 HydrophobicContact CG1-CE2 3.77Å; V121-F150 HydrophobicContact CG1-CZ 3.4Å; V121-F150 VanDerWaalsContact CG1-CZ 3.4Å; V121-F150 HydrophobicContact CG2-CD1 4.31Å; V121-F150 HydrophobicContact CG2-CD2 4.33Å; V121-F150 HydrophobicContact CG2-CG 4.21Å; L125-F150 HydrophobicContact CD1-CZ 4.38Å; L125-F150 HydrophobicContact CD2-CE2 4.15Å; L125-F150 HydrophobicContact CD2-CZ 4.14Å; L125-F150 HydrophobicContact CG-CE2 4.43Å; L125-F150 HydrophobicContact CG-CZ 4.36Å; Y146-F150 WeakPolarHBondContact O-CD2 3.47Å; Y146-F150 PolarHBondContact O-N 2.99Å; V147-F150 PolarHBondContact O-N 3.46Å; I148-F150 PolarHBondContact O-N 3.15Å; F150-L152 VanDerWaalsContact C-N 3.33Å; F150-L152 PolarHBondContact O-N 2.86Å; F150-L153 WeakPolarHBondContact O-CB 3.11Å; F150-L153 PolarHBondContact O-N 2.9Å; F150-Y154 PolarHBondContact O-N 3.08Å
151	A	97.8	Very high	95	Very high	31 Å²	31	44.1 Å²	44.1	26%	0.256	22%	0.218	S	C	.	.	H	α-helix	trans	-63.6	-38.1	177.2	0	0	0	0	0	112.2	L21 V147 I148 Y154 T155	L21-A151 HydrophobicContact CD1-CB 3.71Å; L21-A151 HydrophobicContact CD2-CB 3.75Å; L21-A151 HydrophobicContact CG-CB 4.4Å; V147-A151 WeakPolarHBondContact O-CB 3.3Å; V147-A151 PolarHBondContact O-N 3.26Å; I148-A151 PolarHBondContact O-N 2.91Å; A151-Y154 PolarHBondContact O-N 3.48Å; A151-T155 WeakPolarHBondContact O-CB 3.37Å; A151-T155 PolarHBondContact O-N 3.35Å; A151-T155 PolarHBondContact O-OG1 3.1Å
152	L	97.4	Very high	95.1	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-65.7	-42.1	173.3	-78.9	172.5	0	0	0	111.9	L21 F94 Y95 I148 N149 F150 Y154 T155 N156	L21-L152 HydrophobicContact CB-CD2 3.8Å; L21-L152 HydrophobicContact CB-CG 4Å; L21-L152 HydrophobicContact CD1-CD2 4.15Å; L21-L152 HydrophobicContact CD1-CG 4.28Å; F94-L152 HydrophobicContact CE1-CD1 3.91Å; F94-L152 HydrophobicContact CZ-CD1 4.3Å; Y95-L152 HydrophobicContact CD1-CD1 3.78Å; Y95-L152 HydrophobicContact CE1-CD1 3.6Å; I148-L152 HydrophobicContact CG2-CD1 4.06Å; I148-L152 HydrophobicContact CG2-CG 4.43Å; I148-L152 WeakPolarHBondContact O-CB 3.4Å; I148-L152 WeakPolarHBondContact O-CG 3.47Å; I148-L152 PolarHBondContact O-N 3.47Å; N149-L152 PolarHBondContact O-N 2.71Å; F150-L152 VanDerWaalsContact C-N 3.33Å; F150-L152 PolarHBondContact O-N 2.86Å; L152-Y154 VanDerWaalsContact C-N 3.34Å; L152-Y154 PolarHBondContact O-N 2.94Å; L152-T155 PolarHBondContact O-N 2.97Å; L152-N156 WeakPolarHBondContact O-CB 3.13Å; L152-N156 VanDerWaalsContact O-CG 3.24Å; L152-N156 PolarHBondContact O-N 3.01Å; L152-N156 PolarHBondContact O-ND2 2.87Å
153	L	97.8	Very high	95.2	Very high	10 Å²	10	44.6 Å²	44.6	5%	0.052	22%	0.222	C	C	.	.	H	α-helix	trans	-57.6	-48.5	174.2	177.2	59.2	0	0	0	110.9	W118 V121 N149 F150 T155 N156 L157	W118-L153 HydrophobicContact CD2-CD1 4.25Å; W118-L153 HydrophobicContact CD2-CD2 4.01Å; W118-L153 HydrophobicContact CE3-CD2 4.13Å; W118-L153 HydrophobicContact CG-CD1 4.07Å; W118-L153 HydrophobicContact CH2-CD2 4.33Å; W118-L153 HydrophobicContact CZ2-CD2 4.21Å; W118-L153 HydrophobicContact CZ3-CD2 4.29Å; V121-L153 HydrophobicContact CB-CD2 4.43Å; V121-L153 HydrophobicContact CG2-CB 4.17Å; V121-L153 HydrophobicContact CG2-CD2 3.95Å; N149-L153 PolarHBondContact O-N 2.85Å; F150-L153 WeakPolarHBondContact O-CB 3.11Å; F150-L153 PolarHBondContact O-N 2.9Å; L153-T155 PolarHBondContact O-N 3.13Å; L153-N156 PolarHBondContact O-N 3.46Å; L153-L157 HydrophobicContact CD1-CD1 4.21Å; L153-L157 HydrophobicContact CD1-CG 4.18Å; L153-L157 HydrophobicContact CG-CD1 4.11Å; L153-L157 VanDerWaalsContact O-CG 3.29Å; L153-L157 WeakPolarHBondContact O-CG 3.33Å; L153-L157 PolarHBondContact O-N 3.15Å
154	Y	97.5	Very high	95.1	Very high	120 Å²	120	45.8 Å²	45.8	47%	0.471	22%	0.224	S	C	.	.	H	α-helix	trans	-58.6	-47.1	176.8	175.4	-102	0	0	0	112.1	W13 F150 A151 L152 N156 L157 K158	W13-Y154 AromaticContact CH2-CD1 3.98Å; W13-Y154 HydrophobicContact CH2-CD1 3.98Å; W13-Y154 AromaticContact CH2-CE1 3.6Å; W13-Y154 HydrophobicContact CH2-CE1 3.6Å; W13-Y154 AromaticContact CZ2-CE1 3.95Å; W13-Y154 HydrophobicContact CZ2-CE1 3.95Å; F150-Y154 PolarHBondContact O-N 3.08Å; A151-Y154 PolarHBondContact O-N 3.48Å; L152-Y154 VanDerWaalsContact C-N 3.34Å; L152-Y154 PolarHBondContact O-N 2.94Å; Y154-N156 VanDerWaalsContact C-N 3.33Å; Y154-N156 PolarHBondContact O-N 3.41Å; Y154-L157 PolarHBondContact O-N 2.94Å; Y154-K158 HydrophobicContact CE1-CG 4.21Å; Y154-K158 VanDerWaalsContact CE2-CE 3.48Å; Y154-K158 HydrophobicContact CE2-CG 4.24Å; Y154-K158 VanDerWaalsContact CZ-CE 3.42Å; Y154-K158 WeakPolarHBondContact O-CG 3.29Å; Y154-K158 PolarHBondContact O-N 3.49Å; Y154-K158 WeakPolarHBondContact OH-CE 3.42Å
155	T	96.5	Very high	94.6	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-58.1	-45	177.4	-58.4	0	0	0	0	111.1	W13 E14 A151 L152 L153 K158 R159	W13-T155 HydrophobicContact CZ3-CG2 4.12Å; E14-T155 HydrophobicContact CG-CG2 3.79Å; A151-T155 WeakPolarHBondContact O-CB 3.37Å; A151-T155 PolarHBondContact O-N 3.35Å; A151-T155 PolarHBondContact O-OG1 3.1Å; L152-T155 PolarHBondContact O-N 2.97Å; L153-T155 PolarHBondContact O-N 3.13Å; T155-K158 PolarHBondContact O-N 2.57Å; T155-R159 WeakPolarHBondContact O-CB 3.21Å; T155-R159 PolarHBondContact O-N 3.11Å
156	N	96.8	Very high	94	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-68	-37.1	179	-73.3	-27.4	0	0	0	113	R18 Q98 L113 V114 S117 L152 L153 Y154 R159 R160	R18-N156 PolarHBondContact NH1-OD1 3.24Å; R18-N156 VanDerWaalsContact NH1-OD1 3.13Å; R18-N156 PolarHBondContact NH2-OD1 3.48Å; Q98-N156 PolarHBondContact NE2-ND2 2.86Å; Q98-N156 PolarHBondContact OE1-ND2 3.03Å; L113-N156 HydrophobicContact CB-CB 4.35Å; L113-N156 PolarHBondContact O-ND2 3.25Å; V114-N156 HydrophobicContact CG2-CB 3.86Å; S117-N156 PolarHBondContact OG-ND2 3.17Å; L152-N156 WeakPolarHBondContact O-CB 3.13Å; L152-N156 VanDerWaalsContact O-CG 3.24Å; L152-N156 PolarHBondContact O-N 3.01Å; L152-N156 PolarHBondContact O-ND2 2.87Å; L153-N156 PolarHBondContact O-N 3.46Å; Y154-N156 VanDerWaalsContact C-N 3.33Å; Y154-N156 PolarHBondContact O-N 3.41Å; N156-R159 PolarHBondContact O-N 3.14Å; N156-R160 WeakPolarHBondContact O-CB 3.45Å; N156-R160 PolarHBondContact O-N 2.58Å
157	L	96.4	Very high	92.9	Very high	60 Å²	60	51.5 Å²	51.5	31%	0.314	25%	0.253	S	S	.	.	H	α-helix	trans	-64.2	-42.2	174.5	-72.5	171	0	0	0	111.7	V114 L153 Y154 R160 K161	V114-L157 HydrophobicContact CG1-CD2 3.92Å; V114-L157 HydrophobicContact CG2-CD2 4.27Å; L153-L157 HydrophobicContact CD1-CD1 4.21Å; L153-L157 HydrophobicContact CD1-CG 4.18Å; L153-L157 HydrophobicContact CG-CD1 4.11Å; L153-L157 VanDerWaalsContact O-CG 3.29Å; L153-L157 WeakPolarHBondContact O-CG 3.33Å; L153-L157 PolarHBondContact O-N 3.15Å; Y154-L157 PolarHBondContact O-N 2.94Å; L157-R160 PolarHBondContact O-N 3.49Å; L157-K161 WeakPolarHBondContact O-CG 3.38Å; L157-K161 PolarHBondContact O-N 2.86Å; L157-K161 VanDerWaalsContact O-N 3.1Å
158	K	95.1	Very high	91.7	Very high	81 Å²	81	55.3 Å²	55.3	35%	0.352	26%	0.261	S	S	.	.	H	α-helix	trans	-65.5	-43.7	175.8	-68.5	-65.2	-172.6	174.7	0	111.6	P11 W13 Y154 T155 K161 A162	P11-K158 HydrophobicContact CG-CB 4.4Å; W13-K158 HydrophobicContact CH2-CB 4.33Å; W13-K158 HydrophobicContact CH2-CG 4.22Å; W13-K158 HydrophobicContact CZ2-CB 4.33Å; W13-K158 HydrophobicContact CZ2-CG 4.12Å; Y154-K158 HydrophobicContact CE1-CG 4.21Å; Y154-K158 VanDerWaalsContact CE2-CE 3.48Å; Y154-K158 HydrophobicContact CE2-CG 4.24Å; Y154-K158 VanDerWaalsContact CZ-CE 3.42Å; Y154-K158 WeakPolarHBondContact O-CG 3.29Å; Y154-K158 PolarHBondContact O-N 3.49Å; Y154-K158 WeakPolarHBondContact OH-CE 3.42Å; T155-K158 PolarHBondContact O-N 2.57Å; K158-K161 PolarHBondContact O-N 3.4Å; K158-A162 PolarHBondContact O-N 3.11Å
159	R	93.4	Very high	90.1	Very high	9 Å²	9	63.7 Å²	63.7	3%	0.034	30%	0.297	C	S	.	.	H	α-helix	trans	-57.7	-48.2	174.1	-177.5	179.7	-172.1	93.5	-0.9	111.9	L10 E14 G102 S104 T155 N156 K161 A162 I163	L10-R159 HydrophobicContact CD2-CB 4.32Å; L10-R159 HydrophobicContact CD2-CG 3.76Å; E14-R159 VanDerWaalsContact CD-NH1 3.3Å; E14-R159 HydrophobicContact CG-CB 4.41Å; E14-R159 IonicContact OE1-CZ 2.78Å; E14-R159 IonicContact OE1-NH1 3.04Å; E14-R159 PolarHBondContact OE1-NH1 3.37Å; E14-R159 IonicContact OE2-NH1 2.92Å; E14-R159 PolarHBondContact OE2-NH1 2.96Å; G102-R159 PolarHBondContact O-NH2 3.43Å; S104-R159 PolarHBondContact O-NH2 3.49Å; T155-R159 WeakPolarHBondContact O-CB 3.21Å; T155-R159 PolarHBondContact O-N 3.11Å; N156-R159 PolarHBondContact O-N 3.14Å; R159-K161 PolarHBondContact O-N 2.95Å; R159-A162 WeakPolarHBondContact O-CB 3.21Å; R159-A162 PolarHBondContact O-N 3.06Å; R159-I163 HydrophobicContact CG-CD1 3.8Å; R159-I163 WeakPolarHBondContact O-CG1 3.36Å; R159-I163 PolarHBondContact O-N 3.24Å
160	R	94.3	Very high	88.4	Confident	85 Å²	85	69.3 Å²	69.3	32%	0.321	33%	0.332	S	S	.	.	H	α-helix	trans	-59.5	-47.6	179.5	179.8	178.5	168.5	-177.3	-2.4	111.8	A110 V114 N156 L157 A162 I163 E164	A110-R160 HydrophobicContact CB-CB 4.39Å; V114-R160 HydrophobicContact CG2-CB 4.12Å; N156-R160 WeakPolarHBondContact O-CB 3.45Å; N156-R160 PolarHBondContact O-N 2.58Å; L157-R160 PolarHBondContact O-N 3.49Å; R160-A162 VanDerWaalsContact C-N 3.32Å; R160-A162 PolarHBondContact O-N 2.91Å; R160-I163 PolarHBondContact O-N 3.13Å; R160-E164 HydrophobicContact CG-CG 4.45Å; R160-E164 IonicContact CZ-OE1 3.34Å; R160-E164 IonicContact NE-OE1 3.96Å; R160-E164 PolarHBondContact NE-OE1 3Å; R160-E164 IonicContact NH2-OE1 2.7Å; R160-E164 PolarHBondContact NH2-OE1 2.9Å; R160-E164 WeakPolarHBondContact O-CB 3.23Å; R160-E164 WeakPolarHBondContact O-CG 3.45Å; R160-E164 PolarHBondContact O-N 3.48Å
161	K	93.1	Very high	86.1	Confident	142 Å²	142	70.3 Å²	70.3	62%	0.617	37%	0.37	S	S	*	.	H	α-helix	trans	-59.3	-42.7	177.3	-74	-178	178.7	-174.1	0	112	L157 K158 R159 E164 G165	L157-K161 WeakPolarHBondContact O-CG 3.38Å; L157-K161 PolarHBondContact O-N 2.86Å; L157-K161 VanDerWaalsContact O-N 3.1Å; K158-K161 PolarHBondContact O-N 3.4Å; R159-K161 PolarHBondContact O-N 2.95Å; K161-E164 PolarHBondContact O-N 2.7Å; K161-G165 PolarHBondContact O-N 2.6Å
162	A	91.1	Very high	85.5	Confident	20 Å²	20	72.3 Å²	72.3	17%	0.165	38%	0.376	C	S	.	.	H	α-helix	trans	-61.6	-47	175.9	0	0	0	0	0	112.1	G9 L10 K158 R159 R160 E164 G165 M166	G9-A162 VanDerWaalsContact O-CB 3.32Å; G9-A162 WeakPolarHBondContact O-CB 3.28Å; L10-A162 HydrophobicContact CD2-CB 3.89Å; K158-A162 PolarHBondContact O-N 3.11Å; R159-A162 WeakPolarHBondContact O-CB 3.21Å; R159-A162 PolarHBondContact O-N 3.06Å; R160-A162 VanDerWaalsContact C-N 3.32Å; R160-A162 PolarHBondContact O-N 2.91Å; A162-E164 PolarHBondContact O-N 3.46Å; A162-G165 PolarHBondContact O-N 2.93Å; A162-M166 WeakPolarHBondContact O-CG 3.16Å; A162-M166 PolarHBondContact O-N 3.11Å
163	I	89.5	Confident	84.9	Confident	9 Å²	9	76.1 Å²	76.1	5%	0.046	40%	0.395	C	S	.	.	H	α-helix	trans	-65.4	-38.5	178.9	-67	169.7	0	0	0	112.3	L10 K107 A110 R159 R160 M166 K167	L10-I163 HydrophobicContact CD2-CG1 4.4Å; K107-I163 HydrophobicContact CG-CG2 3.83Å; A110-I163 HydrophobicContact CB-CD1 3.82Å; R159-I163 HydrophobicContact CG-CD1 3.8Å; R159-I163 WeakPolarHBondContact O-CG1 3.36Å; R159-I163 PolarHBondContact O-N 3.24Å; R160-I163 PolarHBondContact O-N 3.13Å; I163-M166 HydrophobicContact CB-CE 4.18Å; I163-M166 HydrophobicContact CG1-CE 3.68Å; I163-K167 PolarHBondContact O-N 3.04Å
164	E	88	Confident	84.2	Confident	75 Å²	75	79.7 Å²	79.7	35%	0.35	41%	0.414	S	S	.	.	H	α-helix	trans	-64.8	-40.6	173.8	-74.4	173.8	179.2	0	0	112	R160 K161 A162 K167 K168	R160-E164 HydrophobicContact CG-CG 4.45Å; R160-E164 IonicContact CZ-OE1 3.34Å; R160-E164 IonicContact NE-OE1 3.96Å; R160-E164 PolarHBondContact NE-OE1 3Å; R160-E164 IonicContact NH2-OE1 2.7Å; R160-E164 PolarHBondContact NH2-OE1 2.9Å; R160-E164 WeakPolarHBondContact O-CB 3.23Å; R160-E164 WeakPolarHBondContact O-CG 3.45Å; R160-E164 PolarHBondContact O-N 3.48Å; K161-E164 PolarHBondContact O-N 2.7Å; A162-E164 PolarHBondContact O-N 3.46Å; E164-K167 PolarHBondContact O-N 3.12Å; E164-K168 PolarHBondContact O-N 3.1Å
165	G	84.4	Confident	83.4	Confident	32 Å²	32	77.4 Å²	77.4	33%	0.33	41%	0.411	S	S	.	.	H	α-helix	trans	-66.2	-37.1	177	0	0	0	0	0	113.7	K161 A162 K168	K161-G165 PolarHBondContact O-N 2.6Å; A162-G165 PolarHBondContact O-N 2.93Å; G165-K168 PolarHBondContact O-N 3.33Å
166	M	81.6	Confident	82.6	Confident	50 Å²	50	82 Å²	82	25%	0.246	44%	0.436	C	S	.	.	H	α-helix	trans	-61.8	-45.5	175.7	-72.6	-176.3	-76.8	0	0	111.6	A162 I163 K168 K169 T170	A162-M166 WeakPolarHBondContact O-CG 3.16Å; A162-M166 PolarHBondContact O-N 3.11Å; I163-M166 HydrophobicContact CB-CE 4.18Å; I163-M166 HydrophobicContact CG1-CE 3.68Å; M166-K168 VanDerWaalsContact C-N 3.33Å; M166-K168 PolarHBondContact O-N 2.9Å; M166-K169 PolarHBondContact O-N 3.43Å; M166-K169 VanDerWaalsContact O-N 3.13Å; M166-T170 PolarHBondContact O-OG1 2.99Å
167	K	70.7	Confident	81.6	Confident	137 Å²	137	87.4 Å²	87.4	60%	0.596	46%	0.464	S	S	*	.	H	α-helix	trans	-67.7	-28.4	-178.7	-175.4	158.1	177.4	179.6	0	113.7	K107 I163 E164 K169 T170 G171	K107-K167 HydrophobicContact CD-CD 4.14Å; I163-K167 PolarHBondContact O-N 3.04Å; E164-K167 PolarHBondContact O-N 3.12Å; K167-K169 PolarHBondContact O-N 3.15Å; K167-T170 PolarHBondContact O-N 2.92Å; K167-G171 PolarHBondContact O-N 3.02Å
168	K	71.9	Confident	80.6	Confident	175 Å²	175	89.4 Å²	89.4	76%	0.761	48%	0.475	S	S	*	.	H	α-helix	trans	-69.6	-17.6	174.5	-75.2	-172.8	177.4	-172.8	0	113.7	E164 G165 M166	E164-K168 PolarHBondContact O-N 3.1Å; G165-K168 PolarHBondContact O-N 3.33Å; M166-K168 VanDerWaalsContact C-N 3.33Å; M166-K168 PolarHBondContact O-N 2.9Å
169	K	64.1	Low	79.5	Confident	190 Å²	190	90 Å²	90	83%	0.826	49%	0.485	S	S	*	.	H	α-helix	trans	-92.9	-13.8	178.1	-66.1	-178.6	177.2	-174.2	0	113	M166 K167	M166-K169 PolarHBondContact O-N 3.43Å; M166-K169 VanDerWaalsContact O-N 3.13Å; K167-K169 PolarHBondContact O-N 3.15Å
170	T	60.9	Low	78.3	Confident	127 Å²	127	96.8 Å²	96.8	78%	0.779	52%	0.522	S	S	*	.	H	α-helix	trans	-106.9	-12.5	-174.7	-45.2	0	0	0	0	112.9	M166 K167	M166-T170 PolarHBondContact O-OG1 2.99Å; K167-T170 PolarHBondContact O-N 2.92Å
171	G	50.3	Low	76.9	Confident	119 Å²	119	97.8 Å²	97.8	100%	1.227	54%	0.54	S	S	*	.			trans	-119.5	0	173.3	0	0	0	0	0	109.8	K167	K167-G171 PolarHBondContact O-N 3.02Å

Retrieved 171 of 171 residues in 40.5 ms (Link to these results)

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