A0A096MT23_PAPAN Loading...

Guanylate cyclase activator 2B

Endogenous activator of intestinal guanylate cyclase. It stimulates this enzyme through the same receptor binding region as the heat-stable enterotoxins. May be a potent physiological regulator of intestinal fluid and electrolyte transport. May be an autocrine/paracrine regulator of intestinal salt and water transport.

AlphaFold DB , UniProt , Accession A0A096MT23, Species PAPAN (Papio anubis, Olive baboon), Gene GUCA2B, Length 112 aa.

						>A0A096MT23_PAPAN|A0A096MT23|GUCA2B
MGCRAVSGLLPGVAVVLLLLLQSTQSVYIQYQGFRVQLESMKKLSELEAQWAPSPRLQIQSLLPVVCHHPALPQDLQPVCASQEASSIFKTLRTIANDDCELCVNVACTGCL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	38.2	Very low	55.2	Low	254 Å²	254	125.8 Å²	125.8	100%	1.251	76%	0.758	S	S	*	*				0	121.3	0	-84.1	144.1	96	0	0	108.7
2	G	47.8	Very low	57.4	Low	70 Å²	70	118.5 Å²	118.5	72%	0.722	73%	0.727	S	S	*	*			trans	108.9	45.8	151.5	0	0	0	0	0	120.3	R4	G2-R4 VanDerWaalsContact C-N 3.34Å; G2-R4 PolarHBondContact O-N 3.02Å
3	C	51.5	Low	59.5	Low	144 Å²	144	116.8 Å²	116.8	97%	0.973	72%	0.716	S	S	*	*			trans	-79.5	87.8	154.3	-71	0	0	0	0	108.1
4	R	55.9	Low	61.4	Low	235 Å²	235	111.7 Å²	111.7	89%	0.887	69%	0.692	S	S	*	*			trans	-110	116.2	177.4	-86.1	-174.6	168.8	178	-3.3	111.1	G2	G2-R4 VanDerWaalsContact C-N 3.34Å; G2-R4 PolarHBondContact O-N 3.02Å
5	A	52.3	Low	63	Low	89 Å²	89	109.7 Å²	109.7	74%	0.736	68%	0.679	S	S	*	*			trans	67	66.4	140.2	0	0	0	0	0	118.9
6	V	52.3	Low	64.4	Low	111 Å²	111	107.9 Å²	107.9	67%	0.673	67%	0.667	S	S	*	*	S	Bend	trans	-102	-8.9	151	177.7	0	0	0	0	111.4	G8	V6-G8 PolarHBondContact O-N 3.27Å
7	S	54.6	Low	65.5	Low	98 Å²	98	107.8 Å²	107.8	69%	0.685	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-13.6	-170.2	-164	0	0	0	0	115.8	P11	S7-P11 WeakPolarHBondContact O-CD 3.48Å
8	G	55.1	Low	66.2	Low	62 Å²	62	108.2 Å²	108.2	64%	0.639	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-22.6	-176.9	0	0	0	0	0	114.9	V6 P11	V6-G8 PolarHBondContact O-N 3.27Å; G8-P11 WeakPolarHBondContact O-CD 3.45Å; G8-P11 WeakPolarHBondContact O-CG 3.43Å
9	L	57.5	Low	66.8	Low	128 Å²	128	107.9 Å²	107.9	67%	0.67	65%	0.651	S	S	*	*	H	α-helix	trans	-79.8	-36.1	179.3	-77.4	153.9	0	0	0	112	G12 V13	L9-G12 PolarHBondContact O-N 3.26Å; L9-V13 WeakPolarHBondContact O-CB 3.42Å; L9-V13 VanDerWaalsContact O-CG2 3.24Å; L9-V13 WeakPolarHBondContact O-CG2 3.46Å; L9-V13 PolarHBondContact O-N 3.16Å
10	L	64.4	Low	67.2	Low	120 Å²	120	107.9 Å²	107.9	63%	0.628	65%	0.647	S	S	*	*	H	α-helix	trans	-56.6	-50.1	178.4	-75.5	156.3	0	0	0	114	A14	L10-A14 VanDerWaalsContact O-CB 3.26Å; L10-A14 WeakPolarHBondContact O-CB 3.46Å; L10-A14 PolarHBondContact O-N 3.28Å
11	P	77.9	Confident	67.3	Low	73 Å²	73	108.2 Å²	108.2	47%	0.474	64%	0.644	S	S	.	*	H	α-helix	trans	-70	-35.9	179.1	26.3	-34.1	0	0	0	112.1	S7 G8 A14 V15	S7-P11 WeakPolarHBondContact O-CD 3.48Å; G8-P11 WeakPolarHBondContact O-CD 3.45Å; G8-P11 WeakPolarHBondContact O-CG 3.43Å; P11-A14 PolarHBondContact O-N 3.31Å; P11-V15 WeakPolarHBondContact O-CB 3.32Å; P11-V15 VanDerWaalsContact O-CG2 3.26Å; P11-V15 WeakPolarHBondContact O-CG2 3.33Å; P11-V15 PolarHBondContact O-N 2.87Å
12	G	80.8	Confident	68.5	Low	38 Å²	38	102.7 Å²	102.7	39%	0.392	62%	0.616	S	S	.	*	H	α-helix	trans	-64.2	-46.9	176.6	0	0	0	0	0	112.3	L9 A14 V15 V16	L9-G12 PolarHBondContact O-N 3.26Å; G12-A14 VanDerWaalsContact C-N 3.33Å; G12-A14 PolarHBondContact O-N 3.46Å; G12-V15 PolarHBondContact O-N 3.1Å; G12-V16 VanDerWaalsContact O-CG2 3.31Å; G12-V16 WeakPolarHBondContact O-CG2 3.41Å; G12-V16 PolarHBondContact O-N 3.31Å
13	V	85.6	Confident	69	Low	96 Å²	96	103.9 Å²	103.9	58%	0.582	61%	0.613	S	S	*	*	H	α-helix	trans	-63.4	-40.1	175	173.3	0	0	0	0	111	L9 V16 L17	L9-V13 WeakPolarHBondContact O-CB 3.42Å; L9-V13 VanDerWaalsContact O-CG2 3.24Å; L9-V13 WeakPolarHBondContact O-CG2 3.46Å; L9-V13 PolarHBondContact O-N 3.16Å; V13-V16 PolarHBondContact O-N 3.21Å; V13-L17 VanDerWaalsContact O-CB 3.3Å; V13-L17 WeakPolarHBondContact O-CB 3.5Å; V13-L17 PolarHBondContact O-N 3.21Å
14	A	85.5	Confident	69.4	Low	46 Å²	46	102.4 Å²	102.4	38%	0.38	60%	0.6	S	S	.	*	H	α-helix	trans	-64	-43.7	176.5	0	0	0	0	0	112.4	L10 P11 G12 L17 L18	L10-A14 VanDerWaalsContact O-CB 3.26Å; L10-A14 WeakPolarHBondContact O-CB 3.46Å; L10-A14 PolarHBondContact O-N 3.28Å; P11-A14 PolarHBondContact O-N 3.31Å; G12-A14 VanDerWaalsContact C-N 3.33Å; G12-A14 PolarHBondContact O-N 3.46Å; A14-L17 PolarHBondContact O-N 2.97Å; A14-L18 WeakPolarHBondContact O-CB 3.38Å; A14-L18 VanDerWaalsContact O-CG 3.25Å; A14-L18 WeakPolarHBondContact O-CG 3.48Å; A14-L18 PolarHBondContact O-N 3.06Å
15	V	86.3	Confident	70	Confident	81 Å²	81	95.1 Å²	95.1	49%	0.491	58%	0.576	S	S	.	*	H	α-helix	trans	-63.4	-45.2	176.1	170.4	0	0	0	0	110.8	P11 G12 L17 L18 L19	P11-V15 WeakPolarHBondContact O-CB 3.32Å; P11-V15 VanDerWaalsContact O-CG2 3.26Å; P11-V15 WeakPolarHBondContact O-CG2 3.33Å; P11-V15 PolarHBondContact O-N 2.87Å; G12-V15 PolarHBondContact O-N 3.1Å; V15-L17 VanDerWaalsContact C-N 3.34Å; V15-L17 PolarHBondContact O-N 3.12Å; V15-L18 PolarHBondContact O-N 3.24Å; V15-L19 HydrophobicContact CG1-CD1 4Å; V15-L19 HydrophobicContact CG1-CG 4.43Å; V15-L19 VanDerWaalsContact O-CG 3.28Å; V15-L19 WeakPolarHBondContact O-CG 3.26Å; V15-L19 PolarHBondContact O-N 3.15Å
16	V	85.2	Confident	71.3	Confident	82 Å²	82	93.5 Å²	93.5	50%	0.497	56%	0.559	S	S	.	*	H	α-helix	trans	-61	-43.3	176.3	171.4	0	0	0	0	111.1	G12 V13 L18 L19 L20	G12-V16 VanDerWaalsContact O-CG2 3.31Å; G12-V16 WeakPolarHBondContact O-CG2 3.41Å; G12-V16 PolarHBondContact O-N 3.31Å; V13-V16 PolarHBondContact O-N 3.21Å; V16-L18 PolarHBondContact O-N 3.29Å; V16-L19 PolarHBondContact O-N 3.06Å; V16-L20 HydrophobicContact CG1-CD1 3.92Å; V16-L20 HydrophobicContact CG1-CG 4.41Å; V16-L20 WeakPolarHBondContact O-CB 3.45Å; V16-L20 VanDerWaalsContact O-CG 3.27Å; V16-L20 WeakPolarHBondContact O-CG 3.46Å; V16-L20 PolarHBondContact O-N 3.27Å
17	L	82	Confident	73.1	Confident	105 Å²	105	89.3 Å²	89.3	55%	0.55	53%	0.534	S	S	.	.	H	α-helix	trans	-63.8	-40.6	177.9	-173	67.4	0	0	0	112.1	V13 A14 V15 L20 L21	V13-L17 VanDerWaalsContact O-CB 3.3Å; V13-L17 WeakPolarHBondContact O-CB 3.5Å; V13-L17 PolarHBondContact O-N 3.21Å; A14-L17 PolarHBondContact O-N 2.97Å; V15-L17 VanDerWaalsContact C-N 3.34Å; V15-L17 PolarHBondContact O-N 3.12Å; L17-L20 PolarHBondContact O-N 3.34Å; L17-L21 WeakPolarHBondContact O-CB 3.45Å; L17-L21 PolarHBondContact O-N 2.04Å
18	L	79.5	Confident	74.8	Confident	116 Å²	116	87.1 Å²	87.1	61%	0.607	51%	0.511	S	S	*	.	H	α-helix	trans	-65.4	-42	176.3	-72	170.8	0	0	0	111.9	A14 V15 V16 L21 Q22	A14-L18 WeakPolarHBondContact O-CB 3.38Å; A14-L18 VanDerWaalsContact O-CG 3.25Å; A14-L18 WeakPolarHBondContact O-CG 3.48Å; A14-L18 PolarHBondContact O-N 3.06Å; V15-L18 PolarHBondContact O-N 3.24Å; V16-L18 PolarHBondContact O-N 3.29Å; L18-L21 PolarHBondContact O-N 3.09Å; L18-Q22 WeakPolarHBondContact O-CG 2.99Å; L18-Q22 PolarHBondContact O-N 3.26Å
19	L	77.6	Confident	76.6	Confident	103 Å²	103	84.1 Å²	84.1	54%	0.539	48%	0.48	S	S	.	.	H	α-helix	trans	-62.9	-43.5	175.7	-69.7	171.6	0	0	0	111.5	V15 V16 L21 Q22 S23	V15-L19 HydrophobicContact CG1-CD1 4Å; V15-L19 HydrophobicContact CG1-CG 4.43Å; V15-L19 VanDerWaalsContact O-CG 3.28Å; V15-L19 WeakPolarHBondContact O-CG 3.26Å; V15-L19 PolarHBondContact O-N 3.15Å; V16-L19 PolarHBondContact O-N 3.06Å; L19-L21 VanDerWaalsContact C-N 3.34Å; L19-L21 PolarHBondContact O-N 2.88Å; L19-Q22 PolarHBondContact O-N 2.57Å; L19-S23 PolarHBondContact O-N 3.12Å; L19-S23 PolarHBondContact O-OG 3.06Å
20	L	74.4	Confident	78.4	Confident	106 Å²	106	81.9 Å²	81.9	56%	0.555	47%	0.466	S	S	*	.	H	α-helix	trans	-64.9	-36.8	176.6	-70.1	171.2	0	0	0	112.5	V16 L17 Q22 S23 T24	V16-L20 HydrophobicContact CG1-CD1 3.92Å; V16-L20 HydrophobicContact CG1-CG 4.41Å; V16-L20 WeakPolarHBondContact O-CB 3.45Å; V16-L20 VanDerWaalsContact O-CG 3.27Å; V16-L20 WeakPolarHBondContact O-CG 3.46Å; V16-L20 PolarHBondContact O-N 3.27Å; L17-L20 PolarHBondContact O-N 3.34Å; L20-Q22 VanDerWaalsContact C-N 3.27Å; L20-Q22 PolarHBondContact O-N 3.36Å; L20-S23 PolarHBondContact O-N 3.34Å; L20-S23 VanDerWaalsContact O-N 3.12Å; L20-T24 PolarHBondContact O-N 3.24Å
21	L	69.2	Low	79.7	Confident	115 Å²	115	79.1 Å²	79.1	60%	0.602	45%	0.448	S	S	*	.	H	α-helix	trans	-64.7	-31.8	176.4	-126.3	78.3	0	0	0	112.4	L17 L18 L19 S23 T24	L17-L21 WeakPolarHBondContact O-CB 3.45Å; L17-L21 PolarHBondContact O-N 2.04Å; L18-L21 PolarHBondContact O-N 3.09Å; L19-L21 VanDerWaalsContact C-N 3.34Å; L19-L21 PolarHBondContact O-N 2.88Å; L21-S23 VanDerWaalsContact C-N 3.3Å; L21-T24 PolarHBondContact O-OG1 3Å
22	Q	62.1	Low	80.2	Confident	138 Å²	138	81 Å²	81	65%	0.645	45%	0.451	S	S	*	.	H	α-helix	trans	-72.2	-25.7	174.3	-66	-161.5	-27.6	0	0	112.7	L18 L19 L20	L18-Q22 WeakPolarHBondContact O-CG 2.99Å; L18-Q22 PolarHBondContact O-N 3.26Å; L19-Q22 PolarHBondContact O-N 2.57Å; L20-Q22 VanDerWaalsContact C-N 3.27Å; L20-Q22 PolarHBondContact O-N 3.36Å
23	S	60.2	Low	80.7	Confident	96 Å²	96	83 Å²	83	67%	0.671	47%	0.471	S	S	*	.	H	α-helix	trans	-79.3	-16.7	179.8	-57	0	0	0	0	113.6	L19 L20 L21 Q25	L19-S23 PolarHBondContact O-N 3.12Å; L19-S23 PolarHBondContact O-OG 3.06Å; L20-S23 PolarHBondContact O-N 3.34Å; L20-S23 VanDerWaalsContact O-N 3.12Å; L21-S23 VanDerWaalsContact C-N 3.3Å; S23-Q25 VanDerWaalsContact C-N 3.25Å; S23-Q25 PolarHBondContact O-N 3.21Å
24	T	59.7	Low	81	Confident	112 Å²	112	80.6 Å²	80.6	69%	0.687	45%	0.452	S	S	*	.			trans	-82.9	70.7	173.8	55.1	0	0	0	0	110.6	L20 L21	L20-T24 PolarHBondContact O-N 3.24Å; L21-T24 PolarHBondContact O-OG1 3Å
25	Q	66.8	Low	81.3	Confident	82 Å²	82	84.9 Å²	84.9	38%	0.383	46%	0.459	S	S	.	.			trans	-89.5	118.6	171.4	-70	-155.9	-75.7	0	0	110.6	S23 V27 G110 L112	S23-Q25 VanDerWaalsContact C-N 3.25Å; S23-Q25 PolarHBondContact O-N 3.21Å; Q25-V27 PolarHBondContact O-N 2.98Å; Q25-G110 WeakPolarHBondContact CB-O 3.27Å; Q25-G110 PolarHBondContact NE2-O 3.38Å; Q25-L112 HydrophobicContact CG-CD1 3.98Å; Q25-L112 VanDerWaalsContact OE1-CB 3.26Å; Q25-L112 VanDerWaalsContact OE1-CD1 3.29Å; Q25-L112 VanDerWaalsContact OE1-CG 3.29Å
26	S	80.3	Confident	81.7	Confident	55 Å²	55	81 Å²	81	39%	0.385	44%	0.435	S	S	.	.			trans	-80.4	114.1	165.1	45.7	0	0	0	0	109	Y28	S26-Y28 VanDerWaalsContact O-CD2 3.24Å; S26-Y28 WeakPolarHBondContact O-CD2 3.31Å; S26-Y28 WeakPolarHBondContact O-CE2 3.25Å; S26-Y28 WeakPolarHBondContact OG-CE2 3.43Å; S26-Y28 PolarHBondContact OG-OH 3.17Å
27	V	89.6	Confident	82	Confident	24 Å²	24	80.7 Å²	80.7	15%	0.145	43%	0.429	C	S	.	.			trans	-82.7	128.5	171.6	-177	0	0	0	0	108.8	Q25 L38 C100 C108 T109	Q25-V27 PolarHBondContact O-N 2.98Å; V27-L38 HydrophobicContact CB-CB 4.09Å; V27-L38 HydrophobicContact CB-CD2 4.03Å; V27-L38 HydrophobicContact CG1-CB 4.39Å; V27-L38 HydrophobicContact CG1-CD2 4.23Å; V27-L38 WeakPolarHBondContact O-CB 3Å; V27-L38 PolarHBondContact O-N 3.2Å; V27-C100 HydrophobicContact CG1-CB 4.11Å; V27-C108 HydrophobicContact CG1-CB 4.21Å; V27-T109 CarbonylContact C-O 3.48Å; V27-T109 WeakPolarHBondContact CA-O 3.5Å
28	Y	91.8	Very high	82.5	Confident	51 Å²	51	76.5 Å²	76.5	20%	0.2	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.6	175.8	-54.4	-97.6	0	0	0	110.5	S26 R35 V36 Q37 C108 T109	S26-Y28 VanDerWaalsContact O-CD2 3.24Å; S26-Y28 WeakPolarHBondContact O-CD2 3.31Å; S26-Y28 WeakPolarHBondContact O-CE2 3.25Å; S26-Y28 WeakPolarHBondContact OG-CE2 3.43Å; S26-Y28 PolarHBondContact OG-OH 3.17Å; Y28-R35 HydrophobicContact CD1-CG 4.18Å; Y28-R35 HydrophobicContact CG-CG 4.48Å; Y28-V36 CarbonylContact C-O 3.55Å; Y28-V36 VanDerWaalsContact CA-O 3.28Å; Y28-V36 WeakPolarHBondContact CA-O 3.28Å; Y28-Q37 HydrophobicContact CD1-CG 3.64Å; Y28-Q37 HydrophobicContact CE1-CG 3.47Å; Y28-Q37 VanDerWaalsContact CE1-CG 3.47Å; Y28-C108 CarbonylContact O-C 3.57Å; Y28-C108 WeakPolarHBondContact O-CA 3.45Å; Y28-T109 WeakPolarHBondContact CB-OG1 3.31Å; Y28-T109 PolarHBondContact N-O 3.49Å; Y28-T109 PolarHBondContact O-N 2.98Å; Y28-T109 PolarHBondContact O-OG1 2.92Å
29	I	93.1	Very high	82.9	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	124.1	173.3	-49.3	178.5	0	0	0	108.1	R35 V36 L38 M41 L92 I95 A96 C100 A107	I29-R35 WeakPolarHBondContact O-CA 3.48Å; I29-V36 PolarHBondContact N-O 3.03Å; I29-V36 PolarHBondContact O-N 3.46Å; I29-L38 HydrophobicContact CD1-CD1 4.26Å; I29-M41 HydrophobicContact CD1-CG 4.09Å; I29-L92 HydrophobicContact CB-CD2 4.38Å; I29-L92 HydrophobicContact CG2-CD2 3.73Å; I29-I95 HydrophobicContact CG2-CB 4.29Å; I29-I95 HydrophobicContact CG2-CG2 3.62Å; I29-A96 HydrophobicContact CD1-CB 3.59Å; I29-C100 HydrophobicContact CG1-CB 4.42Å; I29-A107 CarbonylContact C-O 3.58Å; I29-A107 WeakPolarHBondContact CA-O 3.14Å
30	Q	93.4	Very high	83.6	Confident	81 Å²	81	71.2 Å²	71.2	38%	0.379	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	114.6	173	-71.4	-75.2	20.2	0	0	109.3	F34 A107 T109	Q30-F34 WeakPolarHBondContact CA-O 3.11Å; Q30-F34 PolarHBondContact OE1-O 3.44Å; Q30-A107 PolarHBondContact N-O 3.26Å; Q30-T109 HydrophobicContact CG-CG2 4.05Å
31	Y	92.4	Very high	84.4	Confident	61 Å²	61	66.9 Å²	66.9	24%	0.239	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	125	179.8	-175.2	-101.3	0	0	0	110.9	G33 F34 I88 T91 L92 I95	Y31-G33 PolarHBondContact O-N 3.07Å; Y31-F34 PolarHBondContact N-O 2.95Å; Y31-F34 WeakPolarHBondContact O-CB 3.25Å; Y31-F34 WeakPolarHBondContact O-CD2 3.36Å; Y31-F34 PolarHBondContact O-N 3.44Å; Y31-I88 HydrophobicContact CD1-CG2 4.15Å; Y31-I88 HydrophobicContact CE1-CG1 4.5Å; Y31-I88 HydrophobicContact CE1-CG2 4.38Å; Y31-T91 HydrophobicContact CD2-CG2 4.12Å; Y31-T91 HydrophobicContact CE1-CG2 4.06Å; Y31-T91 HydrophobicContact CE2-CG2 3.53Å; Y31-T91 VanDerWaalsContact CZ-CG2 3.49Å; Y31-L92 HydrophobicContact CG-CD2 4.4Å; Y31-I95 HydrophobicContact CD2-CD1 3.82Å; Y31-I95 HydrophobicContact CE2-CD1 4.37Å; Y31-I95 HydrophobicContact CG-CD1 4.37Å
32	Q	89.5	Confident	85.3	Confident	114 Å²	114	64.8 Å²	64.8	53%	0.533	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	33.9	178.5	-66.5	-173.7	-5.2	0	0	114.9	F34	Q32-F34 VanDerWaalsContact C-N 3.3Å; Q32-F34 HydrophobicContact CB-CD2 4.32Å; Q32-F34 PolarHBondContact O-N 3.29Å
33	G	90.1	Very high	86.6	Confident	79 Å²	79	63 Å²	63	81%	0.814	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	-3.1	-178.3	0	0	0	0	0	115	Y31	Y31-G33 PolarHBondContact O-N 3.07Å
34	F	92.5	Very high	87.9	Confident	45 Å²	45	58.6 Å²	58.6	20%	0.197	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	135.7	169.1	-58.2	-76.8	0	0	0	110.6	Q30 Y31 Q32 P78 V79 I88	Q30-F34 WeakPolarHBondContact CA-O 3.11Å; Q30-F34 PolarHBondContact OE1-O 3.44Å; Y31-F34 PolarHBondContact N-O 2.95Å; Y31-F34 WeakPolarHBondContact O-CB 3.25Å; Y31-F34 WeakPolarHBondContact O-CD2 3.36Å; Y31-F34 PolarHBondContact O-N 3.44Å; Q32-F34 VanDerWaalsContact C-N 3.3Å; Q32-F34 HydrophobicContact CB-CD2 4.32Å; Q32-F34 PolarHBondContact O-N 3.29Å; F34-P78 HydrophobicContact CD1-CB 4.06Å; F34-P78 HydrophobicContact CE1-CB 4.06Å; F34-P78 WeakPolarHBondContact CE1-O 3.27Å; F34-V79 HydrophobicContact CB-CG2 4.24Å; F34-V79 HydrophobicContact CD1-CG2 3.84Å; F34-V79 HydrophobicContact CE1-CG2 4.36Å; F34-V79 HydrophobicContact CG-CG2 3.96Å; F34-I88 HydrophobicContact CD2-CG2 4.39Å; F34-I88 HydrophobicContact CE2-CD1 3.8Å; F34-I88 HydrophobicContact CZ-CD1 4.42Å
35	R	92.6	Very high	89.1	Confident	136 Å²	136	55.8 Å²	55.8	51%	0.513	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	112.6	172.5	-172.3	-179.2	-178.6	-170.9	-0.7	109.3	Y28 I29	Y28-R35 HydrophobicContact CD1-CG 4.18Å; Y28-R35 HydrophobicContact CG-CG 4.48Å; I29-R35 WeakPolarHBondContact O-CA 3.48Å
36	V	93.1	Very high	90	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	142	-175.2	177.5	0	0	0	0	109.4	Y28 I29 M41 L76 V79 L92	Y28-V36 CarbonylContact C-O 3.55Å; Y28-V36 VanDerWaalsContact CA-O 3.28Å; Y28-V36 WeakPolarHBondContact CA-O 3.28Å; I29-V36 PolarHBondContact N-O 3.03Å; I29-V36 PolarHBondContact O-N 3.46Å; V36-M41 HydrophobicContact CG1-CE 4.31Å; V36-M41 HydrophobicContact CG1-CG 3.85Å; V36-M41 HydrophobicContact CG1-SD 4.22Å; V36-L76 HydrophobicContact CB-CD2 4.28Å; V36-L76 HydrophobicContact CG1-CD2 3.42Å; V36-L76 VanDerWaalsContact CG1-CD2 3.42Å; V36-L76 HydrophobicContact CG1-CG 4.22Å; V36-L76 HydrophobicContact CG2-CD2 3.8Å; V36-V79 HydrophobicContact CG2-CG2 4.32Å; V36-L92 HydrophobicContact CG2-CD1 4.13Å
37	Q	92.9	Very high	90.3	Very high	76 Å²	76	56.5 Å²	56.5	36%	0.355	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	137.1	172.5	-67.1	-177.8	21.8	0	0	110.6	Y28 E39 S40 M41 D75	Y28-Q37 HydrophobicContact CD1-CG 3.64Å; Y28-Q37 HydrophobicContact CE1-CG 3.47Å; Y28-Q37 VanDerWaalsContact CE1-CG 3.47Å; Q37-E39 PolarHBondContact O-N 3.48Å; Q37-S40 WeakPolarHBondContact O-CB 3.45Å; Q37-S40 PolarHBondContact O-N 2.85Å; Q37-M41 PolarHBondContact O-N 3.01Å; Q37-D75 WeakPolarHBondContact CB-OD2 3.48Å; Q37-D75 PolarHBondContact N-OD2 3.05Å
38	L	90.8	Very high	89.9	Confident	17 Å²	17	58.2 Å²	58.2	9%	0.089	29%	0.289	C	S	.	.	H	α-helix	trans	-54.7	-40.5	172.7	179.1	60.7	0	0	0	111	V27 I29 S40 M41 K42 A96 C100	V27-L38 HydrophobicContact CB-CB 4.09Å; V27-L38 HydrophobicContact CB-CD2 4.03Å; V27-L38 HydrophobicContact CG1-CB 4.39Å; V27-L38 HydrophobicContact CG1-CD2 4.23Å; V27-L38 WeakPolarHBondContact O-CB 3Å; V27-L38 PolarHBondContact O-N 3.2Å; I29-L38 HydrophobicContact CD1-CD1 4.26Å; L38-S40 VanDerWaalsContact C-N 3.32Å; L38-S40 PolarHBondContact O-N 3.32Å; L38-M41 WeakPolarHBondContact O-CB 3.44Å; L38-M41 PolarHBondContact O-N 3.21Å; L38-M41 VanDerWaalsContact O-N 3.12Å; L38-K42 PolarHBondContact O-N 2.99Å; L38-K42 VanDerWaalsContact O-N 3.09Å; L38-A96 HydrophobicContact CD1-CB 3.71Å; L38-A96 WeakPolarHBondContact CD1-O 3.46Å; L38-C100 HydrophobicContact CD1-CB 4.06Å; L38-C100 HydrophobicContact CD2-CB 4.24Å
39	E	89.6	Confident	89.5	Confident	97 Å²	97	60 Å²	60	45%	0.453	31%	0.314	S	S	.	.	H	α-helix	trans	-60.1	-38.6	176.4	-174.9	60.7	-163.9	0	0	113	Q37 M41 K42 K43	Q37-E39 PolarHBondContact O-N 3.48Å; E39-M41 VanDerWaalsContact C-N 3.31Å; E39-M41 PolarHBondContact O-N 3.5Å; E39-K42 PolarHBondContact O-N 3.26Å; E39-K43 HydrophobicContact CG-CD 4.42Å; E39-K43 WeakPolarHBondContact O-CG 3.21Å; E39-K43 PolarHBondContact O-N 2.89Å; E39-K43 VanDerWaalsContact OE1-CE 3.22Å; E39-K43 WeakPolarHBondContact OE1-CE 3.46Å; E39-K43 IonicContact OE1-NZ 3.76Å
40	S	91.9	Very high	89	Confident	11 Å²	11	67.3 Å²	67.3	8%	0.077	35%	0.348	C	S	.	.	H	α-helix	trans	-66	-35	175.9	-67.7	0	0	0	0	112.1	Q37 L38 L44 D75	Q37-S40 WeakPolarHBondContact O-CB 3.45Å; Q37-S40 PolarHBondContact O-N 2.85Å; L38-S40 VanDerWaalsContact C-N 3.32Å; L38-S40 PolarHBondContact O-N 3.32Å; S40-L44 WeakPolarHBondContact O-CB 3.38Å; S40-L44 PolarHBondContact O-N 3.33Å; S40-D75 VanDerWaalsContact CB-OD1 3.22Å; S40-D75 WeakPolarHBondContact CB-OD1 3.22Å; S40-D75 WeakPolarHBondContact CB-OD2 3.31Å; S40-D75 PolarHBondContact OG-OD1 3.44Å; S40-D75 PolarHBondContact OG-OD2 3.38Å
41	M	90.4	Very high	88.2	Confident	14 Å²	14	66.8 Å²	66.8	7%	0.069	34%	0.343	C	S	.	.	H	α-helix	trans	-67.2	-40	174.1	-67	-77.9	72.7	0	0	112.5	I29 V36 Q37 L38 E39 L44 S45 L76 F89 L92 A96	I29-M41 HydrophobicContact CD1-CG 4.09Å; V36-M41 HydrophobicContact CG1-CE 4.31Å; V36-M41 HydrophobicContact CG1-CG 3.85Å; V36-M41 HydrophobicContact CG1-SD 4.22Å; Q37-M41 PolarHBondContact O-N 3.01Å; L38-M41 WeakPolarHBondContact O-CB 3.44Å; L38-M41 PolarHBondContact O-N 3.21Å; L38-M41 VanDerWaalsContact O-N 3.12Å; E39-M41 VanDerWaalsContact C-N 3.31Å; E39-M41 PolarHBondContact O-N 3.5Å; M41-L44 HydrophobicContact CE-CB 4.18Å; M41-L44 HydrophobicContact CE-CD2 3.58Å; M41-L44 WeakPolarHBondContact O-CB 3.45Å; M41-L44 PolarHBondContact O-N 2.84Å; M41-S45 PolarHBondContact O-N 3.43Å; M41-L76 HydrophobicContact CE-CD1 3.36Å; M41-L76 HydrophobicContact CE-CD2 3.32Å; M41-L76 HydrophobicContact CE-CG 3.92Å; M41-L76 HydrophobicContact SD-CD2 4.35Å; M41-F89 HydrophobicContact CE-CD1 4.16Å; M41-F89 HydrophobicContact CE-CE1 4.03Å; M41-L92 HydrophobicContact SD-CB 3.71Å; M41-L92 HydrophobicContact SD-CD1 4.41Å; M41-A96 HydrophobicContact CB-CB 3.83Å; M41-A96 HydrophobicContact CG-CB 4.07Å
42	K	88.1	Confident	87.3	Confident	72 Å²	72	68.3 Å²	68.3	31%	0.313	37%	0.368	S	S	.	.	H	α-helix	trans	-61.7	-50.5	174.6	-68.3	-177.4	174.3	-166	0	111.4	L38 E39 L44 S45 E46 E101	L38-K42 PolarHBondContact O-N 2.99Å; L38-K42 VanDerWaalsContact O-N 3.09Å; E39-K42 PolarHBondContact O-N 3.26Å; K42-L44 VanDerWaalsContact C-N 3.27Å; K42-L44 PolarHBondContact O-N 3.16Å; K42-S45 WeakPolarHBondContact O-CB 3.2Å; K42-S45 PolarHBondContact O-N 3.19Å; K42-S45 VanDerWaalsContact O-N 3.08Å; K42-E46 PolarHBondContact O-N 2.94Å; K42-E101 WeakPolarHBondContact CE-OE1 3.5Å; K42-E101 IonicContact NZ-OE1 2.66Å; K42-E101 PolarHBondContact NZ-OE1 2.95Å
43	K	88.9	Confident	86.5	Confident	101 Å²	101	64 Å²	64	44%	0.439	35%	0.35	S	S	.	.	H	α-helix	trans	-57.3	-41.1	175.2	-73.5	175	-178	166.6	0	112	E39 S45 E46 L47	E39-K43 HydrophobicContact CG-CD 4.42Å; E39-K43 WeakPolarHBondContact O-CG 3.21Å; E39-K43 PolarHBondContact O-N 2.89Å; E39-K43 VanDerWaalsContact OE1-CE 3.22Å; E39-K43 WeakPolarHBondContact OE1-CE 3.46Å; E39-K43 IonicContact OE1-NZ 3.76Å; K43-S45 VanDerWaalsContact C-N 3.33Å; K43-S45 PolarHBondContact O-N 3.33Å; K43-E46 PolarHBondContact O-N 2.92Å; K43-L47 WeakPolarHBondContact O-CB 3.19Å; K43-L47 WeakPolarHBondContact O-CG 3.43Å; K43-L47 PolarHBondContact O-N 2.74Å
44	L	88.6	Confident	85.8	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.016	33%	0.33	C	S	.	.	H	α-helix	trans	-60.3	-43.7	176.7	-166.4	75.5	0	0	0	111.9	S40 M41 K42 E46 L47 E48 V66 L72 L76 F89	S40-L44 WeakPolarHBondContact O-CB 3.38Å; S40-L44 PolarHBondContact O-N 3.33Å; M41-L44 HydrophobicContact CE-CB 4.18Å; M41-L44 HydrophobicContact CE-CD2 3.58Å; M41-L44 WeakPolarHBondContact O-CB 3.45Å; M41-L44 PolarHBondContact O-N 2.84Å; K42-L44 VanDerWaalsContact C-N 3.27Å; K42-L44 PolarHBondContact O-N 3.16Å; L44-E46 VanDerWaalsContact C-N 3.32Å; L44-E46 PolarHBondContact O-N 2.75Å; L44-L47 PolarHBondContact O-N 2.79Å; L44-E48 WeakPolarHBondContact O-CG 3.22Å; L44-E48 PolarHBondContact O-N 2.95Å; L44-V66 HydrophobicContact CD1-CB 3.94Å; L44-V66 HydrophobicContact CD1-CG1 4.1Å; L44-V66 HydrophobicContact CD2-CB 4.46Å; L44-V66 HydrophobicContact CD2-CG1 4.41Å; L44-V66 HydrophobicContact CD2-CG2 4.32Å; L44-V66 HydrophobicContact CG-CB 4.4Å; L44-V66 HydrophobicContact CG-CG1 4.17Å; L44-L72 HydrophobicContact CD1-CD1 3.52Å; L44-L76 HydrophobicContact CB-CD1 4.24Å; L44-L76 HydrophobicContact CD1-CD1 4.03Å; L44-L76 HydrophobicContact CD2-CD1 4.06Å; L44-L76 HydrophobicContact CG-CD1 4.35Å; L44-F89 HydrophobicContact CD2-CD1 3.74Å; L44-F89 HydrophobicContact CD2-CE1 3.53Å
45	S	84.1	Confident	84.9	Confident	52 Å²	52	65.1 Å²	65.1	36%	0.364	35%	0.348	S	S	.	.	H	α-helix	trans	-64.1	-37.5	178.4	-167.9	0	0	0	0	112.1	M41 K42 K43 A49	M41-S45 PolarHBondContact O-N 3.43Å; K42-S45 WeakPolarHBondContact O-CB 3.2Å; K42-S45 PolarHBondContact O-N 3.19Å; K42-S45 VanDerWaalsContact O-N 3.08Å; K43-S45 VanDerWaalsContact C-N 3.33Å; K43-S45 PolarHBondContact O-N 3.33Å; S45-A49 WeakPolarHBondContact O-CB 3.44Å; S45-A49 PolarHBondContact O-N 2.96Å
46	E	86.8	Confident	84	Confident	115 Å²	115	67.9 Å²	67.9	54%	0.537	36%	0.359	S	S	.	.	H	α-helix	trans	-67.2	-42.6	174.7	-68.9	177.4	-179.2	0	0	111.9	K42 K43 L44 E48 A49 Q50	K42-E46 PolarHBondContact O-N 2.94Å; K43-E46 PolarHBondContact O-N 2.92Å; L44-E46 VanDerWaalsContact C-N 3.32Å; L44-E46 PolarHBondContact O-N 2.75Å; E46-E48 VanDerWaalsContact C-N 3.35Å; E46-A49 PolarHBondContact O-N 2.73Å; E46-Q50 VanDerWaalsContact O-CG 3.31Å; E46-Q50 WeakPolarHBondContact O-CG 3.28Å; E46-Q50 PolarHBondContact O-N 2.97Å
47	L	85.7	Confident	83.1	Confident	37 Å²	37	71.4 Å²	71.4	19%	0.194	38%	0.378	C	S	.	.	H	α-helix	trans	-61.4	-43.8	175.7	-70.6	173.7	0	0	0	111.2	K43 L44 A49 Q50 W51 A71	K43-L47 WeakPolarHBondContact O-CB 3.19Å; K43-L47 WeakPolarHBondContact O-CG 3.43Å; K43-L47 PolarHBondContact O-N 2.74Å; L44-L47 PolarHBondContact O-N 2.79Å; L47-A49 VanDerWaalsContact C-N 3.35Å; L47-A49 PolarHBondContact O-N 3.39Å; L47-Q50 PolarHBondContact O-N 2.82Å; L47-W51 WeakPolarHBondContact O-CB 2.87Å; L47-W51 PolarHBondContact O-N 3.31Å; L47-A71 HydrophobicContact CD1-CB 4.22Å; L47-A71 VanDerWaalsContact CD1-O 3.28Å; L47-A71 WeakPolarHBondContact CD1-O 3.47Å; L47-A71 HydrophobicContact CD2-CB 4.31Å
48	E	82.3	Confident	82	Confident	60 Å²	60	73.3 Å²	73.3	28%	0.28	39%	0.386	S	S	.	.	H	α-helix	trans	-60.4	-42.2	173.9	-78.8	-175	175.1	0	0	112.6	L44 E46 Q50 W51 V66 R93	L44-E48 WeakPolarHBondContact O-CG 3.22Å; L44-E48 PolarHBondContact O-N 2.95Å; E46-E48 VanDerWaalsContact C-N 3.35Å; E48-Q50 VanDerWaalsContact C-N 3.3Å; E48-Q50 PolarHBondContact O-N 3.22Å; E48-W51 PolarHBondContact O-N 3.2Å; E48-W51 VanDerWaalsContact O-O 3.06Å; E48-V66 VanDerWaalsContact CD-CG1 3.44Å; E48-V66 HydrophobicContact CG-CG1 3.18Å; E48-V66 WeakPolarHBondContact OE1-CG1 3.37Å; E48-R93 IonicContact OE1-CZ 3.76Å; E48-R93 IonicContact OE1-NH1 3.94Å; E48-R93 IonicContact OE1-NH2 2.72Å; E48-R93 PolarHBondContact OE1-NH2 3.3Å; E48-R93 IonicContact OE2-CZ 3.17Å; E48-R93 IonicContact OE2-NH1 2.8Å; E48-R93 PolarHBondContact OE2-NH1 3.48Å; E48-R93 IonicContact OE2-NH2 2.83Å; E48-R93 PolarHBondContact OE2-NH2 2.93Å
49	A	82.3	Confident	80.9	Confident	88 Å²	88	79.4 Å²	79.4	73%	0.727	42%	0.417	S	S	*	.	H	α-helix	trans	-66.9	-33.3	-179.3	0	0	0	0	0	112.5	S45 E46 L47	S45-A49 WeakPolarHBondContact O-CB 3.44Å; S45-A49 PolarHBondContact O-N 2.96Å; E46-A49 PolarHBondContact O-N 2.73Å; L47-A49 VanDerWaalsContact C-N 3.35Å; L47-A49 PolarHBondContact O-N 3.39Å
50	Q	82.1	Confident	79.7	Confident	155 Å²	155	82 Å²	82	72%	0.724	43%	0.43	S	S	*	.	H	α-helix	trans	-85.2	-23.9	179.6	-66.7	170.1	35.6	0	0	112.5	E46 L47 E48	E46-Q50 VanDerWaalsContact O-CG 3.31Å; E46-Q50 WeakPolarHBondContact O-CG 3.28Å; E46-Q50 PolarHBondContact O-N 2.97Å; L47-Q50 PolarHBondContact O-N 2.82Å; E48-Q50 VanDerWaalsContact C-N 3.3Å; E48-Q50 PolarHBondContact O-N 3.22Å
51	W	76.6	Confident	78.6	Confident	70 Å²	70	83 Å²	83	27%	0.265	44%	0.437	S	S	.	.			trans	-97.3	118.1	-175.7	-173.4	46	0	0	0	111.6	L47 E48 P53 V65 H68 H69	L47-W51 WeakPolarHBondContact O-CB 2.87Å; L47-W51 PolarHBondContact O-N 3.31Å; E48-W51 PolarHBondContact O-N 3.2Å; E48-W51 VanDerWaalsContact O-O 3.06Å; W51-P53 HydrophobicContact CD2-CB 4.33Å; W51-P53 HydrophobicContact CE3-CB 4.46Å; W51-P53 HydrophobicContact CH2-CB 4.19Å; W51-P53 HydrophobicContact CZ2-CB 4Å; W51-P53 HydrophobicContact CZ3-CB 4.43Å; W51-P53 WeakPolarHBondContact O-CD 3.09Å; W51-V65 HydrophobicContact CE3-CG1 4.23Å; W51-V65 HydrophobicContact CH2-CG1 3.41Å; W51-V65 VanDerWaalsContact CH2-CG1 3.41Å; W51-V65 VanDerWaalsContact CH2-O 3.25Å; W51-V65 WeakPolarHBondContact CH2-O 3.3Å; W51-V65 HydrophobicContact CZ2-CG1 4.32Å; W51-V65 HydrophobicContact CZ3-CB 4.29Å; W51-V65 HydrophobicContact CZ3-CG1 3.38Å; W51-V65 WeakPolarHBondContact CZ3-O 3.39Å; W51-H68 HydrophobicContact CH2-CB 4.23Å; W51-H69 AromaticContact CD2-CD2 3.65Å; W51-H69 HydrophobicContact CE3-CB 4.4Å; W51-H69 AromaticContact CE3-CD2 3.65Å; W51-H69 AromaticContact CG-CD2 3.89Å; W51-H69 HydrophobicContact CZ3-CB 4.1Å
52	A	74.8	Confident	77.6	Confident	93 Å²	93	90.6 Å²	90.6	77%	0.769	48%	0.477	S	S	*	.			trans	-97	91.3	168.6	0	0	0	0	0	109.3
53	P	71.6	Confident	77.1	Confident	24 Å²	24	90.1 Å²	90.1	16%	0.156	48%	0.477	C	S	.	.			trans	-63.4	147.1	177.1	24.8	-33.5	0	0	0	111	W51 Q58 V65	W51-P53 HydrophobicContact CD2-CB 4.33Å; W51-P53 HydrophobicContact CE3-CB 4.46Å; W51-P53 HydrophobicContact CH2-CB 4.19Å; W51-P53 HydrophobicContact CZ2-CB 4Å; W51-P53 HydrophobicContact CZ3-CB 4.43Å; W51-P53 WeakPolarHBondContact O-CD 3.09Å; P53-Q58 HydrophobicContact CB-CG 4.35Å; P53-Q58 HydrophobicContact CG-CG 4.03Å; P53-V65 HydrophobicContact CB-CG1 3.31Å; P53-V65 HydrophobicContact CG-CB 4.47Å; P53-V65 HydrophobicContact CG-CG1 3.52Å
54	S	76.9	Confident	76.7	Confident	55 Å²	55	86.1 Å²	86.1	39%	0.385	46%	0.462	S	S	.	.			trans	-60.5	143.3	178.7	74.7	0	0	0	0	110.9	R56 L57 Q58	S54-R56 PolarHBondContact O-N 3.37Å; S54-L57 WeakPolarHBondContact O-CB 3Å; S54-L57 PolarHBondContact O-N 3.12Å; S54-L57 WeakPolarHBondContact OG-CG 3.45Å; S54-L57 PolarHBondContact OG-N 3.47Å; S54-Q58 PolarHBondContact O-N 2.92Å
55	P	72.3	Confident	76.5	Confident	91 Å²	91	87.6 Å²	87.6	59%	0.591	47%	0.471	S	S	*	.	H	α-helix	trans	-55.3	-29.7	179.7	-26.8	33.5	0	0	0	113.3	Q58 I59	P55-Q58 PolarHBondContact O-N 3.02Å; P55-I59 WeakPolarHBondContact O-CD1 3.36Å; P55-I59 VanDerWaalsContact O-CG1 3.27Å; P55-I59 WeakPolarHBondContact O-CG1 3.4Å; P55-I59 PolarHBondContact O-N 3.39Å
56	R	75.2	Confident	76.5	Confident	194 Å²	194	85.4 Å²	85.4	73%	0.732	46%	0.455	S	S	*	.	H	α-helix	trans	-67.5	-39.2	177	-68.5	-173.4	176.3	-159.2	-0.8	112.7	S54 Q58 I59 Q60	S54-R56 PolarHBondContact O-N 3.37Å; R56-Q58 VanDerWaalsContact C-N 3.34Å; R56-I59 PolarHBondContact O-N 3.23Å; R56-Q60 WeakPolarHBondContact O-CB 3.18Å; R56-Q60 WeakPolarHBondContact O-CG 3.21Å; R56-Q60 PolarHBondContact O-N 3.06Å; R56-Q60 VanDerWaalsContact O-N 3.16Å
57	L	73.5	Confident	76.6	Confident	75 Å²	75	81 Å²	81	39%	0.393	44%	0.437	S	S	.	.	H	α-helix	trans	-67.1	-37.1	176.3	-78.8	166.3	0	0	0	111.5	S54 I59 S61	S54-L57 WeakPolarHBondContact O-CB 3Å; S54-L57 PolarHBondContact O-N 3.12Å; S54-L57 WeakPolarHBondContact OG-CG 3.45Å; S54-L57 PolarHBondContact OG-N 3.47Å; L57-I59 VanDerWaalsContact C-N 3.33Å; L57-I59 PolarHBondContact O-N 3.25Å; L57-S61 WeakPolarHBondContact O-CB 3.24Å; L57-S61 PolarHBondContact O-N 3.32Å
58	Q	69.1	Low	76.6	Confident	115 Å²	115	83.8 Å²	83.8	54%	0.537	45%	0.449	S	S	.	.	H	α-helix	trans	-66.3	-34	178.2	-64.3	-175.8	-40.8	0	0	112.9	P53 S54 P55 R56 V65	P53-Q58 HydrophobicContact CB-CG 4.35Å; P53-Q58 HydrophobicContact CG-CG 4.03Å; S54-Q58 PolarHBondContact O-N 2.92Å; P55-Q58 PolarHBondContact O-N 3.02Å; R56-Q58 VanDerWaalsContact C-N 3.34Å; Q58-V65 HydrophobicContact CG-CG2 4.24Å
59	I	67.1	Low	76.8	Confident	145 Å²	145	82.3 Å²	82.3	74%	0.744	44%	0.442	S	S	*	.	H	α-helix	trans	-84.9	-31.8	-176.1	-64.1	164.7	0	0	0	112.3	P55 R56 L57	P55-I59 WeakPolarHBondContact O-CD1 3.36Å; P55-I59 VanDerWaalsContact O-CG1 3.27Å; P55-I59 WeakPolarHBondContact O-CG1 3.4Å; P55-I59 PolarHBondContact O-N 3.39Å; R56-I59 PolarHBondContact O-N 3.23Å; L57-I59 VanDerWaalsContact C-N 3.33Å; L57-I59 PolarHBondContact O-N 3.25Å
60	Q	65.9	Low	77	Confident	152 Å²	152	84.2 Å²	84.2	71%	0.71	45%	0.446	S	S	*	.	H	α-helix	trans	-96.7	-11.4	-172.7	-68.8	174.1	50.7	0	0	114	R56	R56-Q60 WeakPolarHBondContact O-CB 3.18Å; R56-Q60 WeakPolarHBondContact O-CG 3.21Å; R56-Q60 PolarHBondContact O-N 3.06Å; R56-Q60 VanDerWaalsContact O-N 3.16Å
61	S	67.6	Low	77.3	Confident	33 Å²	33	79.5 Å²	79.5	23%	0.231	43%	0.434	C	S	.	.			trans	-84.5	121.8	-174.2	-176.1	0	0	0	0	112	L57 L63 H68	L57-S61 WeakPolarHBondContact O-CB 3.24Å; L57-S61 PolarHBondContact O-N 3.32Å; S61-L63 WeakPolarHBondContact CB-O 3.28Å; S61-L63 PolarHBondContact OG-N 2.72Å; S61-L63 VanDerWaalsContact OG-N 3.12Å; S61-L63 PolarHBondContact OG-O 2.8Å; S61-H68 PolarHBondContact OG-NE2 2.83Å
62	L	69.9	Low	77.9	Confident	172 Å²	172	77.3 Å²	77.3	90%	0.901	43%	0.427	S	S	*	.	S	Bend	trans	-72.2	-21.8	164.6	-77.6	157	0	0	0	111.9
63	L	77.3	Confident	78.7	Confident	62 Å²	62	73.7 Å²	73.7	33%	0.325	40%	0.396	S	S	.	.	S	Bend	trans	-96.3	157.4	-179.5	-70.1	171.4	0	0	0	111.3	S61 V65 C67 C80 A85	S61-L63 WeakPolarHBondContact CB-O 3.28Å; S61-L63 PolarHBondContact OG-N 2.72Å; S61-L63 VanDerWaalsContact OG-N 3.12Å; S61-L63 PolarHBondContact OG-O 2.8Å; L63-V65 PolarHBondContact O-N 2.97Å; L63-C67 HydrophobicContact CB-CB 4.36Å; L63-C80 WeakPolarHBondContact CD2-O 3.5Å; L63-A85 HydrophobicContact CD2-CB 4.22Å
64	P	81.7	Confident	79.6	Confident	18 Å²	18	80.3 Å²	80.3	12%	0.117	43%	0.425	C	S	.	.			trans	-53	134.9	165	-25	35	0	0	0	110.1	V66 C67 A85 S86 F89	P64-V66 HydrophobicContact CB-CG2 3.54Å; P64-V66 PolarHBondContact O-N 3.47Å; P64-V66 VanDerWaalsContact O-N 3.09Å; P64-C67 VanDerWaalsContact O-CB 3.28Å; P64-C67 WeakPolarHBondContact O-CB 3.36Å; P64-C67 PolarHBondContact O-N 3.28Å; P64-A85 HydrophobicContact CG-CB 3.78Å; P64-S86 WeakPolarHBondContact CG-OG 3.45Å; P64-F89 HydrophobicContact CB-CD2 4.23Å; P64-F89 HydrophobicContact CG-CD2 3.79Å; P64-F89 HydrophobicContact CG-CE2 4.3Å
65	V	84	Confident	80.3	Confident	34 Å²	34	79.4 Å²	79.4	21%	0.206	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-57.3	-33.2	-177.2	-176.7	0	0	0	0	111	W51 P53 Q58 L63 C67 H68	W51-V65 HydrophobicContact CE3-CG1 4.23Å; W51-V65 HydrophobicContact CH2-CG1 3.41Å; W51-V65 VanDerWaalsContact CH2-CG1 3.41Å; W51-V65 VanDerWaalsContact CH2-O 3.25Å; W51-V65 WeakPolarHBondContact CH2-O 3.3Å; W51-V65 HydrophobicContact CZ2-CG1 4.32Å; W51-V65 HydrophobicContact CZ3-CB 4.29Å; W51-V65 HydrophobicContact CZ3-CG1 3.38Å; W51-V65 WeakPolarHBondContact CZ3-O 3.39Å; P53-V65 HydrophobicContact CB-CG1 3.31Å; P53-V65 HydrophobicContact CG-CB 4.47Å; P53-V65 HydrophobicContact CG-CG1 3.52Å; Q58-V65 HydrophobicContact CG-CG2 4.24Å; L63-V65 PolarHBondContact O-N 2.97Å; V65-C67 PolarHBondContact O-N 3.06Å; V65-C67 VanDerWaalsContact O-N 3.17Å; V65-H68 WeakPolarHBondContact O-CB 3.39Å; V65-H68 PolarHBondContact O-N 3.44Å
66	V	84.6	Confident	81.3	Confident	6 Å²	6	75 Å²	75	4%	0.036	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-55.4	-28.6	173.5	-70.7	0	0	0	0	115.5	L44 E48 P64 H68 H69 F89	L44-V66 HydrophobicContact CD1-CB 3.94Å; L44-V66 HydrophobicContact CD1-CG1 4.1Å; L44-V66 HydrophobicContact CD2-CB 4.46Å; L44-V66 HydrophobicContact CD2-CG1 4.41Å; L44-V66 HydrophobicContact CD2-CG2 4.32Å; L44-V66 HydrophobicContact CG-CB 4.4Å; L44-V66 HydrophobicContact CG-CG1 4.17Å; E48-V66 VanDerWaalsContact CD-CG1 3.44Å; E48-V66 HydrophobicContact CG-CG1 3.18Å; E48-V66 WeakPolarHBondContact OE1-CG1 3.37Å; P64-V66 HydrophobicContact CB-CG2 3.54Å; P64-V66 PolarHBondContact O-N 3.47Å; P64-V66 VanDerWaalsContact O-N 3.09Å; V66-H68 PolarHBondContact O-N 3.08Å; V66-H69 VanDerWaalsContact O-CB 3.25Å; V66-H69 WeakPolarHBondContact O-CB 3.45Å; V66-H69 PolarHBondContact O-N 3.3Å; V66-F89 HydrophobicContact CG2-CE1 4.48Å; V66-F89 HydrophobicContact CG2-CE2 4.42Å; V66-F89 HydrophobicContact CG2-CZ 4.36Å
67	C	88.9	Confident	82.1	Confident	23 Å²	23	71.4 Å²	71.4	16%	0.155	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-67.5	-17.4	177.4	-67.7	0	0	0	0	112.6	L63 P64 V65 C80	L63-C67 HydrophobicContact CB-CB 4.36Å; P64-C67 VanDerWaalsContact O-CB 3.28Å; P64-C67 WeakPolarHBondContact O-CB 3.36Å; P64-C67 PolarHBondContact O-N 3.28Å; V65-C67 PolarHBondContact O-N 3.06Å; V65-C67 VanDerWaalsContact O-N 3.17Å; C67-C80 WeakPolarHBondContact CA-SG 3.47Å; C67-C80 HydrophobicContact CB-CB 3.68Å; C67-C80 WeakPolarHBondContact CB-SG 3.41Å; C67-C80 VanDerWaalsContact SG-CA 3.54Å; C67-C80 WeakPolarHBondContact SG-CB 3.05Å; C67-C80 CovalentContact SG-SG 2.04Å; C67-C80 PolarHBondContact SG-SG 3.35Å
68	H	85.9	Confident	83	Confident	95 Å²	95	71.1 Å²	71.1	44%	0.44	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-91.1	-3.1	173.6	-61	-69	0	0	0	113.1	W51 S61 V65 V66	W51-H68 HydrophobicContact CH2-CB 4.23Å; S61-H68 PolarHBondContact OG-NE2 2.83Å; V65-H68 WeakPolarHBondContact O-CB 3.39Å; V65-H68 PolarHBondContact O-N 3.44Å; V66-H68 PolarHBondContact O-N 3.08Å
69	H	86.1	Confident	84.1	Confident	29 Å²	29	65.7 Å²	65.7	13%	0.134	36%	0.356	C	S	.	.			trans	-74	126.7	-177.9	-164.7	-83.8	0	0	0	110.5	W51 V66 A71 L72	W51-H69 AromaticContact CD2-CD2 3.65Å; W51-H69 HydrophobicContact CE3-CB 4.4Å; W51-H69 AromaticContact CE3-CD2 3.65Å; W51-H69 AromaticContact CG-CD2 3.89Å; W51-H69 HydrophobicContact CZ3-CB 4.1Å; V66-H69 VanDerWaalsContact O-CB 3.25Å; V66-H69 WeakPolarHBondContact O-CB 3.45Å; V66-H69 PolarHBondContact O-N 3.3Å; H69-A71 PolarHBondContact ND1-N 3.31Å; H69-A71 PolarHBondContact O-N 2.9Å; H69-L72 VanDerWaalsContact O-CB 3.31Å; H69-L72 WeakPolarHBondContact O-CB 3.22Å; H69-L72 PolarHBondContact O-N 2.91Å
70	P	85.1	Confident	85.3	Confident	127 Å²	127	59.6 Å²	59.6	83%	0.825	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-24.9	-176.3	26.3	-34.9	0	0	0	113.3	L72	P70-L72 VanDerWaalsContact C-N 3.34Å
71	A	88.4	Confident	86.4	Confident	56 Å²	56	56.7 Å²	56.7	46%	0.463	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	24	174.7	0	0	0	0	0	113.3	L47 H69 P73	L47-A71 HydrophobicContact CD1-CB 4.22Å; L47-A71 VanDerWaalsContact CD1-O 3.28Å; L47-A71 WeakPolarHBondContact CD1-O 3.47Å; L47-A71 HydrophobicContact CD2-CB 4.31Å; H69-A71 PolarHBondContact ND1-N 3.31Å; H69-A71 PolarHBondContact O-N 2.9Å; A71-P73 WeakPolarHBondContact O-CD 3.47Å
72	L	90.4	Very high	87.5	Confident	24 Å²	24	56.5 Å²	56.5	13%	0.126	33%	0.327	C	S	.	.			trans	-57.6	128.7	174.5	-177.8	75.7	0	0	0	110.1	L44 H69 P70 L76 Q77	L44-L72 HydrophobicContact CD1-CD1 3.52Å; H69-L72 VanDerWaalsContact O-CB 3.31Å; H69-L72 WeakPolarHBondContact O-CB 3.22Å; H69-L72 PolarHBondContact O-N 2.91Å; P70-L72 VanDerWaalsContact C-N 3.34Å; L72-L76 HydrophobicContact CD1-CB 4.07Å; L72-L76 HydrophobicContact CD1-CD1 4.28Å; L72-L76 HydrophobicContact CD2-CB 4.5Å; L72-L76 HydrophobicContact CG-CB 4.24Å; L72-Q77 HydrophobicContact CD2-CG 4.08Å
73	P	91.4	Very high	88.4	Confident	18 Å²	18	57.8 Å²	57.8	12%	0.117	33%	0.329	C	S	.	.			trans	-54.9	138.3	172.4	-26.1	33.3	0	0	0	112.9	A71 D75 L76	A71-P73 WeakPolarHBondContact O-CD 3.47Å; P73-D75 VanDerWaalsContact C-N 3.28Å; P73-D75 WeakPolarHBondContact CB-OD1 3.47Å; P73-D75 PolarHBondContact O-N 3.05Å; P73-L76 HydrophobicContact CB-CD1 3.92Å; P73-L76 HydrophobicContact CB-CG 4.32Å; P73-L76 HydrophobicContact CG-CD1 3.84Å; P73-L76 WeakPolarHBondContact O-CB 3.42Å; P73-L76 PolarHBondContact O-N 3.41Å
74	Q	91.1	Very high	88.9	Confident	163 Å²	163	60.1 Å²	60.1	76%	0.762	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-62.5	-33.3	-172.6	-68.5	-178.9	-13.7	0	0	113.3	L76 Q77	Q74-L76 PolarHBondContact O-N 2.91Å; Q74-Q77 WeakPolarHBondContact O-CB 3.37Å; Q74-Q77 PolarHBondContact O-N 3.06Å
75	D	91.4	Very high	89.3	Confident	35 Å²	35	59.3 Å²	59.3	19%	0.187	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-70.7	-10.9	178.1	59.6	-32.7	0	0	0	113.9	Q37 S40 P73	Q37-D75 WeakPolarHBondContact CB-OD2 3.48Å; Q37-D75 PolarHBondContact N-OD2 3.05Å; S40-D75 VanDerWaalsContact CB-OD1 3.22Å; S40-D75 WeakPolarHBondContact CB-OD1 3.22Å; S40-D75 WeakPolarHBondContact CB-OD2 3.31Å; S40-D75 PolarHBondContact OG-OD1 3.44Å; S40-D75 PolarHBondContact OG-OD2 3.38Å; P73-D75 VanDerWaalsContact C-N 3.28Å; P73-D75 WeakPolarHBondContact CB-OD1 3.47Å; P73-D75 PolarHBondContact O-N 3.05Å
76	L	92.3	Very high	89.5	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-98.3	-13.3	175.8	-65.4	171.4	0	0	0	113.9	V36 M41 L44 L72 P73 Q74 P78 V79 C80 F89	V36-L76 HydrophobicContact CB-CD2 4.28Å; V36-L76 HydrophobicContact CG1-CD2 3.42Å; V36-L76 VanDerWaalsContact CG1-CD2 3.42Å; V36-L76 HydrophobicContact CG1-CG 4.22Å; V36-L76 HydrophobicContact CG2-CD2 3.8Å; M41-L76 HydrophobicContact CE-CD1 3.36Å; M41-L76 HydrophobicContact CE-CD2 3.32Å; M41-L76 HydrophobicContact CE-CG 3.92Å; M41-L76 HydrophobicContact SD-CD2 4.35Å; L44-L76 HydrophobicContact CB-CD1 4.24Å; L44-L76 HydrophobicContact CD1-CD1 4.03Å; L44-L76 HydrophobicContact CD2-CD1 4.06Å; L44-L76 HydrophobicContact CG-CD1 4.35Å; L72-L76 HydrophobicContact CD1-CB 4.07Å; L72-L76 HydrophobicContact CD1-CD1 4.28Å; L72-L76 HydrophobicContact CD2-CB 4.5Å; L72-L76 HydrophobicContact CG-CB 4.24Å; P73-L76 HydrophobicContact CB-CD1 3.92Å; P73-L76 HydrophobicContact CB-CG 4.32Å; P73-L76 HydrophobicContact CG-CD1 3.84Å; P73-L76 WeakPolarHBondContact O-CB 3.42Å; P73-L76 PolarHBondContact O-N 3.41Å; Q74-L76 PolarHBondContact O-N 2.91Å; L76-P78 VanDerWaalsContact C-CD 3.41Å; L76-P78 VanDerWaalsContact C-N 3.32Å; L76-V79 HydrophobicContact CD2-CG2 4.44Å; L76-V79 WeakPolarHBondContact O-CB 3.15Å; L76-V79 PolarHBondContact O-N 3.49Å; L76-C80 PolarHBondContact O-N 3.22Å; L76-F89 HydrophobicContact CB-CE1 4.29Å; L76-F89 HydrophobicContact CB-CZ 4.15Å; L76-F89 HydrophobicContact CD1-CE1 4.16Å; L76-F89 HydrophobicContact CD2-CE1 3.78Å; L76-F89 HydrophobicContact CD2-CZ 4.29Å; L76-F89 HydrophobicContact CG-CE1 4.3Å
77	Q	91.8	Very high	89.8	Confident	117 Å²	117	63.4 Å²	63.4	55%	0.547	36%	0.363	S	S	.	.	H	α-helix	trans	-55.2	-41.1	175.2	-65.8	-179.2	-52.2	0	0	112.9	L72 Q74 V79 C80 A81	L72-Q77 HydrophobicContact CD2-CG 4.08Å; Q74-Q77 WeakPolarHBondContact O-CB 3.37Å; Q74-Q77 PolarHBondContact O-N 3.06Å; Q77-V79 VanDerWaalsContact C-N 3.27Å; Q77-V79 PolarHBondContact O-N 3.24Å; Q77-C80 WeakPolarHBondContact O-CB 3.45Å; Q77-C80 PolarHBondContact O-N 3.27Å; Q77-A81 PolarHBondContact O-N 2.76Å
78	P	92.6	Very high	90	Very high	70 Å²	70	62.4 Å²	62.4	46%	0.455	36%	0.356	S	S	.	.	H	α-helix	trans	-62.7	-32.9	176.6	-22.5	34.7	0	0	0	113.2	F34 L76 A81	F34-P78 HydrophobicContact CD1-CB 4.06Å; F34-P78 HydrophobicContact CE1-CB 4.06Å; F34-P78 WeakPolarHBondContact CE1-O 3.27Å; L76-P78 VanDerWaalsContact C-CD 3.41Å; L76-P78 VanDerWaalsContact C-N 3.32Å; P78-A81 PolarHBondContact O-N 2.84Å
79	V	92.9	Very high	90.3	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-67.5	-40	177.6	-176.6	0	0	0	0	110.3	F34 V36 L76 Q77 A81 S82 A85 I88 F89 L92	F34-V79 HydrophobicContact CB-CG2 4.24Å; F34-V79 HydrophobicContact CD1-CG2 3.84Å; F34-V79 HydrophobicContact CE1-CG2 4.36Å; F34-V79 HydrophobicContact CG-CG2 3.96Å; V36-V79 HydrophobicContact CG2-CG2 4.32Å; L76-V79 HydrophobicContact CD2-CG2 4.44Å; L76-V79 WeakPolarHBondContact O-CB 3.15Å; L76-V79 PolarHBondContact O-N 3.49Å; Q77-V79 VanDerWaalsContact C-N 3.27Å; Q77-V79 PolarHBondContact O-N 3.24Å; V79-A81 PolarHBondContact O-N 2.77Å; V79-S82 VanDerWaalsContact O-CB 3.26Å; V79-S82 WeakPolarHBondContact O-CB 3.32Å; V79-S82 PolarHBondContact O-N 2.02Å; V79-A85 WeakPolarHBondContact O-CB 3.05Å; V79-I88 HydrophobicContact CG1-CB 3.98Å; V79-I88 HydrophobicContact CG1-CG2 3.56Å; V79-F89 HydrophobicContact CB-CE2 3.99Å; V79-F89 HydrophobicContact CB-CZ 4.08Å; V79-F89 HydrophobicContact CG1-CD2 3.72Å; V79-F89 HydrophobicContact CG1-CE2 3.52Å; V79-F89 HydrophobicContact CG1-CG 4.34Å; V79-F89 HydrophobicContact CG1-CZ 3.98Å; V79-L92 HydrophobicContact CG1-CD1 4.49Å; V79-L92 HydrophobicContact CG2-CD1 4.18Å
80	C	91.5	Very high	90.4	Very high	18 Å²	18	64.4 Å²	64.4	12%	0.122	36%	0.363	C	S	.	.	H	α-helix	trans	-65.9	-19.3	176.2	-69.7	0	0	0	0	114.2	L63 C67 L76 Q77 S82	L63-C80 WeakPolarHBondContact CD2-O 3.5Å; C67-C80 WeakPolarHBondContact CA-SG 3.47Å; C67-C80 HydrophobicContact CB-CB 3.68Å; C67-C80 WeakPolarHBondContact CB-SG 3.41Å; C67-C80 VanDerWaalsContact SG-CA 3.54Å; C67-C80 WeakPolarHBondContact SG-CB 3.05Å; C67-C80 CovalentContact SG-SG 2.04Å; C67-C80 PolarHBondContact SG-SG 3.35Å; L76-C80 PolarHBondContact O-N 3.22Å; Q77-C80 WeakPolarHBondContact O-CB 3.45Å; Q77-C80 PolarHBondContact O-N 3.27Å; C80-S82 VanDerWaalsContact C-N 3.29Å
81	A	90.5	Very high	90.7	Very high	90 Å²	90	60.6 Å²	60.6	74%	0.744	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-12.6	172.7	0	0	0	0	0	112.9	Q77 P78 V79	Q77-A81 PolarHBondContact O-N 2.76Å; P78-A81 PolarHBondContact O-N 2.84Å; V79-A81 PolarHBondContact O-N 2.77Å
82	S	90.2	Very high	90.9	Very high	30 Å²	30	57.9 Å²	57.9	21%	0.21	32%	0.315	C	S	.	.	S	Bend	trans	-78.6	142.1	177	-176.2	0	0	0	0	111.6	V79 C80 E84 A85 I88	V79-S82 VanDerWaalsContact O-CB 3.26Å; V79-S82 WeakPolarHBondContact O-CB 3.32Å; V79-S82 PolarHBondContact O-N 2.02Å; C80-S82 VanDerWaalsContact C-N 3.29Å; S82-E84 PolarHBondContact O-N 3.44Å; S82-E84 PolarHBondContact OG-N 2.87Å; S82-E84 VanDerWaalsContact OG-N 3.15Å; S82-A85 WeakPolarHBondContact O-CB 3.46Å; S82-A85 PolarHBondContact O-N 3.41Å; S82-I88 WeakPolarHBondContact OG-CD1 2.99Å
83	Q	87.5	Confident	90.8	Very high	199 Å²	199	60.9 Å²	60.9	93%	0.93	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-22.9	170.6	-166.2	171.4	29.3	0	0	112.1
84	E	88.9	Confident	90.7	Very high	110 Å²	110	63.5 Å²	63.5	51%	0.514	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	19.4	178.5	-66	-175.8	-169.7	0	0	112.3	S82 S86 S87 I88	S82-E84 PolarHBondContact O-N 3.44Å; S82-E84 PolarHBondContact OG-N 2.87Å; S82-E84 VanDerWaalsContact OG-N 3.15Å; E84-S86 PolarHBondContact O-N 3.47Å; E84-S86 VanDerWaalsContact O-N 3.12Å; E84-S87 PolarHBondContact O-N 3.48Å; E84-S87 VanDerWaalsContact O-N 3.1Å; E84-S87 PolarHBondContact O-OG 3.01Å; E84-I88 HydrophobicContact CB-CD1 3.95Å; E84-I88 HydrophobicContact CB-CG1 4.27Å; E84-I88 VanDerWaalsContact O-CG1 3.32Å; E84-I88 WeakPolarHBondContact O-CG1 3.15Å; E84-I88 PolarHBondContact O-N 2.81Å
85	A	89.9	Confident	90.6	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.008	31%	0.308	C	S	.	.	H	α-helix	trans	-49.1	-45.5	-176.7	0	0	0	0	0	112.4	L63 P64 V79 S82 S87 I88 F89	L63-A85 HydrophobicContact CD2-CB 4.22Å; P64-A85 HydrophobicContact CG-CB 3.78Å; V79-A85 WeakPolarHBondContact O-CB 3.05Å; S82-A85 WeakPolarHBondContact O-CB 3.46Å; S82-A85 PolarHBondContact O-N 3.41Å; A85-S87 PolarHBondContact O-N 3.38Å; A85-I88 PolarHBondContact O-N 3.09Å; A85-F89 HydrophobicContact CB-CD2 4.38Å; A85-F89 HydrophobicContact CB-CE2 4.49Å; A85-F89 WeakPolarHBondContact O-CB 2.97Å; A85-F89 WeakPolarHBondContact O-CD2 3.45Å; A85-F89 PolarHBondContact O-N 3.32Å
86	S	88.6	Confident	90.5	Very high	68 Å²	68	54.8 Å²	54.8	48%	0.476	30%	0.3	S	S	.	.	H	α-helix	trans	-60.3	-43	-179.8	-58.2	0	0	0	0	114.2	P64 E84 K90	P64-S86 WeakPolarHBondContact CG-OG 3.45Å; E84-S86 PolarHBondContact O-N 3.47Å; E84-S86 VanDerWaalsContact O-N 3.12Å; S86-K90 PolarHBondContact O-N 3.13Å
87	S	90.5	Very high	90.1	Very high	59 Å²	59	59 Å²	59	41%	0.413	32%	0.322	S	S	.	.	H	α-helix	trans	-72.1	-42	177	50.9	0	0	0	0	110.9	E84 A85 F89 K90 T91	E84-S87 PolarHBondContact O-N 3.48Å; E84-S87 VanDerWaalsContact O-N 3.1Å; E84-S87 PolarHBondContact O-OG 3.01Å; A85-S87 PolarHBondContact O-N 3.38Å; S87-F89 PolarHBondContact O-N 2.92Å; S87-K90 WeakPolarHBondContact O-CB 3.26Å; S87-K90 PolarHBondContact O-N 3.47Å; S87-T91 PolarHBondContact O-N 3.03Å; S87-T91 PolarHBondContact O-OG1 3.03Å
88	I	92.6	Very high	89.5	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-61.2	-47.7	179.1	-64	163.8	0	0	0	110.7	Y31 F34 V79 S82 E84 A85 K90 T91 L92	Y31-I88 HydrophobicContact CD1-CG2 4.15Å; Y31-I88 HydrophobicContact CE1-CG1 4.5Å; Y31-I88 HydrophobicContact CE1-CG2 4.38Å; F34-I88 HydrophobicContact CD2-CG2 4.39Å; F34-I88 HydrophobicContact CE2-CD1 3.8Å; F34-I88 HydrophobicContact CZ-CD1 4.42Å; V79-I88 HydrophobicContact CG1-CB 3.98Å; V79-I88 HydrophobicContact CG1-CG2 3.56Å; S82-I88 WeakPolarHBondContact OG-CD1 2.99Å; E84-I88 HydrophobicContact CB-CD1 3.95Å; E84-I88 HydrophobicContact CB-CG1 4.27Å; E84-I88 VanDerWaalsContact O-CG1 3.32Å; E84-I88 WeakPolarHBondContact O-CG1 3.15Å; E84-I88 PolarHBondContact O-N 2.81Å; A85-I88 PolarHBondContact O-N 3.09Å; I88-K90 VanDerWaalsContact C-N 3.3Å; I88-K90 PolarHBondContact O-N 3.4Å; I88-T91 PolarHBondContact O-N 2.95Å; I88-L92 HydrophobicContact CG2-CD1 3.74Å; I88-L92 HydrophobicContact CG2-CG 4.09Å; I88-L92 WeakPolarHBondContact O-CB 3.47Å; I88-L92 VanDerWaalsContact O-CG 3.3Å; I88-L92 WeakPolarHBondContact O-CG 3.48Å; I88-L92 PolarHBondContact O-N 2.96Å
89	F	91.6	Very high	89	Confident	8 Å²	8	57 Å²	57	4%	0.035	31%	0.311	C	S	.	.	H	α-helix	trans	-61.1	-38	176.8	-88.1	-72.1	0	0	0	112.6	M41 L44 P64 V66 L76 V79 A85 S87 R93	M41-F89 HydrophobicContact CE-CD1 4.16Å; M41-F89 HydrophobicContact CE-CE1 4.03Å; L44-F89 HydrophobicContact CD2-CD1 3.74Å; L44-F89 HydrophobicContact CD2-CE1 3.53Å; P64-F89 HydrophobicContact CB-CD2 4.23Å; P64-F89 HydrophobicContact CG-CD2 3.79Å; P64-F89 HydrophobicContact CG-CE2 4.3Å; V66-F89 HydrophobicContact CG2-CE1 4.48Å; V66-F89 HydrophobicContact CG2-CE2 4.42Å; V66-F89 HydrophobicContact CG2-CZ 4.36Å; L76-F89 HydrophobicContact CB-CE1 4.29Å; L76-F89 HydrophobicContact CB-CZ 4.15Å; L76-F89 HydrophobicContact CD1-CE1 4.16Å; L76-F89 HydrophobicContact CD2-CE1 3.78Å; L76-F89 HydrophobicContact CD2-CZ 4.29Å; L76-F89 HydrophobicContact CG-CE1 4.3Å; V79-F89 HydrophobicContact CB-CE2 3.99Å; V79-F89 HydrophobicContact CB-CZ 4.08Å; V79-F89 HydrophobicContact CG1-CD2 3.72Å; V79-F89 HydrophobicContact CG1-CE2 3.52Å; V79-F89 HydrophobicContact CG1-CG 4.34Å; V79-F89 HydrophobicContact CG1-CZ 3.98Å; A85-F89 HydrophobicContact CB-CD2 4.38Å; A85-F89 HydrophobicContact CB-CE2 4.49Å; A85-F89 WeakPolarHBondContact O-CB 2.97Å; A85-F89 WeakPolarHBondContact O-CD2 3.45Å; A85-F89 PolarHBondContact O-N 3.32Å; S87-F89 PolarHBondContact O-N 2.92Å; F89-R93 WeakPolarHBondContact O-CB 3.25Å; F89-R93 PolarHBondContact O-N 3.48Å
90	K	89.4	Confident	88.8	Confident	158 Å²	158	57 Å²	57	69%	0.687	31%	0.311	S	S	*	.	H	α-helix	trans	-61.7	-47.4	175.6	-173.3	-179.2	179.5	-178.5	0	111	S86 S87 I88 R93 T94	S86-K90 PolarHBondContact O-N 3.13Å; S87-K90 WeakPolarHBondContact O-CB 3.26Å; S87-K90 PolarHBondContact O-N 3.47Å; I88-K90 VanDerWaalsContact C-N 3.3Å; I88-K90 PolarHBondContact O-N 3.4Å; K90-R93 PolarHBondContact O-N 3.21Å; K90-T94 PolarHBondContact O-N 2.96Å; K90-T94 PolarHBondContact O-OG1 2.03Å
91	T	91.5	Very high	88.3	Confident	47 Å²	47	61.1 Å²	61.1	29%	0.288	33%	0.329	S	S	.	.	H	α-helix	trans	-67.1	-43.8	178.5	-60.1	0	0	0	0	112.2	Y31 S87 I88 R93 T94 I95	Y31-T91 HydrophobicContact CD2-CG2 4.12Å; Y31-T91 HydrophobicContact CE1-CG2 4.06Å; Y31-T91 HydrophobicContact CE2-CG2 3.53Å; Y31-T91 VanDerWaalsContact CZ-CG2 3.49Å; S87-T91 PolarHBondContact O-N 3.03Å; S87-T91 PolarHBondContact O-OG1 3.03Å; I88-T91 PolarHBondContact O-N 2.95Å; T91-R93 VanDerWaalsContact C-N 3.25Å; T91-R93 PolarHBondContact O-N 3.31Å; T91-T94 PolarHBondContact O-N 2.95Å; T91-I95 HydrophobicContact CG2-CD1 3.76Å; T91-I95 HydrophobicContact CG2-CG1 4.34Å; T91-I95 WeakPolarHBondContact O-CG1 3.35Å; T91-I95 PolarHBondContact O-N 3.34Å
92	L	91.9	Very high	87.8	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-58.4	-38.1	175.8	-74.6	174.4	0	0	0	111.7	I29 Y31 V36 M41 V79 I88 I95 A96	I29-L92 HydrophobicContact CB-CD2 4.38Å; I29-L92 HydrophobicContact CG2-CD2 3.73Å; Y31-L92 HydrophobicContact CG-CD2 4.4Å; V36-L92 HydrophobicContact CG2-CD1 4.13Å; M41-L92 HydrophobicContact SD-CB 3.71Å; M41-L92 HydrophobicContact SD-CD1 4.41Å; V79-L92 HydrophobicContact CG1-CD1 4.49Å; V79-L92 HydrophobicContact CG2-CD1 4.18Å; I88-L92 HydrophobicContact CG2-CD1 3.74Å; I88-L92 HydrophobicContact CG2-CG 4.09Å; I88-L92 WeakPolarHBondContact O-CB 3.47Å; I88-L92 VanDerWaalsContact O-CG 3.3Å; I88-L92 WeakPolarHBondContact O-CG 3.48Å; I88-L92 PolarHBondContact O-N 2.96Å; L92-I95 PolarHBondContact O-N 3.45Å; L92-A96 WeakPolarHBondContact O-CB 3.48Å; L92-A96 PolarHBondContact O-N 3.41Å
93	R	89.5	Confident	87.6	Confident	87 Å²	87	64.6 Å²	64.6	33%	0.328	34%	0.336	S	S	.	.	H	α-helix	trans	-64.8	-43.9	175.8	-172.5	174.1	-56.1	-170.4	2.8	112.6	E48 F89 K90 T91 A96 N97	E48-R93 IonicContact OE1-CZ 3.76Å; E48-R93 IonicContact OE1-NH1 3.94Å; E48-R93 IonicContact OE1-NH2 2.72Å; E48-R93 PolarHBondContact OE1-NH2 3.3Å; E48-R93 IonicContact OE2-CZ 3.17Å; E48-R93 IonicContact OE2-NH1 2.8Å; E48-R93 PolarHBondContact OE2-NH1 3.48Å; E48-R93 IonicContact OE2-NH2 2.83Å; E48-R93 PolarHBondContact OE2-NH2 2.93Å; F89-R93 WeakPolarHBondContact O-CB 3.25Å; F89-R93 PolarHBondContact O-N 3.48Å; K90-R93 PolarHBondContact O-N 3.21Å; T91-R93 VanDerWaalsContact C-N 3.25Å; T91-R93 PolarHBondContact O-N 3.31Å; R93-A96 PolarHBondContact O-N 3.26Å; R93-N97 PolarHBondContact O-N 2.66Å
94	T	88.9	Confident	87.6	Confident	73 Å²	73	60 Å²	60	45%	0.448	32%	0.321	S	S	.	.	H	α-helix	trans	-60.6	-49.1	175.3	-60.3	0	0	0	0	110.8	K90 T91 A96 N97 D98	K90-T94 PolarHBondContact O-N 2.96Å; K90-T94 PolarHBondContact O-OG1 2.03Å; T91-T94 PolarHBondContact O-N 2.95Å; T94-A96 VanDerWaalsContact C-N 3.32Å; T94-A96 PolarHBondContact O-N 3.02Å; T94-N97 PolarHBondContact O-N 3.45Å; T94-D98 WeakPolarHBondContact O-CB 3.47Å; T94-D98 PolarHBondContact O-N 3.44Å
95	I	89.4	Confident	87.6	Confident	13 Å²	13	57.1 Å²	57.1	7%	0.067	31%	0.309	C	S	.	.	I	π-helix	trans	-62.6	-41	178.2	-63.5	167.5	0	0	0	111	I29 Y31 T91 L92 D99 C100 A107	I29-I95 HydrophobicContact CG2-CB 4.29Å; I29-I95 HydrophobicContact CG2-CG2 3.62Å; Y31-I95 HydrophobicContact CD2-CD1 3.82Å; Y31-I95 HydrophobicContact CE2-CD1 4.37Å; Y31-I95 HydrophobicContact CG-CD1 4.37Å; T91-I95 HydrophobicContact CG2-CD1 3.76Å; T91-I95 HydrophobicContact CG2-CG1 4.34Å; T91-I95 WeakPolarHBondContact O-CG1 3.35Å; T91-I95 PolarHBondContact O-N 3.34Å; L92-I95 PolarHBondContact O-N 3.45Å; I95-D99 HydrophobicContact CG2-CB 4.3Å; I95-D99 WeakPolarHBondContact O-CB 3.26Å; I95-D99 PolarHBondContact O-N 3.12Å; I95-D99 VanDerWaalsContact O-N 3.13Å; I95-C100 WeakPolarHBondContact CG2-SG 3.3Å; I95-C100 PolarHBondContact O-N 3.35Å; I95-A107 HydrophobicContact CD1-CB 4.5Å; I95-A107 HydrophobicContact CG2-CB 4.02Å
96	A	88.3	Confident	87.5	Confident	2 Å²	2	63.7 Å²	63.7	2%	0.017	35%	0.349	C	S	.	.	I	π-helix	trans	-62.4	-49.9	-179.9	0	0	0	0	0	112.5	I29 L38 M41 L92 R93 T94 E101	I29-A96 HydrophobicContact CD1-CB 3.59Å; L38-A96 HydrophobicContact CD1-CB 3.71Å; L38-A96 WeakPolarHBondContact CD1-O 3.46Å; M41-A96 HydrophobicContact CB-CB 3.83Å; M41-A96 HydrophobicContact CG-CB 4.07Å; L92-A96 WeakPolarHBondContact O-CB 3.48Å; L92-A96 PolarHBondContact O-N 3.41Å; R93-A96 PolarHBondContact O-N 3.26Å; T94-A96 VanDerWaalsContact C-N 3.32Å; T94-A96 PolarHBondContact O-N 3.02Å; A96-E101 WeakPolarHBondContact O-CG 3.03Å
97	N	83.8	Confident	87.5	Confident	88 Å²	88	61 Å²	61	47%	0.471	33%	0.331	S	S	.	.	I	π-helix	trans	-76.5	-41.6	-174.6	-84.2	12.4	0	0	0	113.1	R93 T94	R93-N97 PolarHBondContact O-N 2.66Å; T94-N97 PolarHBondContact O-N 3.45Å
98	D	78.5	Confident	87.5	Confident	101 Å²	101	59 Å²	59	54%	0.54	32%	0.316	S	S	.	.	I	π-helix	trans	-95.8	-40	-169	-61.2	-34.3	0	0	0	111.8	T94	T94-D98 WeakPolarHBondContact O-CB 3.47Å; T94-D98 PolarHBondContact O-N 3.44Å
99	D	83.8	Confident	87.3	Confident	43 Å²	43	61.2 Å²	61.2	23%	0.23	33%	0.33	C	S	.	.	I	π-helix	trans	-100.1	-46.1	-167.4	-67.2	-31.1	0	0	0	113.5	I95 C103 V104 N105	I95-D99 HydrophobicContact CG2-CB 4.3Å; I95-D99 WeakPolarHBondContact O-CB 3.26Å; I95-D99 PolarHBondContact O-N 3.12Å; I95-D99 VanDerWaalsContact O-N 3.13Å; D99-C103 WeakPolarHBondContact O-CA 3.48Å; D99-C103 PolarHBondContact O-N 3.37Å; D99-V104 HydrophobicContact CB-CG2 4.3Å; D99-V104 PolarHBondContact O-N 2.88Å; D99-N105 HydrophobicContact CB-CB 3.43Å; D99-N105 VanDerWaalsContact CB-CB 3.43Å; D99-N105 PolarHBondContact OD2-ND2 3.29Å
100	C	87.6	Confident	86.9	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.007	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-13.4	-171.2	-64.9	0	0	0	0	114.5	V27 I29 L38 I95 C108	V27-C100 HydrophobicContact CG1-CB 4.11Å; I29-C100 HydrophobicContact CG1-CB 4.42Å; L38-C100 HydrophobicContact CD1-CB 4.06Å; L38-C100 HydrophobicContact CD2-CB 4.24Å; I95-C100 WeakPolarHBondContact CG2-SG 3.3Å; I95-C100 PolarHBondContact O-N 3.35Å; C100-C108 WeakPolarHBondContact CA-SG 3.07Å; C100-C108 HydrophobicContact CB-CB 3.82Å; C100-C108 WeakPolarHBondContact CB-SG 3.49Å; C100-C108 PolarHBondContact N-SG 2.87Å; C100-C108 VanDerWaalsContact N-SG 3.44Å; C100-C108 WeakPolarHBondContact SG-CB 3.49Å; C100-C108 CovalentContact SG-SG 2.02Å; C100-C108 PolarHBondContact SG-SG 3.44Å
101	E	80.8	Confident	86.6	Confident	104 Å²	104	56.9 Å²	56.9	49%	0.486	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-35.6	166.4	-66.1	-146.2	133.1	0	0	112.1	K42 A96	K42-E101 WeakPolarHBondContact CE-OE1 3.5Å; K42-E101 IonicContact NZ-OE1 2.66Å; K42-E101 PolarHBondContact NZ-OE1 2.95Å; A96-E101 WeakPolarHBondContact O-CG 3.03Å
102	L	80.6	Confident	85.5	Confident	132 Å²	132	63.8 Å²	63.8	69%	0.691	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-0.2	-179.4	-59.8	179.4	0	0	0	113	V104	L102-V104 VanDerWaalsContact C-N 3.27Å; L102-V104 HydrophobicContact CB-CG1 3.85Å; L102-V104 HydrophobicContact CB-CG2 4.37Å; L102-V104 WeakPolarHBondContact O-CG1 3.26Å; L102-V104 PolarHBondContact O-N 3.35Å
103	C	85.3	Confident	85.1	Confident	61 Å²	61	67 Å²	67	41%	0.412	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	38.5	-177.7	-65.8	0	0	0	0	113.9	D99 C111	D99-C103 WeakPolarHBondContact O-CA 3.48Å; D99-C103 PolarHBondContact O-N 3.37Å; C103-C111 HydrophobicContact CB-CB 3.5Å; C103-C111 VanDerWaalsContact CB-CB 3.5Å; C103-C111 WeakPolarHBondContact CB-SG 3.41Å; C103-C111 WeakPolarHBondContact SG-CB 3.24Å; C103-C111 CovalentContact SG-SG 2.03Å; C103-C111 PolarHBondContact SG-SG 3.2Å
104	V	88.7	Confident	84.9	Confident	102 Å²	102	65.9 Å²	65.9	62%	0.618	38%	0.381	S	S	*	.			trans	-98.4	-2.3	-174.2	-63.6	0	0	0	0	114.5	D99 L102	D99-V104 HydrophobicContact CB-CG2 4.3Å; D99-V104 PolarHBondContact O-N 2.88Å; L102-V104 VanDerWaalsContact C-N 3.27Å; L102-V104 HydrophobicContact CB-CG1 3.85Å; L102-V104 HydrophobicContact CB-CG2 4.37Å; L102-V104 WeakPolarHBondContact O-CG1 3.26Å; L102-V104 PolarHBondContact O-N 3.35Å
105	N	88.1	Confident	84.7	Confident	50 Å²	50	65.5 Å²	65.5	27%	0.267	38%	0.377	S	S	.	.	S	Bend	trans	-123.3	143.7	-179.3	-170.9	-7.2	0	0	0	111.7	D99 A107 C108	D99-N105 HydrophobicContact CB-CB 3.43Å; D99-N105 VanDerWaalsContact CB-CB 3.43Å; D99-N105 PolarHBondContact OD2-ND2 3.29Å; N105-A107 PolarHBondContact O-N 3.37Å; N105-A107 PolarHBondContact OD1-N 2.96Å; N105-C108 VanDerWaalsContact O-CB 3.26Å; N105-C108 WeakPolarHBondContact O-CB 3.28Å; N105-C108 PolarHBondContact O-N 2.96Å; N105-C108 PolarHBondContact O-SG 3.35Å; N105-C108 VanDerWaalsContact O-SG 3.4Å
106	V	87.8	Confident	84.4	Confident	140 Å²	140	68.6 Å²	68.6	85%	0.848	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.1	177.8	-60	0	0	0	0	113.5	C108	V106-C108 PolarHBondContact O-N 3.38Å
107	A	89.1	Confident	84.2	Confident	12 Å²	12	72.8 Å²	72.8	10%	0.099	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-24.1	170.7	0	0	0	0	0	111.9	I29 Q30 I95 N105	I29-A107 CarbonylContact C-O 3.58Å; I29-A107 WeakPolarHBondContact CA-O 3.14Å; Q30-A107 PolarHBondContact N-O 3.26Å; I95-A107 HydrophobicContact CD1-CB 4.5Å; I95-A107 HydrophobicContact CG2-CB 4.02Å; N105-A107 PolarHBondContact O-N 3.37Å; N105-A107 PolarHBondContact OD1-N 2.96Å
108	C	90.9	Very high	84.2	Confident	15 Å²	15	71.7 Å²	71.7	10%	0.101	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	118.9	-178.5	-43.4	0	0	0	0	109.8	V27 Y28 C100 N105 V106	V27-C108 HydrophobicContact CG1-CB 4.21Å; Y28-C108 CarbonylContact O-C 3.57Å; Y28-C108 WeakPolarHBondContact O-CA 3.45Å; C100-C108 WeakPolarHBondContact CA-SG 3.07Å; C100-C108 HydrophobicContact CB-CB 3.82Å; C100-C108 WeakPolarHBondContact CB-SG 3.49Å; C100-C108 PolarHBondContact N-SG 2.87Å; C100-C108 VanDerWaalsContact N-SG 3.44Å; C100-C108 WeakPolarHBondContact SG-CB 3.49Å; C100-C108 CovalentContact SG-SG 2.02Å; C100-C108 PolarHBondContact SG-SG 3.44Å; N105-C108 VanDerWaalsContact O-CB 3.26Å; N105-C108 WeakPolarHBondContact O-CB 3.28Å; N105-C108 PolarHBondContact O-N 2.96Å; N105-C108 PolarHBondContact O-SG 3.35Å; N105-C108 VanDerWaalsContact O-SG 3.4Å; V106-C108 PolarHBondContact O-N 3.38Å
109	T	87.3	Confident	84.6	Confident	48 Å²	48	69.6 Å²	69.6	29%	0.294	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	149.1	-179.7	61.6	0	0	0	0	110	V27 Y28 Q30	V27-T109 CarbonylContact C-O 3.48Å; V27-T109 WeakPolarHBondContact CA-O 3.5Å; Y28-T109 WeakPolarHBondContact CB-OG1 3.31Å; Y28-T109 PolarHBondContact N-O 3.49Å; Y28-T109 PolarHBondContact O-N 2.98Å; Y28-T109 PolarHBondContact O-OG1 2.92Å; Q30-T109 HydrophobicContact CG-CG2 4.05Å
110	G	84.5	Confident	84.6	Confident	36 Å²	36	71.7 Å²	71.7	37%	0.371	42%	0.42	S	S	.	.	S	Bend	trans	85.6	18.8	-175.5	0	0	0	0	0	114.2	Q25	Q25-G110 WeakPolarHBondContact CB-O 3.27Å; Q25-G110 PolarHBondContact NE2-O 3.38Å
111	C	83.2	Confident	84.4	Confident	40 Å²	40	77.6 Å²	77.6	27%	0.27	46%	0.455	S	S	.	.			trans	-88.2	138.7	163.2	-61	0	0	0	0	109.7	C103	C103-C111 HydrophobicContact CB-CB 3.5Å; C103-C111 VanDerWaalsContact CB-CB 3.5Å; C103-C111 WeakPolarHBondContact CB-SG 3.41Å; C103-C111 WeakPolarHBondContact SG-CB 3.24Å; C103-C111 CovalentContact SG-SG 2.03Å; C103-C111 PolarHBondContact SG-SG 3.2Å
112	L	66.6	Low	84.7	Confident	191 Å²	191	75.2 Å²	75.2	100%	1	45%	0.452	S	S	*	.			trans	-86.5	0	173.3	-87.3	157.7	0	0	0	112.5	Q25	Q25-L112 HydrophobicContact CG-CD1 3.98Å; Q25-L112 VanDerWaalsContact OE1-CB 3.26Å; Q25-L112 VanDerWaalsContact OE1-CD1 3.29Å; Q25-L112 VanDerWaalsContact OE1-CG 3.29Å

Retrieved 112 of 112 residues in 56.1 ms (Link to these results)

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