X6R6X3_HUMAN Loading...

Zinc finger containing ubiquitin peptidase 1

AlphaFold DB , UniProt , Accession X6R6X3, Species HUMAN (Homo sapiens, Human), Gene ZUP1, Length 280 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	77.8	Confident	85	Confident	187 Å²	187	88 Å²	88	92%	0.921	51%	0.506	S	S	*	.				0	126.1	0	-70.8	172.8	174	0	0	107	V11	M1-V11 CarbonylContact C-O 3.52Å; M1-V11 VanDerWaalsContact CA-O 3.23Å; M1-V11 WeakPolarHBondContact CA-O 3.44Å
2	L	86.3	Confident	85.2	Confident	79 Å²	79	89.8 Å²	89.8	41%	0.414	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.1	178.6	-60.3	172.7	0	0	0	107.3	T10 V11 E14 M17	L2-T10 CarbonylContact O-C 3.6Å; L2-T10 WeakPolarHBondContact O-CA 3.31Å; L2-V11 PolarHBondContact N-O 3.24Å; L2-V11 PolarHBondContact O-N 3.39Å; L2-E14 HydrophobicContact CD1-CB 4.3Å; L2-M17 VanDerWaalsContact C-CE 3.49Å; L2-M17 HydrophobicContact CB-CE 3.61Å; L2-M17 HydrophobicContact CD1-CB 4.17Å; L2-M17 WeakPolarHBondContact O-CE 3.36Å
3	S	88.7	Confident	85.6	Confident	73 Å²	73	85.9 Å²	85.9	51%	0.51	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	134.4	176.3	50	0	0	0	0	110.9	E9 M17	S3-E9 CarbonylContact C-O 3.56Å; S3-E9 WeakPolarHBondContact CA-O 3.47Å; S3-M17 VanDerWaalsContact C-CE 3.46Å
4	C	88.4	Confident	85.8	Confident	4 Å²	4	90.7 Å²	90.7	3%	0.027	52%	0.516	C	S	.	.			trans	-75	126.5	172.5	179.5	0	0	0	0	109.9	I6 G8 E9 M17 H20	C4-I6 PolarHBondContact O-N 3.32Å; C4-I6 PolarHBondContact SG-N 3.27Å; C4-I6 VanDerWaalsContact SG-N 3.4Å; C4-G8 WeakPolarHBondContact O-CA 3.42Å; C4-G8 PolarHBondContact O-N 3.35Å; C4-E9 PolarHBondContact N-O 3.03Å; C4-M17 HydrophobicContact CB-CE 4.17Å; C4-M17 HydrophobicContact CB-SD 4.1Å; C4-H20 VanDerWaalsContact CB-NE2 3.26Å; C4-H20 WeakPolarHBondContact CB-NE2 3.44Å; C4-H20 PolarHBondContact SG-NE2 2.68Å
5	N	80.7	Confident	85.9	Confident	160 Å²	160	90.9 Å²	90.9	86%	0.856	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-8.3	179.4	-61.1	-52.4	0	0	0	113.6
6	I	82.2	Confident	85.9	Confident	111 Å²	111	89.4 Å²	89.4	57%	0.569	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-42.3	-178.6	-51.7	173.3	0	0	0	111.2	C4 L21 H24	C4-I6 PolarHBondContact O-N 3.32Å; C4-I6 PolarHBondContact SG-N 3.27Å; C4-I6 VanDerWaalsContact SG-N 3.4Å; I6-L21 HydrophobicContact CD1-CD2 3.91Å; I6-H24 HydrophobicContact CD1-CB 3.64Å; I6-H24 WeakPolarHBondContact CG2-ND1 3.28Å
7	C	84.1	Confident	86.1	Confident	68 Å²	68	85.4 Å²	85.4	46%	0.459	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.2	-1.4	-176.3	65.3	0	0	0	0	115.3	E9 H20	C7-E9 PolarHBondContact O-N 3.31Å; C7-H20 PolarHBondContact SG-CE1 3.34Å; C7-H20 PolarHBondContact SG-NE2 3.33Å
8	G	83.3	Confident	86.1	Confident	53 Å²	53	89.1 Å²	89.1	55%	0.546	50%	0.497	S	S	.	.			trans	76.8	-3	-179.6	0	0	0	0	0	115.8	C4	C4-G8 WeakPolarHBondContact O-CA 3.42Å; C4-G8 PolarHBondContact O-N 3.35Å
9	E	87.7	Confident	86	Confident	115 Å²	115	87.4 Å²	87.4	54%	0.537	50%	0.496	S	S	.	.			trans	-64.7	138.7	-178	-169.4	169.1	-151.8	0	0	111.9	S3 C4 C7 H20	S3-E9 CarbonylContact C-O 3.56Å; S3-E9 WeakPolarHBondContact CA-O 3.47Å; C4-E9 PolarHBondContact N-O 3.03Å; C7-E9 PolarHBondContact O-N 3.31Å; E9-H20 IonicContact OE2-CE1 3.79Å; E9-H20 PolarHBondContact OE2-CE1 2.61Å; E9-H20 IonicContact OE2-ND1 2.86Å; E9-H20 PolarHBondContact OE2-ND1 3.33Å
10	T	88.3	Confident	85.9	Confident	97 Å²	97	84.3 Å²	84.3	60%	0.595	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	120.7	-177.9	58.1	0	0	0	0	111.7	L2	L2-T10 CarbonylContact O-C 3.6Å; L2-T10 WeakPolarHBondContact O-CA 3.31Å
11	V	87.6	Confident	85.7	Confident	21 Å²	21	83.5 Å²	83.5	13%	0.127	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	149.4	-174	-148.1	0	0	0	0	110.7	M1 L2 D16 M17 H20	M1-V11 CarbonylContact C-O 3.52Å; M1-V11 VanDerWaalsContact CA-O 3.23Å; M1-V11 WeakPolarHBondContact CA-O 3.44Å; L2-V11 PolarHBondContact N-O 3.24Å; L2-V11 PolarHBondContact O-N 3.39Å; V11-D16 HydrophobicContact CB-CB 4.47Å; V11-D16 HydrophobicContact CG1-CB 3.3Å; V11-M17 HydrophobicContact CB-CE 4.19Å; V11-M17 HydrophobicContact CG2-CE 3.57Å; V11-M17 HydrophobicContact CG2-SD 4.16Å; V11-H20 HydrophobicContact CG2-CB 4.42Å
12	T	86.9	Confident	85.9	Confident	110 Å²	110	78.1 Å²	78.1	68%	0.675	45%	0.445	S	S	*	.	S	Bend	trans	-78.1	-30.6	-170.1	35.8	0	0	0	0	114.6	D16	T12-D16 PolarHBondContact OG1-OD2 2.92Å
13	S	91.2	Very high	85.3	Confident	39 Å²	39	78.4 Å²	78.4	27%	0.273	45%	0.45	S	S	.	.	S	Bend	trans	-141.2	167.1	-178.5	79.3	0	0	0	0	113.4	P15 D16 M17	S13-P15 WeakPolarHBondContact OG-CD 3.47Å; S13-P15 WeakPolarHBondContact OG-CG 3.45Å; S13-D16 WeakPolarHBondContact CB-OD2 3.49Å; S13-D16 PolarHBondContact N-OD2 2.93Å; S13-D16 PolarHBondContact O-N 2.94Å; S13-D16 PolarHBondContact OG-N 3.39Å; S13-D16 PolarHBondContact OG-OD1 3.43Å; S13-D16 PolarHBondContact OG-OD2 3.44Å; S13-M17 PolarHBondContact O-N 3.43Å
14	E	88.2	Confident	84.5	Confident	153 Å²	153	77.3 Å²	77.3	72%	0.715	44%	0.437	S	S	*	.	H	α-helix	trans	-61.5	-48	174.9	-173.2	-172.1	156.6	0	0	114	L2 D16 M17 K18	L2-E14 HydrophobicContact CD1-CB 4.3Å; E14-D16 VanDerWaalsContact C-N 3.29Å; E14-D16 PolarHBondContact O-N 3.49Å; E14-M17 WeakPolarHBondContact O-CB 3.32Å; E14-M17 PolarHBondContact O-N 2.9Å; E14-K18 PolarHBondContact O-N 3.33Å
15	P	87.6	Confident	83.6	Confident	93 Å²	93	84.3 Å²	84.3	60%	0.604	47%	0.471	S	S	*	.	H	α-helix	trans	-64	-33.3	176.2	23.1	-33.1	0	0	0	112.8	S13 K18 A19	S13-P15 WeakPolarHBondContact OG-CD 3.47Å; S13-P15 WeakPolarHBondContact OG-CG 3.45Å; P15-K18 PolarHBondContact O-N 2.96Å; P15-A19 PolarHBondContact O-N 3.14Å
16	D	86.4	Confident	82.7	Confident	68 Å²	68	83.7 Å²	83.7	36%	0.364	46%	0.463	S	S	.	.	H	α-helix	trans	-66.1	-42.6	173.9	-53.7	-35.4	0	0	0	111	V11 T12 S13 E14 K18 A19 H20	V11-D16 HydrophobicContact CB-CB 4.47Å; V11-D16 HydrophobicContact CG1-CB 3.3Å; T12-D16 PolarHBondContact OG1-OD2 2.92Å; S13-D16 WeakPolarHBondContact CB-OD2 3.49Å; S13-D16 PolarHBondContact N-OD2 2.93Å; S13-D16 PolarHBondContact O-N 2.94Å; S13-D16 PolarHBondContact OG-N 3.39Å; S13-D16 PolarHBondContact OG-OD1 3.43Å; S13-D16 PolarHBondContact OG-OD2 3.44Å; E14-D16 VanDerWaalsContact C-N 3.29Å; E14-D16 PolarHBondContact O-N 3.49Å; D16-K18 VanDerWaalsContact C-N 3.3Å; D16-K18 PolarHBondContact O-N 2.95Å; D16-A19 PolarHBondContact O-N 3.01Å; D16-H20 WeakPolarHBondContact O-CB 3.49Å; D16-H20 PolarHBondContact O-N 2.97Å
17	M	88.5	Confident	81.8	Confident	20 Å²	20	81.4 Å²	81.4	10%	0.099	46%	0.457	C	S	.	.	H	α-helix	trans	-60.6	-40	173.9	179.2	59.2	73.6	0	0	111.3	L2 S3 C4 V11 S13 E14 H20 L21	L2-M17 VanDerWaalsContact C-CE 3.49Å; L2-M17 HydrophobicContact CB-CE 3.61Å; L2-M17 HydrophobicContact CD1-CB 4.17Å; L2-M17 WeakPolarHBondContact O-CE 3.36Å; S3-M17 VanDerWaalsContact C-CE 3.46Å; C4-M17 HydrophobicContact CB-CE 4.17Å; C4-M17 HydrophobicContact CB-SD 4.1Å; V11-M17 HydrophobicContact CB-CE 4.19Å; V11-M17 HydrophobicContact CG2-CE 3.57Å; V11-M17 HydrophobicContact CG2-SD 4.16Å; S13-M17 PolarHBondContact O-N 3.43Å; E14-M17 WeakPolarHBondContact O-CB 3.32Å; E14-M17 PolarHBondContact O-N 2.9Å; M17-H20 PolarHBondContact O-N 3.27Å; M17-L21 HydrophobicContact CG-CD1 4.21Å; M17-L21 HydrophobicContact CG-CG 4.5Å; M17-L21 VanDerWaalsContact O-CG 3.31Å; M17-L21 WeakPolarHBondContact O-CG 3.45Å; M17-L21 PolarHBondContact O-N 3.35Å; M17-L21 HydrophobicContact SD-CD1 4.43Å; M17-L21 HydrophobicContact SD-CG 4.21Å
18	K	85.9	Confident	80.8	Confident	152 Å²	152	84.8 Å²	84.8	66%	0.661	47%	0.466	S	S	*	.	H	α-helix	trans	-63.8	-42	176	-172.4	174.8	-178.9	175.9	0	112.1	E14 P15 D16 L21 I22	E14-K18 PolarHBondContact O-N 3.33Å; P15-K18 PolarHBondContact O-N 2.96Å; D16-K18 VanDerWaalsContact C-N 3.3Å; D16-K18 PolarHBondContact O-N 2.95Å; K18-L21 PolarHBondContact O-N 2.91Å; K18-I22 WeakPolarHBondContact O-CG1 3.44Å; K18-I22 PolarHBondContact O-N 3.02Å
19	A	84.3	Confident	80.2	Confident	57 Å²	57	84.8 Å²	84.8	47%	0.471	45%	0.453	S	S	.	.	H	α-helix	trans	-65.5	-40.8	174.4	0	0	0	0	0	112	P15 D16 L21 I22	P15-A19 PolarHBondContact O-N 3.14Å; D16-A19 PolarHBondContact O-N 3.01Å; A19-L21 PolarHBondContact O-N 3.33Å; A19-I22 WeakPolarHBondContact O-CB 3.26Å; A19-I22 PolarHBondContact O-N 3.46Å
20	H	85.1	Confident	79.9	Confident	26 Å²	26	84.3 Å²	84.3	12%	0.12	45%	0.453	C	S	.	.	H	α-helix	trans	-61.8	-40.3	175	172.5	94.6	0	0	0	112.4	C4 C7 E9 V11 D16 M17 I22 V23 H24	C4-H20 VanDerWaalsContact CB-NE2 3.26Å; C4-H20 WeakPolarHBondContact CB-NE2 3.44Å; C4-H20 PolarHBondContact SG-NE2 2.68Å; C7-H20 PolarHBondContact SG-CE1 3.34Å; C7-H20 PolarHBondContact SG-NE2 3.33Å; E9-H20 IonicContact OE2-CE1 3.79Å; E9-H20 PolarHBondContact OE2-CE1 2.61Å; E9-H20 IonicContact OE2-ND1 2.86Å; E9-H20 PolarHBondContact OE2-ND1 3.33Å; V11-H20 HydrophobicContact CG2-CB 4.42Å; D16-H20 WeakPolarHBondContact O-CB 3.49Å; D16-H20 PolarHBondContact O-N 2.97Å; M17-H20 PolarHBondContact O-N 3.27Å; H20-I22 VanDerWaalsContact C-N 3.3Å; H20-I22 PolarHBondContact O-N 3.23Å; H20-V23 WeakPolarHBondContact O-CB 3.45Å; H20-V23 PolarHBondContact O-N 3.15Å; H20-H24 AromaticContact CD2-CD2 3.8Å; H20-H24 AromaticContact CD2-NE2 3.68Å; H20-H24 AromaticContact CE1-NE2 3.55Å; H20-H24 AromaticContact NE2-CD2 3.57Å; H20-H24 AromaticContact NE2-NE2 2.96Å; H20-H24 PolarHBondContact NE2-NE2 3.01Å; H20-H24 PolarHBondContact O-CD2 3.29Å
21	L	81.4	Confident	79.7	Confident	67 Å²	67	79.9 Å²	79.9	35%	0.351	43%	0.426	S	S	.	.	H	α-helix	trans	-66.8	-27.9	177	-71.5	171.7	0	0	0	113.4	I6 M17 K18 A19 V23 H24 M25	I6-L21 HydrophobicContact CD1-CD2 3.91Å; M17-L21 HydrophobicContact CG-CD1 4.21Å; M17-L21 HydrophobicContact CG-CG 4.5Å; M17-L21 VanDerWaalsContact O-CG 3.31Å; M17-L21 WeakPolarHBondContact O-CG 3.45Å; M17-L21 PolarHBondContact O-N 3.35Å; M17-L21 HydrophobicContact SD-CD1 4.43Å; M17-L21 HydrophobicContact SD-CG 4.21Å; K18-L21 PolarHBondContact O-N 2.91Å; A19-L21 PolarHBondContact O-N 3.33Å; L21-V23 VanDerWaalsContact C-N 3.27Å; L21-V23 PolarHBondContact O-N 3.45Å; L21-H24 PolarHBondContact O-N 3.47Å; L21-H24 VanDerWaalsContact O-N 3.16Å; L21-M25 WeakPolarHBondContact O-CG 3.45Å; L21-M25 PolarHBondContact O-N 3.4Å; L21-M25 VanDerWaalsContact O-N 3.13Å
22	I	80.6	Confident	79.4	Confident	74 Å²	74	83.6 Å²	83.6	38%	0.379	45%	0.451	S	S	.	.	H	α-helix	trans	-62.8	-36.5	173.4	-66.8	166.3	0	0	0	110.6	K18 A19 H20 H24 M25 E26	K18-I22 WeakPolarHBondContact O-CG1 3.44Å; K18-I22 PolarHBondContact O-N 3.02Å; A19-I22 WeakPolarHBondContact O-CB 3.26Å; A19-I22 PolarHBondContact O-N 3.46Å; H20-I22 VanDerWaalsContact C-N 3.3Å; H20-I22 PolarHBondContact O-N 3.23Å; I22-H24 VanDerWaalsContact C-N 3.25Å; I22-H24 PolarHBondContact O-N 3.47Å; I22-M25 CarbonylContact O-C 3.54Å; I22-M25 WeakPolarHBondContact O-CA 3.32Å; I22-M25 WeakPolarHBondContact O-CB 3.49Å; I22-M25 PolarHBondContact O-N 3.23Å; I22-E26 HydrophobicContact CG2-CG 4.09Å; I22-E26 WeakPolarHBondContact CG2-OE1 3.32Å; I22-E26 WeakPolarHBondContact O-CB 3.29Å; I22-E26 WeakPolarHBondContact O-CG 3.34Å; I22-E26 PolarHBondContact O-N 3.15Å
23	V	74.7	Confident	79.2	Confident	86 Å²	86	81.9 Å²	81.9	52%	0.521	43%	0.434	S	S	.	.	H	α-helix	trans	-63.4	-31.6	176.2	-174.5	0	0	0	0	112	H20 L21 S27	H20-V23 WeakPolarHBondContact O-CB 3.45Å; H20-V23 PolarHBondContact O-N 3.15Å; L21-V23 VanDerWaalsContact C-N 3.27Å; L21-V23 PolarHBondContact O-N 3.45Å; V23-S27 PolarHBondContact O-N 2.92Å; V23-S27 PolarHBondContact O-OG 3.4Å
24	H	71.9	Confident	78.9	Confident	50 Å²	50	82.5 Å²	82.5	23%	0.231	44%	0.437	C	S	.	.	H	α-helix	trans	-75.4	-27.5	172.3	-66.5	-71.9	0	0	0	112.9	I6 H20 L21 I22	I6-H24 HydrophobicContact CD1-CB 3.64Å; I6-H24 WeakPolarHBondContact CG2-ND1 3.28Å; H20-H24 AromaticContact CD2-CD2 3.8Å; H20-H24 AromaticContact CD2-NE2 3.68Å; H20-H24 AromaticContact CE1-NE2 3.55Å; H20-H24 AromaticContact NE2-CD2 3.57Å; H20-H24 AromaticContact NE2-NE2 2.96Å; H20-H24 PolarHBondContact NE2-NE2 3.01Å; H20-H24 PolarHBondContact O-CD2 3.29Å; L21-H24 PolarHBondContact O-N 3.47Å; L21-H24 VanDerWaalsContact O-N 3.16Å; I22-H24 VanDerWaalsContact C-N 3.25Å; I22-H24 PolarHBondContact O-N 3.47Å
25	M	68.5	Low	78.7	Confident	150 Å²	150	84.6 Å²	84.6	74%	0.739	44%	0.444	S	S	*	.	H	α-helix	trans	-77.7	-29.2	172.9	-64	174.5	64.6	0	0	112.6	L21 I22	L21-M25 WeakPolarHBondContact O-CG 3.45Å; L21-M25 PolarHBondContact O-N 3.4Å; L21-M25 VanDerWaalsContact O-N 3.13Å; I22-M25 CarbonylContact O-C 3.54Å; I22-M25 WeakPolarHBondContact O-CA 3.32Å; I22-M25 WeakPolarHBondContact O-CB 3.49Å; I22-M25 PolarHBondContact O-N 3.23Å
26	E	62.3	Low	78.3	Confident	148 Å²	148	83.2 Å²	83.2	69%	0.692	43%	0.431	S	S	*	.	S	Bend	trans	-87.7	-8	174.5	-68.5	176.7	173.3	0	0	112.7	I22 E28	I22-E26 HydrophobicContact CG2-CG 4.09Å; I22-E26 WeakPolarHBondContact CG2-OE1 3.32Å; I22-E26 WeakPolarHBondContact O-CB 3.29Å; I22-E26 WeakPolarHBondContact O-CG 3.34Å; I22-E26 PolarHBondContact O-N 3.15Å; E26-E28 PolarHBondContact O-N 2.97Å
27	S	64.1	Low	78.1	Confident	63 Å²	63	82.6 Å²	82.6	44%	0.441	43%	0.432	S	S	.	.	S	Bend	trans	-66.1	124.2	171.8	-69.7	0	0	0	0	109.2	V23 I29	V23-S27 PolarHBondContact O-N 2.92Å; V23-S27 PolarHBondContact O-OG 3.4Å; S27-I29 PolarHBondContact O-N 2.91Å; S27-I29 VanDerWaalsContact O-N 3.07Å
28	E	62.1	Low	77.2	Confident	138 Å²	138	84.2 Å²	84.2	65%	0.645	46%	0.455	S	S	*	.			trans	-47.4	114.7	-170.1	-65.2	174.9	-175.3	0	0	112.1	E26 I30	E26-E28 PolarHBondContact O-N 2.97Å; E28-I30 WeakPolarHBondContact O-CG1 3.39Å; E28-I30 PolarHBondContact O-N 3.42Å; E28-I30 VanDerWaalsContact O-N 3.13Å
29	I	70.9	Confident	76.6	Confident	53 Å²	53	79 Å²	79	27%	0.272	44%	0.435	S	S	.	.	B	Isolated β-bridge	trans	-69.1	114.7	176.6	-57.7	173.7	0	0	0	107.1	S27 S37 Y41 M44	S27-I29 PolarHBondContact O-N 2.91Å; S27-I29 VanDerWaalsContact O-N 3.07Å; I29-S37 WeakPolarHBondContact O-CA 3.46Å; I29-Y41 HydrophobicContact CD1-CD2 4.35Å; I29-M44 HydrophobicContact CG2-CB 4Å; I29-M44 HydrophobicContact CG2-CE 4.08Å; I29-M44 HydrophobicContact CG2-CG 3.77Å; I29-M44 WeakPolarHBondContact O-CE 3.36Å
30	I	81	Confident	76.3	Confident	106 Å²	106	80.6 Å²	80.6	54%	0.544	44%	0.436	S	S	.	.			trans	-99	133.7	179.2	-46.4	-173.5	0	0	0	108.8	E28 L36	E28-I30 WeakPolarHBondContact O-CG1 3.39Å; E28-I30 PolarHBondContact O-N 3.42Å; E28-I30 VanDerWaalsContact O-N 3.13Å; I30-L36 WeakPolarHBondContact CA-O 3.3Å
31	C	84.9	Confident	76.2	Confident	3 Å²	3	86.3 Å²	86.3	2%	0.02	46%	0.457	C	S	.	.			trans	-63.9	124.7	174.6	-176.9	0	0	0	0	109.6	F33 C34 L36 M44 H47	C31-F33 PolarHBondContact O-N 2.95Å; C31-F33 VanDerWaalsContact O-N 3.16Å; C31-C34 PolarHBondContact O-N 2.92Å; C31-L36 HydrophobicContact CB-CB 4.34Å; C31-L36 PolarHBondContact N-O 2.59Å; C31-M44 VanDerWaalsContact CA-SD 3.53Å; C31-M44 HydrophobicContact CB-CE 3.88Å; C31-M44 HydrophobicContact CB-SD 3.5Å; C31-M44 WeakPolarHBondContact CB-SD 3.34Å; C31-H47 VanDerWaalsContact SG-CD2 3.57Å; C31-H47 PolarHBondContact SG-NE2 3.44Å
32	P	80.3	Confident	76.2	Confident	100 Å²	100	88.5 Å²	88.5	65%	0.649	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-15.8	179.5	27.1	-33.8	0	0	0	113
33	F	83.8	Confident	76.4	Confident	74 Å²	74	90.4 Å²	90.4	33%	0.325	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-8.3	-177.2	-49.6	-64.8	0	0	0	113.9	C31 I48 H52 Q55	C31-F33 PolarHBondContact O-N 2.95Å; C31-F33 VanDerWaalsContact O-N 3.16Å; F33-I48 HydrophobicContact CD2-CG1 4.26Å; F33-I48 HydrophobicContact CD2-CG2 4.11Å; F33-I48 HydrophobicContact CE2-CG1 4.42Å; F33-I48 HydrophobicContact CE2-CG2 3.74Å; F33-H52 HydrophobicContact CB-CB 4.39Å; F33-H52 VanDerWaalsContact CB-CE1 3.49Å; F33-H52 WeakPolarHBondContact CB-CE1 3.46Å; F33-H52 WeakPolarHBondContact CB-ND1 3.42Å; F33-H52 HydrophobicContact CD2-CB 3.91Å; F33-H52 AromaticContact CD2-CG 3.89Å; F33-H52 HydrophobicContact CG-CB 4.28Å; F33-Q55 HydrophobicContact CD1-CG 4.03Å; F33-Q55 HydrophobicContact CE1-CB 4.41Å; F33-Q55 HydrophobicContact CE1-CG 3.71Å; F33-Q55 HydrophobicContact CZ-CG 4.32Å
34	C	84.9	Confident	77	Confident	51 Å²	51	86.6 Å²	86.6	35%	0.345	45%	0.453	S	S	.	.	S	Bend	trans	-150.8	-155.7	177.2	82.1	0	0	0	0	112.5	C31 L36 H47	C31-C34 PolarHBondContact O-N 2.92Å; C34-L36 VanDerWaalsContact SG-CB 3.53Å; C34-L36 PolarHBondContact SG-N 3.04Å; C34-H47 PolarHBondContact SG-NE2 2.94Å
35	K	82.8	Confident	77.6	Confident	197 Å²	197	86.2 Å²	86.2	86%	0.857	46%	0.456	S	S	*	.	S	Bend	trans	-112.2	10.8	179.7	-62.1	-174.9	-179.8	-179	0	113.7	S37	K35-S37 PolarHBondContact O-N 3.24Å; K35-S37 PolarHBondContact O-OG 2.86Å
36	L	80.6	Confident	78.5	Confident	64 Å²	64	85.5 Å²	85.5	34%	0.335	45%	0.449	S	S	.	.			trans	-68.8	129.5	175.7	-169.6	141.5	0	0	0	109.1	I30 C31 C34 V39 M44	I30-L36 WeakPolarHBondContact CA-O 3.3Å; C31-L36 HydrophobicContact CB-CB 4.34Å; C31-L36 PolarHBondContact N-O 2.59Å; C34-L36 VanDerWaalsContact SG-CB 3.53Å; C34-L36 PolarHBondContact SG-N 3.04Å; L36-V39 HydrophobicContact CD2-CB 4.39Å; L36-V39 HydrophobicContact CD2-CG1 3.92Å; L36-V39 HydrophobicContact CD2-CG2 3.53Å; L36-M44 HydrophobicContact CD2-CE 3.77Å; L36-M44 HydrophobicContact CD2-SD 4.34Å
37	S	82.4	Confident	79.8	Confident	55 Å²	55	79.9 Å²	79.9	39%	0.385	42%	0.423	S	S	.	.			trans	-151.4	161.1	-172.1	40.9	0	0	0	0	109.7	I29 K35	I29-S37 WeakPolarHBondContact O-CA 3.46Å; K35-S37 PolarHBondContact O-N 3.24Å; K35-S37 PolarHBondContact O-OG 2.86Å
38	G	69	Low	80.9	Confident	55 Å²	55	78 Å²	78	57%	0.567	41%	0.408	S	S	*	.	S	Bend	trans	75.8	22.5	177.8	0	0	0	0	0	115.3
39	V	72.8	Confident	82.1	Confident	42 Å²	42	75.1 Å²	75.1	26%	0.255	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-108.7	159.3	171.1	-60	0	0	0	0	110.5	L36 E43 M44	L36-V39 HydrophobicContact CD2-CB 4.39Å; L36-V39 HydrophobicContact CD2-CG1 3.92Å; L36-V39 HydrophobicContact CD2-CG2 3.53Å; V39-E43 HydrophobicContact CB-CB 3.96Å; V39-E43 HydrophobicContact CG2-CB 4.28Å; V39-M44 HydrophobicContact CG2-CB 4.06Å; V39-M44 HydrophobicContact CG2-CE 3.69Å
40	N	79.1	Confident	82.8	Confident	90 Å²	90	76.7 Å²	76.7	48%	0.481	41%	0.406	S	S	.	.			trans	-69.8	162.9	176.9	-175.7	36.4	0	0	0	111.7	D42 E43 M44	N40-D42 VanDerWaalsContact C-N 3.34Å; N40-D42 PolarHBondContact ND2-OD2 2.73Å; N40-D42 PolarHBondContact O-N 2.97Å; N40-E43 HydrophobicContact CB-CG 4.37Å; N40-E43 PolarHBondContact N-OE2 3.01Å; N40-E43 WeakPolarHBondContact O-CB 3.5Å; N40-E43 PolarHBondContact O-N 2.89Å; N40-E43 VanDerWaalsContact O-N 3.12Å; N40-M44 PolarHBondContact O-N 2.86Å
41	Y	82.4	Confident	82.9	Confident	146 Å²	146	74.5 Å²	74.5	57%	0.573	40%	0.404	S	S	*	.	H	α-helix	trans	-52.9	-47.9	179.7	179.7	-94.3	0	0	0	112.6	I29 E43 M44 C45	I29-Y41 HydrophobicContact CD1-CD2 4.35Å; Y41-E43 VanDerWaalsContact C-N 3.3Å; Y41-E43 PolarHBondContact O-N 3.15Å; Y41-M44 WeakPolarHBondContact O-CB 3.44Å; Y41-M44 PolarHBondContact O-N 2.81Å; Y41-M44 VanDerWaalsContact O-N 3.17Å; Y41-C45 WeakPolarHBondContact CE1-SG 3.33Å; Y41-C45 VanDerWaalsContact CZ-SG 3.53Å; Y41-C45 PolarHBondContact O-N 2.63Å; Y41-C45 PolarHBondContact O-SG 3.46Å
42	D	81.4	Confident	83	Confident	113 Å²	113	76.2 Å²	76.2	60%	0.604	41%	0.411	S	S	*	.	H	α-helix	trans	-64.1	-36.1	-179.2	-53.4	-52	0	0	0	112.4	N40 F46	N40-D42 VanDerWaalsContact C-N 3.34Å; N40-D42 PolarHBondContact ND2-OD2 2.73Å; N40-D42 PolarHBondContact O-N 2.97Å; D42-F46 WeakPolarHBondContact O-CB 3.43Å; D42-F46 PolarHBondContact O-N 3.34Å
43	E	84	Confident	82.5	Confident	115 Å²	115	78.5 Å²	78.5	54%	0.537	41%	0.411	S	S	.	.	H	α-helix	trans	-72.1	-35.5	176.6	-62	176.9	138.1	0	0	111.2	V39 N40 Y41 H47	V39-E43 HydrophobicContact CB-CB 3.96Å; V39-E43 HydrophobicContact CG2-CB 4.28Å; N40-E43 HydrophobicContact CB-CG 4.37Å; N40-E43 PolarHBondContact N-OE2 3.01Å; N40-E43 WeakPolarHBondContact O-CB 3.5Å; N40-E43 PolarHBondContact O-N 2.89Å; N40-E43 VanDerWaalsContact O-N 3.12Å; Y41-E43 VanDerWaalsContact C-N 3.3Å; Y41-E43 PolarHBondContact O-N 3.15Å; E43-H47 VanDerWaalsContact O-CB 3.32Å; E43-H47 WeakPolarHBondContact O-CB 3.39Å; E43-H47 PolarHBondContact O-N 3.2Å
44	M	86.9	Confident	81.4	Confident	5 Å²	5	83 Å²	83	3%	0.025	43%	0.433	C	S	.	.	H	α-helix	trans	-66.1	-45.9	172.1	-175.9	58.2	71.6	0	0	111.5	I29 C31 L36 V39 N40 Y41 F46 H47 I48	I29-M44 HydrophobicContact CG2-CB 4Å; I29-M44 HydrophobicContact CG2-CE 4.08Å; I29-M44 HydrophobicContact CG2-CG 3.77Å; I29-M44 WeakPolarHBondContact O-CE 3.36Å; C31-M44 VanDerWaalsContact CA-SD 3.53Å; C31-M44 HydrophobicContact CB-CE 3.88Å; C31-M44 HydrophobicContact CB-SD 3.5Å; C31-M44 WeakPolarHBondContact CB-SD 3.34Å; L36-M44 HydrophobicContact CD2-CE 3.77Å; L36-M44 HydrophobicContact CD2-SD 4.34Å; V39-M44 HydrophobicContact CG2-CB 4.06Å; V39-M44 HydrophobicContact CG2-CE 3.69Å; N40-M44 PolarHBondContact O-N 2.86Å; Y41-M44 WeakPolarHBondContact O-CB 3.44Å; Y41-M44 PolarHBondContact O-N 2.81Å; Y41-M44 VanDerWaalsContact O-N 3.17Å; M44-F46 VanDerWaalsContact C-N 3.34Å; M44-F46 PolarHBondContact O-N 3.31Å; M44-H47 WeakPolarHBondContact O-CB 3.39Å; M44-H47 PolarHBondContact O-N 3.35Å; M44-I48 HydrophobicContact CG-CD1 3.88Å; M44-I48 HydrophobicContact CG-CG1 4.44Å; M44-I48 WeakPolarHBondContact O-CG1 3.34Å; M44-I48 PolarHBondContact O-N 3.01Å; M44-I48 HydrophobicContact SD-CD1 4.16Å; M44-I48 HydrophobicContact SD-CG1 4.24Å
45	C	85	Confident	80	Confident	42 Å²	42	86.6 Å²	86.6	28%	0.284	45%	0.445	S	S	.	.	H	α-helix	trans	-58.6	-46.3	175.3	-72.4	0	0	0	0	111.2	Y41 H47 I48 E49	Y41-C45 WeakPolarHBondContact CE1-SG 3.33Å; Y41-C45 VanDerWaalsContact CZ-SG 3.53Å; Y41-C45 PolarHBondContact O-N 2.63Å; Y41-C45 PolarHBondContact O-SG 3.46Å; C45-H47 PolarHBondContact O-N 3.46Å; C45-I48 PolarHBondContact O-N 2.9Å; C45-E49 WeakPolarHBondContact O-CB 3.47Å; C45-E49 WeakPolarHBondContact O-CG 3.19Å; C45-E49 PolarHBondContact O-N 3.15Å
46	F	87.1	Confident	78.6	Confident	135 Å²	135	78.6 Å²	78.6	59%	0.592	41%	0.412	S	S	*	.	H	α-helix	trans	-61.7	-41.2	174.9	-179.5	-98.8	0	0	0	112.5	D42 M44 E49 T50	D42-F46 WeakPolarHBondContact O-CB 3.43Å; D42-F46 PolarHBondContact O-N 3.34Å; M44-F46 VanDerWaalsContact C-N 3.34Å; M44-F46 PolarHBondContact O-N 3.31Å; F46-E49 PolarHBondContact O-N 2.93Å; F46-T50 HydrophobicContact CD1-CG2 4.4Å; F46-T50 HydrophobicContact CD2-CG2 4.15Å; F46-T50 HydrophobicContact CE1-CG2 3.99Å; F46-T50 HydrophobicContact CE2-CG2 3.73Å; F46-T50 HydrophobicContact CG-CG2 4.48Å; F46-T50 HydrophobicContact CZ-CG2 3.65Å; F46-T50 WeakPolarHBondContact O-CB 3.4Å; F46-T50 WeakPolarHBondContact O-CG2 3.32Å; F46-T50 PolarHBondContact O-N 3.18Å; F46-T50 PolarHBondContact O-OG1 3.48Å
47	H	89.6	Confident	77.4	Confident	31 Å²	31	79.2 Å²	79.2	14%	0.144	42%	0.418	C	S	.	.	H	α-helix	trans	-60.4	-44.8	173.8	166.4	62.4	0	0	0	112	C31 C34 E43 M44 C45 T50 A51 H52	C31-H47 VanDerWaalsContact SG-CD2 3.57Å; C31-H47 PolarHBondContact SG-NE2 3.44Å; C34-H47 PolarHBondContact SG-NE2 2.94Å; E43-H47 VanDerWaalsContact O-CB 3.32Å; E43-H47 WeakPolarHBondContact O-CB 3.39Å; E43-H47 PolarHBondContact O-N 3.2Å; M44-H47 WeakPolarHBondContact O-CB 3.39Å; M44-H47 PolarHBondContact O-N 3.35Å; C45-H47 PolarHBondContact O-N 3.46Å; H47-T50 PolarHBondContact O-N 2.88Å; H47-T50 PolarHBondContact O-OG1 3.39Å; H47-A51 WeakPolarHBondContact O-CB 3.4Å; H47-A51 PolarHBondContact O-N 3.4Å; H47-H52 AromaticContact CE1-NE2 3.81Å; H47-H52 AromaticContact NE2-CD2 3.77Å; H47-H52 AromaticContact NE2-NE2 3.5Å
48	I	87.2	Confident	76	Confident	24 Å²	24	82.7 Å²	82.7	12%	0.123	43%	0.432	C	S	.	.	H	α-helix	trans	-66.1	-45.4	177.8	-66.5	167.1	0	0	0	110.8	F33 M44 C45 T50 H52 N56	F33-I48 HydrophobicContact CD2-CG1 4.26Å; F33-I48 HydrophobicContact CD2-CG2 4.11Å; F33-I48 HydrophobicContact CE2-CG1 4.42Å; F33-I48 HydrophobicContact CE2-CG2 3.74Å; M44-I48 HydrophobicContact CG-CD1 3.88Å; M44-I48 HydrophobicContact CG-CG1 4.44Å; M44-I48 WeakPolarHBondContact O-CG1 3.34Å; M44-I48 PolarHBondContact O-N 3.01Å; M44-I48 HydrophobicContact SD-CD1 4.16Å; M44-I48 HydrophobicContact SD-CG1 4.24Å; C45-I48 PolarHBondContact O-N 2.9Å; I48-T50 VanDerWaalsContact C-N 3.29Å; I48-T50 PolarHBondContact O-N 3.48Å; I48-H52 HydrophobicContact CG2-CB 4.39Å; I48-H52 CarbonylContact O-C 3.29Å; I48-H52 VanDerWaalsContact O-C 3.29Å; I48-H52 VanDerWaalsContact O-CA 3.32Å; I48-H52 WeakPolarHBondContact O-CA 3.37Å; I48-H52 WeakPolarHBondContact O-CB 3.32Å; I48-H52 PolarHBondContact O-N 3.39Å; I48-N56 HydrophobicContact CG2-CB 4.46Å
49	E	87.1	Confident	75.2	Confident	77 Å²	77	85.8 Å²	85.8	36%	0.36	43%	0.432	S	S	.	.	H	α-helix	trans	-63.2	-31	177.1	-74.1	-166.5	140.7	0	0	113.1	C45 F46 F53 R60	C45-E49 WeakPolarHBondContact O-CB 3.47Å; C45-E49 WeakPolarHBondContact O-CG 3.19Å; C45-E49 PolarHBondContact O-N 3.15Å; F46-E49 PolarHBondContact O-N 2.93Å; E49-F53 WeakPolarHBondContact O-CB 3.23Å; E49-F53 WeakPolarHBondContact O-CD2 3.49Å; E49-R60 IonicContact OE1-CZ 3.9Å; E49-R60 IonicContact OE1-NH1 2.63Å; E49-R60 PolarHBondContact OE1-NH1 3.33Å; E49-R60 IonicContact OE1-NH2 3.83Å; E49-R60 PolarHBondContact OE1-NH2 2.87Å
50	T	85.7	Confident	74.2	Confident	85 Å²	85	89.8 Å²	89.8	52%	0.521	44%	0.442	S	S	.	.	H	α-helix	trans	-96.5	-34.3	-177.2	54.5	0	0	0	0	114.9	F46 H47 I48	F46-T50 HydrophobicContact CD1-CG2 4.4Å; F46-T50 HydrophobicContact CD2-CG2 4.15Å; F46-T50 HydrophobicContact CE1-CG2 3.99Å; F46-T50 HydrophobicContact CE2-CG2 3.73Å; F46-T50 HydrophobicContact CG-CG2 4.48Å; F46-T50 HydrophobicContact CZ-CG2 3.65Å; F46-T50 WeakPolarHBondContact O-CB 3.4Å; F46-T50 WeakPolarHBondContact O-CG2 3.32Å; F46-T50 PolarHBondContact O-N 3.18Å; F46-T50 PolarHBondContact O-OG1 3.48Å; H47-T50 PolarHBondContact O-N 2.88Å; H47-T50 PolarHBondContact O-OG1 3.39Å; I48-T50 VanDerWaalsContact C-N 3.29Å; I48-T50 PolarHBondContact O-N 3.48Å
51	A	83.5	Confident	72.6	Confident	60 Å²	60	90.2 Å²	90.2	50%	0.496	45%	0.445	S	S	.	.	H	α-helix	trans	-99.8	-20.7	-177.5	0	0	0	0	0	113.7	H47	H47-A51 WeakPolarHBondContact O-CB 3.4Å; H47-A51 PolarHBondContact O-N 3.4Å
52	H	87.2	Confident	70.8	Confident	40 Å²	40	90.6 Å²	90.6	19%	0.185	45%	0.449	C	S	.	.	S	Bend	trans	-127.2	27.7	-175.5	-58.4	-65.7	0	0	0	112.3	F33 H47 I48 E54 Q55 N56	F33-H52 HydrophobicContact CB-CB 4.39Å; F33-H52 VanDerWaalsContact CB-CE1 3.49Å; F33-H52 WeakPolarHBondContact CB-CE1 3.46Å; F33-H52 WeakPolarHBondContact CB-ND1 3.42Å; F33-H52 HydrophobicContact CD2-CB 3.91Å; F33-H52 AromaticContact CD2-CG 3.89Å; F33-H52 HydrophobicContact CG-CB 4.28Å; H47-H52 AromaticContact CE1-NE2 3.81Å; H47-H52 AromaticContact NE2-CD2 3.77Å; H47-H52 AromaticContact NE2-NE2 3.5Å; I48-H52 HydrophobicContact CG2-CB 4.39Å; I48-H52 CarbonylContact O-C 3.29Å; I48-H52 VanDerWaalsContact O-C 3.29Å; I48-H52 VanDerWaalsContact O-CA 3.32Å; I48-H52 WeakPolarHBondContact O-CA 3.37Å; I48-H52 WeakPolarHBondContact O-CB 3.32Å; I48-H52 PolarHBondContact O-N 3.39Å; H52-E54 VanDerWaalsContact C-N 3.29Å; H52-E54 PolarHBondContact O-N 3Å; H52-E54 VanDerWaalsContact O-N 3.15Å; H52-Q55 PolarHBondContact O-N 2.79Å; H52-N56 PolarHBondContact O-N 2.92Å
53	F	70.9	Confident	69.2	Low	148 Å²	148	92.3 Å²	92.3	65%	0.649	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	-41.7	-173.3	-175.3	-103.7	0	0	0	114.3	E49	E49-F53 WeakPolarHBondContact O-CB 3.23Å; E49-F53 WeakPolarHBondContact O-CD2 3.49Å
54	E	60.1	Low	67.4	Low	167 Å²	167	95.7 Å²	95.7	78%	0.78	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-35.7	-178.6	-63.4	-177.3	160.5	0	0	112.2	H52 T57	H52-E54 VanDerWaalsContact C-N 3.29Å; H52-E54 PolarHBondContact O-N 3Å; H52-E54 VanDerWaalsContact O-N 3.15Å; E54-T57 PolarHBondContact O-N 3.32Å; E54-T57 PolarHBondContact O-OG1 2.88Å
55	Q	56.5	Low	65.4	Low	128 Å²	128	101.9 Å²	101.9	60%	0.598	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-36.2	179.4	-148.7	79.5	14.6	0	0	112.2	F33 H52 T57 L58	F33-Q55 HydrophobicContact CD1-CG 4.03Å; F33-Q55 HydrophobicContact CE1-CB 4.41Å; F33-Q55 HydrophobicContact CE1-CG 3.71Å; F33-Q55 HydrophobicContact CZ-CG 4.32Å; H52-Q55 PolarHBondContact O-N 2.79Å; Q55-T57 PolarHBondContact O-N 3.01Å; Q55-L58 PolarHBondContact O-N 3.21Å
56	N	53.3	Low	63.4	Low	28 Å²	28	106.8 Å²	106.8	15%	0.15	52%	0.517	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-9.6	-179.1	-163.5	-10.1	0	0	0	112.9	I48 H52 L58 R60	I48-N56 HydrophobicContact CG2-CB 4.46Å; H52-N56 PolarHBondContact O-N 2.92Å; N56-L58 PolarHBondContact O-N 3.33Å; N56-R60 PolarHBondContact O-N 2.93Å
57	T	54.5	Low	61.5	Low	77 Å²	77	106 Å²	106	47%	0.472	52%	0.523	S	S	.	.	H	α-helix	trans	-65.2	-26.4	174.3	63.3	0	0	0	0	112.9	E54 Q55 N61	E54-T57 PolarHBondContact O-N 3.32Å; E54-T57 PolarHBondContact O-OG1 2.88Å; Q55-T57 PolarHBondContact O-N 3.01Å; T57-N61 PolarHBondContact O-ND2 3.05Å
58	L	52.5	Low	59.1	Low	128 Å²	128	109.7 Å²	109.7	67%	0.67	55%	0.548	S	S	*	.	H	α-helix	trans	-69.5	-46.6	178.9	-161.6	83.8	0	0	0	111.8	Q55 N56 F62	Q55-L58 PolarHBondContact O-N 3.21Å; N56-L58 PolarHBondContact O-N 3.33Å; L58-F62 WeakPolarHBondContact O-CD2 3.42Å
59	E	53	Low	57	Low	121 Å²	121	117.1 Å²	117.1	57%	0.565	58%	0.582	S	S	*	*	H	α-helix	trans	-72.7	-42.3	-176.4	-65.8	-176.2	146.4	0	0	112	N61 F62	E59-N61 PolarHBondContact O-N 3.47Å; E59-N61 VanDerWaalsContact O-N 3.08Å; E59-F62 PolarHBondContact O-N 3.42Å
60	R	51.7	Low	54.3	Low	125 Å²	125	125.4 Å²	125.4	47%	0.472	61%	0.612	S	S	.	*	H	α-helix	trans	-65.3	-16.6	-177.3	-151.4	176.9	-156.1	131.9	6.9	114.4	E49 N56	E49-R60 IonicContact OE1-CZ 3.9Å; E49-R60 IonicContact OE1-NH1 2.63Å; E49-R60 PolarHBondContact OE1-NH1 3.33Å; E49-R60 IonicContact OE1-NH2 3.83Å; E49-R60 PolarHBondContact OE1-NH2 2.87Å; N56-R60 PolarHBondContact O-N 2.93Å
61	N	44.3	Very low	51.9	Low	100 Å²	100	125 Å²	125	54%	0.535	62%	0.624	S	S	.	*	H	α-helix	trans	-76.9	-22.2	174.4	-82.6	-53.9	0	0	0	113.3	T57 E59 I65	T57-N61 PolarHBondContact O-ND2 3.05Å; E59-N61 PolarHBondContact O-N 3.47Å; E59-N61 VanDerWaalsContact O-N 3.08Å; N61-I65 WeakPolarHBondContact O-CD1 3.37Å; N61-I65 WeakPolarHBondContact O-CG1 3.49Å
62	F	45.8	Very low	49.5	Very low	154 Å²	154	128.7 Å²	128.7	68%	0.675	64%	0.641	S	S	*	*	H	α-helix	trans	-76	-37.1	175.9	-74.5	-83.1	0	0	0	112.7	L58 E59	L58-F62 WeakPolarHBondContact O-CD2 3.42Å; E59-F62 PolarHBondContact O-N 3.42Å
63	E	47.7	Very low	47.2	Very low	149 Å²	149	131 Å²	131	70%	0.696	66%	0.661	S	S	*	*	H	α-helix	trans	-75.4	-32.2	-179.2	-63.1	-171.6	146.1	0	0	113.3	I65	E63-I65 VanDerWaalsContact C-N 3.3Å; E63-I65 PolarHBondContact O-N 3.28Å
64	R	45	Very low	45.5	Very low	186 Å²	186	131 Å²	131	70%	0.702	67%	0.668	S	S	*	*	H	α-helix	trans	-70.3	-22.4	-173.8	-176.4	171.1	-79.1	-173.6	-3.2	113.9	N66	R64-N66 VanDerWaalsContact C-N 3.32Å; R64-N66 PolarHBondContact O-N 2.84Å
65	I	46.2	Very low	44.4	Very low	135 Å²	135	130.5 Å²	130.5	69%	0.692	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-25.3	-176	-61.6	169.8	0	0	0	111.9	N61 E63 T67	N61-I65 WeakPolarHBondContact O-CD1 3.37Å; N61-I65 WeakPolarHBondContact O-CG1 3.49Å; E63-I65 VanDerWaalsContact C-N 3.3Å; E63-I65 PolarHBondContact O-N 3.28Å; I65-T67 PolarHBondContact O-N 3.17Å
66	N	43.3	Very low	43.5	Very low	145 Å²	145	133.1 Å²	133.1	78%	0.775	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	0.1	-175.4	-76.4	-28.7	0	0	0	115.5	R64	R64-N66 VanDerWaalsContact C-N 3.32Å; R64-N66 PolarHBondContact O-N 2.84Å
67	T	45.9	Very low	43	Very low	117 Å²	117	140.1 Å²	140.1	72%	0.718	71%	0.709	S	S	*	*			trans	-119.7	48.3	-167.5	-34	0	0	0	0	114	I65	I65-T67 PolarHBondContact O-N 3.17Å
68	V	40.6	Very low	42	Very low	110 Å²	110	142.7 Å²	142.7	67%	0.667	72%	0.72	S	S	*	*			trans	-137.8	128.4	172.1	176.7	0	0	0	0	112
69	Q	41.8	Very low	41	Very low	180 Å²	180	144.5 Å²	144.5	84%	0.841	73%	0.731	S	S	*	*			trans	77.3	77.7	165.1	-73.3	168.4	64.3	0	0	119.8
70	Y	31.3	Very low	40.4	Very low	250 Å²	250	144.7 Å²	144.7	98%	0.98	74%	0.74	S	S	*	*				-134.6	128	121.9	-113.7	-89.9	0	0	0	108.8
71	G	33.9	Very low	39.8	Very low	77 Å²	77	146.6 Å²	146.6	79%	0.794	76%	0.759	S	S	*	*			trans	157.9	82.6	-177.4	0	0	0	0	0	114.2
72	T	35	Very low	39.3	Very low	137 Å²	137	150.2 Å²	150.2	84%	0.84	77%	0.773	S	S	*	*			trans	-86.8	127.4	176.3	-58.4	0	0	0	0	111.4
73	S	38	Very low	38.7	Very low	88 Å²	88	148.2 Å²	148.2	62%	0.615	78%	0.776	S	S	*	*			trans	43	122.2	152.1	-144.8	0	0	0	0	120.4
74	D	34.4	Very low	38.1	Very low	149 Å²	149	144.1 Å²	144.1	80%	0.797	77%	0.774	S	S	*	*				-171.9	159.3	92.8	-100.1	-21	0	0	0	114.8
75	N	38.8	Very low	37.5	Very low	156 Å²	156	142.6 Å²	142.6	83%	0.834	78%	0.777	S	S	*	*			trans	-78.4	141.5	-172.8	-74.3	-90.3	0	0	0	113.6
76	K	36.7	Very low	37	Very low	183 Å²	183	145.3 Å²	145.3	80%	0.796	79%	0.787	S	S	*	*				179.4	100.2	121.5	-172.4	171.6	-178.7	-176.6	0	115
77	K	42	Very low	36.4	Very low	175 Å²	175	144.5 Å²	144.5	76%	0.761	79%	0.787	S	S	*	*			trans	56.2	138	137.7	-59.4	-166.9	178.6	-167.4	0	123
78	D	33.8	Very low	35.6	Very low	131 Å²	131	146.1 Å²	146.1	70%	0.701	79%	0.791	S	S	*	*			trans	67.8	97.5	148.6	-51.8	-21.5	0	0	0	119.2
79	N	32	Very low	35.3	Very low	166 Å²	166	145.6 Å²	145.6	89%	0.888	79%	0.792	S	S	*	*				-158.5	117.6	99.1	-98.1	-60.1	0	0	0	112.3
80	T	39.7	Very low	34.9	Very low	125 Å²	125	142 Å²	142	77%	0.767	79%	0.787	S	S	*	*			trans	-65.4	131.7	161.1	-64.4	0	0	0	0	109.3
81	L	39.1	Very low	35.1	Very low	166 Å²	166	138.3 Å²	138.3	87%	0.869	78%	0.782	S	S	*	*			trans	-164	93.5	133.7	-105.9	165.6	0	0	0	111.1
82	Q	34.8	Very low	35.1	Very low	176 Å²	176	142.4 Å²	142.4	82%	0.822	79%	0.786	S	S	*	*			trans	-61.7	129.7	161.9	174.2	176.7	-4.1	0	0	109.6
83	C	33.3	Very low	35.2	Very low	111 Å²	111	141.8 Å²	141.8	75%	0.75	79%	0.787	S	S	*	*			trans	-127.8	75.4	162.4	-163.4	0	0	0	0	109.9
84	G	35.5	Very low	34.7	Very low	63 Å²	63	140.7 Å²	140.7	65%	0.649	79%	0.789	S	S	*	*			trans	-85.9	114	145.4	0	0	0	0	0	106.9
85	M	31.7	Very low	34.4	Very low	155 Å²	155	139.8 Å²	139.8	76%	0.764	79%	0.793	S	S	*	*			trans	-140.2	101.8	166.3	-79.5	-164.3	166.2	0	0	109.8	V87	M85-V87 HydrophobicContact CB-CG2 4.25Å
86	E	34.9	Very low	34	Very low	192 Å²	192	136.9 Å²	136.9	90%	0.897	79%	0.791	S	S	*	*			trans	-60	131.7	152.2	-62.7	172.7	-178.7	0	0	108.3
87	V	30.4	Very low	33.8	Very low	128 Å²	128	133 Å²	133	78%	0.776	79%	0.787	S	S	*	*			trans	-136.4	127.2	168.9	-155.4	0	0	0	0	109.6	M85	M85-V87 HydrophobicContact CB-CG2 4.25Å
88	N	30.9	Very low	33.4	Very low	150 Å²	150	130.8 Å²	130.8	80%	0.802	78%	0.783	S	S	*	*			trans	-80.9	132.1	-172.3	-84.3	-75.1	0	0	0	113.4
89	S	32.9	Very low	33.7	Very low	99 Å²	99	132.9 Å²	132.9	69%	0.692	79%	0.788	S	S	*	*			trans	64.7	125.6	141.5	127.9	0	0	0	0	122
90	S	34.3	Very low	34.1	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	78%	0.777	S	S	*	*			trans	81.7	110.6	133	-51.4	0	0	0	0	121.3
91	I	34.6	Very low	33.9	Very low	171 Å²	171	133.1 Å²	133.1	88%	0.877	78%	0.781	S	S	*	*				-139.7	137	116.7	-66.5	-162.7	0	0	0	110.9
92	L	34.8	Very low	33.3	Very low	164 Å²	164	132.6 Å²	132.6	86%	0.859	78%	0.779	S	S	*	*			trans	-44	145.6	-179.6	-64.1	148.4	0	0	0	120.9
93	S	37.5	Very low	33	Very low	124 Å²	124	129.7 Å²	129.7	87%	0.867	78%	0.779	S	S	*	*				-163.2	106.8	124.9	-170	0	0	0	0	109.3
94	G	25.8	Very low	32.7	Very low	64 Å²	64	128.4 Å²	128.4	66%	0.66	78%	0.776	S	S	*	*				80.9	117.6	107.8	0	0	0	0	0	113.1
95	C	29.2	Very low	32.5	Very low	131 Å²	131	134.7 Å²	134.7	89%	0.885	79%	0.788	S	S	*	*			cis	-153	161.1	25.1	-68.2	0	0	0	0	113.6
96	A	29.4	Very low	32.3	Very low	95 Å²	95	134.9 Å²	134.9	79%	0.785	79%	0.792	S	S	*	*			trans	18.1	137.7	150.4	0	0	0	0	0	120.2
97	S	32.7	Very low	32	Very low	101 Å²	101	134 Å²	134	71%	0.706	79%	0.793	S	S	*	*			cis	-177.1	-173.6	10	-117.2	0	0	0	0	108.6
98	N	33.8	Very low	31.8	Very low	129 Å²	129	133.4 Å²	133.4	69%	0.69	79%	0.79	S	S	*	*			cis	-158.5	129.1	6.6	-127.8	2	0	0	0	112.5
99	H	39.8	Very low	31.7	Very low	174 Å²	174	135.4 Å²	135.4	81%	0.806	79%	0.791	S	S	*	*			trans	60.6	156.6	152.9	-85.5	-86.8	0	0	0	121.9
100	P	41.8	Very low	31.4	Very low	101 Å²	101	137.8 Å²	137.8	66%	0.656	80%	0.796	S	S	*	*			trans	-139.6	-169.8	-135.6	43.7	-24.4	0	0	0	115.1
101	K	34.1	Very low	31.1	Very low	195 Å²	195	136.8 Å²	136.8	85%	0.848	79%	0.789	S	S	*	*			trans	-167.3	138.9	137.4	-102.2	145.1	-170.7	176.3	0	113.8
102	N	26.7	Very low	30.7	Very low	155 Å²	155	134.9 Å²	134.9	83%	0.829	79%	0.786	S	S	*	*			trans	-15.1	154.3	157.2	-47.6	-38.4	0	0	0	117
103	S	29.1	Very low	30.4	Very low	116 Å²	116	134.3 Å²	134.3	81%	0.811	78%	0.783	S	S	*	*			cis	-163.7	152.5	36.5	-170.7	0	0	0	0	112.1
104	A	27.4	Very low	30	Very low	83 Å²	83	137.8 Å²	137.8	69%	0.686	78%	0.782	S	S	*	*			trans	-80.3	153.3	166.2	0	0	0	0	0	111.6
105	Q	31.6	Very low	29.9	Very low	195 Å²	195	142.4 Å²	142.4	91%	0.911	79%	0.786	S	S	*	*			trans	-169.2	129.5	131.6	-105.8	165.2	11.9	0	0	111.7
106	N	27.5	Very low	29.8	Very low	160 Å²	160	144.3 Å²	144.3	86%	0.856	78%	0.782	S	S	*	*			trans	-85.1	142.9	164	-82.7	-88.6	0	0	0	109
107	L	26.9	Very low	29.6	Very low	173 Å²	173	143 Å²	143	91%	0.906	78%	0.779	S	S	*	*			trans	-156.1	149.8	139.1	-147.3	63.6	0	0	0	112.9
108	T	27	Very low	29.4	Very low	116 Å²	116	147.9 Å²	147.9	71%	0.712	79%	0.787	S	S	*	*			trans	-98.7	157.5	-176.1	39.2	0	0	0	0	113.3
109	K	29.7	Very low	29	Very low	191 Å²	191	152.5 Å²	152.5	83%	0.83	80%	0.797	S	S	*	*			trans	127.4	110	146.3	-69.7	174.6	-179.1	-178.7	0	115.4
110	D	25.1	Very low	28.7	Very low	150 Å²	150	148.3 Å²	148.3	80%	0.802	79%	0.787	S	S	*	*				21.4	138	106.2	-152.3	62.6	0	0	0	117.4
111	S	28.4	Very low	28.1	Very low	85 Å²	85	152.6 Å²	152.6	59%	0.594	80%	0.798	S	S	*	*			cis	-164.7	163.7	1.8	27.8	0	0	0	0	109.1
112	T	27	Very low	28.1	Very low	131 Å²	131	150.1 Å²	150.1	80%	0.804	79%	0.794	S	S	*	*			trans	-169.3	105.8	150.6	-72.3	0	0	0	0	113.4
113	L	29	Very low	28.3	Very low	151 Å²	151	151 Å²	151	79%	0.791	80%	0.798	S	S	*	*			trans	21.5	133	134.6	-60.6	157.9	0	0	0	121.4
114	K	28.1	Very low	28.3	Very low	198 Å²	198	151.4 Å²	151.4	86%	0.861	80%	0.796	S	S	*	*				-159.6	143.1	82.8	-54.3	-156.7	177.9	-177.6	0	109.1
115	H	24.4	Very low	28.3	Very low	160 Å²	160	156.3 Å²	156.3	74%	0.741	80%	0.804	S	S	*	*				55.5	122.9	60.2	-119.3	-119.5	0	0	0	112.1
116	E	25.7	Very low	28.4	Very low	171 Å²	171	152 Å²	152	80%	0.799	80%	0.796	S	S	*	*			cis	-144.9	173.1	16.3	-75	176.4	-177	0	0	109.9
117	G	25.8	Very low	28.5	Very low	69 Å²	69	156.2 Å²	156.2	71%	0.711	80%	0.8	S	S	*	*			cis	-176.3	166.4	2.5	0	0	0	0	0	111.4
118	F	28.4	Very low	28.8	Very low	202 Å²	202	156.9 Å²	156.9	89%	0.886	80%	0.795	S	S	*	*			trans	-82	151.7	-178.6	-86.7	-106.7	0	0	0	113.1
119	Y	26	Very low	28.9	Very low	227 Å²	227	160.9 Å²	160.9	89%	0.89	80%	0.803	S	S	*	*				-161.5	153.9	109.5	-122.1	-92	0	0	0	111.6
120	S	32.6	Very low	28.9	Very low	85 Å²	85	160.1 Å²	160.1	59%	0.594	81%	0.807	S	S	*	*			trans	-104.7	156.8	-176.6	74.9	0	0	0	0	112.6
121	E	28.7	Very low	29.4	Very low	192 Å²	192	162.3 Å²	162.3	90%	0.897	81%	0.81	S	S	*	*				-156.8	159	128.1	-117.6	166.9	-161.3	0	0	112.4
122	N	33.9	Very low	29.4	Very low	143 Å²	143	163.9 Å²	163.9	77%	0.765	82%	0.821	S	S	*	*			trans	-91.1	161.5	-170.1	-63.9	-91.5	0	0	0	111.7
123	L	30.9	Very low	29.5	Very low	174 Å²	174	168.7 Å²	168.7	91%	0.911	82%	0.824	S	S	*	*			trans	-160.5	131.6	132.3	-108.6	162.8	0	0	0	112.4
124	T	31	Very low	29.8	Very low	124 Å²	124	169.1 Å²	169.1	76%	0.761	82%	0.822	S	S	*	*			trans	-73.6	159.9	176.8	-23.7	0	0	0	0	111.5
125	E	27.2	Very low	30.1	Very low	185 Å²	185	167.7 Å²	167.7	86%	0.864	82%	0.816	S	S	*	*				160.5	138.4	110	-168.6	156.6	-137.4	0	0	113.9
126	S	32.1	Very low	30.5	Very low	106 Å²	106	168 Å²	168	74%	0.741	82%	0.818	S	S	*	*			trans	-75.4	134.9	179.9	-44.6	0	0	0	0	112.6	K128	S126-K128 PolarHBondContact O-N 2.92Å
127	R	31.3	Very low	31	Very low	248 Å²	248	165.1 Å²	165.1	94%	0.936	82%	0.816	S	S	*	*			trans	-88.5	104.3	173.8	-168.9	171.4	-68.7	178	0.4	112
128	K	32.1	Very low	31.2	Very low	186 Å²	186	168 Å²	168	81%	0.809	83%	0.826	S	S	*	*			trans	-84	162.7	167.3	-71.3	-179.5	178.8	175.9	0	111.9	S126	S126-K128 PolarHBondContact O-N 2.92Å
129	F	29.9	Very low	31.6	Very low	201 Å²	201	164.7 Å²	164.7	88%	0.882	82%	0.817	S	S	*	*			trans	-44	142.6	172	-79.1	-102.6	0	0	0	115.1
130	L	29.4	Very low	31.9	Very low	175 Å²	175	160.9 Å²	160.9	92%	0.916	82%	0.817	S	S	*	*			trans	-135.6	126.8	149.5	-87	173.1	0	0	0	110.7
131	K	35.6	Very low	32.2	Very low	195 Å²	195	164 Å²	164	85%	0.848	82%	0.822	S	S	*	*			trans	-87.7	174.9	166.7	-105.3	-179.8	176.2	177.4	0	110.1
132	S	29.5	Very low	32.8	Very low	119 Å²	119	162 Å²	162	83%	0.832	82%	0.816	S	S	*	*			trans	89.3	148.7	177.7	85.1	0	0	0	0	114.5
133	R	28.2	Very low	32.9	Very low	231 Å²	231	164.5 Å²	164.5	87%	0.872	82%	0.82	S	S	*	*			cis	-152.5	150.8	11.7	-160	169.5	89.5	-173.6	7.2	111.6
134	E	34.8	Very low	32.9	Very low	160 Å²	160	160.2 Å²	160.2	75%	0.748	82%	0.818	S	S	*	*			trans	-67.5	138.4	166	-55.5	173.6	140.2	0	0	111.7
135	K	34.6	Very low	33.1	Very low	168 Å²	168	159.9 Å²	159.9	73%	0.73	82%	0.821	S	S	*	*				155	135.8	117.1	-86.6	-176.1	-179.7	-179.2	0	115
136	Q	32.5	Very low	34.3	Very low	166 Å²	166	157.7 Å²	157.7	78%	0.776	82%	0.82	S	S	*	*			trans	73.3	97	141.3	-71.6	177	-45.5	0	0	121.3
137	S	35.9	Very low	34.3	Very low	111 Å²	111	162.4 Å²	162.4	78%	0.776	82%	0.823	S	S	*	*				49.5	126.6	118.9	66.3	0	0	0	0	121.9
138	S	30.5	Very low	34.6	Very low	129 Å²	129	158.3 Å²	158.3	90%	0.902	81%	0.814	S	S	*	*				-144.3	155.6	127.3	60.5	0	0	0	0	111
139	L	36.1	Very low	35	Very low	134 Å²	134	154.5 Å²	154.5	70%	0.702	81%	0.807	S	S	*	*			trans	-103.4	144.4	-163.8	-179.4	73.6	0	0	0	111.5	E141	L139-E141 HydrophobicContact CD1-CG 3.85Å; L139-E141 HydrophobicContact CD2-CG 4.16Å; L139-E141 HydrophobicContact CG-CG 4.08Å
140	T	34	Very low	36.2	Very low	147 Å²	147	152 Å²	152	90%	0.902	81%	0.808	S	S	*	*			trans	-145.4	114.2	148.4	-9.5	0	0	0	0	109.8
141	E	38.5	Very low	37.4	Very low	150 Å²	150	153 Å²	153	70%	0.701	80%	0.801	S	S	*	*			trans	-88.6	-174.3	175	-63.5	-178.9	118	0	0	111.7	L139	L139-E141 HydrophobicContact CD1-CG 3.85Å; L139-E141 HydrophobicContact CD2-CG 4.16Å; L139-E141 HydrophobicContact CG-CG 4.08Å
142	I	40.8	Very low	38.6	Very low	149 Å²	149	149 Å²	149	76%	0.764	80%	0.798	S	S	*	*			trans	92	117.8	166.5	-53	167	0	0	0	112.8
143	K	36.5	Very low	40.3	Very low	196 Å²	196	146.3 Å²	146.3	85%	0.852	78%	0.778	S	S	*	*			cis	-154.2	144.1	-2.1	-109.2	165.5	-169.9	172.1	0	107.8
144	G	31.1	Very low	42.1	Very low	84 Å²	84	137.8 Å²	137.8	87%	0.866	75%	0.752	S	S	*	*			trans	-98	-171.4	-168.3	0	0	0	0	0	117.3
145	S	34.9	Very low	44	Very low	118 Å²	118	136.3 Å²	136.3	83%	0.825	75%	0.745	S	S	*	*			trans	-138.7	161.2	160.9	-171.1	0	0	0	0	109
146	V	51.8	Low	46.2	Very low	138 Å²	138	128.4 Å²	128.4	84%	0.836	71%	0.711	S	S	*	*			trans	-111.8	104	-158.6	176.8	0	0	0	0	112.8
147	Y	33.6	Very low	48.2	Very low	205 Å²	205	126.1 Å²	126.1	80%	0.804	71%	0.711	S	S	*	*			trans	175.4	152.8	148.2	71.9	-80	0	0	0	104.8
148	E	36.2	Very low	49.8	Very low	162 Å²	162	126.4 Å²	126.4	76%	0.757	70%	0.698	S	S	*	*			cis	-180	156.7	-9.4	168.2	168.6	-170.8	0	0	104.8
149	T	40.8	Very low	52	Low	107 Å²	107	123.3 Å²	123.3	66%	0.656	68%	0.676	S	S	*	*			trans	77.1	121.2	175	-19.2	0	0	0	0	118.5	Y151	T149-Y151 HydrophobicContact CG2-CD2 3.46Å; T149-Y151 VanDerWaalsContact CG2-CD2 3.46Å; T149-Y151 HydrophobicContact CG2-CE2 3.53Å; T149-Y151 PolarHBondContact O-N 3.28Å; T149-Y151 VanDerWaalsContact O-N 3.16Å
150	T	55.3	Low	53.8	Low	147 Å²	147	119.2 Å²	119.2	90%	0.902	67%	0.666	S	S	*	*			trans	-82.9	80.1	174.7	-46.2	0	0	0	0	111.1
151	Y	55.3	Low	55.8	Low	196 Å²	196	117.6 Å²	117.6	77%	0.769	65%	0.647	S	S	*	*			trans	-120.9	129.6	163.9	-78.3	-83.5	0	0	0	109.6	T149	T149-Y151 HydrophobicContact CG2-CD2 3.46Å; T149-Y151 VanDerWaalsContact CG2-CD2 3.46Å; T149-Y151 HydrophobicContact CG2-CE2 3.53Å; T149-Y151 PolarHBondContact O-N 3.28Å; T149-Y151 VanDerWaalsContact O-N 3.16Å
152	S	59.6	Low	57.4	Low	113 Å²	113	115.2 Å²	115.2	79%	0.79	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-59	130.3	163.4	-57.1	0	0	0	0	107.7
153	P	65	Low	58.9	Low	62 Å²	62	110.6 Å²	110.6	40%	0.403	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-65.3	144.6	-178.3	-3.1	15.1	0	0	0	109.6	E155 I162 E163	P153-E155 PolarHBondContact O-N 3.07Å; P153-I162 HydrophobicContact CB-CG2 3.59Å; P153-I162 HydrophobicContact CG-CG2 3.79Å; P153-E163 VanDerWaalsContact CB-O 3.3Å; P153-E163 WeakPolarHBondContact CB-O 3.26Å
154	P	65.6	Low	60.1	Low	52 Å²	52	109.3 Å²	109.3	34%	0.338	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-62	136.3	-171.2	24.4	-33.8	0	0	0	111.7	E163 M169	P154-E163 PolarHBondContact O-N 3Å; P154-M169 HydrophobicContact CB-CE 4.46Å; P154-M169 HydrophobicContact CG-CB 4.25Å; P154-M169 WeakPolarHBondContact O-CE 3.26Å
155	E	76.4	Confident	62	Low	129 Å²	129	110.9 Å²	110.9	60%	0.603	59%	0.594	S	S	*	*	B	Isolated β-bridge	trans	-95.7	132.4	173.1	-79.7	176.6	-151.1	0	0	110.6	P153 P157 K161 I162	P153-E155 PolarHBondContact O-N 3.07Å; E155-P157 VanDerWaalsContact O-CD 3.28Å; E155-P157 WeakPolarHBondContact O-CD 3.19Å; E155-K161 CarbonylContact C-O 3.54Å; E155-K161 WeakPolarHBondContact CA-O 3.48Å; E155-I162 HydrophobicContact CG-CD1 4.36Å; E155-I162 HydrophobicContact CG-CG1 3.53Å
156	C	79.6	Confident	63.3	Low	1 Å²	1	109.4 Å²	109.4	1%	0.007	58%	0.584	C	S	.	*	P	Polyproline II helix	trans	-67.4	116.5	175.9	179.5	0	0	0	0	110.1	F158 C159 G160 K161 M169 H172	C156-F158 PolarHBondContact O-N 2.83Å; C156-C159 PolarHBondContact O-N 3.35Å; C156-G160 WeakPolarHBondContact O-CA 3.31Å; C156-G160 PolarHBondContact O-N 3.03Å; C156-K161 HydrophobicContact CB-CB 4.4Å; C156-K161 PolarHBondContact N-O 3.41Å; C156-M169 HydrophobicContact CB-CE 3.82Å; C156-M169 HydrophobicContact CB-SD 3.58Å; C156-M169 VanDerWaalsContact CB-SD 3.58Å; C156-M169 VanDerWaalsContact N-CE 3.32Å; C156-H172 PolarHBondContact SG-NE2 3.18Å; C156-H172 VanDerWaalsContact SG-NE2 3.42Å
157	P	74.9	Confident	64.2	Low	119 Å²	119	109.8 Å²	109.8	77%	0.773	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-20.9	-176.2	-24.6	35.4	0	0	0	114.3	E155	E155-P157 VanDerWaalsContact O-CD 3.28Å; E155-P157 WeakPolarHBondContact O-CD 3.19Å
158	F	69.9	Low	66	Low	116 Å²	116	103.8 Å²	103.8	51%	0.509	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.2	-20.1	-175.7	-55.7	-77.5	0	0	0	114.2	C156 V173 H177 L180	C156-F158 PolarHBondContact O-N 2.83Å; F158-V173 HydrophobicContact CD2-CG1 4.12Å; F158-V173 HydrophobicContact CE2-CG1 3.86Å; F158-H177 WeakPolarHBondContact CB-CE1 3.37Å; F158-L180 HydrophobicContact CD1-CD1 4.09Å; F158-L180 HydrophobicContact CE1-CD1 4.41Å
159	C	76.8	Confident	67.8	Low	64 Å²	64	97 Å²	97	43%	0.432	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.1	2.4	-176.9	67.9	0	0	0	0	116.3	C156 K161 H172 H177	C156-C159 PolarHBondContact O-N 3.35Å; C159-K161 VanDerWaalsContact C-N 3.27Å; C159-K161 PolarHBondContact O-N 2.88Å; C159-H172 PolarHBondContact SG-NE2 3.37Å; C159-H177 PolarHBondContact SG-NE2 3.44Å
160	G	72.5	Confident	69.5	Low	48 Å²	48	97 Å²	97	50%	0.495	52%	0.519	S	S	.	.			trans	68.7	17.3	175.2	0	0	0	0	0	115.2	C156	C156-G160 WeakPolarHBondContact O-CA 3.31Å; C156-G160 PolarHBondContact O-N 3.03Å
161	K	76.6	Confident	70.5	Confident	114 Å²	114	93.7 Å²	93.7	50%	0.496	50%	0.499	S	S	.	.			trans	-73.7	137.2	171.8	-70.8	-143.2	-162.9	177.4	0	111	E155 C156 C159 M169	E155-K161 CarbonylContact C-O 3.54Å; E155-K161 WeakPolarHBondContact CA-O 3.48Å; C156-K161 HydrophobicContact CB-CB 4.4Å; C156-K161 PolarHBondContact N-O 3.41Å; C159-K161 VanDerWaalsContact C-N 3.27Å; C159-K161 PolarHBondContact O-N 2.88Å; K161-M169 WeakPolarHBondContact O-CE 3.48Å
162	I	72	Confident	71.8	Confident	99 Å²	99	84.9 Å²	84.9	51%	0.508	47%	0.465	S	S	.	.	B	Isolated β-bridge	trans	-97.6	123.3	172.2	-60	165.1	0	0	0	106.7	P153 E155	P153-I162 HydrophobicContact CB-CG2 3.59Å; P153-I162 HydrophobicContact CG-CG2 3.79Å; E155-I162 HydrophobicContact CG-CD1 4.36Å; E155-I162 HydrophobicContact CG-CG1 3.53Å
163	E	72.8	Confident	72.6	Confident	53 Å²	53	80.6 Å²	80.6	25%	0.248	43%	0.434	C	S	.	.			trans	-111.7	146.7	172.7	-55.5	-69.9	173.7	0	0	108.7	P153 P154 H165 D168 M169 H172	P153-E163 VanDerWaalsContact CB-O 3.3Å; P153-E163 WeakPolarHBondContact CB-O 3.26Å; P154-E163 PolarHBondContact O-N 3Å; E163-H165 VanDerWaalsContact C-N 3.3Å; E163-H165 PolarHBondContact O-N 3.32Å; E163-D168 HydrophobicContact CB-CB 4.15Å; E163-M169 HydrophobicContact CB-CB 4.48Å; E163-M169 HydrophobicContact CB-CE 4.09Å; E163-M169 HydrophobicContact CG-CE 3.74Å; E163-H172 HydrophobicContact CG-CB 4.32Å; E163-H172 IonicContact OE1-CE1 3.96Å; E163-H172 IonicContact OE1-CG 3.18Å; E163-H172 IonicContact OE1-ND1 3.03Å; E163-H172 PolarHBondContact OE1-ND1 3.22Å
164	E	62.3	Low	73.1	Confident	169 Å²	169	83.1 Å²	83.1	79%	0.79	44%	0.439	S	S	*	.	S	Bend	trans	-71.3	-23.7	-172.2	-63.9	-171.5	164.5	0	0	113.2
165	H	69.2	Low	73.6	Confident	116 Å²	116	85 Å²	85	54%	0.537	45%	0.449	S	S	.	.	S	Bend	trans	-133.3	153.9	177.7	-60.1	-46.8	0	0	0	112.7	E163 E167 D168 M169	E163-H165 VanDerWaalsContact C-N 3.3Å; E163-H165 PolarHBondContact O-N 3.32Å; H165-E167 VanDerWaalsContact C-N 3.31Å; H165-E167 PolarHBondContact O-N 3.27Å; H165-D168 IonicContact CD2-OD2 3.69Å; H165-D168 PolarHBondContact O-N 3.26Å; H165-M169 PolarHBondContact O-N 3.44Å; H165-M169 VanDerWaalsContact O-N 3.1Å
166	S	63.8	Low	73.3	Confident	87 Å²	87	85.6 Å²	85.6	61%	0.608	45%	0.45	S	S	*	.	H	α-helix	trans	-67	-28.9	-179.2	50.1	0	0	0	0	113.8	M169 E170	S166-M169 WeakPolarHBondContact O-CB 3.48Å; S166-M169 PolarHBondContact O-N 3.29Å; S166-E170 PolarHBondContact O-N 3.28Å
167	E	69.1	Low	73.2	Confident	147 Å²	147	86.9 Å²	86.9	69%	0.687	46%	0.456	S	S	*	.	H	α-helix	trans	-72.4	-35.3	177.6	-65.1	170.2	156	0	0	110.9	H165 E170 T171	H165-E167 VanDerWaalsContact C-N 3.31Å; H165-E167 PolarHBondContact O-N 3.27Å; E167-E170 PolarHBondContact O-N 3.39Å; E167-T171 WeakPolarHBondContact O-CG2 3.25Å; E167-T171 PolarHBondContact O-N 3.44Å; E167-T171 PolarHBondContact O-OG1 3.49Å
168	D	72.9	Confident	72.6	Confident	78 Å²	78	82.1 Å²	82.1	42%	0.417	43%	0.426	S	S	.	.	H	α-helix	trans	-68.4	-35.9	170.7	-63.2	-45.2	0	0	0	111.3	E163 H165 T171 H172	E163-D168 HydrophobicContact CB-CB 4.15Å; H165-D168 IonicContact CD2-OD2 3.69Å; H165-D168 PolarHBondContact O-N 3.26Å; D168-T171 WeakPolarHBondContact CA-OG1 3.42Å; D168-T171 PolarHBondContact O-OG1 2.81Å; D168-T171 VanDerWaalsContact O-OG1 3.09Å; D168-H172 WeakPolarHBondContact O-CB 3.42Å; D168-H172 PolarHBondContact O-N 3.47Å
169	M	74.1	Confident	72.1	Confident	20 Å²	20	83.8 Å²	83.8	10%	0.099	44%	0.44	C	S	.	.	H	α-helix	trans	-63.4	-44.5	170.4	-177.3	54	66.4	0	0	112.3	P154 C156 K161 E163 H165 S166 T171 H172 V173	P154-M169 HydrophobicContact CB-CE 4.46Å; P154-M169 HydrophobicContact CG-CB 4.25Å; P154-M169 WeakPolarHBondContact O-CE 3.26Å; C156-M169 HydrophobicContact CB-CE 3.82Å; C156-M169 HydrophobicContact CB-SD 3.58Å; C156-M169 VanDerWaalsContact CB-SD 3.58Å; C156-M169 VanDerWaalsContact N-CE 3.32Å; K161-M169 WeakPolarHBondContact O-CE 3.48Å; E163-M169 HydrophobicContact CB-CB 4.48Å; E163-M169 HydrophobicContact CB-CE 4.09Å; E163-M169 HydrophobicContact CG-CE 3.74Å; H165-M169 PolarHBondContact O-N 3.44Å; H165-M169 VanDerWaalsContact O-N 3.1Å; S166-M169 WeakPolarHBondContact O-CB 3.48Å; S166-M169 PolarHBondContact O-N 3.29Å; M169-T171 PolarHBondContact O-N 2.85Å; M169-H172 WeakPolarHBondContact O-CB 3.38Å; M169-H172 PolarHBondContact O-N 2.96Å; M169-V173 WeakPolarHBondContact O-CG2 3.46Å; M169-V173 PolarHBondContact O-N 3.19Å; M169-V173 HydrophobicContact SD-CG2 4.03Å
170	E	76.4	Confident	71.2	Confident	107 Å²	107	86.2 Å²	86.2	50%	0.5	45%	0.448	S	S	.	.	H	α-helix	trans	-64.6	-41.9	179.3	-170.9	177.8	-177	0	0	111.6	S166 E167 V173 K174	S166-E170 PolarHBondContact O-N 3.28Å; E167-E170 PolarHBondContact O-N 3.39Å; E170-V173 PolarHBondContact O-N 2.83Å; E170-K174 HydrophobicContact CG-CD 4.13Å; E170-K174 WeakPolarHBondContact O-CB 3.32Å; E170-K174 VanDerWaalsContact O-CG 3.28Å; E170-K174 WeakPolarHBondContact O-CG 3.43Å; E170-K174 PolarHBondContact O-N 2.9Å; E170-K174 WeakPolarHBondContact OE1-CE 3.48Å; E170-K174 IonicContact OE1-NZ 3.54Å; E170-K174 PolarHBondContact OE1-NZ 2.87Å
171	T	74.8	Confident	70.5	Confident	77 Å²	77	88.3 Å²	88.3	47%	0.472	45%	0.448	S	S	.	.	H	α-helix	trans	-70.5	-33.9	174.4	59	0	0	0	0	112.7	E167 D168 M169 T175	E167-T171 WeakPolarHBondContact O-CG2 3.25Å; E167-T171 PolarHBondContact O-N 3.44Å; E167-T171 PolarHBondContact O-OG1 3.49Å; D168-T171 WeakPolarHBondContact CA-OG1 3.42Å; D168-T171 PolarHBondContact O-OG1 2.81Å; D168-T171 VanDerWaalsContact O-OG1 3.09Å; M169-T171 PolarHBondContact O-N 2.85Å; T171-T175 WeakPolarHBondContact O-CB 3.45Å; T171-T175 VanDerWaalsContact O-CG2 3.27Å; T171-T175 WeakPolarHBondContact O-CG2 3.45Å; T171-T175 PolarHBondContact O-N 3.37Å; T171-T175 PolarHBondContact O-OG1 3.3Å
172	H	83.3	Confident	69.2	Low	12 Å²	12	88.5 Å²	88.5	6%	0.056	45%	0.454	C	S	.	.	H	α-helix	trans	-56.4	-53.7	169.9	170.5	114.5	0	0	0	110.5	C156 C159 E163 D168 M169 T175 K176 H177	C156-H172 PolarHBondContact SG-NE2 3.18Å; C156-H172 VanDerWaalsContact SG-NE2 3.42Å; C159-H172 PolarHBondContact SG-NE2 3.37Å; E163-H172 HydrophobicContact CG-CB 4.32Å; E163-H172 IonicContact OE1-CE1 3.96Å; E163-H172 IonicContact OE1-CG 3.18Å; E163-H172 IonicContact OE1-ND1 3.03Å; E163-H172 PolarHBondContact OE1-ND1 3.22Å; D168-H172 WeakPolarHBondContact O-CB 3.42Å; D168-H172 PolarHBondContact O-N 3.47Å; M169-H172 WeakPolarHBondContact O-CB 3.38Å; M169-H172 PolarHBondContact O-N 2.96Å; H172-T175 PolarHBondContact O-N 2.95Å; H172-T175 PolarHBondContact O-OG1 2.87Å; H172-K176 WeakPolarHBondContact O-CB 3.47Å; H172-K176 PolarHBondContact O-N 3.03Å; H172-H177 AromaticContact NE2-CD2 3.9Å; H172-H177 AromaticContact NE2-NE2 3.76Å
173	V	76.1	Confident	68.2	Low	22 Å²	22	89.9 Å²	89.9	13%	0.133	46%	0.461	C	S	.	.	H	α-helix	trans	-65.9	-45.3	-178.2	-174.9	0	0	0	0	109.9	F158 M169 E170 T175 H177 A178 L181	F158-V173 HydrophobicContact CD2-CG1 4.12Å; F158-V173 HydrophobicContact CE2-CG1 3.86Å; M169-V173 WeakPolarHBondContact O-CG2 3.46Å; M169-V173 PolarHBondContact O-N 3.19Å; M169-V173 HydrophobicContact SD-CG2 4.03Å; E170-V173 PolarHBondContact O-N 2.83Å; V173-T175 PolarHBondContact O-N 3.45Å; V173-H177 HydrophobicContact CG1-CB 3.91Å; V173-H177 CarbonylContact O-C 3.15Å; V173-H177 WeakPolarHBondContact O-CA 3.29Å; V173-H177 WeakPolarHBondContact O-CB 3.36Å; V173-H177 PolarHBondContact O-N 3.13Å; V173-A178 PolarHBondContact O-N 2.89Å; V173-L181 HydrophobicContact CG1-CD1 3.74Å; V173-L181 HydrophobicContact CG1-CG 4.39Å
174	K	74.9	Confident	66.9	Low	116 Å²	116	91.7 Å²	91.7	50%	0.504	48%	0.478	S	S	.	.	H	α-helix	trans	-62.4	-21.4	177.1	-73	176.9	-175.2	174.2	0	115.2	E170 A178 L181	E170-K174 HydrophobicContact CG-CD 4.13Å; E170-K174 WeakPolarHBondContact O-CB 3.32Å; E170-K174 VanDerWaalsContact O-CG 3.28Å; E170-K174 WeakPolarHBondContact O-CG 3.43Å; E170-K174 PolarHBondContact O-N 2.9Å; E170-K174 WeakPolarHBondContact OE1-CE 3.48Å; E170-K174 IonicContact OE1-NZ 3.54Å; E170-K174 PolarHBondContact OE1-NZ 2.87Å; K174-A178 VanDerWaalsContact O-CB 3.27Å; K174-A178 WeakPolarHBondContact O-CB 3.43Å; K174-L181 HydrophobicContact CG-CD1 4.04Å
175	T	76.3	Confident	66.4	Low	91 Å²	91	92.5 Å²	92.5	56%	0.558	49%	0.487	S	S	*	.	H	α-helix	trans	-108.7	-29.7	-178.9	60.5	0	0	0	0	114.5	T171 H172 V173	T171-T175 WeakPolarHBondContact O-CB 3.45Å; T171-T175 VanDerWaalsContact O-CG2 3.27Å; T171-T175 WeakPolarHBondContact O-CG2 3.45Å; T171-T175 PolarHBondContact O-N 3.37Å; T171-T175 PolarHBondContact O-OG1 3.3Å; H172-T175 PolarHBondContact O-N 2.95Å; H172-T175 PolarHBondContact O-OG1 2.87Å; V173-T175 PolarHBondContact O-N 3.45Å
176	K	71.4	Confident	65.3	Low	142 Å²	142	94.6 Å²	94.6	62%	0.617	50%	0.497	S	S	*	.	H	α-helix	trans	-100.4	-28.5	-179.5	-56.1	-53.3	178	-168.7	0	112.9	H172	H172-K176 WeakPolarHBondContact O-CB 3.47Å; H172-K176 PolarHBondContact O-N 3.03Å
177	H	76.1	Confident	64.6	Low	28 Å²	28	98.7 Å²	98.7	13%	0.13	51%	0.512	C	S	.	.	S	Bend	trans	-111.8	22.4	172.8	-58	-73	0	0	0	111.2	F158 C159 H172 V173 N179 L180 L181	F158-H177 WeakPolarHBondContact CB-CE1 3.37Å; C159-H177 PolarHBondContact SG-NE2 3.44Å; H172-H177 AromaticContact NE2-CD2 3.9Å; H172-H177 AromaticContact NE2-NE2 3.76Å; V173-H177 HydrophobicContact CG1-CB 3.91Å; V173-H177 CarbonylContact O-C 3.15Å; V173-H177 WeakPolarHBondContact O-CA 3.29Å; V173-H177 WeakPolarHBondContact O-CB 3.36Å; V173-H177 PolarHBondContact O-N 3.13Å; H177-N179 PolarHBondContact O-N 3.48Å; H177-L180 HydrophobicContact CB-CB 4.48Å; H177-L180 HydrophobicContact CB-CD1 4.24Å; H177-L180 WeakPolarHBondContact O-CA 3.45Å; H177-L180 WeakPolarHBondContact O-CB 3.46Å; H177-L180 PolarHBondContact O-N 3.17Å; H177-L181 PolarHBondContact O-N 3.09Å
178	A	62.7	Low	63.5	Low	19 Å²	19	96 Å²	96	16%	0.157	51%	0.508	C	S	.	.	H	α-helix	trans	-47.7	-47.5	173.2	0	0	0	0	0	111.8	V173 K174 L180 L181 D182	V173-A178 PolarHBondContact O-N 2.89Å; K174-A178 VanDerWaalsContact O-CB 3.27Å; K174-A178 WeakPolarHBondContact O-CB 3.43Å; A178-L180 PolarHBondContact O-N 3.42Å; A178-L181 PolarHBondContact O-N 3.41Å; A178-D182 PolarHBondContact O-N 3.21Å
179	N	60.4	Low	62.6	Low	150 Å²	150	100.4 Å²	100.4	80%	0.802	53%	0.532	S	S	*	.	H	α-helix	trans	-66.3	-3.6	178.2	-52	-48.5	0	0	0	114.8	H177	H177-N179 PolarHBondContact O-N 3.48Å
180	L	57.2	Low	62	Low	115 Å²	115	106.1 Å²	106.1	60%	0.602	56%	0.558	S	S	*	*	H	α-helix	trans	-109.9	-8.4	172.4	-56.3	179.2	0	0	0	112.4	F158 H177 A178	F158-L180 HydrophobicContact CD1-CD1 4.09Å; F158-L180 HydrophobicContact CE1-CD1 4.41Å; H177-L180 HydrophobicContact CB-CB 4.48Å; H177-L180 HydrophobicContact CB-CD1 4.24Å; H177-L180 WeakPolarHBondContact O-CA 3.45Å; H177-L180 WeakPolarHBondContact O-CB 3.46Å; H177-L180 PolarHBondContact O-N 3.17Å; A178-L180 PolarHBondContact O-N 3.42Å
181	L	58.3	Low	61.3	Low	92 Å²	92	104.5 Å²	104.5	48%	0.482	56%	0.557	S	S	.	*	H	α-helix	trans	-110.6	-35.1	179.3	-70.2	-180	0	0	0	112.3	V173 K174 H177 A178 I183	V173-L181 HydrophobicContact CG1-CD1 3.74Å; V173-L181 HydrophobicContact CG1-CG 4.39Å; K174-L181 HydrophobicContact CG-CD1 4.04Å; H177-L181 PolarHBondContact O-N 3.09Å; A178-L181 PolarHBondContact O-N 3.41Å; L181-I183 VanDerWaalsContact C-N 3.27Å; L181-I183 PolarHBondContact O-N 2.97Å
182	D	48.9	Very low	61.7	Low	118 Å²	118	106.2 Å²	106.2	63%	0.631	56%	0.562	S	S	*	*			trans	-78.7	77.9	169.2	-69.4	-34.4	0	0	0	109.3	A178 P184	A178-D182 PolarHBondContact O-N 3.21Å; D182-P184 WeakPolarHBondContact O-CD 3.32Å
183	I	51.6	Low	61.8	Low	128 Å²	128	109.6 Å²	109.6	66%	0.656	58%	0.575	S	S	*	*			trans	-81.5	108.4	138.9	-59.1	176.3	0	0	0	104.2	L181 L185 T203	L181-I183 VanDerWaalsContact C-N 3.27Å; L181-I183 PolarHBondContact O-N 2.97Å; I183-L185 PolarHBondContact O-N 2.7Å; I183-T203 HydrophobicContact CD1-CG2 4.08Å
184	P	44.4	Very low	62.4	Low	92 Å²	92	113.8 Å²	113.8	60%	0.597	60%	0.597	S	S	*	*			trans	-58.1	127	176.2	-22.4	34.2	0	0	0	108.9	D182 E186	D182-P184 WeakPolarHBondContact O-CD 3.32Å; P184-E186 HydrophobicContact CB-CB 4.31Å; P184-E186 HydrophobicContact CB-CG 4.06Å; P184-E186 PolarHBondContact O-N 2.75Å
185	L	52.6	Low	63.2	Low	186 Å²	186	108.3 Å²	108.3	97%	0.974	57%	0.574	S	S	*	*			trans	-74.7	55.4	166.1	-165.9	76.9	0	0	0	109	I183	I183-L185 PolarHBondContact O-N 2.7Å
186	E	46.7	Very low	63.6	Low	160 Å²	160	109.1 Å²	109.1	75%	0.748	58%	0.58	S	S	*	*			trans	-91.8	127.5	169.3	-80.5	-98	133.4	0	0	107.7	P184 C188	P184-E186 HydrophobicContact CB-CB 4.31Å; P184-E186 HydrophobicContact CB-CG 4.06Å; P184-E186 PolarHBondContact O-N 2.75Å; E186-C188 PolarHBondContact O-N 3.31Å
187	D	48.5	Very low	64.3	Low	173 Å²	173	107.3 Å²	107.3	93%	0.925	58%	0.575	S	S	*	*			trans	-55.7	97.2	-175.1	-155.6	17.9	0	0	0	111.6
188	C	45.2	Very low	64.9	Low	91 Å²	91	109.3 Å²	109.3	62%	0.615	59%	0.591	S	S	*	*			trans	-140.8	136	175.2	-87.9	0	0	0	0	108.7	E186 Q190	E186-C188 PolarHBondContact O-N 3.31Å; C188-Q190 PolarHBondContact O-N 3.16Å
189	D	55.4	Low	65.9	Low	170 Å²	170	110.9 Å²	110.9	91%	0.909	61%	0.61	S	S	*	*			trans	-69.8	51.9	176.6	-61.1	-72.3	0	0	0	112.7	P191	D189-P191 VanDerWaalsContact O-CD 3.29Å; D189-P191 WeakPolarHBondContact O-CD 3.27Å
190	Q	61	Low	67.2	Low	139 Å²	139	107.9 Å²	107.9	65%	0.65	59%	0.593	S	S	*	*			trans	-72.1	115.8	172.5	-128.3	73.1	11.2	0	0	107.8	C188 L192	C188-Q190 PolarHBondContact O-N 3.16Å; Q190-L192 PolarHBondContact O-N 3.2Å
191	P	62.3	Low	68.7	Low	73 Å²	73	107.8 Å²	107.8	47%	0.474	59%	0.592	S	S	.	*			trans	-63.4	111.4	178	25.2	-33	0	0	0	109.2	D189 Y193	D189-P191 VanDerWaalsContact O-CD 3.29Å; D189-P191 WeakPolarHBondContact O-CD 3.27Å; P191-Y193 HydrophobicContact CB-CE1 4.37Å; P191-Y193 HydrophobicContact CB-CE2 4.09Å; P191-Y193 HydrophobicContact CG-CE2 3.94Å; P191-Y193 WeakPolarHBondContact CG-OH 3.11Å; P191-Y193 WeakPolarHBondContact O-CD2 3.43Å; P191-Y193 WeakPolarHBondContact O-CE2 3.23Å
192	L	82.1	Confident	70.1	Confident	113 Å²	113	103.7 Å²	103.7	59%	0.592	57%	0.571	S	S	*	*			trans	-78	129.8	165.4	-66.7	176.8	0	0	0	107.7	Q190 I201 T203	Q190-L192 PolarHBondContact O-N 3.2Å; L192-I201 HydrophobicContact CB-CG2 3.82Å; L192-I201 HydrophobicContact CD1-CG2 4.19Å; L192-I201 HydrophobicContact CD2-CG2 4.2Å; L192-I201 HydrophobicContact CG-CG2 4.29Å; L192-T203 HydrophobicContact CD2-CG2 4.4Å
193	Y	85	Confident	71.8	Confident	83 Å²	83	101.8 Å²	101.8	33%	0.325	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.3	121.2	-176.7	-57.7	-92.2	0	0	0	109.7	P191 C202 Y205	P191-Y193 HydrophobicContact CB-CE1 4.37Å; P191-Y193 HydrophobicContact CB-CE2 4.09Å; P191-Y193 HydrophobicContact CG-CE2 3.94Å; P191-Y193 WeakPolarHBondContact CG-OH 3.11Å; P191-Y193 WeakPolarHBondContact O-CD2 3.43Å; P191-Y193 WeakPolarHBondContact O-CE2 3.23Å; Y193-C202 PolarHBondContact N-O 3.42Å; Y193-C202 PolarHBondContact O-N 3.06Å; Y193-Y205 VanDerWaalsContact CE2-N 3.33Å
194	D	90.1	Very high	73.4	Confident	110 Å²	110	99.1 Å²	99.1	59%	0.588	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.6	139.9	177.1	59.8	-61.1	0	0	0	112.2	P196 L208	D194-P196 WeakPolarHBondContact O-CD 3.48Å; D194-L208 WeakPolarHBondContact O-CD2 3.43Å
195	C	90.3	Very high	75.3	Confident	2 Å²	2	100.1 Å²	100.1	1%	0.014	54%	0.544	C	S	.	.			trans	-79.3	117.7	171.9	-178.6	0	0	0	0	110.9	M197 C198 G199 L200 L208 H211	C195-M197 PolarHBondContact O-N 3.13Å; C195-M197 VanDerWaalsContact O-N 3.12Å; C195-C198 PolarHBondContact O-N 3.4Å; C195-C198 VanDerWaalsContact SG-SG 3.63Å; C195-G199 WeakPolarHBondContact O-CA 3.25Å; C195-G199 PolarHBondContact O-N 3.11Å; C195-L200 HydrophobicContact CB-CB 4.18Å; C195-L200 PolarHBondContact N-O 3.41Å; C195-L208 HydrophobicContact CB-CD1 3.61Å; C195-H211 PolarHBondContact SG-CD2 3.32Å; C195-H211 PolarHBondContact SG-NE2 3.39Å
196	P	85.1	Confident	76.9	Confident	107 Å²	107	97.4 Å²	97.4	70%	0.695	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-13.9	-178.4	28.9	-36	0	0	0	113.4	D194	D194-P196 WeakPolarHBondContact O-CD 3.48Å
197	M	86.4	Confident	78.8	Confident	105 Å²	105	93.9 Å²	93.9	52%	0.517	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-30.2	-178.9	-59.3	-62.9	-74.4	0	0	113.3	C195 H215	C195-M197 PolarHBondContact O-N 3.13Å; C195-M197 VanDerWaalsContact O-N 3.12Å; M197-H215 HydrophobicContact CB-CB 4.48Å; M197-H215 HydrophobicContact CG-CB 4.36Å
198	C	88.7	Confident	80.8	Confident	69 Å²	69	86.5 Å²	86.5	47%	0.466	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.4	-5.3	-172	73	0	0	0	0	115.6	C195 L200 H211 H215	C195-C198 PolarHBondContact O-N 3.4Å; C195-C198 VanDerWaalsContact SG-SG 3.63Å; C198-L200 VanDerWaalsContact C-N 3.32Å; C198-L200 PolarHBondContact O-N 2.99Å; C198-H211 PolarHBondContact SG-NE2 3Å; C198-H215 PolarHBondContact SG-NE2 3.47Å; C198-H215 VanDerWaalsContact SG-NE2 3.42Å
199	G	83.8	Confident	83	Confident	53 Å²	53	85.2 Å²	85.2	55%	0.546	46%	0.456	S	S	.	.			trans	75.2	11.2	-179.3	0	0	0	0	0	115.5	C195 I201	C195-G199 WeakPolarHBondContact O-CA 3.25Å; C195-G199 PolarHBondContact O-N 3.11Å; G199-I201 PolarHBondContact O-N 3.49Å
200	L	88.6	Confident	84.7	Confident	87 Å²	87	83.6 Å²	83.6	46%	0.455	44%	0.444	S	S	.	.			trans	-63.2	131	172.7	-176.7	66.1	0	0	0	110.3	C195 C198	C195-L200 HydrophobicContact CB-CB 4.18Å; C195-L200 PolarHBondContact N-O 3.41Å; C198-L200 VanDerWaalsContact C-N 3.32Å; C198-L200 PolarHBondContact O-N 2.99Å
201	I	87.7	Confident	86.1	Confident	113 Å²	113	78.8 Å²	78.8	58%	0.579	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	120.4	177.4	-57	176.9	0	0	0	109.3	L192 G199	L192-I201 HydrophobicContact CB-CG2 3.82Å; L192-I201 HydrophobicContact CD1-CG2 4.19Å; L192-I201 HydrophobicContact CD2-CG2 4.2Å; L192-I201 HydrophobicContact CG-CG2 4.29Å; G199-I201 PolarHBondContact O-N 3.49Å
202	C	87.1	Confident	87.5	Confident	6 Å²	6	76.6 Å²	76.6	4%	0.041	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	141.8	179.7	-67.8	0	0	0	0	111.3	Y193 N204 I207 L208	Y193-C202 PolarHBondContact N-O 3.42Å; Y193-C202 PolarHBondContact O-N 3.06Å; C202-N204 VanDerWaalsContact C-N 3.3Å; C202-N204 PolarHBondContact O-N 2.99Å; C202-I207 HydrophobicContact CB-CG2 4.44Å; C202-L208 HydrophobicContact CB-CB 3.88Å
203	T	85.4	Confident	87.9	Confident	77 Å²	77	74 Å²	74	47%	0.472	39%	0.393	S	S	.	.	S	Bend	trans	-81.2	-6.2	179.1	53.1	0	0	0	0	114	I183 L192	I183-T203 HydrophobicContact CD1-CG2 4.08Å; L192-T203 HydrophobicContact CD2-CG2 4.4Å
204	N	85.1	Confident	88	Confident	73 Å²	73	75.3 Å²	75.3	39%	0.39	41%	0.405	S	S	.	.	S	Bend	trans	-154.3	139.8	-177.6	-169.9	-45.6	0	0	0	110.2	C202 H206 I207 L208	C202-N204 VanDerWaalsContact C-N 3.3Å; C202-N204 PolarHBondContact O-N 2.99Å; N204-H206 VanDerWaalsContact C-N 3.26Å; N204-H206 PolarHBondContact O-N 3.08Å; N204-H206 PolarHBondContact OD1-CD2 3.35Å; N204-H206 PolarHBondContact OD1-N 3.13Å; N204-I207 HydrophobicContact CB-CD1 4.09Å; N204-I207 HydrophobicContact CB-CG1 4.22Å; N204-I207 PolarHBondContact O-N 2.71Å; N204-I207 VanDerWaalsContact O-N 3.14Å; N204-L208 PolarHBondContact O-N 2.98Å; N204-L208 VanDerWaalsContact O-N 3.1Å
205	Y	83.7	Confident	87.9	Confident	112 Å²	112	71.9 Å²	71.9	44%	0.439	39%	0.385	S	S	.	.	H	α-helix	trans	-52.5	-39.7	174.4	172	-100.5	0	0	0	113.1	Y193 I207 L208 Q209	Y193-Y205 VanDerWaalsContact CE2-N 3.33Å; Y205-I207 VanDerWaalsContact C-N 3.34Å; Y205-I207 PolarHBondContact O-N 2.82Å; Y205-L208 PolarHBondContact O-N 3Å; Y205-Q209 HydrophobicContact CE1-CB 4.45Å; Y205-Q209 WeakPolarHBondContact O-CB 3.43Å; Y205-Q209 PolarHBondContact O-N 3.14Å; Y205-Q209 PolarHBondContact OH-OE1 3.19Å
206	H	85.9	Confident	87.6	Confident	129 Å²	129	76.2 Å²	76.2	60%	0.597	41%	0.408	S	S	*	.	H	α-helix	trans	-63.7	-38.3	179.4	-67.1	-62.7	0	0	0	112.9	N204 Q209 E210	N204-H206 VanDerWaalsContact C-N 3.26Å; N204-H206 PolarHBondContact O-N 3.08Å; N204-H206 PolarHBondContact OD1-CD2 3.35Å; N204-H206 PolarHBondContact OD1-N 3.13Å; H206-Q209 PolarHBondContact O-N 3.07Å; H206-E210 PolarHBondContact O-N 2.78Å
207	I	88.1	Confident	87.3	Confident	86 Å²	86	76.5 Å²	76.5	44%	0.441	40%	0.4	S	S	.	.	H	α-helix	trans	-70.2	-38.8	176.8	-61.1	172.8	0	0	0	109.9	C202 N204 Y205 H211	C202-I207 HydrophobicContact CB-CG2 4.44Å; N204-I207 HydrophobicContact CB-CD1 4.09Å; N204-I207 HydrophobicContact CB-CG1 4.22Å; N204-I207 PolarHBondContact O-N 2.71Å; N204-I207 VanDerWaalsContact O-N 3.14Å; Y205-I207 VanDerWaalsContact C-N 3.34Å; Y205-I207 PolarHBondContact O-N 2.82Å; I207-H211 VanDerWaalsContact O-CB 3.25Å; I207-H211 WeakPolarHBondContact O-CB 3.25Å; I207-H211 PolarHBondContact O-N 3.41Å; I207-H211 VanDerWaalsContact O-N 3.07Å
208	L	90.4	Very high	86.6	Confident	19 Å²	19	77.6 Å²	77.6	10%	0.099	40%	0.404	C	S	.	.	H	α-helix	trans	-63.4	-42.9	172.8	177.5	59.9	0	0	0	111.6	D194 C195 C202 N204 Y205 H211 V212	D194-L208 WeakPolarHBondContact O-CD2 3.43Å; C195-L208 HydrophobicContact CB-CD1 3.61Å; C202-L208 HydrophobicContact CB-CB 3.88Å; N204-L208 PolarHBondContact O-N 2.98Å; N204-L208 VanDerWaalsContact O-N 3.1Å; Y205-L208 PolarHBondContact O-N 3Å; L208-H211 PolarHBondContact O-N 3.07Å; L208-V212 HydrophobicContact CD1-CG2 3.69Å; L208-V212 HydrophobicContact CG-CG2 4.11Å; L208-V212 WeakPolarHBondContact O-CB 3.44Å; L208-V212 WeakPolarHBondContact O-CG2 3.32Å; L208-V212 PolarHBondContact O-N 3.36Å
209	Q	90.8	Very high	85.4	Confident	63 Å²	63	77.7 Å²	77.7	29%	0.294	40%	0.4	S	S	.	.	H	α-helix	trans	-60.3	-53	179.8	-173.5	60.6	47.6	0	0	110.8	Y205 H206 H211 V212 D213	Y205-Q209 HydrophobicContact CE1-CB 4.45Å; Y205-Q209 WeakPolarHBondContact O-CB 3.43Å; Y205-Q209 PolarHBondContact O-N 3.14Å; Y205-Q209 PolarHBondContact OH-OE1 3.19Å; H206-Q209 PolarHBondContact O-N 3.07Å; Q209-H211 PolarHBondContact O-N 3.01Å; Q209-V212 PolarHBondContact O-N 2.94Å; Q209-D213 VanDerWaalsContact NE2-CG 3.33Å; Q209-D213 PolarHBondContact NE2-OD1 2.85Å; Q209-D213 PolarHBondContact NE2-OD2 3.17Å; Q209-D213 WeakPolarHBondContact O-CB 3.35Å; Q209-D213 PolarHBondContact O-N 3.31Å
210	E	90.9	Very high	84.2	Confident	137 Å²	137	78.6 Å²	78.6	64%	0.64	40%	0.398	S	S	*	.	H	α-helix	trans	-56.7	-38.3	175.8	-71	178	-175.9	0	0	112.1	H206 L214	H206-E210 PolarHBondContact O-N 2.78Å; E210-L214 WeakPolarHBondContact O-CG 3.49Å; E210-L214 PolarHBondContact O-N 3.43Å
211	H	91.2	Very high	82.5	Confident	37 Å²	37	82.4 Å²	82.4	17%	0.171	41%	0.411	C	S	.	.	H	α-helix	trans	-70.7	-39.4	177.6	171.3	61.6	0	0	0	113.8	C195 C198 I207 L208 Q209 L214 H215	C195-H211 PolarHBondContact SG-CD2 3.32Å; C195-H211 PolarHBondContact SG-NE2 3.39Å; C198-H211 PolarHBondContact SG-NE2 3Å; I207-H211 VanDerWaalsContact O-CB 3.25Å; I207-H211 WeakPolarHBondContact O-CB 3.25Å; I207-H211 PolarHBondContact O-N 3.41Å; I207-H211 VanDerWaalsContact O-N 3.07Å; L208-H211 PolarHBondContact O-N 3.07Å; Q209-H211 PolarHBondContact O-N 3.01Å; H211-L214 PolarHBondContact O-N 3.32Å; H211-H215 AromaticContact CE1-CD2 3.67Å; H211-H215 AromaticContact CE1-NE2 3.32Å; H211-H215 PolarHBondContact CE1-NE2 3.33Å; H211-H215 VanDerWaalsContact CE1-NE2 3.32Å; H211-H215 AromaticContact NE2-CD2 3.62Å; H211-H215 AromaticContact NE2-NE2 3.43Å; H211-H215 PolarHBondContact NE2-NE2 3.37Å; H211-H215 PolarHBondContact O-N 3.3Å
212	V	90.4	Very high	80.8	Confident	28 Å²	28	83.2 Å²	83.2	17%	0.17	41%	0.412	C	S	.	.	H	α-helix	trans	-69.5	-39.1	174.4	169.7	0	0	0	0	110.4	L208 Q209 L214 H215 L216	L208-V212 HydrophobicContact CD1-CG2 3.69Å; L208-V212 HydrophobicContact CG-CG2 4.11Å; L208-V212 WeakPolarHBondContact O-CB 3.44Å; L208-V212 WeakPolarHBondContact O-CG2 3.32Å; L208-V212 PolarHBondContact O-N 3.36Å; Q209-V212 PolarHBondContact O-N 2.94Å; V212-L214 VanDerWaalsContact C-N 3.3Å; V212-L214 PolarHBondContact O-N 3.36Å; V212-H215 WeakPolarHBondContact O-CA 3.23Å; V212-H215 WeakPolarHBondContact O-CB 3.49Å; V212-H215 PolarHBondContact O-N 3.12Å; V212-L216 HydrophobicContact CG1-CD1 4.23Å; V212-L216 HydrophobicContact CG1-CG 4.44Å; V212-L216 WeakPolarHBondContact O-CG 3.45Å; V212-L216 PolarHBondContact O-N 3.12Å
213	D	90.7	Very high	79	Confident	59 Å²	59	88.9 Å²	88.9	32%	0.316	44%	0.438	S	S	.	.	H	α-helix	trans	-61.2	-39.8	175.4	-67.7	-24.8	0	0	0	110.8	Q209 H215 L216 E217	Q209-D213 VanDerWaalsContact NE2-CG 3.33Å; Q209-D213 PolarHBondContact NE2-OD1 2.85Å; Q209-D213 PolarHBondContact NE2-OD2 3.17Å; Q209-D213 WeakPolarHBondContact O-CB 3.35Å; Q209-D213 PolarHBondContact O-N 3.31Å; D213-H215 PolarHBondContact O-N 3.49Å; D213-L216 CarbonylContact O-C 3.6Å; D213-L216 PolarHBondContact O-N 2.78Å; D213-L216 VanDerWaalsContact O-N 3.11Å; D213-E217 WeakPolarHBondContact O-CB 3.32Å; D213-E217 WeakPolarHBondContact O-CG 3.48Å; D213-E217 PolarHBondContact O-N 3Å
214	L	88.2	Confident	77.2	Confident	109 Å²	109	88.2 Å²	88.2	57%	0.571	45%	0.447	S	S	*	.	H	α-helix	trans	-60.6	-39.6	171.1	-73.7	170.6	0	0	0	113	E210 H211 V212 E217 E218	E210-L214 WeakPolarHBondContact O-CG 3.49Å; E210-L214 PolarHBondContact O-N 3.43Å; H211-L214 PolarHBondContact O-N 3.32Å; V212-L214 VanDerWaalsContact C-N 3.3Å; V212-L214 PolarHBondContact O-N 3.36Å; L214-E217 PolarHBondContact O-N 2.88Å; L214-E218 VanDerWaalsContact O-CB 3.25Å; L214-E218 WeakPolarHBondContact O-CB 3.49Å; L214-E218 PolarHBondContact O-N 3.43Å
215	H	88.2	Confident	75.5	Confident	38 Å²	38	92.3 Å²	92.3	18%	0.176	47%	0.466	C	S	.	.	H	α-helix	trans	-65.4	-36.9	172.4	-81.6	-53.5	0	0	0	112.4	M197 C198 H211 V212 D213 N219	M197-H215 HydrophobicContact CB-CB 4.48Å; M197-H215 HydrophobicContact CG-CB 4.36Å; C198-H215 PolarHBondContact SG-NE2 3.47Å; C198-H215 VanDerWaalsContact SG-NE2 3.42Å; H211-H215 AromaticContact CE1-CD2 3.67Å; H211-H215 AromaticContact CE1-NE2 3.32Å; H211-H215 PolarHBondContact CE1-NE2 3.33Å; H211-H215 VanDerWaalsContact CE1-NE2 3.32Å; H211-H215 AromaticContact NE2-CD2 3.62Å; H211-H215 AromaticContact NE2-NE2 3.43Å; H211-H215 PolarHBondContact NE2-NE2 3.37Å; H211-H215 PolarHBondContact O-N 3.3Å; V212-H215 WeakPolarHBondContact O-CA 3.23Å; V212-H215 WeakPolarHBondContact O-CB 3.49Å; V212-H215 PolarHBondContact O-N 3.12Å; D213-H215 PolarHBondContact O-N 3.49Å; H215-N219 VanDerWaalsContact O-CB 3.25Å; H215-N219 WeakPolarHBondContact O-CB 3.43Å; H215-N219 VanDerWaalsContact O-CG 3.26Å; H215-N219 PolarHBondContact O-N 2.93Å; H215-N219 PolarHBondContact O-ND2 2.68Å
216	L	83.9	Confident	73.9	Confident	93 Å²	93	91.3 Å²	91.3	49%	0.487	47%	0.468	S	S	.	.	H	α-helix	trans	-70.3	-40.1	176.9	-66.4	173.7	0	0	0	111.7	V212 D213 S220	V212-L216 HydrophobicContact CG1-CD1 4.23Å; V212-L216 HydrophobicContact CG1-CG 4.44Å; V212-L216 WeakPolarHBondContact O-CG 3.45Å; V212-L216 PolarHBondContact O-N 3.12Å; D213-L216 CarbonylContact O-C 3.6Å; D213-L216 PolarHBondContact O-N 2.78Å; D213-L216 VanDerWaalsContact O-N 3.11Å; L216-S220 WeakPolarHBondContact O-CB 3.5Å; L216-S220 PolarHBondContact O-N 3.48Å; L216-S220 PolarHBondContact O-OG 3.42Å
217	E	79.1	Confident	72.3	Confident	113 Å²	113	96.6 Å²	96.6	53%	0.528	48%	0.483	S	S	.	.	H	α-helix	trans	-66.5	-47.1	174.4	-73.1	-173.1	-179.7	0	0	111.7	D213 L214 N219 S220 F221	D213-E217 WeakPolarHBondContact O-CB 3.32Å; D213-E217 WeakPolarHBondContact O-CG 3.48Å; D213-E217 PolarHBondContact O-N 3Å; L214-E217 PolarHBondContact O-N 2.88Å; E217-N219 VanDerWaalsContact C-N 3.34Å; E217-N219 PolarHBondContact O-N 2.87Å; E217-S220 CarbonylContact O-C 3.57Å; E217-S220 WeakPolarHBondContact O-CA 3.36Å; E217-S220 VanDerWaalsContact O-CB 3.32Å; E217-S220 WeakPolarHBondContact O-CB 3.46Å; E217-S220 PolarHBondContact O-N 2.87Å; E217-F221 VanDerWaalsContact O-CD2 3.23Å; E217-F221 WeakPolarHBondContact O-CD2 3.33Å; E217-F221 PolarHBondContact O-N 2.86Å
218	E	71.8	Confident	70.8	Confident	128 Å²	128	96.9 Å²	96.9	60%	0.598	49%	0.488	S	S	*	.	H	α-helix	trans	-59.2	-44.9	176.2	-174.5	173.6	-147.3	0	0	111.1	L214 S220 F221 Q222	L214-E218 VanDerWaalsContact O-CB 3.25Å; L214-E218 WeakPolarHBondContact O-CB 3.49Å; L214-E218 PolarHBondContact O-N 3.43Å; E218-S220 VanDerWaalsContact C-N 3.31Å; E218-S220 PolarHBondContact O-N 3.34Å; E218-F221 PolarHBondContact O-N 3.01Å; E218-Q222 WeakPolarHBondContact O-CB 3.39Å; E218-Q222 PolarHBondContact O-N 3.31Å
219	N	61.7	Low	69.1	Low	71 Å²	71	104 Å²	104	38%	0.38	52%	0.52	S	S	.	.	H	α-helix	trans	-63.4	-34	172.2	-77.4	-50.9	0	0	0	112.6	H215 E217 Q222 Q223	H215-N219 VanDerWaalsContact O-CB 3.25Å; H215-N219 WeakPolarHBondContact O-CB 3.43Å; H215-N219 VanDerWaalsContact O-CG 3.26Å; H215-N219 PolarHBondContact O-N 2.93Å; H215-N219 PolarHBondContact O-ND2 2.68Å; E217-N219 VanDerWaalsContact C-N 3.34Å; E217-N219 PolarHBondContact O-N 2.87Å; N219-Q222 PolarHBondContact O-N 2.86Å; N219-Q223 VanDerWaalsContact O-CB 3.23Å; N219-Q223 WeakPolarHBondContact O-CB 3.46Å; N219-Q223 VanDerWaalsContact O-CG 3.27Å; N219-Q223 WeakPolarHBondContact O-CG 3.36Å; N219-Q223 PolarHBondContact O-N 3.16Å
220	S	59.8	Low	67.4	Low	72 Å²	72	105 Å²	105	50%	0.503	53%	0.534	S	S	.	.	H	α-helix	trans	-67.9	-40.3	175.5	-60.7	0	0	0	0	112.1	L216 E217 E218 G224	L216-S220 WeakPolarHBondContact O-CB 3.5Å; L216-S220 PolarHBondContact O-N 3.48Å; L216-S220 PolarHBondContact O-OG 3.42Å; E217-S220 CarbonylContact O-C 3.57Å; E217-S220 WeakPolarHBondContact O-CA 3.36Å; E217-S220 VanDerWaalsContact O-CB 3.32Å; E217-S220 WeakPolarHBondContact O-CB 3.46Å; E217-S220 PolarHBondContact O-N 2.87Å; E218-S220 VanDerWaalsContact C-N 3.31Å; E218-S220 PolarHBondContact O-N 3.34Å; S220-G224 PolarHBondContact O-N 3.19Å
221	F	52.9	Low	66.5	Low	168 Å²	168	101.8 Å²	101.8	74%	0.737	53%	0.526	S	S	*	.	H	α-helix	trans	-67.5	-37.3	173.7	-80.9	-73.4	0	0	0	111.7	E217 E218 G224	E217-F221 VanDerWaalsContact O-CD2 3.23Å; E217-F221 WeakPolarHBondContact O-CD2 3.33Å; E217-F221 PolarHBondContact O-N 2.86Å; E218-F221 PolarHBondContact O-N 3.01Å; F221-G224 PolarHBondContact O-N 3.36Å
222	Q	52.6	Low	66.2	Low	130 Å²	130	102.1 Å²	102.1	61%	0.607	54%	0.54	S	S	*	.	H	α-helix	trans	-72.5	-39.3	176.5	-153.2	63.5	47.3	0	0	112.2	E218 N219 G224 M225	E218-Q222 WeakPolarHBondContact O-CB 3.39Å; E218-Q222 PolarHBondContact O-N 3.31Å; N219-Q222 PolarHBondContact O-N 2.86Å; Q222-G224 PolarHBondContact O-N 3.33Å; Q222-M225 PolarHBondContact O-N 2.88Å; Q222-M225 VanDerWaalsContact O-N 3.08Å
223	Q	48.6	Very low	66.1	Low	124 Å²	124	106.4 Å²	106.4	58%	0.579	56%	0.562	S	S	*	*	H	α-helix	trans	-65.8	-19.6	170.2	-78.2	-179.2	-7.3	0	0	113.1	N219 M225 D226	N219-Q223 VanDerWaalsContact O-CB 3.23Å; N219-Q223 WeakPolarHBondContact O-CB 3.46Å; N219-Q223 VanDerWaalsContact O-CG 3.27Å; N219-Q223 WeakPolarHBondContact O-CG 3.36Å; N219-Q223 PolarHBondContact O-N 3.16Å; Q223-M225 PolarHBondContact O-N 3.25Å; Q223-D226 PolarHBondContact O-N 2.85Å
224	G	47.4	Very low	66	Low	64 Å²	64	109.8 Å²	109.8	66%	0.66	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-19.1	167.3	0	0	0	0	0	113.9	S220 F221 Q222	S220-G224 PolarHBondContact O-N 3.19Å; F221-G224 PolarHBondContact O-N 3.36Å; Q222-G224 PolarHBondContact O-N 3.33Å
225	M	50.2	Low	66.2	Low	159 Å²	159	111.3 Å²	111.3	78%	0.783	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	-22.7	171.3	-62.4	-174.2	70.4	0	0	113.6	Q222 Q223 R227	Q222-M225 PolarHBondContact O-N 2.88Å; Q222-M225 VanDerWaalsContact O-N 3.08Å; Q223-M225 PolarHBondContact O-N 3.25Å; M225-R227 PolarHBondContact O-N 3.46Å; M225-R227 VanDerWaalsContact O-N 3.14Å
226	D	48.8	Very low	66.4	Low	91 Å²	91	113.8 Å²	113.8	49%	0.487	60%	0.598	S	S	.	*			trans	-92.2	64.6	-175.7	-151.8	-11.8	0	0	0	113.4	Q223 V228	Q223-D226 PolarHBondContact O-N 2.85Å; D226-V228 PolarHBondContact O-N 3.45Å; D226-V228 WeakPolarHBondContact OD1-CB 3.42Å; D226-V228 WeakPolarHBondContact OD1-CG2 3.4Å
227	R	52.9	Low	66.9	Low	240 Å²	240	112 Å²	112	91%	0.906	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	10.7	176.5	-129.5	-179.1	-172.9	-156.3	1.4	114.1	M225	M225-R227 PolarHBondContact O-N 3.46Å; M225-R227 VanDerWaalsContact O-N 3.14Å
228	V	56.7	Low	67.6	Low	91 Å²	91	112.8 Å²	112.8	55%	0.552	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-24.4	-165.4	-174.3	0	0	0	0	112.7	D226 C230 S231	D226-V228 PolarHBondContact O-N 3.45Å; D226-V228 WeakPolarHBondContact OD1-CB 3.42Å; D226-V228 WeakPolarHBondContact OD1-CG2 3.4Å; V228-C230 PolarHBondContact O-N 3.01Å; V228-C230 VanDerWaalsContact O-N 3.11Å; V228-S231 VanDerWaalsContact O-CB 3.26Å; V228-S231 WeakPolarHBondContact O-CB 3.43Å; V228-S231 PolarHBondContact O-N 3.06Å; V228-S231 PolarHBondContact O-OG 3.08Å
229	Q	54.8	Low	68.8	Low	168 Å²	168	112.6 Å²	112.6	79%	0.785	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-2.7	-169.6	-152	160.5	5.2	0	0	115.7
230	C	55.8	Low	70.5	Confident	86 Å²	86	114.4 Å²	114.4	58%	0.581	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.7	24.1	165.8	-71	0	0	0	0	113.5	V228 G232 D233 L234	V228-C230 PolarHBondContact O-N 3.01Å; V228-C230 VanDerWaalsContact O-N 3.11Å; C230-G232 VanDerWaalsContact C-N 3.32Å; C230-G232 PolarHBondContact O-N 3.28Å; C230-D233 PolarHBondContact O-N 3.45Å; C230-L234 VanDerWaalsContact O-CB 3.29Å; C230-L234 WeakPolarHBondContact O-CB 3.48Å; C230-L234 PolarHBondContact O-N 2.86Å
231	S	71.1	Confident	72.3	Confident	68 Å²	68	115.7 Å²	115.7	48%	0.476	61%	0.606	S	S	.	*	H	α-helix	trans	-58.6	-39	-179.7	47.9	0	0	0	0	113.5	V228 Q235	V228-S231 VanDerWaalsContact O-CB 3.26Å; V228-S231 WeakPolarHBondContact O-CB 3.43Å; V228-S231 PolarHBondContact O-N 3.06Å; V228-S231 PolarHBondContact O-OG 3.08Å; S231-Q235 VanDerWaalsContact O-CB 3.25Å; S231-Q235 WeakPolarHBondContact O-CB 3.48Å; S231-Q235 PolarHBondContact O-N 2.69Å; S231-Q235 VanDerWaalsContact O-N 3.13Å
232	G	84.5	Confident	74.4	Confident	45 Å²	45	113.5 Å²	113.5	46%	0.464	60%	0.598	S	S	.	*	H	α-helix	trans	-64.1	-54.3	176.8	0	0	0	0	0	113.3	C230 L234 Q235 L236	C230-G232 VanDerWaalsContact C-N 3.32Å; C230-G232 PolarHBondContact O-N 3.28Å; G232-L234 PolarHBondContact O-N 3.02Å; G232-Q235 PolarHBondContact O-N 3.33Å; G232-L236 WeakPolarHBondContact O-CB 3.44Å; G232-L236 PolarHBondContact O-N 3.46Å
233	D	89.6	Confident	76.5	Confident	118 Å²	118	112.1 Å²	112.1	63%	0.631	59%	0.592	S	S	*	*	H	α-helix	trans	-67	-37.9	-176.5	-66.8	-11.7	0	0	0	112.3	C230 Q235 L236 A237	C230-D233 PolarHBondContact O-N 3.45Å; D233-Q235 VanDerWaalsContact C-N 3.34Å; D233-L236 PolarHBondContact O-N 3.28Å; D233-A237 WeakPolarHBondContact O-CB 3.49Å; D233-A237 PolarHBondContact O-N 2.84Å
234	L	86.9	Confident	78.9	Confident	130 Å²	130	112 Å²	112	68%	0.681	59%	0.591	S	S	*	*	H	α-helix	trans	-63.7	-40.5	174.1	-178.7	61.8	0	0	0	111.7	C230 G232 H238	C230-L234 VanDerWaalsContact O-CB 3.29Å; C230-L234 WeakPolarHBondContact O-CB 3.48Å; C230-L234 PolarHBondContact O-N 2.86Å; G232-L234 PolarHBondContact O-N 3.02Å; L234-H238 WeakPolarHBondContact O-CB 3.21Å; L234-H238 PolarHBondContact O-N 3.43Å; L234-H238 VanDerWaalsContact O-N 3.09Å
235	Q	92.2	Very high	81.3	Confident	141 Å²	141	110.5 Å²	110.5	66%	0.659	57%	0.568	S	S	*	*	H	α-helix	trans	-69	-39.6	176.8	-175.5	166.7	-1.1	0	0	111.7	S231 G232 D233 H238 Q239	S231-Q235 VanDerWaalsContact O-CB 3.25Å; S231-Q235 WeakPolarHBondContact O-CB 3.48Å; S231-Q235 PolarHBondContact O-N 2.69Å; S231-Q235 VanDerWaalsContact O-N 3.13Å; G232-Q235 PolarHBondContact O-N 3.33Å; D233-Q235 VanDerWaalsContact C-N 3.34Å; Q235-H238 PolarHBondContact O-N 2.81Å; Q235-Q239 WeakPolarHBondContact O-CB 3.39Å; Q235-Q239 PolarHBondContact O-N 3.48Å
236	L	93.8	Very high	83.5	Confident	89 Å²	89	110.6 Å²	110.6	47%	0.466	56%	0.56	S	S	.	*	H	α-helix	trans	-63.2	-46.8	174.7	178.4	60	0	0	0	111.6	G232 D233 H238 Q239 L240	G232-L236 WeakPolarHBondContact O-CB 3.44Å; G232-L236 PolarHBondContact O-N 3.46Å; D233-L236 PolarHBondContact O-N 3.28Å; L236-H238 VanDerWaalsContact C-N 3.34Å; L236-H238 PolarHBondContact O-N 3.32Å; L236-Q239 PolarHBondContact O-N 3.42Å; L236-L240 HydrophobicContact CD1-CD1 4.15Å; L236-L240 HydrophobicContact CD1-CG 4.13Å; L236-L240 HydrophobicContact CG-CD1 4.08Å; L236-L240 HydrophobicContact CG-CG 4.47Å; L236-L240 WeakPolarHBondContact O-CG 3.49Å; L236-L240 PolarHBondContact O-N 2.92Å
237	A	93.8	Very high	85.9	Confident	57 Å²	57	113.7 Å²	113.7	47%	0.471	57%	0.569	S	S	.	*	H	α-helix	trans	-58.7	-44.8	176.9	0	0	0	0	0	111.7	D233 Q239 L240 Q241	D233-A237 WeakPolarHBondContact O-CB 3.49Å; D233-A237 PolarHBondContact O-N 2.84Å; A237-Q239 PolarHBondContact O-N 3.13Å; A237-L240 PolarHBondContact O-N 3.11Å; A237-Q241 WeakPolarHBondContact O-CB 3.39Å; A237-Q241 PolarHBondContact O-N 3.05Å
238	H	94.4	Very high	88	Confident	129 Å²	129	107.6 Å²	107.6	60%	0.597	55%	0.546	S	S	*	.	H	α-helix	trans	-64.5	-38	176	-173.7	-80.4	0	0	0	112.6	L234 Q235 L236 Q242	L234-H238 WeakPolarHBondContact O-CB 3.21Å; L234-H238 PolarHBondContact O-N 3.43Å; L234-H238 VanDerWaalsContact O-N 3.09Å; Q235-H238 PolarHBondContact O-N 2.81Å; L236-H238 VanDerWaalsContact C-N 3.34Å; L236-H238 PolarHBondContact O-N 3.32Å; H238-Q242 WeakPolarHBondContact O-CB 3.41Å; H238-Q242 PolarHBondContact O-N 3.5Å
239	Q	96.8	Very high	89.9	Confident	123 Å²	123	110.1 Å²	110.1	58%	0.575	55%	0.546	S	S	*	.	H	α-helix	trans	-66.7	-44.2	176.6	-177.6	177.7	-12.1	0	0	112.1	Q235 L236 A237 Q242 E243	Q235-Q239 WeakPolarHBondContact O-CB 3.39Å; Q235-Q239 PolarHBondContact O-N 3.48Å; L236-Q239 PolarHBondContact O-N 3.42Å; A237-Q239 PolarHBondContact O-N 3.13Å; Q239-Q242 PolarHBondContact O-N 3.25Å; Q239-E243 PolarHBondContact O-N 3.46Å
240	L	97.1	Very high	92	Very high	110 Å²	110	106 Å²	106	58%	0.576	54%	0.536	S	S	*	.	H	α-helix	trans	-62.6	-45.9	177.5	-70.8	172.8	0	0	0	111.3	L236 A237 Q242 E243 E244	L236-L240 HydrophobicContact CD1-CD1 4.15Å; L236-L240 HydrophobicContact CD1-CG 4.13Å; L236-L240 HydrophobicContact CG-CD1 4.08Å; L236-L240 HydrophobicContact CG-CG 4.47Å; L236-L240 WeakPolarHBondContact O-CG 3.49Å; L236-L240 PolarHBondContact O-N 2.92Å; A237-L240 PolarHBondContact O-N 3.11Å; L240-Q242 VanDerWaalsContact C-N 3.33Å; L240-Q242 PolarHBondContact O-N 3.42Å; L240-E243 PolarHBondContact O-N 3.06Å; L240-E244 PolarHBondContact O-N 3.43Å
241	Q	97.1	Very high	94	Very high	98 Å²	98	105.2 Å²	105.2	46%	0.458	52%	0.523	S	S	.	.	H	α-helix	trans	-56.7	-46	174.8	-176.9	62.7	56.3	0	0	111.6	A237 E243 E244 D245	A237-Q241 WeakPolarHBondContact O-CB 3.39Å; A237-Q241 PolarHBondContact O-N 3.05Å; Q241-E243 PolarHBondContact O-N 3.21Å; Q241-E244 PolarHBondContact O-N 2.69Å; Q241-D245 VanDerWaalsContact NE2-CG 3.3Å; Q241-D245 PolarHBondContact NE2-OD1 3.43Å; Q241-D245 PolarHBondContact NE2-OD2 3.35Å; Q241-D245 WeakPolarHBondContact O-CB 3.48Å; Q241-D245 VanDerWaalsContact O-CG 3.3Å; Q241-D245 PolarHBondContact O-N 3.46Å
242	Q	97.4	Very high	95.2	Very high	122 Å²	122	106.3 Å²	106.3	57%	0.57	52%	0.521	S	S	*	.	H	α-helix	trans	-64.2	-39.8	-179.7	-177	172.7	60.7	0	0	112.7	H238 Q239 L240 R246	H238-Q242 WeakPolarHBondContact O-CB 3.41Å; H238-Q242 PolarHBondContact O-N 3.5Å; Q239-Q242 PolarHBondContact O-N 3.25Å; L240-Q242 VanDerWaalsContact C-N 3.33Å; L240-Q242 PolarHBondContact O-N 3.42Å; Q242-R246 VanDerWaalsContact O-CB 3.3Å; Q242-R246 WeakPolarHBondContact O-CB 3.46Å; Q242-R246 PolarHBondContact O-N 2.8Å
243	E	97.3	Very high	95.8	Very high	101 Å²	101	106.9 Å²	106.9	47%	0.472	52%	0.518	S	S	.	.	H	α-helix	trans	-73.8	-36.7	178.7	-169.2	56.7	-146.6	0	0	111.8	Q239 L240 Q241 R246 K247	Q239-E243 PolarHBondContact O-N 3.46Å; L240-E243 PolarHBondContact O-N 3.06Å; Q241-E243 PolarHBondContact O-N 3.21Å; E243-R246 PolarHBondContact O-N 2.81Å; E243-R246 IonicContact OE2-NH1 2.86Å; E243-K247 WeakPolarHBondContact O-CB 3.32Å; E243-K247 PolarHBondContact O-N 3.4Å
244	E	97.3	Very high	96.2	Very high	121 Å²	121	106.8 Å²	106.8	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-62.6	-48.3	171.6	-169.2	-175	145.4	0	0	111.5	L240 Q241 R246 K247 R248	L240-E244 PolarHBondContact O-N 3.43Å; Q241-E244 PolarHBondContact O-N 2.69Å; E244-R246 PolarHBondContact O-N 2.96Å; E244-K247 PolarHBondContact O-N 3.24Å; E244-K247 VanDerWaalsContact O-N 3.17Å; E244-R248 WeakPolarHBondContact O-CB 3.38Å; E244-R248 PolarHBondContact O-N 3.02Å
245	D	97.9	Very high	96.7	Very high	34 Å²	34	105.3 Å²	105.3	18%	0.182	50%	0.498	C	S	.	.	H	α-helix	trans	-63	-30	177.4	-74	-33.2	0	0	0	112.4	Q241 R248 R249	Q241-D245 VanDerWaalsContact NE2-CG 3.3Å; Q241-D245 PolarHBondContact NE2-OD1 3.43Å; Q241-D245 PolarHBondContact NE2-OD2 3.35Å; Q241-D245 WeakPolarHBondContact O-CB 3.48Å; Q241-D245 VanDerWaalsContact O-CG 3.3Å; Q241-D245 PolarHBondContact O-N 3.46Å; D245-R248 IonicContact OD1-CZ 2.86Å; D245-R248 IonicContact OD1-NH1 2.73Å; D245-R248 PolarHBondContact OD1-NH1 2.73Å; D245-R248 IonicContact OD1-NH2 3.6Å; D245-R248 PolarHBondContact OD1-NH2 3.48Å; D245-R249 WeakPolarHBondContact O-CG 3.38Å; D245-R249 PolarHBondContact O-N 2.98Å; D245-R249 PolarHBondContact O-NE 3.15Å; D245-R249 PolarHBondContact O-NH2 2.76Å
246	R	97.9	Very high	97	Very high	161 Å²	161	105.1 Å²	105.1	61%	0.608	50%	0.497	S	S	*	.	H	α-helix	trans	-72	-46.6	173.4	-175.7	-174	-175.1	-172.4	2.1	111.2	Q242 E243 E244 R249 S250	Q242-R246 VanDerWaalsContact O-CB 3.3Å; Q242-R246 WeakPolarHBondContact O-CB 3.46Å; Q242-R246 PolarHBondContact O-N 2.8Å; E243-R246 PolarHBondContact O-N 2.81Å; E243-R246 IonicContact OE2-NH1 2.86Å; E244-R246 PolarHBondContact O-N 2.96Å; R246-R249 PolarHBondContact O-N 3.21Å; R246-S250 WeakPolarHBondContact O-CB 3.34Å; R246-S250 PolarHBondContact O-N 3.42Å
247	K	97.8	Very high	97.1	Very high	155 Å²	155	105.3 Å²	105.3	67%	0.674	50%	0.498	S	S	*	.	H	α-helix	trans	-62.7	-44.6	179.2	-173.3	178.4	-179.7	-176.7	0	111.4	E243 E244 S250 E251	E243-K247 WeakPolarHBondContact O-CB 3.32Å; E243-K247 PolarHBondContact O-N 3.4Å; E244-K247 PolarHBondContact O-N 3.24Å; E244-K247 VanDerWaalsContact O-N 3.17Å; K247-S250 PolarHBondContact O-N 2.82Å; K247-E251 WeakPolarHBondContact O-CB 3.06Å; K247-E251 PolarHBondContact O-N 3.17Å
248	R	97.9	Very high	97.3	Very high	112 Å²	112	106 Å²	106	42%	0.423	49%	0.491	S	S	.	.	H	α-helix	trans	-56.8	-53.8	175.8	-172	174.8	68.2	-109.4	-5.5	111.1	E244 D245 S250 E251 E252	E244-R248 WeakPolarHBondContact O-CB 3.38Å; E244-R248 PolarHBondContact O-N 3.02Å; D245-R248 IonicContact OD1-CZ 2.86Å; D245-R248 IonicContact OD1-NH1 2.73Å; D245-R248 PolarHBondContact OD1-NH1 2.73Å; D245-R248 IonicContact OD1-NH2 3.6Å; D245-R248 PolarHBondContact OD1-NH2 3.48Å; R248-S250 VanDerWaalsContact C-N 3.33Å; R248-S250 PolarHBondContact O-N 2.85Å; R248-E251 PolarHBondContact O-N 3.24Å; R248-E251 VanDerWaalsContact O-N 3.15Å; R248-E252 HydrophobicContact CG-CG 4.46Å; R248-E252 WeakPolarHBondContact CG-OE1 3.25Å; R248-E252 IonicContact NE-OE1 3.83Å; R248-E252 WeakPolarHBondContact O-CG 3.46Å; R248-E252 PolarHBondContact O-N 3.2Å
249	R	97.5	Very high	97.5	Very high	145 Å²	145	104.5 Å²	104.5	55%	0.547	48%	0.484	S	S	.	.	H	α-helix	trans	-61	-36.5	177.7	-77.5	177.7	-71.6	-159.3	-2.9	113.9	D245 R246 E251 E252 S253	D245-R249 WeakPolarHBondContact O-CG 3.38Å; D245-R249 PolarHBondContact O-N 2.98Å; D245-R249 PolarHBondContact O-NE 3.15Å; D245-R249 PolarHBondContact O-NH2 2.76Å; R246-R249 PolarHBondContact O-N 3.21Å; R249-E251 VanDerWaalsContact C-N 3.35Å; R249-E252 WeakPolarHBondContact CA-OE2 3.38Å; R249-S253 WeakPolarHBondContact O-CB 3.43Å; R249-S253 PolarHBondContact O-N 2.83Å
250	S	97.4	Very high	97.5	Very high	82 Å²	82	105.3 Å²	105.3	57%	0.573	49%	0.486	S	S	*	.	H	α-helix	trans	-68.3	-35.5	177	-170.6	0	0	0	0	112.4	R246 K247 R248 R254	R246-S250 WeakPolarHBondContact O-CB 3.34Å; R246-S250 PolarHBondContact O-N 3.42Å; K247-S250 PolarHBondContact O-N 2.82Å; R248-S250 VanDerWaalsContact C-N 3.33Å; R248-S250 PolarHBondContact O-N 2.85Å; S250-R254 WeakPolarHBondContact O-CB 3.14Å; S250-R254 PolarHBondContact O-N 2.81Å; S250-R254 VanDerWaalsContact O-N 3.15Å
251	E	97.4	Very high	97.5	Very high	69 Å²	69	105.4 Å²	105.4	32%	0.322	48%	0.484	S	S	.	.	H	α-helix	trans	-76.1	-42.7	177.8	179.7	57.4	-163.3	0	0	111.3	K247 R248 R249 S253 R254 Q255	K247-E251 WeakPolarHBondContact O-CB 3.06Å; K247-E251 PolarHBondContact O-N 3.17Å; R248-E251 PolarHBondContact O-N 3.24Å; R248-E251 VanDerWaalsContact O-N 3.15Å; R249-E251 VanDerWaalsContact C-N 3.35Å; E251-S253 PolarHBondContact O-N 3.07Å; E251-R254 PolarHBondContact O-N 2.83Å; E251-R254 IonicContact OE1-CZ 2.61Å; E251-R254 IonicContact OE1-NE 2.68Å; E251-R254 IonicContact OE1-NH2 3.93Å; E251-R254 PolarHBondContact OE1-NH2 3.47Å; E251-R254 IonicContact OE2-CZ 3.06Å; E251-R254 VanDerWaalsContact OE2-CZ 3.29Å; E251-R254 IonicContact OE2-NE 2.6Å; E251-R254 PolarHBondContact OE2-NE 3.06Å; E251-R254 IonicContact OE2-NH2 2.69Å; E251-R254 PolarHBondContact OE2-NH2 3.37Å; E251-Q255 WeakPolarHBondContact O-CG 3.3Å; E251-Q255 PolarHBondContact O-N 3.28Å; E251-Q255 PolarHBondContact OE1-NE2 3.25Å
252	E	97.4	Very high	97.5	Very high	91 Å²	91	106.1 Å²	106.1	43%	0.425	49%	0.485	S	S	.	.	H	α-helix	trans	-53.6	-51.9	171	-72.2	164.8	168.2	0	0	110.8	R248 R249 R254 Q255 E256	R248-E252 HydrophobicContact CG-CG 4.46Å; R248-E252 WeakPolarHBondContact CG-OE1 3.25Å; R248-E252 IonicContact NE-OE1 3.83Å; R248-E252 WeakPolarHBondContact O-CG 3.46Å; R248-E252 PolarHBondContact O-N 3.2Å; R249-E252 WeakPolarHBondContact CA-OE2 3.38Å; E252-R254 VanDerWaalsContact C-N 3.32Å; E252-R254 PolarHBondContact O-N 3.16Å; E252-Q255 PolarHBondContact O-N 2.92Å; E252-E256 WeakPolarHBondContact O-CG 3.37Å; E252-E256 PolarHBondContact O-N 3.41Å
253	S	97.8	Very high	97.4	Very high	57 Å²	57	105.4 Å²	105.4	40%	0.399	49%	0.485	S	S	.	.	H	α-helix	trans	-63.1	-34.9	178.9	-176.1	0	0	0	0	113.2	R249 E251 I257	R249-S253 WeakPolarHBondContact O-CB 3.43Å; R249-S253 PolarHBondContact O-N 2.83Å; E251-S253 PolarHBondContact O-N 3.07Å; S253-I257 WeakPolarHBondContact O-CD1 3.2Å; S253-I257 VanDerWaalsContact O-CG1 3.28Å; S253-I257 WeakPolarHBondContact O-CG1 3.29Å; S253-I257 PolarHBondContact O-N 2.81Å; S253-I257 VanDerWaalsContact O-N 3.15Å
254	R	97.5	Very high	97.3	Very high	116 Å²	116	105 Å²	105	44%	0.438	48%	0.483	S	S	.	.	H	α-helix	trans	-65.5	-45.1	174.3	-174	177.8	71	91	-5.5	111.2	S250 E251 E252 I257 E258	S250-R254 WeakPolarHBondContact O-CB 3.14Å; S250-R254 PolarHBondContact O-N 2.81Å; S250-R254 VanDerWaalsContact O-N 3.15Å; E251-R254 PolarHBondContact O-N 2.83Å; E251-R254 IonicContact OE1-CZ 2.61Å; E251-R254 IonicContact OE1-NE 2.68Å; E251-R254 IonicContact OE1-NH2 3.93Å; E251-R254 PolarHBondContact OE1-NH2 3.47Å; E251-R254 IonicContact OE2-CZ 3.06Å; E251-R254 VanDerWaalsContact OE2-CZ 3.29Å; E251-R254 IonicContact OE2-NE 2.6Å; E251-R254 PolarHBondContact OE2-NE 3.06Å; E251-R254 IonicContact OE2-NH2 2.69Å; E251-R254 PolarHBondContact OE2-NH2 3.37Å; E252-R254 VanDerWaalsContact C-N 3.32Å; E252-R254 PolarHBondContact O-N 3.16Å; R254-I257 PolarHBondContact O-N 2.95Å; R254-E258 IonicContact CZ-OE1 2.75Å; R254-E258 IonicContact NH1-OE1 3.34Å; R254-E258 PolarHBondContact NH1-OE1 3.4Å; R254-E258 IonicContact NH1-OE2 3.65Å; R254-E258 WeakPolarHBondContact O-CG 3.28Å; R254-E258 PolarHBondContact O-N 2.97Å
255	Q	97.5	Very high	97.3	Very high	98 Å²	98	104.2 Å²	104.2	46%	0.458	48%	0.479	S	S	.	.	H	α-helix	trans	-63.7	-42.9	177.4	-69.3	175.6	14.7	0	0	111.7	E251 E252 I257 E258 E259	E251-Q255 WeakPolarHBondContact O-CG 3.3Å; E251-Q255 PolarHBondContact O-N 3.28Å; E251-Q255 PolarHBondContact OE1-NE2 3.25Å; E252-Q255 PolarHBondContact O-N 2.92Å; Q255-I257 VanDerWaalsContact C-N 3.32Å; Q255-I257 PolarHBondContact O-N 3.22Å; Q255-E258 PolarHBondContact O-N 3.1Å; Q255-E259 WeakPolarHBondContact O-CG 3.38Å; Q255-E259 PolarHBondContact O-N 2.75Å
256	E	97.4	Very high	97.2	Very high	138 Å²	138	108.1 Å²	108.1	65%	0.645	50%	0.5	S	S	*	.	H	α-helix	trans	-57.3	-43	174.5	-74.2	179.4	167.5	0	0	112.4	E252 F260	E252-E256 WeakPolarHBondContact O-CG 3.37Å; E252-E256 PolarHBondContact O-N 3.41Å; E256-F260 VanDerWaalsContact O-CB 3.29Å; E256-F260 WeakPolarHBondContact O-CB 3.38Å; E256-F260 PolarHBondContact O-N 3.38Å
257	I	97.4	Very high	97	Very high	92 Å²	92	105.2 Å²	105.2	47%	0.472	50%	0.496	S	S	.	.	H	α-helix	trans	-66.8	-42.5	177.4	-67.9	165.2	0	0	0	111.1	S253 R254 Q255 F260 Q261	S253-I257 WeakPolarHBondContact O-CD1 3.2Å; S253-I257 VanDerWaalsContact O-CG1 3.28Å; S253-I257 WeakPolarHBondContact O-CG1 3.29Å; S253-I257 PolarHBondContact O-N 2.81Å; S253-I257 VanDerWaalsContact O-N 3.15Å; R254-I257 PolarHBondContact O-N 2.95Å; Q255-I257 VanDerWaalsContact C-N 3.32Å; Q255-I257 PolarHBondContact O-N 3.22Å; I257-F260 PolarHBondContact O-N 3.03Å; I257-Q261 VanDerWaalsContact O-CG 3.31Å; I257-Q261 WeakPolarHBondContact O-CG 3.44Å; I257-Q261 PolarHBondContact O-N 2.6Å
258	E	97.5	Very high	96.8	Very high	71 Å²	71	102.6 Å²	102.6	33%	0.332	48%	0.484	S	S	.	.	H	α-helix	trans	-64.3	-43.1	177.4	-74.3	177.3	-155.7	0	0	112.1	R254 Q255 Q261 K262	R254-E258 IonicContact CZ-OE1 2.75Å; R254-E258 IonicContact NH1-OE1 3.34Å; R254-E258 PolarHBondContact NH1-OE1 3.4Å; R254-E258 IonicContact NH1-OE2 3.65Å; R254-E258 WeakPolarHBondContact O-CG 3.28Å; R254-E258 PolarHBondContact O-N 2.97Å; Q255-E258 PolarHBondContact O-N 3.1Å; E258-Q261 PolarHBondContact O-N 3.14Å; E258-K262 VanDerWaalsContact O-CG 3.32Å; E258-K262 WeakPolarHBondContact O-CG 3.28Å; E258-K262 PolarHBondContact O-N 3.46Å
259	E	97.3	Very high	96.6	Very high	98 Å²	98	103.3 Å²	103.3	46%	0.458	49%	0.492	S	S	.	.	H	α-helix	trans	-66	-41.6	174.6	-70.2	-53.2	127.2	0	0	112	Q255 Q261 K262 L263	Q255-E259 WeakPolarHBondContact O-CG 3.38Å; Q255-E259 PolarHBondContact O-N 2.75Å; E259-Q261 VanDerWaalsContact C-N 3.31Å; E259-Q261 PolarHBondContact O-N 3Å; E259-K262 PolarHBondContact O-N 2.93Å; E259-K262 IonicContact OE1-NZ 3.29Å; E259-K262 PolarHBondContact OE1-NZ 2.95Å; E259-L263 WeakPolarHBondContact O-CG 3.43Å; E259-L263 PolarHBondContact O-N 3.46Å
260	F	97.6	Very high	96.5	Very high	141 Å²	141	102.1 Å²	102.1	62%	0.618	49%	0.491	S	S	*	.	H	α-helix	trans	-61.2	-39.7	175.1	-174.1	-97.8	0	0	0	112.2	E256 I257 L263 Q264	E256-F260 VanDerWaalsContact O-CB 3.29Å; E256-F260 WeakPolarHBondContact O-CB 3.38Å; E256-F260 PolarHBondContact O-N 3.38Å; I257-F260 PolarHBondContact O-N 3.03Å; F260-L263 PolarHBondContact O-N 2.94Å; F260-Q264 WeakPolarHBondContact O-CB 3.39Å; F260-Q264 PolarHBondContact O-N 3.3Å
261	Q	96.9	Very high	96.2	Very high	111 Å²	111	101.5 Å²	101.5	52%	0.519	48%	0.481	S	S	.	.	H	α-helix	trans	-64.5	-44.1	174	-73.6	176.4	16.9	0	0	112.2	I257 E258 E259 L263 Q264 E265	I257-Q261 VanDerWaalsContact O-CG 3.31Å; I257-Q261 WeakPolarHBondContact O-CG 3.44Å; I257-Q261 PolarHBondContact O-N 2.6Å; E258-Q261 PolarHBondContact O-N 3.14Å; E259-Q261 VanDerWaalsContact C-N 3.31Å; E259-Q261 PolarHBondContact O-N 3Å; Q261-L263 VanDerWaalsContact C-N 3.34Å; Q261-L263 PolarHBondContact O-N 3.49Å; Q261-Q264 WeakPolarHBondContact O-CB 3.33Å; Q261-Q264 PolarHBondContact O-N 3.36Å; Q261-Q264 VanDerWaalsContact O-N 3.15Å; Q261-E265 PolarHBondContact O-N 3.1Å
262	K	97.1	Very high	95.8	Very high	113 Å²	113	99.8 Å²	99.8	49%	0.491	48%	0.481	S	S	.	.	H	α-helix	trans	-59.1	-44.5	174.9	-69.4	166.8	-162.1	168.8	0	111.6	E258 E259 Q264 E265 L266	E258-K262 VanDerWaalsContact O-CG 3.32Å; E258-K262 WeakPolarHBondContact O-CG 3.28Å; E258-K262 PolarHBondContact O-N 3.46Å; E259-K262 PolarHBondContact O-N 2.93Å; E259-K262 IonicContact OE1-NZ 3.29Å; E259-K262 PolarHBondContact OE1-NZ 2.95Å; K262-Q264 VanDerWaalsContact C-N 3.32Å; K262-Q264 PolarHBondContact O-N 3.16Å; K262-E265 PolarHBondContact O-N 3.32Å; K262-L266 WeakPolarHBondContact O-CB 3.39Å; K262-L266 PolarHBondContact O-N 3.04Å
263	L	96.5	Very high	95.4	Very high	107 Å²	107	99.5 Å²	99.5	56%	0.56	48%	0.482	S	S	*	.	H	α-helix	trans	-62.3	-38.7	175.4	-70.4	172.1	0	0	0	111.9	E259 F260 Q261 L266 L267	E259-L263 WeakPolarHBondContact O-CG 3.43Å; E259-L263 PolarHBondContact O-N 3.46Å; F260-L263 PolarHBondContact O-N 2.94Å; Q261-L263 VanDerWaalsContact C-N 3.34Å; Q261-L263 PolarHBondContact O-N 3.49Å; L263-L266 PolarHBondContact O-N 2.8Å; L263-L267 WeakPolarHBondContact O-CB 3.27Å; L263-L267 PolarHBondContact O-N 3.37Å
264	Q	95.1	Very high	94.8	Very high	92 Å²	92	101 Å²	101	43%	0.43	49%	0.485	S	S	.	.	H	α-helix	trans	-66.1	-40.9	176.4	-161.7	-174	21.8	0	0	112.3	F260 Q261 K262 L267 K268	F260-Q264 WeakPolarHBondContact O-CB 3.39Å; F260-Q264 PolarHBondContact O-N 3.3Å; Q261-Q264 WeakPolarHBondContact O-CB 3.33Å; Q261-Q264 PolarHBondContact O-N 3.36Å; Q261-Q264 VanDerWaalsContact O-N 3.15Å; K262-Q264 VanDerWaalsContact C-N 3.32Å; K262-Q264 PolarHBondContact O-N 3.16Å; Q264-L267 PolarHBondContact O-N 3.35Å; Q264-K268 VanDerWaalsContact O-CG 3.32Å; Q264-K268 WeakPolarHBondContact O-CG 3.4Å; Q264-K268 PolarHBondContact O-N 3.3Å
265	E	95.9	Very high	94.2	Very high	105 Å²	105	105.1 Å²	105.1	49%	0.491	50%	0.5	S	S	.	.	H	α-helix	trans	-67.8	-41.2	174.5	-69.2	-51.1	135.5	0	0	112.5	Q261 K262 L267 K268 H269	Q261-E265 PolarHBondContact O-N 3.1Å; K262-E265 PolarHBondContact O-N 3.32Å; E265-L267 VanDerWaalsContact C-N 3.29Å; E265-L267 PolarHBondContact O-N 3.41Å; E265-K268 PolarHBondContact O-N 3.42Å; E265-K268 IonicContact OE1-NZ 3.16Å; E265-K268 PolarHBondContact OE1-NZ 3.23Å; E265-K268 WeakPolarHBondContact OE2-CD 3.44Å; E265-K268 IonicContact OE2-NZ 2.7Å; E265-H269 WeakPolarHBondContact O-CB 3.1Å; E265-H269 PolarHBondContact O-N 2.79Å
266	L	96	Very high	93.3	Very high	117 Å²	117	108.3 Å²	108.3	61%	0.613	52%	0.517	S	S	*	.	H	α-helix	trans	-58.6	-43	173.5	-167.2	80.8	0	0	0	111.1	K262 L263 H269 F270	K262-L266 WeakPolarHBondContact O-CB 3.39Å; K262-L266 PolarHBondContact O-N 3.04Å; L263-L266 PolarHBondContact O-N 2.8Å; L266-H269 PolarHBondContact O-N 3.41Å; L266-F270 WeakPolarHBondContact O-CB 3.32Å; L266-F270 PolarHBondContact O-N 2.79Å
267	L	95	Very high	92.6	Very high	100 Å²	100	107.2 Å²	107.2	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-65.2	-43	176.7	-176.5	65.5	0	0	0	112	L263 Q264 E265 H269 F270 I271	L263-L267 WeakPolarHBondContact O-CB 3.27Å; L263-L267 PolarHBondContact O-N 3.37Å; Q264-L267 PolarHBondContact O-N 3.35Å; E265-L267 VanDerWaalsContact C-N 3.29Å; E265-L267 PolarHBondContact O-N 3.41Å; L267-H269 VanDerWaalsContact C-N 3.35Å; L267-H269 PolarHBondContact O-N 2.97Å; L267-F270 PolarHBondContact O-N 2.91Å; L267-I271 HydrophobicContact CD1-CD1 4.18Å; L267-I271 HydrophobicContact CD1-CG1 4.45Å; L267-I271 HydrophobicContact CG-CD1 3.91Å; L267-I271 WeakPolarHBondContact O-CB 3.33Å; L267-I271 VanDerWaalsContact O-CG1 3.26Å; L267-I271 WeakPolarHBondContact O-CG1 3.34Å; L267-I271 PolarHBondContact O-N 3.26Å
268	K	93.2	Very high	91.6	Very high	99 Å²	99	108.1 Å²	108.1	43%	0.43	53%	0.527	S	S	.	.	H	α-helix	trans	-58.5	-46.2	173.8	-74.4	167.4	-174.9	171.3	0	111.3	Q264 E265 I271 G272	Q264-K268 VanDerWaalsContact O-CG 3.32Å; Q264-K268 WeakPolarHBondContact O-CG 3.4Å; Q264-K268 PolarHBondContact O-N 3.3Å; E265-K268 PolarHBondContact O-N 3.42Å; E265-K268 IonicContact OE1-NZ 3.16Å; E265-K268 PolarHBondContact OE1-NZ 3.23Å; E265-K268 WeakPolarHBondContact OE2-CD 3.44Å; E265-K268 IonicContact OE2-NZ 2.7Å; K268-I271 PolarHBondContact O-N 2.99Å; K268-G272 PolarHBondContact O-N 2.86Å
269	H	93.9	Very high	90.3	Very high	127 Å²	127	114.3 Å²	114.3	59%	0.588	56%	0.556	S	S	*	*	H	α-helix	trans	-62.3	-45.2	177.7	-176	-110.8	0	0	0	111.8	E265 L266 L267 G272 I273	E265-H269 WeakPolarHBondContact O-CB 3.1Å; E265-H269 PolarHBondContact O-N 2.79Å; L266-H269 PolarHBondContact O-N 3.41Å; L267-H269 VanDerWaalsContact C-N 3.35Å; L267-H269 PolarHBondContact O-N 2.97Å; H269-G272 WeakPolarHBondContact O-CA 3.43Å; H269-G272 PolarHBondContact O-N 2.84Å; H269-G272 VanDerWaalsContact O-N 3.14Å; H269-I273 WeakPolarHBondContact O-CG1 3.47Å; H269-I273 PolarHBondContact O-N 3.19Å
270	F	94.4	Very high	88.3	Confident	121 Å²	121	121.6 Å²	121.6	53%	0.531	59%	0.593	S	S	.	*	H	α-helix	trans	-63.3	-42.3	177.3	-171.5	-112.1	0	0	0	112.8	L266 L267 G272 I273 I274	L266-F270 WeakPolarHBondContact O-CB 3.32Å; L266-F270 PolarHBondContact O-N 2.79Å; L267-F270 PolarHBondContact O-N 2.91Å; F270-G272 VanDerWaalsContact C-N 3.29Å; F270-G272 PolarHBondContact O-N 3.25Å; F270-I273 PolarHBondContact O-N 2.83Å; F270-I274 HydrophobicContact CD1-CD1 3.75Å; F270-I274 HydrophobicContact CE1-CD1 3.44Å; F270-I274 VanDerWaalsContact CE1-CD1 3.44Å; F270-I274 HydrophobicContact CE1-CG1 4.42Å; F270-I274 HydrophobicContact CG-CD1 4.49Å; F270-I274 HydrophobicContact CZ-CD1 3.92Å; F270-I274 WeakPolarHBondContact O-CG1 3.2Å; F270-I274 PolarHBondContact O-N 3.18Å
271	I	92.3	Very high	87.9	Confident	69 Å²	69	120.7 Å²	120.7	35%	0.354	59%	0.592	S	S	.	*	H	α-helix	trans	-62.6	-37.2	172.6	-69.2	166.9	0	0	0	111.1	L267 K268 I274 R275	L267-I271 HydrophobicContact CD1-CD1 4.18Å; L267-I271 HydrophobicContact CD1-CG1 4.45Å; L267-I271 HydrophobicContact CG-CD1 3.91Å; L267-I271 WeakPolarHBondContact O-CB 3.33Å; L267-I271 VanDerWaalsContact O-CG1 3.26Å; L267-I271 WeakPolarHBondContact O-CG1 3.34Å; L267-I271 PolarHBondContact O-N 3.26Å; K268-I271 PolarHBondContact O-N 2.99Å; I271-I274 PolarHBondContact O-N 3.29Å; I271-R275 WeakPolarHBondContact O-CB 3.27Å; I271-R275 WeakPolarHBondContact O-CG 3.34Å; I271-R275 PolarHBondContact O-N 2.96Å
272	G	87.4	Confident	87.4	Confident	32 Å²	32	121.2 Å²	121.2	33%	0.33	60%	0.595	S	S	.	*	H	α-helix	trans	-60.4	-47	173.2	0	0	0	0	0	112.5	K268 H269 F270 R275 M276	K268-G272 PolarHBondContact O-N 2.86Å; H269-G272 WeakPolarHBondContact O-CA 3.43Å; H269-G272 PolarHBondContact O-N 2.84Å; H269-G272 VanDerWaalsContact O-N 3.14Å; F270-G272 VanDerWaalsContact C-N 3.29Å; F270-G272 PolarHBondContact O-N 3.25Å; G272-R275 PolarHBondContact O-N 3.29Å; G272-M276 WeakPolarHBondContact O-CG 3.13Å; G272-M276 PolarHBondContact O-N 3.09Å
273	I	88.9	Confident	86.9	Confident	85 Å²	85	121.6 Å²	121.6	44%	0.436	60%	0.601	S	S	.	*	H	α-helix	trans	-60.5	-48	175.5	-67.6	166.4	0	0	0	110.9	H269 F270 R275 M276 L277	H269-I273 WeakPolarHBondContact O-CG1 3.47Å; H269-I273 PolarHBondContact O-N 3.19Å; F270-I273 PolarHBondContact O-N 2.83Å; I273-R275 VanDerWaalsContact C-N 3.28Å; I273-R275 PolarHBondContact O-N 2.88Å; I273-M276 PolarHBondContact O-N 3.43Å; I273-L277 PolarHBondContact O-N 2.73Å
274	I	86.8	Confident	86.3	Confident	90 Å²	90	122.5 Å²	122.5	46%	0.462	60%	0.604	S	S	.	*	H	α-helix	trans	-58.8	-40.6	178.9	-71	170	0	0	0	111.4	F270 I271 M276 L277	F270-I274 HydrophobicContact CD1-CD1 3.75Å; F270-I274 HydrophobicContact CE1-CD1 3.44Å; F270-I274 VanDerWaalsContact CE1-CD1 3.44Å; F270-I274 HydrophobicContact CE1-CG1 4.42Å; F270-I274 HydrophobicContact CG-CD1 4.49Å; F270-I274 HydrophobicContact CZ-CD1 3.92Å; F270-I274 WeakPolarHBondContact O-CG1 3.2Å; F270-I274 PolarHBondContact O-N 3.18Å; I271-I274 PolarHBondContact O-N 3.29Å; I274-M276 PolarHBondContact O-N 2.81Å; I274-L277 PolarHBondContact O-N 3.48Å
275	R	83.6	Confident	85.7	Confident	201 Å²	201	124.4 Å²	124.4	76%	0.758	61%	0.614	S	S	*	*	H	α-helix	trans	-66.4	-20.5	177.1	-81.2	-178.1	141.1	94.6	0.8	114.5	I271 G272 I273	I271-R275 WeakPolarHBondContact O-CB 3.27Å; I271-R275 WeakPolarHBondContact O-CG 3.34Å; I271-R275 PolarHBondContact O-N 2.96Å; G272-R275 PolarHBondContact O-N 3.29Å; I273-R275 VanDerWaalsContact C-N 3.28Å; I273-R275 PolarHBondContact O-N 2.88Å
276	M	79.9	Confident	85.1	Confident	165 Å²	165	125.7 Å²	125.7	81%	0.813	62%	0.623	S	S	*	*	H	α-helix	trans	-94.5	-5.1	179.1	-66	-66.6	175.9	0	0	113.2	G272 I273 I274	G272-M276 WeakPolarHBondContact O-CG 3.13Å; G272-M276 PolarHBondContact O-N 3.09Å; I273-M276 PolarHBondContact O-N 3.43Å; I274-M276 PolarHBondContact O-N 2.81Å
277	L	81.3	Confident	84.3	Confident	116 Å²	116	126.3 Å²	126.3	61%	0.607	62%	0.623	S	S	*	*	S	Bend	trans	-72.6	132.7	170.3	-73	168.4	0	0	0	109.9	I273 I274 Q279	I273-L277 PolarHBondContact O-N 2.73Å; I274-L277 PolarHBondContact O-N 3.48Å; L277-Q279 PolarHBondContact O-N 2.86Å
278	P	76.1	Confident	83.5	Confident	110 Å²	110	128.3 Å²	128.3	71%	0.714	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-59.5	130.7	174.5	-21.7	32.6	0	0	0	110.8	M280	P278-M280 PolarHBondContact O-N 3.3Å
279	Q	71	Confident	82.6	Confident	201 Å²	201	130.8 Å²	130.8	94%	0.939	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-69.8	120.6	166.2	-63.5	-175.7	25.1	0	0	107.8	L277	L277-Q279 PolarHBondContact O-N 2.86Å
280	M	56.2	Low	81.6	Confident	252 Å²	252	131.1 Å²	131.1	100%	1.241	65%	0.653	S	S	*	*			trans	-88.3	0	174.4	-58.8	-131.4	78.2	0	0	110.8	P278	P278-M280 PolarHBondContact O-N 3.3Å

Retrieved 280 of 280 residues in 47.1 ms (Link to these results)

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