A0A077ZB24_TRITR Loading...

P53 and DNA damage-regulated protein 1

AlphaFold DB , UniProt , Accession A0A077ZB24, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 140 aa.

						>A0A077ZB24_TRITR|A0A077ZB24
MESAGNELLDLIHRAEIVGQDIVRDREKLLELGKKENDGRQALSALRNYTQSSKQASFPDRGQVWFKTGKLMLQVAPTTAEDIIRKQMEMAANEKAELNKRLKEKVGQLYELQGESGRVECFGLNPLDVDEAKALRNFFK
					

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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	61	Low	86.3	Confident	220 Å²	220	104.9 Å²	104.9	100%	1.084	58%	0.577	S	S	*	*				0	-45.5	0	-74.2	-175.4	167.2	0	0	111.4	S3 A4 G5	M1-S3 PolarHBondContact O-N 3.49Å; M1-A4 PolarHBondContact O-N 3.3Å; M1-G5 PolarHBondContact O-N 3.22Å; M1-G5 VanDerWaalsContact O-N 3.16Å
2	E	78.9	Confident	86.9	Confident	170 Å²	170	104.2 Å²	104.2	79%	0.794	57%	0.57	S	S	*	*	H	α-helix	trans	-55.5	-44.2	177.9	-66.8	177.9	175.2	0	0	114.2	A4 G5 N6	E2-A4 PolarHBondContact O-N 3.24Å; E2-G5 PolarHBondContact O-N 3.24Å; E2-N6 PolarHBondContact O-N 3.32Å
3	S	84.7	Confident	87.5	Confident	78 Å²	78	104.6 Å²	104.6	55%	0.545	57%	0.565	S	S	.	*	H	α-helix	trans	-58.1	-46.9	178.2	-166.4	0	0	0	0	113.1	M1 G5 N6 E7	M1-S3 PolarHBondContact O-N 3.49Å; S3-G5 VanDerWaalsContact C-N 3.29Å; S3-G5 PolarHBondContact O-N 2.87Å; S3-N6 PolarHBondContact O-N 3.45Å; S3-E7 WeakPolarHBondContact O-CG 3.41Å; S3-E7 PolarHBondContact O-N 3.3Å; S3-E7 PolarHBondContact OG-OE1 3.37Å
4	A	85.3	Confident	87.9	Confident	62 Å²	62	106.6 Å²	106.6	51%	0.512	56%	0.56	S	S	.	*	H	α-helix	trans	-66.9	-32.5	179.9	0	0	0	0	0	112	M1 E2 L8	M1-A4 PolarHBondContact O-N 3.3Å; E2-A4 PolarHBondContact O-N 3.24Å; A4-L8 WeakPolarHBondContact O-CB 3.35Å; A4-L8 PolarHBondContact O-N 3.34Å; A4-L8 VanDerWaalsContact O-N 3.08Å
5	G	89.1	Confident	88.3	Confident	37 Å²	37	100.9 Å²	100.9	38%	0.381	54%	0.535	S	S	.	.	H	α-helix	trans	-64.7	-42	172.7	0	0	0	0	0	112.4	M1 E2 S3 L8 L9	M1-G5 PolarHBondContact O-N 3.22Å; M1-G5 VanDerWaalsContact O-N 3.16Å; E2-G5 PolarHBondContact O-N 3.24Å; S3-G5 VanDerWaalsContact C-N 3.29Å; S3-G5 PolarHBondContact O-N 2.87Å; G5-L8 PolarHBondContact O-N 3.44Å; G5-L9 WeakPolarHBondContact O-CB 3.21Å; G5-L9 PolarHBondContact O-N 3.02Å
6	N	92.3	Very high	88.7	Confident	99 Å²	99	101.1 Å²	101.1	53%	0.529	53%	0.532	S	S	.	.	H	α-helix	trans	-66	-43.4	176.7	-65.6	-18.3	0	0	0	111.7	E2 S3 L8 L9 D10	E2-N6 PolarHBondContact O-N 3.32Å; S3-N6 PolarHBondContact O-N 3.45Å; N6-L8 VanDerWaalsContact C-N 3.33Å; N6-L8 PolarHBondContact O-N 2.93Å; N6-L9 PolarHBondContact O-N 3.21Å; N6-D10 PolarHBondContact O-N 3.46Å
7	E	90.4	Very high	89.1	Confident	123 Å²	123	99.5 Å²	99.5	58%	0.575	52%	0.523	S	S	*	.	H	α-helix	trans	-60.9	-41.2	176.3	-71.6	168.4	-156.3	0	0	112.4	S3 D10 L11	S3-E7 WeakPolarHBondContact O-CG 3.41Å; S3-E7 PolarHBondContact O-N 3.3Å; S3-E7 PolarHBondContact OG-OE1 3.37Å; E7-D10 PolarHBondContact O-N 3.22Å; E7-L11 PolarHBondContact O-N 2.95Å
8	L	91.1	Very high	89.5	Confident	101 Å²	101	95.3 Å²	95.3	53%	0.529	50%	0.501	S	S	.	.	H	α-helix	trans	-65.5	-43.5	175	178.1	62.1	0	0	0	111.5	A4 G5 N6 D10 L11 I12	A4-L8 WeakPolarHBondContact O-CB 3.35Å; A4-L8 PolarHBondContact O-N 3.34Å; A4-L8 VanDerWaalsContact O-N 3.08Å; G5-L8 PolarHBondContact O-N 3.44Å; N6-L8 VanDerWaalsContact C-N 3.33Å; N6-L8 PolarHBondContact O-N 2.93Å; L8-D10 VanDerWaalsContact C-N 3.31Å; L8-D10 PolarHBondContact O-N 3.1Å; L8-L11 PolarHBondContact O-N 3.29Å; L8-I12 HydrophobicContact CD1-CD1 4.07Å; L8-I12 HydrophobicContact CD1-CG1 4.31Å; L8-I12 HydrophobicContact CG-CD1 3.93Å; L8-I12 WeakPolarHBondContact O-CG1 3.32Å; L8-I12 PolarHBondContact O-N 3.03Å
9	L	93.3	Very high	89.7	Confident	109 Å²	109	91.3 Å²	91.3	57%	0.571	49%	0.485	S	S	*	.	H	α-helix	trans	-61.9	-40.8	177.5	-173.1	64.2	0	0	0	111.2	G5 N6 I12 H13	G5-L9 WeakPolarHBondContact O-CB 3.21Å; G5-L9 PolarHBondContact O-N 3.02Å; N6-L9 PolarHBondContact O-N 3.21Å; L9-I12 PolarHBondContact O-N 2.78Å; L9-H13 VanDerWaalsContact O-CB 3.26Å; L9-H13 WeakPolarHBondContact O-CB 3.37Å; L9-H13 PolarHBondContact O-N 2.87Å
10	D	92.8	Very high	90	Very high	95 Å²	95	91.6 Å²	91.6	51%	0.508	48%	0.484	S	S	.	.	H	α-helix	trans	-65.6	-37.3	175.6	-73.7	-16.3	0	0	0	112.3	N6 E7 L8 R14	N6-D10 PolarHBondContact O-N 3.46Å; E7-D10 PolarHBondContact O-N 3.22Å; L8-D10 VanDerWaalsContact C-N 3.31Å; L8-D10 PolarHBondContact O-N 3.1Å; D10-R14 WeakPolarHBondContact O-CB 3.45Å; D10-R14 VanDerWaalsContact O-CG 3.29Å; D10-R14 WeakPolarHBondContact O-CG 3.49Å; D10-R14 PolarHBondContact O-N 2.77Å; D10-R14 PolarHBondContact O-NE 2.96Å
11	L	91	Very high	90.3	Very high	60 Å²	60	89.4 Å²	89.4	31%	0.314	47%	0.473	S	S	.	.	H	α-helix	trans	-64.6	-48.3	173.5	-176.2	69.3	0	0	0	111.4	E7 L8 H13 R14 A15 L112	E7-L11 PolarHBondContact O-N 2.95Å; L8-L11 PolarHBondContact O-N 3.29Å; L11-H13 VanDerWaalsContact C-N 3.33Å; L11-H13 PolarHBondContact O-N 2.94Å; L11-R14 PolarHBondContact O-N 2.99Å; L11-A15 PolarHBondContact O-N 3.45Å; L11-L112 HydrophobicContact CD1-CD2 3.92Å
12	I	92.9	Very high	91.9	Very high	96 Å²	96	79.4 Å²	79.4	49%	0.492	42%	0.423	S	S	.	.	H	α-helix	trans	-61.4	-43.7	177.9	-67.7	167.9	0	0	0	110.3	L8 L9 R14 A15 E16	L8-I12 HydrophobicContact CD1-CD1 4.07Å; L8-I12 HydrophobicContact CD1-CG1 4.31Å; L8-I12 HydrophobicContact CG-CD1 3.93Å; L8-I12 WeakPolarHBondContact O-CG1 3.32Å; L8-I12 PolarHBondContact O-N 3.03Å; L9-I12 PolarHBondContact O-N 2.78Å; I12-R14 PolarHBondContact O-N 3.49Å; I12-A15 PolarHBondContact O-N 2.65Å; I12-E16 WeakPolarHBondContact O-CB 3.4Å; I12-E16 PolarHBondContact O-N 2.94Å
13	H	94.5	Very high	92.7	Very high	110 Å²	110	75 Å²	75	51%	0.509	41%	0.408	S	S	.	.	H	α-helix	trans	-62.4	-43	178.9	-176.4	52.8	0	0	0	112.1	L9 L11 E16 I17	L9-H13 VanDerWaalsContact O-CB 3.26Å; L9-H13 WeakPolarHBondContact O-CB 3.37Å; L9-H13 PolarHBondContact O-N 2.87Å; L11-H13 VanDerWaalsContact C-N 3.33Å; L11-H13 PolarHBondContact O-N 2.94Å; H13-E16 PolarHBondContact O-N 3.47Å; H13-I17 WeakPolarHBondContact NE2-CD1 3.21Å; H13-I17 WeakPolarHBondContact O-CG1 3.36Å; H13-I17 PolarHBondContact O-N 3.32Å
14	R	93.7	Very high	93.3	Very high	133 Å²	133	77.7 Å²	77.7	50%	0.502	41%	0.406	S	S	.	.	H	α-helix	trans	-62.3	-43.8	174.2	-75.1	-177.2	-64.7	163.4	-0.2	112.1	D10 L11 I12 E16 I17 V18 L112	D10-R14 WeakPolarHBondContact O-CB 3.45Å; D10-R14 VanDerWaalsContact O-CG 3.29Å; D10-R14 WeakPolarHBondContact O-CG 3.49Å; D10-R14 PolarHBondContact O-N 2.77Å; D10-R14 PolarHBondContact O-NE 2.96Å; L11-R14 PolarHBondContact O-N 2.99Å; I12-R14 PolarHBondContact O-N 3.49Å; R14-E16 VanDerWaalsContact C-N 3.32Å; R14-E16 PolarHBondContact O-N 3.34Å; R14-I17 PolarHBondContact O-N 2.92Å; R14-V18 WeakPolarHBondContact O-CG2 3.45Å; R14-V18 PolarHBondContact O-N 2.99Å; R14-V18 VanDerWaalsContact O-N 3.12Å; R14-L112 HydrophobicContact CB-CD1 4.34Å; R14-L112 HydrophobicContact CB-CD2 4.46Å
15	A	93.8	Very high	93.8	Very high	21 Å²	21	75.6 Å²	75.6	17%	0.174	39%	0.386	C	S	.	.	H	α-helix	trans	-61.8	-40.6	176.4	0	0	0	0	0	111.8	L11 I12 V18 G19 L109 L112	L11-A15 PolarHBondContact O-N 3.45Å; I12-A15 PolarHBondContact O-N 2.65Å; A15-V18 PolarHBondContact O-N 3.45Å; A15-G19 PolarHBondContact O-N 3.09Å; A15-L109 HydrophobicContact CB-CD1 4.3Å; A15-L112 HydrophobicContact CB-CB 4.36Å; A15-L112 HydrophobicContact CB-CD1 4.49Å
16	E	94.8	Very high	94	Very high	104 Å²	104	80.8 Å²	80.8	49%	0.486	39%	0.394	S	S	.	.	H	α-helix	trans	-63.3	-45.3	176.6	-179.1	61.1	-158.8	0	0	111.9	I12 H13 R14 V18 G19 Q20	I12-E16 WeakPolarHBondContact O-CB 3.4Å; I12-E16 PolarHBondContact O-N 2.94Å; H13-E16 PolarHBondContact O-N 3.47Å; R14-E16 VanDerWaalsContact C-N 3.32Å; R14-E16 PolarHBondContact O-N 3.34Å; E16-V18 PolarHBondContact O-N 2.95Å; E16-G19 PolarHBondContact O-N 3.46Å; E16-Q20 WeakPolarHBondContact O-CG 3.47Å; E16-Q20 PolarHBondContact O-N 2.89Å; E16-Q20 PolarHBondContact OE1-NE2 2.97Å
17	I	96	Very high	94.2	Very high	74 Å²	74	81.4 Å²	81.4	38%	0.379	39%	0.394	S	S	.	.	H	α-helix	trans	-58.5	-48.9	176.8	-69.2	166.4	0	0	0	110.7	H13 R14 G19 Q20 D21	H13-I17 WeakPolarHBondContact NE2-CD1 3.21Å; H13-I17 WeakPolarHBondContact O-CG1 3.36Å; H13-I17 PolarHBondContact O-N 3.32Å; R14-I17 PolarHBondContact O-N 2.92Å; I17-G19 VanDerWaalsContact C-N 3.32Å; I17-G19 PolarHBondContact O-N 3.36Å; I17-Q20 PolarHBondContact O-N 2.8Å; I17-D21 WeakPolarHBondContact O-CB 3.27Å; I17-D21 PolarHBondContact O-N 3.44Å
18	V	94.7	Very high	94.5	Very high	23 Å²	23	79.3 Å²	79.3	14%	0.139	38%	0.383	C	S	.	.	H	α-helix	trans	-62.9	-41.3	178.6	176.2	0	0	0	0	110.7	R14 A15 E16 D21 I22 K105 L109 L112	R14-V18 WeakPolarHBondContact O-CG2 3.45Å; R14-V18 PolarHBondContact O-N 2.99Å; R14-V18 VanDerWaalsContact O-N 3.12Å; A15-V18 PolarHBondContact O-N 3.45Å; E16-V18 PolarHBondContact O-N 2.95Å; V18-D21 PolarHBondContact O-N 3.41Å; V18-I22 HydrophobicContact CG1-CD1 3.93Å; V18-I22 VanDerWaalsContact O-CG1 3.28Å; V18-I22 WeakPolarHBondContact O-CG1 3.45Å; V18-I22 PolarHBondContact O-N 3.31Å; V18-K105 WeakPolarHBondContact CG1-O 3.4Å; V18-L109 HydrophobicContact CB-CD1 4.49Å; V18-L109 HydrophobicContact CG1-CB 3.96Å; V18-L109 HydrophobicContact CG1-CD1 4.41Å; V18-L112 HydrophobicContact CB-CD1 4.49Å; V18-L112 HydrophobicContact CG2-CD1 3.96Å
19	G	94.4	Very high	94.7	Very high	19 Å²	19	75.6 Å²	75.6	20%	0.196	36%	0.364	C	S	.	.	H	α-helix	trans	-59.4	-48.4	175.4	0	0	0	0	0	113	A15 E16 I17 D21 I22 V23	A15-G19 PolarHBondContact O-N 3.09Å; E16-G19 PolarHBondContact O-N 3.46Å; I17-G19 VanDerWaalsContact C-N 3.32Å; I17-G19 PolarHBondContact O-N 3.36Å; G19-D21 VanDerWaalsContact C-N 3.31Å; G19-D21 PolarHBondContact O-N 3.47Å; G19-I22 WeakPolarHBondContact O-CB 3.41Å; G19-I22 PolarHBondContact O-N 3.47Å; G19-V23 WeakPolarHBondContact O-CG2 3.22Å; G19-V23 PolarHBondContact O-N 3.5Å
20	Q	96.4	Very high	94.8	Very high	97 Å²	97	76.1 Å²	76.1	45%	0.453	37%	0.367	S	S	.	.	H	α-helix	trans	-61.7	-40.1	177.3	-73.4	-176.7	7.8	0	0	112.1	E16 I17 V23 R24	E16-Q20 WeakPolarHBondContact O-CG 3.47Å; E16-Q20 PolarHBondContact O-N 2.89Å; E16-Q20 PolarHBondContact OE1-NE2 2.97Å; I17-Q20 PolarHBondContact O-N 2.8Å; Q20-V23 PolarHBondContact O-N 2.98Å; Q20-R24 WeakPolarHBondContact O-CB 3.29Å; Q20-R24 PolarHBondContact O-N 3.4Å
21	D	95.4	Very high	94.9	Very high	47 Å²	47	77 Å²	77	25%	0.251	37%	0.368	S	S	.	.	H	α-helix	trans	-63.8	-40.8	176.2	-85.7	5.8	0	0	0	112.6	I17 V18 G19 R24 D25 K105	I17-D21 WeakPolarHBondContact O-CB 3.27Å; I17-D21 PolarHBondContact O-N 3.44Å; V18-D21 PolarHBondContact O-N 3.41Å; G19-D21 VanDerWaalsContact C-N 3.31Å; G19-D21 PolarHBondContact O-N 3.47Å; D21-R24 PolarHBondContact O-N 3.42Å; D21-R24 IonicContact OD1-CZ 3.79Å; D21-R24 IonicContact OD1-NH1 2.72Å; D21-R24 PolarHBondContact OD1-NH1 2.97Å; D21-R24 IonicContact OD1-NH2 3.93Å; D21-R24 PolarHBondContact OD1-NH2 2.82Å; D21-D25 WeakPolarHBondContact O-CB 3.43Å; D21-D25 PolarHBondContact O-N 2.91Å; D21-K105 HydrophobicContact CB-CD 4.44Å; D21-K105 IonicContact OD2-NZ 3.47Å
22	I	95.2	Very high	95.1	Very high	9 Å²	9	74.5 Å²	74.5	5%	0.046	36%	0.355	C	S	.	.	H	α-helix	trans	-62.3	-43.6	174.7	-72.6	164.9	0	0	0	110.8	V18 G19 D25 R26 L102 K105 V106 L109	V18-I22 HydrophobicContact CG1-CD1 3.93Å; V18-I22 VanDerWaalsContact O-CG1 3.28Å; V18-I22 WeakPolarHBondContact O-CG1 3.45Å; V18-I22 PolarHBondContact O-N 3.31Å; G19-I22 WeakPolarHBondContact O-CB 3.41Å; G19-I22 PolarHBondContact O-N 3.47Å; I22-D25 PolarHBondContact O-N 2.9Å; I22-R26 WeakPolarHBondContact O-CG 3.39Å; I22-R26 PolarHBondContact O-N 3.4Å; I22-L102 HydrophobicContact CB-CD1 4.14Å; I22-L102 HydrophobicContact CG1-CD1 4.15Å; I22-L102 HydrophobicContact CG2-CD1 3.79Å; I22-K105 HydrophobicContact CD1-CB 4.16Å; I22-K105 HydrophobicContact CG1-CB 3.76Å; I22-K105 HydrophobicContact CG1-CD 4.45Å; I22-V106 HydrophobicContact CD1-CG2 3.94Å; I22-V106 HydrophobicContact CG1-CG2 4.34Å; I22-V106 HydrophobicContact CG2-CG2 4.33Å; I22-L109 HydrophobicContact CD1-CB 4.04Å; I22-L109 HydrophobicContact CD1-CD2 3.83Å
23	V	95.5	Very high	95.2	Very high	78 Å²	78	71.1 Å²	71.1	47%	0.473	34%	0.343	S	S	.	.	H	α-helix	trans	-62.7	-46.5	178.1	173.4	0	0	0	0	110.5	G19 Q20 D25 R26 E27	G19-V23 WeakPolarHBondContact O-CG2 3.22Å; G19-V23 PolarHBondContact O-N 3.5Å; Q20-V23 PolarHBondContact O-N 2.98Å; V23-D25 PolarHBondContact O-N 3.02Å; V23-R26 WeakPolarHBondContact O-CB 3.2Å; V23-R26 PolarHBondContact O-N 3.36Å; V23-R26 VanDerWaalsContact O-N 3.14Å; V23-E27 WeakPolarHBondContact O-CG 3.32Å; V23-E27 PolarHBondContact O-N 2.99Å
24	R	96.1	Very high	95.1	Very high	134 Å²	134	72.8 Å²	72.8	51%	0.506	35%	0.349	S	S	.	.	H	α-helix	trans	-60.4	-43.4	177.8	-165.7	-174.1	-53.7	118	7.9	112.3	Q20 D21 R26 E27 K28	Q20-R24 WeakPolarHBondContact O-CB 3.29Å; Q20-R24 PolarHBondContact O-N 3.4Å; D21-R24 PolarHBondContact O-N 3.42Å; D21-R24 IonicContact OD1-CZ 3.79Å; D21-R24 IonicContact OD1-NH1 2.72Å; D21-R24 PolarHBondContact OD1-NH1 2.97Å; D21-R24 IonicContact OD1-NH2 3.93Å; D21-R24 PolarHBondContact OD1-NH2 2.82Å; R24-R26 VanDerWaalsContact C-N 3.31Å; R24-R26 PolarHBondContact O-N 3.32Å; R24-E27 PolarHBondContact O-N 2.9Å; R24-K28 PolarHBondContact O-N 3.32Å
25	D	95.6	Very high	95	Very high	19 Å²	19	72.5 Å²	72.5	10%	0.102	35%	0.351	C	S	.	.	H	α-helix	trans	-64.9	-36.5	176.6	-77.2	-20.7	0	0	0	111.6	D21 I22 V23 K28 L29 L98 L102 K105	D21-D25 WeakPolarHBondContact O-CB 3.43Å; D21-D25 PolarHBondContact O-N 2.91Å; I22-D25 PolarHBondContact O-N 2.9Å; V23-D25 PolarHBondContact O-N 3.02Å; D25-K28 PolarHBondContact O-N 3.31Å; D25-L29 WeakPolarHBondContact O-CG 3.31Å; D25-L29 PolarHBondContact O-N 3.4Å; D25-L98 HydrophobicContact CB-CD2 4.11Å; D25-L102 HydrophobicContact CB-CD1 4.09Å; D25-K105 WeakPolarHBondContact OD2-CE 3.36Å; D25-K105 IonicContact OD2-NZ 3.73Å; D25-K105 PolarHBondContact OD2-NZ 3.48Å
26	R	95.2	Very high	94.9	Very high	145 Å²	145	73.1 Å²	73.1	55%	0.547	35%	0.35	S	S	.	.	H	α-helix	trans	-65.4	-42.5	173.6	-81.3	-177.5	172.1	171.9	0.6	112.9	I22 V23 R24 K28 L29 L30 L102	I22-R26 WeakPolarHBondContact O-CG 3.39Å; I22-R26 PolarHBondContact O-N 3.4Å; V23-R26 WeakPolarHBondContact O-CB 3.2Å; V23-R26 PolarHBondContact O-N 3.36Å; V23-R26 VanDerWaalsContact O-N 3.14Å; R24-R26 VanDerWaalsContact C-N 3.31Å; R24-R26 PolarHBondContact O-N 3.32Å; R26-K28 VanDerWaalsContact C-N 3.29Å; R26-K28 PolarHBondContact O-N 3.45Å; R26-L29 WeakPolarHBondContact O-CB 3.29Å; R26-L29 PolarHBondContact O-N 3.26Å; R26-L30 WeakPolarHBondContact O-CG 3.42Å; R26-L30 PolarHBondContact O-N 2.91Å; R26-L102 HydrophobicContact CG-CD1 4.5Å; R26-L102 HydrophobicContact CG-CD2 4.06Å
27	E	96.4	Very high	94.8	Very high	113 Å²	113	71.6 Å²	71.6	53%	0.528	35%	0.346	S	S	.	.	H	α-helix	trans	-59.2	-44.8	174.9	-71.4	175.9	165.8	0	0	110.8	V23 R24 L29 L30 E31	V23-E27 WeakPolarHBondContact O-CG 3.32Å; V23-E27 PolarHBondContact O-N 2.99Å; R24-E27 PolarHBondContact O-N 2.9Å; E27-L29 VanDerWaalsContact C-N 3.34Å; E27-L29 PolarHBondContact O-N 3.46Å; E27-L30 WeakPolarHBondContact O-CB 3.32Å; E27-L30 PolarHBondContact O-N 3.23Å; E27-L30 VanDerWaalsContact O-N 3.09Å; E27-E31 PolarHBondContact O-N 3.26Å
28	K	96	Very high	94.7	Very high	79 Å²	79	72.4 Å²	72.4	34%	0.343	35%	0.351	S	S	.	.	H	α-helix	trans	-60.7	-40.8	175.4	-171.3	172.9	178.1	-177.8	0	112.6	R24 D25 R26 L30 E31 L32 E94 L98	R24-K28 PolarHBondContact O-N 3.32Å; D25-K28 PolarHBondContact O-N 3.31Å; R26-K28 VanDerWaalsContact C-N 3.29Å; R26-K28 PolarHBondContact O-N 3.45Å; K28-L30 VanDerWaalsContact C-N 3.3Å; K28-L30 PolarHBondContact O-N 3.46Å; K28-E31 PolarHBondContact O-N 2.93Å; K28-L32 HydrophobicContact CG-CD1 4.32Å; K28-L32 WeakPolarHBondContact O-CG 3.36Å; K28-L32 PolarHBondContact O-N 3.46Å; K28-E94 WeakPolarHBondContact CE-OE1 3.44Å; K28-E94 IonicContact NZ-OE1 3.44Å; K28-E94 PolarHBondContact NZ-OE1 3Å; K28-L98 HydrophobicContact CB-CD1 4.33Å; K28-L98 HydrophobicContact CD-CD1 3.89Å; K28-L98 HydrophobicContact CD-CD2 4.24Å; K28-L98 HydrophobicContact CG-CD1 3.85Å
29	L	95.4	Very high	94.6	Very high	23 Å²	23	71.7 Å²	71.7	12%	0.12	35%	0.348	C	S	.	.	H	α-helix	trans	-59.5	-39.9	173.7	-76.7	169.6	0	0	0	112.1	D25 R26 E27 G33 K95 L98 N99 L102	D25-L29 WeakPolarHBondContact O-CG 3.31Å; D25-L29 PolarHBondContact O-N 3.4Å; R26-L29 WeakPolarHBondContact O-CB 3.29Å; R26-L29 PolarHBondContact O-N 3.26Å; E27-L29 VanDerWaalsContact C-N 3.34Å; E27-L29 PolarHBondContact O-N 3.46Å; L29-G33 PolarHBondContact O-N 2.97Å; L29-K95 HydrophobicContact CD2-CB 4.25Å; L29-K95 HydrophobicContact CD2-CG 3.63Å; L29-L98 HydrophobicContact CD2-CB 3.62Å; L29-L98 HydrophobicContact CD2-CD1 4.02Å; L29-L98 HydrophobicContact CD2-CG 4.47Å; L29-L98 HydrophobicContact CG-CB 4.04Å; L29-L98 HydrophobicContact CG-CD1 4.22Å; L29-N99 WeakPolarHBondContact CD1-OD1 3.48Å; L29-L102 HydrophobicContact CD1-CD2 3.99Å
30	L	95.2	Very high	94.6	Very high	120 Å²	120	77.5 Å²	77.5	63%	0.628	36%	0.364	S	S	*	.	H	α-helix	trans	-66.7	-42.8	176.6	-67.5	172.4	0	0	0	111.7	R26 E27 K28 G33 K34	R26-L30 WeakPolarHBondContact O-CG 3.42Å; R26-L30 PolarHBondContact O-N 2.91Å; E27-L30 WeakPolarHBondContact O-CB 3.32Å; E27-L30 PolarHBondContact O-N 3.23Å; E27-L30 VanDerWaalsContact O-N 3.09Å; K28-L30 VanDerWaalsContact C-N 3.3Å; K28-L30 PolarHBondContact O-N 3.46Å; L30-G33 PolarHBondContact O-N 3.46Å; L30-K34 WeakPolarHBondContact O-CG 3.41Å; L30-K34 PolarHBondContact O-N 3Å
31	E	95.4	Very high	94.5	Very high	114 Å²	114	78.5 Å²	78.5	53%	0.533	37%	0.369	S	S	.	.	H	α-helix	trans	-61.8	-43.7	175.6	-69.4	-175.2	174.1	0	0	112.5	E27 K28 G33 K34 K35	E27-E31 PolarHBondContact O-N 3.26Å; K28-E31 PolarHBondContact O-N 2.93Å; E31-G33 VanDerWaalsContact C-N 3.33Å; E31-K34 PolarHBondContact O-N 2.85Å; E31-K35 WeakPolarHBondContact O-CG 3.32Å; E31-K35 PolarHBondContact O-N 3.05Å
32	L	95.1	Very high	94.3	Very high	7 Å²	7	78.1 Å²	78.1	4%	0.037	37%	0.372	C	S	.	.	H	α-helix	trans	-63.6	-40.1	175.5	-69.8	171.2	0	0	0	111.6	K28 K34 K35 E36 A91 E94 L98	K28-L32 HydrophobicContact CG-CD1 4.32Å; K28-L32 WeakPolarHBondContact O-CG 3.36Å; K28-L32 PolarHBondContact O-N 3.46Å; L32-K34 VanDerWaalsContact C-N 3.35Å; L32-K34 PolarHBondContact O-N 2.9Å; L32-K35 PolarHBondContact O-N 2.88Å; L32-E36 PolarHBondContact O-N 3.28Å; L32-A91 HydrophobicContact CD2-CB 4.19Å; L32-E94 HydrophobicContact CD1-CB 4.06Å; L32-E94 HydrophobicContact CD1-CG 3.76Å; L32-E94 WeakPolarHBondContact CD2-OE2 3.46Å; L32-L98 HydrophobicContact CD1-CD1 3.49Å; L32-L98 VanDerWaalsContact CD1-CD1 3.49Å
33	G	93.5	Very high	94.1	Very high	24 Å²	24	79.5 Å²	79.5	25%	0.247	38%	0.38	C	S	.	.	H	α-helix	trans	-61.8	-40	174.4	0	0	0	0	0	113	L29 L30 E31 E36 N37	L29-G33 PolarHBondContact O-N 2.97Å; L30-G33 PolarHBondContact O-N 3.46Å; E31-G33 VanDerWaalsContact C-N 3.33Å; G33-E36 PolarHBondContact O-N 3.49Å; G33-N37 PolarHBondContact O-N 2.95Å
34	K	93.5	Very high	94	Very high	145 Å²	145	78.9 Å²	78.9	63%	0.63	38%	0.379	S	S	*	.	H	α-helix	trans	-62.1	-48.2	173.2	-72.5	175.9	-179.1	177.6	0	111.2	L30 E31 L32 E36 N37 D38	L30-K34 WeakPolarHBondContact O-CG 3.41Å; L30-K34 PolarHBondContact O-N 3Å; E31-K34 PolarHBondContact O-N 2.85Å; L32-K34 VanDerWaalsContact C-N 3.35Å; L32-K34 PolarHBondContact O-N 2.9Å; K34-E36 VanDerWaalsContact C-N 3.29Å; K34-E36 PolarHBondContact O-N 3.34Å; K34-N37 PolarHBondContact O-N 3.19Å; K34-N37 VanDerWaalsContact O-N 3.17Å; K34-D38 PolarHBondContact O-N 2.91Å
35	K	91.5	Very high	93.7	Very high	127 Å²	127	75.3 Å²	75.3	55%	0.552	38%	0.378	S	S	*	.	H	α-helix	trans	-58.6	-39.7	176.7	-70.4	174	-177.1	171.5	0	112.6	E31 L32 D38 G39	E31-K35 WeakPolarHBondContact O-CG 3.32Å; E31-K35 PolarHBondContact O-N 3.05Å; L32-K35 PolarHBondContact O-N 2.88Å; K35-D38 PolarHBondContact O-N 3.32Å; K35-G39 PolarHBondContact O-N 2.99Å
36	E	91.7	Very high	93.4	Very high	34 Å²	34	75 Å²	75	16%	0.159	38%	0.376	C	S	.	.	H	α-helix	trans	-64.7	-45.6	176.4	-171.8	-173.1	176.3	0	0	111.5	L32 G33 K34 G39 R40 M88 K95	L32-E36 PolarHBondContact O-N 3.28Å; G33-E36 PolarHBondContact O-N 3.49Å; K34-E36 VanDerWaalsContact C-N 3.29Å; K34-E36 PolarHBondContact O-N 3.34Å; E36-G39 PolarHBondContact O-N 2.95Å; E36-R40 WeakPolarHBondContact O-CG 3.33Å; E36-R40 PolarHBondContact O-N 3.31Å; E36-R40 IonicContact OE1-CZ 2.64Å; E36-R40 IonicContact OE1-NE 3.28Å; E36-R40 IonicContact OE1-NH2 3.69Å; E36-R40 PolarHBondContact OE1-NH2 3.47Å; E36-M88 HydrophobicContact CG-CE 4.39Å; E36-K95 IonicContact OE2-NZ 2.64Å
37	N	93.5	Very high	93	Very high	72 Å²	72	75.9 Å²	75.9	39%	0.385	38%	0.379	S	S	.	.	H	α-helix	trans	-61.4	-45.4	175.7	174.6	75.4	0	0	0	111.7	G33 K34 G39 R40 Q41	G33-N37 PolarHBondContact O-N 2.95Å; K34-N37 PolarHBondContact O-N 3.19Å; K34-N37 VanDerWaalsContact O-N 3.17Å; N37-G39 VanDerWaalsContact C-N 3.28Å; N37-G39 PolarHBondContact O-N 3.39Å; N37-R40 WeakPolarHBondContact O-CB 3.38Å; N37-R40 PolarHBondContact O-N 2.96Å; N37-R40 VanDerWaalsContact O-N 3.15Å; N37-Q41 PolarHBondContact ND2-NE2 3.23Å; N37-Q41 WeakPolarHBondContact O-CG 3.45Å; N37-Q41 PolarHBondContact O-N 2.95Å
38	D	92.6	Very high	92.5	Very high	91 Å²	91	74.5 Å²	74.5	49%	0.487	38%	0.376	S	S	.	.	H	α-helix	trans	-62	-39.3	177.5	-64	-12.7	0	0	0	110.8	K34 K35 Q41 A42	K34-D38 PolarHBondContact O-N 2.91Å; K35-D38 PolarHBondContact O-N 3.32Å; D38-Q41 PolarHBondContact O-N 3.01Å; D38-A42 WeakPolarHBondContact O-CB 3.34Å; D38-A42 PolarHBondContact O-N 3.41Å
39	G	92.6	Very high	91.9	Very high	9 Å²	9	74.1 Å²	74.1	9%	0.093	37%	0.373	C	S	.	.	H	α-helix	trans	-59	-45.6	172	0	0	0	0	0	112.8	K35 E36 N37 Q41 A42 L43 M88	K35-G39 PolarHBondContact O-N 2.99Å; E36-G39 PolarHBondContact O-N 2.95Å; N37-G39 VanDerWaalsContact C-N 3.28Å; N37-G39 PolarHBondContact O-N 3.39Å; G39-Q41 PolarHBondContact O-N 3.15Å; G39-A42 PolarHBondContact O-N 3.3Å; G39-L43 WeakPolarHBondContact O-CG 3.47Å; G39-L43 PolarHBondContact O-N 2.84Å; G39-M88 VanDerWaalsContact C-SD 3.59Å
40	R	93.9	Very high	91	Very high	140 Å²	140	75.7 Å²	75.7	53%	0.528	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-41.9	175.9	-67.3	172.3	-172.1	179.1	-0.8	112	E36 N37 L43 S44 M88	E36-R40 WeakPolarHBondContact O-CG 3.33Å; E36-R40 PolarHBondContact O-N 3.31Å; E36-R40 IonicContact OE1-CZ 2.64Å; E36-R40 IonicContact OE1-NE 3.28Å; E36-R40 IonicContact OE1-NH2 3.69Å; E36-R40 PolarHBondContact OE1-NH2 3.47Å; N37-R40 WeakPolarHBondContact O-CB 3.38Å; N37-R40 PolarHBondContact O-N 2.96Å; N37-R40 VanDerWaalsContact O-N 3.15Å; R40-L43 PolarHBondContact O-N 3.41Å; R40-S44 WeakPolarHBondContact O-CB 3.19Å; R40-S44 PolarHBondContact O-N 2.91Å; R40-M88 HydrophobicContact CG-CE 3.52Å
41	Q	94.5	Very high	90.2	Very high	118 Å²	118	74.8 Å²	74.8	55%	0.551	38%	0.376	S	S	*	.	H	α-helix	trans	-65.2	-41.3	176.2	-68.6	-175.8	14.3	0	0	111.4	N37 D38 G39 S44 A45	N37-Q41 PolarHBondContact ND2-NE2 3.23Å; N37-Q41 WeakPolarHBondContact O-CG 3.45Å; N37-Q41 PolarHBondContact O-N 2.95Å; D38-Q41 PolarHBondContact O-N 3.01Å; G39-Q41 PolarHBondContact O-N 3.15Å; Q41-S44 PolarHBondContact O-N 3.48Å; Q41-A45 WeakPolarHBondContact O-CB 3.46Å; Q41-A45 PolarHBondContact O-N 3.4Å
42	A	91.5	Very high	89.1	Confident	39 Å²	39	72.2 Å²	72.2	32%	0.322	37%	0.37	S	S	.	.	H	α-helix	trans	-63.7	-43.5	176.6	0	0	0	0	0	112.1	D38 G39 S44 A45 L46 I84	D38-A42 WeakPolarHBondContact O-CB 3.34Å; D38-A42 PolarHBondContact O-N 3.41Å; G39-A42 PolarHBondContact O-N 3.3Å; A42-S44 VanDerWaalsContact C-N 3.35Å; A42-S44 PolarHBondContact O-N 2.87Å; A42-A45 PolarHBondContact O-N 2.91Å; A42-L46 VanDerWaalsContact O-CB 3.29Å; A42-L46 WeakPolarHBondContact O-CB 3.41Å; A42-L46 PolarHBondContact O-N 3.42Å; A42-I84 HydrophobicContact CB-CD1 3.91Å
43	L	92.6	Very high	87.5	Confident	38 Å²	38	73.8 Å²	73.8	20%	0.199	38%	0.382	C	S	.	.	H	α-helix	trans	-61.9	-41.9	174.5	-71.8	176.9	0	0	0	112.1	G39 R40 L46 R47 E81 I84 R85 M88	G39-L43 WeakPolarHBondContact O-CG 3.47Å; G39-L43 PolarHBondContact O-N 2.84Å; R40-L43 PolarHBondContact O-N 3.41Å; L43-L46 PolarHBondContact O-N 2.93Å; L43-R47 WeakPolarHBondContact O-CB 3.45Å; L43-R47 PolarHBondContact O-N 2.64Å; L43-E81 HydrophobicContact CD2-CG 3.75Å; L43-I84 HydrophobicContact CD1-CG2 4.21Å; L43-I84 HydrophobicContact CD2-CB 3.98Å; L43-I84 HydrophobicContact CD2-CD1 4.35Å; L43-I84 HydrophobicContact CD2-CG2 3.86Å; L43-I84 HydrophobicContact CG-CB 4.37Å; L43-I84 HydrophobicContact CG-CG2 3.67Å; L43-R85 HydrophobicContact CD1-CG 4.3Å; L43-R85 HydrophobicContact CD2-CG 4.31Å; L43-M88 HydrophobicContact CD1-CE 4.42Å; L43-M88 HydrophobicContact CD1-SD 3.6Å; L43-M88 VanDerWaalsContact CD1-SD 3.6Å; L43-M88 HydrophobicContact CG-SD 4.41Å
44	S	92.4	Very high	85.9	Confident	65 Å²	65	81.7 Å²	81.7	46%	0.455	41%	0.409	S	S	.	.	H	α-helix	trans	-62	-46.5	175.7	-173.2	0	0	0	0	111.5	R40 Q41 A42 L46 R47 N48	R40-S44 WeakPolarHBondContact O-CB 3.19Å; R40-S44 PolarHBondContact O-N 2.91Å; Q41-S44 PolarHBondContact O-N 3.48Å; A42-S44 VanDerWaalsContact C-N 3.35Å; A42-S44 PolarHBondContact O-N 2.87Å; S44-L46 PolarHBondContact O-N 3.34Å; S44-R47 PolarHBondContact O-N 3.43Å; S44-N48 VanDerWaalsContact O-CG 3.27Å; S44-N48 PolarHBondContact O-N 2.91Å; S44-N48 PolarHBondContact O-ND2 3.35Å
45	A	89.6	Confident	84.1	Confident	59 Å²	59	81.5 Å²	81.5	49%	0.488	41%	0.411	S	S	.	.	H	α-helix	trans	-61.7	-42.3	176.9	0	0	0	0	0	112.1	Q41 A42 N48 Y49	Q41-A45 WeakPolarHBondContact O-CB 3.46Å; Q41-A45 PolarHBondContact O-N 3.4Å; A42-A45 PolarHBondContact O-N 2.91Å; A45-N48 PolarHBondContact O-N 3.25Å; A45-Y49 WeakPolarHBondContact O-CB 3.45Å; A45-Y49 PolarHBondContact O-N 3.09Å
46	L	88.4	Confident	82.4	Confident	12 Å²	12	80.8 Å²	80.8	6%	0.063	43%	0.428	C	S	.	.	H	α-helix	trans	-64	-41.5	177.6	-174.6	64	0	0	0	112.2	A42 L43 S44 Y49 T50 V64 P77 A80 E81	A42-L46 VanDerWaalsContact O-CB 3.29Å; A42-L46 WeakPolarHBondContact O-CB 3.41Å; A42-L46 PolarHBondContact O-N 3.42Å; L43-L46 PolarHBondContact O-N 2.93Å; S44-L46 PolarHBondContact O-N 3.34Å; L46-Y49 PolarHBondContact O-N 3.19Å; L46-T50 WeakPolarHBondContact O-CG2 3.5Å; L46-T50 PolarHBondContact O-N 3.22Å; L46-T50 PolarHBondContact O-OG1 3.01Å; L46-V64 HydrophobicContact CD1-CG1 4.38Å; L46-V64 HydrophobicContact CD1-CG2 3.8Å; L46-P77 HydrophobicContact CD1-CB 3.94Å; L46-P77 WeakPolarHBondContact CD2-O 3.16Å; L46-A80 HydrophobicContact CD2-CB 4.2Å; L46-E81 HydrophobicContact CD2-CB 3.69Å; L46-E81 HydrophobicContact CD2-CG 4.33Å
47	R	87.2	Confident	80.7	Confident	164 Å²	164	83 Å²	83	62%	0.619	45%	0.448	S	S	*	.	H	α-helix	trans	-63	-44.2	174.3	-175.9	179.4	173.6	179.5	0.5	111.7	L43 S44 Y49 T50 Q51	L43-R47 WeakPolarHBondContact O-CB 3.45Å; L43-R47 PolarHBondContact O-N 2.64Å; S44-R47 PolarHBondContact O-N 3.43Å; R47-Y49 VanDerWaalsContact C-N 3.31Å; R47-Y49 PolarHBondContact O-N 3.5Å; R47-T50 WeakPolarHBondContact CA-OG1 3.48Å; R47-T50 PolarHBondContact O-N 2.64Å; R47-T50 PolarHBondContact O-OG1 3.08Å; R47-Q51 WeakPolarHBondContact O-CB 3.42Å; R47-Q51 VanDerWaalsContact O-CG 3.27Å; R47-Q51 WeakPolarHBondContact O-CG 3.26Å; R47-Q51 PolarHBondContact O-N 3.42Å
48	N	86.5	Confident	78.7	Confident	84 Å²	84	86 Å²	86	45%	0.449	46%	0.458	S	S	.	.	H	α-helix	trans	-65.6	-37.4	177.6	-67.2	-19.8	0	0	0	111.7	S44 A45 S52	S44-N48 VanDerWaalsContact O-CG 3.27Å; S44-N48 PolarHBondContact O-N 2.91Å; S44-N48 PolarHBondContact O-ND2 3.35Å; A45-N48 PolarHBondContact O-N 3.25Å; N48-S52 WeakPolarHBondContact O-CB 3.37Å; N48-S52 PolarHBondContact O-N 3.35Å; N48-S52 PolarHBondContact O-OG 3.3Å
49	Y	82.7	Confident	76.7	Confident	72 Å²	72	88 Å²	88	28%	0.282	48%	0.476	S	S	.	.	H	α-helix	trans	-63.4	-49.2	176.2	178.7	-97.7	0	0	0	111.9	A45 L46 R47 Q51 S52 S53 R61 V64	A45-Y49 WeakPolarHBondContact O-CB 3.45Å; A45-Y49 PolarHBondContact O-N 3.09Å; L46-Y49 PolarHBondContact O-N 3.19Å; R47-Y49 VanDerWaalsContact C-N 3.31Å; R47-Y49 PolarHBondContact O-N 3.5Å; Y49-Q51 PolarHBondContact O-N 2.89Å; Y49-S52 PolarHBondContact O-N 3.49Å; Y49-S53 WeakPolarHBondContact O-CB 2.87Å; Y49-S53 PolarHBondContact O-N 3.01Å; Y49-R61 HydrophobicContact CE1-CB 4.37Å; Y49-R61 WeakPolarHBondContact OH-CA 3.3Å; Y49-R61 WeakPolarHBondContact OH-CB 3.37Å; Y49-R61 PolarHBondContact OH-O 3.29Å; Y49-V64 HydrophobicContact CD1-CG2 4.09Å; Y49-V64 HydrophobicContact CE1-CG2 3.9Å
50	T	78.1	Confident	74.9	Confident	55 Å²	55	94.8 Å²	94.8	34%	0.337	51%	0.51	S	S	.	.	H	α-helix	trans	-66.5	-35.4	179.3	51.8	0	0	0	0	112.5	L46 R47 S53 P77	L46-T50 WeakPolarHBondContact O-CG2 3.5Å; L46-T50 PolarHBondContact O-N 3.22Å; L46-T50 PolarHBondContact O-OG1 3.01Å; R47-T50 WeakPolarHBondContact CA-OG1 3.48Å; R47-T50 PolarHBondContact O-N 2.64Å; R47-T50 PolarHBondContact O-OG1 3.08Å; T50-S53 PolarHBondContact O-N 3.17Å; T50-P77 HydrophobicContact CG2-CB 3.72Å; T50-P77 HydrophobicContact CG2-CG 4.29Å
51	Q	77.9	Confident	73.2	Confident	102 Å²	102	91.7 Å²	91.7	48%	0.477	50%	0.498	S	S	.	.	H	α-helix	trans	-67.5	-45	173.3	-73.6	179.2	-12.5	0	0	112.2	R47 Y49 S53 K54	R47-Q51 WeakPolarHBondContact O-CB 3.42Å; R47-Q51 VanDerWaalsContact O-CG 3.27Å; R47-Q51 WeakPolarHBondContact O-CG 3.26Å; R47-Q51 PolarHBondContact O-N 3.42Å; Y49-Q51 PolarHBondContact O-N 2.89Å; Q51-S53 PolarHBondContact O-N 3.05Å; Q51-K54 PolarHBondContact O-N 2.91Å
52	S	71.7	Confident	72	Confident	59 Å²	59	88.3 Å²	88.3	41%	0.413	50%	0.495	S	S	.	.	H	α-helix	trans	-66.1	-25.1	176.4	-58	0	0	0	0	112.9	N48 Y49 K54 Q55	N48-S52 WeakPolarHBondContact O-CB 3.37Å; N48-S52 PolarHBondContact O-N 3.35Å; N48-S52 PolarHBondContact O-OG 3.3Å; Y49-S52 PolarHBondContact O-N 3.49Å; S52-K54 PolarHBondContact O-N 3.3Å; S52-Q55 WeakPolarHBondContact O-CB 3.43Å; S52-Q55 PolarHBondContact O-N 2.95Å
53	S	61.6	Low	71.5	Confident	41 Å²	41	90.4 Å²	90.4	29%	0.287	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-12.2	178.2	-171.8	0	0	0	0	114.2	Y49 T50 Q51 Q55 R61	Y49-S53 WeakPolarHBondContact O-CB 2.87Å; Y49-S53 PolarHBondContact O-N 3.01Å; T50-S53 PolarHBondContact O-N 3.17Å; Q51-S53 PolarHBondContact O-N 3.05Å; S53-Q55 PolarHBondContact O-N 3.29Å; S53-R61 VanDerWaalsContact OG-CB 3.32Å; S53-R61 WeakPolarHBondContact OG-CB 3.42Å
54	K	60.3	Low	71.1	Confident	189 Å²	189	90.1 Å²	90.1	82%	0.822	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-7.7	171.9	-66.8	-174.6	177.9	-176.6	0	112.8	Q51 S52	Q51-K54 PolarHBondContact O-N 2.91Å; S52-K54 PolarHBondContact O-N 3.3Å
55	Q	55.2	Low	70.9	Confident	142 Å²	142	94.2 Å²	94.2	66%	0.664	50%	0.503	S	S	*	.	S	Bend	trans	-84	122.2	177	-150.7	158.8	-25.9	0	0	109.7	S52 S53 S57	S52-Q55 WeakPolarHBondContact O-CB 3.43Å; S52-Q55 PolarHBondContact O-N 2.95Å; S53-Q55 PolarHBondContact O-N 3.29Å; Q55-S57 PolarHBondContact O-N 3.48Å
56	A	55.8	Low	70.8	Confident	111 Å²	111	92.7 Å²	92.7	92%	0.917	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-0.4	-167.9	0	0	0	0	0	116.6
57	S	55.5	Low	70.6	Confident	82 Å²	82	99.5 Å²	99.5	57%	0.573	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-3.7	-168.2	56.3	0	0	0	0	116.2	Q55	Q55-S57 PolarHBondContact O-N 3.48Å
58	F	52.3	Low	70.4	Confident	134 Å²	134	94.6 Å²	94.6	59%	0.588	50%	0.503	S	S	*	.			trans	-142.6	107.8	177.4	-89.6	-89.1	0	0	0	113	D60 R61	F58-D60 PolarHBondContact O-N 3.01Å; F58-R61 HydrophobicContact CB-CG 4.21Å
59	P	50.9	Low	70.3	Confident	133 Å²	133	93.6 Å²	93.6	86%	0.864	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-18.9	-176.8	27.4	-32.7	0	0	0	114.8	R61	P59-R61 VanDerWaalsContact C-N 3.27Å; P59-R61 PolarHBondContact O-N 2.95Å
60	D	53.4	Low	70.6	Confident	152 Å²	152	100.4 Å²	100.4	81%	0.813	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	14.8	-172	-119	8.3	0	0	0	114.9	F58 G62	F58-D60 PolarHBondContact O-N 3.01Å; D60-G62 VanDerWaalsContact C-N 3.28Å; D60-G62 PolarHBondContact O-N 2.96Å
61	R	58.6	Low	71.2	Confident	75 Å²	75	103.1 Å²	103.1	28%	0.283	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.6	18.7	-175.7	-63.5	-155.8	-167.6	-171.9	8.1	115.6	Y49 S53 F58 P59 Q63	Y49-R61 HydrophobicContact CE1-CB 4.37Å; Y49-R61 WeakPolarHBondContact OH-CA 3.3Å; Y49-R61 WeakPolarHBondContact OH-CB 3.37Å; Y49-R61 PolarHBondContact OH-O 3.29Å; S53-R61 VanDerWaalsContact OG-CB 3.32Å; S53-R61 WeakPolarHBondContact OG-CB 3.42Å; F58-R61 HydrophobicContact CB-CG 4.21Å; P59-R61 VanDerWaalsContact C-N 3.27Å; P59-R61 PolarHBondContact O-N 2.95Å; R61-Q63 VanDerWaalsContact C-N 3.3Å; R61-Q63 PolarHBondContact O-N 3.3Å
62	G	70.5	Confident	71.8	Confident	47 Å²	47	103.8 Å²	103.8	49%	0.485	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.9	-12.6	-178.4	0	0	0	0	0	114.9	D60 P77	D60-G62 VanDerWaalsContact C-N 3.28Å; D60-G62 PolarHBondContact O-N 2.96Å; G62-P77 WeakPolarHBondContact O-CD 3.49Å
63	Q	80.6	Confident	72.6	Confident	82 Å²	82	105.1 Å²	105.1	38%	0.383	56%	0.563	S	S	.	*			trans	-138	141	-168.3	-64.9	-68.6	-24.6	0	0	111.6	R61 Q74 V75 A76	R61-Q63 VanDerWaalsContact C-N 3.3Å; R61-Q63 PolarHBondContact O-N 3.3Å; Q63-Q74 HydrophobicContact CB-CG 3.53Å; Q63-Q74 VanDerWaalsContact CB-NE2 3.27Å; Q63-Q74 HydrophobicContact CG-CG 4.02Å; Q63-V75 PolarHBondContact OE1-O 3.42Å; Q63-A76 VanDerWaalsContact OE1-N 3.12Å
64	V	84.9	Confident	74	Confident	32 Å²	32	108.4 Å²	108.4	19%	0.194	57%	0.573	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-116	140.4	179.3	177.8	0	0	0	0	108.8	L46 Y49 F66 V75 P77	L46-V64 HydrophobicContact CD1-CG1 4.38Å; L46-V64 HydrophobicContact CD1-CG2 3.8Å; Y49-V64 HydrophobicContact CD1-CG2 4.09Å; Y49-V64 HydrophobicContact CE1-CG2 3.9Å; V64-F66 PolarHBondContact O-N 3.15Å; V64-V75 PolarHBondContact N-O 3.29Å; V64-V75 PolarHBondContact O-N 2.95Å; V64-P77 HydrophobicContact CG2-CB 4.26Å; V64-P77 HydrophobicContact CG2-CG 3.93Å
65	W	87.3	Confident	75.4	Confident	151 Å²	151	100.4 Å²	100.4	57%	0.572	54%	0.54	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	113.1	172.3	-69.1	102.3	0	0	0	110.3	M72 L73 Q74	W65-M72 HydrophobicContact CB-CE 3.49Å; W65-M72 VanDerWaalsContact CB-CE 3.49Å; W65-M72 HydrophobicContact CD2-CE 3.66Å; W65-M72 HydrophobicContact CE3-CE 3.77Å; W65-M72 HydrophobicContact CE3-CG 3.74Å; W65-M72 HydrophobicContact CE3-SD 4.35Å; W65-M72 HydrophobicContact CG-CE 3.56Å; W65-M72 HydrophobicContact CZ3-CG 4.33Å; W65-L73 CarbonylContact C-O 3.58Å; W65-L73 WeakPolarHBondContact CA-O 3.49Å; W65-Q74 HydrophobicContact CD2-CB 4.34Å; W65-Q74 HydrophobicContact CE3-CB 3.92Å; W65-Q74 HydrophobicContact CH2-CB 4.04Å; W65-Q74 HydrophobicContact CZ2-CB 4.4Å; W65-Q74 HydrophobicContact CZ2-CG 4.5Å; W65-Q74 HydrophobicContact CZ3-CB 3.79Å
66	F	87	Confident	76.9	Confident	28 Å²	28	95 Å²	95	12%	0.123	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124.2	176	-179.3	-102.9	0	0	0	110.2	V64 T68 M72 L73 V75 I83 I84	V64-F66 PolarHBondContact O-N 3.15Å; F66-T68 HydrophobicContact CE1-CG2 4.2Å; F66-M72 CarbonylContact O-C 3.58Å; F66-M72 WeakPolarHBondContact O-CA 3.42Å; F66-L73 PolarHBondContact N-O 3.46Å; F66-L73 PolarHBondContact O-N 3.21Å; F66-V75 HydrophobicContact CB-CG2 3.59Å; F66-I83 HydrophobicContact CE1-CG2 3.83Å; F66-I83 HydrophobicContact CE2-CG2 4.13Å; F66-I83 HydrophobicContact CZ-CG2 3.52Å; F66-I84 HydrophobicContact CE2-CG1 3.97Å
67	K	85.7	Confident	78.4	Confident	155 Å²	155	90.8 Å²	90.8	67%	0.674	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.7	177.7	-174.3	-174	175.7	-175	0	110.2	G69 L71	K67-G69 WeakPolarHBondContact CE-O 3.33Å; K67-L71 CarbonylContact C-O 3.54Å; K67-L71 WeakPolarHBondContact CA-O 3.35Å
68	T	82.4	Confident	80	Confident	61 Å²	61	91.4 Å²	91.4	37%	0.374	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	107.7	171.1	-177.2	0	0	0	0	110.2	F66 K70 L71	F66-T68 HydrophobicContact CE1-CG2 4.2Å; T68-K70 PolarHBondContact O-N 3.04Å; T68-L71 HydrophobicContact CG2-CB 3.94Å; T68-L71 HydrophobicContact CG2-CD1 4.5Å; T68-L71 PolarHBondContact N-O 2.94Å; T68-L71 PolarHBondContact O-N 3.33Å
69	G	84.3	Confident	81.7	Confident	63 Å²	63	88.1 Å²	88.1	65%	0.649	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	-112.6	-174.1	0	0	0	0	0	111.9	K67	K67-G69 WeakPolarHBondContact CE-O 3.33Å
70	K	89.2	Confident	83.6	Confident	214 Å²	214	81.9 Å²	81.9	93%	0.93	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-8.7	177.7	-62.2	-177.8	-177.5	178.7	0	113.6	T68	T68-K70 PolarHBondContact O-N 3.04Å
71	L	89.4	Confident	85.4	Confident	112 Å²	112	77.8 Å²	77.8	59%	0.586	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	142.3	-177.1	-59	176.2	0	0	0	110.4	K67 T68	K67-L71 CarbonylContact C-O 3.54Å; K67-L71 WeakPolarHBondContact CA-O 3.35Å; T68-L71 HydrophobicContact CG2-CB 3.94Å; T68-L71 HydrophobicContact CG2-CD1 4.5Å; T68-L71 PolarHBondContact N-O 2.94Å; T68-L71 PolarHBondContact O-N 3.33Å
72	M	90.6	Very high	87	Confident	117 Å²	117	79.2 Å²	79.2	58%	0.576	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.8	122.2	174.8	-173.7	171.8	-179.6	0	0	107.9	W65 F66	W65-M72 HydrophobicContact CB-CE 3.49Å; W65-M72 VanDerWaalsContact CB-CE 3.49Å; W65-M72 HydrophobicContact CD2-CE 3.66Å; W65-M72 HydrophobicContact CE3-CE 3.77Å; W65-M72 HydrophobicContact CE3-CG 3.74Å; W65-M72 HydrophobicContact CE3-SD 4.35Å; W65-M72 HydrophobicContact CG-CE 3.56Å; W65-M72 HydrophobicContact CZ3-CG 4.33Å; F66-M72 CarbonylContact O-C 3.58Å; F66-M72 WeakPolarHBondContact O-CA 3.42Å
73	L	90.2	Very high	88.1	Confident	87 Å²	87	79.5 Å²	79.5	46%	0.455	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	137.6	-174.3	-60.6	173	0	0	0	108.9	W65 F66 V75	W65-L73 CarbonylContact C-O 3.58Å; W65-L73 WeakPolarHBondContact CA-O 3.49Å; F66-L73 PolarHBondContact N-O 3.46Å; F66-L73 PolarHBondContact O-N 3.21Å; L73-V75 HydrophobicContact CB-CG1 4.09Å
74	Q	89.9	Confident	88.7	Confident	110 Å²	110	76.2 Å²	76.2	51%	0.514	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	117.6	168.8	-170.3	173	16.8	0	0	108	Q63 W65	Q63-Q74 HydrophobicContact CB-CG 3.53Å; Q63-Q74 VanDerWaalsContact CB-NE2 3.27Å; Q63-Q74 HydrophobicContact CG-CG 4.02Å; W65-Q74 HydrophobicContact CD2-CB 4.34Å; W65-Q74 HydrophobicContact CE3-CB 3.92Å; W65-Q74 HydrophobicContact CH2-CB 4.04Å; W65-Q74 HydrophobicContact CZ2-CB 4.4Å; W65-Q74 HydrophobicContact CZ2-CG 4.5Å; W65-Q74 HydrophobicContact CZ3-CB 3.79Å
75	V	88.9	Confident	89.1	Confident	21 Å²	21	81.3 Å²	81.3	13%	0.127	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	151.1	-174.4	-67.2	0	0	0	0	110.7	Q63 V64 F66 L73 A80	Q63-V75 PolarHBondContact OE1-O 3.42Å; V64-V75 PolarHBondContact N-O 3.29Å; V64-V75 PolarHBondContact O-N 2.95Å; F66-V75 HydrophobicContact CB-CG2 3.59Å; L73-V75 HydrophobicContact CB-CG1 4.09Å; V75-A80 HydrophobicContact CG2-CB 3.83Å
76	A	88.5	Confident	89.4	Confident	29 Å²	29	80.7 Å²	80.7	24%	0.24	42%	0.415	C	S	.	.			trans	-61.8	147.5	173.5	0	0	0	0	0	110.2	Q63 T78 T79 A80	Q63-A76 VanDerWaalsContact OE1-N 3.12Å; A76-T78 VanDerWaalsContact C-N 3.25Å; A76-T78 PolarHBondContact O-N 2.8Å; A76-T79 PolarHBondContact O-N 3.23Å; A76-T79 VanDerWaalsContact O-N 3.1Å; A76-A80 PolarHBondContact O-N 2.98Å
77	P	86.8	Confident	89.7	Confident	22 Å²	22	83.4 Å²	83.4	14%	0.143	43%	0.428	C	S	.	.	H	α-helix	trans	-52.4	-41.9	178.6	-25.6	28.9	0	0	0	113.5	L46 T50 G62 V64 A80 E81	L46-P77 HydrophobicContact CD1-CB 3.94Å; L46-P77 WeakPolarHBondContact CD2-O 3.16Å; T50-P77 HydrophobicContact CG2-CB 3.72Å; T50-P77 HydrophobicContact CG2-CG 4.29Å; G62-P77 WeakPolarHBondContact O-CD 3.49Å; V64-P77 HydrophobicContact CG2-CB 4.26Å; V64-P77 HydrophobicContact CG2-CG 3.93Å; P77-A80 WeakPolarHBondContact O-CB 3.34Å; P77-A80 PolarHBondContact O-N 2.88Å; P77-E81 PolarHBondContact O-N 3.47Å
78	T	87.7	Confident	90	Very high	94 Å²	94	77.7 Å²	77.7	58%	0.577	40%	0.404	S	S	*	.	H	α-helix	trans	-62.9	-44.9	178.8	50.9	0	0	0	0	111.7	A76 A80 E81 D82	A76-T78 VanDerWaalsContact C-N 3.25Å; A76-T78 PolarHBondContact O-N 2.8Å; T78-A80 VanDerWaalsContact C-N 3.35Å; T78-A80 PolarHBondContact O-N 2.92Å; T78-E81 WeakPolarHBondContact O-CB 3.49Å; T78-E81 PolarHBondContact O-N 3.38Å; T78-D82 PolarHBondContact O-N 3.39Å
79	T	89.3	Confident	90.6	Very high	65 Å²	65	80.6 Å²	80.6	40%	0.399	41%	0.414	S	S	.	.	H	α-helix	trans	-64.2	-39.4	176.3	-50.9	0	0	0	0	111.7	A76 E81 D82 I83	A76-T79 PolarHBondContact O-N 3.23Å; A76-T79 VanDerWaalsContact O-N 3.1Å; T79-E81 VanDerWaalsContact C-N 3.32Å; T79-E81 PolarHBondContact O-N 3.33Å; T79-D82 PolarHBondContact O-N 3.1Å; T79-I83 HydrophobicContact CG2-CD1 3.99Å; T79-I83 WeakPolarHBondContact O-CD1 3.41Å; T79-I83 WeakPolarHBondContact O-CG1 3.37Å; T79-I83 PolarHBondContact O-N 3.37Å
80	A	89.8	Confident	91	Very high	2 Å²	2	83 Å²	83	2%	0.017	41%	0.409	C	S	.	.	H	α-helix	trans	-61.6	-42.6	174.4	0	0	0	0	0	111.4	L46 V75 A76 P77 T78 I83 I84	L46-A80 HydrophobicContact CD2-CB 4.2Å; V75-A80 HydrophobicContact CG2-CB 3.83Å; A76-A80 PolarHBondContact O-N 2.98Å; P77-A80 WeakPolarHBondContact O-CB 3.34Å; P77-A80 PolarHBondContact O-N 2.88Å; T78-A80 VanDerWaalsContact C-N 3.35Å; T78-A80 PolarHBondContact O-N 2.92Å; A80-I83 PolarHBondContact O-N 3.43Å; A80-I84 WeakPolarHBondContact O-CD1 3.47Å; A80-I84 WeakPolarHBondContact O-CG1 3.49Å; A80-I84 PolarHBondContact O-N 2.81Å
81	E	92	Very high	91.2	Very high	66 Å²	66	73.2 Å²	73.2	31%	0.308	37%	0.369	S	S	.	.	H	α-helix	trans	-59.5	-48.4	177	-168.2	174.3	173.2	0	0	111.7	L43 L46 P77 T78 T79 I83 I84 R85	L43-E81 HydrophobicContact CD2-CG 3.75Å; L46-E81 HydrophobicContact CD2-CB 3.69Å; L46-E81 HydrophobicContact CD2-CG 4.33Å; P77-E81 PolarHBondContact O-N 3.47Å; T78-E81 WeakPolarHBondContact O-CB 3.49Å; T78-E81 PolarHBondContact O-N 3.38Å; T79-E81 VanDerWaalsContact C-N 3.32Å; T79-E81 PolarHBondContact O-N 3.33Å; E81-I83 PolarHBondContact O-N 3.35Å; E81-I84 PolarHBondContact O-N 3.25Å; E81-R85 HydrophobicContact CG-CG 4.5Å; E81-R85 WeakPolarHBondContact O-CB 3.44Å; E81-R85 VanDerWaalsContact O-CG 3.29Å; E81-R85 WeakPolarHBondContact O-CG 3.4Å; E81-R85 PolarHBondContact O-N 3.41Å; E81-R85 IonicContact OE1-CZ 3.22Å; E81-R85 VanDerWaalsContact OE1-CZ 3.22Å; E81-R85 IonicContact OE1-NE 3.09Å; E81-R85 PolarHBondContact OE1-NE 2.98Å; E81-R85 VanDerWaalsContact OE1-NE 3.09Å; E81-R85 IonicContact OE1-NH2 2.65Å; E81-R85 PolarHBondContact OE1-NH2 3.09Å
82	D	92.5	Very high	91.3	Very high	105 Å²	105	69.8 Å²	69.8	56%	0.561	36%	0.357	S	S	*	.	H	α-helix	trans	-62.1	-42.7	179.3	-67.8	-27.1	0	0	0	111.9	T78 T79 R85 K86	T78-D82 PolarHBondContact O-N 3.39Å; T79-D82 PolarHBondContact O-N 3.1Å; D82-R85 PolarHBondContact O-N 2.95Å; D82-K86 WeakPolarHBondContact O-CB 3.25Å; D82-K86 PolarHBondContact O-N 3.05Å
83	I	92.5	Very high	91.5	Very high	53 Å²	53	68.8 Å²	68.8	27%	0.272	35%	0.353	S	S	.	.	H	α-helix	trans	-61.7	-47.9	176.8	-68.8	165.4	0	0	0	110.4	F66 T79 A80 E81 K86 Q87	F66-I83 HydrophobicContact CE1-CG2 3.83Å; F66-I83 HydrophobicContact CE2-CG2 4.13Å; F66-I83 HydrophobicContact CZ-CG2 3.52Å; T79-I83 HydrophobicContact CG2-CD1 3.99Å; T79-I83 WeakPolarHBondContact O-CD1 3.41Å; T79-I83 WeakPolarHBondContact O-CG1 3.37Å; T79-I83 PolarHBondContact O-N 3.37Å; A80-I83 PolarHBondContact O-N 3.43Å; E81-I83 PolarHBondContact O-N 3.35Å; I83-K86 PolarHBondContact O-N 3.45Å; I83-Q87 HydrophobicContact CG2-CG 4.5Å; I83-Q87 VanDerWaalsContact O-CG 3.31Å; I83-Q87 WeakPolarHBondContact O-CG 3.37Å; I83-Q87 PolarHBondContact O-N 2.72Å
84	I	92.9	Very high	91.7	Very high	13 Å²	13	68.1 Å²	68.1	7%	0.067	35%	0.348	C	S	.	.	H	α-helix	trans	-63.8	-45.5	-179.1	-65.3	160.9	0	0	0	110.3	A42 L43 F66 A80 E81 K86 Q87 M88	A42-I84 HydrophobicContact CB-CD1 3.91Å; L43-I84 HydrophobicContact CD1-CG2 4.21Å; L43-I84 HydrophobicContact CD2-CB 3.98Å; L43-I84 HydrophobicContact CD2-CD1 4.35Å; L43-I84 HydrophobicContact CD2-CG2 3.86Å; L43-I84 HydrophobicContact CG-CB 4.37Å; L43-I84 HydrophobicContact CG-CG2 3.67Å; F66-I84 HydrophobicContact CE2-CG1 3.97Å; A80-I84 WeakPolarHBondContact O-CD1 3.47Å; A80-I84 WeakPolarHBondContact O-CG1 3.49Å; A80-I84 PolarHBondContact O-N 2.81Å; E81-I84 PolarHBondContact O-N 3.25Å; I84-K86 PolarHBondContact O-N 3.07Å; I84-Q87 PolarHBondContact O-N 2.96Å; I84-M88 HydrophobicContact CG2-CG 4.33Å; I84-M88 HydrophobicContact CG2-SD 3.94Å; I84-M88 WeakPolarHBondContact O-CG 3.49Å; I84-M88 PolarHBondContact O-N 3.41Å
85	R	94.2	Very high	91.9	Very high	140 Å²	140	66.3 Å²	66.3	53%	0.528	34%	0.339	S	S	.	.	H	α-helix	trans	-58.7	-46.5	177.8	-74.7	175	177.3	-134.4	5.2	111.6	L43 E81 D82 Q87 M88 E89	L43-R85 HydrophobicContact CD1-CG 4.3Å; L43-R85 HydrophobicContact CD2-CG 4.31Å; E81-R85 HydrophobicContact CG-CG 4.5Å; E81-R85 WeakPolarHBondContact O-CB 3.44Å; E81-R85 VanDerWaalsContact O-CG 3.29Å; E81-R85 WeakPolarHBondContact O-CG 3.4Å; E81-R85 PolarHBondContact O-N 3.41Å; E81-R85 IonicContact OE1-CZ 3.22Å; E81-R85 VanDerWaalsContact OE1-CZ 3.22Å; E81-R85 IonicContact OE1-NE 3.09Å; E81-R85 PolarHBondContact OE1-NE 2.98Å; E81-R85 VanDerWaalsContact OE1-NE 3.09Å; E81-R85 IonicContact OE1-NH2 2.65Å; E81-R85 PolarHBondContact OE1-NH2 3.09Å; D82-R85 PolarHBondContact O-N 2.95Å; R85-Q87 VanDerWaalsContact C-N 3.35Å; R85-Q87 PolarHBondContact O-N 3.21Å; R85-M88 PolarHBondContact O-N 3.42Å; R85-E89 PolarHBondContact O-N 3.41Å
86	K	94.4	Very high	92.1	Very high	137 Å²	137	68 Å²	68	60%	0.596	35%	0.354	S	S	*	.	H	α-helix	trans	-62.4	-40.8	177.1	-174.8	175.9	-178.8	176.4	0	112.3	D82 I83 I84 E89 M90	D82-K86 WeakPolarHBondContact O-CB 3.25Å; D82-K86 PolarHBondContact O-N 3.05Å; I83-K86 PolarHBondContact O-N 3.45Å; I84-K86 PolarHBondContact O-N 3.07Å; K86-E89 PolarHBondContact O-N 3.25Å; K86-M90 HydrophobicContact CG-SD 4.39Å; K86-M90 WeakPolarHBondContact O-CG 3.4Å; K86-M90 PolarHBondContact O-N 3.3Å
87	Q	92.1	Very high	92.4	Very high	85 Å²	85	71.4 Å²	71.4	40%	0.397	37%	0.365	S	S	.	.	H	α-helix	trans	-64.6	-41.1	176.1	-75.1	179.3	-11.3	0	0	112.1	I83 I84 R85 M90 A91	I83-Q87 HydrophobicContact CG2-CG 4.5Å; I83-Q87 VanDerWaalsContact O-CG 3.31Å; I83-Q87 WeakPolarHBondContact O-CG 3.37Å; I83-Q87 PolarHBondContact O-N 2.72Å; I84-Q87 PolarHBondContact O-N 2.96Å; R85-Q87 VanDerWaalsContact C-N 3.35Å; R85-Q87 PolarHBondContact O-N 3.21Å; Q87-M90 PolarHBondContact O-N 3.02Å; Q87-A91 WeakPolarHBondContact O-CB 3.49Å; Q87-A91 PolarHBondContact O-N 3.43Å
88	M	93	Very high	92.7	Very high	35 Å²	35	70.4 Å²	70.4	17%	0.172	36%	0.359	C	S	.	.	H	α-helix	trans	-64.3	-41.6	175.6	-71.4	176.8	60.7	0	0	111.8	E36 G39 R40 L43 I84 R85 A91 A92	E36-M88 HydrophobicContact CG-CE 4.39Å; G39-M88 VanDerWaalsContact C-SD 3.59Å; R40-M88 HydrophobicContact CG-CE 3.52Å; L43-M88 HydrophobicContact CD1-CE 4.42Å; L43-M88 HydrophobicContact CD1-SD 3.6Å; L43-M88 VanDerWaalsContact CD1-SD 3.6Å; L43-M88 HydrophobicContact CG-SD 4.41Å; I84-M88 HydrophobicContact CG2-CG 4.33Å; I84-M88 HydrophobicContact CG2-SD 3.94Å; I84-M88 WeakPolarHBondContact O-CG 3.49Å; I84-M88 PolarHBondContact O-N 3.41Å; R85-M88 PolarHBondContact O-N 3.42Å; M88-A91 PolarHBondContact O-N 2.98Å; M88-A92 WeakPolarHBondContact O-CB 3.42Å; M88-A92 PolarHBondContact O-N 2.68Å
89	E	94.1	Very high	93	Very high	122 Å²	122	69.2 Å²	69.2	57%	0.57	35%	0.349	S	S	*	.	H	α-helix	trans	-62.2	-46.5	175.7	-175.3	-177.9	-174	0	0	111.7	R85 K86 A91 A92 N93	R85-E89 PolarHBondContact O-N 3.41Å; K86-E89 PolarHBondContact O-N 3.25Å; E89-A91 VanDerWaalsContact C-N 3.32Å; E89-A91 PolarHBondContact O-N 2.65Å; E89-A92 PolarHBondContact O-N 3.09Å; E89-N93 PolarHBondContact O-N 3.48Å; E89-N93 PolarHBondContact O-ND2 3.14Å
90	M	93.7	Very high	93	Very high	113 Å²	113	71.8 Å²	71.8	56%	0.557	36%	0.355	S	S	*	.	H	α-helix	trans	-57.9	-43.8	174.5	-75.2	171.8	34.9	0	0	112.1	K86 Q87 A92 N93 E94	K86-M90 HydrophobicContact CG-SD 4.39Å; K86-M90 WeakPolarHBondContact O-CG 3.4Å; K86-M90 PolarHBondContact O-N 3.3Å; Q87-M90 PolarHBondContact O-N 3.02Å; M90-A92 VanDerWaalsContact C-N 3.35Å; M90-N93 PolarHBondContact O-N 3.46Å; M90-E94 WeakPolarHBondContact O-CB 3.28Å; M90-E94 PolarHBondContact O-N 3.47Å
91	A	93	Very high	93.1	Very high	10 Å²	10	76 Å²	76	8%	0.083	37%	0.37	C	S	.	.	H	α-helix	trans	-65.4	-37.8	177.6	0	0	0	0	0	112.2	L32 Q87 M88 E89 E94 K95	L32-A91 HydrophobicContact CD2-CB 4.19Å; Q87-A91 WeakPolarHBondContact O-CB 3.49Å; Q87-A91 PolarHBondContact O-N 3.43Å; M88-A91 PolarHBondContact O-N 2.98Å; E89-A91 VanDerWaalsContact C-N 3.32Å; E89-A91 PolarHBondContact O-N 2.65Å; A91-E94 PolarHBondContact O-N 3.44Å; A91-K95 VanDerWaalsContact O-CB 3.26Å; A91-K95 WeakPolarHBondContact O-CB 3.49Å; A91-K95 PolarHBondContact O-N 2.88Å
92	A	91.9	Very high	93.1	Very high	40 Å²	40	73.8 Å²	73.8	33%	0.331	36%	0.36	S	S	.	.	H	α-helix	trans	-64.7	-44.5	176.1	0	0	0	0	0	111.7	M88 E89 M90 K95 A96	M88-A92 WeakPolarHBondContact O-CB 3.42Å; M88-A92 PolarHBondContact O-N 2.68Å; E89-A92 PolarHBondContact O-N 3.09Å; M90-A92 VanDerWaalsContact C-N 3.35Å; A92-K95 PolarHBondContact O-N 3.42Å; A92-A96 PolarHBondContact O-N 3Å
93	N	94.6	Very high	93	Very high	95 Å²	95	75.5 Å²	75.5	51%	0.508	36%	0.363	S	S	.	.	H	α-helix	trans	-62.8	-45	175.6	-69.1	-21.5	0	0	0	111.3	E89 M90 K95 A96 E97	E89-N93 PolarHBondContact O-N 3.48Å; E89-N93 PolarHBondContact O-ND2 3.14Å; M90-N93 PolarHBondContact O-N 3.46Å; N93-K95 VanDerWaalsContact C-N 3.31Å; N93-K95 PolarHBondContact O-N 2.94Å; N93-A96 PolarHBondContact O-N 3.35Å; N93-E97 WeakPolarHBondContact O-CG 3.45Å; N93-E97 PolarHBondContact O-N 2.98Å
94	E	94.9	Very high	92.8	Very high	73 Å²	73	78.1 Å²	78.1	34%	0.341	37%	0.374	S	S	.	.	H	α-helix	trans	-63.7	-37.7	177.9	-170.5	172.6	-164.6	0	0	112.3	K28 L32 M90 A91 E97 L98	K28-E94 WeakPolarHBondContact CE-OE1 3.44Å; K28-E94 IonicContact NZ-OE1 3.44Å; K28-E94 PolarHBondContact NZ-OE1 3Å; L32-E94 HydrophobicContact CD1-CB 4.06Å; L32-E94 HydrophobicContact CD1-CG 3.76Å; L32-E94 WeakPolarHBondContact CD2-OE2 3.46Å; M90-E94 WeakPolarHBondContact O-CB 3.28Å; M90-E94 PolarHBondContact O-N 3.47Å; A91-E94 PolarHBondContact O-N 3.44Å; E94-E97 PolarHBondContact O-N 3.42Å; E94-L98 HydrophobicContact CG-CD1 4.22Å; E94-L98 WeakPolarHBondContact O-CB 3.41Å; E94-L98 WeakPolarHBondContact O-CG 3.17Å; E94-L98 PolarHBondContact O-N 3.33Å
95	K	93.6	Very high	92.8	Very high	73 Å²	73	79.6 Å²	79.6	32%	0.317	38%	0.38	S	S	.	.	H	α-helix	trans	-64.9	-42.2	174.3	-177.7	179.7	180	178.9	0	112	L29 E36 A91 A92 N93 L98 N99	L29-K95 HydrophobicContact CD2-CB 4.25Å; L29-K95 HydrophobicContact CD2-CG 3.63Å; E36-K95 IonicContact OE2-NZ 2.64Å; A91-K95 VanDerWaalsContact O-CB 3.26Å; A91-K95 WeakPolarHBondContact O-CB 3.49Å; A91-K95 PolarHBondContact O-N 2.88Å; A92-K95 PolarHBondContact O-N 3.42Å; N93-K95 VanDerWaalsContact C-N 3.31Å; N93-K95 PolarHBondContact O-N 2.94Å; K95-L98 PolarHBondContact O-N 3.03Å; K95-N99 WeakPolarHBondContact O-CB 3.28Å; K95-N99 VanDerWaalsContact O-CG 3.29Å; K95-N99 PolarHBondContact O-N 3.24Å; K95-N99 PolarHBondContact O-ND2 3.07Å
96	A	92.8	Very high	92.6	Very high	55 Å²	55	74.5 Å²	74.5	46%	0.455	36%	0.364	S	S	.	.	H	α-helix	trans	-61.7	-46.6	176.5	0	0	0	0	0	111.2	A92 N93 N99 K100	A92-A96 PolarHBondContact O-N 3Å; N93-A96 PolarHBondContact O-N 3.35Å; A96-N99 PolarHBondContact O-N 3.43Å; A96-K100 PolarHBondContact O-N 3.36Å
97	E	94.2	Very high	92.2	Very high	102 Å²	102	68.8 Å²	68.8	48%	0.477	34%	0.344	S	S	.	.	H	α-helix	trans	-63.5	-41.7	176.5	-74.3	-58.4	131.2	0	0	112.7	N93 E94 K100 R101	N93-E97 WeakPolarHBondContact O-CG 3.45Å; N93-E97 PolarHBondContact O-N 2.98Å; E94-E97 PolarHBondContact O-N 3.42Å; E97-K100 PolarHBondContact O-N 3.02Å; E97-R101 WeakPolarHBondContact O-CG 3.48Å; E97-R101 PolarHBondContact O-N 2.97Å
98	L	94.4	Very high	92.1	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-61.8	-44.8	174	-82.5	164.5	0	0	0	111.8	D25 K28 L29 L32 E94 K95 K100 R101 L102	D25-L98 HydrophobicContact CB-CD2 4.11Å; K28-L98 HydrophobicContact CB-CD1 4.33Å; K28-L98 HydrophobicContact CD-CD1 3.89Å; K28-L98 HydrophobicContact CD-CD2 4.24Å; K28-L98 HydrophobicContact CG-CD1 3.85Å; L29-L98 HydrophobicContact CD2-CB 3.62Å; L29-L98 HydrophobicContact CD2-CD1 4.02Å; L29-L98 HydrophobicContact CD2-CG 4.47Å; L29-L98 HydrophobicContact CG-CB 4.04Å; L29-L98 HydrophobicContact CG-CD1 4.22Å; L32-L98 HydrophobicContact CD1-CD1 3.49Å; L32-L98 VanDerWaalsContact CD1-CD1 3.49Å; E94-L98 HydrophobicContact CG-CD1 4.22Å; E94-L98 WeakPolarHBondContact O-CB 3.41Å; E94-L98 WeakPolarHBondContact O-CG 3.17Å; E94-L98 PolarHBondContact O-N 3.33Å; K95-L98 PolarHBondContact O-N 3.03Å; L98-K100 VanDerWaalsContact C-N 3.3Å; L98-K100 PolarHBondContact O-N 3.1Å; L98-R101 PolarHBondContact O-N 3.38Å; L98-L102 VanDerWaalsContact O-CB 3.25Å; L98-L102 WeakPolarHBondContact O-CB 3.48Å; L98-L102 PolarHBondContact O-N 3.01Å
99	N	92.3	Very high	91.9	Very high	69 Å²	69	69.1 Å²	69.1	37%	0.369	35%	0.346	S	S	.	.	H	α-helix	trans	-62.1	-38.7	177.8	-77.4	-31.5	0	0	0	112	L29 K95 A96 L102 K103	L29-N99 WeakPolarHBondContact CD1-OD1 3.48Å; K95-N99 WeakPolarHBondContact O-CB 3.28Å; K95-N99 VanDerWaalsContact O-CG 3.29Å; K95-N99 PolarHBondContact O-N 3.24Å; K95-N99 PolarHBondContact O-ND2 3.07Å; A96-N99 PolarHBondContact O-N 3.43Å; N99-L102 PolarHBondContact O-N 3.16Å; N99-K103 WeakPolarHBondContact O-CG 3.47Å; N99-K103 PolarHBondContact O-N 3.44Å; N99-K103 VanDerWaalsContact O-N 3.1Å
100	K	90.9	Very high	91.6	Very high	120 Å²	120	66.4 Å²	66.4	52%	0.522	33%	0.331	S	S	.	.	H	α-helix	trans	-62.2	-51.3	175.3	-173.8	-177.7	175.6	-174.2	0	111.1	A96 E97 L98 L102 K103 E104	A96-K100 PolarHBondContact O-N 3.36Å; E97-K100 PolarHBondContact O-N 3.02Å; L98-K100 VanDerWaalsContact C-N 3.3Å; L98-K100 PolarHBondContact O-N 3.1Å; K100-L102 VanDerWaalsContact C-N 3.29Å; K100-L102 PolarHBondContact O-N 3.36Å; K100-K103 WeakPolarHBondContact O-CB 3.15Å; K100-K103 PolarHBondContact O-N 3.2Å; K100-E104 PolarHBondContact O-N 2.99Å
101	R	91.5	Very high	91.4	Very high	90 Å²	90	67.3 Å²	67.3	34%	0.34	33%	0.334	S	S	.	.	H	α-helix	trans	-62	-36.5	176.9	-68.8	-166.3	-57.5	-85.5	2.3	112.7	E97 L98 E104 K105	E97-R101 WeakPolarHBondContact O-CG 3.48Å; E97-R101 PolarHBondContact O-N 2.97Å; L98-R101 PolarHBondContact O-N 3.38Å; R101-E104 PolarHBondContact O-N 3.44Å; R101-K105 WeakPolarHBondContact O-CG 3.49Å; R101-K105 PolarHBondContact O-N 3.28Å
102	L	92.8	Very high	91.1	Very high	19 Å²	19	68.7 Å²	68.7	10%	0.099	34%	0.34	C	S	.	.	H	α-helix	trans	-65.1	-39.5	179	-165.2	68.8	0	0	0	111.4	I22 D25 R26 L29 L98 N99 K100 E104 K105 V106	I22-L102 HydrophobicContact CB-CD1 4.14Å; I22-L102 HydrophobicContact CG1-CD1 4.15Å; I22-L102 HydrophobicContact CG2-CD1 3.79Å; D25-L102 HydrophobicContact CB-CD1 4.09Å; R26-L102 HydrophobicContact CG-CD1 4.5Å; R26-L102 HydrophobicContact CG-CD2 4.06Å; L29-L102 HydrophobicContact CD1-CD2 3.99Å; L98-L102 VanDerWaalsContact O-CB 3.25Å; L98-L102 WeakPolarHBondContact O-CB 3.48Å; L98-L102 PolarHBondContact O-N 3.01Å; N99-L102 PolarHBondContact O-N 3.16Å; K100-L102 VanDerWaalsContact C-N 3.29Å; K100-L102 PolarHBondContact O-N 3.36Å; L102-E104 VanDerWaalsContact C-N 3.33Å; L102-E104 PolarHBondContact O-N 3.12Å; L102-K105 PolarHBondContact O-N 3.29Å; L102-V106 HydrophobicContact CG-CG2 4.31Å; L102-V106 VanDerWaalsContact O-CB 3.28Å; L102-V106 WeakPolarHBondContact O-CB 3.31Å; L102-V106 WeakPolarHBondContact O-CG2 3.49Å; L102-V106 PolarHBondContact O-N 2.91Å
103	K	88.6	Confident	90.8	Very high	141 Å²	141	71.4 Å²	71.4	61%	0.613	35%	0.346	S	S	*	.	H	α-helix	trans	-58.6	-45.6	174.2	-73.4	178.4	179	-173.9	0	111.3	N99 K100 G107	N99-K103 WeakPolarHBondContact O-CG 3.47Å; N99-K103 PolarHBondContact O-N 3.44Å; N99-K103 VanDerWaalsContact O-N 3.1Å; K100-K103 WeakPolarHBondContact O-CB 3.15Å; K100-K103 PolarHBondContact O-N 3.2Å; K103-G107 PolarHBondContact O-N 3.08Å
104	E	89.8	Confident	90.1	Very high	108 Å²	108	70 Å²	70	51%	0.505	35%	0.353	S	S	.	.	H	α-helix	trans	-63.8	-48.1	178.4	-66.6	169.1	-170	0	0	111.6	K100 R101 L102 V106 G107 Q108	K100-E104 PolarHBondContact O-N 2.99Å; R101-E104 PolarHBondContact O-N 3.44Å; L102-E104 VanDerWaalsContact C-N 3.33Å; L102-E104 PolarHBondContact O-N 3.12Å; E104-V106 PolarHBondContact O-N 3.45Å; E104-G107 PolarHBondContact O-N 3.36Å; E104-Q108 WeakPolarHBondContact O-CG 3.46Å; E104-Q108 PolarHBondContact O-N 2.86Å
105	K	91.5	Very high	89.3	Confident	44 Å²	44	70.1 Å²	70.1	19%	0.191	35%	0.354	C	S	.	.	H	α-helix	trans	-63	-40.2	178.2	-71.3	-178.7	178	-174.3	0	113	V18 D21 I22 D25 R101 L102 G107 Q108 L109	V18-K105 WeakPolarHBondContact CG1-O 3.4Å; D21-K105 HydrophobicContact CB-CD 4.44Å; D21-K105 IonicContact OD2-NZ 3.47Å; I22-K105 HydrophobicContact CD1-CB 4.16Å; I22-K105 HydrophobicContact CG1-CB 3.76Å; I22-K105 HydrophobicContact CG1-CD 4.45Å; D25-K105 WeakPolarHBondContact OD2-CE 3.36Å; D25-K105 IonicContact OD2-NZ 3.73Å; D25-K105 PolarHBondContact OD2-NZ 3.48Å; R101-K105 WeakPolarHBondContact O-CG 3.49Å; R101-K105 PolarHBondContact O-N 3.28Å; L102-K105 PolarHBondContact O-N 3.29Å; K105-G107 VanDerWaalsContact C-N 3.31Å; K105-Q108 WeakPolarHBondContact O-CB 3.42Å; K105-Q108 PolarHBondContact O-N 3.38Å; K105-L109 PolarHBondContact O-N 3.47Å
106	V	90.3	Very high	87.9	Confident	34 Å²	34	70.3 Å²	70.3	21%	0.206	36%	0.364	C	S	.	.	H	α-helix	trans	-64.8	-39.2	176.1	168.1	0	0	0	0	110.5	I22 L102 E104 L109 Y110	I22-V106 HydrophobicContact CD1-CG2 3.94Å; I22-V106 HydrophobicContact CG1-CG2 4.34Å; I22-V106 HydrophobicContact CG2-CG2 4.33Å; L102-V106 HydrophobicContact CG-CG2 4.31Å; L102-V106 VanDerWaalsContact O-CB 3.28Å; L102-V106 WeakPolarHBondContact O-CB 3.31Å; L102-V106 WeakPolarHBondContact O-CG2 3.49Å; L102-V106 PolarHBondContact O-N 2.91Å; E104-V106 PolarHBondContact O-N 3.45Å; V106-L109 PolarHBondContact O-N 3.33Å; V106-Y110 HydrophobicContact CG1-CD2 3.8Å; V106-Y110 HydrophobicContact CG1-CE2 3.31Å; V106-Y110 WeakPolarHBondContact O-CD2 3.36Å; V106-Y110 PolarHBondContact O-N 2.84Å; V106-Y110 VanDerWaalsContact O-N 3.08Å
107	G	86.8	Confident	86.3	Confident	17 Å²	17	70.3 Å²	70.3	18%	0.175	37%	0.369	C	S	.	.	H	α-helix	trans	-57	-49.7	170.7	0	0	0	0	0	112.3	K103 E104 K105 L109 Y110 E111	K103-G107 PolarHBondContact O-N 3.08Å; E104-G107 PolarHBondContact O-N 3.36Å; K105-G107 VanDerWaalsContact C-N 3.31Å; G107-L109 VanDerWaalsContact C-N 3.31Å; G107-L109 PolarHBondContact O-N 3.23Å; G107-Y110 PolarHBondContact O-N 3.45Å; G107-Y110 VanDerWaalsContact O-N 3.16Å; G107-E111 WeakPolarHBondContact O-CG 3.37Å; G107-E111 PolarHBondContact O-N 3.34Å
108	Q	89.6	Confident	84.7	Confident	96 Å²	96	73.1 Å²	73.1	45%	0.449	38%	0.376	S	S	.	.	H	α-helix	trans	-59.4	-39.4	176.4	-68	172.5	12	0	0	112.6	E104 K105 E111 L112	E104-Q108 WeakPolarHBondContact O-CG 3.46Å; E104-Q108 PolarHBondContact O-N 2.86Å; K105-Q108 WeakPolarHBondContact O-CB 3.42Å; K105-Q108 PolarHBondContact O-N 3.38Å; Q108-E111 PolarHBondContact O-N 2.99Å; Q108-L112 VanDerWaalsContact O-CG 3.31Å; Q108-L112 WeakPolarHBondContact O-CG 3.29Å; Q108-L112 PolarHBondContact O-N 3.47Å
109	L	89.9	Confident	82.9	Confident	31 Å²	31	76.5 Å²	76.5	16%	0.162	40%	0.396	C	S	.	.	H	α-helix	trans	-62.8	-42.5	176.8	-175.8	63.9	0	0	0	111.6	A15 V18 I22 K105 V106 G107 L112 Q113	A15-L109 HydrophobicContact CB-CD1 4.3Å; V18-L109 HydrophobicContact CB-CD1 4.49Å; V18-L109 HydrophobicContact CG1-CB 3.96Å; V18-L109 HydrophobicContact CG1-CD1 4.41Å; I22-L109 HydrophobicContact CD1-CB 4.04Å; I22-L109 HydrophobicContact CD1-CD2 3.83Å; K105-L109 PolarHBondContact O-N 3.47Å; V106-L109 PolarHBondContact O-N 3.33Å; G107-L109 VanDerWaalsContact C-N 3.31Å; G107-L109 PolarHBondContact O-N 3.23Å; L109-L112 PolarHBondContact O-N 3.24Å; L109-Q113 WeakPolarHBondContact O-CG 3.46Å; L109-Q113 PolarHBondContact O-N 2.96Å
110	Y	87.7	Confident	81.1	Confident	65 Å²	65	80.8 Å²	80.8	26%	0.255	41%	0.414	S	S	.	.	H	α-helix	trans	-66.5	-39.3	177.2	-71.1	-50.6	0	0	0	112.6	V106 G107 L112 Q113 G114 E115 V119	V106-Y110 HydrophobicContact CG1-CD2 3.8Å; V106-Y110 HydrophobicContact CG1-CE2 3.31Å; V106-Y110 WeakPolarHBondContact O-CD2 3.36Å; V106-Y110 PolarHBondContact O-N 2.84Å; V106-Y110 VanDerWaalsContact O-N 3.08Å; G107-Y110 PolarHBondContact O-N 3.45Å; G107-Y110 VanDerWaalsContact O-N 3.16Å; Y110-L112 VanDerWaalsContact C-N 3.33Å; Y110-L112 PolarHBondContact O-N 3.43Å; Y110-Q113 PolarHBondContact O-N 2.96Å; Y110-G114 PolarHBondContact O-N 3.03Å; Y110-G114 VanDerWaalsContact O-N 3.13Å; Y110-E115 HydrophobicContact CD1-CB 4.38Å; Y110-E115 PolarHBondContact O-N 3.32Å; Y110-V119 HydrophobicContact CD2-CG2 3.34Å; Y110-V119 HydrophobicContact CE2-CG2 3.99Å; Y110-V119 HydrophobicContact CG-CG2 4.13Å
111	E	88.3	Confident	79.4	Confident	132 Å²	132	79.8 Å²	79.8	62%	0.617	42%	0.421	S	S	*	.	H	α-helix	trans	-59.7	-44.1	173.1	-71.3	175.4	-178.7	0	0	111.5	G107 Q108 Q113 G114	G107-E111 WeakPolarHBondContact O-CG 3.37Å; G107-E111 PolarHBondContact O-N 3.34Å; Q108-E111 PolarHBondContact O-N 2.99Å; E111-Q113 VanDerWaalsContact C-N 3.27Å; E111-Q113 PolarHBondContact O-N 3.4Å; E111-G114 PolarHBondContact O-N 2.83Å; E111-G114 VanDerWaalsContact O-N 3.13Å
112	L	87.2	Confident	78.3	Confident	38 Å²	38	84.2 Å²	84.2	20%	0.199	44%	0.443	C	S	.	.	H	α-helix	trans	-65.5	-29.2	177.2	-71.3	171.7	0	0	0	113.1	L11 R14 A15 V18 Q108 L109 Y110 G114	L11-L112 HydrophobicContact CD1-CD2 3.92Å; R14-L112 HydrophobicContact CB-CD1 4.34Å; R14-L112 HydrophobicContact CB-CD2 4.46Å; A15-L112 HydrophobicContact CB-CB 4.36Å; A15-L112 HydrophobicContact CB-CD1 4.49Å; V18-L112 HydrophobicContact CB-CD1 4.49Å; V18-L112 HydrophobicContact CG2-CD1 3.96Å; Q108-L112 VanDerWaalsContact O-CG 3.31Å; Q108-L112 WeakPolarHBondContact O-CG 3.29Å; Q108-L112 PolarHBondContact O-N 3.47Å; L109-L112 PolarHBondContact O-N 3.24Å; Y110-L112 VanDerWaalsContact C-N 3.33Å; Y110-L112 PolarHBondContact O-N 3.43Å; L112-G114 VanDerWaalsContact C-N 3.32Å
113	Q	85.6	Confident	76.8	Confident	98 Å²	98	86.1 Å²	86.1	46%	0.458	47%	0.468	S	S	.	.	H	α-helix	trans	-83.1	-7.8	176	-70.5	174.8	-4.2	0	0	113.2	L109 Y110 E111 E115	L109-Q113 WeakPolarHBondContact O-CG 3.46Å; L109-Q113 PolarHBondContact O-N 2.96Å; Y110-Q113 PolarHBondContact O-N 2.96Å; E111-Q113 VanDerWaalsContact C-N 3.27Å; E111-Q113 PolarHBondContact O-N 3.4Å; Q113-E115 HydrophobicContact CB-CG 4.33Å; Q113-E115 PolarHBondContact O-N 3.37Å
114	G	80.2	Confident	76	Confident	64 Å²	64	86.1 Å²	86.1	66%	0.66	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	9.9	-173.3	0	0	0	0	0	113.9	Y110 E111 L112 S116	Y110-G114 PolarHBondContact O-N 3.03Å; Y110-G114 VanDerWaalsContact O-N 3.13Å; E111-G114 PolarHBondContact O-N 2.83Å; E111-G114 VanDerWaalsContact O-N 3.13Å; L112-G114 VanDerWaalsContact C-N 3.32Å; G114-S116 VanDerWaalsContact C-N 3.31Å; G114-S116 PolarHBondContact O-N 3.05Å
115	E	77.1	Confident	75.1	Confident	77 Å²	77	86.8 Å²	86.8	36%	0.36	48%	0.481	S	S	.	.			trans	-94.6	38	179.7	-63.8	-168	167	0	0	111.9	Y110 Q113 G117 R118	Y110-E115 HydrophobicContact CD1-CB 4.38Å; Y110-E115 PolarHBondContact O-N 3.32Å; Q113-E115 HydrophobicContact CB-CG 4.33Å; Q113-E115 PolarHBondContact O-N 3.37Å; E115-G117 PolarHBondContact O-N 3.49Å; E115-R118 HydrophobicContact CB-CG 4.23Å; E115-R118 PolarHBondContact O-N 3.33Å; E115-R118 IonicContact OE1-NH1 3.8Å; E115-R118 WeakPolarHBondContact OE2-CD 3.47Å; E115-R118 IonicContact OE2-CZ 3.68Å; E115-R118 IonicContact OE2-NE 3.47Å; E115-R118 IonicContact OE2-NH1 2.81Å; E115-R118 PolarHBondContact OE2-NH1 3.21Å
116	S	65.6	Low	74.3	Confident	76 Å²	76	90.4 Å²	90.4	53%	0.531	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-56	-23.9	-175.9	-49.6	0	0	0	0	113.6	G114 R118	G114-S116 VanDerWaalsContact C-N 3.31Å; G114-S116 PolarHBondContact O-N 3.05Å; S116-R118 VanDerWaalsContact C-N 3.32Å; S116-R118 PolarHBondContact O-N 3.13Å
117	G	59.1	Low	73.9	Confident	55 Å²	55	93.2 Å²	93.2	57%	0.567	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-73.7	-10.3	176.9	0	0	0	0	0	115.5	E115 V119 E120	E115-G117 PolarHBondContact O-N 3.49Å; G117-V119 VanDerWaalsContact C-N 3.34Å; G117-E120 WeakPolarHBondContact O-CG 3.32Å
118	R	59.4	Low	73.9	Confident	162 Å²	162	96.4 Å²	96.4	61%	0.611	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-80.7	-16.8	179.6	-65.9	-175.3	87.5	171.3	7.9	113.4	E115 S116 E120	E115-R118 HydrophobicContact CB-CG 4.23Å; E115-R118 PolarHBondContact O-N 3.33Å; E115-R118 IonicContact OE1-NH1 3.8Å; E115-R118 WeakPolarHBondContact OE2-CD 3.47Å; E115-R118 IonicContact OE2-CZ 3.68Å; E115-R118 IonicContact OE2-NE 3.47Å; E115-R118 IonicContact OE2-NH1 2.81Å; E115-R118 PolarHBondContact OE2-NH1 3.21Å; S116-R118 VanDerWaalsContact C-N 3.32Å; S116-R118 PolarHBondContact O-N 3.13Å; R118-E120 PolarHBondContact O-N 2.96Å
119	V	55.9	Low	73.8	Confident	71 Å²	71	96.2 Å²	96.2	43%	0.43	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-90	43.6	172.3	-159.8	0	0	0	0	110.2	Y110 G117 C121	Y110-V119 HydrophobicContact CD2-CG2 3.34Å; Y110-V119 HydrophobicContact CE2-CG2 3.99Å; Y110-V119 HydrophobicContact CG-CG2 4.13Å; G117-V119 VanDerWaalsContact C-N 3.34Å; V119-C121 HydrophobicContact CG1-CB 4.5Å; V119-C121 PolarHBondContact O-N 3.13Å; V119-C121 VanDerWaalsContact O-N 3.1Å
120	E	55.4	Low	73.7	Confident	158 Å²	158	99.6 Å²	99.6	74%	0.738	56%	0.558	S	S	*	*			trans	-73.3	23.8	157.4	-75.2	-176.8	-179.3	0	0	111.5	G117 R118 F122	G117-E120 WeakPolarHBondContact O-CG 3.32Å; R118-E120 PolarHBondContact O-N 2.96Å; E120-F122 PolarHBondContact O-N 2.98Å
121	C	55.5	Low	73.8	Confident	100 Å²	100	101.5 Å²	101.5	68%	0.676	57%	0.569	S	S	*	*			trans	-67.8	108.1	159.9	-61.5	0	0	0	0	105.6	V119 G123	V119-C121 HydrophobicContact CG1-CB 4.5Å; V119-C121 PolarHBondContact O-N 3.13Å; V119-C121 VanDerWaalsContact O-N 3.1Å; C121-G123 PolarHBondContact O-N 3.24Å
122	F	67.5	Low	73.8	Confident	182 Å²	182	97.3 Å²	97.3	80%	0.798	56%	0.557	S	S	*	*			trans	-55	15.7	174.3	-71.8	-78.7	0	0	0	114.9	E120 L124	E120-F122 PolarHBondContact O-N 2.98Å; F122-L124 HydrophobicContact CB-CD1 4Å; F122-L124 HydrophobicContact CB-CD2 4.24Å; F122-L124 HydrophobicContact CB-CG 3.68Å; F122-L124 PolarHBondContact O-N 3.47Å; F122-L124 VanDerWaalsContact O-N 3.09Å
123	G	62.3	Low	73.9	Confident	60 Å²	60	100.8 Å²	100.8	62%	0.619	57%	0.571	S	S	*	*			trans	63.3	15.5	-175.5	0	0	0	0	0	112.6	C121 N125	C121-G123 PolarHBondContact O-N 3.24Å; G123-N125 PolarHBondContact O-N 3Å
124	L	71.4	Confident	74.1	Confident	140 Å²	140	99 Å²	99	73%	0.733	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-65.2	125	-175.3	-60.7	174.3	0	0	0	109.3	F122	F122-L124 HydrophobicContact CB-CD1 4Å; F122-L124 HydrophobicContact CB-CD2 4.24Å; F122-L124 HydrophobicContact CB-CG 3.68Å; F122-L124 PolarHBondContact O-N 3.47Å; F122-L124 VanDerWaalsContact O-N 3.09Å
125	N	71.3	Confident	74.5	Confident	123 Å²	123	99.7 Å²	99.7	66%	0.658	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-76.8	148.4	167	-68.2	-39.2	0	0	0	108.7	G123 L127	G123-N125 PolarHBondContact O-N 3Å; N125-L127 PolarHBondContact O-N 2.87Å
126	P	75.3	Confident	75.1	Confident	119 Å²	119	105.6 Å²	105.6	77%	0.773	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-56.5	137.4	169.3	25.8	-33	0	0	0	108.8	D128	P126-D128 PolarHBondContact O-N 3.25Å
127	L	81.2	Confident	76.2	Confident	93 Å²	93	107.4 Å²	107.4	49%	0.487	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-58.9	129.4	-177.9	-151.4	85.2	0	0	0	110	N125 E131 A132 L135	N125-L127 PolarHBondContact O-N 2.87Å; L127-E131 HydrophobicContact CD1-CB 4.13Å; L127-E131 HydrophobicContact CD2-CB 4.24Å; L127-E131 HydrophobicContact CG-CB 3.69Å; L127-A132 HydrophobicContact CD2-CB 3.71Å; L127-L135 HydrophobicContact CD1-CD1 3.92Å; L127-L135 HydrophobicContact CD2-CD1 3.56Å; L127-L135 HydrophobicContact CD2-CG 4.37Å; L127-L135 HydrophobicContact CG-CD1 4.41Å
128	D	86.1	Confident	77.5	Confident	84 Å²	84	113.2 Å²	113.2	45%	0.449	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-67.3	158	175.7	-176.5	38.4	0	0	0	111.1	P126 D130 E131 A132	P126-D128 PolarHBondContact O-N 3.25Å; D128-D130 PolarHBondContact O-N 3.38Å; D128-D130 PolarHBondContact OD2-N 2.93Å; D128-E131 HydrophobicContact CB-CB 4.3Å; D128-E131 HydrophobicContact CB-CG 4.08Å; D128-E131 PolarHBondContact N-OE2 3.46Å; D128-E131 PolarHBondContact O-N 2.81Å; D128-A132 WeakPolarHBondContact O-CB 3.43Å; D128-A132 PolarHBondContact O-N 3.46Å
129	V	88.1	Confident	78.6	Confident	93 Å²	93	113.6 Å²	113.6	56%	0.564	60%	0.6	S	S	*	*	H	α-helix	trans	-58	-35.8	179	179.1	0	0	0	0	110.9	K133	V129-K133 HydrophobicContact CG1-CD 4.45Å; V129-K133 VanDerWaalsContact O-CG 3.3Å; V129-K133 WeakPolarHBondContact O-CG 3.26Å; V129-K133 PolarHBondContact O-N 2.82Å; V129-K133 VanDerWaalsContact O-N 3.09Å
130	D	88.4	Confident	79.2	Confident	102 Å²	102	121.5 Å²	121.5	55%	0.545	63%	0.629	S	S	.	*	H	α-helix	trans	-77.3	-36.9	179.7	-66.5	-26.9	0	0	0	112	D128 K133 A134	D128-D130 PolarHBondContact O-N 3.38Å; D128-D130 PolarHBondContact OD2-N 2.93Å; D130-K133 PolarHBondContact O-N 3.46Å; D130-K133 IonicContact OD1-NZ 2.68Å; D130-K133 PolarHBondContact OD1-NZ 2.89Å; D130-A134 WeakPolarHBondContact O-CB 2.89Å; D130-A134 PolarHBondContact O-N 3Å
131	E	88.3	Confident	80.4	Confident	104 Å²	104	119.7 Å²	119.7	49%	0.486	62%	0.623	S	S	.	*	H	α-helix	trans	-62.9	-40.9	170	-68.6	177.2	157.6	0	0	111.7	L127 D128 K133 A134 L135	L127-E131 HydrophobicContact CD1-CB 4.13Å; L127-E131 HydrophobicContact CD2-CB 4.24Å; L127-E131 HydrophobicContact CG-CB 3.69Å; D128-E131 HydrophobicContact CB-CB 4.3Å; D128-E131 HydrophobicContact CB-CG 4.08Å; D128-E131 PolarHBondContact N-OE2 3.46Å; D128-E131 PolarHBondContact O-N 2.81Å; E131-K133 PolarHBondContact O-N 3.43Å; E131-A134 PolarHBondContact O-N 3.4Å; E131-L135 WeakPolarHBondContact O-CG 3.45Å; E131-L135 PolarHBondContact O-N 2.96Å
132	A	88.6	Confident	81.7	Confident	44 Å²	44	120.7 Å²	120.7	36%	0.364	62%	0.62	S	S	.	*	H	α-helix	trans	-61.8	-42.3	175.8	0	0	0	0	0	112.2	L127 D128 R136	L127-A132 HydrophobicContact CD2-CB 3.71Å; D128-A132 WeakPolarHBondContact O-CB 3.43Å; D128-A132 PolarHBondContact O-N 3.46Å; A132-R136 WeakPolarHBondContact O-CB 3.45Å; A132-R136 PolarHBondContact O-N 3.08Å
133	K	90.5	Very high	82.5	Confident	112 Å²	112	117.3 Å²	117.3	49%	0.487	61%	0.61	S	S	.	*	H	α-helix	trans	-66	-42.3	174.3	-73.7	166	-176.1	161.5	0	111.5	V129 D130 E131 R136 N137	V129-K133 HydrophobicContact CG1-CD 4.45Å; V129-K133 VanDerWaalsContact O-CG 3.3Å; V129-K133 WeakPolarHBondContact O-CG 3.26Å; V129-K133 PolarHBondContact O-N 2.82Å; V129-K133 VanDerWaalsContact O-N 3.09Å; D130-K133 PolarHBondContact O-N 3.46Å; D130-K133 IonicContact OD1-NZ 2.68Å; D130-K133 PolarHBondContact OD1-NZ 2.89Å; E131-K133 PolarHBondContact O-N 3.43Å; K133-R136 PolarHBondContact O-N 3.01Å; K133-N137 VanDerWaalsContact O-CG 3.27Å; K133-N137 PolarHBondContact O-N 3.42Å; K133-N137 PolarHBondContact O-ND2 3.31Å
134	A	89.3	Confident	83.7	Confident	59 Å²	59	120.6 Å²	120.6	49%	0.488	61%	0.61	S	S	.	*	H	α-helix	trans	-62	-46.7	178	0	0	0	0	0	111.6	D130 E131 R136 N137 F138	D130-A134 WeakPolarHBondContact O-CB 2.89Å; D130-A134 PolarHBondContact O-N 3Å; E131-A134 PolarHBondContact O-N 3.4Å; A134-R136 VanDerWaalsContact C-N 3.35Å; A134-R136 PolarHBondContact O-N 3.2Å; A134-N137 PolarHBondContact O-N 3.21Å; A134-F138 WeakPolarHBondContact O-CB 3.42Å; A134-F138 PolarHBondContact O-N 3.19Å
135	L	89.3	Confident	84.5	Confident	80 Å²	80	119.4 Å²	119.4	42%	0.419	60%	0.602	S	S	.	*	H	α-helix	trans	-60.3	-44	173.8	-73.2	-175	0	0	0	111.6	L127 E131 N137 F138 F139	L127-L135 HydrophobicContact CD1-CD1 3.92Å; L127-L135 HydrophobicContact CD2-CD1 3.56Å; L127-L135 HydrophobicContact CD2-CG 4.37Å; L127-L135 HydrophobicContact CG-CD1 4.41Å; E131-L135 WeakPolarHBondContact O-CG 3.45Å; E131-L135 PolarHBondContact O-N 2.96Å; L135-N137 VanDerWaalsContact C-N 3.26Å; L135-N137 PolarHBondContact O-N 3.42Å; L135-F138 PolarHBondContact O-N 3.16Å; L135-F138 VanDerWaalsContact O-N 3.15Å; L135-F139 HydrophobicContact CB-CD2 4.48Å; L135-F139 HydrophobicContact CB-CE2 4.44Å; L135-F139 HydrophobicContact CD2-CE2 4.27Å; L135-F139 WeakPolarHBondContact O-CD2 3.33Å; L135-F139 PolarHBondContact O-N 3.46Å
136	R	88.9	Confident	85.3	Confident	201 Å²	201	119.2 Å²	119.2	76%	0.758	60%	0.598	S	S	*	*	H	α-helix	trans	-60.6	-35.8	177.2	-176	179	174.8	-177.9	-1	112.7	A132 K133 A134	A132-R136 WeakPolarHBondContact O-CB 3.45Å; A132-R136 PolarHBondContact O-N 3.08Å; K133-R136 PolarHBondContact O-N 3.01Å; A134-R136 VanDerWaalsContact C-N 3.35Å; A134-R136 PolarHBondContact O-N 3.2Å
137	N	89.1	Confident	86.1	Confident	114 Å²	114	119.2 Å²	119.2	61%	0.61	59%	0.586	S	S	*	*	H	α-helix	trans	-76.5	-29.7	176.8	-68.8	-19.3	0	0	0	112.4	K133 A134 L135	K133-N137 VanDerWaalsContact O-CG 3.27Å; K133-N137 PolarHBondContact O-N 3.42Å; K133-N137 PolarHBondContact O-ND2 3.31Å; A134-N137 PolarHBondContact O-N 3.21Å; L135-N137 VanDerWaalsContact C-N 3.26Å; L135-N137 PolarHBondContact O-N 3.42Å
138	F	86	Confident	86.4	Confident	176 Å²	176	121.2 Å²	121.2	77%	0.772	59%	0.594	S	S	*	*	H	α-helix	trans	-74.8	-33.7	178.4	-164.7	-89.8	0	0	0	112.8	A134 L135 K140	A134-F138 WeakPolarHBondContact O-CB 3.42Å; A134-F138 PolarHBondContact O-N 3.19Å; L135-F138 PolarHBondContact O-N 3.16Å; L135-F138 VanDerWaalsContact O-N 3.15Å; F138-K140 VanDerWaalsContact C-N 3.26Å; F138-K140 PolarHBondContact O-N 3.38Å
139	F	82.2	Confident	86.5	Confident	170 Å²	170	124.3 Å²	124.3	75%	0.746	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	12.8	176.4	-70.1	-65.6	0	0	0	114.3	L135	L135-F139 HydrophobicContact CB-CD2 4.48Å; L135-F139 HydrophobicContact CB-CE2 4.44Å; L135-F139 HydrophobicContact CD2-CE2 4.27Å; L135-F139 WeakPolarHBondContact O-CD2 3.33Å; L135-F139 PolarHBondContact O-N 3.46Å
140	K	68.8	Low	86.3	Confident	237 Å²	237	127.2 Å²	127.2	100%	1.03	61%	0.61	S	S	*	*			trans	-111.4	0	178.2	-162.5	-174.1	-176.3	-170.4	0	110.6	F138	F138-K140 VanDerWaalsContact C-N 3.26Å; F138-K140 PolarHBondContact O-N 3.38Å

Retrieved 140 of 140 residues in 83.4 ms (Link to these results)

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