A0A077Z1N8_TRITR Loading...

OPA3 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z1N8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 176 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	46.1	Very low	76	Confident	229 Å²	229	126.5 Å²	126.5	100%	1.128	67%	0.671	S	S	*	*				0	109.6	0	-76.8	-176.1	-90.2	0	0	109.1	V3	M1-V3 HydrophobicContact CB-CG2 4.41Å; M1-V3 PolarHBondContact O-N 2.72Å; M1-V3 VanDerWaalsContact O-N 3.09Å
2	V	61.1	Low	76.9	Confident	138 Å²	138	119.4 Å²	119.4	84%	0.836	64%	0.644	S	S	*	*			trans	-85.8	49.3	-173.3	-166.9	0	0	0	0	111.3	A4	V2-A4 VanDerWaalsContact C-N 3.34Å
3	V	60.6	Low	78	Confident	102 Å²	102	116.5 Å²	116.5	62%	0.618	63%	0.627	S	S	*	*			trans	-87.8	-6.6	-178.5	-172.1	0	0	0	0	111.9	M1 F5	M1-V3 HydrophobicContact CB-CG2 4.41Å; M1-V3 PolarHBondContact O-N 2.72Å; M1-V3 VanDerWaalsContact O-N 3.09Å; V3-F5 PolarHBondContact O-N 3.49Å
4	A	68.8	Low	78.9	Confident	76 Å²	76	117.6 Å²	117.6	63%	0.628	62%	0.624	S	S	*	*	H	α-helix	trans	-68.6	-29.5	-174.3	0	0	0	0	0	114.3	V2 F8	V2-A4 VanDerWaalsContact C-N 3.34Å; A4-F8 PolarHBondContact O-N 2.8Å
5	F	72.1	Confident	79.6	Confident	182 Å²	182	110.7 Å²	110.7	80%	0.798	59%	0.588	S	S	*	*	H	α-helix	trans	-68.5	-40.7	-167.2	-174.5	-105.2	0	0	0	114.4	V3	V3-F5 PolarHBondContact O-N 3.49Å
6	P	83.9	Confident	80.1	Confident	77 Å²	77	111.9 Å²	111.9	50%	0.5	58%	0.582	S	S	.	*	H	α-helix	trans	-83	-32	174.8	-14.9	32.3	0	0	0	113.5	F8 K9 L10	P6-F8 PolarHBondContact O-N 3.1Å; P6-K9 PolarHBondContact O-N 3.17Å; P6-L10 WeakPolarHBondContact O-CG 2.97Å; P6-L10 PolarHBondContact O-N 2.95Å; P6-L10 VanDerWaalsContact O-N 3.09Å
7	L	88.3	Confident	80.7	Confident	101 Å²	101	113.3 Å²	113.3	53%	0.529	59%	0.585	S	S	.	*	H	α-helix	trans	-64.5	-42	-172.1	-174.5	64.1	0	0	0	112	K9 L10 V11	L7-K9 VanDerWaalsContact C-N 3.28Å; L7-K9 PolarHBondContact O-N 3.23Å; L7-L10 PolarHBondContact O-N 3.32Å; L7-L10 VanDerWaalsContact O-N 3.12Å; L7-V11 HydrophobicContact CG-CG2 4.46Å; L7-V11 WeakPolarHBondContact O-CG2 3.47Å; L7-V11 PolarHBondContact O-N 3.34Å
8	F	86.9	Confident	81.3	Confident	160 Å²	160	110 Å²	110	70%	0.702	57%	0.57	S	S	*	*	H	α-helix	trans	-57.5	-43.8	177.3	177.2	-100.3	0	0	0	111.8	A4 P6 L10 V11 A12	A4-F8 PolarHBondContact O-N 2.8Å; P6-F8 PolarHBondContact O-N 3.1Å; F8-L10 VanDerWaalsContact C-N 3.33Å; F8-L10 PolarHBondContact O-N 3.07Å; F8-V11 PolarHBondContact O-N 3.48Å; F8-A12 WeakPolarHBondContact O-CB 3.39Å; F8-A12 PolarHBondContact O-N 3.32Å
9	K	87.6	Confident	81.8	Confident	144 Å²	144	104.5 Å²	104.5	63%	0.626	54%	0.542	S	S	*	.	H	α-helix	trans	-64.3	-39.3	177.6	-170.8	174.7	-179	178.5	0	111.5	P6 L7 A12 L13	P6-K9 PolarHBondContact O-N 3.17Å; L7-K9 VanDerWaalsContact C-N 3.28Å; L7-K9 PolarHBondContact O-N 3.23Å; K9-A12 PolarHBondContact O-N 3.32Å; K9-L13 HydrophobicContact CG-CD1 4.37Å; K9-L13 WeakPolarHBondContact O-CB 3.5Å; K9-L13 VanDerWaalsContact O-CG 3.26Å; K9-L13 WeakPolarHBondContact O-CG 3.42Å; K9-L13 PolarHBondContact O-N 3.46Å
10	L	91.5	Very high	82.2	Confident	106 Å²	106	103.8 Å²	103.8	56%	0.555	53%	0.532	S	S	*	.	H	α-helix	trans	-65.2	-44.2	176.6	-66.9	175.5	0	0	0	112.1	P6 L7 F8 L13 F14	P6-L10 WeakPolarHBondContact O-CG 2.97Å; P6-L10 PolarHBondContact O-N 2.95Å; P6-L10 VanDerWaalsContact O-N 3.09Å; L7-L10 PolarHBondContact O-N 3.32Å; L7-L10 VanDerWaalsContact O-N 3.12Å; F8-L10 VanDerWaalsContact C-N 3.33Å; F8-L10 PolarHBondContact O-N 3.07Å; L10-L13 PolarHBondContact O-N 3.44Å; L10-F14 WeakPolarHBondContact O-CB 3.44Å; L10-F14 PolarHBondContact O-N 3.02Å
11	V	89	Confident	82.7	Confident	76 Å²	76	102.2 Å²	102.2	46%	0.461	53%	0.529	S	S	.	.	H	α-helix	trans	-62.1	-44.9	175.7	177.2	0	0	0	0	110.4	L7 F8 L13 F14 V15	L7-V11 HydrophobicContact CG-CG2 4.46Å; L7-V11 WeakPolarHBondContact O-CG2 3.47Å; L7-V11 PolarHBondContact O-N 3.34Å; F8-V11 PolarHBondContact O-N 3.48Å; V11-L13 VanDerWaalsContact C-N 3.31Å; V11-L13 PolarHBondContact O-N 3.12Å; V11-F14 PolarHBondContact O-N 3.06Å; V11-V15 HydrophobicContact CG1-CG2 4.27Å; V11-V15 WeakPolarHBondContact O-CG2 3.35Å; V11-V15 PolarHBondContact O-N 2.92Å
12	A	87	Confident	84.8	Confident	42 Å²	42	93.7 Å²	93.7	35%	0.347	49%	0.487	S	S	.	.	H	α-helix	trans	-59.6	-41.5	177.2	0	0	0	0	0	112.2	F8 K9 R16	F8-A12 WeakPolarHBondContact O-CB 3.39Å; F8-A12 PolarHBondContact O-N 3.32Å; K9-A12 PolarHBondContact O-N 3.32Å; A12-R16 WeakPolarHBondContact O-CB 3.48Å; A12-R16 PolarHBondContact O-N 3.28Å
13	L	91.1	Very high	86.3	Confident	81 Å²	81	87.1 Å²	87.1	42%	0.424	45%	0.448	S	S	.	.	H	α-helix	trans	-69.1	-37.5	176	-70.9	175.3	0	0	0	112.8	K9 L10 V11 R16 Q17	K9-L13 HydrophobicContact CG-CD1 4.37Å; K9-L13 WeakPolarHBondContact O-CB 3.5Å; K9-L13 VanDerWaalsContact O-CG 3.26Å; K9-L13 WeakPolarHBondContact O-CG 3.42Å; K9-L13 PolarHBondContact O-N 3.46Å; L10-L13 PolarHBondContact O-N 3.44Å; V11-L13 VanDerWaalsContact C-N 3.31Å; V11-L13 PolarHBondContact O-N 3.12Å; L13-R16 PolarHBondContact O-N 2.96Å; L13-Q17 WeakPolarHBondContact O-CG 3.22Å; L13-Q17 PolarHBondContact O-N 3.39Å; L13-Q17 PolarHBondContact O-NE2 2.91Å
14	F	90.1	Very high	87.7	Confident	133 Å²	133	86 Å²	86	58%	0.583	44%	0.438	S	S	*	.	H	α-helix	trans	-65.6	-48.7	176.5	177.8	-100.9	0	0	0	111.2	L10 V11 R16 Q17 V18	L10-F14 WeakPolarHBondContact O-CB 3.44Å; L10-F14 PolarHBondContact O-N 3.02Å; V11-F14 PolarHBondContact O-N 3.06Å; F14-R16 VanDerWaalsContact C-N 3.25Å; F14-R16 PolarHBondContact O-N 2.9Å; F14-Q17 PolarHBondContact O-N 3.41Å; F14-V18 HydrophobicContact CD1-CG2 4.34Å; F14-V18 HydrophobicContact CD2-CG2 4.48Å; F14-V18 HydrophobicContact CE1-CG2 3.89Å; F14-V18 HydrophobicContact CE2-CG2 4.05Å; F14-V18 HydrophobicContact CZ-CG2 3.74Å; F14-V18 WeakPolarHBondContact O-CG2 3.23Å; F14-V18 PolarHBondContact O-N 3.03Å
15	V	89.8	Confident	88.7	Confident	13 Å²	13	88.8 Å²	88.8	8%	0.079	44%	0.438	C	S	.	.	H	α-helix	trans	-55.9	-44.1	175.4	170.4	0	0	0	0	110.4	V11 Q17 V18 S19 V89 Y90	V11-V15 HydrophobicContact CG1-CG2 4.27Å; V11-V15 WeakPolarHBondContact O-CG2 3.35Å; V11-V15 PolarHBondContact O-N 2.92Å; V15-Q17 PolarHBondContact O-N 2.93Å; V15-V18 PolarHBondContact O-N 2.93Å; V15-S19 VanDerWaalsContact O-CB 3.27Å; V15-S19 WeakPolarHBondContact O-CB 3.42Å; V15-S19 PolarHBondContact O-N 3.25Å; V15-S19 PolarHBondContact O-OG 3.4Å; V15-V89 HydrophobicContact CG1-CB 4.48Å; V15-V89 HydrophobicContact CG1-CG1 4.02Å; V15-V89 HydrophobicContact CG2-CG1 4.46Å; V15-Y90 HydrophobicContact CG1-CD1 4.5Å; V15-Y90 HydrophobicContact CG1-CE1 3.9Å; V15-Y90 HydrophobicContact CG1-CE2 4.37Å; V15-Y90 HydrophobicContact CG2-CE1 4.07Å
16	R	87.3	Confident	89.5	Confident	131 Å²	131	81.7 Å²	81.7	49%	0.494	41%	0.408	S	S	.	.	H	α-helix	trans	-62.3	-40.7	176.6	-170.4	173	-176.4	168.9	1.4	112.7	A12 L13 F14 S19 R20	A12-R16 WeakPolarHBondContact O-CB 3.48Å; A12-R16 PolarHBondContact O-N 3.28Å; L13-R16 PolarHBondContact O-N 2.96Å; F14-R16 VanDerWaalsContact C-N 3.25Å; F14-R16 PolarHBondContact O-N 2.9Å; R16-S19 WeakPolarHBondContact CA-OG 3.37Å; R16-S19 PolarHBondContact O-N 3.48Å; R16-S19 PolarHBondContact O-OG 3.35Å; R16-S19 VanDerWaalsContact O-OG 3.12Å; R16-R20 VanDerWaalsContact O-CG 3.22Å; R16-R20 WeakPolarHBondContact O-CG 3.35Å; R16-R20 PolarHBondContact O-N 2.89Å
17	Q	91.2	Very high	89.8	Confident	135 Å²	135	79 Å²	79	63%	0.631	39%	0.389	S	S	*	.	H	α-helix	trans	-65.6	-40.3	178	-77.4	172.2	81	0	0	112	L13 F14 V15 P21	L13-Q17 WeakPolarHBondContact O-CG 3.22Å; L13-Q17 PolarHBondContact O-N 3.39Å; L13-Q17 PolarHBondContact O-NE2 2.91Å; F14-Q17 PolarHBondContact O-N 3.41Å; V15-Q17 PolarHBondContact O-N 2.93Å; Q17-P21 WeakPolarHBondContact O-CD 3.36Å
18	V	90.5	Very high	89.8	Confident	54 Å²	54	77.8 Å²	77.8	33%	0.327	38%	0.383	S	S	.	.	H	α-helix	trans	-72.2	-34.7	176.5	178.5	0	0	0	0	111.4	F14 V15 P21 V89	F14-V18 HydrophobicContact CD1-CG2 4.34Å; F14-V18 HydrophobicContact CD2-CG2 4.48Å; F14-V18 HydrophobicContact CE1-CG2 3.89Å; F14-V18 HydrophobicContact CE2-CG2 4.05Å; F14-V18 HydrophobicContact CZ-CG2 3.74Å; F14-V18 WeakPolarHBondContact O-CG2 3.23Å; F14-V18 PolarHBondContact O-N 3.03Å; V15-V18 PolarHBondContact O-N 2.93Å; V18-P21 VanDerWaalsContact O-CD 3.29Å; V18-P21 WeakPolarHBondContact O-CD 3.48Å; V18-P21 VanDerWaalsContact O-CG 3.31Å; V18-P21 WeakPolarHBondContact O-CG 3.26Å; V18-V89 HydrophobicContact CB-CG2 4.47Å; V18-V89 HydrophobicContact CG1-CG1 4.28Å; V18-V89 HydrophobicContact CG1-CG2 3.88Å
19	S	91	Very high	89.7	Confident	5 Å²	5	71.5 Å²	71.5	4%	0.035	36%	0.363	C	S	.	.	H	α-helix	trans	-75	-30.2	-179.1	74.1	0	0	0	0	112.8	V15 R16 I22 A23	V15-S19 VanDerWaalsContact O-CB 3.27Å; V15-S19 WeakPolarHBondContact O-CB 3.42Å; V15-S19 PolarHBondContact O-N 3.25Å; V15-S19 PolarHBondContact O-OG 3.4Å; R16-S19 WeakPolarHBondContact CA-OG 3.37Å; R16-S19 PolarHBondContact O-N 3.48Å; R16-S19 PolarHBondContact O-OG 3.35Å; R16-S19 VanDerWaalsContact O-OG 3.12Å; S19-I22 PolarHBondContact O-N 2.9Å; S19-A23 VanDerWaalsContact O-CB 3.25Å; S19-A23 WeakPolarHBondContact O-CB 3.45Å; S19-A23 PolarHBondContact O-N 3.32Å
20	R	90.1	Very high	89.6	Confident	90 Å²	90	64.7 Å²	64.7	34%	0.34	33%	0.334	S	S	.	.	H	α-helix	trans	-52.8	-53.5	179.2	-80.7	-67.8	-171.8	-146.1	9.5	114.7	R16 I22 A23 N24 D82	R16-R20 VanDerWaalsContact O-CG 3.22Å; R16-R20 WeakPolarHBondContact O-CG 3.35Å; R16-R20 PolarHBondContact O-N 2.89Å; R20-I22 VanDerWaalsContact C-N 3.31Å; R20-I22 PolarHBondContact O-N 3.47Å; R20-A23 PolarHBondContact O-N 2.9Å; R20-N24 WeakPolarHBondContact O-CB 3.36Å; R20-N24 PolarHBondContact O-N 2.9Å; R20-N24 PolarHBondContact O-ND2 2.9Å; R20-D82 IonicContact NH1-OD1 3.16Å; R20-D82 IonicContact NH1-OD2 3.79Å; R20-D82 PolarHBondContact NH1-OD2 2.86Å
21	P	92.1	Very high	89.1	Confident	72 Å²	72	67 Å²	67	47%	0.468	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-39.4	178.5	23.9	-34	0	0	0	111.9	Q17 V18 N24 Q25	Q17-P21 WeakPolarHBondContact O-CD 3.36Å; V18-P21 VanDerWaalsContact O-CD 3.29Å; V18-P21 WeakPolarHBondContact O-CD 3.48Å; V18-P21 VanDerWaalsContact O-CG 3.31Å; V18-P21 WeakPolarHBondContact O-CG 3.26Å; P21-N24 PolarHBondContact O-N 3.15Å; P21-Q25 WeakPolarHBondContact O-CG 3.28Å; P21-Q25 PolarHBondContact O-N 3.26Å
22	I	91.3	Very high	88.9	Confident	50 Å²	50	71.2 Å²	71.2	26%	0.256	35%	0.354	S	S	.	.	H	α-helix	trans	-64.7	-49.9	178.3	-60	171.3	0	0	0	110.1	S19 R20 N24 Q25 L26 I88 V89	S19-I22 PolarHBondContact O-N 2.9Å; R20-I22 VanDerWaalsContact C-N 3.31Å; R20-I22 PolarHBondContact O-N 3.47Å; I22-N24 VanDerWaalsContact C-N 3.31Å; I22-N24 PolarHBondContact O-N 3.21Å; I22-Q25 WeakPolarHBondContact O-CB 3.34Å; I22-Q25 PolarHBondContact O-N 2.87Å; I22-Q25 VanDerWaalsContact O-N 3.14Å; I22-L26 HydrophobicContact CG2-CD1 4.01Å; I22-L26 HydrophobicContact CG2-CG 4.46Å; I22-L26 VanDerWaalsContact O-CG 3.29Å; I22-L26 WeakPolarHBondContact O-CG 3.36Å; I22-L26 PolarHBondContact O-N 3.38Å; I22-I88 HydrophobicContact CG2-CD1 4.18Å; I22-V89 HydrophobicContact CD1-CG2 3.72Å
23	A	91.3	Very high	88.7	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-58.9	-41.4	176.6	0	0	0	0	0	111.5	S19 R20 Q25 L26 K27 D82	S19-A23 VanDerWaalsContact O-CB 3.25Å; S19-A23 WeakPolarHBondContact O-CB 3.45Å; S19-A23 PolarHBondContact O-N 3.32Å; R20-A23 PolarHBondContact O-N 2.9Å; A23-Q25 VanDerWaalsContact C-N 3.34Å; A23-Q25 PolarHBondContact O-N 3.41Å; A23-L26 CarbonylContact O-C 3.6Å; A23-L26 PolarHBondContact O-N 2.98Å; A23-K27 WeakPolarHBondContact O-CB 3.36Å; A23-K27 VanDerWaalsContact O-CG 3.28Å; A23-K27 WeakPolarHBondContact O-CG 3.46Å; A23-K27 PolarHBondContact O-N 2.93Å; A23-D82 WeakPolarHBondContact CB-OD1 3.41Å
24	N	91.5	Very high	88.3	Confident	78 Å²	78	74 Å²	74	42%	0.417	36%	0.362	S	S	.	.	H	α-helix	trans	-62.5	-40.7	175.9	-70.9	-19.4	0	0	0	112	R20 P21 I22 K27 N28	R20-N24 WeakPolarHBondContact O-CB 3.36Å; R20-N24 PolarHBondContact O-N 2.9Å; R20-N24 PolarHBondContact O-ND2 2.9Å; P21-N24 PolarHBondContact O-N 3.15Å; I22-N24 VanDerWaalsContact C-N 3.31Å; I22-N24 PolarHBondContact O-N 3.21Å; N24-K27 PolarHBondContact O-N 3.25Å; N24-N28 VanDerWaalsContact O-CG 3.28Å; N24-N28 PolarHBondContact O-N 3.37Å; N24-N28 PolarHBondContact O-ND2 3.42Å
25	Q	90	Very high	88.1	Confident	135 Å²	135	72.5 Å²	72.5	63%	0.631	36%	0.363	S	S	*	.	H	α-helix	trans	-64.1	-41.6	173.8	-68.8	-65.8	88.8	0	0	111.8	P21 I22 A23 N28 G29	P21-Q25 WeakPolarHBondContact O-CG 3.28Å; P21-Q25 PolarHBondContact O-N 3.26Å; I22-Q25 WeakPolarHBondContact O-CB 3.34Å; I22-Q25 PolarHBondContact O-N 2.87Å; I22-Q25 VanDerWaalsContact O-N 3.14Å; A23-Q25 VanDerWaalsContact C-N 3.34Å; A23-Q25 PolarHBondContact O-N 3.41Å; Q25-N28 PolarHBondContact O-N 2.97Å; Q25-G29 PolarHBondContact O-N 3.16Å
26	L	88.5	Confident	87.9	Confident	32 Å²	32	74.1 Å²	74.1	17%	0.168	37%	0.369	C	S	.	.	H	α-helix	trans	-65.1	-38.9	175.7	-65.4	169	0	0	0	111.8	I22 A23 G29 A30 F36 A81 L84 I88	I22-L26 HydrophobicContact CG2-CD1 4.01Å; I22-L26 HydrophobicContact CG2-CG 4.46Å; I22-L26 VanDerWaalsContact O-CG 3.29Å; I22-L26 WeakPolarHBondContact O-CG 3.36Å; I22-L26 PolarHBondContact O-N 3.38Å; A23-L26 CarbonylContact O-C 3.6Å; A23-L26 PolarHBondContact O-N 2.98Å; L26-G29 PolarHBondContact O-N 3.45Å; L26-A30 WeakPolarHBondContact O-CB 3.33Å; L26-A30 PolarHBondContact O-N 3.47Å; L26-F36 HydrophobicContact CB-CE1 4.48Å; L26-F36 HydrophobicContact CD2-CE1 4.49Å; L26-F36 HydrophobicContact CD2-CZ 3.91Å; L26-A81 HydrophobicContact CB-CB 4Å; L26-L84 HydrophobicContact CD1-CB 4.02Å; L26-L84 HydrophobicContact CD1-CD2 3.92Å; L26-L84 HydrophobicContact CD1-CG 3.92Å; L26-L84 HydrophobicContact CD2-CD2 4.06Å; L26-I88 HydrophobicContact CD1-CD1 4.04Å
27	K	88.9	Confident	87.9	Confident	22 Å²	22	70.8 Å²	70.8	10%	0.096	36%	0.357	C	S	.	.	H	α-helix	trans	-61.4	-47.1	173.9	-73.6	176.4	-168.9	-178.5	0	110.9	A23 N24 G29 A30 K31 E78 A81 D82	A23-K27 WeakPolarHBondContact O-CB 3.36Å; A23-K27 VanDerWaalsContact O-CG 3.28Å; A23-K27 WeakPolarHBondContact O-CG 3.46Å; A23-K27 PolarHBondContact O-N 2.93Å; N24-K27 PolarHBondContact O-N 3.25Å; K27-G29 VanDerWaalsContact C-N 3.35Å; K27-A30 PolarHBondContact O-N 3.32Å; K27-K31 WeakPolarHBondContact O-CG 3.48Å; K27-K31 PolarHBondContact O-N 2.89Å; K27-E78 HydrophobicContact CD-CG 4.11Å; K27-E78 VanDerWaalsContact CE-CG 3.45Å; K27-E78 WeakPolarHBondContact CE-O 3.42Å; K27-E78 IonicContact NZ-OE1 3.24Å; K27-E78 PolarHBondContact NZ-OE1 2.85Å; K27-A81 HydrophobicContact CB-CB 4.34Å; K27-A81 HydrophobicContact CD-CB 4.47Å; K27-A81 HydrophobicContact CG-CB 3.39Å; K27-D82 WeakPolarHBondContact CE-OD1 3.4Å; K27-D82 IonicContact NZ-OD1 2.77Å; K27-D82 PolarHBondContact NZ-OD1 3.29Å; K27-D82 IonicContact NZ-OD2 3.53Å
28	N	88.9	Confident	87.7	Confident	74 Å²	74	72 Å²	72	40%	0.396	36%	0.356	S	S	.	.	H	α-helix	trans	-61.4	-45.3	176.7	-68.7	-19.9	0	0	0	110.6	N24 Q25 A30 K31 H32	N24-N28 VanDerWaalsContact O-CG 3.28Å; N24-N28 PolarHBondContact O-N 3.37Å; N24-N28 PolarHBondContact O-ND2 3.42Å; Q25-N28 PolarHBondContact O-N 2.97Å; N28-A30 VanDerWaalsContact C-N 3.34Å; N28-A30 PolarHBondContact O-N 3.48Å; N28-K31 PolarHBondContact O-N 3.47Å; N28-H32 PolarHBondContact O-CD2 2.99Å; N28-H32 PolarHBondContact O-N 3.41Å; N28-H32 VanDerWaalsContact O-N 3.13Å
29	G	85.1	Confident	87.6	Confident	29 Å²	29	78 Å²	78	30%	0.299	37%	0.374	S	S	.	.	H	α-helix	trans	-59.4	-40.1	174.9	0	0	0	0	0	113.5	Q25 L26 K27 H32 S33	Q25-G29 PolarHBondContact O-N 3.16Å; L26-G29 PolarHBondContact O-N 3.45Å; K27-G29 VanDerWaalsContact C-N 3.35Å; G29-H32 PolarHBondContact O-N 2.94Å; G29-S33 WeakPolarHBondContact O-CB 3.39Å; G29-S33 PolarHBondContact O-N 3.26Å; G29-S33 PolarHBondContact O-OG 3.02Å
30	A	84.4	Confident	87.4	Confident	1 Å²	1	80 Å²	80	1%	0.008	39%	0.386	C	S	.	.	H	α-helix	trans	-68.7	-32.9	176.8	0	0	0	0	0	113.5	L26 K27 N28 F36 R37 V77	L26-A30 WeakPolarHBondContact O-CB 3.33Å; L26-A30 PolarHBondContact O-N 3.47Å; K27-A30 PolarHBondContact O-N 3.32Å; N28-A30 VanDerWaalsContact C-N 3.34Å; N28-A30 PolarHBondContact O-N 3.48Å; A30-F36 HydrophobicContact CB-CD1 3.69Å; A30-F36 HydrophobicContact CB-CE1 4Å; A30-R37 HydrophobicContact CB-CB 4.29Å; A30-R37 WeakPolarHBondContact O-CB 3.38Å; A30-V77 HydrophobicContact CB-CG1 3.57Å
31	K	82.2	Confident	87.3	Confident	155 Å²	155	75.7 Å²	75.7	67%	0.674	37%	0.37	S	S	*	.	H	α-helix	trans	-68.1	-37.3	174	-72.5	178.1	179.1	-175.6	0	111.8	K27 N28	K27-K31 WeakPolarHBondContact O-CG 3.48Å; K27-K31 PolarHBondContact O-N 2.89Å; N28-K31 PolarHBondContact O-N 3.47Å
32	H	83.6	Confident	87.1	Confident	164 Å²	164	73 Å²	73	76%	0.759	35%	0.351	S	S	*	.	H	α-helix	trans	-84	-26.5	-180	-67.2	-61.2	0	0	0	113.8	N28 G29	N28-H32 PolarHBondContact O-CD2 2.99Å; N28-H32 PolarHBondContact O-N 3.41Å; N28-H32 VanDerWaalsContact O-N 3.13Å; G29-H32 PolarHBondContact O-N 2.94Å
33	S	83.9	Confident	87	Confident	45 Å²	45	73.7 Å²	73.7	32%	0.315	36%	0.359	S	S	.	.			trans	-119.1	108.5	-177	65.9	0	0	0	0	112.5	G29 V35 F36 R37	G29-S33 WeakPolarHBondContact O-CB 3.39Å; G29-S33 PolarHBondContact O-N 3.26Å; G29-S33 PolarHBondContact O-OG 3.02Å; S33-V35 PolarHBondContact O-N 3.26Å; S33-F36 PolarHBondContact O-N 3.31Å; S33-F36 WeakPolarHBondContact OG-CB 3.35Å; S33-R37 WeakPolarHBondContact O-CB 3.25Å; S33-R37 PolarHBondContact O-N 2.96Å; S33-R37 VanDerWaalsContact O-N 3.12Å
34	H	82.7	Confident	87	Confident	137 Å²	137	76.4 Å²	76.4	63%	0.634	37%	0.373	S	S	*	.	H	α-helix	trans	-58.7	-34	175.1	-75.2	-84.4	0	0	0	112.5	R38	H34-R38 WeakPolarHBondContact O-CB 3.5Å; H34-R38 PolarHBondContact O-N 3.44Å
35	V	86.1	Confident	87.1	Confident	100 Å²	100	72.7 Å²	72.7	61%	0.606	35%	0.353	S	S	*	.	H	α-helix	trans	-62.9	-54.9	178.6	179.1	0	0	0	0	110.4	S33 R37 R38 Y39	S33-V35 PolarHBondContact O-N 3.26Å; V35-R37 VanDerWaalsContact C-N 3.33Å; V35-R37 PolarHBondContact O-N 3.01Å; V35-R38 PolarHBondContact O-N 3.35Å; V35-Y39 HydrophobicContact CB-CD2 4.34Å; V35-Y39 HydrophobicContact CG1-CD2 3.65Å; V35-Y39 HydrophobicContact CG1-CE2 4.14Å; V35-Y39 WeakPolarHBondContact O-CB 3.43Å; V35-Y39 VanDerWaalsContact O-CD2 3.26Å; V35-Y39 WeakPolarHBondContact O-CD2 3.22Å; V35-Y39 PolarHBondContact O-N 3.21Å
36	F	84.6	Confident	87.2	Confident	47 Å²	47	67.9 Å²	67.9	21%	0.206	33%	0.331	C	S	.	.	H	α-helix	trans	-61.7	-44.3	-179.2	-178.8	-107	0	0	0	111.7	L26 A30 S33 R38 V40 C41 L84	L26-F36 HydrophobicContact CB-CE1 4.48Å; L26-F36 HydrophobicContact CD2-CE1 4.49Å; L26-F36 HydrophobicContact CD2-CZ 3.91Å; A30-F36 HydrophobicContact CB-CD1 3.69Å; A30-F36 HydrophobicContact CB-CE1 4Å; S33-F36 PolarHBondContact O-N 3.31Å; S33-F36 WeakPolarHBondContact OG-CB 3.35Å; F36-R38 PolarHBondContact O-N 3.16Å; F36-V40 HydrophobicContact CD2-CB 3.92Å; F36-V40 HydrophobicContact CD2-CG1 4.39Å; F36-V40 HydrophobicContact CD2-CG2 3.84Å; F36-V40 HydrophobicContact CE2-CB 3.86Å; F36-V40 HydrophobicContact CE2-CG1 3.82Å; F36-V40 HydrophobicContact CE2-CG2 4.06Å; F36-V40 HydrophobicContact CZ-CB 4.49Å; F36-V40 HydrophobicContact CZ-CG1 4.29Å; F36-V40 WeakPolarHBondContact O-CA 3.43Å; F36-V40 WeakPolarHBondContact O-CB 3.29Å; F36-V40 PolarHBondContact O-N 2.87Å; F36-C41 WeakPolarHBondContact CE1-SG 3.48Å; F36-C41 PolarHBondContact O-N 3.39Å; F36-L84 HydrophobicContact CE2-CD2 3.99Å; F36-L84 HydrophobicContact CZ-CD2 3.56Å
37	R	87.2	Confident	87.3	Confident	62 Å²	62	71.8 Å²	71.8	23%	0.234	35%	0.351	C	S	.	.	I	π-helix	trans	-54.6	-51.5	174.5	160.8	176.1	146.5	174.6	-6.1	111.5	A30 S33 V35 L42 E73 V77	A30-R37 HydrophobicContact CB-CB 4.29Å; A30-R37 WeakPolarHBondContact O-CB 3.38Å; S33-R37 WeakPolarHBondContact O-CB 3.25Å; S33-R37 PolarHBondContact O-N 2.96Å; S33-R37 VanDerWaalsContact O-N 3.12Å; V35-R37 VanDerWaalsContact C-N 3.33Å; V35-R37 PolarHBondContact O-N 3.01Å; R37-L42 HydrophobicContact CG-CD1 3.78Å; R37-L42 WeakPolarHBondContact O-CB 3.28Å; R37-L42 WeakPolarHBondContact O-CD1 3.43Å; R37-L42 WeakPolarHBondContact O-CG 3.46Å; R37-L42 PolarHBondContact O-N 2.87Å; R37-E73 IonicContact CZ-OE1 3.98Å; R37-E73 IonicContact CZ-OE2 3.59Å; R37-E73 IonicContact NH2-OE1 2.98Å; R37-E73 PolarHBondContact NH2-OE1 3.09Å; R37-E73 IonicContact NH2-OE2 2.63Å; R37-E73 PolarHBondContact NH2-OE2 3.37Å; R37-V77 HydrophobicContact CB-CG2 4.32Å; R37-V77 HydrophobicContact CG-CG2 3.63Å
38	R	87.3	Confident	87.4	Confident	161 Å²	161	76.2 Å²	76.2	61%	0.608	37%	0.368	S	S	*	.	I	π-helix	trans	-75.2	-39	-173.4	-175.4	59.5	176.1	-169.6	1.6	113.8	H34 V35 F36 P43	H34-R38 WeakPolarHBondContact O-CB 3.5Å; H34-R38 PolarHBondContact O-N 3.44Å; V35-R38 PolarHBondContact O-N 3.35Å; F36-R38 PolarHBondContact O-N 3.16Å; R38-P43 VanDerWaalsContact O-CD 3.3Å; R38-P43 WeakPolarHBondContact O-CD 3.5Å
39	Y	87.9	Confident	87.6	Confident	178 Å²	178	74.2 Å²	74.2	70%	0.698	36%	0.356	S	S	*	.	I	π-helix	trans	-95.6	-22.2	-172	-70.4	-74.4	0	0	0	114.1	V35 P43	V35-Y39 HydrophobicContact CB-CD2 4.34Å; V35-Y39 HydrophobicContact CG1-CD2 3.65Å; V35-Y39 HydrophobicContact CG1-CE2 4.14Å; V35-Y39 WeakPolarHBondContact O-CB 3.43Å; V35-Y39 VanDerWaalsContact O-CD2 3.26Å; V35-Y39 WeakPolarHBondContact O-CD2 3.22Å; V35-Y39 PolarHBondContact O-N 3.21Å; Y39-P43 WeakPolarHBondContact O-CG 3.5Å
40	V	87.8	Confident	87.8	Confident	48 Å²	48	80.1 Å²	80.1	29%	0.291	37%	0.369	S	S	.	.	I	π-helix	trans	-115.2	-63.9	-177.3	-174.6	0	0	0	0	110.8	F36 P43 I44 L84	F36-V40 HydrophobicContact CD2-CB 3.92Å; F36-V40 HydrophobicContact CD2-CG1 4.39Å; F36-V40 HydrophobicContact CD2-CG2 3.84Å; F36-V40 HydrophobicContact CE2-CB 3.86Å; F36-V40 HydrophobicContact CE2-CG1 3.82Å; F36-V40 HydrophobicContact CE2-CG2 4.06Å; F36-V40 HydrophobicContact CZ-CB 4.49Å; F36-V40 HydrophobicContact CZ-CG1 4.29Å; F36-V40 WeakPolarHBondContact O-CA 3.43Å; F36-V40 WeakPolarHBondContact O-CB 3.29Å; F36-V40 PolarHBondContact O-N 2.87Å; V40-P43 WeakPolarHBondContact O-CD 3.44Å; V40-P43 WeakPolarHBondContact O-CG 3.38Å; V40-I44 HydrophobicContact CG1-CD1 3.83Å; V40-I44 WeakPolarHBondContact O-CB 3.2Å; V40-I44 WeakPolarHBondContact O-CD1 3.42Å; V40-I44 WeakPolarHBondContact O-CG1 3.47Å; V40-I44 PolarHBondContact O-N 2.94Å; V40-L84 HydrophobicContact CG1-CD2 4.03Å
41	C	88	Confident	88.2	Confident	0 Å²	0	83.2 Å²	83.2	0%	0	39%	0.388	C	S	.	.	I	π-helix	trans	-65.9	-49.7	-171.7	-65.6	0	0	0	0	112.9	F36 I44 A45	F36-C41 WeakPolarHBondContact CE1-SG 3.48Å; F36-C41 PolarHBondContact O-N 3.39Å; C41-I44 PolarHBondContact O-N 3.22Å; C41-A45 WeakPolarHBondContact O-CB 3.29Å; C41-A45 PolarHBondContact O-N 3.31Å
42	L	88.6	Confident	88.7	Confident	15 Å²	15	79.5 Å²	79.5	8%	0.079	38%	0.375	C	S	.	.	H	α-helix	trans	-58.9	-52.9	-178.2	-87.4	153	0	0	0	113.4	R37 I44 A45 Q46 A76	R37-L42 HydrophobicContact CG-CD1 3.78Å; R37-L42 WeakPolarHBondContact O-CB 3.28Å; R37-L42 WeakPolarHBondContact O-CD1 3.43Å; R37-L42 WeakPolarHBondContact O-CG 3.46Å; R37-L42 PolarHBondContact O-N 2.87Å; L42-I44 VanDerWaalsContact C-N 3.35Å; L42-I44 PolarHBondContact O-N 3.46Å; L42-A45 PolarHBondContact O-N 2.91Å; L42-Q46 WeakPolarHBondContact O-CB 3.26Å; L42-Q46 WeakPolarHBondContact O-CG 3.46Å; L42-Q46 PolarHBondContact O-N 3.38Å; L42-A76 HydrophobicContact CD2-CB 3.8Å
43	P	89.4	Confident	89.1	Confident	64 Å²	64	73.2 Å²	73.2	42%	0.416	35%	0.349	S	S	.	.	H	α-helix	trans	-65	-38.8	-178.7	21.8	-31.2	0	0	0	112.3	R38 Y39 V40 L47	R38-P43 VanDerWaalsContact O-CD 3.3Å; R38-P43 WeakPolarHBondContact O-CD 3.5Å; Y39-P43 WeakPolarHBondContact O-CG 3.5Å; V40-P43 WeakPolarHBondContact O-CD 3.44Å; V40-P43 WeakPolarHBondContact O-CG 3.38Å; P43-L47 VanDerWaalsContact O-CB 3.24Å; P43-L47 WeakPolarHBondContact O-CB 3.38Å; P43-L47 PolarHBondContact O-N 2.89Å
44	I	91.5	Very high	89.4	Confident	58 Å²	58	73 Å²	73	30%	0.297	35%	0.345	S	S	.	.	H	α-helix	trans	-64.9	-46.3	177.2	-65.7	172.3	0	0	0	110.4	V40 C41 L42 L47 Y48 I83	V40-I44 HydrophobicContact CG1-CD1 3.83Å; V40-I44 WeakPolarHBondContact O-CB 3.2Å; V40-I44 WeakPolarHBondContact O-CD1 3.42Å; V40-I44 WeakPolarHBondContact O-CG1 3.47Å; V40-I44 PolarHBondContact O-N 2.94Å; C41-I44 PolarHBondContact O-N 3.22Å; L42-I44 VanDerWaalsContact C-N 3.35Å; L42-I44 PolarHBondContact O-N 3.46Å; I44-L47 PolarHBondContact O-N 2.94Å; I44-Y48 WeakPolarHBondContact O-CB 3.2Å; I44-Y48 PolarHBondContact O-N 3.47Å; I44-I83 HydrophobicContact CG2-CB 4.44Å; I44-I83 HydrophobicContact CG2-CG2 3.93Å
45	A	92.1	Very high	89.8	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-65.4	-43.1	-179.7	0	0	0	0	0	112.5	C41 L42 Y48 H49 A76 L79	C41-A45 WeakPolarHBondContact O-CB 3.29Å; C41-A45 PolarHBondContact O-N 3.31Å; L42-A45 PolarHBondContact O-N 2.91Å; A45-Y48 PolarHBondContact O-N 3.22Å; A45-H49 VanDerWaalsContact O-CB 3.25Å; A45-H49 WeakPolarHBondContact O-CB 3.36Å; A45-H49 PolarHBondContact O-N 3.27Å; A45-A76 HydrophobicContact CB-CB 4.01Å; A45-A76 WeakPolarHBondContact CB-O 3.31Å; A45-L79 HydrophobicContact CB-CB 4.36Å; A45-L79 HydrophobicContact CB-CD2 4.48Å
46	Q	92	Very high	90.1	Very high	34 Å²	34	74.2 Å²	74.2	16%	0.159	34%	0.341	C	S	.	.	H	α-helix	trans	-68.1	-37.2	178.2	-65	-66	-15.1	0	0	111.4	L42 R50 L71	L42-Q46 WeakPolarHBondContact O-CB 3.26Å; L42-Q46 WeakPolarHBondContact O-CG 3.46Å; L42-Q46 PolarHBondContact O-N 3.38Å; Q46-R50 WeakPolarHBondContact O-CB 3.49Å; Q46-R50 VanDerWaalsContact O-CG 3.22Å; Q46-R50 WeakPolarHBondContact O-CG 3.42Å; Q46-R50 PolarHBondContact O-N 2.86Å; Q46-L71 PolarHBondContact NE2-O 2.93Å
47	L	91.4	Very high	90.5	Very high	113 Å²	113	74.8 Å²	74.8	59%	0.592	34%	0.344	S	S	*	.	H	α-helix	trans	-63.7	-50.1	173.4	178.2	62	0	0	0	111	P43 I44 H49 R50 V51	P43-L47 VanDerWaalsContact O-CB 3.24Å; P43-L47 WeakPolarHBondContact O-CB 3.38Å; P43-L47 PolarHBondContact O-N 2.89Å; I44-L47 PolarHBondContact O-N 2.94Å; L47-H49 VanDerWaalsContact C-N 3.33Å; L47-H49 PolarHBondContact O-N 2.88Å; L47-R50 PolarHBondContact O-N 3.37Å; L47-V51 HydrophobicContact CD1-CG2 4.37Å; L47-V51 WeakPolarHBondContact O-CG2 3.23Å; L47-V51 PolarHBondContact O-N 3.33Å
48	Y	91.6	Very high	90.7	Very high	115 Å²	115	75.9 Å²	75.9	45%	0.451	35%	0.354	S	S	.	.	H	α-helix	trans	-57.7	-47.7	178.3	-179	-86.7	0	0	0	111	I44 A45 R50 V51 D52 L79 I83	I44-Y48 WeakPolarHBondContact O-CB 3.2Å; I44-Y48 PolarHBondContact O-N 3.47Å; A45-Y48 PolarHBondContact O-N 3.22Å; Y48-R50 PolarHBondContact O-N 3.07Å; Y48-V51 PolarHBondContact O-N 3.45Å; Y48-D52 HydrophobicContact CD1-CB 4.46Å; Y48-D52 HydrophobicContact CE1-CB 4.27Å; Y48-D52 WeakPolarHBondContact O-CB 3.49Å; Y48-D52 PolarHBondContact O-N 3.46Å; Y48-L79 HydrophobicContact CD1-CD1 4.26Å; Y48-L79 HydrophobicContact CD1-CD2 3.92Å; Y48-L79 HydrophobicContact CD1-CG 4.36Å; Y48-L79 HydrophobicContact CE1-CD1 4.21Å; Y48-L79 HydrophobicContact CE1-CD2 4.49Å; Y48-I83 HydrophobicContact CD1-CD1 3.8Å; Y48-I83 HydrophobicContact CD2-CD1 3.52Å; Y48-I83 HydrophobicContact CD2-CG1 4.22Å; Y48-I83 HydrophobicContact CE1-CD1 4.39Å; Y48-I83 HydrophobicContact CE2-CD1 4.14Å; Y48-I83 HydrophobicContact CE2-CG1 4.44Å; Y48-I83 HydrophobicContact CG-CD1 3.31Å; Y48-I83 HydrophobicContact CG-CG1 4.41Å
49	H	92.5	Very high	91	Very high	33 Å²	33	76.2 Å²	76.2	15%	0.153	37%	0.365	C	S	.	.	H	α-helix	trans	-61.1	-43.1	179.4	-173.8	60.6	0	0	0	112.7	A45 L47 V51 D52 V53 P69 L71	A45-H49 VanDerWaalsContact O-CB 3.25Å; A45-H49 WeakPolarHBondContact O-CB 3.36Å; A45-H49 PolarHBondContact O-N 3.27Å; L47-H49 VanDerWaalsContact C-N 3.33Å; L47-H49 PolarHBondContact O-N 2.88Å; H49-V51 VanDerWaalsContact C-N 3.33Å; H49-V51 PolarHBondContact O-N 2.93Å; H49-D52 PolarHBondContact O-N 3.29Å; H49-V53 VanDerWaalsContact CE1-CG2 3.48Å; H49-V53 WeakPolarHBondContact CE1-CG2 3.23Å; H49-V53 WeakPolarHBondContact O-CB 3.47Å; H49-V53 WeakPolarHBondContact O-CG2 3.47Å; H49-V53 PolarHBondContact O-N 2.96Å; H49-P69 PolarHBondContact CD2-O 3.45Å; H49-P69 PolarHBondContact NE2-O 2.86Å; H49-L71 HydrophobicContact CB-CD1 3.61Å; H49-L71 HydrophobicContact CB-CG 4.11Å
50	R	90.1	Very high	91.2	Very high	153 Å²	153	73.1 Å²	73.1	58%	0.577	36%	0.358	S	S	*	.	H	α-helix	trans	-59.9	-44.3	175.4	-76.5	173.7	179.9	-176	0.9	111.8	Q46 L47 Y48 T54 V68	Q46-R50 WeakPolarHBondContact O-CB 3.49Å; Q46-R50 VanDerWaalsContact O-CG 3.22Å; Q46-R50 WeakPolarHBondContact O-CG 3.42Å; Q46-R50 PolarHBondContact O-N 2.86Å; L47-R50 PolarHBondContact O-N 3.37Å; Y48-R50 PolarHBondContact O-N 3.07Å; R50-T54 WeakPolarHBondContact O-CB 3.44Å; R50-T54 PolarHBondContact O-N 2.94Å; R50-T54 PolarHBondContact O-OG1 2.94Å; R50-V68 HydrophobicContact CG-CB 4.38Å; R50-V68 HydrophobicContact CG-CG1 4.47Å
51	V	92.6	Very high	91.3	Very high	65 Å²	65	74 Å²	74	39%	0.394	38%	0.376	S	S	.	.	H	α-helix	trans	-66.4	-45.2	178.4	173.2	0	0	0	0	110.7	L47 Y48 H49 T54 K55	L47-V51 HydrophobicContact CD1-CG2 4.37Å; L47-V51 WeakPolarHBondContact O-CG2 3.23Å; L47-V51 PolarHBondContact O-N 3.33Å; Y48-V51 PolarHBondContact O-N 3.45Å; H49-V51 VanDerWaalsContact C-N 3.33Å; H49-V51 PolarHBondContact O-N 2.93Å; V51-T54 PolarHBondContact O-N 3.39Å; V51-K55 HydrophobicContact CG1-CD 3.98Å; V51-K55 HydrophobicContact CG1-CG 4.3Å; V51-K55 WeakPolarHBondContact O-CB 3.44Å; V51-K55 WeakPolarHBondContact O-CG 3.43Å; V51-K55 PolarHBondContact O-N 2.89Å
52	D	91.6	Very high	91.4	Very high	78 Å²	78	81.1 Å²	81.1	42%	0.417	41%	0.408	S	S	.	.	H	α-helix	trans	-60.2	-52.1	-179.7	-176.1	58.3	0	0	0	111.6	Y48 H49 T54 K55 K56	Y48-D52 HydrophobicContact CD1-CB 4.46Å; Y48-D52 HydrophobicContact CE1-CB 4.27Å; Y48-D52 WeakPolarHBondContact O-CB 3.49Å; Y48-D52 PolarHBondContact O-N 3.46Å; H49-D52 PolarHBondContact O-N 3.29Å; D52-T54 VanDerWaalsContact C-N 3.34Å; D52-T54 PolarHBondContact O-N 3.39Å; D52-K55 PolarHBondContact O-N 3.28Å; D52-K56 WeakPolarHBondContact O-CB 3.48Å; D52-K56 PolarHBondContact O-N 2.88Å
53	V	91.9	Very high	91.3	Very high	32 Å²	32	81.8 Å²	81.8	19%	0.194	42%	0.419	C	S	.	.	H	α-helix	trans	-62.9	-41.6	177.8	176.7	0	0	0	0	111.1	H49 K56 M57 P65 V68	H49-V53 VanDerWaalsContact CE1-CG2 3.48Å; H49-V53 WeakPolarHBondContact CE1-CG2 3.23Å; H49-V53 WeakPolarHBondContact O-CB 3.47Å; H49-V53 WeakPolarHBondContact O-CG2 3.47Å; H49-V53 PolarHBondContact O-N 2.96Å; V53-K56 PolarHBondContact O-N 3.36Å; V53-M57 HydrophobicContact CG1-CG 4.28Å; V53-M57 WeakPolarHBondContact O-CB 3.43Å; V53-M57 WeakPolarHBondContact O-CG 3.48Å; V53-M57 PolarHBondContact O-N 2.9Å; V53-P65 HydrophobicContact CG1-CG 4.28Å; V53-V68 HydrophobicContact CB-CG1 3.94Å; V53-V68 HydrophobicContact CB-CG2 4.26Å; V53-V68 HydrophobicContact CG1-CG1 4.06Å; V53-V68 HydrophobicContact CG1-CG2 4.01Å; V53-V68 HydrophobicContact CG2-CG1 3.99Å
54	T	89.8	Confident	91.1	Very high	39 Å²	39	87 Å²	87	24%	0.239	44%	0.435	C	S	.	.	H	α-helix	trans	-63.8	-44.9	178.4	-60.3	0	0	0	0	111.6	R50 V51 D52 M57 I58 K64	R50-T54 WeakPolarHBondContact O-CB 3.44Å; R50-T54 PolarHBondContact O-N 2.94Å; R50-T54 PolarHBondContact O-OG1 2.94Å; V51-T54 PolarHBondContact O-N 3.39Å; D52-T54 VanDerWaalsContact C-N 3.34Å; D52-T54 PolarHBondContact O-N 3.39Å; T54-M57 PolarHBondContact O-N 3.21Å; T54-I58 HydrophobicContact CG2-CD1 3.68Å; T54-I58 HydrophobicContact CG2-CG1 4.35Å; T54-I58 WeakPolarHBondContact O-CB 3.41Å; T54-I58 WeakPolarHBondContact O-CG1 3.39Å; T54-I58 PolarHBondContact O-N 3.47Å; T54-K64 HydrophobicContact CG2-CG 4.23Å
55	K	93	Very high	90.6	Very high	143 Å²	143	85.9 Å²	85.9	62%	0.622	43%	0.431	S	S	*	.	H	α-helix	trans	-63.5	-43.2	177.3	-76.4	-177.3	178.2	-177.4	0	111.6	V51 D52 M57 I58 M59	V51-K55 HydrophobicContact CG1-CD 3.98Å; V51-K55 HydrophobicContact CG1-CG 4.3Å; V51-K55 WeakPolarHBondContact O-CB 3.44Å; V51-K55 WeakPolarHBondContact O-CG 3.43Å; V51-K55 PolarHBondContact O-N 2.89Å; D52-K55 PolarHBondContact O-N 3.28Å; K55-M57 PolarHBondContact O-N 3.1Å; K55-I58 PolarHBondContact O-N 2.98Å; K55-M59 VanDerWaalsContact O-CB 3.27Å; K55-M59 WeakPolarHBondContact O-CB 3.26Å; K55-M59 PolarHBondContact O-N 3.41Å
56	K	92	Very high	90.1	Very high	121 Å²	121	91.4 Å²	91.4	53%	0.526	48%	0.477	S	S	.	.	H	α-helix	trans	-60.5	-44.7	177.2	-174.5	176	-179.7	177.6	0	111.8	D52 V53 M59 M60	D52-K56 WeakPolarHBondContact O-CB 3.48Å; D52-K56 PolarHBondContact O-N 2.88Å; V53-K56 PolarHBondContact O-N 3.36Å; K56-M59 PolarHBondContact O-N 2.94Å; K56-M60 HydrophobicContact CD-CE 4.28Å; K56-M60 VanDerWaalsContact CE-CE 3.45Å; K56-M60 HydrophobicContact CG-CE 3.81Å; K56-M60 HydrophobicContact CG-SD 4.26Å; K56-M60 WeakPolarHBondContact O-CG 3.17Å; K56-M60 PolarHBondContact O-N 2.85Å
57	M	92.1	Very high	89.5	Confident	58 Å²	58	98.7 Å²	98.7	29%	0.286	51%	0.508	S	S	.	.	H	α-helix	trans	-68.5	-40.7	178.8	-70.2	-62.7	-73.9	0	0	112.7	V53 T54 K55 M59 M60 G61 F62 G63 P65	V53-M57 HydrophobicContact CG1-CG 4.28Å; V53-M57 WeakPolarHBondContact O-CB 3.43Å; V53-M57 WeakPolarHBondContact O-CG 3.48Å; V53-M57 PolarHBondContact O-N 2.9Å; T54-M57 PolarHBondContact O-N 3.21Å; K55-M57 PolarHBondContact O-N 3.1Å; M57-M59 VanDerWaalsContact C-N 3.34Å; M57-M60 PolarHBondContact O-N 3.4Å; M57-G61 PolarHBondContact O-N 3.1Å; M57-F62 HydrophobicContact CE-CB 3.41Å; M57-F62 VanDerWaalsContact CE-CB 3.41Å; M57-F62 HydrophobicContact CE-CD2 3.86Å; M57-F62 HydrophobicContact CE-CG 3.84Å; M57-F62 PolarHBondContact O-N 2.93Å; M57-F62 HydrophobicContact SD-CB 4.39Å; M57-F62 HydrophobicContact SD-CD2 4.07Å; M57-G63 CarbonylContact C-O 3.45Å; M57-G63 VanDerWaalsContact CB-O 3.29Å; M57-G63 WeakPolarHBondContact CB-O 3.42Å; M57-P65 HydrophobicContact CB-CG 4.48Å; M57-P65 HydrophobicContact CG-CB 4.35Å; M57-P65 HydrophobicContact CG-CG 4.26Å
58	I	92.6	Very high	89.1	Confident	86 Å²	86	94.7 Å²	94.7	44%	0.441	49%	0.488	S	S	.	.	H	α-helix	trans	-62.6	-43.7	173.9	-70.1	170.1	0	0	0	110.3	T54 K55 M60 G61 G63 K64	T54-I58 HydrophobicContact CG2-CD1 3.68Å; T54-I58 HydrophobicContact CG2-CG1 4.35Å; T54-I58 WeakPolarHBondContact O-CB 3.41Å; T54-I58 WeakPolarHBondContact O-CG1 3.39Å; T54-I58 PolarHBondContact O-N 3.47Å; K55-I58 PolarHBondContact O-N 2.98Å; I58-M60 VanDerWaalsContact C-N 3.32Å; I58-M60 PolarHBondContact O-N 3.05Å; I58-G61 PolarHBondContact O-N 3.25Å; I58-G63 PolarHBondContact N-O 3.24Å; I58-K64 HydrophobicContact CD1-CG 4.02Å; I58-K64 HydrophobicContact CG1-CG 4.31Å
59	M	93.1	Very high	88.6	Confident	168 Å²	168	93.7 Å²	93.7	83%	0.828	50%	0.496	S	S	*	.	H	α-helix	trans	-64.3	-35.2	179	-176.2	-177.9	-70.2	0	0	112.6	K55 K56 M57 G61	K55-M59 VanDerWaalsContact O-CB 3.27Å; K55-M59 WeakPolarHBondContact O-CB 3.26Å; K55-M59 PolarHBondContact O-N 3.41Å; K56-M59 PolarHBondContact O-N 2.94Å; M57-M59 VanDerWaalsContact C-N 3.34Å; M59-G61 PolarHBondContact O-N 2.89Å
60	M	92.2	Very high	88.1	Confident	112 Å²	112	96.5 Å²	96.5	55%	0.552	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	0.1	174.7	-67.9	177.2	-178.9	0	0	113.4	K56 M57 I58 F62	K56-M60 HydrophobicContact CD-CE 4.28Å; K56-M60 VanDerWaalsContact CE-CE 3.45Å; K56-M60 HydrophobicContact CG-CE 3.81Å; K56-M60 HydrophobicContact CG-SD 4.26Å; K56-M60 WeakPolarHBondContact O-CG 3.17Å; K56-M60 PolarHBondContact O-N 2.85Å; M57-M60 PolarHBondContact O-N 3.4Å; I58-M60 VanDerWaalsContact C-N 3.32Å; I58-M60 PolarHBondContact O-N 3.05Å; M60-F62 VanDerWaalsContact C-N 3.3Å; M60-F62 HydrophobicContact CB-CD2 3.67Å; M60-F62 HydrophobicContact CB-CE2 3.88Å; M60-F62 PolarHBondContact O-N 2.91Å; M60-F62 HydrophobicContact SD-CE2 4.43Å
61	G	89.8	Confident	87.7	Confident	66 Å²	66	91.2 Å²	91.2	68%	0.68	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	-1.7	177.8	0	0	0	0	0	115.3	M57 I58 M59 G63	M57-G61 PolarHBondContact O-N 3.1Å; I58-G61 PolarHBondContact O-N 3.25Å; M59-G61 PolarHBondContact O-N 2.89Å; G61-G63 PolarHBondContact O-N 3.16Å
62	F	88.6	Confident	87.4	Confident	150 Å²	150	92.5 Å²	92.5	66%	0.658	51%	0.51	S	S	*	.			trans	-73	-7.8	176.8	-64.4	-62.1	0	0	0	113.6	M57 M60	M57-F62 HydrophobicContact CE-CB 3.41Å; M57-F62 VanDerWaalsContact CE-CB 3.41Å; M57-F62 HydrophobicContact CE-CD2 3.86Å; M57-F62 HydrophobicContact CE-CG 3.84Å; M57-F62 PolarHBondContact O-N 2.93Å; M57-F62 HydrophobicContact SD-CB 4.39Å; M57-F62 HydrophobicContact SD-CD2 4.07Å; M60-F62 VanDerWaalsContact C-N 3.3Å; M60-F62 HydrophobicContact CB-CD2 3.67Å; M60-F62 HydrophobicContact CB-CE2 3.88Å; M60-F62 PolarHBondContact O-N 2.91Å; M60-F62 HydrophobicContact SD-CE2 4.43Å
63	G	86.8	Confident	87	Confident	30 Å²	30	93.3 Å²	93.3	31%	0.309	51%	0.511	S	S	.	.			trans	76.4	-158	-178	0	0	0	0	0	113.2	M57 I58 G61	M57-G63 CarbonylContact C-O 3.45Å; M57-G63 VanDerWaalsContact CB-O 3.29Å; M57-G63 WeakPolarHBondContact CB-O 3.42Å; I58-G63 PolarHBondContact N-O 3.24Å; G61-G63 PolarHBondContact O-N 3.16Å
64	K	84.8	Confident	86.8	Confident	173 Å²	173	99.7 Å²	99.7	75%	0.752	54%	0.539	S	S	*	.	S	Bend	trans	-80.1	125.9	-178.5	-68.7	179.4	-177.2	178.2	0	110.1	T54 I58	T54-K64 HydrophobicContact CG2-CG 4.23Å; I58-K64 HydrophobicContact CD1-CG 4.02Å; I58-K64 HydrophobicContact CG1-CG 4.31Å
65	P	82.5	Confident	86.8	Confident	35 Å²	35	100.3 Å²	100.3	23%	0.227	55%	0.545	C	S	.	.			trans	-68	134.2	178.4	27.6	-33	0	0	0	110.8	V53 M57 K67 V68	V53-P65 HydrophobicContact CG1-CG 4.28Å; M57-P65 HydrophobicContact CB-CG 4.48Å; M57-P65 HydrophobicContact CG-CB 4.35Å; M57-P65 HydrophobicContact CG-CG 4.26Å; P65-K67 PolarHBondContact O-N 3.33Å; P65-V68 HydrophobicContact CB-CG2 4.25Å; P65-V68 HydrophobicContact CG-CG2 3.65Å
66	A	80.1	Confident	86.7	Confident	115 Å²	115	93.5 Å²	93.5	95%	0.95	52%	0.515	S	S	*	.	S	Bend	trans	-66.9	-34.3	-177.9	0	0	0	0	0	113.4
67	K	81.4	Confident	86.6	Confident	188 Å²	188	88.3 Å²	88.3	82%	0.817	49%	0.494	S	S	*	.			trans	-146	111.8	176.9	-171.8	176.9	-178.8	-179.1	0	109.5	P65	P65-K67 PolarHBondContact O-N 3.33Å
68	V	81.6	Confident	86.5	Confident	28 Å²	28	90.6 Å²	90.6	17%	0.17	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-82.2	123.9	171.6	-179.3	0	0	0	0	108.2	R50 V53 P65 S70	R50-V68 HydrophobicContact CG-CB 4.38Å; R50-V68 HydrophobicContact CG-CG1 4.47Å; V53-V68 HydrophobicContact CB-CG1 3.94Å; V53-V68 HydrophobicContact CB-CG2 4.26Å; V53-V68 HydrophobicContact CG1-CG1 4.06Å; V53-V68 HydrophobicContact CG1-CG2 4.01Å; V53-V68 HydrophobicContact CG2-CG1 3.99Å; P65-V68 HydrophobicContact CB-CG2 4.25Å; P65-V68 HydrophobicContact CG-CG2 3.65Å; V68-S70 PolarHBondContact O-N 3.42Å
69	P	81.1	Confident	86.4	Confident	95 Å²	95	88.7 Å²	88.7	62%	0.617	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-61.6	131.9	173.8	26	-32.7	0	0	0	109.3	H49	H49-P69 PolarHBondContact CD2-O 3.45Å; H49-P69 PolarHBondContact NE2-O 2.86Å
70	S	82.4	Confident	86.3	Confident	91 Å²	91	80.7 Å²	80.7	64%	0.636	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-70.6	143	175.9	52	0	0	0	0	110.3	V68	V68-S70 PolarHBondContact O-N 3.42Å
71	L	80.8	Confident	86.3	Confident	43 Å²	43	75.4 Å²	75.4	23%	0.225	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-61.6	148.2	172.3	-70.3	165.4	0	0	0	110.9	Q46 H49 A76 L79	Q46-L71 PolarHBondContact NE2-O 2.93Å; H49-L71 HydrophobicContact CB-CD1 3.61Å; H49-L71 HydrophobicContact CB-CG 4.11Å; L71-A76 HydrophobicContact CB-CB 4.08Å; L71-L79 HydrophobicContact CD1-CD2 3.51Å
72	T	86.5	Confident	86.3	Confident	92 Å²	92	73.7 Å²	73.7	56%	0.564	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-58.5	152.6	167.4	58.6	0	0	0	0	109.7	E74 S75 A76	T72-E74 VanDerWaalsContact C-N 3.28Å; T72-E74 PolarHBondContact O-N 2.92Å; T72-S75 PolarHBondContact O-N 3.36Å; T72-S75 WeakPolarHBondContact OG1-CB 3.46Å; T72-S75 PolarHBondContact OG1-OG 3.46Å; T72-A76 VanDerWaalsContact O-CB 3.26Å; T72-A76 WeakPolarHBondContact O-CB 3.47Å; T72-A76 PolarHBondContact O-N 2.93Å
73	E	83.8	Confident	86.4	Confident	94 Å²	94	67.7 Å²	67.7	44%	0.439	38%	0.379	S	S	.	.	H	α-helix	trans	-59.7	-39.6	-174.9	-66.1	-167.2	122.8	0	0	112.6	R37 A76 V77	R37-E73 IonicContact CZ-OE1 3.98Å; R37-E73 IonicContact CZ-OE2 3.59Å; R37-E73 IonicContact NH2-OE1 2.98Å; R37-E73 PolarHBondContact NH2-OE1 3.09Å; R37-E73 IonicContact NH2-OE2 2.63Å; R37-E73 PolarHBondContact NH2-OE2 3.37Å; E73-A76 PolarHBondContact O-N 2.94Å; E73-V77 VanDerWaalsContact O-CG2 3.29Å; E73-V77 WeakPolarHBondContact O-CG2 3.35Å; E73-V77 PolarHBondContact O-N 3.2Å
74	E	88.4	Confident	86.6	Confident	166 Å²	166	67.9 Å²	67.9	78%	0.776	37%	0.372	S	S	*	.	H	α-helix	trans	-64.8	-49.5	179.2	-63	-174.1	167.2	0	0	111.9	T72 A76 V77 E78	T72-E74 VanDerWaalsContact C-N 3.28Å; T72-E74 PolarHBondContact O-N 2.92Å; E74-A76 VanDerWaalsContact C-N 3.29Å; E74-A76 PolarHBondContact O-N 3.37Å; E74-V77 PolarHBondContact O-N 3.46Å; E74-E78 PolarHBondContact O-N 3.05Å
75	S	88.9	Confident	86.9	Confident	53 Å²	53	59.6 Å²	59.6	37%	0.371	34%	0.336	S	S	.	.	H	α-helix	trans	-65.9	-33	177.4	-56	0	0	0	0	112	T72 E78 L79	T72-S75 PolarHBondContact O-N 3.36Å; T72-S75 WeakPolarHBondContact OG1-CB 3.46Å; T72-S75 PolarHBondContact OG1-OG 3.46Å; S75-E78 PolarHBondContact O-N 2.76Å; S75-L79 VanDerWaalsContact O-CB 3.31Å; S75-L79 WeakPolarHBondContact O-CB 3.49Å; S75-L79 PolarHBondContact O-N 2.78Å
76	A	90.4	Very high	87.3	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-67.6	-39.5	174.6	0	0	0	0	0	111.8	L42 A45 L71 T72 E73 E74 E78 G80	L42-A76 HydrophobicContact CD2-CB 3.8Å; A45-A76 HydrophobicContact CB-CB 4.01Å; A45-A76 WeakPolarHBondContact CB-O 3.31Å; L71-A76 HydrophobicContact CB-CB 4.08Å; T72-A76 VanDerWaalsContact O-CB 3.26Å; T72-A76 WeakPolarHBondContact O-CB 3.47Å; T72-A76 PolarHBondContact O-N 2.93Å; E73-A76 PolarHBondContact O-N 2.94Å; E74-A76 VanDerWaalsContact C-N 3.29Å; E74-A76 PolarHBondContact O-N 3.37Å; A76-E78 VanDerWaalsContact C-N 3.34Å; A76-G80 PolarHBondContact O-N 3.46Å
77	V	89.7	Confident	87.9	Confident	12 Å²	12	59.8 Å²	59.8	7%	0.073	32%	0.32	C	S	.	.	H	α-helix	trans	-62.8	-44.9	173.1	168.6	0	0	0	0	110.5	A30 R37 E73 E74 A81	A30-V77 HydrophobicContact CB-CG1 3.57Å; R37-V77 HydrophobicContact CB-CG2 4.32Å; R37-V77 HydrophobicContact CG-CG2 3.63Å; E73-V77 VanDerWaalsContact O-CG2 3.29Å; E73-V77 WeakPolarHBondContact O-CG2 3.35Å; E73-V77 PolarHBondContact O-N 3.2Å; E74-V77 PolarHBondContact O-N 3.46Å; V77-A81 VanDerWaalsContact O-CB 3.3Å; V77-A81 WeakPolarHBondContact O-CB 3.48Å; V77-A81 PolarHBondContact O-N 3.47Å
78	E	90.5	Very high	88.5	Confident	105 Å²	105	53.6 Å²	53.6	49%	0.491	30%	0.295	S	S	.	.	H	α-helix	trans	-61.5	-51.5	-179.8	-165.9	177.3	-176.1	0	0	112	K27 E74 S75 A76 A81 D82	K27-E78 HydrophobicContact CD-CG 4.11Å; K27-E78 VanDerWaalsContact CE-CG 3.45Å; K27-E78 WeakPolarHBondContact CE-O 3.42Å; K27-E78 IonicContact NZ-OE1 3.24Å; K27-E78 PolarHBondContact NZ-OE1 2.85Å; E74-E78 PolarHBondContact O-N 3.05Å; S75-E78 PolarHBondContact O-N 2.76Å; A76-E78 VanDerWaalsContact C-N 3.34Å; E78-A81 PolarHBondContact O-N 3.22Å; E78-D82 PolarHBondContact O-N 3.35Å
79	L	90.8	Very high	89	Confident	47 Å²	47	53 Å²	53	25%	0.246	29%	0.291	C	S	.	.	H	α-helix	trans	-64.5	-43.6	180	-178.4	62.1	0	0	0	111.7	A45 Y48 L71 S75 A81 D82 I83	A45-L79 HydrophobicContact CB-CB 4.36Å; A45-L79 HydrophobicContact CB-CD2 4.48Å; Y48-L79 HydrophobicContact CD1-CD1 4.26Å; Y48-L79 HydrophobicContact CD1-CD2 3.92Å; Y48-L79 HydrophobicContact CD1-CG 4.36Å; Y48-L79 HydrophobicContact CE1-CD1 4.21Å; Y48-L79 HydrophobicContact CE1-CD2 4.49Å; L71-L79 HydrophobicContact CD1-CD2 3.51Å; S75-L79 VanDerWaalsContact O-CB 3.31Å; S75-L79 WeakPolarHBondContact O-CB 3.49Å; S75-L79 PolarHBondContact O-N 2.78Å; L79-A81 VanDerWaalsContact C-N 3.33Å; L79-A81 PolarHBondContact O-N 3.44Å; L79-D82 PolarHBondContact O-N 3.09Å; L79-I83 HydrophobicContact CD1-CD1 4.03Å; L79-I83 HydrophobicContact CD1-CG1 4.37Å; L79-I83 HydrophobicContact CG-CD1 3.85Å; L79-I83 WeakPolarHBondContact O-CD1 3.22Å; L79-I83 VanDerWaalsContact O-CG1 3.27Å; L79-I83 WeakPolarHBondContact O-CG1 3.34Å; L79-I83 PolarHBondContact O-N 2.86Å
80	G	91.3	Very high	89.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-39.2	179.8	0	0	0	0	0	112.5	A76 L84	A76-G80 PolarHBondContact O-N 3.46Å; G80-L84 VanDerWaalsContact O-CB 3.3Å; G80-L84 WeakPolarHBondContact O-CB 3.44Å; G80-L84 PolarHBondContact O-N 3.09Å
81	A	91.2	Very high	90.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-71.8	-38.5	176.7	0	0	0	0	0	112.9	L26 K27 V77 E78 L79 L84 G85	L26-A81 HydrophobicContact CB-CB 4Å; K27-A81 HydrophobicContact CB-CB 4.34Å; K27-A81 HydrophobicContact CD-CB 4.47Å; K27-A81 HydrophobicContact CG-CB 3.39Å; V77-A81 VanDerWaalsContact O-CB 3.3Å; V77-A81 WeakPolarHBondContact O-CB 3.48Å; V77-A81 PolarHBondContact O-N 3.47Å; E78-A81 PolarHBondContact O-N 3.22Å; L79-A81 VanDerWaalsContact C-N 3.33Å; L79-A81 PolarHBondContact O-N 3.44Å; A81-L84 PolarHBondContact O-N 3.12Å; A81-G85 PolarHBondContact O-N 3.23Å
82	D	90.6	Very high	91	Very high	31 Å²	31	55.5 Å²	55.5	17%	0.166	29%	0.289	C	S	.	.	H	α-helix	trans	-61	-47.6	173.9	-84.1	3.9	0	0	0	110.6	R20 A23 K27 E78 L79 L84 G85 E86	R20-D82 IonicContact NH1-OD1 3.16Å; R20-D82 IonicContact NH1-OD2 3.79Å; R20-D82 PolarHBondContact NH1-OD2 2.86Å; A23-D82 WeakPolarHBondContact CB-OD1 3.41Å; K27-D82 WeakPolarHBondContact CE-OD1 3.4Å; K27-D82 IonicContact NZ-OD1 2.77Å; K27-D82 PolarHBondContact NZ-OD1 3.29Å; K27-D82 IonicContact NZ-OD2 3.53Å; E78-D82 PolarHBondContact O-N 3.35Å; L79-D82 PolarHBondContact O-N 3.09Å; D82-L84 PolarHBondContact O-N 3.43Å; D82-G85 PolarHBondContact O-N 2.91Å; D82-E86 PolarHBondContact O-N 3.18Å
83	I	91.4	Very high	91.3	Very high	24 Å²	24	53.5 Å²	53.5	12%	0.123	28%	0.282	C	S	.	.	H	α-helix	trans	-61.3	-47	177	-67	163.6	0	0	0	111.1	I44 Y48 L79 G85 E86 V87	I44-I83 HydrophobicContact CG2-CB 4.44Å; I44-I83 HydrophobicContact CG2-CG2 3.93Å; Y48-I83 HydrophobicContact CD1-CD1 3.8Å; Y48-I83 HydrophobicContact CD2-CD1 3.52Å; Y48-I83 HydrophobicContact CD2-CG1 4.22Å; Y48-I83 HydrophobicContact CE1-CD1 4.39Å; Y48-I83 HydrophobicContact CE2-CD1 4.14Å; Y48-I83 HydrophobicContact CE2-CG1 4.44Å; Y48-I83 HydrophobicContact CG-CD1 3.31Å; Y48-I83 HydrophobicContact CG-CG1 4.41Å; L79-I83 HydrophobicContact CD1-CD1 4.03Å; L79-I83 HydrophobicContact CD1-CG1 4.37Å; L79-I83 HydrophobicContact CG-CD1 3.85Å; L79-I83 WeakPolarHBondContact O-CD1 3.22Å; L79-I83 VanDerWaalsContact O-CG1 3.27Å; L79-I83 WeakPolarHBondContact O-CG1 3.34Å; L79-I83 PolarHBondContact O-N 2.86Å; I83-G85 VanDerWaalsContact C-N 3.28Å; I83-G85 PolarHBondContact O-N 2.97Å; I83-E86 PolarHBondContact O-N 3.44Å; I83-V87 HydrophobicContact CG2-CG2 4.19Å; I83-V87 VanDerWaalsContact O-CG2 3.3Å; I83-V87 WeakPolarHBondContact O-CG2 3.23Å; I83-V87 PolarHBondContact O-N 3.44Å
84	L	90.8	Very high	91.9	Very high	33 Å²	33	51.6 Å²	51.6	17%	0.173	28%	0.282	C	S	.	.	H	α-helix	trans	-63.8	-37.8	-178.8	-173.8	65.9	0	0	0	111.4	L26 F36 V40 G80 A81 D82 V87 I88	L26-L84 HydrophobicContact CD1-CB 4.02Å; L26-L84 HydrophobicContact CD1-CD2 3.92Å; L26-L84 HydrophobicContact CD1-CG 3.92Å; L26-L84 HydrophobicContact CD2-CD2 4.06Å; F36-L84 HydrophobicContact CE2-CD2 3.99Å; F36-L84 HydrophobicContact CZ-CD2 3.56Å; V40-L84 HydrophobicContact CG1-CD2 4.03Å; G80-L84 VanDerWaalsContact O-CB 3.3Å; G80-L84 WeakPolarHBondContact O-CB 3.44Å; G80-L84 PolarHBondContact O-N 3.09Å; A81-L84 PolarHBondContact O-N 3.12Å; D82-L84 PolarHBondContact O-N 3.43Å; L84-V87 PolarHBondContact O-N 2.91Å; L84-I88 HydrophobicContact CG-CD1 4.16Å; L84-I88 WeakPolarHBondContact O-CD1 3.45Å; L84-I88 VanDerWaalsContact O-CG1 3.23Å; L84-I88 WeakPolarHBondContact O-CG1 3.27Å; L84-I88 PolarHBondContact O-N 3.16Å
85	G	91.6	Very high	92.3	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.2	-45.3	172.9	0	0	0	0	0	112.4	A81 D82 I83 I88 V89	A81-G85 PolarHBondContact O-N 3.23Å; D82-G85 PolarHBondContact O-N 2.91Å; I83-G85 VanDerWaalsContact C-N 3.28Å; I83-G85 PolarHBondContact O-N 2.97Å; G85-I88 PolarHBondContact O-N 3.16Å; G85-V89 WeakPolarHBondContact O-CG2 3.35Å; G85-V89 PolarHBondContact O-N 3.33Å; G85-V89 VanDerWaalsContact O-N 3.16Å
86	E	89.9	Confident	92.7	Very high	74 Å²	74	49.7 Å²	49.7	35%	0.346	28%	0.275	S	S	.	.	H	α-helix	trans	-63.6	-44.6	175.3	-71.2	-178.4	-171.2	0	0	112.3	D82 I83 I88 V89 Y90	D82-E86 PolarHBondContact O-N 3.18Å; I83-E86 PolarHBondContact O-N 3.44Å; E86-I88 VanDerWaalsContact C-N 3.3Å; E86-I88 PolarHBondContact O-N 2.82Å; E86-V89 PolarHBondContact O-N 3.36Å; E86-Y90 HydrophobicContact CB-CD2 4.3Å; E86-Y90 HydrophobicContact CB-CE2 4.1Å; E86-Y90 WeakPolarHBondContact O-CB 3.36Å; E86-Y90 WeakPolarHBondContact O-CD2 3.29Å; E86-Y90 PolarHBondContact O-N 3.3Å
87	V	92.7	Very high	92.9	Very high	79 Å²	79	56.6 Å²	56.6	48%	0.479	31%	0.306	S	S	.	.	H	α-helix	trans	-60.3	-40.2	178.2	170.3	0	0	0	0	111.4	I83 L84 Y90 S91	I83-V87 HydrophobicContact CG2-CG2 4.19Å; I83-V87 VanDerWaalsContact O-CG2 3.3Å; I83-V87 WeakPolarHBondContact O-CG2 3.23Å; I83-V87 PolarHBondContact O-N 3.44Å; L84-V87 PolarHBondContact O-N 2.91Å; V87-Y90 PolarHBondContact O-N 3.35Å; V87-S91 VanDerWaalsContact O-CB 3.24Å; V87-S91 WeakPolarHBondContact O-CB 3.13Å; V87-S91 PolarHBondContact O-N 2.9Å
88	I	93.9	Very high	93.1	Very high	58 Å²	58	59.6 Å²	59.6	30%	0.297	32%	0.324	S	S	.	.	H	α-helix	trans	-62.9	-48.6	176.3	-70.9	164.6	0	0	0	110.7	I22 L26 L84 G85 E86 Y90 S91 I92	I22-I88 HydrophobicContact CG2-CD1 4.18Å; L26-I88 HydrophobicContact CD1-CD1 4.04Å; L84-I88 HydrophobicContact CG-CD1 4.16Å; L84-I88 WeakPolarHBondContact O-CD1 3.45Å; L84-I88 VanDerWaalsContact O-CG1 3.23Å; L84-I88 WeakPolarHBondContact O-CG1 3.27Å; L84-I88 PolarHBondContact O-N 3.16Å; G85-I88 PolarHBondContact O-N 3.16Å; E86-I88 VanDerWaalsContact C-N 3.3Å; E86-I88 PolarHBondContact O-N 2.82Å; I88-Y90 VanDerWaalsContact C-N 3.34Å; I88-Y90 PolarHBondContact O-N 3.09Å; I88-S91 WeakPolarHBondContact O-CB 3.31Å; I88-S91 PolarHBondContact O-N 2.93Å; I88-I92 HydrophobicContact CG2-CD1 3.89Å; I88-I92 WeakPolarHBondContact O-CG1 3.34Å; I88-I92 PolarHBondContact O-N 3.38Å
89	V	93.3	Very high	93.4	Very high	16 Å²	16	59.5 Å²	59.5	10%	0.097	33%	0.326	C	S	.	.	H	α-helix	trans	-62	-43.9	179.3	175.8	0	0	0	0	110.8	V15 V18 I22 G85 E86 S91 I92 A93	V15-V89 HydrophobicContact CG1-CB 4.48Å; V15-V89 HydrophobicContact CG1-CG1 4.02Å; V15-V89 HydrophobicContact CG2-CG1 4.46Å; V18-V89 HydrophobicContact CB-CG2 4.47Å; V18-V89 HydrophobicContact CG1-CG1 4.28Å; V18-V89 HydrophobicContact CG1-CG2 3.88Å; I22-V89 HydrophobicContact CD1-CG2 3.72Å; G85-V89 WeakPolarHBondContact O-CG2 3.35Å; G85-V89 PolarHBondContact O-N 3.33Å; G85-V89 VanDerWaalsContact O-N 3.16Å; E86-V89 PolarHBondContact O-N 3.36Å; V89-S91 PolarHBondContact O-N 3.37Å; V89-I92 PolarHBondContact O-N 3.45Å; V89-A93 WeakPolarHBondContact O-CB 3.46Å; V89-A93 PolarHBondContact O-N 3.07Å
90	Y	93.4	Very high	93.5	Very high	120 Å²	120	62 Å²	62	47%	0.471	34%	0.337	S	S	.	.	H	α-helix	trans	-63.9	-39.6	176.3	-73.7	-49.7	0	0	0	112.7	V15 E86 V87 I88 A93 A94	V15-Y90 HydrophobicContact CG1-CD1 4.5Å; V15-Y90 HydrophobicContact CG1-CE1 3.9Å; V15-Y90 HydrophobicContact CG1-CE2 4.37Å; V15-Y90 HydrophobicContact CG2-CE1 4.07Å; E86-Y90 HydrophobicContact CB-CD2 4.3Å; E86-Y90 HydrophobicContact CB-CE2 4.1Å; E86-Y90 WeakPolarHBondContact O-CB 3.36Å; E86-Y90 WeakPolarHBondContact O-CD2 3.29Å; E86-Y90 PolarHBondContact O-N 3.3Å; V87-Y90 PolarHBondContact O-N 3.35Å; I88-Y90 VanDerWaalsContact C-N 3.34Å; I88-Y90 PolarHBondContact O-N 3.09Å; Y90-A93 PolarHBondContact O-N 2.95Å; Y90-A94 VanDerWaalsContact O-CB 3.23Å; Y90-A94 WeakPolarHBondContact O-CB 3.24Å; Y90-A94 PolarHBondContact O-N 3.46Å
91	S	96	Very high	93.6	Very high	69 Å²	69	69.2 Å²	69.2	48%	0.483	37%	0.365	S	S	.	.	H	α-helix	trans	-60.7	-51.2	176.5	-178	0	0	0	0	110.8	V87 I88 V89 A93 A94 T95	V87-S91 VanDerWaalsContact O-CB 3.24Å; V87-S91 WeakPolarHBondContact O-CB 3.13Å; V87-S91 PolarHBondContact O-N 2.9Å; I88-S91 WeakPolarHBondContact O-CB 3.31Å; I88-S91 PolarHBondContact O-N 2.93Å; V89-S91 PolarHBondContact O-N 3.37Å; S91-A93 VanDerWaalsContact C-N 3.33Å; S91-A93 PolarHBondContact O-N 2.87Å; S91-A94 PolarHBondContact O-N 3.06Å; S91-T95 WeakPolarHBondContact O-CB 3.1Å; S91-T95 PolarHBondContact O-N 3.03Å; S91-T95 PolarHBondContact O-OG1 3.31Å
92	I	95.5	Very high	93.5	Very high	93 Å²	93	75 Å²	75	48%	0.477	39%	0.393	S	S	.	.	H	α-helix	trans	-58.4	-46.8	177.6	-65.7	166.6	0	0	0	110.6	I88 V89 T95 L96	I88-I92 HydrophobicContact CG2-CD1 3.89Å; I88-I92 WeakPolarHBondContact O-CG1 3.34Å; I88-I92 PolarHBondContact O-N 3.38Å; V89-I92 PolarHBondContact O-N 3.45Å; I92-T95 PolarHBondContact O-N 3.41Å; I92-L96 HydrophobicContact CG2-CD1 3.99Å; I92-L96 HydrophobicContact CG2-CG 4.47Å; I92-L96 WeakPolarHBondContact O-CB 3.48Å; I92-L96 WeakPolarHBondContact O-CG 3.23Å; I92-L96 PolarHBondContact O-N 3.46Å
93	A	93.8	Very high	93.5	Very high	50 Å²	50	80.5 Å²	80.5	41%	0.413	41%	0.412	S	S	.	.	H	α-helix	trans	-62.8	-44.6	179.3	0	0	0	0	0	112.3	V89 Y90 S91 L96 F97	V89-A93 WeakPolarHBondContact O-CB 3.46Å; V89-A93 PolarHBondContact O-N 3.07Å; Y90-A93 PolarHBondContact O-N 2.95Å; S91-A93 VanDerWaalsContact C-N 3.33Å; S91-A93 PolarHBondContact O-N 2.87Å; A93-L96 PolarHBondContact O-N 3.19Å; A93-F97 VanDerWaalsContact O-CB 3.23Å; A93-F97 WeakPolarHBondContact O-CB 3.25Å; A93-F97 PolarHBondContact O-N 3.33Å
94	A	95.8	Very high	93.4	Very high	54 Å²	54	83.2 Å²	83.2	45%	0.446	43%	0.43	S	S	.	.	H	α-helix	trans	-65.2	-40.8	178.4	0	0	0	0	0	111.7	Y90 S91 F97 T98	Y90-A94 VanDerWaalsContact O-CB 3.23Å; Y90-A94 WeakPolarHBondContact O-CB 3.24Å; Y90-A94 PolarHBondContact O-N 3.46Å; S91-A94 PolarHBondContact O-N 3.06Å; A94-F97 PolarHBondContact O-N 2.97Å; A94-T98 WeakPolarHBondContact O-CB 3.3Å; A94-T98 PolarHBondContact O-N 2.99Å; A94-T98 PolarHBondContact O-OG1 3.12Å
95	T	96.9	Very high	93.2	Very high	75 Å²	75	84 Å²	84	46%	0.46	44%	0.438	S	S	.	.	H	α-helix	trans	-61.8	-51.4	174.9	-59.4	0	0	0	0	110.9	S91 I92 F97 T98 L99	S91-T95 WeakPolarHBondContact O-CB 3.1Å; S91-T95 PolarHBondContact O-N 3.03Å; S91-T95 PolarHBondContact O-OG1 3.31Å; I92-T95 PolarHBondContact O-N 3.41Å; T95-F97 VanDerWaalsContact C-N 3.34Å; T95-F97 PolarHBondContact O-N 3.49Å; T95-T98 PolarHBondContact O-N 2.86Å; T95-L99 HydrophobicContact CG2-CD1 4.06Å; T95-L99 HydrophobicContact CG2-CG 4.48Å; T95-L99 VanDerWaalsContact O-CG 3.3Å; T95-L99 WeakPolarHBondContact O-CG 3.36Å; T95-L99 PolarHBondContact O-N 3.43Å
96	L	96.4	Very high	92.8	Very high	103 Å²	103	88 Å²	88	54%	0.539	46%	0.456	S	S	.	.	H	α-helix	trans	-60.3	-44	178.1	-71.6	174.7	0	0	0	111.9	I92 A93 T98 L99 E100	I92-L96 HydrophobicContact CG2-CD1 3.99Å; I92-L96 HydrophobicContact CG2-CG 4.47Å; I92-L96 WeakPolarHBondContact O-CB 3.48Å; I92-L96 WeakPolarHBondContact O-CG 3.23Å; I92-L96 PolarHBondContact O-N 3.46Å; A93-L96 PolarHBondContact O-N 3.19Å; L96-T98 VanDerWaalsContact C-N 3.34Å; L96-T98 PolarHBondContact O-N 3.28Å; L96-L99 PolarHBondContact O-N 2.8Å; L96-E100 WeakPolarHBondContact O-CB 3.49Å; L96-E100 WeakPolarHBondContact O-CG 3.24Å; L96-E100 PolarHBondContact O-N 2.87Å
97	F	95.3	Very high	92.6	Very high	146 Å²	146	89.6 Å²	89.6	64%	0.64	46%	0.462	S	S	*	.	H	α-helix	trans	-59.8	-44.7	176.8	-177.8	-94.5	0	0	0	111.7	A93 A94 T95 E100 Y101	A93-F97 VanDerWaalsContact O-CB 3.23Å; A93-F97 WeakPolarHBondContact O-CB 3.25Å; A93-F97 PolarHBondContact O-N 3.33Å; A94-F97 PolarHBondContact O-N 2.97Å; T95-F97 VanDerWaalsContact C-N 3.34Å; T95-F97 PolarHBondContact O-N 3.49Å; F97-E100 PolarHBondContact O-N 3.41Å; F97-Y101 WeakPolarHBondContact O-CB 3.38Å; F97-Y101 PolarHBondContact O-N 2.89Å
98	T	95	Very high	92.4	Very high	74 Å²	74	88.3 Å²	88.3	45%	0.454	46%	0.46	S	S	.	.	H	α-helix	trans	-63.6	-44.6	179	-55.9	0	0	0	0	110.9	A94 T95 L96 Y101 M102	A94-T98 WeakPolarHBondContact O-CB 3.3Å; A94-T98 PolarHBondContact O-N 2.99Å; A94-T98 PolarHBondContact O-OG1 3.12Å; T95-T98 PolarHBondContact O-N 2.86Å; L96-T98 VanDerWaalsContact C-N 3.34Å; L96-T98 PolarHBondContact O-N 3.28Å; T98-Y101 PolarHBondContact O-N 3.26Å; T98-M102 HydrophobicContact CG2-SD 4.14Å; T98-M102 VanDerWaalsContact O-CG 3.24Å; T98-M102 WeakPolarHBondContact O-CG 3.4Å; T98-M102 PolarHBondContact O-N 2.82Å
99	L	95.7	Very high	92.1	Very high	103 Å²	103	91.5 Å²	91.5	54%	0.539	47%	0.468	S	S	.	.	H	α-helix	trans	-63.1	-44.6	178	-68.1	174.9	0	0	0	112.1	T95 L96 R103	T95-L99 HydrophobicContact CG2-CD1 4.06Å; T95-L99 HydrophobicContact CG2-CG 4.48Å; T95-L99 VanDerWaalsContact O-CG 3.3Å; T95-L99 WeakPolarHBondContact O-CG 3.36Å; T95-L99 PolarHBondContact O-N 3.43Å; L96-L99 PolarHBondContact O-N 2.8Å; L99-R103 WeakPolarHBondContact O-CB 3.29Å; L99-R103 PolarHBondContact O-N 3.45Å; L99-R103 VanDerWaalsContact O-N 3.09Å
100	E	93.7	Very high	92	Very high	100 Å²	100	94.4 Å²	94.4	47%	0.467	48%	0.482	S	S	.	.	H	α-helix	trans	-68.2	-37.6	176.9	-73.9	-60.1	153	0	0	112.2	L96 F97 R103 T104	L96-E100 WeakPolarHBondContact O-CB 3.49Å; L96-E100 WeakPolarHBondContact O-CG 3.24Å; L96-E100 PolarHBondContact O-N 2.87Å; F97-E100 PolarHBondContact O-N 3.41Å; E100-R103 PolarHBondContact O-N 2.72Å; E100-T104 VanDerWaalsContact O-CB 3.23Å; E100-T104 WeakPolarHBondContact O-CB 3.45Å; E100-T104 PolarHBondContact O-N 3.23Å; E100-T104 PolarHBondContact O-OG1 3.01Å
101	Y	92.7	Very high	91.9	Very high	152 Å²	152	95.3 Å²	95.3	60%	0.596	49%	0.489	S	S	*	.	H	α-helix	trans	-61.4	-48.7	175.7	-180	-100.3	0	0	0	111	F97 T98 R103 T104 S105	F97-Y101 WeakPolarHBondContact O-CB 3.38Å; F97-Y101 PolarHBondContact O-N 2.89Å; T98-Y101 PolarHBondContact O-N 3.26Å; Y101-R103 VanDerWaalsContact C-N 3.28Å; Y101-R103 PolarHBondContact O-N 2.97Å; Y101-T104 PolarHBondContact O-N 2.96Å; Y101-S105 WeakPolarHBondContact O-CB 3.3Å; Y101-S105 PolarHBondContact O-N 3.22Å; Y101-S105 PolarHBondContact O-OG 2.87Å
102	M	88.4	Confident	91.7	Very high	120 Å²	120	98 Å²	98	59%	0.591	49%	0.494	S	S	*	.	H	α-helix	trans	-59.6	-38.5	176.5	-70.4	174	72	0	0	112.2	T98 S105	T98-M102 HydrophobicContact CG2-SD 4.14Å; T98-M102 VanDerWaalsContact O-CG 3.24Å; T98-M102 WeakPolarHBondContact O-CG 3.4Å; T98-M102 PolarHBondContact O-N 2.82Å; M102-S105 PolarHBondContact O-OG 3.25Å; M102-S105 VanDerWaalsContact O-OG 3.09Å
103	R	90.5	Very high	91.6	Very high	148 Å²	148	97.9 Å²	97.9	56%	0.558	49%	0.491	S	S	*	.	H	α-helix	trans	-72	-36.4	178.1	-170.8	-178.7	-173	-169.8	2.6	112.8	L99 E100 Y101	L99-R103 WeakPolarHBondContact O-CB 3.29Å; L99-R103 PolarHBondContact O-N 3.45Å; L99-R103 VanDerWaalsContact O-N 3.09Å; E100-R103 PolarHBondContact O-N 2.72Å; Y101-R103 VanDerWaalsContact C-N 3.28Å; Y101-R103 PolarHBondContact O-N 2.97Å
104	T	89.6	Confident	91.7	Very high	81 Å²	81	99.8 Å²	99.8	50%	0.497	49%	0.494	S	S	.	.	H	α-helix	trans	-78.6	-38.4	-175.1	-59.7	0	0	0	0	111.4	E100 Y101 E106 K107 A108	E100-T104 VanDerWaalsContact O-CB 3.23Å; E100-T104 WeakPolarHBondContact O-CB 3.45Å; E100-T104 PolarHBondContact O-N 3.23Å; E100-T104 PolarHBondContact O-OG1 3.01Å; Y101-T104 PolarHBondContact O-N 2.96Å; T104-E106 PolarHBondContact O-N 3.38Å; T104-K107 PolarHBondContact O-N 3.44Å; T104-A108 WeakPolarHBondContact O-CB 3.33Å; T104-A108 PolarHBondContact O-N 2.94Å
105	S	86.3	Confident	91.7	Very high	50 Å²	50	102.1 Å²	102.1	35%	0.35	50%	0.498	S	S	.	.	H	α-helix	trans	-61	-42.9	179.4	60.3	0	0	0	0	112.2	Y101 M102 K107 A108 R109	Y101-S105 WeakPolarHBondContact O-CB 3.3Å; Y101-S105 PolarHBondContact O-N 3.22Å; Y101-S105 PolarHBondContact O-OG 2.87Å; M102-S105 PolarHBondContact O-OG 3.25Å; M102-S105 VanDerWaalsContact O-OG 3.09Å; S105-K107 PolarHBondContact O-N 3.37Å; S105-A108 WeakPolarHBondContact O-CB 3.47Å; S105-A108 PolarHBondContact O-N 3.5Å; S105-R109 PolarHBondContact O-N 3.46Å
106	E	84.3	Confident	91.7	Very high	82 Å²	82	103.4 Å²	103.4	38%	0.383	50%	0.502	S	S	.	.	H	α-helix	trans	-65.2	-42.1	179.9	-176	60.9	-175.4	0	0	112	T104 A108 R109 I110	T104-E106 PolarHBondContact O-N 3.38Å; E106-A108 VanDerWaalsContact C-N 3.31Å; E106-A108 PolarHBondContact O-N 3.4Å; E106-R109 PolarHBondContact O-N 3.48Å; E106-R109 IonicContact OE1-CZ 3.86Å; E106-R109 IonicContact OE1-NE 2.78Å; E106-R109 IonicContact OE1-NH2 3.54Å; E106-R109 PolarHBondContact OE1-NH2 2.84Å; E106-R109 IonicContact OE2-CZ 3.81Å; E106-R109 IonicContact OE2-NE 2.97Å; E106-R109 PolarHBondContact OE2-NE 2.75Å; E106-R109 VanDerWaalsContact OE2-NE 3.16Å; E106-R109 IonicContact OE2-NH2 3.33Å; E106-R109 PolarHBondContact OE2-NH2 3.22Å; E106-I110 HydrophobicContact CG-CD1 4.24Å; E106-I110 WeakPolarHBondContact O-CG1 2.97Å; E106-I110 PolarHBondContact O-N 3.16Å
107	K	85.7	Confident	91.7	Very high	108 Å²	108	103.6 Å²	103.6	47%	0.47	50%	0.503	S	S	.	.	H	α-helix	trans	-66.6	-34.6	175.2	-68.8	178.6	-179.9	179.7	0	112.3	T104 S105 K111	T104-K107 PolarHBondContact O-N 3.44Å; S105-K107 PolarHBondContact O-N 3.37Å; K107-K111 WeakPolarHBondContact O-CB 3.38Å; K107-K111 VanDerWaalsContact O-CG 3.23Å; K107-K111 WeakPolarHBondContact O-CG 3.23Å; K107-K111 PolarHBondContact O-N 3.04Å; K107-K111 VanDerWaalsContact O-N 3.16Å
108	A	87.9	Confident	91.7	Very high	52 Å²	52	104.4 Å²	104.4	43%	0.43	50%	0.502	S	S	.	.	H	α-helix	trans	-65.9	-45.4	176.2	0	0	0	0	0	110.6	T104 S105 E106 K111 E112	T104-A108 WeakPolarHBondContact O-CB 3.33Å; T104-A108 PolarHBondContact O-N 2.94Å; S105-A108 WeakPolarHBondContact O-CB 3.47Å; S105-A108 PolarHBondContact O-N 3.5Å; E106-A108 VanDerWaalsContact C-N 3.31Å; E106-A108 PolarHBondContact O-N 3.4Å; A108-K111 WeakPolarHBondContact O-CB 3.47Å; A108-K111 PolarHBondContact O-N 3.44Å; A108-E112 WeakPolarHBondContact O-CB 3.3Å; A108-E112 PolarHBondContact O-N 3Å
109	R	88	Confident	91.8	Very high	125 Å²	125	105.1 Å²	105.1	47%	0.472	50%	0.502	S	S	.	.	H	α-helix	trans	-59.8	-48.8	176.8	-174.9	177.9	66.5	143.3	4.3	112.6	S105 E106 K111 E112 E113	S105-R109 PolarHBondContact O-N 3.46Å; E106-R109 PolarHBondContact O-N 3.48Å; E106-R109 IonicContact OE1-CZ 3.86Å; E106-R109 IonicContact OE1-NE 2.78Å; E106-R109 IonicContact OE1-NH2 3.54Å; E106-R109 PolarHBondContact OE1-NH2 2.84Å; E106-R109 IonicContact OE2-CZ 3.81Å; E106-R109 IonicContact OE2-NE 2.97Å; E106-R109 PolarHBondContact OE2-NE 2.75Å; E106-R109 VanDerWaalsContact OE2-NE 3.16Å; E106-R109 IonicContact OE2-NH2 3.33Å; E106-R109 PolarHBondContact OE2-NH2 3.22Å; R109-K111 VanDerWaalsContact C-N 3.28Å; R109-K111 PolarHBondContact O-N 2.99Å; R109-E112 WeakPolarHBondContact O-CB 3.28Å; R109-E112 PolarHBondContact O-N 3.29Å; R109-E112 VanDerWaalsContact O-N 3.1Å; R109-E113 WeakPolarHBondContact O-CG 3.49Å; R109-E113 PolarHBondContact O-N 3.38Å
110	I	90.3	Very high	91.8	Very high	77 Å²	77	102.7 Å²	102.7	40%	0.395	49%	0.494	S	S	.	.	H	α-helix	trans	-60.6	-40.3	178.1	-66.5	166.4	0	0	0	110.9	E106 E112 L114	E106-I110 HydrophobicContact CG-CD1 4.24Å; E106-I110 WeakPolarHBondContact O-CG1 2.97Å; E106-I110 PolarHBondContact O-N 3.16Å; I110-E112 VanDerWaalsContact C-N 3.35Å; I110-L114 HydrophobicContact CG2-CD1 4.01Å; I110-L114 HydrophobicContact CG2-CG 4.39Å; I110-L114 WeakPolarHBondContact O-CB 3.27Å; I110-L114 WeakPolarHBondContact O-CG 3.34Å; I110-L114 PolarHBondContact O-N 3.42Å
111	K	91.6	Very high	92	Very high	140 Å²	140	102 Å²	102	61%	0.609	49%	0.493	S	S	*	.	H	α-helix	trans	-63.9	-41.6	175.8	-74.6	173.4	-178.2	-176.3	0	111.6	K107 A108 R109 L114 L115	K107-K111 WeakPolarHBondContact O-CB 3.38Å; K107-K111 VanDerWaalsContact O-CG 3.23Å; K107-K111 WeakPolarHBondContact O-CG 3.23Å; K107-K111 PolarHBondContact O-N 3.04Å; K107-K111 VanDerWaalsContact O-N 3.16Å; A108-K111 WeakPolarHBondContact O-CB 3.47Å; A108-K111 PolarHBondContact O-N 3.44Å; R109-K111 VanDerWaalsContact C-N 3.28Å; R109-K111 PolarHBondContact O-N 2.99Å; K111-L114 PolarHBondContact O-N 3.43Å; K111-L115 VanDerWaalsContact O-CG 3.26Å; K111-L115 WeakPolarHBondContact O-CG 3.31Å; K111-L115 PolarHBondContact O-N 3.02Å
112	E	92.7	Very high	92.2	Very high	124 Å²	124	99.7 Å²	99.7	58%	0.579	49%	0.491	S	S	*	.	H	α-helix	trans	-63.8	-47.2	177	-173.2	172.6	-169.5	0	0	111.6	A108 R109 I110 L114 L115 L116	A108-E112 WeakPolarHBondContact O-CB 3.3Å; A108-E112 PolarHBondContact O-N 3Å; R109-E112 WeakPolarHBondContact O-CB 3.28Å; R109-E112 PolarHBondContact O-N 3.29Å; R109-E112 VanDerWaalsContact O-N 3.1Å; I110-E112 VanDerWaalsContact C-N 3.35Å; E112-L114 VanDerWaalsContact C-N 3.33Å; E112-L114 PolarHBondContact O-N 2.88Å; E112-L115 WeakPolarHBondContact O-CB 3.35Å; E112-L115 PolarHBondContact O-N 3.45Å; E112-L115 VanDerWaalsContact O-N 3.1Å; E112-L116 WeakPolarHBondContact O-CG 3.47Å; E112-L116 PolarHBondContact O-N 3.38Å
113	E	94.1	Very high	92.6	Very high	92 Å²	92	99.6 Å²	99.6	43%	0.43	49%	0.489	S	S	.	.	H	α-helix	trans	-59.3	-42.6	174.5	-72	175.7	-172.1	0	0	111.9	R109 L115 L116 N117	R109-E113 WeakPolarHBondContact O-CG 3.49Å; R109-E113 PolarHBondContact O-N 3.38Å; E113-L115 VanDerWaalsContact C-N 3.33Å; E113-L115 PolarHBondContact O-N 2.91Å; E113-L116 PolarHBondContact O-N 3.4Å; E113-N117 WeakPolarHBondContact O-CB 3.27Å; E113-N117 VanDerWaalsContact O-CG 3.28Å; E113-N117 PolarHBondContact O-N 3.19Å; E113-N117 PolarHBondContact O-ND2 3.38Å
114	L	95.2	Very high	92.9	Very high	90 Å²	90	97.5 Å²	97.5	47%	0.471	49%	0.489	S	S	.	.	H	α-helix	trans	-64.2	-36.9	174.8	-73.8	172.9	0	0	0	112.4	I110 K111 E112 R118	I110-L114 HydrophobicContact CG2-CD1 4.01Å; I110-L114 HydrophobicContact CG2-CG 4.39Å; I110-L114 WeakPolarHBondContact O-CB 3.27Å; I110-L114 WeakPolarHBondContact O-CG 3.34Å; I110-L114 PolarHBondContact O-N 3.42Å; K111-L114 PolarHBondContact O-N 3.43Å; E112-L114 VanDerWaalsContact C-N 3.33Å; E112-L114 PolarHBondContact O-N 2.88Å; L114-R118 WeakPolarHBondContact O-CB 3.3Å; L114-R118 WeakPolarHBondContact O-CG 3.4Å; L114-R118 PolarHBondContact O-N 3.14Å
115	L	95.2	Very high	93.2	Very high	102 Å²	102	98.8 Å²	98.8	53%	0.534	49%	0.488	S	S	.	.	H	α-helix	trans	-67	-44.2	175	-73.5	172.2	0	0	0	111.1	K111 E112 E113 R118 I119	K111-L115 VanDerWaalsContact O-CG 3.26Å; K111-L115 WeakPolarHBondContact O-CG 3.31Å; K111-L115 PolarHBondContact O-N 3.02Å; E112-L115 WeakPolarHBondContact O-CB 3.35Å; E112-L115 PolarHBondContact O-N 3.45Å; E112-L115 VanDerWaalsContact O-N 3.1Å; E113-L115 VanDerWaalsContact C-N 3.33Å; E113-L115 PolarHBondContact O-N 2.91Å; L115-R118 WeakPolarHBondContact O-CB 3.35Å; L115-R118 PolarHBondContact O-N 2.99Å; L115-I119 VanDerWaalsContact O-CG1 3.31Å; L115-I119 WeakPolarHBondContact O-CG1 3.29Å; L115-I119 PolarHBondContact O-N 2.87Å
116	L	96.2	Very high	93.7	Very high	103 Å²	103	101.9 Å²	101.9	54%	0.539	50%	0.499	S	S	.	.	H	α-helix	trans	-61.8	-44.4	175.8	-69.6	174	0	0	0	111.8	E112 E113 R118 I119 S120	E112-L116 WeakPolarHBondContact O-CG 3.47Å; E112-L116 PolarHBondContact O-N 3.38Å; E113-L116 PolarHBondContact O-N 3.4Å; L116-R118 VanDerWaalsContact C-N 3.31Å; L116-R118 PolarHBondContact O-N 2.77Å; L116-I119 PolarHBondContact O-N 3.49Å; L116-S120 PolarHBondContact O-N 2.93Å
117	N	96.8	Very high	94.2	Very high	106 Å²	106	101 Å²	101	57%	0.567	50%	0.502	S	S	*	.	H	α-helix	trans	-62	-38.4	174.9	-75.6	-39.2	0	0	0	112.3	E113 N121	E113-N117 WeakPolarHBondContact O-CB 3.27Å; E113-N117 VanDerWaalsContact O-CG 3.28Å; E113-N117 PolarHBondContact O-N 3.19Å; E113-N117 PolarHBondContact O-ND2 3.38Å; N117-N121 VanDerWaalsContact O-CB 3.29Å; N117-N121 WeakPolarHBondContact O-CB 3.37Å; N117-N121 PolarHBondContact O-N 3.24Å
118	R	96.2	Very high	94.8	Very high	164 Å²	164	102.3 Å²	102.3	62%	0.619	51%	0.51	S	S	*	.	H	α-helix	trans	-65.5	-43.3	174.9	-77.5	171.9	-175.3	-163.7	1.7	111.7	L114 L115 L116 N121 L122	L114-R118 WeakPolarHBondContact O-CB 3.3Å; L114-R118 WeakPolarHBondContact O-CG 3.4Å; L114-R118 PolarHBondContact O-N 3.14Å; L115-R118 WeakPolarHBondContact O-CB 3.35Å; L115-R118 PolarHBondContact O-N 2.99Å; L116-R118 VanDerWaalsContact C-N 3.31Å; L116-R118 PolarHBondContact O-N 2.77Å; R118-N121 PolarHBondContact O-N 3.31Å; R118-L122 WeakPolarHBondContact O-CB 3.13Å; R118-L122 VanDerWaalsContact O-CG 3.28Å; R118-L122 WeakPolarHBondContact O-CG 3.34Å; R118-L122 PolarHBondContact O-N 3.45Å
119	I	96.8	Very high	95.1	Very high	88 Å²	88	105.7 Å²	105.7	45%	0.451	52%	0.52	S	S	.	.	H	α-helix	trans	-60.5	-51.1	176.6	-70.1	164.3	0	0	0	109.5	L115 L116 N121 L122 E123	L115-I119 VanDerWaalsContact O-CG1 3.31Å; L115-I119 WeakPolarHBondContact O-CG1 3.29Å; L115-I119 PolarHBondContact O-N 2.87Å; L116-I119 PolarHBondContact O-N 3.49Å; I119-N121 VanDerWaalsContact C-N 3.32Å; I119-N121 PolarHBondContact O-N 3.04Å; I119-L122 WeakPolarHBondContact O-CB 3.46Å; I119-L122 PolarHBondContact O-N 2.96Å; I119-L122 VanDerWaalsContact O-N 3.07Å; I119-E123 HydrophobicContact CG2-CG 4.42Å; I119-E123 WeakPolarHBondContact O-CG 3.41Å; I119-E123 PolarHBondContact O-N 2.98Å
120	S	96.6	Very high	95.5	Very high	53 Å²	53	102 Å²	102	37%	0.371	52%	0.516	S	S	.	.	H	α-helix	trans	-59.4	-40.5	178.4	178.8	0	0	0	0	112.7	L116 E123 N124	L116-S120 PolarHBondContact O-N 2.93Å; S120-E123 PolarHBondContact O-N 3.39Å; S120-N124 WeakPolarHBondContact O-CB 3.36Å; S120-N124 VanDerWaalsContact O-CG 3.26Å; S120-N124 PolarHBondContact O-N 2.97Å; S120-N124 PolarHBondContact O-ND2 2.79Å
121	N	97.2	Very high	95.7	Very high	84 Å²	84	103.7 Å²	103.7	45%	0.449	52%	0.524	S	S	.	.	H	α-helix	trans	-63.9	-42	175	-172.3	-12.7	0	0	0	111.8	N117 R118 I119 N124 K125	N117-N121 VanDerWaalsContact O-CB 3.29Å; N117-N121 WeakPolarHBondContact O-CB 3.37Å; N117-N121 PolarHBondContact O-N 3.24Å; R118-N121 PolarHBondContact O-N 3.31Å; I119-N121 VanDerWaalsContact C-N 3.32Å; I119-N121 PolarHBondContact O-N 3.04Å; N121-N124 PolarHBondContact O-N 3.34Å; N121-K125 WeakPolarHBondContact O-CG 3.4Å; N121-K125 PolarHBondContact O-N 3.21Å; N121-K125 VanDerWaalsContact OD1-CE 3.29Å; N121-K125 WeakPolarHBondContact OD1-CE 3.21Å
122	L	96.2	Very high	95.8	Very high	104 Å²	104	98.4 Å²	98.4	55%	0.545	51%	0.509	S	S	.	.	H	α-helix	trans	-64.2	-42.3	175.6	-71.6	171.3	0	0	0	111.6	R118 I119 K125 I126	R118-L122 WeakPolarHBondContact O-CB 3.13Å; R118-L122 VanDerWaalsContact O-CG 3.28Å; R118-L122 WeakPolarHBondContact O-CG 3.34Å; R118-L122 PolarHBondContact O-N 3.45Å; I119-L122 WeakPolarHBondContact O-CB 3.46Å; I119-L122 PolarHBondContact O-N 2.96Å; I119-L122 VanDerWaalsContact O-N 3.07Å; L122-K125 PolarHBondContact O-N 3.36Å; L122-I126 WeakPolarHBondContact O-CB 3.42Å; L122-I126 VanDerWaalsContact O-CG1 3.25Å; L122-I126 WeakPolarHBondContact O-CG1 3.34Å; L122-I126 PolarHBondContact O-N 3.35Å
123	E	96.7	Very high	96	Very high	119 Å²	119	96.4 Å²	96.4	56%	0.556	51%	0.505	S	S	*	.	H	α-helix	trans	-60.1	-45	174.8	-71.9	175.7	161.6	0	0	111.7	I119 S120 K125 I126 S127	I119-E123 HydrophobicContact CG2-CG 4.42Å; I119-E123 WeakPolarHBondContact O-CG 3.41Å; I119-E123 PolarHBondContact O-N 2.98Å; S120-E123 PolarHBondContact O-N 3.39Å; E123-K125 PolarHBondContact O-N 2.89Å; E123-I126 PolarHBondContact O-N 2.94Å; E123-S127 WeakPolarHBondContact O-CB 3.48Å; E123-S127 PolarHBondContact O-N 2.98Å
124	N	96.7	Very high	96	Very high	103 Å²	103	98.1 Å²	98.1	55%	0.551	51%	0.513	S	S	*	.	H	α-helix	trans	-61.4	-43	176	-71.5	-26.1	0	0	0	112	S120 N121 S127 E128	S120-N124 WeakPolarHBondContact O-CB 3.36Å; S120-N124 VanDerWaalsContact O-CG 3.26Å; S120-N124 PolarHBondContact O-N 2.97Å; S120-N124 PolarHBondContact O-ND2 2.79Å; N121-N124 PolarHBondContact O-N 3.34Å; N124-S127 PolarHBondContact O-N 3.01Å; N124-E128 WeakPolarHBondContact O-CB 3.47Å; N124-E128 PolarHBondContact O-N 3Å
125	K	95.8	Very high	96	Very high	109 Å²	109	102.8 Å²	102.8	47%	0.474	52%	0.524	S	S	.	.	H	α-helix	trans	-64.8	-39.7	176.1	-75.6	179.3	176.1	-175.4	0	112.5	N121 L122 E123 S127 E128 L129	N121-K125 WeakPolarHBondContact O-CG 3.4Å; N121-K125 PolarHBondContact O-N 3.21Å; N121-K125 VanDerWaalsContact OD1-CE 3.29Å; N121-K125 WeakPolarHBondContact OD1-CE 3.21Å; L122-K125 PolarHBondContact O-N 3.36Å; E123-K125 PolarHBondContact O-N 2.89Å; K125-S127 VanDerWaalsContact C-N 3.34Å; K125-E128 PolarHBondContact O-N 3.42Å; K125-L129 WeakPolarHBondContact O-CB 3.19Å; K125-L129 WeakPolarHBondContact O-CG 3.25Å; K125-L129 PolarHBondContact O-N 3.44Å
126	I	97.2	Very high	95.9	Very high	115 Å²	115	102.9 Å²	102.9	59%	0.59	53%	0.525	S	S	*	.	H	α-helix	trans	-63.2	-44	175.3	-71.1	164.9	0	0	0	109.9	L122 E123 L129 A130	L122-I126 WeakPolarHBondContact O-CB 3.42Å; L122-I126 VanDerWaalsContact O-CG1 3.25Å; L122-I126 WeakPolarHBondContact O-CG1 3.34Å; L122-I126 PolarHBondContact O-N 3.35Å; E123-I126 PolarHBondContact O-N 2.94Å; I126-L129 PolarHBondContact O-N 3.43Å; I126-A130 WeakPolarHBondContact O-CB 3.22Å; I126-A130 PolarHBondContact O-N 3.41Å
127	S	96.1	Very high	95.8	Very high	64 Å²	64	102.2 Å²	102.2	45%	0.448	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-45.1	176.3	-175.2	0	0	0	0	112.3	E123 N124 K125 L129 A130 M131	E123-S127 WeakPolarHBondContact O-CB 3.48Å; E123-S127 PolarHBondContact O-N 2.98Å; N124-S127 PolarHBondContact O-N 3.01Å; K125-S127 VanDerWaalsContact C-N 3.34Å; S127-L129 PolarHBondContact O-N 2.88Å; S127-A130 PolarHBondContact O-N 3.27Å; S127-M131 WeakPolarHBondContact O-CG 3.32Å; S127-M131 PolarHBondContact O-N 2.85Å
128	E	96.4	Very high	95.6	Very high	134 Å²	134	99.5 Å²	99.5	63%	0.626	51%	0.512	S	S	*	.	H	α-helix	trans	-60.4	-43.6	175.6	-173.7	-179.5	-177.9	0	0	112.1	N124 K125 M131 G132	N124-E128 WeakPolarHBondContact O-CB 3.47Å; N124-E128 PolarHBondContact O-N 3Å; K125-E128 PolarHBondContact O-N 3.42Å; E128-M131 PolarHBondContact O-N 3.35Å; E128-G132 PolarHBondContact O-N 3.13Å
129	L	95	Very high	95.5	Very high	124 Å²	124	95.2 Å²	95.2	65%	0.649	50%	0.504	S	S	*	.	H	α-helix	trans	-64.1	-42	175.1	-73	171.6	0	0	0	111.8	K125 I126 S127 G132 V133	K125-L129 WeakPolarHBondContact O-CB 3.19Å; K125-L129 WeakPolarHBondContact O-CG 3.25Å; K125-L129 PolarHBondContact O-N 3.44Å; I126-L129 PolarHBondContact O-N 3.43Å; S127-L129 PolarHBondContact O-N 2.88Å; L129-G132 PolarHBondContact O-N 3.35Å; L129-V133 WeakPolarHBondContact O-CG2 3.39Å; L129-V133 PolarHBondContact O-N 3.02Å
130	A	95.7	Very high	95.3	Very high	47 Å²	47	96.5 Å²	96.5	39%	0.388	51%	0.511	S	S	.	.	H	α-helix	trans	-61.1	-47.7	176.7	0	0	0	0	0	111.5	I126 S127 G132 V133 E134	I126-A130 WeakPolarHBondContact O-CB 3.22Å; I126-A130 PolarHBondContact O-N 3.41Å; S127-A130 PolarHBondContact O-N 3.27Å; A130-G132 VanDerWaalsContact C-N 3.3Å; A130-G132 PolarHBondContact O-N 3.21Å; A130-V133 PolarHBondContact O-N 3.39Å; A130-E134 PolarHBondContact O-N 3.4Å
131	M	95	Very high	95.1	Very high	113 Å²	113	99.3 Å²	99.3	56%	0.557	51%	0.513	S	S	*	.	H	α-helix	trans	-61.4	-38.2	174.1	-69.4	-174.3	-68.2	0	0	112.2	S127 E128 E134 R135	S127-M131 WeakPolarHBondContact O-CG 3.32Å; S127-M131 PolarHBondContact O-N 2.85Å; E128-M131 PolarHBondContact O-N 3.35Å; M131-E134 PolarHBondContact O-N 3.06Å; M131-R135 WeakPolarHBondContact O-CB 3.38Å; M131-R135 PolarHBondContact O-N 3.23Å
132	G	94.8	Very high	94.9	Very high	28 Å²	28	97.5 Å²	97.5	29%	0.289	51%	0.51	S	S	.	.	H	α-helix	trans	-63.1	-41.3	175.3	0	0	0	0	0	112.8	E128 L129 A130 R135 N136	E128-G132 PolarHBondContact O-N 3.13Å; L129-G132 PolarHBondContact O-N 3.35Å; A130-G132 VanDerWaalsContact C-N 3.3Å; A130-G132 PolarHBondContact O-N 3.21Å; G132-R135 PolarHBondContact O-N 3.43Å; G132-N136 WeakPolarHBondContact O-CB 3.18Å; G132-N136 PolarHBondContact O-N 3.37Å; G132-N136 PolarHBondContact O-ND2 3.39Å
133	V	96.3	Very high	94.4	Very high	82 Å²	82	98 Å²	98	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-62.6	-49.6	174.4	169.9	0	0	0	0	110.5	L129 A130 R135 N136 E137	L129-V133 WeakPolarHBondContact O-CG2 3.39Å; L129-V133 PolarHBondContact O-N 3.02Å; A130-V133 PolarHBondContact O-N 3.39Å; V133-R135 VanDerWaalsContact C-N 3.31Å; V133-R135 PolarHBondContact O-N 2.69Å; V133-N136 PolarHBondContact O-N 2.87Å; V133-N136 VanDerWaalsContact O-N 3.16Å; V133-E137 WeakPolarHBondContact O-CG 3.24Å; V133-E137 PolarHBondContact O-N 2.87Å
134	E	94.2	Very high	94.2	Very high	128 Å²	128	98.9 Å²	98.9	60%	0.598	52%	0.515	S	S	*	.	H	α-helix	trans	-59.3	-41.2	177.9	-71.4	179.1	-173.8	0	0	112.4	A130 M131 E137 A138	A130-E134 PolarHBondContact O-N 3.4Å; M131-E134 PolarHBondContact O-N 3.06Å; E134-E137 PolarHBondContact O-N 3.05Å; E134-A138 PolarHBondContact O-N 3.45Å
135	R	94.5	Very high	93.9	Very high	189 Å²	189	102.4 Å²	102.4	71%	0.713	52%	0.52	S	S	*	.	H	α-helix	trans	-63.3	-44.6	176.1	-173.4	-178.7	-178.9	101.8	0	111.5	M131 G132 V133 E137 A138 V139	M131-R135 WeakPolarHBondContact O-CB 3.38Å; M131-R135 PolarHBondContact O-N 3.23Å; G132-R135 PolarHBondContact O-N 3.43Å; V133-R135 VanDerWaalsContact C-N 3.31Å; V133-R135 PolarHBondContact O-N 2.69Å; R135-E137 VanDerWaalsContact C-N 3.34Å; R135-A138 PolarHBondContact O-N 3.49Å; R135-V139 WeakPolarHBondContact O-CG2 3.07Å; R135-V139 PolarHBondContact O-N 2.95Å
136	N	92.9	Very high	93.6	Very high	104 Å²	104	102.6 Å²	102.6	56%	0.556	53%	0.526	S	S	*	.	H	α-helix	trans	-63.1	-41.6	178.3	-73	-21.1	0	0	0	111.3	G132 V133 A138 V139 L140	G132-N136 WeakPolarHBondContact O-CB 3.18Å; G132-N136 PolarHBondContact O-N 3.37Å; G132-N136 PolarHBondContact O-ND2 3.39Å; V133-N136 PolarHBondContact O-N 2.87Å; V133-N136 VanDerWaalsContact O-N 3.16Å; N136-A138 PolarHBondContact O-N 3.4Å; N136-V139 PolarHBondContact O-N 3.02Å; N136-L140 WeakPolarHBondContact O-CG 3.2Å; N136-L140 PolarHBondContact O-N 3.4Å
137	E	95.1	Very high	93.3	Very high	89 Å²	89	102 Å²	102	42%	0.416	53%	0.528	S	S	.	.	H	α-helix	trans	-62.6	-41.1	174.2	-70.8	-173	-175.9	0	0	112.8	V133 E134 R135 V139 L140 R141	V133-E137 WeakPolarHBondContact O-CG 3.24Å; V133-E137 PolarHBondContact O-N 2.87Å; E134-E137 PolarHBondContact O-N 3.05Å; R135-E137 VanDerWaalsContact C-N 3.34Å; E137-V139 VanDerWaalsContact C-N 3.32Å; E137-V139 PolarHBondContact O-N 3.42Å; E137-L140 PolarHBondContact O-N 2.92Å; E137-R141 WeakPolarHBondContact O-CG 3.37Å; E137-R141 PolarHBondContact O-N 3.31Å; E137-R141 IonicContact OE2-CZ 2.9Å; E137-R141 IonicContact OE2-NH1 3.01Å; E137-R141 PolarHBondContact OE2-NH1 2.93Å; E137-R141 IonicContact OE2-NH2 3.99Å
138	A	92.7	Very high	92.8	Very high	49 Å²	49	105.8 Å²	105.8	41%	0.405	54%	0.538	S	S	.	.	H	α-helix	trans	-62.8	-40.4	176.9	0	0	0	0	0	111.9	E134 R135 N136 R141 A142	E134-A138 PolarHBondContact O-N 3.45Å; R135-A138 PolarHBondContact O-N 3.49Å; N136-A138 PolarHBondContact O-N 3.4Å; A138-R141 PolarHBondContact O-N 2.86Å; A138-A142 WeakPolarHBondContact O-CB 3.26Å; A138-A142 PolarHBondContact O-N 3.35Å
139	V	93.1	Very high	92.5	Very high	74 Å²	74	105.5 Å²	105.5	45%	0.448	54%	0.537	S	S	.	.	H	α-helix	trans	-65.3	-44.2	174.6	173	0	0	0	0	111	R135 N136 E137 R141 A142 M143	R135-V139 WeakPolarHBondContact O-CG2 3.07Å; R135-V139 PolarHBondContact O-N 2.95Å; N136-V139 PolarHBondContact O-N 3.02Å; E137-V139 VanDerWaalsContact C-N 3.32Å; E137-V139 PolarHBondContact O-N 3.42Å; V139-R141 PolarHBondContact O-N 3.41Å; V139-A142 PolarHBondContact O-N 3Å; V139-A142 VanDerWaalsContact O-N 3.16Å; V139-M143 HydrophobicContact CG1-CG 4.38Å; V139-M143 HydrophobicContact CG1-SD 4.13Å; V139-M143 WeakPolarHBondContact O-CG 3.29Å; V139-M143 PolarHBondContact O-N 3.36Å
140	L	93.8	Very high	92	Very high	114 Å²	114	107.5 Å²	107.5	60%	0.597	54%	0.54	S	S	*	.	H	α-helix	trans	-58.1	-46.7	175.6	-75.7	171.1	0	0	0	111.5	N136 E137 A142 M143 E144	N136-L140 WeakPolarHBondContact O-CG 3.2Å; N136-L140 PolarHBondContact O-N 3.4Å; E137-L140 PolarHBondContact O-N 2.92Å; L140-A142 VanDerWaalsContact C-N 3.32Å; L140-A142 PolarHBondContact O-N 2.94Å; L140-M143 PolarHBondContact O-N 2.81Å; L140-E144 WeakPolarHBondContact O-CB 3.45Å; L140-E144 PolarHBondContact O-N 3.34Å
141	R	92.5	Very high	91.6	Very high	112 Å²	112	108.6 Å²	108.6	42%	0.423	55%	0.545	S	S	.	.	H	α-helix	trans	-62	-37.7	175.9	-71.8	-175	-71	-102.3	1	112.4	E137 A138 V139 R145	E137-R141 WeakPolarHBondContact O-CG 3.37Å; E137-R141 PolarHBondContact O-N 3.31Å; E137-R141 IonicContact OE2-CZ 2.9Å; E137-R141 IonicContact OE2-NH1 3.01Å; E137-R141 PolarHBondContact OE2-NH1 2.93Å; E137-R141 IonicContact OE2-NH2 3.99Å; A138-R141 PolarHBondContact O-N 2.86Å; V139-R141 PolarHBondContact O-N 3.41Å; R141-R145 WeakPolarHBondContact O-CG 3.42Å; R141-R145 PolarHBondContact O-N 3.44Å
142	A	91.9	Very high	90.9	Very high	46 Å²	46	106.8 Å²	106.8	38%	0.38	54%	0.543	S	S	.	.	H	α-helix	trans	-68.6	-41.1	176.5	0	0	0	0	0	112	A138 V139 L140 R145 L146	A138-A142 WeakPolarHBondContact O-CB 3.26Å; A138-A142 PolarHBondContact O-N 3.35Å; V139-A142 PolarHBondContact O-N 3Å; V139-A142 VanDerWaalsContact O-N 3.16Å; L140-A142 VanDerWaalsContact C-N 3.32Å; L140-A142 PolarHBondContact O-N 2.94Å; A142-R145 PolarHBondContact O-N 2.87Å; A142-L146 PolarHBondContact O-N 3.2Å
143	M	86.7	Confident	90.3	Very high	114 Å²	114	109 Å²	109	56%	0.562	55%	0.554	S	S	*	*	H	α-helix	trans	-63.8	-43.7	175.4	-72.9	-179	131.4	0	0	111.7	V139 L140 R145 L146 V147	V139-M143 HydrophobicContact CG1-CG 4.38Å; V139-M143 HydrophobicContact CG1-SD 4.13Å; V139-M143 WeakPolarHBondContact O-CG 3.29Å; V139-M143 PolarHBondContact O-N 3.36Å; L140-M143 PolarHBondContact O-N 2.81Å; M143-R145 VanDerWaalsContact C-N 3.3Å; M143-R145 PolarHBondContact O-N 3.42Å; M143-L146 PolarHBondContact O-N 2.67Å; M143-L146 VanDerWaalsContact O-N 3.15Å; M143-V147 WeakPolarHBondContact O-CG2 3.41Å; M143-V147 PolarHBondContact O-N 3.23Å
144	E	91.9	Very high	89.7	Confident	138 Å²	138	107.7 Å²	107.7	65%	0.645	55%	0.549	S	S	*	.	H	α-helix	trans	-57.7	-43.1	177.3	-173.8	178	-168.8	0	0	111.7	L140 L146 V147 H148	L140-E144 WeakPolarHBondContact O-CB 3.45Å; L140-E144 PolarHBondContact O-N 3.34Å; E144-L146 PolarHBondContact O-N 3.42Å; E144-V147 PolarHBondContact O-N 3.01Å; E144-H148 WeakPolarHBondContact O-CB 3.35Å; E144-H148 PolarHBondContact O-N 3.28Å
145	R	89.9	Confident	88.9	Confident	177 Å²	177	107.5 Å²	107.5	67%	0.668	55%	0.551	S	S	*	*	H	α-helix	trans	-61.2	-43.5	175.5	-69.4	172.1	-167.4	162.6	2.8	112.3	R141 A142 M143 H148 Q149	R141-R145 WeakPolarHBondContact O-CG 3.42Å; R141-R145 PolarHBondContact O-N 3.44Å; A142-R145 PolarHBondContact O-N 2.87Å; M143-R145 VanDerWaalsContact C-N 3.3Å; M143-R145 PolarHBondContact O-N 3.42Å; R145-H148 PolarHBondContact O-N 2.87Å; R145-Q149 VanDerWaalsContact O-CB 3.28Å; R145-Q149 WeakPolarHBondContact O-CB 3.48Å; R145-Q149 PolarHBondContact O-N 3.43Å
146	L	89.6	Confident	88.3	Confident	114 Å²	114	101.9 Å²	101.9	60%	0.597	54%	0.541	S	S	*	.	H	α-helix	trans	-66.7	-39.4	178	-69	175.3	0	0	0	112	A142 M143 E144 K150	A142-L146 PolarHBondContact O-N 3.2Å; M143-L146 PolarHBondContact O-N 2.67Å; M143-L146 VanDerWaalsContact O-N 3.15Å; E144-L146 PolarHBondContact O-N 3.42Å; L146-K150 VanDerWaalsContact O-CB 3.26Å; L146-K150 WeakPolarHBondContact O-CB 3.38Å; L146-K150 PolarHBondContact O-N 3.04Å
147	V	90.6	Very high	87.7	Confident	102 Å²	102	104.4 Å²	104.4	62%	0.618	54%	0.543	S	S	*	.	H	α-helix	trans	-62	-45.8	174.5	171.3	0	0	0	0	110.3	M143 E144 K150 S151	M143-V147 WeakPolarHBondContact O-CG2 3.41Å; M143-V147 PolarHBondContact O-N 3.23Å; E144-V147 PolarHBondContact O-N 3.01Å; V147-K150 PolarHBondContact O-N 3.02Å; V147-S151 WeakPolarHBondContact O-CB 3.5Å; V147-S151 PolarHBondContact O-N 2.92Å
148	H	86.4	Confident	86.8	Confident	143 Å²	143	107.1 Å²	107.1	66%	0.662	55%	0.549	S	S	*	.	H	α-helix	trans	-67.8	-41.2	179.9	-154.7	70.1	0	0	0	112.3	E144 R145 S151 S152	E144-H148 WeakPolarHBondContact O-CB 3.35Å; E144-H148 PolarHBondContact O-N 3.28Å; R145-H148 PolarHBondContact O-N 2.87Å; H148-S151 PolarHBondContact O-N 3.37Å; H148-S152 WeakPolarHBondContact O-CB 3.26Å; H148-S152 PolarHBondContact O-N 2.87Å
149	Q	89.7	Confident	86.3	Confident	129 Å²	129	112.2 Å²	112.2	60%	0.603	56%	0.562	S	S	*	*	H	α-helix	trans	-61.5	-44.8	174.3	-176.7	-178	-0.1	0	0	111.4	R145 S152 S153	R145-Q149 VanDerWaalsContact O-CB 3.28Å; R145-Q149 WeakPolarHBondContact O-CB 3.48Å; R145-Q149 PolarHBondContact O-N 3.43Å; Q149-S152 PolarHBondContact O-N 3.39Å; Q149-S153 WeakPolarHBondContact O-CB 3.29Å; Q149-S153 PolarHBondContact O-N 3.29Å
150	K	85.5	Confident	85.6	Confident	166 Å²	166	111.6 Å²	111.6	72%	0.722	57%	0.565	S	S	*	*	H	α-helix	trans	-65.6	-40.3	177.6	-172.6	176.2	-177.8	-176.4	0	111.6	L146 V147 S154	L146-K150 VanDerWaalsContact O-CB 3.26Å; L146-K150 WeakPolarHBondContact O-CB 3.38Å; L146-K150 PolarHBondContact O-N 3.04Å; V147-K150 PolarHBondContact O-N 3.02Å; K150-S154 VanDerWaalsContact O-CB 3.23Å; K150-S154 WeakPolarHBondContact O-CB 3.22Å; K150-S154 PolarHBondContact O-N 3.21Å
151	S	85.7	Confident	84.7	Confident	70 Å²	70	112.7 Å²	112.7	49%	0.49	57%	0.565	S	S	.	*	H	α-helix	trans	-63	-47.9	176.1	-176.9	0	0	0	0	111.6	V147 H148 S154 L155	V147-S151 WeakPolarHBondContact O-CB 3.5Å; V147-S151 PolarHBondContact O-N 2.92Å; H148-S151 PolarHBondContact O-N 3.37Å; S151-S154 WeakPolarHBondContact O-CB 3.42Å; S151-S154 PolarHBondContact O-N 2.93Å; S151-L155 WeakPolarHBondContact O-CB 3.45Å; S151-L155 PolarHBondContact O-N 3.4Å
152	S	82.2	Confident	83.8	Confident	74 Å²	74	115.1 Å²	115.1	52%	0.517	58%	0.581	S	S	.	*	H	α-helix	trans	-65.2	-44.1	178.9	-177.6	0	0	0	0	112.8	H148 Q149 L155 S156	H148-S152 WeakPolarHBondContact O-CB 3.26Å; H148-S152 PolarHBondContact O-N 2.87Å; Q149-S152 PolarHBondContact O-N 3.39Å; S152-L155 PolarHBondContact O-N 2.95Å; S152-S156 PolarHBondContact O-N 3.41Å; S152-S156 PolarHBondContact O-OG 3.34Å
153	S	80.5	Confident	82.5	Confident	74 Å²	74	116.3 Å²	116.3	52%	0.517	59%	0.591	S	S	.	*	H	α-helix	trans	-64.4	-40.2	176.4	-178	0	0	0	0	112.3	Q149 S156 W157	Q149-S153 WeakPolarHBondContact O-CB 3.29Å; Q149-S153 PolarHBondContact O-N 3.29Å; S153-S156 PolarHBondContact O-OG 3.44Å; S153-W157 WeakPolarHBondContact O-CB 3.3Å; S153-W157 PolarHBondContact O-N 2.97Å; S153-W157 VanDerWaalsContact O-N 3.12Å
154	S	84.2	Confident	81.1	Confident	56 Å²	56	115.8 Å²	115.8	39%	0.392	59%	0.594	S	S	.	*	H	α-helix	trans	-58.8	-54.2	171.1	179.2	0	0	0	0	109.7	K150 S151 S156 W157 W158	K150-S154 VanDerWaalsContact O-CB 3.23Å; K150-S154 WeakPolarHBondContact O-CB 3.22Å; K150-S154 PolarHBondContact O-N 3.21Å; S151-S154 WeakPolarHBondContact O-CB 3.42Å; S151-S154 PolarHBondContact O-N 2.93Å; S154-S156 VanDerWaalsContact C-N 3.31Å; S154-S156 PolarHBondContact O-N 2.86Å; S154-W157 WeakPolarHBondContact O-CA 3.19Å; S154-W157 WeakPolarHBondContact O-CB 3.4Å; S154-W157 PolarHBondContact O-N 3.49Å; S154-W158 VanDerWaalsContact C-CD1 3.49Å; S154-W158 PolarHBondContact O-N 3.33Å; S154-W158 PolarHBondContact OG-NE1 3.22Å
155	L	77.7	Confident	79.3	Confident	124 Å²	124	114.4 Å²	114.4	65%	0.649	60%	0.597	S	S	*	*	H	α-helix	trans	-58.8	-39.3	-176.1	-149.3	79.4	0	0	0	113.1	S151 S152 W158 K159	S151-L155 WeakPolarHBondContact O-CB 3.45Å; S151-L155 PolarHBondContact O-N 3.4Å; S152-L155 PolarHBondContact O-N 2.95Å; L155-W158 PolarHBondContact O-N 2.9Å; L155-K159 PolarHBondContact O-N 3.43Å; L155-K159 VanDerWaalsContact O-N 3.07Å
156	S	82.3	Confident	77.6	Confident	71 Å²	71	115.8 Å²	115.8	50%	0.497	61%	0.611	S	S	.	*	H	α-helix	trans	-67.7	-38	175.9	66.6	0	0	0	0	112.1	S152 S153 S154 K159 A160	S152-S156 PolarHBondContact O-N 3.41Å; S152-S156 PolarHBondContact O-OG 3.34Å; S153-S156 PolarHBondContact O-OG 3.44Å; S154-S156 VanDerWaalsContact C-N 3.31Å; S154-S156 PolarHBondContact O-N 2.86Å; S156-K159 PolarHBondContact O-N 3.12Å; S156-A160 WeakPolarHBondContact O-CB 3.34Å; S156-A160 PolarHBondContact O-N 3.2Å
157	W	78.8	Confident	75.8	Confident	157 Å²	157	117.1 Å²	117.1	60%	0.595	62%	0.619	S	S	*	*	H	α-helix	trans	-63.2	-40	174.6	-171.8	85.7	0	0	0	112.3	S153 S154 K161	S153-W157 WeakPolarHBondContact O-CB 3.3Å; S153-W157 PolarHBondContact O-N 2.97Å; S153-W157 VanDerWaalsContact O-N 3.12Å; S154-W157 WeakPolarHBondContact O-CA 3.19Å; S154-W157 WeakPolarHBondContact O-CB 3.4Å; S154-W157 PolarHBondContact O-N 3.49Å; W157-K161 HydrophobicContact CH2-CD 4.47Å; W157-K161 PolarHBondContact O-N 3.27Å
158	W	77.8	Confident	73.9	Confident	145 Å²	145	121.3 Å²	121.3	55%	0.549	63%	0.632	S	S	.	*	H	α-helix	trans	-64.6	-44.4	173.2	-65.6	99.9	0	0	0	112.1	S154 L155 A160 K161 E162	S154-W158 VanDerWaalsContact C-CD1 3.49Å; S154-W158 PolarHBondContact O-N 3.33Å; S154-W158 PolarHBondContact OG-NE1 3.22Å; L155-W158 PolarHBondContact O-N 2.9Å; W158-A160 PolarHBondContact O-N 2.97Å; W158-K161 PolarHBondContact O-N 3.36Å; W158-E162 PolarHBondContact O-N 3.25Å; W158-E162 VanDerWaalsContact O-N 3.17Å
159	K	80.6	Confident	72	Confident	157 Å²	157	123.1 Å²	123.1	68%	0.683	64%	0.64	S	S	*	*	H	α-helix	trans	-66.5	-36.5	-178.7	-155.9	178.2	-127.6	-177.2	0	112.8	L155 S156 K161 E162 A163	L155-K159 PolarHBondContact O-N 3.43Å; L155-K159 VanDerWaalsContact O-N 3.07Å; S156-K159 PolarHBondContact O-N 3.12Å; K159-K161 VanDerWaalsContact C-N 3.32Å; K159-E162 PolarHBondContact O-N 3.4Å; K159-A163 WeakPolarHBondContact O-CB 3.16Å; K159-A163 PolarHBondContact O-N 3.05Å; K159-A163 VanDerWaalsContact O-N 3.1Å
160	A	78.4	Confident	70	Confident	61 Å²	61	126.7 Å²	126.7	50%	0.504	65%	0.654	S	S	.	*	H	α-helix	trans	-64.7	-37	175.1	0	0	0	0	0	112.2	S156 W158 A163 T164	S156-A160 WeakPolarHBondContact O-CB 3.34Å; S156-A160 PolarHBondContact O-N 3.2Å; W158-A160 PolarHBondContact O-N 2.97Å; A160-A163 PolarHBondContact O-N 2.63Å; A160-T164 PolarHBondContact O-N 2.98Å
161	K	76.8	Confident	68.2	Low	137 Å²	137	128.7 Å²	128.7	60%	0.596	67%	0.666	S	S	*	*	H	α-helix	trans	-71.9	-33	179	-167.7	178.8	-178.7	-176.2	0	113.1	W157 W158 K159 T164	W157-K161 HydrophobicContact CH2-CD 4.47Å; W157-K161 PolarHBondContact O-N 3.27Å; W158-K161 PolarHBondContact O-N 3.36Å; K159-K161 VanDerWaalsContact C-N 3.32Å; K161-T164 PolarHBondContact O-OG1 2.86Å
162	E	73.2	Confident	66.5	Low	163 Å²	163	128.8 Å²	128.8	76%	0.762	68%	0.678	S	S	*	*	H	α-helix	trans	-72.7	-31.8	171.9	-72.7	176.8	176.3	0	0	112.1	W158 K159 T164	W158-E162 PolarHBondContact O-N 3.25Å; W158-E162 VanDerWaalsContact O-N 3.17Å; K159-E162 PolarHBondContact O-N 3.4Å; E162-T164 VanDerWaalsContact C-N 3.34Å; E162-T164 PolarHBondContact O-N 3.4Å
163	A	64.5	Low	64.8	Low	71 Å²	71	128.8 Å²	128.8	59%	0.587	69%	0.689	S	S	*	*	H	α-helix	trans	-77	-14.3	-178.7	0	0	0	0	0	114.3	K159 A160 P165	K159-A163 WeakPolarHBondContact O-CB 3.16Å; K159-A163 PolarHBondContact O-N 3.05Å; K159-A163 VanDerWaalsContact O-N 3.1Å; A160-A163 PolarHBondContact O-N 2.63Å; A163-P165 WeakPolarHBondContact O-CD 3.39Å; A163-P165 WeakPolarHBondContact O-CG 3.21Å; A163-P165 VanDerWaalsContact O-N 3.12Å
164	T	57.5	Low	63.1	Low	102 Å²	102	131.5 Å²	131.5	63%	0.626	70%	0.703	S	S	*	*	S	Bend	trans	-68	102.7	170.5	29.6	0	0	0	0	109.6	A160 K161 E162	A160-T164 PolarHBondContact O-N 2.98Å; K161-T164 PolarHBondContact O-OG1 2.86Å; E162-T164 VanDerWaalsContact C-N 3.34Å; E162-T164 PolarHBondContact O-N 3.4Å
165	P	54.3	Low	61.6	Low	110 Å²	110	137.9 Å²	137.9	71%	0.714	73%	0.727	S	S	*	*			trans	-72.8	137.9	179.9	-5.3	25.7	0	0	0	107.7	A163 N167	A163-P165 WeakPolarHBondContact O-CD 3.39Å; A163-P165 WeakPolarHBondContact O-CG 3.21Å; A163-P165 VanDerWaalsContact O-N 3.12Å; P165-N167 PolarHBondContact O-N 3.46Å
166	Q	54.3	Low	60.3	Low	205 Å²	205	145.3 Å²	145.3	96%	0.958	75%	0.754	S	S	*	*	S	Bend	trans	-62.1	76.9	174.3	-163.9	174.5	10.3	0	0	109.9
167	N	51.6	Low	59.2	Low	143 Å²	143	149.1 Å²	149.1	77%	0.765	77%	0.767	S	S	*	*			trans	-136.7	49.4	178.9	-150.6	29.5	0	0	0	110.8	P165	P165-N167 PolarHBondContact O-N 3.46Å
168	E	50.9	Low	58.1	Low	189 Å²	189	148.6 Å²	148.6	88%	0.883	78%	0.776	S	S	*	*			trans	-129.9	64.4	159.4	-88	-165.2	148.2	0	0	108.5
169	H	46.3	Very low	57	Low	181 Å²	181	148.8 Å²	148.8	84%	0.838	79%	0.789	S	S	*	*	S	Bend	trans	-148.4	79.9	157.6	-112.6	-60	0	0	0	106.7
170	K	47.1	Very low	55.7	Low	204 Å²	204	148.4 Å²	148.4	89%	0.887	80%	0.795	S	S	*	*			trans	163.1	81.7	153.2	-92	167.4	-173.4	-169.4	0	110.9
171	E	48.4	Very low	54.2	Low	208 Å²	208	153.8 Å²	153.8	97%	0.972	81%	0.813	S	S	*	*			trans	-164	122.4	146.6	-68.5	-161.2	157.3	0	0	106.1
172	G	48.3	Very low	52.7	Low	72 Å²	72	154.9 Å²	154.9	74%	0.742	83%	0.827	S	S	*	*			cis	-160.1	137.2	-14.2	0	0	0	0	0	103.4
173	G	48.3	Very low	51.3	Low	74 Å²	74	154.4 Å²	154.4	76%	0.763	83%	0.832	S	S	*	*				49.3	82.2	82.2	0	0	0	0	0	109.7
174	T	44.6	Very low	50.3	Low	132 Å²	132	160.8 Å²	160.8	81%	0.81	85%	0.851	S	S	*	*				45.6	98	89.1	-44.1	0	0	0	0	113.4
175	E	51.7	Low	49.7	Very low	190 Å²	190	165.7 Å²	165.7	89%	0.888	87%	0.87	S	S	*	*			trans	-173.6	93.9	145.8	-106.3	171.4	149	0	0	105.6
176	K	50.3	Low	49.3	Very low	280 Å²	280	170.7 Å²	170.7	100%	1.217	88%	0.884	S	S	*	*				55.1	0	94.1	-85.8	-162.8	178.1	-174.3	0	114.4

Retrieved 176 of 176 residues in 253.8 ms (Link to these results)

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