A0A087Y6U8_POEFO Loading...

SPT3 homolog, SAGA and STAGA complex component

AlphaFold DB , UniProt , Accession A0A087Y6U8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 276 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	90.8	Very high	95.4	Very high	97 Å²	97	65.1 Å²	65.1	48%	0.478	35%	0.346	S	S	.	.				0	-62.6	0	-168.1	177	-120.9	0	0	112	H3 Q4 A5 I22 L25 M26 L160 L163	M1-H3 PolarHBondContact O-N 3.06Å; M1-Q4 PolarHBondContact O-N 3.41Å; M1-A5 PolarHBondContact O-N 3.06Å; M1-I22 HydrophobicContact CE-CG2 4.17Å; M1-I22 HydrophobicContact SD-CG2 4.36Å; M1-L25 HydrophobicContact CG-CD1 3.92Å; M1-L25 WeakPolarHBondContact O-CD1 3.25Å; M1-M26 HydrophobicContact CE-CG 3.69Å; M1-M26 HydrophobicContact CE-SD 4.07Å; M1-L160 HydrophobicContact SD-CD2 4.22Å; M1-L163 HydrophobicContact CE-CD1 3.99Å; M1-L163 HydrophobicContact SD-CD1 3.93Å
2	L	93.6	Very high	95.2	Very high	29 Å²	29	69.8 Å²	69.8	15%	0.152	36%	0.355	C	S	.	.	H	α-helix	trans	-58	-43.3	-176.2	-93.1	169.6	0	0	0	114.7	A5 C6 I17 L143 L148 P152 L160	L2-A5 PolarHBondContact O-N 2.97Å; L2-C6 WeakPolarHBondContact O-CB 3.37Å; L2-C6 PolarHBondContact O-N 2.91Å; L2-I17 HydrophobicContact CD2-CD1 4.16Å; L2-L143 HydrophobicContact CD1-CD1 4.31Å; L2-L143 HydrophobicContact CD1-CD2 4.09Å; L2-L148 HydrophobicContact CB-CD1 4.19Å; L2-L148 HydrophobicContact CD1-CD1 4.36Å; L2-L148 HydrophobicContact CD2-CD1 4.14Å; L2-L148 HydrophobicContact CG-CD1 4.48Å; L2-P152 HydrophobicContact CD2-CG 4.42Å; L2-L160 HydrophobicContact CD1-CD1 4.28Å; L2-L160 HydrophobicContact CD2-CD1 3.59Å; L2-L160 HydrophobicContact CG-CD1 4.05Å; L2-L160 HydrophobicContact CG-CD2 4.34Å
3	H	95.1	Very high	95.2	Very high	115 Å²	115	69.3 Å²	69.3	53%	0.532	38%	0.378	S	S	.	.	H	α-helix	trans	-60.8	-45.8	174.3	-74.7	-78.9	0	0	0	112.7	M1 A5 C6 E7	M1-H3 PolarHBondContact O-N 3.06Å; H3-A5 VanDerWaalsContact C-N 3.29Å; H3-A5 PolarHBondContact O-N 3.25Å; H3-C6 WeakPolarHBondContact O-CA 3.4Å; H3-C6 VanDerWaalsContact O-CB 3.27Å; H3-C6 WeakPolarHBondContact O-CB 3.42Å; H3-C6 PolarHBondContact O-N 2.78Å; H3-C6 VanDerWaalsContact O-N 3.09Å; H3-E7 WeakPolarHBondContact O-CG 3.3Å; H3-E7 PolarHBondContact O-N 2.61Å
4	Q	96.1	Very high	95.3	Very high	111 Å²	111	66.9 Å²	66.9	52%	0.519	37%	0.368	S	S	.	.	H	α-helix	trans	-62.5	-36.2	176.4	-67.4	171.8	-25.3	0	0	112.4	M1 C6 G8 L25	M1-Q4 PolarHBondContact O-N 3.41Å; Q4-C6 VanDerWaalsContact C-N 3.35Å; Q4-G8 PolarHBondContact O-N 3.04Å; Q4-L25 HydrophobicContact CB-CD1 3.88Å; Q4-L25 HydrophobicContact CB-CD2 3.87Å
5	A	96.6	Very high	95.3	Very high	1 Å²	1	77.3 Å²	77.3	1%	0.008	40%	0.4	C	S	.	.	H	α-helix	trans	-70.2	-35	175.6	0	0	0	0	0	111.2	M1 L2 H3 A9 I17 D21 L25	M1-A5 PolarHBondContact O-N 3.06Å; L2-A5 PolarHBondContact O-N 2.97Å; H3-A5 VanDerWaalsContact C-N 3.29Å; H3-A5 PolarHBondContact O-N 3.25Å; A5-A9 VanDerWaalsContact O-CB 3.3Å; A5-A9 WeakPolarHBondContact O-CB 3.42Å; A5-A9 PolarHBondContact O-N 3.18Å; A5-I17 HydrophobicContact CB-CG2 3.69Å; A5-D21 HydrophobicContact CB-CB 4.09Å; A5-L25 HydrophobicContact CB-CD1 3.88Å
6	C	96.8	Very high	95.4	Very high	10 Å²	10	76.4 Å²	76.4	7%	0.068	40%	0.399	C	S	.	.	H	α-helix	trans	-64.2	-47.8	173.4	-168	0	0	0	0	111.7	L2 H3 Q4 G8 A9 A10 I17 L148 L150	L2-C6 WeakPolarHBondContact O-CB 3.37Å; L2-C6 PolarHBondContact O-N 2.91Å; H3-C6 WeakPolarHBondContact O-CA 3.4Å; H3-C6 VanDerWaalsContact O-CB 3.27Å; H3-C6 WeakPolarHBondContact O-CB 3.42Å; H3-C6 PolarHBondContact O-N 2.78Å; H3-C6 VanDerWaalsContact O-N 3.09Å; Q4-C6 VanDerWaalsContact C-N 3.35Å; C6-G8 VanDerWaalsContact C-N 3.35Å; C6-G8 PolarHBondContact O-N 2.66Å; C6-A9 PolarHBondContact O-N 2.86Å; C6-A10 WeakPolarHBondContact O-CB 3.43Å; C6-A10 PolarHBondContact O-N 3.08Å; C6-I17 HydrophobicContact CB-CD1 3.83Å; C6-I17 HydrophobicContact CB-CG1 4.38Å; C6-L148 HydrophobicContact CB-CD2 3.95Å; C6-L150 PolarHBondContact SG-N 2.93Å; C6-L150 VanDerWaalsContact SG-N 3.44Å
7	E	96	Very high	95.5	Very high	124 Å²	124	71.9 Å²	71.9	58%	0.579	38%	0.376	S	S	*	.	H	α-helix	trans	-58.7	-46.6	174.8	-70.7	166.2	-169.7	0	0	111.1	H3 A9 A10 L11	H3-E7 WeakPolarHBondContact O-CG 3.3Å; H3-E7 PolarHBondContact O-N 2.61Å; E7-A9 PolarHBondContact O-N 3.43Å; E7-A10 PolarHBondContact O-N 2.97Å; E7-L11 WeakPolarHBondContact O-CG 3.47Å; E7-L11 PolarHBondContact O-N 3.49Å
8	G	94.8	Very high	95.5	Very high	26 Å²	26	68.6 Å²	68.6	27%	0.268	36%	0.359	S	S	.	.	H	α-helix	trans	-60.2	-44.6	176.1	0	0	0	0	0	112.9	Q4 C6 A10 L11 R12	Q4-G8 PolarHBondContact O-N 3.04Å; C6-G8 VanDerWaalsContact C-N 3.35Å; C6-G8 PolarHBondContact O-N 2.66Å; G8-A10 PolarHBondContact O-N 3.44Å; G8-L11 PolarHBondContact O-N 3.42Å; G8-R12 WeakPolarHBondContact O-CG 3.26Å; G8-R12 PolarHBondContact O-N 3.27Å
9	A	97.1	Very high	95.4	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-63	-41.9	177	0	0	0	0	0	112	A5 C6 E7 R12 G13 S14 I17 D21 L150	A5-A9 VanDerWaalsContact O-CB 3.3Å; A5-A9 WeakPolarHBondContact O-CB 3.42Å; A5-A9 PolarHBondContact O-N 3.18Å; C6-A9 PolarHBondContact O-N 2.86Å; E7-A9 PolarHBondContact O-N 3.43Å; A9-R12 PolarHBondContact O-N 2.92Å; A9-G13 PolarHBondContact O-N 3.4Å; A9-S14 WeakPolarHBondContact O-CB 3.38Å; A9-S14 PolarHBondContact O-N 2.92Å; A9-I17 HydrophobicContact CB-CG1 4.28Å; A9-D21 WeakPolarHBondContact CB-OD2 3.49Å; A9-D21 PolarHBondContact N-OD1 3.19Å; A9-L150 HydrophobicContact CB-CD1 3.7Å
10	A	96.6	Very high	95.4	Very high	45 Å²	45	64.5 Å²	64.5	37%	0.372	34%	0.336	S	S	.	.	H	α-helix	trans	-64.1	-42.8	177.7	0	0	0	0	0	111.8	C6 E7 G8 R12 G13 L150	C6-A10 WeakPolarHBondContact O-CB 3.43Å; C6-A10 PolarHBondContact O-N 3.08Å; E7-A10 PolarHBondContact O-N 2.97Å; G8-A10 PolarHBondContact O-N 3.44Å; A10-R12 PolarHBondContact O-N 3.3Å; A10-G13 PolarHBondContact O-N 2.91Å; A10-L150 HydrophobicContact CB-CD1 4.03Å
11	L	95.4	Very high	95.4	Very high	158 Å²	158	61.8 Å²	61.8	83%	0.827	32%	0.322	S	S	*	.	H	α-helix	trans	-62.1	-28.5	176.1	-72.8	172.6	0	0	0	113.2	E7 G8 G13	E7-L11 WeakPolarHBondContact O-CG 3.47Å; E7-L11 PolarHBondContact O-N 3.49Å; G8-L11 PolarHBondContact O-N 3.42Å; L11-G13 VanDerWaalsContact C-N 3.27Å
12	R	93.6	Very high	95.7	Very high	122 Å²	122	57.2 Å²	57.2	46%	0.46	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-2.9	173.2	-64	-170.2	-55.6	134.9	0.1	113.6	G8 A9 A10 S14 S18 E20 D21	G8-R12 WeakPolarHBondContact O-CG 3.26Å; G8-R12 PolarHBondContact O-N 3.27Å; A9-R12 PolarHBondContact O-N 2.92Å; A10-R12 PolarHBondContact O-N 3.3Å; R12-S14 PolarHBondContact O-N 3.28Å; R12-S18 PolarHBondContact NH2-OG 2.96Å; R12-E20 IonicContact CZ-OE2 3.24Å; R12-E20 IonicContact NH1-OE2 3.33Å; R12-E20 PolarHBondContact NH1-OE2 3.05Å; R12-E20 IonicContact NH2-OE2 2.76Å; R12-D21 IonicContact CZ-OD1 3.86Å; R12-D21 VanDerWaalsContact CZ-OD1 3.24Å; R12-D21 IonicContact NE-OD1 2.81Å; R12-D21 PolarHBondContact NE-OD1 3.09Å; R12-D21 IonicContact NH2-OD1 3.11Å; R12-D21 PolarHBondContact NH2-OD1 3.18Å; R12-D21 IonicContact NH2-OD2 3.64Å; R12-D21 PolarHBondContact NH2-OD2 2.89Å
13	G	95.1	Very high	95.7	Very high	63 Å²	63	55.8 Å²	55.8	65%	0.649	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	18.9	-172.9	0	0	0	0	0	113.7	A9 A10 L11	A9-G13 PolarHBondContact O-N 3.4Å; A10-G13 PolarHBondContact O-N 2.91Å; L11-G13 VanDerWaalsContact C-N 3.27Å
14	S	96.1	Very high	95.7	Very high	35 Å²	35	54.5 Å²	54.5	25%	0.245	29%	0.285	C	S	.	.			trans	-76.3	148.2	177.3	-175.6	0	0	0	0	110.9	A9 R12 V16 L150	A9-S14 WeakPolarHBondContact O-CB 3.38Å; A9-S14 PolarHBondContact O-N 2.92Å; R12-S14 PolarHBondContact O-N 3.28Å; S14-V16 PolarHBondContact OG-N 3.38Å; S14-V16 PolarHBondContact OG-O 3.28Å; S14-L150 WeakPolarHBondContact O-CD1 3.26Å
15	R	95.9	Very high	95.6	Very high	224 Å²	224	51.4 Å²	51.4	85%	0.845	27%	0.272	S	S	*	.	S	Bend	trans	-91	-5.9	174.9	-59.1	-176.3	-175.5	-168.1	0.7	113.3
16	V	96.4	Very high	95.5	Very high	63 Å²	63	52.1 Å²	52.1	38%	0.382	28%	0.276	S	S	.	.	S	Bend	trans	-144.4	152	-177.8	-63.3	0	0	0	0	110.2	S14 S18 N153	S14-V16 PolarHBondContact OG-N 3.38Å; S14-V16 PolarHBondContact OG-O 3.28Å; V16-S18 PolarHBondContact O-N 2.9Å; V16-N153 HydrophobicContact CG2-CB 4.46Å
17	I	97	Very high	95.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-75.8	115.9	168.9	-51	171.2	0	0	0	107.4	L2 A5 C6 A9 D21 L150 K151 P152 N153 A156	L2-I17 HydrophobicContact CD2-CD1 4.16Å; A5-I17 HydrophobicContact CB-CG2 3.69Å; C6-I17 HydrophobicContact CB-CD1 3.83Å; C6-I17 HydrophobicContact CB-CG1 4.38Å; A9-I17 HydrophobicContact CB-CG1 4.28Å; I17-D21 HydrophobicContact CG2-CB 3.88Å; I17-L150 VanDerWaalsContact CD1-O 3.3Å; I17-L150 WeakPolarHBondContact CD1-O 3.48Å; I17-L150 HydrophobicContact CG1-CB 4.01Å; I17-K151 PolarHBondContact N-O 2.81Å; I17-P152 HydrophobicContact CB-CB 4.28Å; I17-N153 PolarHBondContact O-N 3.23Å; I17-A156 WeakPolarHBondContact O-CB 3.27Å
18	S	95.5	Very high	94.9	Very high	12 Å²	12	58.7 Å²	58.7	8%	0.084	29%	0.294	C	S	.	.			trans	-90.6	171.3	178	85	0	0	0	0	111	R12 V16 E20 D21	R12-S18 PolarHBondContact NH2-OG 2.96Å; V16-S18 PolarHBondContact O-N 2.9Å; S18-E20 PolarHBondContact O-N 3.31Å; S18-E20 WeakPolarHBondContact OG-CB 3.49Å; S18-E20 PolarHBondContact OG-N 2.88Å; S18-E20 PolarHBondContact OG-OE2 3.27Å; S18-D21 PolarHBondContact N-OD2 2.99Å; S18-D21 PolarHBondContact O-N 3Å; S18-D21 PolarHBondContact OG-OD2 3.09Å
19	A	94.9	Very high	94.8	Very high	1 Å²	1	60 Å²	60	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-61.6	-34	175.2	0	0	0	0	0	111.9	D21 I22 L23 L76 I155 I159	A19-D21 VanDerWaalsContact C-N 3.29Å; A19-D21 PolarHBondContact O-N 2.91Å; A19-I22 PolarHBondContact O-N 3.36Å; A19-I22 VanDerWaalsContact O-N 3.11Å; A19-L23 VanDerWaalsContact O-CG 3.3Å; A19-L23 WeakPolarHBondContact O-CG 3.35Å; A19-L23 PolarHBondContact O-N 3.36Å; A19-L76 HydrophobicContact CB-CD2 3.77Å; A19-I155 HydrophobicContact CB-CB 4.44Å; A19-I155 HydrophobicContact CB-CG2 3.81Å; A19-I159 HydrophobicContact CB-CD1 3.51Å
20	E	94.4	Very high	94.3	Very high	53 Å²	53	63.6 Å²	63.6	25%	0.248	31%	0.31	C	S	.	.	H	α-helix	trans	-59.1	-39.6	179.8	-57.6	159.1	160.9	0	0	111.5	R12 S18 I22 L23 F24 L76 F80	R12-E20 IonicContact CZ-OE2 3.24Å; R12-E20 IonicContact NH1-OE2 3.33Å; R12-E20 PolarHBondContact NH1-OE2 3.05Å; R12-E20 IonicContact NH2-OE2 2.76Å; S18-E20 PolarHBondContact O-N 3.31Å; S18-E20 WeakPolarHBondContact OG-CB 3.49Å; S18-E20 PolarHBondContact OG-N 2.88Å; S18-E20 PolarHBondContact OG-OE2 3.27Å; E20-I22 VanDerWaalsContact C-N 3.26Å; E20-I22 PolarHBondContact O-N 2.97Å; E20-L23 PolarHBondContact O-N 3.01Å; E20-F24 VanDerWaalsContact O-CB 3.25Å; E20-F24 WeakPolarHBondContact O-CB 3.36Å; E20-F24 PolarHBondContact O-N 3.48Å; E20-L76 HydrophobicContact CG-CD2 3.97Å; E20-F80 HydrophobicContact CB-CD2 3.6Å; E20-F80 HydrophobicContact CB-CE2 3.68Å; E20-F80 HydrophobicContact CB-CG 4.11Å; E20-F80 HydrophobicContact CB-CZ 4.24Å; E20-F80 HydrophobicContact CG-CB 4.1Å; E20-F80 HydrophobicContact CG-CD2 3.62Å; E20-F80 HydrophobicContact CG-CE2 4.24Å; E20-F80 HydrophobicContact CG-CG 3.91Å; E20-F80 WeakPolarHBondContact O-CZ 3.33Å
21	D	96	Very high	93.9	Very high	8 Å²	8	70 Å²	70	4%	0.043	32%	0.324	C	S	.	.	H	α-helix	trans	-61.7	-37.6	178.7	-57.8	-56.1	0	0	0	111.1	A5 A9 R12 I17 S18 A19 L25	A5-D21 HydrophobicContact CB-CB 4.09Å; A9-D21 WeakPolarHBondContact CB-OD2 3.49Å; A9-D21 PolarHBondContact N-OD1 3.19Å; R12-D21 IonicContact CZ-OD1 3.86Å; R12-D21 VanDerWaalsContact CZ-OD1 3.24Å; R12-D21 IonicContact NE-OD1 2.81Å; R12-D21 PolarHBondContact NE-OD1 3.09Å; R12-D21 IonicContact NH2-OD1 3.11Å; R12-D21 PolarHBondContact NH2-OD1 3.18Å; R12-D21 IonicContact NH2-OD2 3.64Å; R12-D21 PolarHBondContact NH2-OD2 2.89Å; I17-D21 HydrophobicContact CG2-CB 3.88Å; S18-D21 PolarHBondContact N-OD2 2.99Å; S18-D21 PolarHBondContact O-N 3Å; S18-D21 PolarHBondContact OG-OD2 3.09Å; A19-D21 VanDerWaalsContact C-N 3.29Å; A19-D21 PolarHBondContact O-N 2.91Å; D21-L25 WeakPolarHBondContact O-CG 3.45Å; D21-L25 PolarHBondContact O-N 3.03Å
22	I	95.9	Very high	93.6	Very high	1 Å²	1	66.2 Å²	66.2	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-74.7	-46.1	177.6	-57.4	172.4	0	0	0	110.7	M1 A19 E20 F24 L25 M26 A156 I159 L160 L163	M1-I22 HydrophobicContact CE-CG2 4.17Å; M1-I22 HydrophobicContact SD-CG2 4.36Å; A19-I22 PolarHBondContact O-N 3.36Å; A19-I22 VanDerWaalsContact O-N 3.11Å; E20-I22 VanDerWaalsContact C-N 3.26Å; E20-I22 PolarHBondContact O-N 2.97Å; I22-F24 VanDerWaalsContact C-N 3.26Å; I22-F24 PolarHBondContact O-N 3.39Å; I22-L25 PolarHBondContact O-N 3.38Å; I22-M26 HydrophobicContact CG2-SD 4.32Å; I22-M26 WeakPolarHBondContact O-CG 3.38Å; I22-M26 PolarHBondContact O-N 3.27Å; I22-A156 HydrophobicContact CD1-CB 3.76Å; I22-A156 WeakPolarHBondContact CD1-O 3.3Å; I22-I159 HydrophobicContact CB-CG2 4.45Å; I22-I159 HydrophobicContact CD1-CB 4.29Å; I22-I159 HydrophobicContact CD1-CG2 4.34Å; I22-I159 HydrophobicContact CG2-CG2 3.74Å; I22-L160 HydrophobicContact CD1-CD1 4.24Å; I22-L160 HydrophobicContact CD1-CD2 4.12Å; I22-L160 HydrophobicContact CD1-CG 3.8Å; I22-L163 HydrophobicContact CG2-CD1 4.01Å
23	L	94.6	Very high	93.5	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-38.8	178.6	-64.8	173.7	0	0	0	110.9	A19 E20 L25 M26 R27 L33 V36 A77 F80	A19-L23 VanDerWaalsContact O-CG 3.3Å; A19-L23 WeakPolarHBondContact O-CG 3.35Å; A19-L23 PolarHBondContact O-N 3.36Å; E20-L23 PolarHBondContact O-N 3.01Å; L23-L25 PolarHBondContact O-N 2.89Å; L23-M26 CarbonylContact O-C 3.29Å; L23-M26 PolarHBondContact O-N 2.94Å; L23-M26 VanDerWaalsContact O-N 3.14Å; L23-R27 PolarHBondContact O-N 3.48Å; L23-R27 VanDerWaalsContact O-N 3.1Å; L23-L33 HydrophobicContact CB-CD1 4.23Å; L23-L33 HydrophobicContact CD2-CD1 3.62Å; L23-V36 HydrophobicContact CD2-CG1 3.89Å; L23-A77 HydrophobicContact CD1-CB 4.02Å; L23-F80 HydrophobicContact CB-CD1 3.76Å; L23-F80 HydrophobicContact CB-CE1 3.4Å; L23-F80 VanDerWaalsContact CB-CE1 3.4Å; L23-F80 HydrophobicContact CB-CZ 4.37Å; L23-F80 HydrophobicContact CD1-CD1 3.83Å; L23-F80 HydrophobicContact CD1-CE1 4.37Å; L23-F80 HydrophobicContact CG-CD1 4.46Å
24	F	94.3	Very high	93.3	Very high	87 Å²	87	58.8 Å²	58.8	38%	0.382	26%	0.26	S	S	.	.	H	α-helix	trans	-59.8	-43.8	175.3	-175.8	-104.5	0	0	0	112.8	E20 I22 M26 R27 F80 M84	E20-F24 VanDerWaalsContact O-CB 3.25Å; E20-F24 WeakPolarHBondContact O-CB 3.36Å; E20-F24 PolarHBondContact O-N 3.48Å; I22-F24 VanDerWaalsContact C-N 3.26Å; I22-F24 PolarHBondContact O-N 3.39Å; F24-M26 PolarHBondContact O-N 2.91Å; F24-R27 WeakPolarHBondContact O-CB 3.49Å; F24-R27 VanDerWaalsContact O-CD 3.31Å; F24-R27 WeakPolarHBondContact O-CD 3.13Å; F24-R27 WeakPolarHBondContact O-CG 3.41Å; F24-R27 PolarHBondContact O-N 3.31Å; F24-R27 PolarHBondContact O-NH1 3.46Å; F24-F80 HydrophobicContact CB-CZ 3.86Å; F24-F80 HydrophobicContact CD2-CZ 4.42Å; F24-M84 HydrophobicContact CD2-CE 4.07Å
25	L	95.2	Very high	93	Very high	47 Å²	47	58.8 Å²	58.8	25%	0.246	26%	0.255	C	S	.	.	H	α-helix	trans	-63.9	-31.9	177.1	-67.8	176.7	0	0	0	111.8	M1 Q4 A5 D21 I22 L23	M1-L25 HydrophobicContact CG-CD1 3.92Å; M1-L25 WeakPolarHBondContact O-CD1 3.25Å; Q4-L25 HydrophobicContact CB-CD1 3.88Å; Q4-L25 HydrophobicContact CB-CD2 3.87Å; A5-L25 HydrophobicContact CB-CD1 3.88Å; D21-L25 WeakPolarHBondContact O-CG 3.45Å; D21-L25 PolarHBondContact O-N 3.03Å; I22-L25 PolarHBondContact O-N 3.38Å; L23-L25 PolarHBondContact O-N 2.89Å
26	M	93	Very high	92.9	Very high	16 Å²	16	48.1 Å²	48.1	8%	0.079	22%	0.215	C	C	.	.	H	α-helix	trans	-86.1	-6.2	-179.5	-65.4	-175.6	63.8	0	0	114.5	M1 I22 L23 F24 R28 D29 K32 L33 V36 L163	M1-M26 HydrophobicContact CE-CG 3.69Å; M1-M26 HydrophobicContact CE-SD 4.07Å; I22-M26 HydrophobicContact CG2-SD 4.32Å; I22-M26 WeakPolarHBondContact O-CG 3.38Å; I22-M26 PolarHBondContact O-N 3.27Å; L23-M26 CarbonylContact O-C 3.29Å; L23-M26 PolarHBondContact O-N 2.94Å; L23-M26 VanDerWaalsContact O-N 3.14Å; F24-M26 PolarHBondContact O-N 2.91Å; M26-R28 PolarHBondContact O-N 2.76Å; M26-D29 PolarHBondContact O-N 3.26Å; M26-K32 HydrophobicContact CE-CB 3.61Å; M26-L33 HydrophobicContact CB-CD1 4.46Å; M26-V36 HydrophobicContact CE-CG2 3.76Å; M26-V36 HydrophobicContact SD-CG2 4.16Å; M26-L163 HydrophobicContact CE-CD2 3.7Å; M26-L163 HydrophobicContact SD-CD1 3.73Å; M26-L163 HydrophobicContact SD-CD2 3.79Å; M26-L163 HydrophobicContact SD-CG 4.39Å
27	R	91.5	Very high	92.6	Very high	67 Å²	67	45.9 Å²	45.9	25%	0.253	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-27.1	-170.3	75.4	-171.3	-178.5	-78.2	5	116	L23 F24 M84 F90	L23-R27 PolarHBondContact O-N 3.48Å; L23-R27 VanDerWaalsContact O-N 3.1Å; F24-R27 WeakPolarHBondContact O-CB 3.49Å; F24-R27 VanDerWaalsContact O-CD 3.31Å; F24-R27 WeakPolarHBondContact O-CD 3.13Å; F24-R27 WeakPolarHBondContact O-CG 3.41Å; F24-R27 PolarHBondContact O-N 3.31Å; F24-R27 PolarHBondContact O-NH1 3.46Å; R27-M84 HydrophobicContact CB-CE 4.16Å; R27-M84 HydrophobicContact CB-SD 3.61Å; R27-M84 HydrophobicContact CG-SD 4.4Å; R27-F90 HydrophobicContact CB-CE1 4.35Å; R27-F90 HydrophobicContact CB-CZ 4.2Å
28	R	90.5	Very high	92.2	Very high	205 Å²	205	48.9 Å²	48.9	77%	0.774	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-31.3	179.9	-64.5	-170.2	178.1	114.8	-5.3	112.5	M26 K30	M26-R28 PolarHBondContact O-N 2.76Å; R28-K30 PolarHBondContact O-N 2.99Å
29	D	90.8	Very high	91.9	Very high	52 Å²	52	49.9 Å²	49.9	28%	0.278	22%	0.216	S	C	.	.			trans	-97.5	82.9	178.8	-169.4	-27.1	0	0	0	109.5	M26 R31 K32 L33	M26-D29 PolarHBondContact O-N 3.26Å; D29-R31 PolarHBondContact O-N 3.23Å; D29-R31 PolarHBondContact OD1-N 2.89Å; D29-K32 HydrophobicContact CB-CB 4.14Å; D29-K32 HydrophobicContact CB-CD 4.44Å; D29-K32 HydrophobicContact CB-CG 4.42Å; D29-K32 VanDerWaalsContact CG-CG 3.49Å; D29-K32 PolarHBondContact O-N 3.03Å; D29-K32 PolarHBondContact OD1-N 2.76Å; D29-K32 WeakPolarHBondContact OD2-CD 3.43Å; D29-K32 VanDerWaalsContact OD2-CE 3.23Å; D29-K32 WeakPolarHBondContact OD2-CE 3.39Å; D29-K32 WeakPolarHBondContact OD2-CG 3.39Å; D29-K32 IonicContact OD2-NZ 3.21Å; D29-K32 PolarHBondContact OD2-NZ 3.12Å; D29-L33 WeakPolarHBondContact O-CB 3.11Å; D29-L33 PolarHBondContact O-N 2.98Å
30	K	88.1	Confident	91.7	Very high	77 Å²	77	49.9 Å²	49.9	34%	0.335	22%	0.215	S	C	.	.	H	α-helix	trans	-57	-32.9	-179.2	-63.3	174.3	178.5	171.6	0	112.1	R28 A34 E89 L93	R28-K30 PolarHBondContact O-N 2.99Å; K30-A34 WeakPolarHBondContact O-CB 3.39Å; K30-A34 PolarHBondContact O-N 2.83Å; K30-E89 IonicContact NZ-OE1 2.82Å; K30-E89 PolarHBondContact NZ-OE1 3Å; K30-E89 IonicContact NZ-OE2 2.65Å; K30-E89 PolarHBondContact NZ-OE2 3.26Å; K30-L93 HydrophobicContact CB-CD2 4.27Å; K30-L93 WeakPolarHBondContact O-CD2 3.46Å
31	R	87.3	Confident	91.4	Very high	178 Å²	178	50.1 Å²	50.1	67%	0.672	22%	0.216	S	C	*	.	H	α-helix	trans	-69.1	-49.4	179	-63.6	-179	74.3	174.2	2.5	110.4	D29 L33 A34 R35	D29-R31 PolarHBondContact O-N 3.23Å; D29-R31 PolarHBondContact OD1-N 2.89Å; R31-L33 VanDerWaalsContact C-N 3.32Å; R31-L33 PolarHBondContact O-N 2.82Å; R31-A34 PolarHBondContact O-N 3.39Å; R31-R35 VanDerWaalsContact O-CG 3.26Å; R31-R35 WeakPolarHBondContact O-CG 3.4Å; R31-R35 PolarHBondContact O-N 3.33Å
32	K	89.8	Confident	91	Very high	80 Å²	80	54.4 Å²	54.4	35%	0.348	24%	0.235	S	C	.	.	H	α-helix	trans	-63.4	-39.7	175.3	-72.5	-174.5	-170.8	115.9	0	111.7	M26 D29 R35 V36	M26-K32 HydrophobicContact CE-CB 3.61Å; D29-K32 HydrophobicContact CB-CB 4.14Å; D29-K32 HydrophobicContact CB-CD 4.44Å; D29-K32 HydrophobicContact CB-CG 4.42Å; D29-K32 VanDerWaalsContact CG-CG 3.49Å; D29-K32 PolarHBondContact O-N 3.03Å; D29-K32 PolarHBondContact OD1-N 2.76Å; D29-K32 WeakPolarHBondContact OD2-CD 3.43Å; D29-K32 VanDerWaalsContact OD2-CE 3.23Å; D29-K32 WeakPolarHBondContact OD2-CE 3.39Å; D29-K32 WeakPolarHBondContact OD2-CG 3.39Å; D29-K32 IonicContact OD2-NZ 3.21Å; D29-K32 PolarHBondContact OD2-NZ 3.12Å; K32-R35 PolarHBondContact O-N 2.71Å; K32-V36 WeakPolarHBondContact O-CG2 3.35Å; K32-V36 PolarHBondContact O-N 3Å
33	L	91.6	Very high	90.6	Very high	1 Å²	1	57 Å²	57	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-60.4	-48.9	177.6	-173	63.5	0	0	0	111.4	L23 M26 D29 R31 R35 V36 L37 L81 F90 L93	L23-L33 HydrophobicContact CB-CD1 4.23Å; L23-L33 HydrophobicContact CD2-CD1 3.62Å; M26-L33 HydrophobicContact CB-CD1 4.46Å; D29-L33 WeakPolarHBondContact O-CB 3.11Å; D29-L33 PolarHBondContact O-N 2.98Å; R31-L33 VanDerWaalsContact C-N 3.32Å; R31-L33 PolarHBondContact O-N 2.82Å; L33-R35 VanDerWaalsContact C-N 3.27Å; L33-R35 PolarHBondContact O-N 3.47Å; L33-V36 WeakPolarHBondContact O-CB 3.37Å; L33-V36 PolarHBondContact O-N 3.45Å; L33-V36 VanDerWaalsContact O-N 3.11Å; L33-L37 HydrophobicContact CG-CD1 4.36Å; L33-L37 WeakPolarHBondContact O-CG 3.3Å; L33-L37 PolarHBondContact O-N 2.88Å; L33-L81 HydrophobicContact CD2-CD2 3.97Å; L33-F90 HydrophobicContact CD2-CD1 3.86Å; L33-F90 HydrophobicContact CD2-CE1 3.75Å; L33-L93 HydrophobicContact CB-CD2 4.37Å; L33-L93 HydrophobicContact CD2-CD2 4.23Å; L33-L93 HydrophobicContact CG-CD2 4.39Å
34	A	89.5	Confident	90.3	Very high	28 Å²	28	57.2 Å²	57.2	23%	0.231	25%	0.246	C	C	.	.	H	α-helix	trans	-55.3	-41.8	176	0	0	0	0	0	112.8	K30 R31 L37 K38 L93	K30-A34 WeakPolarHBondContact O-CB 3.39Å; K30-A34 PolarHBondContact O-N 2.83Å; R31-A34 PolarHBondContact O-N 3.39Å; A34-L37 PolarHBondContact O-N 3.16Å; A34-K38 PolarHBondContact O-N 2.88Å; A34-L93 HydrophobicContact CB-CD1 3.7Å; A34-L93 HydrophobicContact CB-CD2 4.11Å; A34-L93 HydrophobicContact CB-CG 3.84Å
35	R	91.4	Very high	89.9	Confident	34 Å²	34	59.9 Å²	59.9	13%	0.128	25%	0.254	C	S	.	.	H	α-helix	trans	-64.4	-41.5	178.2	-64.9	176.5	74.6	-133	-12	112	R31 K32 L33 K38 Y39 D100 E166	R31-R35 VanDerWaalsContact O-CG 3.26Å; R31-R35 WeakPolarHBondContact O-CG 3.4Å; R31-R35 PolarHBondContact O-N 3.33Å; K32-R35 PolarHBondContact O-N 2.71Å; L33-R35 VanDerWaalsContact C-N 3.27Å; L33-R35 PolarHBondContact O-N 3.47Å; R35-K38 PolarHBondContact O-N 3.11Å; R35-Y39 WeakPolarHBondContact O-CB 3.3Å; R35-Y39 PolarHBondContact O-N 3.36Å; R35-D100 WeakPolarHBondContact CD-OD1 3.41Å; R35-D100 WeakPolarHBondContact CG-OD1 3.34Å; R35-D100 IonicContact CZ-OD1 2.96Å; R35-D100 IonicContact CZ-OD2 3.12Å; R35-D100 VanDerWaalsContact NE-CG 3.27Å; R35-D100 IonicContact NE-OD1 3.11Å; R35-D100 PolarHBondContact NE-OD1 3.49Å; R35-D100 IonicContact NE-OD2 3.94Å; R35-D100 PolarHBondContact NE-OD2 2.98Å; R35-D100 IonicContact NH2-OD2 2.89Å; R35-D100 PolarHBondContact NH2-OD2 3.27Å; R35-D100 VanDerWaalsContact NH2-OD2 3.12Å; R35-E166 IonicContact CZ-OE2 2.71Å; R35-E166 IonicContact NH1-OE2 2.67Å; R35-E166 PolarHBondContact NH1-OE2 3.41Å; R35-E166 VanDerWaalsContact NH1-OE2 3.11Å; R35-E166 IonicContact NH2-OE1 3.16Å; R35-E166 IonicContact NH2-OE2 3.59Å; R35-E166 PolarHBondContact NH2-OE2 2.71Å
36	V	92.3	Very high	89.4	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.006	26%	0.255	C	S	.	.	H	α-helix	trans	-61.8	-45	173.3	174.9	0	0	0	0	110.9	L23 M26 K32 L33 K38 Y39 L40 I159 Y162 L163	L23-V36 HydrophobicContact CD2-CG1 3.89Å; M26-V36 HydrophobicContact CE-CG2 3.76Å; M26-V36 HydrophobicContact SD-CG2 4.16Å; K32-V36 WeakPolarHBondContact O-CG2 3.35Å; K32-V36 PolarHBondContact O-N 3Å; L33-V36 WeakPolarHBondContact O-CB 3.37Å; L33-V36 PolarHBondContact O-N 3.45Å; L33-V36 VanDerWaalsContact O-N 3.11Å; V36-K38 PolarHBondContact O-N 3.24Å; V36-Y39 WeakPolarHBondContact O-CB 3.41Å; V36-Y39 PolarHBondContact O-N 2.99Å; V36-L40 HydrophobicContact CG1-CD1 4.29Å; V36-L40 HydrophobicContact CG1-CG 4.42Å; V36-L40 WeakPolarHBondContact O-CG 3.45Å; V36-L40 PolarHBondContact O-N 3.39Å; V36-I159 HydrophobicContact CG1-CG1 4.4Å; V36-I159 HydrophobicContact CG1-CG2 4.09Å; V36-Y162 HydrophobicContact CB-CE1 4.38Å; V36-Y162 HydrophobicContact CG2-CD1 4.02Å; V36-Y162 HydrophobicContact CG2-CE1 3.74Å; V36-L163 HydrophobicContact CG2-CD2 3.84Å
37	L	90.4	Very high	89	Confident	15 Å²	15	61 Å²	61	8%	0.079	26%	0.26	C	S	.	.	H	α-helix	trans	-60.7	-46.1	178.5	-63.7	168.9	0	0	0	111.8	L33 A34 Y39 L40 Q41 A77 L81	L33-L37 HydrophobicContact CG-CD1 4.36Å; L33-L37 WeakPolarHBondContact O-CG 3.3Å; L33-L37 PolarHBondContact O-N 2.88Å; A34-L37 PolarHBondContact O-N 3.16Å; L37-Y39 VanDerWaalsContact C-N 3.3Å; L37-Y39 PolarHBondContact O-N 3.38Å; L37-L40 PolarHBondContact O-N 3.36Å; L37-Q41 PolarHBondContact O-N 3.34Å; L37-A77 HydrophobicContact CD2-CB 3.58Å; L37-L81 HydrophobicContact CD1-CD1 3.41Å; L37-L81 VanDerWaalsContact CD1-CD1 3.41Å; L37-L81 HydrophobicContact CD2-CD1 3.87Å; L37-L81 HydrophobicContact CG-CD1 4.27Å
38	K	89.3	Confident	88.7	Confident	64 Å²	64	62.6 Å²	62.6	28%	0.278	27%	0.269	S	S	.	.	H	α-helix	trans	-61.2	-39.8	175.6	-163.5	77.8	175.8	-157.3	0	111.6	A34 R35 V36 Q41 F42 Q97 E98	A34-K38 PolarHBondContact O-N 2.88Å; R35-K38 PolarHBondContact O-N 3.11Å; V36-K38 PolarHBondContact O-N 3.24Å; K38-Q41 PolarHBondContact O-N 2.95Å; K38-F42 WeakPolarHBondContact O-CB 3.38Å; K38-F42 PolarHBondContact O-N 3.13Å; K38-Q97 PolarHBondContact NZ-O 2.7Å; K38-E98 PolarHBondContact NZ-O 3.33Å; K38-E98 VanDerWaalsContact NZ-O 3.09Å
39	Y	89.8	Confident	88.5	Confident	33 Å²	33	56.8 Å²	56.8	13%	0.129	25%	0.253	C	S	.	.	H	α-helix	trans	-61.1	-47.9	174.5	168.5	-98.8	0	0	0	111.7	R35 V36 L37 Q41 F42 R43 E158 Y162	R35-Y39 WeakPolarHBondContact O-CB 3.3Å; R35-Y39 PolarHBondContact O-N 3.36Å; V36-Y39 WeakPolarHBondContact O-CB 3.41Å; V36-Y39 PolarHBondContact O-N 2.99Å; L37-Y39 VanDerWaalsContact C-N 3.3Å; L37-Y39 PolarHBondContact O-N 3.38Å; Y39-Q41 PolarHBondContact O-N 3.11Å; Y39-F42 PolarHBondContact O-N 3.33Å; Y39-R43 HydrophobicContact CD1-CG 4.26Å; Y39-R43 HydrophobicContact CD2-CG 4.13Å; Y39-R43 HydrophobicContact CE1-CG 3.8Å; Y39-R43 HydrophobicContact CE2-CG 3.67Å; Y39-R43 HydrophobicContact CG-CG 4.41Å; Y39-R43 VanDerWaalsContact CZ-CG 3.48Å; Y39-R43 WeakPolarHBondContact O-CB 3.41Å; Y39-R43 VanDerWaalsContact O-CG 3.28Å; Y39-R43 WeakPolarHBondContact O-CG 3.43Å; Y39-R43 PolarHBondContact O-N 2.94Å; Y39-E158 HydrophobicContact CE1-CG 4.2Å; Y39-Y162 HydrophobicContact CD1-CD1 4.08Å; Y39-Y162 HydrophobicContact CD1-CD2 4.03Å; Y39-Y162 AromaticContact CD1-CG 3.72Å; Y39-Y162 HydrophobicContact CD1-CG 3.72Å; Y39-Y162 AromaticContact CD2-CD2 3.42Å; Y39-Y162 HydrophobicContact CD2-CD2 3.42Å; Y39-Y162 VanDerWaalsContact CD2-CD2 3.42Å; Y39-Y162 AromaticContact CD2-CE2 3.74Å; Y39-Y162 HydrophobicContact CD2-CE2 3.74Å; Y39-Y162 HydrophobicContact CD2-CG 4Å; Y39-Y162 HydrophobicContact CE1-CD2 4.28Å; Y39-Y162 AromaticContact CE1-CG 3.93Å; Y39-Y162 HydrophobicContact CE1-CG 3.93Å; Y39-Y162 AromaticContact CE2-CD2 3.69Å; Y39-Y162 HydrophobicContact CE2-CD2 3.69Å; Y39-Y162 HydrophobicContact CE2-CE2 4.42Å; Y39-Y162 HydrophobicContact CE2-CG 4.18Å; Y39-Y162 HydrophobicContact CG-CD1 4.16Å; Y39-Y162 AromaticContact CG-CD2 3.59Å; Y39-Y162 HydrophobicContact CG-CD2 3.59Å; Y39-Y162 HydrophobicContact CG-CE1 4.38Å; Y39-Y162 AromaticContact CG-CE2 3.86Å; Y39-Y162 HydrophobicContact CG-CE2 3.86Å; Y39-Y162 AromaticContact CG-CG 3.75Å; Y39-Y162 HydrophobicContact CG-CG 3.75Å
40	L	91	Very high	88.1	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-42.9	178.6	-66.4	178.2	0	0	0	111.8	V36 L37 F42 R43 D44 R73 A77 I159	V36-L40 HydrophobicContact CG1-CD1 4.29Å; V36-L40 HydrophobicContact CG1-CG 4.42Å; V36-L40 WeakPolarHBondContact O-CG 3.45Å; V36-L40 PolarHBondContact O-N 3.39Å; L37-L40 PolarHBondContact O-N 3.36Å; L40-F42 PolarHBondContact O-N 3.38Å; L40-R43 PolarHBondContact O-N 3.38Å; L40-D44 PolarHBondContact O-N 3.3Å; L40-R73 HydrophobicContact CB-CB 4.19Å; L40-R73 HydrophobicContact CD2-CB 4.25Å; L40-A77 HydrophobicContact CD1-CB 4.03Å; L40-I159 HydrophobicContact CD1-CD1 4.15Å; L40-I159 HydrophobicContact CD1-CG1 4.36Å; L40-I159 HydrophobicContact CD2-CD1 4.47Å; L40-I159 HydrophobicContact CD2-CG1 3.92Å
41	Q	88.1	Confident	87.8	Confident	57 Å²	57	57.9 Å²	57.9	27%	0.266	26%	0.259	S	S	.	.	H	α-helix	trans	-58.2	-47.2	173.1	-179.3	-176.9	31.2	0	0	111.6	L37 K38 Y39 R43 D44 Y45 Q74	L37-Q41 PolarHBondContact O-N 3.34Å; K38-Q41 PolarHBondContact O-N 2.95Å; Y39-Q41 PolarHBondContact O-N 3.11Å; Q41-R43 VanDerWaalsContact C-N 3.3Å; Q41-R43 PolarHBondContact O-N 2.82Å; Q41-D44 PolarHBondContact O-N 3.5Å; Q41-Y45 WeakPolarHBondContact O-CB 3.34Å; Q41-Y45 PolarHBondContact O-N 3.04Å; Q41-Q74 HydrophobicContact CB-CG 4.38Å
42	F	86.7	Confident	87.3	Confident	99 Å²	99	52.9 Å²	52.9	43%	0.434	25%	0.245	S	C	.	.	H	α-helix	trans	-66.2	-33.4	179.2	-173.6	-100.4	0	0	0	112.4	K38 Y39 L40 K46	K38-F42 WeakPolarHBondContact O-CB 3.38Å; K38-F42 PolarHBondContact O-N 3.13Å; Y39-F42 PolarHBondContact O-N 3.33Å; L40-F42 PolarHBondContact O-N 3.38Å; F42-K46 HydrophobicContact CE1-CD 4.38Å; F42-K46 WeakPolarHBondContact O-CB 3.39Å; F42-K46 PolarHBondContact O-N 2.76Å
43	R	87.3	Confident	86.7	Confident	56 Å²	56	53.7 Å²	53.7	21%	0.211	25%	0.253	C	S	.	.	H	α-helix	trans	-67.4	-41.2	175.5	-74.5	-70.1	-67.4	154.8	4.5	112.1	Y39 L40 Q41 S47 E158	Y39-R43 HydrophobicContact CD1-CG 4.26Å; Y39-R43 HydrophobicContact CD2-CG 4.13Å; Y39-R43 HydrophobicContact CE1-CG 3.8Å; Y39-R43 HydrophobicContact CE2-CG 3.67Å; Y39-R43 HydrophobicContact CG-CG 4.41Å; Y39-R43 VanDerWaalsContact CZ-CG 3.48Å; Y39-R43 WeakPolarHBondContact O-CB 3.41Å; Y39-R43 VanDerWaalsContact O-CG 3.28Å; Y39-R43 WeakPolarHBondContact O-CG 3.43Å; Y39-R43 PolarHBondContact O-N 2.94Å; L40-R43 PolarHBondContact O-N 3.38Å; Q41-R43 VanDerWaalsContact C-N 3.3Å; Q41-R43 PolarHBondContact O-N 2.82Å; R43-S47 WeakPolarHBondContact O-CB 3.43Å; R43-S47 PolarHBondContact O-N 2.97Å; R43-S47 PolarHBondContact O-OG 3.48Å; R43-E158 IonicContact CZ-OE1 2.69Å; R43-E158 IonicContact NE-OE1 3.77Å; R43-E158 PolarHBondContact NE-OE1 3.41Å; R43-E158 IonicContact NH2-OE1 3.56Å; R43-E158 PolarHBondContact NH2-OE1 3.49Å
44	D	88	Confident	85.9	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.016	28%	0.279	C	S	.	.	H	α-helix	trans	-64.4	-46.8	173.6	-87.6	-0.6	0	0	0	111	L40 Q41 K46 S47 K48 N70 Q71 R72 R73 Q74	L40-D44 PolarHBondContact O-N 3.3Å; Q41-D44 PolarHBondContact O-N 3.5Å; D44-K46 PolarHBondContact O-N 3.14Å; D44-S47 PolarHBondContact O-N 3.31Å; D44-K48 PolarHBondContact O-N 2.95Å; D44-N70 WeakPolarHBondContact CB-O 3.26Å; D44-N70 VanDerWaalsContact CG-O 3.25Å; D44-Q71 VanDerWaalsContact OD2-CA 3.27Å; D44-Q71 WeakPolarHBondContact OD2-CA 3.36Å; D44-R72 PolarHBondContact OD2-N 3.02Å; D44-R73 WeakPolarHBondContact OD1-CD 3.49Å; D44-R73 WeakPolarHBondContact OD1-CG 3.39Å; D44-R73 IonicContact OD1-CZ 2.89Å; D44-R73 IonicContact OD1-NE 2.99Å; D44-R73 IonicContact OD1-NH1 3.5Å; D44-R73 PolarHBondContact OD1-NH1 3.47Å; D44-R73 WeakPolarHBondContact OD2-CB 3.32Å; D44-R73 PolarHBondContact OD2-N 3.14Å; D44-Q74 PolarHBondContact OD2-N 3.18Å
45	Y	86.6	Confident	85	Confident	143 Å²	143	64 Å²	64	56%	0.561	30%	0.296	S	S	*	.	H	α-helix	trans	-58	-48.7	174.1	178.3	-101.3	0	0	0	112.7	Q41 S47 K48 L49	Q41-Y45 WeakPolarHBondContact O-CB 3.34Å; Q41-Y45 PolarHBondContact O-N 3.04Å; Y45-S47 VanDerWaalsContact C-N 3.34Å; Y45-S47 PolarHBondContact O-N 2.94Å; Y45-K48 WeakPolarHBondContact O-CB 3.37Å; Y45-K48 PolarHBondContact O-N 2.88Å; Y45-L49 PolarHBondContact O-N 2.8Å
46	K	84.3	Confident	83.5	Confident	59 Å²	59	69.5 Å²	69.5	26%	0.257	32%	0.323	S	S	.	.	H	α-helix	trans	-62.2	-41.5	177.9	179	167.9	-178	167.9	0	111.7	F42 D44 K48 L49 L50	F42-K46 HydrophobicContact CE1-CD 4.38Å; F42-K46 WeakPolarHBondContact O-CB 3.39Å; F42-K46 PolarHBondContact O-N 2.76Å; D44-K46 PolarHBondContact O-N 3.14Å; K46-K48 VanDerWaalsContact C-N 3.28Å; K46-K48 PolarHBondContact O-N 3.48Å; K46-L49 PolarHBondContact O-N 3.16Å; K46-L50 HydrophobicContact CD-CD1 4.37Å; K46-L50 HydrophobicContact CG-CD1 3.63Å; K46-L50 WeakPolarHBondContact O-CD1 3.5Å; K46-L50 PolarHBondContact O-N 3.34Å
47	S	85.3	Confident	81.8	Confident	27 Å²	27	76.6 Å²	76.6	19%	0.189	36%	0.361	C	S	.	.	H	α-helix	trans	-63.1	-37	176.6	-56.9	0	0	0	0	111.6	R43 D44 Y45 K51	R43-S47 WeakPolarHBondContact O-CB 3.43Å; R43-S47 PolarHBondContact O-N 2.97Å; R43-S47 PolarHBondContact O-OG 3.48Å; D44-S47 PolarHBondContact O-N 3.31Å; Y45-S47 VanDerWaalsContact C-N 3.34Å; Y45-S47 PolarHBondContact O-N 2.94Å; S47-K51 WeakPolarHBondContact O-CG 3.38Å; S47-K51 PolarHBondContact O-N 3.37Å
48	K	85.3	Confident	80.1	Confident	102 Å²	102	80.9 Å²	80.9	44%	0.443	39%	0.387	S	S	.	.	H	α-helix	trans	-64.6	-47.1	173	-172.3	-177.4	179.6	-175.4	0	111.7	D44 Y45 K46 K51 N52 N70	D44-K48 PolarHBondContact O-N 2.95Å; Y45-K48 WeakPolarHBondContact O-CB 3.37Å; Y45-K48 PolarHBondContact O-N 2.88Å; K46-K48 VanDerWaalsContact C-N 3.28Å; K46-K48 PolarHBondContact O-N 3.48Å; K48-K51 PolarHBondContact O-N 3.19Å; K48-N52 PolarHBondContact O-N 2.86Å; K48-N52 VanDerWaalsContact O-N 3.07Å; K48-N52 PolarHBondContact O-OD1 3.3Å; K48-N70 HydrophobicContact CB-CB 4.3Å
49	L	85.6	Confident	78.2	Confident	83 Å²	83	85.5 Å²	85.5	44%	0.435	41%	0.41	S	S	.	.	H	α-helix	trans	-63	-44.4	-179	-176	66.2	0	0	0	112.5	Y45 K46 K51 N52 L53	Y45-L49 PolarHBondContact O-N 2.8Å; K46-L49 PolarHBondContact O-N 3.16Å; L49-K51 VanDerWaalsContact C-N 3.35Å; L49-K51 PolarHBondContact O-N 3.19Å; L49-N52 PolarHBondContact O-N 3.42Å; L49-L53 HydrophobicContact CG-CD1 4.39Å; L49-L53 WeakPolarHBondContact O-CG 3.31Å; L49-L53 PolarHBondContact O-N 2.92Å; L49-L53 VanDerWaalsContact O-N 3.1Å
50	L	82.2	Confident	76.1	Confident	83 Å²	83	92.1 Å²	92.1	44%	0.435	44%	0.442	S	S	.	.	H	α-helix	trans	-61.6	-41.4	177.7	-91.4	132.1	0	0	0	112.2	K46 L53 E54	K46-L50 HydrophobicContact CD-CD1 4.37Å; K46-L50 HydrophobicContact CG-CD1 3.63Å; K46-L50 WeakPolarHBondContact O-CD1 3.5Å; K46-L50 PolarHBondContact O-N 3.34Å; L50-L53 PolarHBondContact O-N 3.41Å; L50-E54 WeakPolarHBondContact O-CG 3.3Å; L50-E54 PolarHBondContact O-N 2.97Å
51	K	81.4	Confident	73.2	Confident	69 Å²	69	100.4 Å²	100.4	30%	0.3	48%	0.481	S	S	.	.	H	α-helix	trans	-63.9	-43.4	175.8	-74.4	176.7	173.5	-173.4	0	112.5	S47 K48 L49 L53 E54 E55 N70	S47-K51 WeakPolarHBondContact O-CG 3.38Å; S47-K51 PolarHBondContact O-N 3.37Å; K48-K51 PolarHBondContact O-N 3.19Å; L49-K51 VanDerWaalsContact C-N 3.35Å; L49-K51 PolarHBondContact O-N 3.19Å; K51-L53 VanDerWaalsContact C-N 3.27Å; K51-L53 PolarHBondContact O-N 3.17Å; K51-E54 PolarHBondContact O-N 2.79Å; K51-E55 WeakPolarHBondContact O-CB 3.25Å; K51-E55 WeakPolarHBondContact O-CG 3.39Å; K51-E55 PolarHBondContact O-N 3.31Å; K51-N70 WeakPolarHBondContact CD-OD1 3.45Å; K51-N70 WeakPolarHBondContact CE-OD1 3.39Å; K51-N70 PolarHBondContact NZ-OD1 2.67Å
52	N	76.8	Confident	71.1	Confident	72 Å²	72	103.4 Å²	103.4	39%	0.385	51%	0.505	S	S	.	.	H	α-helix	trans	-60.1	-39	177.1	-70.7	7.1	0	0	0	111.9	K48 L49 E55 E56	K48-N52 PolarHBondContact O-N 2.86Å; K48-N52 VanDerWaalsContact O-N 3.07Å; K48-N52 PolarHBondContact O-OD1 3.3Å; L49-N52 PolarHBondContact O-N 3.42Å; N52-E55 PolarHBondContact O-N 2.83Å; N52-E56 PolarHBondContact O-N 2.73Å
53	L	77.4	Confident	68.7	Low	98 Å²	98	102.6 Å²	102.6	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-68.7	-36.7	176.4	-69.8	169.5	0	0	0	112.5	L49 L50 K51 D57	L49-L53 HydrophobicContact CG-CD1 4.39Å; L49-L53 WeakPolarHBondContact O-CG 3.31Å; L49-L53 PolarHBondContact O-N 2.92Å; L49-L53 VanDerWaalsContact O-N 3.1Å; L50-L53 PolarHBondContact O-N 3.41Å; K51-L53 VanDerWaalsContact C-N 3.27Å; K51-L53 PolarHBondContact O-N 3.17Å; L53-D57 PolarHBondContact O-N 3.24Å
54	E	75.4	Confident	66	Low	121 Å²	121	103.5 Å²	103.5	57%	0.565	55%	0.552	S	S	*	*	H	α-helix	trans	-69	-34	174	-71.7	168.9	-174.8	0	0	111.6	L50 K51 D57 V58	L50-E54 WeakPolarHBondContact O-CG 3.3Å; L50-E54 PolarHBondContact O-N 2.97Å; K51-E54 PolarHBondContact O-N 2.79Å; E54-D57 PolarHBondContact O-N 3.44Å; E54-V58 VanDerWaalsContact O-CG2 3.26Å; E54-V58 WeakPolarHBondContact O-CG2 3.38Å; E54-V58 PolarHBondContact O-N 3.5Å
55	E	71.1	Confident	63.9	Low	125 Å²	125	112 Å²	112	58%	0.584	60%	0.596	S	S	*	*	H	α-helix	trans	-73	-35.1	177	-73.6	171.3	-164.4	0	0	112.6	K51 N52 D57 V58	K51-E55 WeakPolarHBondContact O-CB 3.25Å; K51-E55 WeakPolarHBondContact O-CG 3.39Å; K51-E55 PolarHBondContact O-N 3.31Å; N52-E55 PolarHBondContact O-N 2.83Å; E55-D57 PolarHBondContact O-N 3.44Å; E55-V58 PolarHBondContact O-N 3.35Å
56	E	59.2	Low	61.5	Low	148 Å²	148	109 Å²	109	69%	0.692	60%	0.601	S	S	*	*	H	α-helix	trans	-66.1	-23.4	172.8	-77.5	-177.6	163.4	0	0	113.1	N52	N52-E56 PolarHBondContact O-N 2.73Å
57	D	56.2	Low	59.4	Low	151 Å²	151	110.7 Å²	110.7	81%	0.807	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-11.6	177.8	-144.7	20.9	0	0	0	112.6	L53 E54 E55	L53-D57 PolarHBondContact O-N 3.24Å; E54-D57 PolarHBondContact O-N 3.44Å; E55-D57 PolarHBondContact O-N 3.44Å
58	V	54.6	Low	57.2	Low	104 Å²	104	112.6 Å²	112.6	63%	0.63	65%	0.65	S	S	*	*			trans	-122.9	42.3	-173.6	-171.6	0	0	0	0	111.6	E54 E55 Q60	E54-V58 VanDerWaalsContact O-CG2 3.26Å; E54-V58 WeakPolarHBondContact O-CG2 3.38Å; E54-V58 PolarHBondContact O-N 3.5Å; E55-V58 PolarHBondContact O-N 3.35Å; V58-Q60 PolarHBondContact O-N 2.8Å
59	Q	51	Low	55.6	Low	161 Å²	161	109.4 Å²	109.4	75%	0.752	65%	0.646	S	S	*	*			trans	-73.3	63.1	169.9	-136.6	104.4	16.1	0	0	111.5
60	Q	44.9	Very low	54.1	Low	173 Å²	173	107 Å²	107	81%	0.808	63%	0.633	S	S	*	*	S	Bend	trans	-167	89.2	162.8	-110.5	167.9	63.8	0	0	110.4	V58	V58-Q60 PolarHBondContact O-N 2.8Å
61	E	30.9	Very low	53.3	Low	174 Å²	174	107.2 Å²	107.2	81%	0.813	63%	0.632	S	S	*	*			trans	142.7	132.7	142.3	-78.6	-63.7	106	0	0	113.1
62	P	42.7	Very low	53.4	Low	120 Å²	120	112.1 Å²	112.1	78%	0.779	65%	0.649	S	S	*	*			trans	-91.5	110.4	-173.1	34.5	-28.4	0	0	0	111
63	G	36.5	Very low	54	Low	82 Å²	82	110.9 Å²	110.9	85%	0.845	64%	0.639	S	S	*	*			trans	175.9	101.9	169	0	0	0	0	0	115
64	G	31.9	Very low	54.4	Low	75 Å²	75	108.7 Å²	108.7	77%	0.773	63%	0.626	S	S	*	*			trans	145	81.9	161.6	0	0	0	0	0	114.9	A66	G64-A66 PolarHBondContact O-N 3.28Å; G64-A66 VanDerWaalsContact O-N 3.13Å
65	L	42.3	Very low	55.1	Low	182 Å²	182	109.8 Å²	109.8	95%	0.953	63%	0.625	S	S	*	*			trans	-59.1	109.9	170	-70.4	160.7	0	0	0	111.4
66	A	36.9	Very low	56	Low	81 Å²	81	105.5 Å²	105.5	67%	0.669	61%	0.606	S	S	*	*			trans	-140.3	52.4	160.1	0	0	0	0	0	111.6	G64 G68	G64-A66 PolarHBondContact O-N 3.28Å; G64-A66 VanDerWaalsContact O-N 3.13Å; A66-G68 VanDerWaalsContact C-N 3.32Å; A66-G68 PolarHBondContact O-N 2.89Å
67	A	39	Very low	57.4	Low	94 Å²	94	98.5 Å²	98.5	78%	0.777	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	3.5	-174.7	0	0	0	0	0	115.9
68	G	40.9	Very low	58.9	Low	67 Å²	67	93.6 Å²	93.6	69%	0.691	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-12.3	-169.3	0	0	0	0	0	117.6	A66 N70	A66-G68 VanDerWaalsContact C-N 3.32Å; A66-G68 PolarHBondContact O-N 2.89Å; G68-N70 PolarHBondContact O-N 3.07Å
69	G	50	Low	60.6	Low	34 Å²	34	93.9 Å²	93.9	35%	0.351	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-81.7	-15.4	-165.2	0	0	0	0	0	116.5	Q71	G69-Q71 PolarHBondContact O-N 3.45Å
70	N	54.9	Low	62.5	Low	33 Å²	33	86.8 Å²	86.8	18%	0.176	51%	0.51	C	S	.	.	G	3₁₀ helix	trans	-85	-9.2	-159	-67.2	-8	0	0	0	115.3	D44 K48 K51 G68	D44-N70 WeakPolarHBondContact CB-O 3.26Å; D44-N70 VanDerWaalsContact CG-O 3.25Å; K48-N70 HydrophobicContact CB-CB 4.3Å; K51-N70 WeakPolarHBondContact CD-OD1 3.45Å; K51-N70 WeakPolarHBondContact CE-OD1 3.39Å; K51-N70 PolarHBondContact NZ-OD1 2.67Å; G68-N70 PolarHBondContact O-N 3.07Å
71	Q	65.7	Low	64.6	Low	87 Å²	87	78.6 Å²	78.6	41%	0.407	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-125.2	10.8	174.1	-67.1	-179.6	24.3	0	0	112.2	D44 G69 R73 R75	D44-Q71 VanDerWaalsContact OD2-CA 3.27Å; D44-Q71 WeakPolarHBondContact OD2-CA 3.36Å; G69-Q71 PolarHBondContact O-N 3.45Å; Q71-R73 VanDerWaalsContact C-N 3.29Å; Q71-R73 PolarHBondContact O-N 3.2Å; Q71-R75 HydrophobicContact CB-CG 4.23Å; Q71-R75 WeakPolarHBondContact O-CB 3.44Å; Q71-R75 VanDerWaalsContact O-CG 3.26Å; Q71-R75 WeakPolarHBondContact O-CG 3.46Å; Q71-R75 PolarHBondContact O-N 3.3Å
72	R	82.7	Confident	67.3	Low	172 Å²	172	74.3 Å²	74.3	65%	0.649	46%	0.457	S	S	*	.	H	α-helix	trans	-65.4	-34.7	-170.1	-174.9	177.8	177.6	-175.8	1.3	111.8	D44 L76	D44-R72 PolarHBondContact OD2-N 3.02Å; R72-L76 VanDerWaalsContact O-CB 3.23Å; R72-L76 WeakPolarHBondContact O-CB 3.23Å; R72-L76 PolarHBondContact O-N 3.36Å
73	R	89.6	Confident	69.6	Low	47 Å²	47	77.6 Å²	77.6	18%	0.177	45%	0.454	C	S	.	.	H	α-helix	trans	-74.2	-48.2	-177.6	-57.5	173.8	-179.3	77.7	1.2	110.5	L40 D44 Q71 A77 I155 E158	L40-R73 HydrophobicContact CB-CB 4.19Å; L40-R73 HydrophobicContact CD2-CB 4.25Å; D44-R73 WeakPolarHBondContact OD1-CD 3.49Å; D44-R73 WeakPolarHBondContact OD1-CG 3.39Å; D44-R73 IonicContact OD1-CZ 2.89Å; D44-R73 IonicContact OD1-NE 2.99Å; D44-R73 IonicContact OD1-NH1 3.5Å; D44-R73 PolarHBondContact OD1-NH1 3.47Å; D44-R73 WeakPolarHBondContact OD2-CB 3.32Å; D44-R73 PolarHBondContact OD2-N 3.14Å; Q71-R73 VanDerWaalsContact C-N 3.29Å; Q71-R73 PolarHBondContact O-N 3.2Å; R73-A77 WeakPolarHBondContact O-CB 3.49Å; R73-A77 PolarHBondContact O-N 2.79Å; R73-A77 VanDerWaalsContact O-N 3.08Å; R73-I155 HydrophobicContact CG-CD1 4.21Å; R73-I155 HydrophobicContact CG-CG1 4.32Å; R73-I155 HydrophobicContact CG-CG2 4.28Å; R73-E158 IonicContact CZ-OE1 3.5Å; R73-E158 IonicContact CZ-OE2 3.26Å; R73-E158 IonicContact NE-OE1 2.71Å; R73-E158 PolarHBondContact NE-OE1 2.95Å; R73-E158 IonicContact NE-OE2 3.62Å; R73-E158 PolarHBondContact NE-OE2 3.22Å; R73-E158 IonicContact NH2-OE1 3.65Å; R73-E158 IonicContact NH2-OE2 3.77Å; R73-E158 PolarHBondContact NH2-OE2 2.93Å; R73-E158 VanDerWaalsContact NH2-OE2 3.17Å
74	Q	87	Confident	72	Confident	52 Å²	52	74.6 Å²	74.6	24%	0.243	42%	0.419	C	S	.	.	H	α-helix	trans	-63.1	-47.7	179.9	-173	-177.7	9.6	0	0	110.7	Q41 D44 A77 Q78	Q41-Q74 HydrophobicContact CB-CG 4.38Å; D44-Q74 PolarHBondContact OD2-N 3.18Å; Q74-A77 PolarHBondContact O-N 3.11Å; Q74-Q78 HydrophobicContact CG-CG 4.25Å; Q74-Q78 WeakPolarHBondContact O-CB 3.28Å; Q74-Q78 WeakPolarHBondContact O-CG 3.38Å; Q74-Q78 PolarHBondContact O-N 2.69Å
75	R	88.6	Confident	74.7	Confident	143 Å²	143	72.2 Å²	72.2	54%	0.54	39%	0.388	S	S	.	.	H	α-helix	trans	-59.7	-49	179.1	-71.7	176.7	-170.8	-176	-0.4	112.1	Q71 A77 Q78 D79	Q71-R75 HydrophobicContact CB-CG 4.23Å; Q71-R75 WeakPolarHBondContact O-CB 3.44Å; Q71-R75 VanDerWaalsContact O-CG 3.26Å; Q71-R75 WeakPolarHBondContact O-CG 3.46Å; Q71-R75 PolarHBondContact O-N 3.3Å; R75-A77 VanDerWaalsContact C-N 3.28Å; R75-A77 PolarHBondContact O-N 3.3Å; R75-Q78 WeakPolarHBondContact O-CB 3.39Å; R75-Q78 PolarHBondContact O-N 3.1Å; R75-Q78 VanDerWaalsContact O-N 3.07Å; R75-D79 PolarHBondContact O-N 3.37Å
76	L	90.6	Very high	76.7	Confident	35 Å²	35	72.5 Å²	72.5	18%	0.183	39%	0.385	C	S	.	.	H	α-helix	trans	-55.4	-45.5	177.1	-176.1	162.2	0	0	0	111.6	A19 E20 R72 F80 I155	A19-L76 HydrophobicContact CB-CD2 3.77Å; E20-L76 HydrophobicContact CG-CD2 3.97Å; R72-L76 VanDerWaalsContact O-CB 3.23Å; R72-L76 WeakPolarHBondContact O-CB 3.23Å; R72-L76 PolarHBondContact O-N 3.36Å; L76-F80 WeakPolarHBondContact O-CB 3.26Å; L76-F80 PolarHBondContact O-N 3.37Å; L76-F80 VanDerWaalsContact O-N 3.12Å; L76-I155 HydrophobicContact CD1-CD1 4.21Å
77	A	88.6	Confident	79	Confident	2 Å²	2	73.1 Å²	73.1	2%	0.017	38%	0.38	C	S	.	.	H	α-helix	trans	-67	-38.3	179	0	0	0	0	0	112.2	L23 L37 L40 R73 Q74 R75 L81	L23-A77 HydrophobicContact CD1-CB 4.02Å; L37-A77 HydrophobicContact CD2-CB 3.58Å; L40-A77 HydrophobicContact CD1-CB 4.03Å; R73-A77 WeakPolarHBondContact O-CB 3.49Å; R73-A77 PolarHBondContact O-N 2.79Å; R73-A77 VanDerWaalsContact O-N 3.08Å; Q74-A77 PolarHBondContact O-N 3.11Å; R75-A77 VanDerWaalsContact C-N 3.28Å; R75-A77 PolarHBondContact O-N 3.3Å; A77-L81 VanDerWaalsContact O-CG 3.31Å; A77-L81 WeakPolarHBondContact O-CG 3.27Å; A77-L81 PolarHBondContact O-N 3.4Å; A77-L81 VanDerWaalsContact O-N 3.13Å
78	Q	88.4	Confident	81	Confident	47 Å²	47	70.6 Å²	70.6	22%	0.22	36%	0.363	C	S	.	.	H	α-helix	trans	-65.3	-49.6	176.6	-71.6	-69.1	-10.3	0	0	111.8	Q74 R75 F80 L81 V82 A94	Q74-Q78 HydrophobicContact CG-CG 4.25Å; Q74-Q78 WeakPolarHBondContact O-CB 3.28Å; Q74-Q78 WeakPolarHBondContact O-CG 3.38Å; Q74-Q78 PolarHBondContact O-N 2.69Å; R75-Q78 WeakPolarHBondContact O-CB 3.39Å; R75-Q78 PolarHBondContact O-N 3.1Å; R75-Q78 VanDerWaalsContact O-N 3.07Å; Q78-F80 PolarHBondContact O-N 3.43Å; Q78-L81 PolarHBondContact O-N 2.93Å; Q78-V82 VanDerWaalsContact O-CG2 3.32Å; Q78-V82 WeakPolarHBondContact O-CG2 3.33Å; Q78-V82 PolarHBondContact O-N 3.42Å; Q78-A94 PolarHBondContact NE2-O 3.44Å
79	D	90.1	Very high	83	Confident	110 Å²	110	71.8 Å²	71.8	59%	0.588	35%	0.351	S	S	*	.	H	α-helix	trans	-57	-39.8	178.1	-62.8	-20.6	0	0	0	111	R75 V82 W83	R75-D79 PolarHBondContact O-N 3.37Å; D79-V82 PolarHBondContact O-N 3.39Å; D79-W83 WeakPolarHBondContact O-CB 3.42Å; D79-W83 PolarHBondContact O-N 3Å
80	F	90.2	Very high	84.6	Confident	13 Å²	13	71.2 Å²	71.2	6%	0.057	34%	0.339	C	S	.	.	H	α-helix	trans	-65.4	-39.1	176	177.6	-109.8	0	0	0	113.4	E20 L23 F24 L76 Q78 W83 M84	E20-F80 HydrophobicContact CB-CD2 3.6Å; E20-F80 HydrophobicContact CB-CE2 3.68Å; E20-F80 HydrophobicContact CB-CG 4.11Å; E20-F80 HydrophobicContact CB-CZ 4.24Å; E20-F80 HydrophobicContact CG-CB 4.1Å; E20-F80 HydrophobicContact CG-CD2 3.62Å; E20-F80 HydrophobicContact CG-CE2 4.24Å; E20-F80 HydrophobicContact CG-CG 3.91Å; E20-F80 WeakPolarHBondContact O-CZ 3.33Å; L23-F80 HydrophobicContact CB-CD1 3.76Å; L23-F80 HydrophobicContact CB-CE1 3.4Å; L23-F80 VanDerWaalsContact CB-CE1 3.4Å; L23-F80 HydrophobicContact CB-CZ 4.37Å; L23-F80 HydrophobicContact CD1-CD1 3.83Å; L23-F80 HydrophobicContact CD1-CE1 4.37Å; L23-F80 HydrophobicContact CG-CD1 4.46Å; F24-F80 HydrophobicContact CB-CZ 3.86Å; F24-F80 HydrophobicContact CD2-CZ 4.42Å; L76-F80 WeakPolarHBondContact O-CB 3.26Å; L76-F80 PolarHBondContact O-N 3.37Å; L76-F80 VanDerWaalsContact O-N 3.12Å; Q78-F80 PolarHBondContact O-N 3.43Å; F80-W83 HydrophobicContact CD2-CE3 4.09Å; F80-W83 AromaticContact CE2-CE3 3.92Å; F80-W83 HydrophobicContact CE2-CE3 3.92Å; F80-W83 AromaticContact CE2-CZ3 3.9Å; F80-W83 HydrophobicContact CE2-CZ3 3.9Å; F80-W83 PolarHBondContact O-N 2.88Å; F80-M84 HydrophobicContact CD1-CE 4.04Å; F80-M84 HydrophobicContact CE1-CE 3.06Å; F80-M84 HydrophobicContact CE2-CE 4.03Å; F80-M84 HydrophobicContact CZ-CE 3.05Å; F80-M84 WeakPolarHBondContact O-CB 3.42Å; F80-M84 PolarHBondContact O-N 3.25Å
81	L	88.3	Confident	85.9	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-68.4	-43.4	176.3	-66.2	171.9	0	0	0	111.2	L33 L37 A77 Q78 W83 M84 D85 F90 A94	L33-L81 HydrophobicContact CD2-CD2 3.97Å; L37-L81 HydrophobicContact CD1-CD1 3.41Å; L37-L81 VanDerWaalsContact CD1-CD1 3.41Å; L37-L81 HydrophobicContact CD2-CD1 3.87Å; L37-L81 HydrophobicContact CG-CD1 4.27Å; A77-L81 VanDerWaalsContact O-CG 3.31Å; A77-L81 WeakPolarHBondContact O-CG 3.27Å; A77-L81 PolarHBondContact O-N 3.4Å; A77-L81 VanDerWaalsContact O-N 3.13Å; Q78-L81 PolarHBondContact O-N 2.93Å; L81-W83 PolarHBondContact O-N 3.4Å; L81-M84 PolarHBondContact O-N 3.12Å; L81-M84 VanDerWaalsContact O-N 3.08Å; L81-D85 VanDerWaalsContact O-CB 3.29Å; L81-D85 WeakPolarHBondContact O-CB 3.07Å; L81-D85 PolarHBondContact O-N 3.03Å; L81-F90 HydrophobicContact CB-CB 4.33Å; L81-F90 HydrophobicContact CD2-CB 4.19Å; L81-F90 HydrophobicContact CD2-CD1 4.01Å; L81-F90 HydrophobicContact CD2-CG 4.42Å; L81-A94 HydrophobicContact CD1-CB 3.61Å
82	V	89.4	Confident	86.7	Confident	84 Å²	84	70.8 Å²	70.8	51%	0.509	34%	0.343	S	S	.	.	H	α-helix	trans	-53.8	-44.9	174	175.5	0	0	0	0	110.1	Q78 D79 D85 L91	Q78-V82 VanDerWaalsContact O-CG2 3.32Å; Q78-V82 WeakPolarHBondContact O-CG2 3.33Å; Q78-V82 PolarHBondContact O-N 3.42Å; D79-V82 PolarHBondContact O-N 3.39Å; V82-D85 PolarHBondContact O-N 2.9Å; V82-L91 HydrophobicContact CB-CD2 4.27Å; V82-L91 HydrophobicContact CG2-CD2 3.56Å
83	W	89	Confident	86.5	Confident	189 Å²	189	64.2 Å²	64.2	72%	0.716	32%	0.321	S	S	*	.	H	α-helix	trans	-67.3	-36.3	178	175.3	82.2	0	0	0	113.6	D79 F80 L81	D79-W83 WeakPolarHBondContact O-CB 3.42Å; D79-W83 PolarHBondContact O-N 3Å; F80-W83 HydrophobicContact CD2-CE3 4.09Å; F80-W83 AromaticContact CE2-CE3 3.92Å; F80-W83 HydrophobicContact CE2-CE3 3.92Å; F80-W83 AromaticContact CE2-CZ3 3.9Å; F80-W83 HydrophobicContact CE2-CZ3 3.9Å; F80-W83 PolarHBondContact O-N 2.88Å; L81-W83 PolarHBondContact O-N 3.4Å
84	M	88.7	Confident	85.7	Confident	20 Å²	20	63 Å²	63	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-77.6	-24.8	179.4	-170.8	-175.6	-52.6	0	0	113	F24 R27 F80 L81 Q86 F90	F24-M84 HydrophobicContact CD2-CE 4.07Å; R27-M84 HydrophobicContact CB-CE 4.16Å; R27-M84 HydrophobicContact CB-SD 3.61Å; R27-M84 HydrophobicContact CG-SD 4.4Å; F80-M84 HydrophobicContact CD1-CE 4.04Å; F80-M84 HydrophobicContact CE1-CE 3.06Å; F80-M84 HydrophobicContact CE2-CE 4.03Å; F80-M84 HydrophobicContact CZ-CE 3.05Å; F80-M84 WeakPolarHBondContact O-CB 3.42Å; F80-M84 PolarHBondContact O-N 3.25Å; L81-M84 PolarHBondContact O-N 3.12Å; L81-M84 VanDerWaalsContact O-N 3.08Å; M84-Q86 PolarHBondContact O-N 3.46Å; M84-F90 HydrophobicContact CG-CD2 4.44Å; M84-F90 HydrophobicContact CG-CE2 4.25Å; M84-F90 HydrophobicContact SD-CD2 4.43Å; M84-F90 HydrophobicContact SD-CE1 4.08Å; M84-F90 HydrophobicContact SD-CE2 3.96Å; M84-F90 HydrophobicContact SD-CZ 3.76Å
85	D	87.8	Confident	85.2	Confident	25 Å²	25	67.5 Å²	67.5	13%	0.134	34%	0.341	C	S	.	.			trans	-75.9	95.7	-164.5	-157.8	8.9	0	0	0	113.2	L81 V82 T87 G88 E89 F90 L91	L81-D85 VanDerWaalsContact O-CB 3.29Å; L81-D85 WeakPolarHBondContact O-CB 3.07Å; L81-D85 PolarHBondContact O-N 3.03Å; V82-D85 PolarHBondContact O-N 2.9Å; D85-T87 PolarHBondContact OD1-N 3.18Å; D85-G88 VanDerWaalsContact CG-CA 3.46Å; D85-G88 VanDerWaalsContact CG-N 3.31Å; D85-G88 WeakPolarHBondContact OD1-CA 3.35Å; D85-G88 PolarHBondContact OD1-N 3.26Å; D85-G88 WeakPolarHBondContact OD2-CA 3.5Å; D85-G88 PolarHBondContact OD2-N 3.08Å; D85-E89 PolarHBondContact OD1-N 2.95Å; D85-E89 VanDerWaalsContact OD1-N 3.13Å; D85-E89 PolarHBondContact OD2-N 3.28Å; D85-F90 HydrophobicContact CB-CB 3.95Å; D85-F90 HydrophobicContact CB-CD2 4.44Å; D85-F90 PolarHBondContact OD1-N 2.9Å; D85-F90 PolarHBondContact OD2-N 3.34Å; D85-L91 HydrophobicContact CB-CD1 4.29Å; D85-L91 HydrophobicContact CB-CG 4.07Å; D85-L91 VanDerWaalsContact OD2-CB 3.27Å; D85-L91 WeakPolarHBondContact OD2-CB 3.42Å; D85-L91 WeakPolarHBondContact OD2-CD1 3.27Å; D85-L91 WeakPolarHBondContact OD2-CG 3.36Å; D85-L91 PolarHBondContact OD2-N 3.07Å
86	Q	84.8	Confident	84.4	Confident	188 Å²	188	66.4 Å²	66.4	88%	0.879	34%	0.34	S	S	*	.	S	Bend	trans	-87.5	-21.2	173.2	-65	173.8	2.1	0	0	112.3	M84	M84-Q86 PolarHBondContact O-N 3.46Å
87	T	84.4	Confident	83.3	Confident	94 Å²	94	72.1 Å²	72.1	58%	0.577	37%	0.366	S	S	*	.	S	Bend	trans	-112.2	-8.9	-169.9	58.7	0	0	0	0	114	D85 E89	D85-T87 PolarHBondContact OD1-N 3.18Å; T87-E89 PolarHBondContact O-N 2.84Å; T87-E89 WeakPolarHBondContact OG1-CG 3.32Å; T87-E89 PolarHBondContact OG1-OE2 2.96Å
88	G	81.4	Confident	82.4	Confident	41 Å²	41	78.2 Å²	78.2	42%	0.423	39%	0.394	S	S	.	.	S	Bend	trans	81.6	-4.1	-172.5	0	0	0	0	0	113.6	D85 S92	D85-G88 VanDerWaalsContact CG-CA 3.46Å; D85-G88 VanDerWaalsContact CG-N 3.31Å; D85-G88 WeakPolarHBondContact OD1-CA 3.35Å; D85-G88 PolarHBondContact OD1-N 3.26Å; D85-G88 WeakPolarHBondContact OD2-CA 3.5Å; D85-G88 PolarHBondContact OD2-N 3.08Å; G88-S92 PolarHBondContact O-N 3.49Å
89	E	83.1	Confident	81.8	Confident	91 Å²	91	80.4 Å²	80.4	43%	0.425	41%	0.411	S	S	.	.	H	α-helix	trans	-77.8	-33.2	-174.3	-65.1	-177.4	115.4	0	0	112.2	K30 D85 T87 S92 L93	K30-E89 IonicContact NZ-OE1 2.82Å; K30-E89 PolarHBondContact NZ-OE1 3Å; K30-E89 IonicContact NZ-OE2 2.65Å; K30-E89 PolarHBondContact NZ-OE2 3.26Å; D85-E89 PolarHBondContact OD1-N 2.95Å; D85-E89 VanDerWaalsContact OD1-N 3.13Å; D85-E89 PolarHBondContact OD2-N 3.28Å; T87-E89 PolarHBondContact O-N 2.84Å; T87-E89 WeakPolarHBondContact OG1-CG 3.32Å; T87-E89 PolarHBondContact OG1-OE2 2.96Å; E89-S92 PolarHBondContact O-OG 3.07Å; E89-L93 PolarHBondContact O-N 3.49Å; E89-L93 VanDerWaalsContact O-N 3.14Å
90	F	83.8	Confident	81.4	Confident	22 Å²	22	76 Å²	76	10%	0.096	39%	0.387	C	S	.	.	H	α-helix	trans	-75	-36.6	-178.5	-71	-75.2	0	0	0	112.2	R27 L33 L81 M84 D85 L93 A94	R27-F90 HydrophobicContact CB-CE1 4.35Å; R27-F90 HydrophobicContact CB-CZ 4.2Å; L33-F90 HydrophobicContact CD2-CD1 3.86Å; L33-F90 HydrophobicContact CD2-CE1 3.75Å; L81-F90 HydrophobicContact CB-CB 4.33Å; L81-F90 HydrophobicContact CD2-CB 4.19Å; L81-F90 HydrophobicContact CD2-CD1 4.01Å; L81-F90 HydrophobicContact CD2-CG 4.42Å; M84-F90 HydrophobicContact CG-CD2 4.44Å; M84-F90 HydrophobicContact CG-CE2 4.25Å; M84-F90 HydrophobicContact SD-CD2 4.43Å; M84-F90 HydrophobicContact SD-CE1 4.08Å; M84-F90 HydrophobicContact SD-CE2 3.96Å; M84-F90 HydrophobicContact SD-CZ 3.76Å; D85-F90 HydrophobicContact CB-CB 3.95Å; D85-F90 HydrophobicContact CB-CD2 4.44Å; D85-F90 PolarHBondContact OD1-N 2.9Å; D85-F90 PolarHBondContact OD2-N 3.34Å; F90-L93 VanDerWaalsContact O-CB 3.31Å; F90-L93 WeakPolarHBondContact O-CB 3.41Å; F90-L93 PolarHBondContact O-N 3.06Å; F90-A94 PolarHBondContact O-N 3.19Å; F90-A94 VanDerWaalsContact O-N 3.11Å
91	L	81.6	Confident	81.1	Confident	62 Å²	62	78.6 Å²	78.6	33%	0.325	41%	0.405	S	S	.	.	H	α-helix	trans	-63	-46.3	172.2	-71.7	169.1	0	0	0	110.7	V82 D85 L93 A94 E95	V82-L91 HydrophobicContact CB-CD2 4.27Å; V82-L91 HydrophobicContact CG2-CD2 3.56Å; D85-L91 HydrophobicContact CB-CD1 4.29Å; D85-L91 HydrophobicContact CB-CG 4.07Å; D85-L91 VanDerWaalsContact OD2-CB 3.27Å; D85-L91 WeakPolarHBondContact OD2-CB 3.42Å; D85-L91 WeakPolarHBondContact OD2-CD1 3.27Å; D85-L91 WeakPolarHBondContact OD2-CG 3.36Å; D85-L91 PolarHBondContact OD2-N 3.07Å; L91-L93 PolarHBondContact O-N 3.23Å; L91-A94 WeakPolarHBondContact O-CB 3.43Å; L91-A94 PolarHBondContact O-N 3.04Å; L91-E95 WeakPolarHBondContact O-CG 3.39Å; L91-E95 PolarHBondContact O-N 3.1Å
92	S	82.7	Confident	80.9	Confident	49 Å²	49	80.3 Å²	80.3	34%	0.343	42%	0.416	S	S	.	.	H	α-helix	trans	-57.8	-35.1	176.1	82.3	0	0	0	0	112.4	G88 E89 K96	G88-S92 PolarHBondContact O-N 3.49Å; E89-S92 PolarHBondContact O-OG 3.07Å; S92-K96 WeakPolarHBondContact O-CB 3.44Å; S92-K96 WeakPolarHBondContact O-CG 3.38Å; S92-K96 PolarHBondContact O-N 3.25Å
93	L	78	Confident	80.6	Confident	35 Å²	35	81.6 Å²	81.6	18%	0.183	42%	0.415	C	S	.	.	H	α-helix	trans	-68.5	-36.4	176.9	-166.2	69.3	0	0	0	112.1	K30 L33 A34 E89 F90 L91	K30-L93 HydrophobicContact CB-CD2 4.27Å; K30-L93 WeakPolarHBondContact O-CD2 3.46Å; L33-L93 HydrophobicContact CB-CD2 4.37Å; L33-L93 HydrophobicContact CD2-CD2 4.23Å; L33-L93 HydrophobicContact CG-CD2 4.39Å; A34-L93 HydrophobicContact CB-CD1 3.7Å; A34-L93 HydrophobicContact CB-CD2 4.11Å; A34-L93 HydrophobicContact CB-CG 3.84Å; E89-L93 PolarHBondContact O-N 3.49Å; E89-L93 VanDerWaalsContact O-N 3.14Å; F90-L93 VanDerWaalsContact O-CB 3.31Å; F90-L93 WeakPolarHBondContact O-CB 3.41Å; F90-L93 PolarHBondContact O-N 3.06Å; L91-L93 PolarHBondContact O-N 3.23Å
94	A	73.5	Confident	80.3	Confident	20 Å²	20	76.6 Å²	76.6	17%	0.165	40%	0.399	C	S	.	.	H	α-helix	trans	-77.7	-30.3	-176.4	0	0	0	0	0	112.5	Q78 L81 F90 L91	Q78-A94 PolarHBondContact NE2-O 3.44Å; L81-A94 HydrophobicContact CD1-CB 3.61Å; F90-A94 PolarHBondContact O-N 3.19Å; F90-A94 VanDerWaalsContact O-N 3.11Å; L91-A94 WeakPolarHBondContact O-CB 3.43Å; L91-A94 PolarHBondContact O-N 3.04Å
95	E	76.3	Confident	80	Confident	147 Å²	147	81.6 Å²	81.6	69%	0.687	42%	0.422	S	S	*	.	H	α-helix	trans	-82.1	-31.7	177.7	-70.2	178.1	173.6	0	0	113.2	L91 Q97	L91-E95 WeakPolarHBondContact O-CG 3.39Å; L91-E95 PolarHBondContact O-N 3.1Å; E95-Q97 PolarHBondContact O-N 3.32Å
96	K	72.9	Confident	79.8	Confident	120 Å²	120	82.6 Å²	82.6	52%	0.522	42%	0.424	S	S	.	.			trans	-61.2	101	177.1	-82.1	175.7	-178	-167.3	0	110.5	S92 E98	S92-K96 WeakPolarHBondContact O-CB 3.44Å; S92-K96 WeakPolarHBondContact O-CG 3.38Å; S92-K96 PolarHBondContact O-N 3.25Å; K96-E98 HydrophobicContact CB-CG 4.3Å; K96-E98 PolarHBondContact O-N 3.12Å
97	Q	65.4	Low	79.4	Confident	155 Å²	155	79.4 Å²	79.4	72%	0.724	41%	0.411	S	S	*	.			trans	-74	21.6	171.9	-72.9	-164.6	44.9	0	0	113.5	K38 E95	K38-Q97 PolarHBondContact NZ-O 2.7Å; E95-Q97 PolarHBondContact O-N 3.32Å
98	E	71.4	Confident	79.1	Confident	130 Å²	130	79.5 Å²	79.5	61%	0.607	40%	0.404	S	S	*	.			trans	-55.9	150.4	179	-69	177.8	-168.8	0	0	111.3	K38 K96	K38-E98 PolarHBondContact NZ-O 3.33Å; K38-E98 VanDerWaalsContact NZ-O 3.09Å; K96-E98 HydrophobicContact CB-CG 4.3Å; K96-E98 PolarHBondContact O-N 3.12Å
99	V	74.6	Confident	78.6	Confident	94 Å²	94	81.7 Å²	81.7	57%	0.57	41%	0.41	S	S	*	.			trans	-70	139.2	174.6	-179	0	0	0	0	107.8	P101 Q104	V99-P101 WeakPolarHBondContact O-CD 3.24Å; V99-Q104 HydrophobicContact CG1-CB 3.98Å
100	D	83.2	Confident	77.9	Confident	17 Å²	17	82.3 Å²	82.3	9%	0.091	41%	0.408	C	S	.	.			trans	-61.9	111.1	173.1	170.9	6.3	0	0	0	108.7	R35 V102 K103 Q104	R35-D100 WeakPolarHBondContact CD-OD1 3.41Å; R35-D100 WeakPolarHBondContact CG-OD1 3.34Å; R35-D100 IonicContact CZ-OD1 2.96Å; R35-D100 IonicContact CZ-OD2 3.12Å; R35-D100 VanDerWaalsContact NE-CG 3.27Å; R35-D100 IonicContact NE-OD1 3.11Å; R35-D100 PolarHBondContact NE-OD1 3.49Å; R35-D100 IonicContact NE-OD2 3.94Å; R35-D100 PolarHBondContact NE-OD2 2.98Å; R35-D100 IonicContact NH2-OD2 2.89Å; R35-D100 PolarHBondContact NH2-OD2 3.27Å; R35-D100 VanDerWaalsContact NH2-OD2 3.12Å; D100-V102 PolarHBondContact O-N 2.95Å; D100-V102 WeakPolarHBondContact OD1-CB 3.45Å; D100-V102 PolarHBondContact OD1-N 2.93Å; D100-K103 HydrophobicContact CB-CB 3.74Å; D100-K103 WeakPolarHBondContact O-CB 3.28Å; D100-K103 PolarHBondContact O-N 3.29Å; D100-K103 PolarHBondContact OD1-N 3.26Å; D100-K103 WeakPolarHBondContact OD2-CB 3Å; D100-Q104 PolarHBondContact O-N 2.93Å
101	P	82.4	Confident	76.8	Confident	67 Å²	67	84.3 Å²	84.3	44%	0.435	44%	0.435	S	S	.	.	H	α-helix	trans	-63	-32.8	-173.4	25.4	-34.4	0	0	0	111.8	V99 Q104 E105	V99-P101 WeakPolarHBondContact O-CD 3.24Å; P101-Q104 PolarHBondContact O-N 3.45Å; P101-E105 WeakPolarHBondContact O-CB 3.44Å; P101-E105 PolarHBondContact O-N 3.44Å
102	V	84.6	Confident	75.8	Confident	37 Å²	37	88.9 Å²	88.9	22%	0.224	45%	0.454	C	S	.	.	H	α-helix	trans	-68.5	-39.9	176.9	178.5	0	0	0	0	110.3	D100 Q104 R106	D100-V102 PolarHBondContact O-N 2.95Å; D100-V102 WeakPolarHBondContact OD1-CB 3.45Å; D100-V102 PolarHBondContact OD1-N 2.93Å; V102-Q104 VanDerWaalsContact C-N 3.35Å; V102-R106 WeakPolarHBondContact O-CB 3.31Å; V102-R106 WeakPolarHBondContact O-CD 3.23Å; V102-R106 WeakPolarHBondContact O-CG 3.44Å; V102-R106 PolarHBondContact O-N 3.19Å; V102-R106 VanDerWaalsContact O-N 3.11Å
103	K	82.5	Confident	74.5	Confident	111 Å²	111	92.5 Å²	92.5	48%	0.483	47%	0.465	S	S	.	.	H	α-helix	trans	-69	-37.1	177	-169.8	178.8	179.8	-174.3	0	111.4	D100 M107	D100-K103 HydrophobicContact CB-CB 3.74Å; D100-K103 WeakPolarHBondContact O-CB 3.28Å; D100-K103 PolarHBondContact O-N 3.29Å; D100-K103 PolarHBondContact OD1-N 3.26Å; D100-K103 WeakPolarHBondContact OD2-CB 3Å; K103-M107 WeakPolarHBondContact O-CB 3.18Å; K103-M107 PolarHBondContact O-N 3.48Å
104	Q	83.8	Confident	73.5	Confident	84 Å²	84	98.4 Å²	98.4	39%	0.393	49%	0.492	S	S	.	.	H	α-helix	trans	-65.5	-51.6	176.3	178.7	168.4	-8.4	0	0	111.3	V99 D100 P101 V102 R106 M107 E108	V99-Q104 HydrophobicContact CG1-CB 3.98Å; D100-Q104 PolarHBondContact O-N 2.93Å; P101-Q104 PolarHBondContact O-N 3.45Å; V102-Q104 VanDerWaalsContact C-N 3.35Å; Q104-R106 VanDerWaalsContact C-N 3.32Å; Q104-R106 PolarHBondContact O-N 3.33Å; Q104-M107 CarbonylContact O-C 3.31Å; Q104-M107 WeakPolarHBondContact O-CA 3.09Å; Q104-M107 WeakPolarHBondContact O-CB 3.4Å; Q104-M107 PolarHBondContact O-N 3.38Å; Q104-E108 HydrophobicContact CG-CG 4.38Å; Q104-E108 WeakPolarHBondContact CG-OE1 3.47Å; Q104-E108 PolarHBondContact NE2-OE1 3.4Å; Q104-E108 WeakPolarHBondContact O-CG 3.19Å; Q104-E108 PolarHBondContact O-N 3.24Å
105	E	82.9	Confident	72.8	Confident	125 Å²	125	105.8 Å²	105.8	58%	0.584	53%	0.527	S	S	*	.	H	α-helix	trans	-55.5	-46.5	176.7	-177	-178.2	-174.1	0	0	111.5	P101 M107 E108 V109	P101-E105 WeakPolarHBondContact O-CB 3.44Å; P101-E105 PolarHBondContact O-N 3.44Å; E105-M107 PolarHBondContact O-N 3.47Å; E105-E108 PolarHBondContact O-N 3.03Å; E105-V109 WeakPolarHBondContact O-CG2 3.28Å; E105-V109 PolarHBondContact O-N 3.34Å
106	R	82.3	Confident	72.4	Confident	46 Å²	46	101.3 Å²	101.3	17%	0.174	51%	0.507	C	S	.	.	H	α-helix	trans	-63.4	-28.4	175.7	-72.9	173.4	176.9	164.2	3.7	113.6	V102 Q104 R110 E166 D173	V102-R106 WeakPolarHBondContact O-CB 3.31Å; V102-R106 WeakPolarHBondContact O-CD 3.23Å; V102-R106 WeakPolarHBondContact O-CG 3.44Å; V102-R106 PolarHBondContact O-N 3.19Å; V102-R106 VanDerWaalsContact O-N 3.11Å; Q104-R106 VanDerWaalsContact C-N 3.32Å; Q104-R106 PolarHBondContact O-N 3.33Å; R106-R110 WeakPolarHBondContact O-CB 3.42Å; R106-E166 IonicContact CZ-OE2 2.71Å; R106-E166 IonicContact NH1-OE1 3.93Å; R106-E166 IonicContact NH1-OE2 3.98Å; R106-E166 PolarHBondContact NH1-OE2 3.07Å; R106-E166 IonicContact NH2-OE2 2.86Å; R106-D173 IonicContact CZ-OD2 2.76Å; R106-D173 IonicContact NE-OD2 2.74Å; R106-D173 PolarHBondContact NE-OD2 3.43Å; R106-D173 IonicContact NH2-OD2 3.48Å; R106-D173 PolarHBondContact NH2-OD2 3.31Å
107	M	76.6	Confident	72.7	Confident	121 Å²	121	99 Å²	99	60%	0.596	51%	0.506	S	S	*	.	H	α-helix	trans	-77.5	-42.5	175.6	-172.2	-173.4	-60.1	0	0	110.6	K103 Q104 E105 R110 G111	K103-M107 WeakPolarHBondContact O-CB 3.18Å; K103-M107 PolarHBondContact O-N 3.48Å; Q104-M107 CarbonylContact O-C 3.31Å; Q104-M107 WeakPolarHBondContact O-CA 3.09Å; Q104-M107 WeakPolarHBondContact O-CB 3.4Å; Q104-M107 PolarHBondContact O-N 3.38Å; E105-M107 PolarHBondContact O-N 3.47Å; M107-R110 CarbonylContact O-C 3.58Å; M107-R110 WeakPolarHBondContact O-CB 3.31Å; M107-R110 PolarHBondContact O-N 2.87Å; M107-G111 PolarHBondContact O-N 3.1Å
108	E	78.4	Confident	73.4	Confident	95 Å²	95	99.8 Å²	99.8	44%	0.444	51%	0.509	S	S	.	.	H	α-helix	trans	-62.5	-51.7	177.6	-72.1	170.7	-172.3	0	0	110.5	Q104 E105 R110 G111 H112	Q104-E108 HydrophobicContact CG-CG 4.38Å; Q104-E108 WeakPolarHBondContact CG-OE1 3.47Å; Q104-E108 PolarHBondContact NE2-OE1 3.4Å; Q104-E108 WeakPolarHBondContact O-CG 3.19Å; Q104-E108 PolarHBondContact O-N 3.24Å; E105-E108 PolarHBondContact O-N 3.03Å; E108-R110 PolarHBondContact O-N 3.36Å; E108-G111 WeakPolarHBondContact O-CA 3.47Å; E108-G111 PolarHBondContact O-N 3.19Å; E108-H112 VanDerWaalsContact C-ND1 3.35Å; E108-H112 PolarHBondContact O-N 3.46Å; E108-H112 VanDerWaalsContact O-N 3.07Å; E108-H112 PolarHBondContact O-ND1 3.38Å
109	V	71.1	Confident	74	Confident	88 Å²	88	101.2 Å²	101.2	53%	0.533	51%	0.514	S	S	.	.	H	α-helix	trans	-52.9	-35.2	175	172.8	0	0	0	0	111.6	E105 H113	E105-V109 WeakPolarHBondContact O-CG2 3.28Å; E105-V109 PolarHBondContact O-N 3.34Å; V109-H113 PolarHBondContact O-CD2 3.15Å; V109-H113 VanDerWaalsContact O-CD2 3.29Å
110	R	67.4	Low	74.3	Confident	104 Å²	104	101.4 Å²	101.4	39%	0.392	51%	0.507	S	S	.	.	H	α-helix	trans	-76.1	-36.1	176.8	-171.7	-175.9	-53.5	-89.8	-11.9	113.1	R106 M107 E108 H112 H113 I124 L128	R106-R110 WeakPolarHBondContact O-CB 3.42Å; M107-R110 CarbonylContact O-C 3.58Å; M107-R110 WeakPolarHBondContact O-CB 3.31Å; M107-R110 PolarHBondContact O-N 2.87Å; E108-R110 PolarHBondContact O-N 3.36Å; R110-H112 VanDerWaalsContact C-N 3.27Å; R110-H112 PolarHBondContact O-N 3.03Å; R110-H113 PolarHBondContact O-N 3.45Å; R110-I124 VanDerWaalsContact NH1-CG2 3.34Å; R110-L128 VanDerWaalsContact CZ-CD2 3.45Å
111	G	61.8	Low	74.2	Confident	64 Å²	64	107.6 Å²	107.6	66%	0.66	53%	0.53	S	S	*	.	H	α-helix	trans	-68.4	-24.5	177.8	0	0	0	0	0	113.5	M107 E108 H113	M107-G111 PolarHBondContact O-N 3.1Å; E108-G111 WeakPolarHBondContact O-CA 3.47Å; E108-G111 PolarHBondContact O-N 3.19Å; G111-H113 PolarHBondContact O-N 2.8Å
112	H	59.9	Low	74.1	Confident	158 Å²	158	108.5 Å²	108.5	73%	0.731	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-15.2	173	-67.9	93.3	0	0	0	113.2	E108 R110 E114	E108-H112 VanDerWaalsContact C-ND1 3.35Å; E108-H112 PolarHBondContact O-N 3.46Å; E108-H112 VanDerWaalsContact O-N 3.07Å; E108-H112 PolarHBondContact O-ND1 3.38Å; R110-H112 VanDerWaalsContact C-N 3.27Å; R110-H112 PolarHBondContact O-N 3.03Å; H112-E114 PolarHBondContact O-N 3.49Å; H112-E114 VanDerWaalsContact O-N 3.15Å
113	H	54.9	Low	74	Confident	124 Å²	124	109.7 Å²	109.7	57%	0.574	54%	0.536	S	S	*	.	S	Bend	trans	-87.4	77.4	177.7	-71.3	-66.5	0	0	0	112.2	V109 R110 G111	V109-H113 PolarHBondContact O-CD2 3.15Å; V109-H113 VanDerWaalsContact O-CD2 3.29Å; R110-H113 PolarHBondContact O-N 3.45Å; G111-H113 PolarHBondContact O-N 2.8Å
114	E	57.3	Low	73.5	Confident	160 Å²	160	106.6 Å²	106.6	75%	0.748	52%	0.524	S	S	*	.			trans	66.3	161.3	148.8	-146.2	165.4	-161.3	0	0	117.6	H112 M116	H112-E114 PolarHBondContact O-N 3.49Å; H112-E114 VanDerWaalsContact O-N 3.15Å; E114-M116 WeakPolarHBondContact O-CG 3.36Å; E114-M116 PolarHBondContact O-N 3.48Å
115	I	60	Low	73.1	Confident	175 Å²	175	108 Å²	108	90%	0.897	53%	0.527	S	S	*	.	S	Bend	trans	-64.1	104.6	170.6	-63.1	170.3	0	0	0	107.3
116	M	66.6	Low	72.8	Confident	52 Å²	52	107.6 Å²	107.6	26%	0.256	52%	0.523	S	S	.	.			trans	-82.9	129.5	-173.6	-70.3	-73.9	-70.7	0	0	110.7	E114 K120 I124	E114-M116 WeakPolarHBondContact O-CG 3.36Å; E114-M116 PolarHBondContact O-N 3.48Å; M116-K120 HydrophobicContact CE-CB 3.68Å; M116-K120 HydrophobicContact CE-CD 3.37Å; M116-K120 HydrophobicContact CE-CG 3.29Å; M116-K120 HydrophobicContact SD-CD 3.42Å; M116-K120 WeakPolarHBondContact SD-CD 3.33Å; M116-K120 WeakPolarHBondContact SD-CE 3.49Å; M116-K120 HydrophobicContact SD-CG 4.08Å; M116-K120 PolarHBondContact SD-NZ 3.28Å; M116-I124 HydrophobicContact CE-CD1 3.34Å; M116-I124 HydrophobicContact CE-CG1 4.28Å
117	S	79.8	Confident	72.5	Confident	73 Å²	73	112.3 Å²	112.3	51%	0.51	55%	0.547	S	S	.	.			trans	-62.5	148.4	166.2	69.3	0	0	0	0	110.4	K119 K120 Y121	S117-K119 PolarHBondContact O-N 2.98Å; S117-K120 PolarHBondContact O-N 2.86Å; S117-K120 WeakPolarHBondContact OG-CB 3.45Å; S117-Y121 PolarHBondContact O-N 3.35Å
118	E	80.6	Confident	72.2	Confident	170 Å²	170	109.7 Å²	109.7	79%	0.794	53%	0.534	S	S	*	.	H	α-helix	trans	-51.3	-44	-179.1	-175.9	-175.9	179.9	0	0	112.3	K120 Y121 L122	E118-K120 PolarHBondContact O-N 2.99Å; E118-Y121 WeakPolarHBondContact O-CB 3.31Å; E118-Y121 PolarHBondContact O-N 3.46Å; E118-L122 WeakPolarHBondContact O-CB 3.45Å; E118-L122 PolarHBondContact O-N 2.93Å
119	K	84.1	Confident	71.6	Confident	161 Å²	161	107 Å²	107	70%	0.7	52%	0.523	S	S	*	.	H	α-helix	trans	-60	-45.7	177.8	-175	177.6	-180	177.7	0	112.3	S117 Y121 L122 D123	S117-K119 PolarHBondContact O-N 2.98Å; K119-Y121 VanDerWaalsContact C-N 3.35Å; K119-L122 PolarHBondContact O-N 3.26Å; K119-D123 PolarHBondContact O-N 3.48Å
120	K	80.3	Confident	71.3	Confident	97 Å²	97	105.3 Å²	105.3	42%	0.422	52%	0.519	S	S	.	.	H	α-helix	trans	-68.2	-37.8	-179.5	-162.3	-171.8	162.8	-166.5	0	110.5	M116 S117 E118 I124	M116-K120 HydrophobicContact CE-CB 3.68Å; M116-K120 HydrophobicContact CE-CD 3.37Å; M116-K120 HydrophobicContact CE-CG 3.29Å; M116-K120 HydrophobicContact SD-CD 3.42Å; M116-K120 WeakPolarHBondContact SD-CD 3.33Å; M116-K120 WeakPolarHBondContact SD-CE 3.49Å; M116-K120 HydrophobicContact SD-CG 4.08Å; M116-K120 PolarHBondContact SD-NZ 3.28Å; S117-K120 PolarHBondContact O-N 2.86Å; S117-K120 WeakPolarHBondContact OG-CB 3.45Å; E118-K120 PolarHBondContact O-N 2.99Å; K120-I124 WeakPolarHBondContact O-CG1 3.38Å; K120-I124 PolarHBondContact O-N 3.26Å
121	Y	80.4	Confident	71.1	Confident	148 Å²	148	102.7 Å²	102.7	58%	0.58	51%	0.514	S	S	*	.	H	α-helix	trans	-61.1	-49	172.7	178	-91.8	0	0	0	111.7	S117 E118 K119 D123 I124 Y125	S117-Y121 PolarHBondContact O-N 3.35Å; E118-Y121 WeakPolarHBondContact O-CB 3.31Å; E118-Y121 PolarHBondContact O-N 3.46Å; K119-Y121 VanDerWaalsContact C-N 3.35Å; Y121-D123 VanDerWaalsContact C-N 3.35Å; Y121-D123 PolarHBondContact O-N 3.47Å; Y121-I124 PolarHBondContact O-N 3.28Å; Y121-Y125 WeakPolarHBondContact O-CB 3.21Å; Y121-Y125 PolarHBondContact O-N 3.07Å
122	L	81.5	Confident	71	Confident	85 Å²	85	102.4 Å²	102.4	45%	0.445	50%	0.5	S	S	.	.	H	α-helix	trans	-64.4	-39.3	-178.3	-167.4	69	0	0	0	112	E118 K119 Y125 K126	E118-L122 WeakPolarHBondContact O-CB 3.45Å; E118-L122 PolarHBondContact O-N 2.93Å; K119-L122 PolarHBondContact O-N 3.26Å; L122-Y125 WeakPolarHBondContact O-CB 3.32Å; L122-Y125 PolarHBondContact O-N 2.95Å; L122-K126 VanDerWaalsContact O-CG 3.32Å; L122-K126 WeakPolarHBondContact O-CG 3.49Å; L122-K126 PolarHBondContact O-N 3.43Å
123	D	80.9	Confident	70.9	Confident	62 Å²	62	96.1 Å²	96.1	33%	0.332	48%	0.475	S	S	.	.	H	α-helix	trans	-67	-41.9	176.1	-76.3	-14.9	0	0	0	111.8	K119 Y121 Y125 K126 H127	K119-D123 PolarHBondContact O-N 3.48Å; Y121-D123 VanDerWaalsContact C-N 3.35Å; Y121-D123 PolarHBondContact O-N 3.47Å; D123-Y125 VanDerWaalsContact C-N 3.32Å; D123-Y125 PolarHBondContact O-N 2.94Å; D123-K126 WeakPolarHBondContact O-CB 3.46Å; D123-K126 PolarHBondContact O-N 2.65Å; D123-K126 IonicContact OD1-NZ 2.92Å; D123-K126 PolarHBondContact OD1-NZ 2.95Å; D123-H127 PolarHBondContact O-CD2 2.88Å; D123-H127 PolarHBondContact O-N 2.96Å
124	I	73.7	Confident	71.3	Confident	47 Å²	47	97.6 Å²	97.6	24%	0.241	48%	0.48	C	S	.	.	H	α-helix	trans	-59.1	-45	171.3	-73.6	-175.5	0	0	0	111	R110 M116 K120 Y121 K126 H127 L128	R110-I124 VanDerWaalsContact NH1-CG2 3.34Å; M116-I124 HydrophobicContact CE-CD1 3.34Å; M116-I124 HydrophobicContact CE-CG1 4.28Å; K120-I124 WeakPolarHBondContact O-CG1 3.38Å; K120-I124 PolarHBondContact O-N 3.26Å; Y121-I124 PolarHBondContact O-N 3.28Å; I124-K126 VanDerWaalsContact C-N 3.33Å; I124-K126 PolarHBondContact O-N 3.44Å; I124-H127 PolarHBondContact O-N 2.73Å; I124-L128 HydrophobicContact CG2-CD1 3.71Å; I124-L128 HydrophobicContact CG2-CG 4.16Å; I124-L128 WeakPolarHBondContact O-CB 3.42Å; I124-L128 VanDerWaalsContact O-CG 3.29Å; I124-L128 WeakPolarHBondContact O-CG 3.41Å; I124-L128 PolarHBondContact O-N 2.94Å
125	Y	73.8	Confident	71.8	Confident	114 Å²	114	96.5 Å²	96.5	45%	0.447	47%	0.473	S	S	.	.	H	α-helix	trans	-60.1	-42.1	177.6	177	-89.2	0	0	0	112.1	Y121 L122 D123 L128 N129	Y121-Y125 WeakPolarHBondContact O-CB 3.21Å; Y121-Y125 PolarHBondContact O-N 3.07Å; L122-Y125 WeakPolarHBondContact O-CB 3.32Å; L122-Y125 PolarHBondContact O-N 2.95Å; D123-Y125 VanDerWaalsContact C-N 3.32Å; D123-Y125 PolarHBondContact O-N 2.94Å; Y125-L128 PolarHBondContact O-N 2.88Å; Y125-N129 WeakPolarHBondContact CD2-ND2 3.42Å; Y125-N129 VanDerWaalsContact CE1-ND2 3.26Å; Y125-N129 WeakPolarHBondContact CE1-ND2 3.22Å; Y125-N129 WeakPolarHBondContact CE2-ND2 3.46Å; Y125-N129 WeakPolarHBondContact O-CB 3.29Å; Y125-N129 PolarHBondContact O-N 3.5Å; Y125-N129 PolarHBondContact O-ND2 2.96Å
126	K	78.3	Confident	72.4	Confident	116 Å²	116	89.9 Å²	89.9	50%	0.504	44%	0.444	S	S	.	.	H	α-helix	trans	-59.9	-45.9	175.2	-73.4	170.4	-166.4	157.6	0	111.4	L122 D123 I124 N129 A130	L122-K126 VanDerWaalsContact O-CG 3.32Å; L122-K126 WeakPolarHBondContact O-CG 3.49Å; L122-K126 PolarHBondContact O-N 3.43Å; D123-K126 WeakPolarHBondContact O-CB 3.46Å; D123-K126 PolarHBondContact O-N 2.65Å; D123-K126 IonicContact OD1-NZ 2.92Å; D123-K126 PolarHBondContact OD1-NZ 2.95Å; I124-K126 VanDerWaalsContact C-N 3.33Å; I124-K126 PolarHBondContact O-N 3.44Å; K126-N129 CarbonylContact O-C 3.58Å; K126-N129 PolarHBondContact O-N 3.14Å; K126-A130 PolarHBondContact O-N 3.4Å; K126-A130 VanDerWaalsContact O-N 3.1Å
127	H	76	Confident	72.9	Confident	145 Å²	145	90.4 Å²	90.4	67%	0.671	45%	0.453	S	S	*	.	H	α-helix	trans	-66	-39.8	178.3	-73.5	-63.9	0	0	0	112.4	D123 I124 N129 A130	D123-H127 PolarHBondContact O-CD2 2.88Å; D123-H127 PolarHBondContact O-N 2.96Å; I124-H127 PolarHBondContact O-N 2.73Å; H127-N129 VanDerWaalsContact C-N 3.35Å; H127-N129 PolarHBondContact O-N 3.21Å; H127-A130 VanDerWaalsContact O-CB 3.27Å; H127-A130 WeakPolarHBondContact O-CB 3.48Å; H127-A130 PolarHBondContact O-N 3.21Å
128	L	69.1	Low	73.2	Confident	65 Å²	65	93.6 Å²	93.6	34%	0.34	46%	0.458	S	S	.	.	H	α-helix	trans	-66.4	-34.8	177	-75.8	175.7	0	0	0	113.3	R110 I124 Y125 A130	R110-L128 VanDerWaalsContact CZ-CD2 3.45Å; I124-L128 HydrophobicContact CG2-CD1 3.71Å; I124-L128 HydrophobicContact CG2-CG 4.16Å; I124-L128 WeakPolarHBondContact O-CB 3.42Å; I124-L128 VanDerWaalsContact O-CG 3.29Å; I124-L128 WeakPolarHBondContact O-CG 3.41Å; I124-L128 PolarHBondContact O-N 2.94Å; Y125-L128 PolarHBondContact O-N 2.88Å; L128-A130 VanDerWaalsContact C-N 3.31Å
129	N	66.8	Low	73.4	Confident	39 Å²	39	86.1 Å²	86.1	21%	0.209	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	10.8	177.3	-69.4	-69.1	0	0	0	113.1	Y125 K126 H127 T131 K134	Y125-N129 WeakPolarHBondContact CD2-ND2 3.42Å; Y125-N129 VanDerWaalsContact CE1-ND2 3.26Å; Y125-N129 WeakPolarHBondContact CE1-ND2 3.22Å; Y125-N129 WeakPolarHBondContact CE2-ND2 3.46Å; Y125-N129 WeakPolarHBondContact O-CB 3.29Å; Y125-N129 PolarHBondContact O-N 3.5Å; Y125-N129 PolarHBondContact O-ND2 2.96Å; K126-N129 CarbonylContact O-C 3.58Å; K126-N129 PolarHBondContact O-N 3.14Å; H127-N129 VanDerWaalsContact C-N 3.35Å; H127-N129 PolarHBondContact O-N 3.21Å; N129-T131 PolarHBondContact O-N 3.08Å; N129-T131 VanDerWaalsContact O-N 3.12Å; N129-K134 PolarHBondContact O-NZ 2.97Å
130	A	65.2	Low	73.5	Confident	53 Å²	53	83.9 Å²	83.9	44%	0.438	41%	0.41	S	S	.	.			trans	-77.9	93.5	172.8	0	0	0	0	0	109.2	K126 H127 L128	K126-A130 PolarHBondContact O-N 3.4Å; K126-A130 VanDerWaalsContact O-N 3.1Å; H127-A130 VanDerWaalsContact O-CB 3.27Å; H127-A130 WeakPolarHBondContact O-CB 3.48Å; H127-A130 PolarHBondContact O-N 3.21Å; L128-A130 VanDerWaalsContact C-N 3.31Å
131	T	63	Low	73.8	Confident	49 Å²	49	84.6 Å²	84.6	30%	0.301	42%	0.418	S	S	.	.			trans	-99.2	141.4	175	60.2	0	0	0	0	110.6	N129 A133 K134	N129-T131 PolarHBondContact O-N 3.08Å; N129-T131 VanDerWaalsContact O-N 3.12Å; T131-A133 PolarHBondContact O-N 3.06Å; T131-K134 PolarHBondContact O-N 2.98Å
132	T	59.4	Low	74.2	Confident	58 Å²	58	86.2 Å²	86.2	36%	0.356	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-59	-24.6	168.5	49	0	0	0	0	112.4	K134 K135 F139 S161	T132-K134 PolarHBondContact O-N 3.29Å; T132-K134 VanDerWaalsContact O-N 3.16Å; T132-K135 CarbonylContact O-C 3.57Å; T132-K135 VanDerWaalsContact O-C 3.29Å; T132-K135 WeakPolarHBondContact O-CA 3.44Å; T132-K135 PolarHBondContact O-N 3.4Å; T132-F139 HydrophobicContact CG2-CD2 4.47Å; T132-S161 WeakPolarHBondContact OG1-CB 3.5Å; T132-S161 PolarHBondContact OG1-O 3.43Å
133	A	57.4	Low	74.5	Confident	26 Å²	26	84 Å²	84	22%	0.215	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-56.1	-28.6	175.7	0	0	0	0	0	114.5	T131 K135 A136	T131-A133 PolarHBondContact O-N 3.06Å; A133-K135 PolarHBondContact O-N 2.9Å; A133-A136 PolarHBondContact O-N 3.43Å
134	K	62.5	Low	74.8	Confident	154 Å²	154	85.8 Å²	85.8	67%	0.67	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-68.1	-15.1	174.5	-70.8	177.1	178.2	172.8	0	112.7	N129 T131 T132	N129-K134 PolarHBondContact O-NZ 2.97Å; T131-K134 PolarHBondContact O-N 2.98Å; T132-K134 PolarHBondContact O-N 3.29Å; T132-K134 VanDerWaalsContact O-N 3.16Å
135	K	67.7	Low	75.5	Confident	137 Å²	137	84.4 Å²	84.4	60%	0.596	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-124.7	47.4	177.4	-65.8	175.1	176	175.4	0	109.9	T132 A133 S137 K138 F139	T132-K135 CarbonylContact O-C 3.57Å; T132-K135 VanDerWaalsContact O-C 3.29Å; T132-K135 WeakPolarHBondContact O-CA 3.44Å; T132-K135 PolarHBondContact O-N 3.4Å; A133-K135 PolarHBondContact O-N 2.9Å; K135-S137 PolarHBondContact O-N 3.36Å; K135-S137 VanDerWaalsContact O-N 3.09Å; K135-K138 HydrophobicContact CB-CB 4.24Å; K135-K138 HydrophobicContact CD-CD 4.31Å; K135-K138 PolarHBondContact O-N 3.41Å; K135-F139 PolarHBondContact O-N 3.25Å
136	A	72.8	Confident	76.2	Confident	37 Å²	37	83 Å²	83	31%	0.306	42%	0.423	S	S	.	.	H	α-helix	trans	-50.8	-37.1	-176	0	0	0	0	0	113.7	A133 R140	A133-A136 PolarHBondContact O-N 3.43Å; A136-R140 WeakPolarHBondContact O-CG 3.44Å; A136-R140 PolarHBondContact O-N 2.97Å
137	S	78.3	Confident	76.7	Confident	62 Å²	62	81.7 Å²	81.7	43%	0.434	43%	0.428	S	S	.	.	H	α-helix	trans	-63.2	-54.2	174.9	-161.5	0	0	0	0	112	K135 F139 R140 D141	K135-S137 PolarHBondContact O-N 3.36Å; K135-S137 VanDerWaalsContact O-N 3.09Å; S137-F139 PolarHBondContact O-N 2.9Å; S137-R140 WeakPolarHBondContact O-CB 3.25Å; S137-R140 PolarHBondContact O-N 3.26Å; S137-D141 PolarHBondContact O-N 3.01Å; S137-D141 VanDerWaalsContact O-OD2 3.12Å
138	K	84.8	Confident	77.5	Confident	141 Å²	141	75.4 Å²	75.4	61%	0.613	40%	0.399	S	S	*	.	H	α-helix	trans	-60.2	-32.9	179.5	-62.4	-170	176.9	-172.7	0	112.5	K135 W142	K135-K138 HydrophobicContact CB-CB 4.24Å; K135-K138 HydrophobicContact CD-CD 4.31Å; K135-K138 PolarHBondContact O-N 3.41Å; K138-W142 VanDerWaalsContact O-CB 3.26Å; K138-W142 WeakPolarHBondContact O-CB 3.34Å; K138-W142 PolarHBondContact O-N 3.41Å
139	F	85.8	Confident	78.6	Confident	13 Å²	13	80.1 Å²	80.1	6%	0.057	42%	0.42	C	S	.	.	H	α-helix	trans	-68	-42.4	175.1	-176.8	-108.4	0	0	0	111.9	T132 K135 S137 W142 L143 T157 L160 S161 A164	T132-F139 HydrophobicContact CG2-CD2 4.47Å; K135-F139 PolarHBondContact O-N 3.25Å; S137-F139 PolarHBondContact O-N 2.9Å; F139-W142 AromaticContact CD2-CE3 3.91Å; F139-W142 HydrophobicContact CD2-CE3 3.91Å; F139-W142 HydrophobicContact CD2-CZ3 4.34Å; F139-W142 AromaticContact CE2-CE3 3.69Å; F139-W142 HydrophobicContact CE2-CE3 3.69Å; F139-W142 AromaticContact CE2-CZ3 3.65Å; F139-W142 HydrophobicContact CE2-CZ3 3.65Å; F139-W142 HydrophobicContact CZ-CZ3 4.3Å; F139-W142 PolarHBondContact O-N 2.86Å; F139-L143 HydrophobicContact CD1-CD1 3.88Å; F139-L143 HydrophobicContact CD1-CG 4.34Å; F139-L143 HydrophobicContact CE1-CD1 3.39Å; F139-L143 HydrophobicContact CE1-CD2 4.47Å; F139-L143 HydrophobicContact CE1-CG 3.95Å; F139-L143 HydrophobicContact CE2-CG 4.39Å; F139-L143 HydrophobicContact CZ-CD1 3.84Å; F139-L143 HydrophobicContact CZ-CD2 4.07Å; F139-L143 HydrophobicContact CZ-CG 3.97Å; F139-L143 WeakPolarHBondContact O-CG 3.48Å; F139-L143 PolarHBondContact O-N 3.11Å; F139-T157 HydrophobicContact CD1-CG2 4.04Å; F139-T157 HydrophobicContact CE1-CG2 4.38Å; F139-L160 HydrophobicContact CE1-CB 4.06Å; F139-L160 HydrophobicContact CZ-CB 4.27Å; F139-S161 WeakPolarHBondContact CD1-OG 3.02Å; F139-S161 WeakPolarHBondContact CE1-OG 3.26Å; F139-A164 HydrophobicContact CE2-CB 4.12Å; F139-A164 HydrophobicContact CZ-CB 4.28Å
140	R	85	Confident	80	Confident	114 Å²	114	79.2 Å²	79.2	43%	0.43	42%	0.415	S	S	.	.	H	α-helix	trans	-64.7	-40.4	173.7	-71.2	-172.8	-53.4	-102	1.5	112.2	A136 S137 W142 L143 D144 T157	A136-R140 WeakPolarHBondContact O-CG 3.44Å; A136-R140 PolarHBondContact O-N 2.97Å; S137-R140 WeakPolarHBondContact O-CB 3.25Å; S137-R140 PolarHBondContact O-N 3.26Å; R140-W142 VanDerWaalsContact C-N 3.31Å; R140-L143 PolarHBondContact O-N 3.47Å; R140-D144 PolarHBondContact O-N 3.28Å; R140-T157 HydrophobicContact CG-CG2 3.85Å
141	D	87.5	Confident	81.4	Confident	112 Å²	112	81.2 Å²	81.2	60%	0.599	41%	0.413	S	S	*	.	H	α-helix	trans	-63	-41.8	176.4	-55.8	-27	0	0	0	110.3	S137 D144	S137-D141 PolarHBondContact O-N 3.01Å; S137-D141 VanDerWaalsContact O-OD2 3.12Å; D141-D144 PolarHBondContact O-N 3.07Å
142	W	88.9	Confident	82.9	Confident	181 Å²	181	79.7 Å²	79.7	69%	0.686	41%	0.405	S	S	*	.	H	α-helix	trans	-66.2	-37.6	175.3	174.3	76.8	0	0	0	113.5	K138 F139 R140 D144	K138-W142 VanDerWaalsContact O-CB 3.26Å; K138-W142 WeakPolarHBondContact O-CB 3.34Å; K138-W142 PolarHBondContact O-N 3.41Å; F139-W142 AromaticContact CD2-CE3 3.91Å; F139-W142 HydrophobicContact CD2-CE3 3.91Å; F139-W142 HydrophobicContact CD2-CZ3 4.34Å; F139-W142 AromaticContact CE2-CE3 3.69Å; F139-W142 HydrophobicContact CE2-CE3 3.69Å; F139-W142 AromaticContact CE2-CZ3 3.65Å; F139-W142 HydrophobicContact CE2-CZ3 3.65Å; F139-W142 HydrophobicContact CZ-CZ3 4.3Å; F139-W142 PolarHBondContact O-N 2.86Å; R140-W142 VanDerWaalsContact C-N 3.31Å; W142-D144 PolarHBondContact O-N 3.37Å
143	L	88.8	Confident	84.6	Confident	40 Å²	40	79.1 Å²	79.1	21%	0.209	40%	0.399	C	S	.	.	H	α-helix	trans	-65.5	-19	175.5	-78.3	177.9	0	0	0	112.8	L2 F139 R140 C145 L160	L2-L143 HydrophobicContact CD1-CD1 4.31Å; L2-L143 HydrophobicContact CD1-CD2 4.09Å; F139-L143 HydrophobicContact CD1-CD1 3.88Å; F139-L143 HydrophobicContact CD1-CG 4.34Å; F139-L143 HydrophobicContact CE1-CD1 3.39Å; F139-L143 HydrophobicContact CE1-CD2 4.47Å; F139-L143 HydrophobicContact CE1-CG 3.95Å; F139-L143 HydrophobicContact CE2-CG 4.39Å; F139-L143 HydrophobicContact CZ-CD1 3.84Å; F139-L143 HydrophobicContact CZ-CD2 4.07Å; F139-L143 HydrophobicContact CZ-CG 3.97Å; F139-L143 WeakPolarHBondContact O-CG 3.48Å; F139-L143 PolarHBondContact O-N 3.11Å; R140-L143 PolarHBondContact O-N 3.47Å; L143-C145 PolarHBondContact O-N 2.98Å; L143-L160 HydrophobicContact CD1-CD1 4.32Å
144	D	87.2	Confident	86.2	Confident	98 Å²	98	82.3 Å²	82.3	52%	0.524	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	42	62.4	-176.1	-172.1	12.2	0	0	0	112.3	R140 D141 W142 S146	R140-D144 PolarHBondContact O-N 3.28Å; D141-D144 PolarHBondContact O-N 3.07Å; W142-D144 PolarHBondContact O-N 3.37Å; D144-S146 PolarHBondContact O-N 3.28Å; D144-S146 VanDerWaalsContact OD1-CB 3.25Å; D144-S146 WeakPolarHBondContact OD1-CB 3.38Å; D144-S146 PolarHBondContact OD1-N 3.11Å; D144-S146 PolarHBondContact OD1-OG 3.31Å
145	C	87.8	Confident	87.6	Confident	18 Å²	18	75.5 Å²	75.5	12%	0.122	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-69.2	5.9	179.6	-65.1	0	0	0	0	112.9	L143 S147 L148 K151	L143-C145 PolarHBondContact O-N 2.98Å; C145-S147 VanDerWaalsContact C-N 3.28Å; C145-S147 PolarHBondContact O-N 3.03Å; C145-L148 HydrophobicContact CB-CD1 3.96Å; C145-L148 WeakPolarHBondContact O-CB 3.39Å; C145-L148 PolarHBondContact O-N 3.13Å; C145-K151 HydrophobicContact CB-CD 4.06Å; C145-K151 PolarHBondContact O-NZ 2.69Å
146	S	88.8	Confident	88.8	Confident	85 Å²	85	69 Å²	69	59%	0.594	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-55.3	-40.6	-171.4	60.3	0	0	0	0	112.9	D144 L148 K151	D144-S146 PolarHBondContact O-N 3.28Å; D144-S146 VanDerWaalsContact OD1-CB 3.25Å; D144-S146 WeakPolarHBondContact OD1-CB 3.38Å; D144-S146 PolarHBondContact OD1-N 3.11Å; D144-S146 PolarHBondContact OD1-OG 3.31Å; S146-L148 VanDerWaalsContact C-N 3.31Å; S146-L148 PolarHBondContact O-N 3.25Å; S146-K151 PolarHBondContact O-NZ 2.95Å
147	S	88.9	Confident	89.8	Confident	89 Å²	89	67.6 Å²	67.6	62%	0.622	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-73.8	-13.1	179.4	61.9	0	0	0	0	115	C145	C145-S147 VanDerWaalsContact C-N 3.28Å; C145-S147 PolarHBondContact O-N 3.03Å
148	L	91.3	Very high	90.4	Very high	12 Å²	12	65.3 Å²	65.3	6%	0.063	33%	0.333	C	S	.	.			trans	-80.6	132.1	178.7	-68.7	167	0	0	0	111.2	L2 C6 C145 S146 K151	L2-L148 HydrophobicContact CB-CD1 4.19Å; L2-L148 HydrophobicContact CD1-CD1 4.36Å; L2-L148 HydrophobicContact CD2-CD1 4.14Å; L2-L148 HydrophobicContact CG-CD1 4.48Å; C6-L148 HydrophobicContact CB-CD2 3.95Å; C145-L148 HydrophobicContact CB-CD1 3.96Å; C145-L148 WeakPolarHBondContact O-CB 3.39Å; C145-L148 PolarHBondContact O-N 3.13Å; S146-L148 VanDerWaalsContact C-N 3.31Å; S146-L148 PolarHBondContact O-N 3.25Å; L148-K151 PolarHBondContact O-NZ 2.85Å
149	E	92.9	Very high	90.8	Very high	165 Å²	165	58.6 Å²	58.6	77%	0.771	30%	0.304	S	S	*	.	S	Bend	trans	-61.2	-48.3	172.1	-175.2	179.8	-178.6	0	0	111.1
150	L	95.6	Very high	91.2	Very high	20 Å²	20	58.7 Å²	58.7	11%	0.105	31%	0.305	C	S	.	.	S	Bend	trans	-106.5	130.4	178.8	-52.7	-179.6	0	0	0	110.3	C6 A9 A10 S14 I17	C6-L150 PolarHBondContact SG-N 2.93Å; C6-L150 VanDerWaalsContact SG-N 3.44Å; A9-L150 HydrophobicContact CB-CD1 3.7Å; A10-L150 HydrophobicContact CB-CD1 4.03Å; S14-L150 WeakPolarHBondContact O-CD1 3.26Å; I17-L150 VanDerWaalsContact CD1-O 3.3Å; I17-L150 WeakPolarHBondContact CD1-O 3.48Å; I17-L150 HydrophobicContact CG1-CB 4.01Å
151	K	94.9	Very high	91.6	Very high	94 Å²	94	53.5 Å²	53.5	41%	0.409	29%	0.285	S	S	.	.			trans	-87.6	145.7	176.8	-55.5	-52.6	-172.9	-146.6	0	110.9	I17 C145 S146 L148	I17-K151 PolarHBondContact N-O 2.81Å; C145-K151 HydrophobicContact CB-CD 4.06Å; C145-K151 PolarHBondContact O-NZ 2.69Å; S146-K151 PolarHBondContact O-NZ 2.95Å; L148-K151 PolarHBondContact O-NZ 2.85Å
152	P	95.3	Very high	91.8	Very high	18 Å²	18	49.1 Å²	49.1	12%	0.117	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-68.8	139.2	172.5	29.1	-33.9	0	0	0	111.9	L2 I17 A156 L160	L2-P152 HydrophobicContact CD2-CG 4.42Å; I17-P152 HydrophobicContact CB-CB 4.28Å; P152-A156 HydrophobicContact CB-CB 3.83Å; P152-L160 HydrophobicContact CB-CD1 4.38Å
153	N	93.9	Very high	92	Very high	45 Å²	45	41.8 Å²	41.8	24%	0.241	24%	0.235	C	C	.	.			trans	-72.6	178.5	172.3	78.6	15.1	0	0	0	111.6	V16 I17 I155 A156 T157	V16-N153 HydrophobicContact CG2-CB 4.46Å; I17-N153 PolarHBondContact O-N 3.23Å; N153-I155 PolarHBondContact O-N 2.94Å; N153-I155 PolarHBondContact OD1-N 3.48Å; N153-I155 VanDerWaalsContact OD1-N 3.11Å; N153-A156 PolarHBondContact O-N 3.46Å; N153-A156 WeakPolarHBondContact OD1-CB 3.29Å; N153-A156 PolarHBondContact OD1-N 2.93Å; N153-T157 WeakPolarHBondContact O-CB 3.28Å; N153-T157 PolarHBondContact O-N 3.27Å; N153-T157 PolarHBondContact O-OG1 2.89Å
154	S	90.6	Very high	92.2	Very high	93 Å²	93	41.2 Å²	41.2	65%	0.65	24%	0.236	S	C	*	.	H	α-helix	trans	-60.3	-42.5	-176.6	55	0	0	0	0	113.2	T157 E158	S154-T157 PolarHBondContact O-N 2.92Å; S154-E158 WeakPolarHBondContact O-CB 3.49Å; S154-E158 PolarHBondContact O-N 2.88Å
155	I	92.1	Very high	92.3	Very high	11 Å²	11	40.9 Å²	40.9	6%	0.056	23%	0.228	C	C	.	.	H	α-helix	trans	-70.5	-41.9	-180	-55.3	177.4	0	0	0	110.3	A19 R73 L76 N153 T157 E158 I159	A19-I155 HydrophobicContact CB-CB 4.44Å; A19-I155 HydrophobicContact CB-CG2 3.81Å; R73-I155 HydrophobicContact CG-CD1 4.21Å; R73-I155 HydrophobicContact CG-CG1 4.32Å; R73-I155 HydrophobicContact CG-CG2 4.28Å; L76-I155 HydrophobicContact CD1-CD1 4.21Å; N153-I155 PolarHBondContact O-N 2.94Å; N153-I155 PolarHBondContact OD1-N 3.48Å; N153-I155 VanDerWaalsContact OD1-N 3.11Å; I155-T157 VanDerWaalsContact C-N 3.34Å; I155-T157 PolarHBondContact O-N 3.19Å; I155-E158 WeakPolarHBondContact O-CB 3.38Å; I155-E158 PolarHBondContact O-N 3.21Å; I155-I159 HydrophobicContact CG2-CD1 4.28Å; I155-I159 WeakPolarHBondContact O-CG1 3.36Å; I155-I159 PolarHBondContact O-N 2.88Å
156	A	94.1	Very high	92.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.5	-44.2	174.8	0	0	0	0	0	111.4	I17 I22 P152 N153 E158 I159 L160	I17-A156 WeakPolarHBondContact O-CB 3.27Å; I22-A156 HydrophobicContact CD1-CB 3.76Å; I22-A156 WeakPolarHBondContact CD1-O 3.3Å; P152-A156 HydrophobicContact CB-CB 3.83Å; N153-A156 PolarHBondContact O-N 3.46Å; N153-A156 WeakPolarHBondContact OD1-CB 3.29Å; N153-A156 PolarHBondContact OD1-N 2.93Å; A156-E158 VanDerWaalsContact C-N 3.3Å; A156-E158 PolarHBondContact O-N 3.47Å; A156-I159 PolarHBondContact O-N 3.38Å; A156-L160 VanDerWaalsContact O-CG 3.3Å; A156-L160 WeakPolarHBondContact O-CG 3.33Å; A156-L160 PolarHBondContact O-N 2.97Å
157	T	92.5	Very high	92.6	Very high	8 Å²	8	40.6 Å²	40.6	5%	0.049	22%	0.22	C	C	.	.	H	α-helix	trans	-62.2	-37.6	175.4	-55.3	0	0	0	0	112	F139 R140 N153 S154 I155 L160 S161	F139-T157 HydrophobicContact CD1-CG2 4.04Å; F139-T157 HydrophobicContact CE1-CG2 4.38Å; R140-T157 HydrophobicContact CG-CG2 3.85Å; N153-T157 WeakPolarHBondContact O-CB 3.28Å; N153-T157 PolarHBondContact O-N 3.27Å; N153-T157 PolarHBondContact O-OG1 2.89Å; S154-T157 PolarHBondContact O-N 2.92Å; I155-T157 VanDerWaalsContact C-N 3.34Å; I155-T157 PolarHBondContact O-N 3.19Å; T157-L160 PolarHBondContact O-N 2.93Å; T157-S161 WeakPolarHBondContact O-CB 3.41Å; T157-S161 PolarHBondContact O-N 2.84Å; T157-S161 PolarHBondContact O-OG 3.25Å
158	E	91.6	Very high	92.7	Very high	15 Å²	15	40.7 Å²	40.7	7%	0.07	22%	0.217	C	C	.	.	H	α-helix	trans	-67	-42.4	176.3	-178.2	169.7	-168.2	0	0	112.1	Y39 R43 R73 S154 I155 A156 S161 Y162	Y39-E158 HydrophobicContact CE1-CG 4.2Å; R43-E158 IonicContact CZ-OE1 2.69Å; R43-E158 IonicContact NE-OE1 3.77Å; R43-E158 PolarHBondContact NE-OE1 3.41Å; R43-E158 IonicContact NH2-OE1 3.56Å; R43-E158 PolarHBondContact NH2-OE1 3.49Å; R73-E158 IonicContact CZ-OE1 3.5Å; R73-E158 IonicContact CZ-OE2 3.26Å; R73-E158 IonicContact NE-OE1 2.71Å; R73-E158 PolarHBondContact NE-OE1 2.95Å; R73-E158 IonicContact NE-OE2 3.62Å; R73-E158 PolarHBondContact NE-OE2 3.22Å; R73-E158 IonicContact NH2-OE1 3.65Å; R73-E158 IonicContact NH2-OE2 3.77Å; R73-E158 PolarHBondContact NH2-OE2 2.93Å; R73-E158 VanDerWaalsContact NH2-OE2 3.17Å; S154-E158 WeakPolarHBondContact O-CB 3.49Å; S154-E158 PolarHBondContact O-N 2.88Å; I155-E158 WeakPolarHBondContact O-CB 3.38Å; I155-E158 PolarHBondContact O-N 3.21Å; A156-E158 VanDerWaalsContact C-N 3.3Å; A156-E158 PolarHBondContact O-N 3.47Å; E158-S161 WeakPolarHBondContact O-CB 3.26Å; E158-S161 PolarHBondContact O-N 2.91Å; E158-Y162 PolarHBondContact O-N 2.89Å
159	I	94.1	Very high	92.6	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62	-46.9	173.3	-66.2	167.7	0	0	0	110.3	A19 I22 V36 L40 I155 A156 S161 Y162 L163	A19-I159 HydrophobicContact CB-CD1 3.51Å; I22-I159 HydrophobicContact CB-CG2 4.45Å; I22-I159 HydrophobicContact CD1-CB 4.29Å; I22-I159 HydrophobicContact CD1-CG2 4.34Å; I22-I159 HydrophobicContact CG2-CG2 3.74Å; V36-I159 HydrophobicContact CG1-CG1 4.4Å; V36-I159 HydrophobicContact CG1-CG2 4.09Å; L40-I159 HydrophobicContact CD1-CD1 4.15Å; L40-I159 HydrophobicContact CD1-CG1 4.36Å; L40-I159 HydrophobicContact CD2-CD1 4.47Å; L40-I159 HydrophobicContact CD2-CG1 3.92Å; I155-I159 HydrophobicContact CG2-CD1 4.28Å; I155-I159 WeakPolarHBondContact O-CG1 3.36Å; I155-I159 PolarHBondContact O-N 2.88Å; A156-I159 PolarHBondContact O-N 3.38Å; I159-S161 VanDerWaalsContact C-N 3.28Å; I159-S161 PolarHBondContact O-N 3Å; I159-Y162 WeakPolarHBondContact O-CB 3.49Å; I159-Y162 PolarHBondContact O-N 3.43Å; I159-Y162 VanDerWaalsContact O-N 3.14Å; I159-L163 HydrophobicContact CG2-CD1 3.91Å; I159-L163 HydrophobicContact CG2-CG 4.22Å; I159-L163 VanDerWaalsContact O-CG 3.32Å; I159-L163 WeakPolarHBondContact O-CG 3.42Å; I159-L163 PolarHBondContact O-N 3.43Å
160	L	94	Very high	92.5	Very high	15 Å²	15	37.4 Å²	37.4	8%	0.079	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-39.6	177	-69.2	165.9	0	0	0	112.2	M1 L2 I22 F139 L143 P152 A156 T157 Y162 L163 A164	M1-L160 HydrophobicContact SD-CD2 4.22Å; L2-L160 HydrophobicContact CD1-CD1 4.28Å; L2-L160 HydrophobicContact CD2-CD1 3.59Å; L2-L160 HydrophobicContact CG-CD1 4.05Å; L2-L160 HydrophobicContact CG-CD2 4.34Å; I22-L160 HydrophobicContact CD1-CD1 4.24Å; I22-L160 HydrophobicContact CD1-CD2 4.12Å; I22-L160 HydrophobicContact CD1-CG 3.8Å; F139-L160 HydrophobicContact CE1-CB 4.06Å; F139-L160 HydrophobicContact CZ-CB 4.27Å; L143-L160 HydrophobicContact CD1-CD1 4.32Å; P152-L160 HydrophobicContact CB-CD1 4.38Å; A156-L160 VanDerWaalsContact O-CG 3.3Å; A156-L160 WeakPolarHBondContact O-CG 3.33Å; A156-L160 PolarHBondContact O-N 2.97Å; T157-L160 PolarHBondContact O-N 2.93Å; L160-Y162 VanDerWaalsContact C-N 3.34Å; L160-Y162 PolarHBondContact O-N 3.31Å; L160-L163 PolarHBondContact O-N 3.42Å; L160-A164 WeakPolarHBondContact O-CB 3.37Å; L160-A164 PolarHBondContact O-N 3.28Å
161	S	92.1	Very high	92.3	Very high	4 Å²	4	39.5 Å²	39.5	3%	0.028	22%	0.215	C	C	.	.	H	α-helix	trans	-60.6	-44.3	175.6	-63.9	0	0	0	0	111.6	T132 F139 T157 E158 I159 Y165	T132-S161 WeakPolarHBondContact OG1-CB 3.5Å; T132-S161 PolarHBondContact OG1-O 3.43Å; F139-S161 WeakPolarHBondContact CD1-OG 3.02Å; F139-S161 WeakPolarHBondContact CE1-OG 3.26Å; T157-S161 WeakPolarHBondContact O-CB 3.41Å; T157-S161 PolarHBondContact O-N 2.84Å; T157-S161 PolarHBondContact O-OG 3.25Å; E158-S161 WeakPolarHBondContact O-CB 3.26Å; E158-S161 PolarHBondContact O-N 2.91Å; I159-S161 VanDerWaalsContact C-N 3.28Å; I159-S161 PolarHBondContact O-N 3Å; S161-Y165 PolarHBondContact O-N 3.37Å; S161-Y165 VanDerWaalsContact O-N 3.16Å
162	Y	91.9	Very high	92.2	Very high	21 Å²	21	37.8 Å²	37.8	8%	0.082	21%	0.212	C	C	.	.	H	α-helix	trans	-64.8	-46.1	176	169.9	-107.5	0	0	0	112	V36 Y39 E158 I159 L160 A164 Y165 E166	V36-Y162 HydrophobicContact CB-CE1 4.38Å; V36-Y162 HydrophobicContact CG2-CD1 4.02Å; V36-Y162 HydrophobicContact CG2-CE1 3.74Å; Y39-Y162 HydrophobicContact CD1-CD1 4.08Å; Y39-Y162 HydrophobicContact CD1-CD2 4.03Å; Y39-Y162 AromaticContact CD1-CG 3.72Å; Y39-Y162 HydrophobicContact CD1-CG 3.72Å; Y39-Y162 AromaticContact CD2-CD2 3.42Å; Y39-Y162 HydrophobicContact CD2-CD2 3.42Å; Y39-Y162 VanDerWaalsContact CD2-CD2 3.42Å; Y39-Y162 AromaticContact CD2-CE2 3.74Å; Y39-Y162 HydrophobicContact CD2-CE2 3.74Å; Y39-Y162 HydrophobicContact CD2-CG 4Å; Y39-Y162 HydrophobicContact CE1-CD2 4.28Å; Y39-Y162 AromaticContact CE1-CG 3.93Å; Y39-Y162 HydrophobicContact CE1-CG 3.93Å; Y39-Y162 AromaticContact CE2-CD2 3.69Å; Y39-Y162 HydrophobicContact CE2-CD2 3.69Å; Y39-Y162 HydrophobicContact CE2-CE2 4.42Å; Y39-Y162 HydrophobicContact CE2-CG 4.18Å; Y39-Y162 HydrophobicContact CG-CD1 4.16Å; Y39-Y162 AromaticContact CG-CD2 3.59Å; Y39-Y162 HydrophobicContact CG-CD2 3.59Å; Y39-Y162 HydrophobicContact CG-CE1 4.38Å; Y39-Y162 AromaticContact CG-CE2 3.86Å; Y39-Y162 HydrophobicContact CG-CE2 3.86Å; Y39-Y162 AromaticContact CG-CG 3.75Å; Y39-Y162 HydrophobicContact CG-CG 3.75Å; E158-Y162 PolarHBondContact O-N 2.89Å; I159-Y162 WeakPolarHBondContact O-CB 3.49Å; I159-Y162 PolarHBondContact O-N 3.43Å; I159-Y162 VanDerWaalsContact O-N 3.14Å; L160-Y162 VanDerWaalsContact C-N 3.34Å; L160-Y162 PolarHBondContact O-N 3.31Å; Y162-A164 VanDerWaalsContact C-N 3.32Å; Y162-A164 PolarHBondContact O-N 3.05Å; Y162-Y165 WeakPolarHBondContact O-CB 3.31Å; Y162-Y165 PolarHBondContact O-N 2.89Å; Y162-E166 HydrophobicContact CD1-CG 4.49Å; Y162-E166 HydrophobicContact CD2-CG 4.08Å; Y162-E166 HydrophobicContact CE1-CG 3.98Å; Y162-E166 HydrophobicContact CE2-CG 3.5Å; Y162-E166 VanDerWaalsContact CE2-CG 3.5Å; Y162-E166 VanDerWaalsContact CZ-CG 3.44Å; Y162-E166 PolarHBondContact O-N 2.71Å
163	L	93.6	Very high	91.9	Very high	27 Å²	27	40 Å²	40	14%	0.141	22%	0.223	C	C	.	.	H	α-helix	trans	-62.5	-39.1	178.9	-67.1	174.9	0	0	0	112.2	M1 I22 M26 V36 I159 L160 E166 T167	M1-L163 HydrophobicContact CE-CD1 3.99Å; M1-L163 HydrophobicContact SD-CD1 3.93Å; I22-L163 HydrophobicContact CG2-CD1 4.01Å; M26-L163 HydrophobicContact CE-CD2 3.7Å; M26-L163 HydrophobicContact SD-CD1 3.73Å; M26-L163 HydrophobicContact SD-CD2 3.79Å; M26-L163 HydrophobicContact SD-CG 4.39Å; V36-L163 HydrophobicContact CG2-CD2 3.84Å; I159-L163 HydrophobicContact CG2-CD1 3.91Å; I159-L163 HydrophobicContact CG2-CG 4.22Å; I159-L163 VanDerWaalsContact O-CG 3.32Å; I159-L163 WeakPolarHBondContact O-CG 3.42Å; I159-L163 PolarHBondContact O-N 3.43Å; L160-L163 PolarHBondContact O-N 3.42Å; L163-E166 PolarHBondContact O-N 2.85Å; L163-T167 WeakPolarHBondContact O-CB 3.14Å; L163-T167 PolarHBondContact O-N 2.71Å; L163-T167 PolarHBondContact O-OG1 3.17Å
164	A	92.3	Very high	91.9	Very high	28 Å²	28	39.8 Å²	39.8	23%	0.231	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-45.5	174.4	0	0	0	0	0	111.5	F139 L160 Y162 T167 V168	F139-A164 HydrophobicContact CE2-CB 4.12Å; F139-A164 HydrophobicContact CZ-CB 4.28Å; L160-A164 WeakPolarHBondContact O-CB 3.37Å; L160-A164 PolarHBondContact O-N 3.28Å; Y162-A164 VanDerWaalsContact C-N 3.32Å; Y162-A164 PolarHBondContact O-N 3.05Å; A164-T167 PolarHBondContact O-N 3.4Å; A164-V168 WeakPolarHBondContact O-CG2 3.48Å; A164-V168 PolarHBondContact O-N 3.42Å; A164-V168 VanDerWaalsContact O-N 3.11Å
165	Y	89.6	Confident	92	Very high	90 Å²	90	35.3 Å²	35.3	35%	0.353	19%	0.191	S	C	.	.	H	α-helix	trans	-58.9	-48.3	175.1	171.8	-90.6	0	0	0	111.7	S161 Y162 T167 V168 A169	S161-Y165 PolarHBondContact O-N 3.37Å; S161-Y165 VanDerWaalsContact O-N 3.16Å; Y162-Y165 WeakPolarHBondContact O-CB 3.31Å; Y162-Y165 PolarHBondContact O-N 2.89Å; Y165-T167 VanDerWaalsContact C-N 3.33Å; Y165-T167 PolarHBondContact O-N 3.22Å; Y165-V168 PolarHBondContact O-N 3.32Å; Y165-A169 PolarHBondContact O-N 2.94Å
166	E	90.6	Very high	91.9	Very high	23 Å²	23	38.7 Å²	38.7	11%	0.107	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-35.7	179.9	-75.1	-59.3	141.7	0	0	113	R35 R106 Y162 L163 A169 Q170	R35-E166 IonicContact CZ-OE2 2.71Å; R35-E166 IonicContact NH1-OE2 2.67Å; R35-E166 PolarHBondContact NH1-OE2 3.41Å; R35-E166 VanDerWaalsContact NH1-OE2 3.11Å; R35-E166 IonicContact NH2-OE1 3.16Å; R35-E166 IonicContact NH2-OE2 3.59Å; R35-E166 PolarHBondContact NH2-OE2 2.71Å; R106-E166 IonicContact CZ-OE2 2.71Å; R106-E166 IonicContact NH1-OE1 3.93Å; R106-E166 IonicContact NH1-OE2 3.98Å; R106-E166 PolarHBondContact NH1-OE2 3.07Å; R106-E166 IonicContact NH2-OE2 2.86Å; Y162-E166 HydrophobicContact CD1-CG 4.49Å; Y162-E166 HydrophobicContact CD2-CG 4.08Å; Y162-E166 HydrophobicContact CE1-CG 3.98Å; Y162-E166 HydrophobicContact CE2-CG 3.5Å; Y162-E166 VanDerWaalsContact CE2-CG 3.5Å; Y162-E166 VanDerWaalsContact CZ-CG 3.44Å; Y162-E166 PolarHBondContact O-N 2.71Å; L163-E166 PolarHBondContact O-N 2.85Å; E166-A169 PolarHBondContact O-N 2.92Å; E166-Q170 WeakPolarHBondContact O-CB 3.49Å; E166-Q170 PolarHBondContact O-N 2.94Å
167	T	92	Very high	91.7	Very high	74 Å²	74	42.3 Å²	42.3	45%	0.454	23%	0.227	S	C	.	.	H	α-helix	trans	-62.3	-46.7	176	-58	0	0	0	0	110.4	L163 A164 Y165 Q170 I171	L163-T167 WeakPolarHBondContact O-CB 3.14Å; L163-T167 PolarHBondContact O-N 2.71Å; L163-T167 PolarHBondContact O-OG1 3.17Å; A164-T167 PolarHBondContact O-N 3.4Å; Y165-T167 VanDerWaalsContact C-N 3.33Å; Y165-T167 PolarHBondContact O-N 3.22Å; T167-Q170 PolarHBondContact O-N 3.46Å; T167-I171 HydrophobicContact CG2-CD1 4.05Å; T167-I171 VanDerWaalsContact O-CG1 3.3Å; T167-I171 WeakPolarHBondContact O-CG1 3.21Å; T167-I171 PolarHBondContact O-N 2.9Å
168	V	91.2	Very high	91.7	Very high	91 Å²	91	41.9 Å²	41.9	55%	0.552	23%	0.225	S	C	*	.	H	α-helix	trans	-63.2	-45.5	176.6	174.7	0	0	0	0	110.8	A164 Y165 Q170 I171 V172	A164-V168 WeakPolarHBondContact O-CG2 3.48Å; A164-V168 PolarHBondContact O-N 3.42Å; A164-V168 VanDerWaalsContact O-N 3.11Å; Y165-V168 PolarHBondContact O-N 3.32Å; V168-Q170 VanDerWaalsContact C-N 3.33Å; V168-Q170 PolarHBondContact O-N 2.95Å; V168-I171 PolarHBondContact O-N 3.48Å; V168-V172 HydrophobicContact CG1-CG2 4.42Å; V168-V172 VanDerWaalsContact O-CG2 3.31Å; V168-V172 WeakPolarHBondContact O-CG2 3.27Å; V168-V172 PolarHBondContact O-N 3.02Å
169	A	89.5	Confident	91.7	Very high	18 Å²	18	43.4 Å²	43.4	15%	0.149	23%	0.231	C	C	.	.	H	α-helix	trans	-58.6	-44.9	177.9	0	0	0	0	0	111.6	Y165 E166 V172 D173	Y165-A169 PolarHBondContact O-N 2.94Å; E166-A169 PolarHBondContact O-N 2.92Å; A169-V172 PolarHBondContact O-N 3.4Å; A169-D173 PolarHBondContact O-N 3.27Å
170	Q	91.1	Very high	91.4	Very high	91 Å²	91	49.6 Å²	49.6	43%	0.425	26%	0.26	S	S	.	.	H	α-helix	trans	-63.1	-43.4	177.4	-172.9	178	13.4	0	0	112.3	E166 T167 V168 V172 D173 L174	E166-Q170 WeakPolarHBondContact O-CB 3.49Å; E166-Q170 PolarHBondContact O-N 2.94Å; T167-Q170 PolarHBondContact O-N 3.46Å; V168-Q170 VanDerWaalsContact C-N 3.33Å; V168-Q170 PolarHBondContact O-N 2.95Å; Q170-V172 VanDerWaalsContact C-N 3.28Å; Q170-V172 PolarHBondContact O-N 3.28Å; Q170-D173 PolarHBondContact O-N 2.81Å; Q170-L174 HydrophobicContact CG-CD1 4.07Å; Q170-L174 HydrophobicContact CG-CG 4.46Å; Q170-L174 WeakPolarHBondContact O-CB 3.45Å; Q170-L174 VanDerWaalsContact O-CG 3.26Å; Q170-L174 WeakPolarHBondContact O-CG 3.49Å; Q170-L174 PolarHBondContact O-N 3.38Å
171	I	92.2	Very high	91.2	Very high	63 Å²	63	51.8 Å²	51.8	32%	0.323	27%	0.27	S	S	.	.	H	α-helix	trans	-60.2	-42.1	176.2	-69.2	166.2	0	0	0	110.5	T167 V168 S175 I266	T167-I171 HydrophobicContact CG2-CD1 4.05Å; T167-I171 VanDerWaalsContact O-CG1 3.3Å; T167-I171 WeakPolarHBondContact O-CG1 3.21Å; T167-I171 PolarHBondContact O-N 2.9Å; V168-I171 PolarHBondContact O-N 3.48Å; I171-S175 VanDerWaalsContact O-CB 3.28Å; I171-S175 WeakPolarHBondContact O-CB 3.48Å; I171-S175 PolarHBondContact O-N 3.06Å; I171-S175 PolarHBondContact O-OG 2.76Å; I171-I266 HydrophobicContact CG2-CG2 3.99Å
172	V	91.6	Very high	91	Very high	58 Å²	58	54.3 Å²	54.3	35%	0.352	28%	0.282	S	S	.	.	H	α-helix	trans	-64.1	-48.6	177.8	169.8	0	0	0	0	111.1	V168 A169 Q170 L174 S175 L176 I261	V168-V172 HydrophobicContact CG1-CG2 4.42Å; V168-V172 VanDerWaalsContact O-CG2 3.31Å; V168-V172 WeakPolarHBondContact O-CG2 3.27Å; V168-V172 PolarHBondContact O-N 3.02Å; A169-V172 PolarHBondContact O-N 3.4Å; Q170-V172 VanDerWaalsContact C-N 3.28Å; Q170-V172 PolarHBondContact O-N 3.28Å; V172-L174 PolarHBondContact O-N 2.89Å; V172-S175 PolarHBondContact O-N 2.93Å; V172-S175 VanDerWaalsContact O-N 3.14Å; V172-L176 HydrophobicContact CG1-CD1 4.12Å; V172-L176 WeakPolarHBondContact O-CG 3.38Å; V172-L176 PolarHBondContact O-N 3.21Å; V172-I261 HydrophobicContact CG1-CD1 3.85Å
173	D	89.8	Confident	90.6	Very high	64 Å²	64	56.6 Å²	56.6	34%	0.342	30%	0.298	S	S	.	.	H	α-helix	trans	-57.7	-48.4	179.4	-64.3	-23.8	0	0	0	111.2	R106 A169 Q170 S175 L176 L177	R106-D173 IonicContact CZ-OD2 2.76Å; R106-D173 IonicContact NE-OD2 2.74Å; R106-D173 PolarHBondContact NE-OD2 3.43Å; R106-D173 IonicContact NH2-OD2 3.48Å; R106-D173 PolarHBondContact NH2-OD2 3.31Å; A169-D173 PolarHBondContact O-N 3.27Å; Q170-D173 PolarHBondContact O-N 2.81Å; D173-S175 VanDerWaalsContact C-N 3.31Å; D173-S175 PolarHBondContact O-N 3.22Å; D173-L176 PolarHBondContact O-N 2.74Å; D173-L177 PolarHBondContact O-N 3.44Å
174	L	92.5	Very high	89.9	Confident	41 Å²	41	58.5 Å²	58.5	22%	0.215	31%	0.311	C	S	.	.	H	α-helix	trans	-64.7	-35.9	177.9	-65.6	172.8	0	0	0	112.1	Q170 V172 L177 V178 A269 Y273	Q170-L174 HydrophobicContact CG-CD1 4.07Å; Q170-L174 HydrophobicContact CG-CG 4.46Å; Q170-L174 WeakPolarHBondContact O-CB 3.45Å; Q170-L174 VanDerWaalsContact O-CG 3.26Å; Q170-L174 WeakPolarHBondContact O-CG 3.49Å; Q170-L174 PolarHBondContact O-N 3.38Å; V172-L174 PolarHBondContact O-N 2.89Å; L174-L177 WeakPolarHBondContact O-CB 3.44Å; L174-L177 PolarHBondContact O-N 3.13Å; L174-V178 WeakPolarHBondContact O-CG2 3.35Å; L174-V178 PolarHBondContact O-N 3.27Å; L174-A269 HydrophobicContact CB-CB 3.89Å; L174-Y273 HydrophobicContact CB-CD2 4.2Å; L174-Y273 HydrophobicContact CD1-CD2 4.1Å; L174-Y273 HydrophobicContact CD1-CG 4Å; L174-Y273 HydrophobicContact CD2-CD1 4.1Å; L174-Y273 HydrophobicContact CD2-CD2 3.81Å; L174-Y273 HydrophobicContact CD2-CE1 4.29Å; L174-Y273 HydrophobicContact CD2-CE2 4.04Å; L174-Y273 HydrophobicContact CD2-CG 3.87Å; L174-Y273 HydrophobicContact CG-CD2 4.26Å; L174-Y273 HydrophobicContact CG-CG 4.46Å
175	S	93.3	Very high	88.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-69.6	-33.6	177.1	-58.8	0	0	0	0	112.2	I171 V172 D173 K179 I266	I171-S175 VanDerWaalsContact O-CB 3.28Å; I171-S175 WeakPolarHBondContact O-CB 3.48Å; I171-S175 PolarHBondContact O-N 3.06Å; I171-S175 PolarHBondContact O-OG 2.76Å; V172-S175 PolarHBondContact O-N 2.93Å; V172-S175 VanDerWaalsContact O-N 3.14Å; D173-S175 VanDerWaalsContact C-N 3.31Å; D173-S175 PolarHBondContact O-N 3.22Å; S175-K179 WeakPolarHBondContact O-CB 3.34Å; S175-K179 PolarHBondContact O-N 2.81Å; S175-I266 WeakPolarHBondContact OG-CA 3.35Å
176	L	89.9	Confident	87.7	Confident	81 Å²	81	64.7 Å²	64.7	42%	0.424	34%	0.344	S	S	.	.	H	α-helix	trans	-67.1	-41.5	173.2	-72.4	169.9	0	0	0	111.3	V172 D173 K179 Q180 I261	V172-L176 HydrophobicContact CG1-CD1 4.12Å; V172-L176 WeakPolarHBondContact O-CG 3.38Å; V172-L176 PolarHBondContact O-N 3.21Å; D173-L176 PolarHBondContact O-N 2.74Å; L176-K179 WeakPolarHBondContact O-CB 3.42Å; L176-K179 PolarHBondContact O-N 2.66Å; L176-Q180 WeakPolarHBondContact O-CB 3.49Å; L176-Q180 PolarHBondContact O-N 3.22Å; L176-I261 HydrophobicContact CD2-CD1 3.74Å; L176-I261 HydrophobicContact CD2-CG1 3.7Å; L176-I261 HydrophobicContact CG-CD1 3.75Å; L176-I261 HydrophobicContact CG-CG1 4.21Å
177	L	89.9	Confident	86.2	Confident	76 Å²	76	68.1 Å²	68.1	40%	0.398	36%	0.363	S	S	.	.	H	α-helix	trans	-59	-49.8	174.3	-169	104.5	0	0	0	111.3	D173 L174 K179 Q180 E181 Y273	D173-L177 PolarHBondContact O-N 3.44Å; L174-L177 WeakPolarHBondContact O-CB 3.44Å; L174-L177 PolarHBondContact O-N 3.13Å; L177-K179 VanDerWaalsContact C-N 3.34Å; L177-K179 PolarHBondContact O-N 3.11Å; L177-Q180 PolarHBondContact O-N 2.93Å; L177-E181 PolarHBondContact O-N 3.03Å; L177-Y273 HydrophobicContact CD2-CE2 4.48Å; L177-Y273 WeakPolarHBondContact CD2-OH 3.17Å
178	V	92.4	Very high	84.6	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-60.2	-43.8	177.2	169.5	0	0	0	0	111.6	L174 Q180 E181 M182 H265 E268 A269 Y273	L174-V178 WeakPolarHBondContact O-CG2 3.35Å; L174-V178 PolarHBondContact O-N 3.27Å; V178-Q180 VanDerWaalsContact C-N 3.34Å; V178-Q180 PolarHBondContact O-N 3.11Å; V178-E181 PolarHBondContact O-N 3.14Å; V178-M182 HydrophobicContact CG1-CE 3.68Å; V178-M182 HydrophobicContact CG1-CG 4.33Å; V178-M182 HydrophobicContact CG1-SD 3.97Å; V178-M182 WeakPolarHBondContact O-CB 3.29Å; V178-M182 WeakPolarHBondContact O-CG 3.15Å; V178-M182 PolarHBondContact O-N 2.75Å; V178-H265 HydrophobicContact CG1-CB 4.31Å; V178-E268 HydrophobicContact CG1-CB 3.93Å; V178-E268 HydrophobicContact CG1-CG 3.76Å; V178-E268 HydrophobicContact CG2-CG 4.4Å; V178-A269 HydrophobicContact CG2-CB 4.11Å; V178-Y273 HydrophobicContact CG2-CE2 4.4Å
179	K	91.4	Very high	83	Confident	47 Å²	47	69.5 Å²	69.5	20%	0.204	37%	0.373	C	S	.	.	H	α-helix	trans	-57.8	-48.5	176.6	176.5	175.8	170.1	-118.7	0	110.9	S175 L176 L177 E181 M182 T183 G259 H265	S175-K179 WeakPolarHBondContact O-CB 3.34Å; S175-K179 PolarHBondContact O-N 2.81Å; L176-K179 WeakPolarHBondContact O-CB 3.42Å; L176-K179 PolarHBondContact O-N 2.66Å; L177-K179 VanDerWaalsContact C-N 3.34Å; L177-K179 PolarHBondContact O-N 3.11Å; K179-E181 PolarHBondContact O-N 3.42Å; K179-M182 PolarHBondContact O-N 3.02Å; K179-T183 HydrophobicContact CG-CG2 4.42Å; K179-T183 WeakPolarHBondContact O-CG2 3.48Å; K179-T183 PolarHBondContact O-N 3.12Å; K179-T183 PolarHBondContact O-OG1 2.89Å; K179-G259 VanDerWaalsContact CE-O 3.28Å; K179-G259 WeakPolarHBondContact CE-O 3.48Å; K179-G259 VanDerWaalsContact NZ-C 3.32Å; K179-G259 PolarHBondContact NZ-O 3.24Å; K179-H265 VanDerWaalsContact CG-CE1 3.47Å; K179-H265 WeakPolarHBondContact CG-CE1 3.42Å
180	Q	89	Confident	81.4	Confident	130 Å²	130	71.9 Å²	71.9	61%	0.607	39%	0.389	S	S	*	.	H	α-helix	trans	-58.7	-48	-179.9	-173.1	176.4	-0	0	0	111	L176 L177 V178 M182 T183 V184	L176-Q180 WeakPolarHBondContact O-CB 3.49Å; L176-Q180 PolarHBondContact O-N 3.22Å; L177-Q180 PolarHBondContact O-N 2.93Å; V178-Q180 VanDerWaalsContact C-N 3.34Å; V178-Q180 PolarHBondContact O-N 3.11Å; Q180-M182 PolarHBondContact O-N 3.01Å; Q180-T183 WeakPolarHBondContact CA-OG1 3.37Å; Q180-T183 PolarHBondContact O-N 3.41Å; Q180-T183 PolarHBondContact O-OG1 2.96Å; Q180-V184 WeakPolarHBondContact O-CG2 3.43Å; Q180-V184 PolarHBondContact O-N 2.97Å
181	E	88.6	Confident	79.5	Confident	60 Å²	60	74.6 Å²	74.6	28%	0.28	40%	0.401	S	S	.	.	H	α-helix	trans	-59.5	-43.4	175.6	-72.3	-176.7	-155.7	0	0	113.2	L177 V178 K179 T183 V184 K185 R272	L177-E181 PolarHBondContact O-N 3.03Å; V178-E181 PolarHBondContact O-N 3.14Å; K179-E181 PolarHBondContact O-N 3.42Å; E181-T183 VanDerWaalsContact C-N 3.34Å; E181-V184 PolarHBondContact O-N 3.27Å; E181-K185 WeakPolarHBondContact O-CB 3.34Å; E181-K185 VanDerWaalsContact O-CG 3.29Å; E181-K185 WeakPolarHBondContact O-CG 3.04Å; E181-K185 PolarHBondContact O-N 3.3Å; E181-K185 IonicContact OE2-NZ 2.73Å; E181-K185 PolarHBondContact OE2-NZ 3.45Å; E181-K185 VanDerWaalsContact OE2-NZ 3.11Å; E181-R272 IonicContact OE1-NH1 3.45Å; E181-R272 IonicContact OE2-CZ 3.75Å; E181-R272 IonicContact OE2-NH1 2.93Å; E181-R272 PolarHBondContact OE2-NH1 3.38Å
182	M	88.6	Confident	77.5	Confident	57 Å²	57	75.9 Å²	75.9	28%	0.281	41%	0.412	S	S	.	.	H	α-helix	trans	-65.6	-38.3	179.5	-74.5	-175.9	176	0	0	111.6	V178 K179 Q180 V184 K185 T186 E268	V178-M182 HydrophobicContact CG1-CE 3.68Å; V178-M182 HydrophobicContact CG1-CG 4.33Å; V178-M182 HydrophobicContact CG1-SD 3.97Å; V178-M182 WeakPolarHBondContact O-CB 3.29Å; V178-M182 WeakPolarHBondContact O-CG 3.15Å; V178-M182 PolarHBondContact O-N 2.75Å; K179-M182 PolarHBondContact O-N 3.02Å; Q180-M182 PolarHBondContact O-N 3.01Å; M182-V184 VanDerWaalsContact C-N 3.34Å; M182-K185 PolarHBondContact O-N 2.94Å; M182-T186 WeakPolarHBondContact O-CB 3.4Å; M182-T186 PolarHBondContact O-N 3.01Å; M182-T186 PolarHBondContact O-OG1 3.11Å; M182-E268 HydrophobicContact CE-CB 4.04Å; M182-E268 HydrophobicContact CE-CG 3.73Å
183	T	83.8	Confident	75.6	Confident	69 Å²	69	80.2 Å²	80.2	42%	0.423	43%	0.431	S	S	.	.	H	α-helix	trans	-65.7	-36.4	175.8	52.2	0	0	0	0	112.7	K179 Q180 E181 N187	K179-T183 HydrophobicContact CG-CG2 4.42Å; K179-T183 WeakPolarHBondContact O-CG2 3.48Å; K179-T183 PolarHBondContact O-N 3.12Å; K179-T183 PolarHBondContact O-OG1 2.89Å; Q180-T183 WeakPolarHBondContact CA-OG1 3.37Å; Q180-T183 PolarHBondContact O-N 3.41Å; Q180-T183 PolarHBondContact O-OG1 2.96Å; E181-T183 VanDerWaalsContact C-N 3.34Å; T183-N187 PolarHBondContact O-N 2.65Å; T183-N187 PolarHBondContact O-ND2 3.19Å
184	V	78.1	Confident	73.4	Confident	67 Å²	67	80.5 Å²	80.5	41%	0.406	44%	0.438	S	S	.	.	H	α-helix	trans	-70.8	-45	175.6	174.1	0	0	0	0	110.9	Q180 E181 M182 T186 N187	Q180-V184 WeakPolarHBondContact O-CG2 3.43Å; Q180-V184 PolarHBondContact O-N 2.97Å; E181-V184 PolarHBondContact O-N 3.27Å; M182-V184 VanDerWaalsContact C-N 3.34Å; V184-T186 VanDerWaalsContact C-N 3.29Å; V184-T186 PolarHBondContact O-N 3.2Å; V184-N187 CarbonylContact O-C 3.59Å; V184-N187 VanDerWaalsContact O-C 3.31Å; V184-N187 PolarHBondContact O-N 3.21Å
185	K	70.7	Confident	71.2	Confident	139 Å²	139	83.3 Å²	83.3	60%	0.604	47%	0.467	S	S	*	.	H	α-helix	trans	-63.6	-32.7	178.6	-74	166.4	179.8	163.6	0	113.4	E181 M182	E181-K185 WeakPolarHBondContact O-CB 3.34Å; E181-K185 VanDerWaalsContact O-CG 3.29Å; E181-K185 WeakPolarHBondContact O-CG 3.04Å; E181-K185 PolarHBondContact O-N 3.3Å; E181-K185 IonicContact OE2-NZ 2.73Å; E181-K185 PolarHBondContact OE2-NZ 3.45Å; E181-K185 VanDerWaalsContact OE2-NZ 3.11Å; M182-K185 PolarHBondContact O-N 2.94Å
186	T	65.8	Low	69.1	Low	109 Å²	109	88.1 Å²	88.1	67%	0.669	50%	0.501	S	S	*	.	H	α-helix	trans	-81.1	-18.7	179.5	-50.4	0	0	0	0	112.2	M182 V184 P188	M182-T186 WeakPolarHBondContact O-CB 3.4Å; M182-T186 PolarHBondContact O-N 3.01Å; M182-T186 PolarHBondContact O-OG1 3.11Å; V184-T186 VanDerWaalsContact C-N 3.29Å; V184-T186 PolarHBondContact O-N 3.2Å; T186-P188 VanDerWaalsContact C-CD 3.43Å; T186-P188 WeakPolarHBondContact O-CD 3.2Å
187	N	58.1	Low	66.9	Low	95 Å²	95	93.2 Å²	93.2	51%	0.508	52%	0.516	S	S	.	.			trans	-119	72.6	176	-73.8	-65.6	0	0	0	111.3	T183 V184 V189 S190	T183-N187 PolarHBondContact O-N 2.65Å; T183-N187 PolarHBondContact O-ND2 3.19Å; V184-N187 CarbonylContact O-C 3.59Å; V184-N187 VanDerWaalsContact O-C 3.31Å; V184-N187 PolarHBondContact O-N 3.21Å; N187-V189 PolarHBondContact O-N 3.32Å; N187-V189 VanDerWaalsContact O-N 3.12Å; N187-S190 PolarHBondContact O-N 2.82Å; N187-S190 PolarHBondContact O-OG 3.36Å
188	P	59.1	Low	64.6	Low	91 Å²	91	95.2 Å²	95.2	59%	0.591	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-14.8	176.5	26.6	-33.7	0	0	0	113.4	T186	T186-P188 VanDerWaalsContact C-CD 3.43Å; T186-P188 WeakPolarHBondContact O-CD 3.2Å
189	V	57.6	Low	62	Low	103 Å²	103	102 Å²	102	62%	0.624	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-10.3	-175	-171.1	0	0	0	0	113	N187 H191 V192	N187-V189 PolarHBondContact O-N 3.32Å; N187-V189 VanDerWaalsContact O-N 3.12Å; V189-H191 PolarHBondContact O-N 2.74Å; V189-V192 HydrophobicContact CG1-CB 4.29Å; V189-V192 CarbonylContact O-C 3.58Å; V189-V192 WeakPolarHBondContact O-CA 3.45Å; V189-V192 PolarHBondContact O-N 3.02Å
190	S	55.6	Low	59.2	Low	69 Å²	69	108.7 Å²	108.7	48%	0.483	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.5	-22.1	178.9	54.7	0	0	0	0	113.5	N187 V192	N187-S190 PolarHBondContact O-N 2.82Å; N187-S190 PolarHBondContact O-OG 3.36Å; S190-V192 VanDerWaalsContact C-N 3.34Å
191	H	51.9	Low	56.6	Low	147 Å²	147	109.9 Å²	109.9	68%	0.681	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-7.5	168.9	-57.9	-63.7	0	0	0	113.2	V189	V189-H191 PolarHBondContact O-N 2.74Å
192	V	50.5	Low	54.1	Low	91 Å²	91	111.5 Å²	111.5	55%	0.552	61%	0.607	S	S	*	*			trans	-106.3	20.7	-175.9	-162.1	0	0	0	0	111.3	V189 S190 S194	V189-V192 HydrophobicContact CG1-CB 4.29Å; V189-V192 CarbonylContact O-C 3.58Å; V189-V192 WeakPolarHBondContact O-CA 3.45Å; V189-V192 PolarHBondContact O-N 3.02Å; S190-V192 VanDerWaalsContact C-N 3.34Å; V192-S194 PolarHBondContact O-N 3.35Å
193	I	52	Low	51.6	Low	148 Å²	148	116.7 Å²	116.7	76%	0.759	63%	0.63	S	S	*	*	S	Bend	trans	-67.8	94.4	156.8	-58.4	-178.9	0	0	0	105.5
194	S	42.4	Very low	49.2	Very low	71 Å²	71	118.9 Å²	118.9	50%	0.497	64%	0.644	S	S	.	*			trans	-46.5	139.6	-175.9	-78.6	0	0	0	0	111.7	V192 S196	V192-S194 PolarHBondContact O-N 3.35Å; S194-S196 WeakPolarHBondContact CB-OG 3.34Å; S194-S196 PolarHBondContact O-N 3.46Å
195	A	47	Very low	47.2	Very low	99 Å²	99	125 Å²	125	82%	0.818	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	14.2	166.2	0	0	0	0	0	114
196	S	49.2	Very low	45.5	Very low	101 Å²	101	125 Å²	125	71%	0.706	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	6	176.8	54	0	0	0	0	114.2	S194	S194-S196 WeakPolarHBondContact CB-OG 3.34Å; S194-S196 PolarHBondContact O-N 3.46Å
197	Y	42.8	Very low	44.1	Very low	189 Å²	189	128.9 Å²	128.9	74%	0.741	69%	0.687	S	S	*	*			trans	-108.3	46.2	163.6	-147.5	-93.2	0	0	0	112	H199	Y197-H199 VanDerWaalsContact C-N 3.27Å; Y197-H199 HydrophobicContact CE1-CB 4.3Å; Y197-H199 PolarHBondContact O-N 2.92Å
198	I	42.1	Very low	42.9	Very low	118 Å²	118	133.5 Å²	133.5	61%	0.605	70%	0.702	S	S	*	*			trans	-84.4	86.8	148.4	-59.6	-174.2	0	0	0	105.2	Y200	I198-Y200 VanDerWaalsContact C-N 3.33Å; I198-Y200 HydrophobicContact CG2-CD2 3.97Å; I198-Y200 HydrophobicContact CG2-CE2 3.94Å; I198-Y200 HydrophobicContact CG2-CG 4.48Å; I198-Y200 PolarHBondContact O-N 3.34Å
199	H	36.8	Very low	41.7	Very low	143 Å²	143	136.4 Å²	136.4	66%	0.662	71%	0.713	S	S	*	*			trans	-69.1	99.6	162.9	-149.1	80.6	0	0	0	106	Y197 N201	Y197-H199 VanDerWaalsContact C-N 3.27Å; Y197-H199 HydrophobicContact CE1-CB 4.3Å; Y197-H199 PolarHBondContact O-N 2.92Å; H199-N201 PolarHBondContact O-N 3.27Å
200	Y	33	Very low	41.2	Very low	186 Å²	186	137.1 Å²	137.1	73%	0.729	72%	0.72	S	S	*	*			trans	-59.6	102	167	-82.7	-90.2	0	0	0	107.8	I198 T202	I198-Y200 VanDerWaalsContact C-N 3.33Å; I198-Y200 HydrophobicContact CG2-CD2 3.97Å; I198-Y200 HydrophobicContact CG2-CE2 3.94Å; I198-Y200 HydrophobicContact CG2-CG 4.48Å; I198-Y200 PolarHBondContact O-N 3.34Å; Y200-T202 VanDerWaalsContact C-N 3.29Å; Y200-T202 PolarHBondContact O-N 3.06Å
201	N	35.8	Very low	40.1	Very low	155 Å²	155	141.5 Å²	141.5	83%	0.829	74%	0.738	S	S	*	*			trans	-88.2	80.2	162.7	-155.3	29.2	0	0	0	107.8	H199	H199-N201 PolarHBondContact O-N 3.27Å
202	T	36.3	Very low	39.3	Very low	95 Å²	95	139 Å²	139	58%	0.583	74%	0.737	S	S	*	*			trans	-119.3	107.2	164.7	47.2	0	0	0	0	107.1	Y200	Y200-T202 VanDerWaalsContact C-N 3.29Å; Y200-T202 PolarHBondContact O-N 3.06Å
203	H	34.3	Very low	39	Very low	166 Å²	166	140.4 Å²	140.4	77%	0.769	75%	0.748	S	S	*	*			trans	174.4	101.9	144	-94.3	-64.5	0	0	0	107.8
204	T	33.4	Very low	38.1	Very low	114 Å²	114	141.2 Å²	141.2	70%	0.699	75%	0.748	S	S	*	*				52.3	109.6	101.2	58.5	0	0	0	0	114	V206	T204-V206 PolarHBondContact O-N 3.4Å
205	E	36.3	Very low	37.7	Very low	196 Å²	196	142.7 Å²	142.7	92%	0.916	77%	0.765	S	S	*	*			trans	-53.3	119.3	164.9	-60.5	-171.1	153.3	0	0	111.4
206	V	35.5	Very low	37.5	Very low	140 Å²	140	143.1 Å²	143.1	85%	0.848	76%	0.757	S	S	*	*			trans	-145.6	132.3	149.6	-172.5	0	0	0	0	109.3	T204	T204-V206 PolarHBondContact O-N 3.4Å
207	K	36.4	Very low	37.3	Very low	189 Å²	189	143.9 Å²	143.9	82%	0.822	76%	0.76	S	S	*	*			trans	-71	156	-176.3	-110.1	171	175.3	166.6	0	114.7
208	K	33.3	Very low	37	Very low	193 Å²	193	140.7 Å²	140.7	84%	0.839	76%	0.762	S	S	*	*			trans	92.4	112.8	146	-84.4	-176.1	171.8	-173.5	0	120
209	D	33.1	Very low	36.6	Very low	152 Å²	152	140.3 Å²	140.3	81%	0.813	77%	0.77	S	S	*	*			trans	-38	163.5	147.8	-69.3	-56.1	0	0	0	114.9
210	P	48.4	Very low	36.8	Very low	118 Å²	118	140 Å²	140	77%	0.766	78%	0.778	S	S	*	*			cis	-146.5	163.7	36.8	39.2	-17.8	0	0	0	118.9
211	D	32.2	Very low	36.9	Very low	160 Å²	160	137 Å²	137	86%	0.856	78%	0.782	S	S	*	*				146	137.8	113.5	-141.6	-3.4	0	0	0	113.4
212	S	34.4	Very low	36.7	Very low	95 Å²	95	133.1 Å²	133.1	66%	0.664	78%	0.778	S	S	*	*			trans	-85.6	163	-177.4	-148.8	0	0	0	0	110.2
213	P	45	Very low	36.6	Very low	120 Å²	120	134.2 Å²	134.2	78%	0.779	79%	0.789	S	S	*	*				-146	143.9	69.4	32	-9.6	0	0	0	117.3
214	E	32.4	Very low	36.3	Very low	166 Å²	166	130.5 Å²	130.5	78%	0.776	78%	0.783	S	S	*	*				37.2	113	127.3	-153.2	154.8	-179.7	0	0	120.5
215	A	33.5	Very low	36.3	Very low	101 Å²	101	134 Å²	134	84%	0.835	79%	0.79	S	S	*	*			trans	-145.9	96.9	154.5	0	0	0	0	0	110.7
216	T	43.6	Very low	36	Very low	109 Å²	109	129.9 Å²	129.9	67%	0.669	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-77.9	131.9	168.7	-47.2	0	0	0	0	109.8
217	P	44.8	Very low	35.8	Very low	116 Å²	116	129 Å²	129	75%	0.753	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-89.3	132.2	160.9	30.3	-27.6	0	0	0	110.8
218	P	37.4	Very low	35.8	Very low	123 Å²	123	128.6 Å²	128.6	80%	0.799	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-88.2	156.6	177.2	33.7	-31.5	0	0	0	114
219	S	32.6	Very low	36.2	Very low	110 Å²	110	125.6 Å²	125.6	77%	0.769	78%	0.782	S	S	*	*			trans	-26.2	146	174.8	-52.1	0	0	0	0	122.2
220	T	40.5	Very low	36.2	Very low	136 Å²	136	125 Å²	125	83%	0.834	78%	0.778	S	S	*	*			trans	-32.3	149	147.4	1.4	0	0	0	0	116.2
221	P	35.3	Very low	35.4	Very low	124 Å²	124	127.7 Å²	127.7	81%	0.805	79%	0.785	S	S	*	*			trans	-112.1	138.5	145.1	24.4	-8.4	0	0	0	111.8
222	G	31.3	Very low	35.5	Very low	72 Å²	72	127.6 Å²	127.6	74%	0.742	78%	0.783	S	S	*	*			trans	-99.3	-169.3	172.1	0	0	0	0	0	114
223	S	34.3	Very low	35.1	Very low	118 Å²	118	126.7 Å²	126.7	83%	0.825	79%	0.79	S	S	*	*			trans	88.7	141.9	166.6	-161.6	0	0	0	0	115.1
224	S	30	Very low	34.5	Very low	89 Å²	89	129.1 Å²	129.1	62%	0.622	80%	0.796	S	S	*	*			cis	-173.9	168.5	-16.3	-83.3	0	0	0	0	105.4
225	H	32	Very low	34.3	Very low	187 Å²	187	125 Å²	125	87%	0.866	80%	0.798	S	S	*	*			trans	148	96.5	148.3	-75.3	-57.6	0	0	0	107.6
226	S	30.9	Very low	34.2	Very low	110 Å²	110	125.8 Å²	125.8	77%	0.769	80%	0.797	S	S	*	*				81.5	105.3	79.9	-173.2	0	0	0	0	112.8
227	S	30.1	Very low	33.6	Very low	121 Å²	121	129 Å²	129	85%	0.846	81%	0.807	S	S	*	*				-170.2	122.3	124.1	25.8	0	0	0	0	111
228	K	37.7	Very low	32.9	Very low	181 Å²	181	130.5 Å²	130.5	79%	0.787	81%	0.809	S	S	*	*			trans	-113.5	161.3	161	-107.9	-178.5	-173.3	178.3	0	104.7
229	P	41.5	Very low	32.6	Very low	129 Å²	129	130.4 Å²	130.4	84%	0.838	81%	0.811	S	S	*	*				-148.9	169.2	59.9	34.9	-11.7	0	0	0	118
230	L	33.4	Very low	32.8	Very low	139 Å²	139	137.2 Å²	137.2	73%	0.728	82%	0.82	S	S	*	*			trans	-65.2	159	168.3	-66.2	152.5	0	0	0	112
231	L	31.8	Very low	32.5	Very low	175 Å²	175	135.2 Å²	135.2	92%	0.916	82%	0.817	S	S	*	*			trans	-153	141.5	135	-107	173.3	0	0	0	112.5
232	L	32.7	Very low	32.6	Very low	158 Å²	158	141.5 Å²	141.5	83%	0.827	82%	0.824	S	S	*	*			trans	-66.6	155.9	176.5	-97.6	71.6	0	0	0	113
233	G	26.5	Very low	32.8	Very low	77 Å²	77	146.9 Å²	146.9	79%	0.794	83%	0.83	S	S	*	*			trans	-164.5	104.7	157.5	0	0	0	0	0	112.3
234	N	32.5	Very low	33	Very low	171 Å²	171	153.1 Å²	153.1	91%	0.914	84%	0.836	S	S	*	*			trans	-78.8	141.7	166.5	-97.5	38.6	0	0	0	110.1
235	G	28.5	Very low	33.2	Very low	80 Å²	80	158.8 Å²	158.8	83%	0.825	85%	0.849	S	S	*	*			trans	-170.7	111.9	169	0	0	0	0	0	112.6
236	S	31.2	Very low	33.7	Very low	116 Å²	116	161.2 Å²	161.2	81%	0.811	85%	0.851	S	S	*	*			trans	-70.4	146.8	172.6	178	0	0	0	0	111.8
237	M	30.8	Very low	33.9	Very low	177 Å²	177	165.6 Å²	165.6	87%	0.872	86%	0.856	S	S	*	*			trans	-176.7	142.1	131.2	-78.9	-143.3	82.3	0	0	111.2
238	D	31.1	Very low	34.3	Very low	148 Å²	148	169 Å²	169	79%	0.791	86%	0.856	S	S	*	*			trans	-54.9	146.3	-178.2	-74.7	-74.2	0	0	0	116.9
239	S	30.7	Very low	34.4	Very low	121 Å²	121	165.5 Å²	165.5	85%	0.846	85%	0.853	S	S	*	*			trans	-168.2	124	131	39.9	0	0	0	0	112
240	R	36.9	Very low	34	Very low	253 Å²	253	163.9 Å²	163.9	96%	0.955	85%	0.845	S	S	*	*			trans	-66.2	128	173.5	-71.4	172.1	178	166.7	-0.5	110.4
241	A	32.7	Very low	34.6	Very low	93 Å²	93	162.8 Å²	162.8	77%	0.769	85%	0.847	S	S	*	*			trans	-145.5	106.6	152.7	0	0	0	0	0	110.2	Q243	A241-Q243 PolarHBondContact O-N 3.04Å
242	R	38.8	Very low	35.2	Very low	257 Å²	257	158.6 Å²	158.6	97%	0.97	84%	0.837	S	S	*	*			trans	-61.5	102.9	168.5	-94.2	177.2	162.9	-157	-1.8	109.1
243	Q	34.4	Very low	35.9	Very low	184 Å²	184	156.7 Å²	156.7	86%	0.86	83%	0.832	S	S	*	*			trans	-103.7	111.3	157.8	-83.3	-171.7	-17.2	0	0	109.5	A241 K245	A241-Q243 PolarHBondContact O-N 3.04Å; Q243-K245 PolarHBondContact O-N 2.7Å
244	R	39.3	Very low	37.3	Very low	250 Å²	250	159 Å²	159	94%	0.943	83%	0.831	S	S	*	*			trans	-58.3	101.8	170.2	-72.8	168.3	119.4	178.2	-0.2	108.4	R246	R244-R246 VanDerWaalsContact C-N 3.33Å; R244-R246 PolarHBondContact O-N 3.47Å
245	K	34.7	Very low	37.9	Very low	208 Å²	208	158.2 Å²	158.2	90%	0.904	82%	0.822	S	S	*	*			trans	-64.1	94.5	165.7	-94.6	-175.2	175.9	177.3	0	108.5	Q243 K247	Q243-K245 PolarHBondContact O-N 2.7Å; K245-K247 PolarHBondContact O-N 3.23Å
246	R	41	Very low	39.2	Very low	238 Å²	238	156.6 Å²	156.6	90%	0.898	80%	0.796	S	S	*	*			trans	-62.9	104.7	163.2	-164	174.5	178	-169.8	-0.5	106.2	R244 K248	R244-R246 VanDerWaalsContact C-N 3.33Å; R244-R246 PolarHBondContact O-N 3.47Å; R246-K248 VanDerWaalsContact C-N 3.33Å; R246-K248 PolarHBondContact O-N 3.41Å
247	K	35.5	Very low	40.5	Very low	202 Å²	202	155.9 Å²	155.9	88%	0.878	79%	0.789	S	S	*	*			trans	-56.6	98.9	169.8	-102.7	176.5	173.1	176.7	0	107.2	K245 S249	K245-K247 PolarHBondContact O-N 3.23Å; K247-S249 VanDerWaalsContact C-N 3.25Å; K247-S249 PolarHBondContact O-N 3.19Å; K247-S249 VanDerWaalsContact O-N 3.08Å
248	K	39.7	Very low	42	Very low	193 Å²	193	154 Å²	154	84%	0.839	79%	0.793	S	S	*	*			trans	-75.3	90.4	163.1	-167	156.3	-174.9	176.1	0	105.2	R246 S250	R246-K248 VanDerWaalsContact C-N 3.33Å; R246-K248 PolarHBondContact O-N 3.41Å; K248-S250 PolarHBondContact O-N 3.17Å
249	S	38.2	Very low	44.1	Very low	106 Å²	106	149.1 Å²	149.1	74%	0.741	78%	0.778	S	S	*	*			trans	-68.1	87.9	167.4	52.2	0	0	0	0	107	K247	K247-S249 VanDerWaalsContact C-N 3.25Å; K247-S249 PolarHBondContact O-N 3.19Å; K247-S249 VanDerWaalsContact O-N 3.08Å
250	S	33.9	Very low	46.7	Very low	95 Å²	95	144.9 Å²	144.9	66%	0.664	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-60	122.4	155.8	-58.5	0	0	0	0	105.9	K248 A252	K248-S250 PolarHBondContact O-N 3.17Å; S250-A252 PolarHBondContact O-N 3.35Å; S250-A252 VanDerWaalsContact O-N 3.12Å
251	P	45.7	Very low	49.3	Very low	117 Å²	117	135.2 Å²	135.2	76%	0.76	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-58.9	123.7	168.9	24.4	-28.7	0	0	0	106.1	T253	P251-T253 PolarHBondContact O-N 3.33Å
252	A	43.6	Very low	52.2	Low	87 Å²	87	133.8 Å²	133.8	72%	0.719	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-53.6	117.5	169.7	0	0	0	0	0	106.5	S250 V254	S250-A252 PolarHBondContact O-N 3.35Å; S250-A252 VanDerWaalsContact O-N 3.12Å; A252-V254 PolarHBondContact O-N 3.29Å
253	T	48.6	Very low	54.8	Low	118 Å²	118	125.1 Å²	125.1	72%	0.724	67%	0.671	S	S	*	*			trans	-60.6	96.4	168.1	-51.3	0	0	0	0	105.4	P251 E255	P251-T253 PolarHBondContact O-N 3.33Å; T253-E255 VanDerWaalsContact C-N 3.31Å; T253-E255 PolarHBondContact O-N 3.23Å
254	V	55.3	Low	57.7	Low	126 Å²	126	118.9 Å²	118.9	76%	0.764	65%	0.647	S	S	*	*			trans	-63	105.5	166.3	177.3	0	0	0	0	103.8	A252 P256	A252-V254 PolarHBondContact O-N 3.29Å; V254-P256 WeakPolarHBondContact O-CD 3.4Å
255	E	46.2	Very low	60.3	Low	154 Å²	154	107.9 Å²	107.9	72%	0.72	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-50.3	118.7	171.1	-84.6	-64.2	144.2	0	0	106.7	T253	T253-E255 VanDerWaalsContact C-N 3.31Å; T253-E255 PolarHBondContact O-N 3.23Å
256	P	55.3	Low	63.2	Low	45 Å²	45	101.1 Å²	101.1	29%	0.292	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-59.1	147	-176.7	20.7	-28.7	0	0	0	108.7	V254 S258 A260	V254-P256 WeakPolarHBondContact O-CD 3.4Å; P256-S258 PolarHBondContact O-N 2.91Å; P256-A260 HydrophobicContact CB-CB 4.07Å
257	P	59.1	Low	65.7	Low	102 Å²	102	97.5 Å²	97.5	66%	0.662	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-47.6	133.1	-179.6	-25	31.6	0	0	0	110.2	G259 A260	P257-G259 PolarHBondContact O-N 2.92Å; P257-A260 WeakPolarHBondContact O-CB 3.45Å; P257-A260 PolarHBondContact O-N 3.38Å
258	S	62.1	Low	68.5	Low	137 Å²	137	89.5 Å²	89.5	96%	0.958	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	113.1	178.5	-173.8	0	0	0	0	108.9	P256	P256-S258 PolarHBondContact O-N 2.91Å
259	G	73.8	Confident	71.1	Confident	45 Å²	45	80.4 Å²	80.4	46%	0.464	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.9	2.9	-174.2	0	0	0	0	0	117.1	K179 P257	K179-G259 VanDerWaalsContact CE-O 3.28Å; K179-G259 WeakPolarHBondContact CE-O 3.48Å; K179-G259 VanDerWaalsContact NZ-C 3.32Å; K179-G259 PolarHBondContact NZ-O 3.24Å; P257-G259 PolarHBondContact O-N 2.92Å
260	A	86.6	Confident	73.8	Confident	33 Å²	33	79.1 Å²	79.1	27%	0.273	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-69.9	151.6	171.8	0	0	0	0	0	112.6	P256 P257 Q262	P256-A260 HydrophobicContact CB-CB 4.07Å; P257-A260 WeakPolarHBondContact O-CB 3.45Å; P257-A260 PolarHBondContact O-N 3.38Å; A260-Q262 PolarHBondContact O-N 2.88Å; A260-Q262 PolarHBondContact O-NE2 3.29Å
261	I	90.9	Very high	76.6	Confident	50 Å²	50	81.8 Å²	81.8	26%	0.256	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-66.4	126.7	170.1	-60.2	172	0	0	0	108.5	V172 L176 H265 I266	V172-I261 HydrophobicContact CG1-CD1 3.85Å; L176-I261 HydrophobicContact CD2-CD1 3.74Å; L176-I261 HydrophobicContact CD2-CG1 3.7Å; L176-I261 HydrophobicContact CG-CD1 3.75Å; L176-I261 HydrophobicContact CG-CG1 4.21Å; I261-H265 HydrophobicContact CG2-CB 4.07Å; I261-I266 HydrophobicContact CG2-CD1 4.22Å; I261-I266 HydrophobicContact CG2-CG1 3.8Å
262	Q	93.3	Very high	78.8	Confident	63 Å²	63	79.7 Å²	79.7	29%	0.294	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-95.6	155.5	177	-60.7	-53.3	-45.9	0	0	111.3	A260 C264 H265 I266	A260-Q262 PolarHBondContact O-N 2.88Å; A260-Q262 PolarHBondContact O-NE2 3.29Å; Q262-C264 PolarHBondContact O-N 2.83Å; Q262-C264 VanDerWaalsContact O-N 3.07Å; Q262-H265 PolarHBondContact N-ND1 2.97Å; Q262-H265 WeakPolarHBondContact O-CB 3.39Å; Q262-H265 PolarHBondContact O-N 3.09Å; Q262-I266 PolarHBondContact O-N 2.99Å
263	P	94.8	Very high	80.9	Confident	74 Å²	74	79 Å²	79	48%	0.481	43%	0.429	S	S	.	.	H	α-helix	trans	-54.5	-28.4	176.4	-28.9	36.5	0	0	0	114.4	I266 R267	P263-I266 PolarHBondContact O-N 3.19Å; P263-R267 VanDerWaalsContact CB-NH1 3.3Å; P263-R267 WeakPolarHBondContact O-CG 3.38Å; P263-R267 PolarHBondContact O-N 3.07Å
264	C	93.7	Very high	82.2	Confident	53 Å²	53	79 Å²	79	36%	0.358	42%	0.424	S	S	.	.	H	α-helix	trans	-65.8	-38.4	175.2	59.7	0	0	0	0	112.7	Q262 I266 R267 E268	Q262-C264 PolarHBondContact O-N 2.83Å; Q262-C264 VanDerWaalsContact O-N 3.07Å; C264-I266 VanDerWaalsContact C-N 3.33Å; C264-I266 PolarHBondContact O-N 2.83Å; C264-R267 PolarHBondContact O-N 2.94Å; C264-E268 VanDerWaalsContact O-CB 3.28Å; C264-E268 WeakPolarHBondContact O-CB 3.17Å; C264-E268 PolarHBondContact O-N 3.05Å
265	H	94.4	Very high	82.1	Confident	20 Å²	20	83.1 Å²	83.1	9%	0.093	43%	0.427	C	S	.	.	H	α-helix	trans	-64.3	-41	176.8	-51.6	145.4	0	0	0	110.9	V178 K179 I261 Q262 E268 A269	V178-H265 HydrophobicContact CG1-CB 4.31Å; K179-H265 VanDerWaalsContact CG-CE1 3.47Å; K179-H265 WeakPolarHBondContact CG-CE1 3.42Å; I261-H265 HydrophobicContact CG2-CB 4.07Å; Q262-H265 PolarHBondContact N-ND1 2.97Å; Q262-H265 WeakPolarHBondContact O-CB 3.39Å; Q262-H265 PolarHBondContact O-N 3.09Å; H265-E268 PolarHBondContact O-N 3.23Å; H265-A269 VanDerWaalsContact O-CB 3.31Å; H265-A269 WeakPolarHBondContact O-CB 3.44Å; H265-A269 PolarHBondContact O-N 3.4Å
266	I	94.8	Very high	82.2	Confident	65 Å²	65	89 Å²	89	33%	0.333	44%	0.443	S	S	.	.	H	α-helix	trans	-65.8	-49.2	178.6	-58.4	171.6	0	0	0	110.6	I171 S175 I261 Q262 P263 C264 E268 A269 I270	I171-I266 HydrophobicContact CG2-CG2 3.99Å; S175-I266 WeakPolarHBondContact OG-CA 3.35Å; I261-I266 HydrophobicContact CG2-CD1 4.22Å; I261-I266 HydrophobicContact CG2-CG1 3.8Å; Q262-I266 PolarHBondContact O-N 2.99Å; P263-I266 PolarHBondContact O-N 3.19Å; C264-I266 VanDerWaalsContact C-N 3.33Å; C264-I266 PolarHBondContact O-N 2.83Å; I266-E268 VanDerWaalsContact C-N 3.27Å; I266-E268 PolarHBondContact O-N 3.47Å; I266-A269 PolarHBondContact O-N 2.99Å; I266-I270 HydrophobicContact CG2-CD1 3.99Å; I266-I270 WeakPolarHBondContact O-CG1 3.18Å; I266-I270 PolarHBondContact O-N 2.68Å
267	R	95	Very high	83.6	Confident	162 Å²	162	91.3 Å²	91.3	61%	0.611	45%	0.451	S	S	*	.	H	α-helix	trans	-58.1	-42.6	177.8	-74.4	-170.9	-62.8	-91.1	4.7	111.6	P263 C264 I270 R271	P263-R267 VanDerWaalsContact CB-NH1 3.3Å; P263-R267 WeakPolarHBondContact O-CG 3.38Å; P263-R267 PolarHBondContact O-N 3.07Å; C264-R267 PolarHBondContact O-N 2.94Å; R267-I270 PolarHBondContact O-N 2.87Å; R267-R271 WeakPolarHBondContact O-CB 3.47Å; R267-R271 PolarHBondContact O-N 3.34Å
268	E	94.4	Very high	84.9	Confident	35 Å²	35	90.7 Å²	90.7	16%	0.164	44%	0.439	C	S	.	.	H	α-helix	trans	-71	-37.9	179.6	-178.9	66.2	-175.7	0	0	112.4	V178 M182 C264 H265 I266 R271 R272	V178-E268 HydrophobicContact CG1-CB 3.93Å; V178-E268 HydrophobicContact CG1-CG 3.76Å; V178-E268 HydrophobicContact CG2-CG 4.4Å; M182-E268 HydrophobicContact CE-CB 4.04Å; M182-E268 HydrophobicContact CE-CG 3.73Å; C264-E268 VanDerWaalsContact O-CB 3.28Å; C264-E268 WeakPolarHBondContact O-CB 3.17Å; C264-E268 PolarHBondContact O-N 3.05Å; H265-E268 PolarHBondContact O-N 3.23Å; I266-E268 VanDerWaalsContact C-N 3.27Å; I266-E268 PolarHBondContact O-N 3.47Å; E268-R271 PolarHBondContact O-N 2.94Å; E268-R271 IonicContact OE1-CZ 3.42Å; E268-R271 IonicContact OE1-NE 3.53Å; E268-R271 PolarHBondContact OE1-NE 2.85Å; E268-R271 IonicContact OE1-NH2 3.41Å; E268-R271 PolarHBondContact OE1-NH2 2.93Å; E268-R271 IonicContact OE2-CZ 2.73Å; E268-R271 IonicContact OE2-NE 2.76Å; E268-R271 PolarHBondContact OE2-NE 3.15Å; E268-R271 IonicContact OE2-NH2 3.17Å; E268-R272 WeakPolarHBondContact O-CG 3.42Å; E268-R272 PolarHBondContact O-N 3.12Å; E268-R272 IonicContact OE1-CZ 3.94Å; E268-R272 VanDerWaalsContact OE1-CZ 3.26Å; E268-R272 IonicContact OE1-NE 2.8Å; E268-R272 PolarHBondContact OE1-NE 2.81Å; E268-R272 IonicContact OE1-NH2 2.79Å; E268-R272 PolarHBondContact OE1-NH2 3.05Å
269	A	94.1	Very high	86.1	Confident	2 Å²	2	88.1 Å²	88.1	2%	0.017	41%	0.411	C	S	.	.	H	α-helix	trans	-59.8	-47.6	172.4	0	0	0	0	0	111.2	L174 V178 H265 I266 R271 R272 Y273	L174-A269 HydrophobicContact CB-CB 3.89Å; V178-A269 HydrophobicContact CG2-CB 4.11Å; H265-A269 VanDerWaalsContact O-CB 3.31Å; H265-A269 WeakPolarHBondContact O-CB 3.44Å; H265-A269 PolarHBondContact O-N 3.4Å; I266-A269 PolarHBondContact O-N 2.99Å; A269-R271 VanDerWaalsContact C-N 3.34Å; A269-R271 PolarHBondContact O-N 2.92Å; A269-R272 PolarHBondContact O-N 3.31Å; A269-Y273 WeakPolarHBondContact O-CB 3.39Å; A269-Y273 VanDerWaalsContact O-CD2 3.24Å; A269-Y273 WeakPolarHBondContact O-CD2 3.32Å; A269-Y273 PolarHBondContact O-N 2.97Å
270	I	93.4	Very high	86.8	Confident	79 Å²	79	90.6 Å²	90.6	41%	0.405	41%	0.408	S	S	.	.	H	α-helix	trans	-60.1	-46.4	175.5	-65.5	169.3	0	0	0	110	I266 R267 R272 Y273 N274	I266-I270 HydrophobicContact CG2-CD1 3.99Å; I266-I270 WeakPolarHBondContact O-CG1 3.18Å; I266-I270 PolarHBondContact O-N 2.68Å; R267-I270 PolarHBondContact O-N 2.87Å; I270-R272 VanDerWaalsContact C-N 3.28Å; I270-R272 PolarHBondContact O-N 2.83Å; I270-Y273 PolarHBondContact O-N 3.27Å; I270-N274 HydrophobicContact CG2-CB 4.08Å; I270-N274 WeakPolarHBondContact O-CB 3.48Å; I270-N274 PolarHBondContact O-N 3.07Å
271	R	93.7	Very high	86.9	Confident	150 Å²	150	94.3 Å²	94.3	57%	0.566	42%	0.416	S	S	*	.	H	α-helix	trans	-57.1	-40.2	179.1	-167.3	-167	68	76.2	-0.8	112.8	R267 E268 A269	R267-R271 WeakPolarHBondContact O-CB 3.47Å; R267-R271 PolarHBondContact O-N 3.34Å; E268-R271 PolarHBondContact O-N 2.94Å; E268-R271 IonicContact OE1-CZ 3.42Å; E268-R271 IonicContact OE1-NE 3.53Å; E268-R271 PolarHBondContact OE1-NE 2.85Å; E268-R271 IonicContact OE1-NH2 3.41Å; E268-R271 PolarHBondContact OE1-NH2 2.93Å; E268-R271 IonicContact OE2-CZ 2.73Å; E268-R271 IonicContact OE2-NE 2.76Å; E268-R271 PolarHBondContact OE2-NE 3.15Å; E268-R271 IonicContact OE2-NH2 3.17Å; A269-R271 VanDerWaalsContact C-N 3.34Å; A269-R271 PolarHBondContact O-N 2.92Å
272	R	91.8	Very high	86.6	Confident	73 Å²	73	97.2 Å²	97.2	28%	0.275	43%	0.427	S	S	.	.	H	α-helix	trans	-81	-37.2	-176.6	-69.9	-179	-170.4	-172.4	8.8	114	E181 E268 A269 I270	E181-R272 IonicContact OE1-NH1 3.45Å; E181-R272 IonicContact OE2-CZ 3.75Å; E181-R272 IonicContact OE2-NH1 2.93Å; E181-R272 PolarHBondContact OE2-NH1 3.38Å; E268-R272 WeakPolarHBondContact O-CG 3.42Å; E268-R272 PolarHBondContact O-N 3.12Å; E268-R272 IonicContact OE1-CZ 3.94Å; E268-R272 VanDerWaalsContact OE1-CZ 3.26Å; E268-R272 IonicContact OE1-NE 2.8Å; E268-R272 PolarHBondContact OE1-NE 2.81Å; E268-R272 IonicContact OE1-NH2 2.79Å; E268-R272 PolarHBondContact OE1-NH2 3.05Å; A269-R272 PolarHBondContact O-N 3.31Å; I270-R272 VanDerWaalsContact C-N 3.28Å; I270-R272 PolarHBondContact O-N 2.83Å
273	Y	87.4	Confident	86.1	Confident	74 Å²	74	99.6 Å²	99.6	29%	0.29	44%	0.436	S	S	.	.	H	α-helix	trans	-115.4	-4	-163.9	-60.6	-74.8	0	0	0	114.7	L174 L177 V178 A269 I270 Y275	L174-Y273 HydrophobicContact CB-CD2 4.2Å; L174-Y273 HydrophobicContact CD1-CD2 4.1Å; L174-Y273 HydrophobicContact CD1-CG 4Å; L174-Y273 HydrophobicContact CD2-CD1 4.1Å; L174-Y273 HydrophobicContact CD2-CD2 3.81Å; L174-Y273 HydrophobicContact CD2-CE1 4.29Å; L174-Y273 HydrophobicContact CD2-CE2 4.04Å; L174-Y273 HydrophobicContact CD2-CG 3.87Å; L174-Y273 HydrophobicContact CG-CD2 4.26Å; L174-Y273 HydrophobicContact CG-CG 4.46Å; L177-Y273 HydrophobicContact CD2-CE2 4.48Å; L177-Y273 WeakPolarHBondContact CD2-OH 3.17Å; V178-Y273 HydrophobicContact CG2-CE2 4.4Å; A269-Y273 WeakPolarHBondContact O-CB 3.39Å; A269-Y273 VanDerWaalsContact O-CD2 3.24Å; A269-Y273 WeakPolarHBondContact O-CD2 3.32Å; A269-Y273 PolarHBondContact O-N 2.97Å; I270-Y273 PolarHBondContact O-N 3.27Å; Y273-Y275 PolarHBondContact O-N 3.33Å; Y273-Y275 VanDerWaalsContact O-N 3.15Å
274	N	76.4	Confident	85.5	Confident	118 Å²	118	101.6 Å²	101.6	63%	0.631	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	2.6	-178.8	-160.3	37.7	0	0	0	114.6	I270	I270-N274 HydrophobicContact CG2-CB 4.08Å; I270-N274 WeakPolarHBondContact O-CB 3.48Å; I270-N274 PolarHBondContact O-N 3.07Å
275	Y	53.6	Low	84.8	Confident	211 Å²	211	105.7 Å²	105.7	83%	0.827	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	12.3	-179.5	-62.9	-78.5	0	0	0	114.1	Y273	Y273-Y275 PolarHBondContact O-N 3.33Å; Y273-Y275 VanDerWaalsContact O-N 3.15Å
276	R	48.1	Very low	83.9	Confident	279 Å²	279	113.5 Å²	113.5	100%	1.053	47%	0.47	S	S	*	.			trans	-124.5	0	176.8	-72.9	-172.8	177.4	-141.2	0.8	110.9

Retrieved 276 of 276 residues in 459.1 ms (Link to these results)

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