X2JFW2_DROME Loading...

DUF4777 domain-containing protein

AlphaFold DB , UniProt , Accession X2JFW2, Species DROME (Drosophila melanogaster, Fruit fly), Gene Dmel\CG45492, Length 90 aa.

						>X2JFW2_DROME|X2JFW2|Dmel\CG45492
MSHKKANISHLVIQCIDAMGGFASKEVILKAVSTATDKKFWKMGRRIDDALDTLIVDGVIRTHNDNYYLNMLEETASASHCNSGSDSDSD
					

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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	36.7	Very low	63.3	Low	230 Å²	230	118.4 Å²	118.4	100%	1.133	61%	0.61	S	S	*	*				0	108.7	0	-60.4	178	-164.7	0	0	107	H3	M1-H3 PolarHBondContact O-N 3.23Å
2	S	42.8	Very low	65.4	Low	115 Å²	115	108.5 Å²	108.5	80%	0.804	56%	0.559	S	S	*	*			trans	-61.4	112.6	178.8	-60.7	0	0	0	0	107.8	K4	S2-K4 PolarHBondContact O-N 3.26Å
3	H	45.4	Very low	67.4	Low	188 Å²	188	103.5 Å²	103.5	87%	0.87	53%	0.533	S	S	*	.			trans	-64.3	71.9	161	-69.4	-93.1	0	0	0	106.5	M1 K5	M1-H3 PolarHBondContact O-N 3.23Å; H3-K5 VanDerWaalsContact C-N 3.31Å; H3-K5 PolarHBondContact O-N 3.01Å
4	K	47.5	Very low	68.9	Low	188 Å²	188	104.8 Å²	104.8	82%	0.817	54%	0.536	S	S	*	.			trans	-53.2	108.7	165.7	-102.6	179.4	174.2	174.7	0	102.6	S2 A6	S2-K4 PolarHBondContact O-N 3.26Å; K4-A6 VanDerWaalsContact C-N 3.31Å; K4-A6 PolarHBondContact O-N 3.06Å
5	K	48.6	Very low	70.2	Confident	204 Å²	204	98.7 Å²	98.7	89%	0.887	51%	0.506	S	S	*	.			trans	-38.3	105.3	170	-111.8	167.7	174.7	168.1	0	105.2	H3 N7	H3-K5 VanDerWaalsContact C-N 3.31Å; H3-K5 PolarHBondContact O-N 3.01Å; K5-N7 VanDerWaalsContact C-N 3.29Å; K5-N7 PolarHBondContact O-N 2.94Å
6	A	56.6	Low	71.5	Confident	84 Å²	84	92.6 Å²	92.6	69%	0.694	48%	0.475	S	S	*	.			trans	-59.6	106.3	178.8	0	0	0	0	0	104.1	K4 I8	K4-A6 VanDerWaalsContact C-N 3.31Å; K4-A6 PolarHBondContact O-N 3.06Å; A6-I8 PolarHBondContact O-N 3.31Å
7	N	76	Confident	72.6	Confident	97 Å²	97	92.2 Å²	92.2	52%	0.519	47%	0.474	S	S	.	.			trans	-62.9	141.3	-178.2	-164	-3.4	0	0	0	106.1	K5 S9 H10 L11	K5-N7 VanDerWaalsContact C-N 3.29Å; K5-N7 PolarHBondContact O-N 2.94Å; N7-S9 PolarHBondContact O-N 2.99Å; N7-S9 VanDerWaalsContact O-N 3.07Å; N7-H10 PolarHBondContact O-N 2.64Å; N7-L11 PolarHBondContact O-N 2.87Å
8	I	83.2	Confident	73.4	Confident	23 Å²	23	92 Å²	92	12%	0.118	49%	0.488	C	S	.	.	H	α-helix	trans	-58.1	-29.7	-174.2	-168.6	157.2	0	0	0	111.2	A6 L11 V12 V32 M43 R46 I47 A50	A6-I8 PolarHBondContact O-N 3.31Å; I8-L11 PolarHBondContact O-N 2.69Å; I8-V12 WeakPolarHBondContact O-CG2 3.13Å; I8-V12 PolarHBondContact O-N 3.37Å; I8-V32 HydrophobicContact CD1-CG1 4.5Å; I8-M43 HydrophobicContact CD1-CE 3.81Å; I8-M43 HydrophobicContact CD1-CG 4.18Å; I8-R46 HydrophobicContact CD1-CB 3.86Å; I8-I47 HydrophobicContact CD1-CG1 3.71Å; I8-I47 HydrophobicContact CG1-CG1 4.22Å; I8-A50 HydrophobicContact CG2-CB 3.77Å
9	S	85.7	Confident	74.2	Confident	19 Å²	19	90.3 Å²	90.3	13%	0.133	48%	0.478	C	S	.	.	H	α-helix	trans	-59.6	-44.2	173	-41.9	0	0	0	0	113.1	N7 L11 V12 I13	N7-S9 PolarHBondContact O-N 2.99Å; N7-S9 VanDerWaalsContact O-N 3.07Å; S9-L11 VanDerWaalsContact C-N 3.3Å; S9-L11 PolarHBondContact O-N 3.25Å; S9-V12 PolarHBondContact O-N 3.1Å; S9-I13 WeakPolarHBondContact O-CG1 3.22Å; S9-I13 PolarHBondContact O-N 2.83Å
10	H	86.7	Confident	74.9	Confident	124 Å²	124	88.8 Å²	88.8	57%	0.574	49%	0.485	S	S	*	.	H	α-helix	trans	-63.9	-38.8	175.8	-79.7	142.2	0	0	0	111.7	N7 I13 Q14	N7-H10 PolarHBondContact O-N 2.64Å; H10-I13 PolarHBondContact O-N 2.98Å; H10-Q14 WeakPolarHBondContact O-CG 3.3Å; H10-Q14 PolarHBondContact O-N 3.46Å
11	L	87.4	Confident	75.6	Confident	30 Å²	30	85 Å²	85	16%	0.157	47%	0.467	C	S	.	.	H	α-helix	trans	-67	-40.2	177.4	-174.9	66.4	0	0	0	111.5	N7 I8 S9 Q14 C15 V32 A35 T36	N7-L11 PolarHBondContact O-N 2.87Å; I8-L11 PolarHBondContact O-N 2.69Å; S9-L11 VanDerWaalsContact C-N 3.3Å; S9-L11 PolarHBondContact O-N 3.25Å; L11-Q14 PolarHBondContact O-N 3.09Å; L11-C15 WeakPolarHBondContact O-CB 3.44Å; L11-C15 PolarHBondContact O-N 3.4Å; L11-C15 PolarHBondContact O-SG 3.22Å; L11-V32 HydrophobicContact CD2-CB 4.45Å; L11-V32 HydrophobicContact CD2-CG1 3.83Å; L11-V32 HydrophobicContact CD2-CG2 4.43Å; L11-V32 HydrophobicContact CG-CG2 4.37Å; L11-A35 HydrophobicContact CD1-CB 4.01Å; L11-A35 HydrophobicContact CD2-CB 4.26Å; L11-T36 HydrophobicContact CD2-CG2 3.26Å
12	V	88.8	Confident	78.1	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	44%	0.435	C	S	.	.	H	α-helix	trans	-59.8	-46.7	174.5	167.9	0	0	0	0	110.8	I8 S9 Q14 C15 I16 I28 V32 I47 L51 L54	I8-V12 WeakPolarHBondContact O-CG2 3.13Å; I8-V12 PolarHBondContact O-N 3.37Å; S9-V12 PolarHBondContact O-N 3.1Å; V12-Q14 PolarHBondContact O-N 3.27Å; V12-C15 PolarHBondContact O-N 2.94Å; V12-I16 HydrophobicContact CG1-CD1 3.78Å; V12-I16 HydrophobicContact CG1-CG1 4.46Å; V12-I16 VanDerWaalsContact O-CG1 3.3Å; V12-I16 WeakPolarHBondContact O-CG1 3.43Å; V12-I16 PolarHBondContact O-N 2.93Å; V12-I28 HydrophobicContact CG1-CG2 4.03Å; V12-I28 HydrophobicContact CG2-CG2 4.19Å; V12-V32 HydrophobicContact CG2-CG2 4.01Å; V12-I47 HydrophobicContact CG2-CG2 4.25Å; V12-L51 HydrophobicContact CG1-CD2 3.61Å; V12-L51 HydrophobicContact CG1-CG 4.41Å; V12-L54 HydrophobicContact CB-CD1 4.26Å; V12-L54 HydrophobicContact CG1-CD1 3.91Å
13	I	90.6	Very high	80.4	Confident	44 Å²	44	74 Å²	74	23%	0.226	40%	0.399	C	S	.	.	H	α-helix	trans	-56.6	-51	175.4	-68.4	164.6	0	0	0	110.5	S9 H10 C15 I16 D17 L54 V59 L69	S9-I13 WeakPolarHBondContact O-CG1 3.22Å; S9-I13 PolarHBondContact O-N 2.83Å; H10-I13 PolarHBondContact O-N 2.98Å; I13-C15 VanDerWaalsContact C-N 3.29Å; I13-C15 PolarHBondContact O-N 3.34Å; I13-I16 PolarHBondContact O-N 2.71Å; I13-I16 VanDerWaalsContact O-N 3.16Å; I13-D17 WeakPolarHBondContact O-CB 3.41Å; I13-D17 PolarHBondContact O-N 3.34Å; I13-L54 HydrophobicContact CD1-CD1 4.49Å; I13-L54 HydrophobicContact CD1-CD2 3.71Å; I13-L54 HydrophobicContact CG1-CD1 3.98Å; I13-L54 HydrophobicContact CG1-CD2 4.05Å; I13-V59 HydrophobicContact CD1-CG1 3.91Å; I13-V59 HydrophobicContact CG1-CG1 4.17Å; I13-L69 HydrophobicContact CB-CD2 4.42Å; I13-L69 HydrophobicContact CG1-CD2 4.34Å; I13-L69 HydrophobicContact CG2-CD2 3.86Å
14	Q	88.9	Confident	82.7	Confident	121 Å²	121	66.6 Å²	66.6	57%	0.565	37%	0.369	S	S	*	.	H	α-helix	trans	-60.5	-37.7	179.3	-74.4	179.2	-30.6	0	0	112.7	H10 L11 V12 A18	H10-Q14 WeakPolarHBondContact O-CG 3.3Å; H10-Q14 PolarHBondContact O-N 3.46Å; L11-Q14 PolarHBondContact O-N 3.09Å; V12-Q14 PolarHBondContact O-N 3.27Å; Q14-A18 VanDerWaalsContact O-CB 3.23Å; Q14-A18 WeakPolarHBondContact O-CB 3.4Å; Q14-A18 PolarHBondContact O-N 2.9Å
15	C	88.6	Confident	84.7	Confident	14 Å²	14	61.2 Å²	61.2	10%	0.095	35%	0.346	C	S	.	.	H	α-helix	trans	-65.1	-46.3	174.8	-70.6	0	0	0	0	111.3	L11 V12 I13 D17 A18 M19 A31	L11-C15 WeakPolarHBondContact O-CB 3.44Å; L11-C15 PolarHBondContact O-N 3.4Å; L11-C15 PolarHBondContact O-SG 3.22Å; V12-C15 PolarHBondContact O-N 2.94Å; I13-C15 VanDerWaalsContact C-N 3.29Å; I13-C15 PolarHBondContact O-N 3.34Å; C15-D17 VanDerWaalsContact C-N 3.34Å; C15-A18 PolarHBondContact O-N 2.9Å; C15-M19 VanDerWaalsContact C-CE 3.45Å; C15-M19 HydrophobicContact CB-CE 4.13Å; C15-M19 WeakPolarHBondContact O-CE 3.24Å; C15-M19 VanDerWaalsContact O-CG 3.28Å; C15-M19 WeakPolarHBondContact O-CG 2.9Å; C15-M19 PolarHBondContact O-N 3.46Å; C15-A31 HydrophobicContact CB-CB 3.88Å
16	I	90.7	Very high	86.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-63.5	-42.5	178.9	-61.9	165.4	0	0	0	110.5	V12 I13 M19 G21 I28 I60 L69	V12-I16 HydrophobicContact CG1-CD1 3.78Å; V12-I16 HydrophobicContact CG1-CG1 4.46Å; V12-I16 VanDerWaalsContact O-CG1 3.3Å; V12-I16 WeakPolarHBondContact O-CG1 3.43Å; V12-I16 PolarHBondContact O-N 2.93Å; I13-I16 PolarHBondContact O-N 2.71Å; I13-I16 VanDerWaalsContact O-N 3.16Å; I16-M19 PolarHBondContact O-N 3.48Å; I16-G21 VanDerWaalsContact CG2-C 3.46Å; I16-G21 WeakPolarHBondContact O-CA 3.41Å; I16-G21 PolarHBondContact O-N 3.48Å; I16-I28 HydrophobicContact CD1-CD1 3.88Å; I16-I28 HydrophobicContact CG1-CD1 3.77Å; I16-I28 HydrophobicContact CG1-CG1 3.94Å; I16-I60 HydrophobicContact CD1-CG2 4.13Å; I16-L69 HydrophobicContact CB-CD1 4.13Å; I16-L69 HydrophobicContact CB-CG 4.12Å; I16-L69 HydrophobicContact CG2-CB 4.49Å; I16-L69 HydrophobicContact CG2-CD1 3.95Å; I16-L69 HydrophobicContact CG2-CG 3.69Å
17	D	89.9	Confident	88.2	Confident	86 Å²	86	57.8 Å²	57.8	46%	0.46	32%	0.322	S	S	.	.	H	α-helix	trans	-60.8	-49	177.2	-173.3	43.6	0	0	0	111.8	I13 C15 M19 G20 L69 M71	I13-D17 WeakPolarHBondContact O-CB 3.41Å; I13-D17 PolarHBondContact O-N 3.34Å; C15-D17 VanDerWaalsContact C-N 3.34Å; D17-M19 PolarHBondContact O-N 3.16Å; D17-G20 PolarHBondContact O-N 2.73Å; D17-L69 HydrophobicContact CB-CD1 3.66Å; D17-M71 WeakPolarHBondContact OD1-CE 3.3Å
18	A	88.1	Confident	88.8	Confident	89 Å²	89	53.2 Å²	53.2	74%	0.736	30%	0.298	S	S	*	.	H	α-helix	trans	-60.8	-17.8	177.1	0	0	0	0	0	114	Q14 C15	Q14-A18 VanDerWaalsContact O-CB 3.23Å; Q14-A18 WeakPolarHBondContact O-CB 3.4Å; Q14-A18 PolarHBondContact O-N 2.9Å; C15-A18 PolarHBondContact O-N 2.9Å
19	M	87.8	Confident	89	Confident	60 Å²	60	53.1 Å²	53.1	30%	0.296	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	7.7	177.2	-67	-176	-77.8	0	0	113.6	C15 I16 D17 A23 V27 I28 A31	C15-M19 VanDerWaalsContact C-CE 3.45Å; C15-M19 HydrophobicContact CB-CE 4.13Å; C15-M19 WeakPolarHBondContact O-CE 3.24Å; C15-M19 VanDerWaalsContact O-CG 3.28Å; C15-M19 WeakPolarHBondContact O-CG 2.9Å; C15-M19 PolarHBondContact O-N 3.46Å; I16-M19 PolarHBondContact O-N 3.48Å; D17-M19 PolarHBondContact O-N 3.16Å; M19-A23 HydrophobicContact CB-CB 4.49Å; M19-A23 HydrophobicContact CE-CB 3.2Å; M19-A23 HydrophobicContact SD-CB 3.76Å; M19-V27 HydrophobicContact CE-CG1 4.05Å; M19-V27 HydrophobicContact SD-CB 4.41Å; M19-V27 HydrophobicContact SD-CG1 3.16Å; M19-V27 WeakPolarHBondContact SD-CG1 3.29Å; M19-I28 HydrophobicContact CE-CG1 4.16Å; M19-A31 HydrophobicContact CE-CB 4.4Å
20	G	87.7	Confident	89.2	Confident	60 Å²	60	58.8 Å²	58.8	62%	0.619	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.8	23.6	-178.7	0	0	0	0	0	113.4	D17	D17-G20 PolarHBondContact O-N 2.73Å
21	G	90.1	Very high	89.2	Confident	10 Å²	10	54.2 Å²	54.2	10%	0.103	30%	0.304	C	S	.	.	S	Bend	trans	84.3	5.9	175.4	0	0	0	0	0	115	I16 Y68 L69	I16-G21 VanDerWaalsContact CG2-C 3.46Å; I16-G21 WeakPolarHBondContact O-CA 3.41Å; I16-G21 PolarHBondContact O-N 3.48Å; G21-Y68 CarbonylContact O-C 3.57Å; G21-Y68 WeakPolarHBondContact O-CA 3.35Å; G21-L69 PolarHBondContact O-N 2.83Å
22	F	90	Very high	89.1	Confident	107 Å²	107	52.8 Å²	52.8	47%	0.469	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	146.9	172.8	70.6	-81.7	0	0	0	112.8	Y67 Y68	F22-Y67 CarbonylContact C-O 3.49Å; F22-Y67 WeakPolarHBondContact CA-O 3.39Å; F22-Y68 HydrophobicContact CB-CD1 3.31Å; F22-Y68 HydrophobicContact CB-CE1 3.51Å; F22-Y68 HydrophobicContact CB-CG 3.96Å; F22-Y68 HydrophobicContact CD2-CE1 4.25Å; F22-Y68 HydrophobicContact CG-CD1 4.13Å; F22-Y68 AromaticContact CG-CE1 3.9Å; F22-Y68 HydrophobicContact CG-CE1 3.9Å
23	A	91.4	Very high	88.9	Confident	6 Å²	6	53.7 Å²	53.7	5%	0.05	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	153	174.9	0	0	0	0	0	112.9	M19 V27 I28 Y67	M19-A23 HydrophobicContact CB-CB 4.49Å; M19-A23 HydrophobicContact CE-CB 3.2Å; M19-A23 HydrophobicContact SD-CB 3.76Å; A23-V27 HydrophobicContact CB-CB 4.45Å; A23-V27 HydrophobicContact CB-CG1 4.37Å; A23-I28 HydrophobicContact CB-CD1 4.18Å; A23-I28 HydrophobicContact CB-CG1 3.7Å; A23-Y67 PolarHBondContact N-O 3.02Å; A23-Y67 PolarHBondContact O-N 3.47Å
24	S	91.9	Very high	88.6	Confident	33 Å²	33	56.8 Å²	56.8	23%	0.231	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	159.7	171.1	73.6	0	0	0	0	111.4	E26 V27 I28 N66	S24-E26 VanDerWaalsContact C-N 3.3Å; S24-E26 PolarHBondContact O-N 2.85Å; S24-V27 PolarHBondContact O-N 3.48Å; S24-V27 VanDerWaalsContact O-N 3.14Å; S24-V27 VanDerWaalsContact OG-CG2 3.24Å; S24-V27 WeakPolarHBondContact OG-CG2 3.39Å; S24-V27 PolarHBondContact OG-N 3.14Å; S24-I28 WeakPolarHBondContact O-CG1 3.42Å; S24-I28 PolarHBondContact O-N 3.46Å; S24-N66 WeakPolarHBondContact CA-OD1 3.37Å; S24-N66 VanDerWaalsContact CB-OD1 3.25Å; S24-N66 WeakPolarHBondContact CB-OD1 3.48Å; S24-N66 PolarHBondContact N-OD1 3.18Å
25	K	89.3	Confident	88.3	Confident	75 Å²	75	54.1 Å²	54.1	33%	0.326	32%	0.322	S	S	.	.	H	α-helix	trans	-50.8	-48.6	176.6	-173.9	170.9	167.9	162.7	0	112.4	V27 I28 L29 D48 Y67	K25-V27 VanDerWaalsContact C-N 3.3Å; K25-V27 PolarHBondContact O-N 3.39Å; K25-I28 PolarHBondContact O-N 2.79Å; K25-L29 HydrophobicContact CG-CD1 4.03Å; K25-L29 HydrophobicContact CG-CG 4.33Å; K25-L29 WeakPolarHBondContact O-CB 3.44Å; K25-L29 VanDerWaalsContact O-CG 3.24Å; K25-L29 WeakPolarHBondContact O-CG 3.46Å; K25-L29 PolarHBondContact O-N 3.29Å; K25-D48 WeakPolarHBondContact CE-OD1 3.4Å; K25-D48 IonicContact NZ-OD1 2.83Å; K25-D48 PolarHBondContact NZ-OD1 2.75Å; K25-D48 IonicContact NZ-OD2 2.64Å; K25-D48 PolarHBondContact NZ-OD2 3.45Å; K25-Y67 HydrophobicContact CB-CE2 3.91Å
26	E	88.9	Confident	87.9	Confident	153 Å²	153	55.3 Å²	55.3	72%	0.715	33%	0.329	S	S	*	.	H	α-helix	trans	-61	-40.8	-178.1	-67.5	-169.7	154.8	0	0	112.3	S24 L29 K30	S24-E26 VanDerWaalsContact C-N 3.3Å; S24-E26 PolarHBondContact O-N 2.85Å; E26-L29 PolarHBondContact O-N 2.68Å; E26-K30 WeakPolarHBondContact O-CB 3.49Å; E26-K30 PolarHBondContact O-N 3.02Å
27	V	89.8	Confident	87.2	Confident	63 Å²	63	62.8 Å²	62.8	38%	0.382	37%	0.369	S	S	.	.	H	α-helix	trans	-68.9	-42.2	179.6	179.1	0	0	0	0	110.3	M19 A23 S24 K25 K30 A31	M19-V27 HydrophobicContact CE-CG1 4.05Å; M19-V27 HydrophobicContact SD-CB 4.41Å; M19-V27 HydrophobicContact SD-CG1 3.16Å; M19-V27 WeakPolarHBondContact SD-CG1 3.29Å; A23-V27 HydrophobicContact CB-CB 4.45Å; A23-V27 HydrophobicContact CB-CG1 4.37Å; S24-V27 PolarHBondContact O-N 3.48Å; S24-V27 VanDerWaalsContact O-N 3.14Å; S24-V27 VanDerWaalsContact OG-CG2 3.24Å; S24-V27 WeakPolarHBondContact OG-CG2 3.39Å; S24-V27 PolarHBondContact OG-N 3.14Å; K25-V27 VanDerWaalsContact C-N 3.3Å; K25-V27 PolarHBondContact O-N 3.39Å; V27-K30 WeakPolarHBondContact O-CB 3.36Å; V27-K30 PolarHBondContact O-N 3.29Å; V27-A31 WeakPolarHBondContact O-CB 3.27Å; V27-A31 PolarHBondContact O-N 2.73Å
28	I	89.9	Confident	86.3	Confident	0 Å²	0	64 Å²	64	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-60.9	-47.7	174.6	-64.8	165.6	0	0	0	110.6	V12 I16 M19 A23 S24 K25 K30 A31 V32 I47 L51 Y67	V12-I28 HydrophobicContact CG1-CG2 4.03Å; V12-I28 HydrophobicContact CG2-CG2 4.19Å; I16-I28 HydrophobicContact CD1-CD1 3.88Å; I16-I28 HydrophobicContact CG1-CD1 3.77Å; I16-I28 HydrophobicContact CG1-CG1 3.94Å; M19-I28 HydrophobicContact CE-CG1 4.16Å; A23-I28 HydrophobicContact CB-CD1 4.18Å; A23-I28 HydrophobicContact CB-CG1 3.7Å; S24-I28 WeakPolarHBondContact O-CG1 3.42Å; S24-I28 PolarHBondContact O-N 3.46Å; K25-I28 PolarHBondContact O-N 2.79Å; I28-K30 PolarHBondContact O-N 3.27Å; I28-A31 PolarHBondContact O-N 3.31Å; I28-V32 HydrophobicContact CG2-CG2 4.16Å; I28-V32 WeakPolarHBondContact O-CB 3.23Å; I28-V32 VanDerWaalsContact O-CG2 3.29Å; I28-V32 WeakPolarHBondContact O-CG2 3.45Å; I28-V32 PolarHBondContact O-N 2.96Å; I28-I47 HydrophobicContact CG2-CG2 4.15Å; I28-L51 HydrophobicContact CD1-CD2 4.1Å; I28-Y67 HydrophobicContact CD1-CD2 3.51Å; I28-Y67 HydrophobicContact CD1-CE2 4.34Å; I28-Y67 HydrophobicContact CD1-CG 3.94Å
29	L	87.9	Confident	85.2	Confident	22 Å²	22	68.5 Å²	68.5	12%	0.115	37%	0.373	C	S	.	.	H	α-helix	trans	-57.4	-41.2	176.8	-69.7	171.1	0	0	0	111.1	K25 E26 S33 F40 I47	K25-L29 HydrophobicContact CG-CD1 4.03Å; K25-L29 HydrophobicContact CG-CG 4.33Å; K25-L29 WeakPolarHBondContact O-CB 3.44Å; K25-L29 VanDerWaalsContact O-CG 3.24Å; K25-L29 WeakPolarHBondContact O-CG 3.46Å; K25-L29 PolarHBondContact O-N 3.29Å; E26-L29 PolarHBondContact O-N 2.68Å; L29-S33 WeakPolarHBondContact O-CB 3.33Å; L29-S33 PolarHBondContact O-N 2.89Å; L29-F40 VanDerWaalsContact C-CZ 3.45Å; L29-F40 HydrophobicContact CB-CD1 3.87Å; L29-F40 HydrophobicContact CB-CE1 3.26Å; L29-F40 HydrophobicContact CB-CZ 3.96Å; L29-F40 HydrophobicContact CD1-CE1 4.28Å; L29-F40 HydrophobicContact CG-CE1 4.35Å; L29-I47 HydrophobicContact CD2-CB 3.79Å; L29-I47 HydrophobicContact CD2-CD1 3.44Å; L29-I47 VanDerWaalsContact CD2-CD1 3.44Å; L29-I47 HydrophobicContact CD2-CG1 4.19Å; L29-I47 HydrophobicContact CD2-CG2 3.81Å
30	K	88.4	Confident	84	Confident	137 Å²	137	70 Å²	70	60%	0.596	38%	0.378	S	S	*	.	H	α-helix	trans	-65.8	-47.1	177.8	-164.2	175.5	178.3	-179.2	0	112.4	E26 V27 I28 S33 T34 F40	E26-K30 WeakPolarHBondContact O-CB 3.49Å; E26-K30 PolarHBondContact O-N 3.02Å; V27-K30 WeakPolarHBondContact O-CB 3.36Å; V27-K30 PolarHBondContact O-N 3.29Å; I28-K30 PolarHBondContact O-N 3.27Å; K30-S33 PolarHBondContact O-N 2.86Å; K30-T34 WeakPolarHBondContact O-CB 3.36Å; K30-T34 PolarHBondContact O-N 2.81Å; K30-T34 PolarHBondContact O-OG1 3.47Å; K30-F40 HydrophobicContact CB-CE2 4.15Å; K30-F40 HydrophobicContact CB-CZ 3.65Å; K30-F40 HydrophobicContact CG-CE2 4.25Å; K30-F40 HydrophobicContact CG-CZ 4.14Å
31	A	87.9	Confident	82.8	Confident	29 Å²	29	79.3 Å²	79.3	24%	0.24	40%	0.395	C	S	.	.	H	α-helix	trans	-62	-48.7	178.4	0	0	0	0	0	110.8	C15 M19 V27 I28 S33 T34 A35	C15-A31 HydrophobicContact CB-CB 3.88Å; M19-A31 HydrophobicContact CE-CB 4.4Å; V27-A31 WeakPolarHBondContact O-CB 3.27Å; V27-A31 PolarHBondContact O-N 2.73Å; I28-A31 PolarHBondContact O-N 3.31Å; A31-S33 PolarHBondContact O-N 3.24Å; A31-T34 PolarHBondContact O-N 3.16Å; A31-A35 WeakPolarHBondContact O-CB 3.33Å; A31-A35 PolarHBondContact O-N 2.86Å
32	V	85.4	Confident	81.7	Confident	0 Å²	0	87.7 Å²	87.7	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-65.2	-41.3	179.1	173	0	0	0	0	111.7	I8 L11 V12 I28 T34 A35 T36 M43 I47	I8-V32 HydrophobicContact CD1-CG1 4.5Å; L11-V32 HydrophobicContact CD2-CB 4.45Å; L11-V32 HydrophobicContact CD2-CG1 3.83Å; L11-V32 HydrophobicContact CD2-CG2 4.43Å; L11-V32 HydrophobicContact CG-CG2 4.37Å; V12-V32 HydrophobicContact CG2-CG2 4.01Å; I28-V32 HydrophobicContact CG2-CG2 4.16Å; I28-V32 WeakPolarHBondContact O-CB 3.23Å; I28-V32 VanDerWaalsContact O-CG2 3.29Å; I28-V32 WeakPolarHBondContact O-CG2 3.45Å; I28-V32 PolarHBondContact O-N 2.96Å; V32-T34 VanDerWaalsContact C-N 3.31Å; V32-T34 PolarHBondContact O-N 3.24Å; V32-A35 PolarHBondContact O-N 3.21Å; V32-T36 HydrophobicContact CG1-CG2 4.27Å; V32-T36 WeakPolarHBondContact O-CB 3.16Å; V32-T36 WeakPolarHBondContact O-CG2 3.43Å; V32-T36 PolarHBondContact O-N 2.86Å; V32-T36 PolarHBondContact O-OG1 3.46Å; V32-M43 HydrophobicContact CG1-CE 4.22Å; V32-M43 HydrophobicContact CG1-CG 4.3Å; V32-I47 HydrophobicContact CB-CD1 3.79Å; V32-I47 HydrophobicContact CG1-CD1 3.55Å; V32-I47 HydrophobicContact CG1-CG1 4.13Å; V32-I47 HydrophobicContact CG2-CD1 4.34Å
33	S	84.4	Confident	80.9	Confident	18 Å²	18	83 Å²	83	13%	0.126	41%	0.408	C	S	.	.	H	α-helix	trans	-61.5	-41.9	176.4	-176.3	0	0	0	0	111.3	L29 K30 A31 D37 K38 F40	L29-S33 WeakPolarHBondContact O-CB 3.33Å; L29-S33 PolarHBondContact O-N 2.89Å; K30-S33 PolarHBondContact O-N 2.86Å; A31-S33 PolarHBondContact O-N 3.24Å; S33-D37 PolarHBondContact O-N 3.28Å; S33-D37 VanDerWaalsContact O-N 3.09Å; S33-K38 PolarHBondContact O-N 2.92Å; S33-K38 PolarHBondContact OG-O 3.18Å; S33-F40 VanDerWaalsContact OG-CD2 3.22Å; S33-F40 WeakPolarHBondContact OG-CD2 3.39Å
34	T	84.3	Confident	80.3	Confident	109 Å²	109	83.6 Å²	83.6	67%	0.669	42%	0.415	S	S	*	.	H	α-helix	trans	-66.1	-43.9	176.2	-52.8	0	0	0	0	111.4	K30 A31 V32 T36	K30-T34 WeakPolarHBondContact O-CB 3.36Å; K30-T34 PolarHBondContact O-N 2.81Å; K30-T34 PolarHBondContact O-OG1 3.47Å; A31-T34 PolarHBondContact O-N 3.16Å; V32-T34 VanDerWaalsContact C-N 3.31Å; V32-T34 PolarHBondContact O-N 3.24Å; T34-T36 PolarHBondContact O-N 3.5Å
35	A	82.3	Confident	79.9	Confident	65 Å²	65	91.8 Å²	91.8	54%	0.537	44%	0.441	S	S	.	.	H	α-helix	trans	-71.2	-28.7	-178.6	0	0	0	0	0	113.7	L11 A31 V32	L11-A35 HydrophobicContact CD1-CB 4.01Å; L11-A35 HydrophobicContact CD2-CB 4.26Å; A31-A35 WeakPolarHBondContact O-CB 3.33Å; A31-A35 PolarHBondContact O-N 2.86Å; V32-A35 PolarHBondContact O-N 3.21Å
36	T	79.3	Confident	79.7	Confident	40 Å²	40	94.7 Å²	94.7	25%	0.245	45%	0.45	C	S	.	.	H	α-helix	trans	-98	-5.3	-179.1	56.4	0	0	0	0	114.4	L11 V32 T34 K38 M43	L11-T36 HydrophobicContact CD2-CG2 3.26Å; V32-T36 HydrophobicContact CG1-CG2 4.27Å; V32-T36 WeakPolarHBondContact O-CB 3.16Å; V32-T36 WeakPolarHBondContact O-CG2 3.43Å; V32-T36 PolarHBondContact O-N 2.86Å; V32-T36 PolarHBondContact O-OG1 3.46Å; T34-T36 PolarHBondContact O-N 3.5Å; T36-K38 PolarHBondContact O-N 2.95Å; T36-K38 VanDerWaalsContact O-N 3.1Å; T36-M43 HydrophobicContact CG2-CE 3.62Å; T36-M43 VanDerWaalsContact OG1-CE 3.3Å; T36-M43 WeakPolarHBondContact OG1-CE 3.24Å
37	D	77.3	Confident	79.6	Confident	157 Å²	157	87.4 Å²	87.4	84%	0.84	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	32.6	-171.3	-162.7	29.2	0	0	0	112.7	S33	S33-D37 PolarHBondContact O-N 3.28Å; S33-D37 VanDerWaalsContact O-N 3.09Å
38	K	70.4	Confident	79.6	Confident	111 Å²	111	87 Å²	87	48%	0.483	41%	0.411	S	S	.	.			trans	-113.6	136.7	-179.4	-78.1	176.9	-176.4	174.5	0	110.2	S33 T36 F40 M43	S33-K38 PolarHBondContact O-N 2.92Å; S33-K38 PolarHBondContact OG-O 3.18Å; T36-K38 PolarHBondContact O-N 2.95Å; T36-K38 VanDerWaalsContact O-N 3.1Å; K38-F40 PolarHBondContact O-N 3.37Å; K38-M43 HydrophobicContact CB-CE 4.35Å; K38-M43 HydrophobicContact CB-SD 3.72Å; K38-M43 HydrophobicContact CD-CE 3.97Å; K38-M43 HydrophobicContact CD-SD 3.84Å; K38-M43 HydrophobicContact CG-SD 4.43Å
39	K	65.6	Low	79.6	Confident	184 Å²	184	91.6 Å²	91.6	80%	0.8	44%	0.436	S	S	*	.			trans	-56.6	127.3	176.6	-71.1	-174.1	177	-177.3	0	111.1	W41 K42	K39-W41 PolarHBondContact O-N 2.92Å; K39-K42 PolarHBondContact O-N 2.97Å
40	F	62.3	Low	79.6	Confident	90 Å²	90	90.7 Å²	90.7	40%	0.395	43%	0.431	S	S	.	.	H	α-helix	trans	-34.5	-47.2	174.6	-105.7	-99.7	0	0	0	114.9	L29 K30 S33 K38 K42 M43 G44	L29-F40 VanDerWaalsContact C-CZ 3.45Å; L29-F40 HydrophobicContact CB-CD1 3.87Å; L29-F40 HydrophobicContact CB-CE1 3.26Å; L29-F40 HydrophobicContact CB-CZ 3.96Å; L29-F40 HydrophobicContact CD1-CE1 4.28Å; L29-F40 HydrophobicContact CG-CE1 4.35Å; K30-F40 HydrophobicContact CB-CE2 4.15Å; K30-F40 HydrophobicContact CB-CZ 3.65Å; K30-F40 HydrophobicContact CG-CE2 4.25Å; K30-F40 HydrophobicContact CG-CZ 4.14Å; S33-F40 VanDerWaalsContact OG-CD2 3.22Å; S33-F40 WeakPolarHBondContact OG-CD2 3.39Å; K38-F40 PolarHBondContact O-N 3.37Å; F40-K42 VanDerWaalsContact C-N 3.3Å; F40-K42 PolarHBondContact O-N 3.28Å; F40-M43 PolarHBondContact O-N 3.22Å; F40-G44 PolarHBondContact O-N 2.96Å
41	W	61.8	Low	79.7	Confident	257 Å²	257	84.3 Å²	84.3	97%	0.973	40%	0.404	S	S	*	.	H	α-helix	trans	-63.8	-31.7	-167.6	-129.5	21.7	0	0	0	114.3	K39	K39-W41 PolarHBondContact O-N 2.92Å
42	K	67.8	Low	79.9	Confident	185 Å²	185	87.8 Å²	87.8	80%	0.804	42%	0.418	S	S	*	.	H	α-helix	trans	-87.2	-12.7	175.7	-68.6	-170.5	178.4	-176.2	0	112.9	K39 F40	K39-K42 PolarHBondContact O-N 2.97Å; F40-K42 VanDerWaalsContact C-N 3.3Å; F40-K42 PolarHBondContact O-N 3.28Å
43	M	73.2	Confident	80.1	Confident	10 Å²	10	91 Å²	91	5%	0.049	44%	0.438	C	S	.	.	H	α-helix	trans	-93.9	-30.3	-174.6	-134.3	81.6	172.4	0	0	112.1	I8 V32 T36 K38 F40 R45 R46 I47	I8-M43 HydrophobicContact CD1-CE 3.81Å; I8-M43 HydrophobicContact CD1-CG 4.18Å; V32-M43 HydrophobicContact CG1-CE 4.22Å; V32-M43 HydrophobicContact CG1-CG 4.3Å; T36-M43 HydrophobicContact CG2-CE 3.62Å; T36-M43 VanDerWaalsContact OG1-CE 3.3Å; T36-M43 WeakPolarHBondContact OG1-CE 3.24Å; K38-M43 HydrophobicContact CB-CE 4.35Å; K38-M43 HydrophobicContact CB-SD 3.72Å; K38-M43 HydrophobicContact CD-CE 3.97Å; K38-M43 HydrophobicContact CD-SD 3.84Å; K38-M43 HydrophobicContact CG-SD 4.43Å; F40-M43 PolarHBondContact O-N 3.22Å; M43-R45 PolarHBondContact O-N 3.07Å; M43-R46 PolarHBondContact O-N 3.2Å; M43-I47 HydrophobicContact CB-CD1 3.88Å; M43-I47 HydrophobicContact CG-CD1 3.65Å; M43-I47 HydrophobicContact CG-CG1 4.16Å; M43-I47 WeakPolarHBondContact O-CG1 3.16Å; M43-I47 PolarHBondContact O-N 2.88Å
44	G	78	Confident	80.4	Confident	18 Å²	18	90.4 Å²	90.4	19%	0.186	43%	0.433	C	S	.	.	H	α-helix	trans	-47.2	-54.1	-174.9	0	0	0	0	0	113.6	F40 R46 I47 D48	F40-G44 PolarHBondContact O-N 2.96Å; G44-R46 PolarHBondContact O-N 3.29Å; G44-I47 PolarHBondContact O-N 3.43Å; G44-D48 PolarHBondContact O-N 2.97Å
45	R	83.5	Confident	80.8	Confident	205 Å²	205	88.2 Å²	88.2	77%	0.774	42%	0.417	S	S	*	.	H	α-helix	trans	-61.7	-40.3	179.7	-159	178.7	-162.4	-177.7	5.4	113.3	M43 I47 D48 D49	M43-R45 PolarHBondContact O-N 3.07Å; R45-I47 VanDerWaalsContact C-N 3.3Å; R45-I47 PolarHBondContact O-N 2.88Å; R45-D48 PolarHBondContact O-N 2.83Å; R45-D49 PolarHBondContact O-N 3.34Å
46	R	85.1	Confident	81.2	Confident	136 Å²	136	90.6 Å²	90.6	51%	0.513	42%	0.424	S	S	.	.	H	α-helix	trans	-70.8	-30.4	-179.3	-57.5	-177.9	78.6	-174.2	6.1	112.1	I8 M43 G44 A50	I8-R46 HydrophobicContact CD1-CB 3.86Å; M43-R46 PolarHBondContact O-N 3.2Å; G44-R46 PolarHBondContact O-N 3.29Å; R46-A50 VanDerWaalsContact O-CB 3.3Å; R46-A50 WeakPolarHBondContact O-CB 3.25Å; R46-A50 PolarHBondContact O-N 3.27Å; R46-A50 VanDerWaalsContact O-N 3.16Å
47	I	87.3	Confident	81.6	Confident	0 Å²	0	93.8 Å²	93.8	0%	0	44%	0.44	C	S	.	.	H	α-helix	trans	-75.8	-40.1	176	-67.1	167.4	0	0	0	109.1	I8 V12 I28 L29 V32 M43 G44 R45 A50 L51	I8-I47 HydrophobicContact CD1-CG1 3.71Å; I8-I47 HydrophobicContact CG1-CG1 4.22Å; V12-I47 HydrophobicContact CG2-CG2 4.25Å; I28-I47 HydrophobicContact CG2-CG2 4.15Å; L29-I47 HydrophobicContact CD2-CB 3.79Å; L29-I47 HydrophobicContact CD2-CD1 3.44Å; L29-I47 VanDerWaalsContact CD2-CD1 3.44Å; L29-I47 HydrophobicContact CD2-CG1 4.19Å; L29-I47 HydrophobicContact CD2-CG2 3.81Å; V32-I47 HydrophobicContact CB-CD1 3.79Å; V32-I47 HydrophobicContact CG1-CD1 3.55Å; V32-I47 HydrophobicContact CG1-CG1 4.13Å; V32-I47 HydrophobicContact CG2-CD1 4.34Å; M43-I47 HydrophobicContact CB-CD1 3.88Å; M43-I47 HydrophobicContact CG-CD1 3.65Å; M43-I47 HydrophobicContact CG-CG1 4.16Å; M43-I47 WeakPolarHBondContact O-CG1 3.16Å; M43-I47 PolarHBondContact O-N 2.88Å; G44-I47 PolarHBondContact O-N 3.43Å; R45-I47 VanDerWaalsContact C-N 3.3Å; R45-I47 PolarHBondContact O-N 2.88Å; I47-A50 WeakPolarHBondContact O-CB 3.37Å; I47-A50 PolarHBondContact O-N 2.93Å; I47-A50 VanDerWaalsContact O-N 3.16Å; I47-L51 HydrophobicContact CG2-CD1 3.77Å; I47-L51 HydrophobicContact CG2-CG 4.19Å; I47-L51 WeakPolarHBondContact O-CB 3.48Å; I47-L51 VanDerWaalsContact O-CG 3.23Å; I47-L51 WeakPolarHBondContact O-CG 3.36Å; I47-L51 PolarHBondContact O-N 3.34Å
48	D	88.9	Confident	82.2	Confident	54 Å²	54	88 Å²	88	29%	0.289	42%	0.418	S	S	.	.	H	α-helix	trans	-59.5	-48.7	173.5	-72.3	-19.6	0	0	0	111.7	K25 G44 R45 A50 L51 D52	K25-D48 WeakPolarHBondContact CE-OD1 3.4Å; K25-D48 IonicContact NZ-OD1 2.83Å; K25-D48 PolarHBondContact NZ-OD1 2.75Å; K25-D48 IonicContact NZ-OD2 2.64Å; K25-D48 PolarHBondContact NZ-OD2 3.45Å; G44-D48 PolarHBondContact O-N 2.97Å; R45-D48 PolarHBondContact O-N 2.83Å; D48-A50 PolarHBondContact O-N 3.16Å; D48-L51 PolarHBondContact O-N 2.95Å; D48-D52 WeakPolarHBondContact O-CB 3.01Å; D48-D52 PolarHBondContact O-N 3.27Å
49	D	89.7	Confident	83.1	Confident	96 Å²	96	85.2 Å²	85.2	51%	0.513	41%	0.41	S	S	.	.	H	α-helix	trans	-59.3	-37.3	175.5	-61.8	-22	0	0	0	111.6	R45 T53	R45-D49 PolarHBondContact O-N 3.34Å; D49-T53 WeakPolarHBondContact O-CB 3.28Å; D49-T53 PolarHBondContact O-N 2.88Å; D49-T53 PolarHBondContact O-OG1 3.23Å
50	A	89	Confident	84.3	Confident	3 Å²	3	76.6 Å²	76.6	3%	0.025	37%	0.372	C	S	.	.	H	α-helix	trans	-71.3	-41.5	179	0	0	0	0	0	112.5	I8 R46 I47 D48 T53 L54	I8-A50 HydrophobicContact CG2-CB 3.77Å; R46-A50 VanDerWaalsContact O-CB 3.3Å; R46-A50 WeakPolarHBondContact O-CB 3.25Å; R46-A50 PolarHBondContact O-N 3.27Å; R46-A50 VanDerWaalsContact O-N 3.16Å; I47-A50 WeakPolarHBondContact O-CB 3.37Å; I47-A50 PolarHBondContact O-N 2.93Å; I47-A50 VanDerWaalsContact O-N 3.16Å; D48-A50 PolarHBondContact O-N 3.16Å; A50-T53 PolarHBondContact O-N 2.93Å; A50-L54 WeakPolarHBondContact O-CB 3.43Å; A50-L54 WeakPolarHBondContact O-CG 3.3Å; A50-L54 PolarHBondContact O-N 3.47Å
51	L	90.5	Very high	85.7	Confident	3 Å²	3	79.4 Å²	79.4	2%	0.016	38%	0.38	C	S	.	.	H	α-helix	trans	-64	-44.1	176.1	-71	166	0	0	0	110.4	V12 I28 I47 D48 T53 L54 I55 I60 Y67	V12-L51 HydrophobicContact CG1-CD2 3.61Å; V12-L51 HydrophobicContact CG1-CG 4.41Å; I28-L51 HydrophobicContact CD1-CD2 4.1Å; I47-L51 HydrophobicContact CG2-CD1 3.77Å; I47-L51 HydrophobicContact CG2-CG 4.19Å; I47-L51 WeakPolarHBondContact O-CB 3.48Å; I47-L51 VanDerWaalsContact O-CG 3.23Å; I47-L51 WeakPolarHBondContact O-CG 3.36Å; I47-L51 PolarHBondContact O-N 3.34Å; D48-L51 PolarHBondContact O-N 2.95Å; L51-T53 PolarHBondContact O-N 3.32Å; L51-L54 PolarHBondContact O-N 3.32Å; L51-I55 VanDerWaalsContact O-CG1 3.27Å; L51-I55 WeakPolarHBondContact O-CG1 3.35Å; L51-I55 PolarHBondContact O-N 3.02Å; L51-I60 HydrophobicContact CB-CD1 4.41Å; L51-I60 HydrophobicContact CD2-CD1 3.57Å; L51-Y67 HydrophobicContact CB-CD1 4.48Å; L51-Y67 HydrophobicContact CB-CE1 3.89Å; L51-Y67 HydrophobicContact CD1-CE1 4.02Å; L51-Y67 HydrophobicContact CD1-CE2 3.98Å; L51-Y67 HydrophobicContact CD2-CD1 3.72Å; L51-Y67 HydrophobicContact CD2-CD2 4.28Å; L51-Y67 HydrophobicContact CD2-CE1 3.86Å; L51-Y67 HydrophobicContact CD2-CE2 4.44Å; L51-Y67 HydrophobicContact CD2-CG 3.93Å; L51-Y67 HydrophobicContact CG-CD1 4.49Å; L51-Y67 HydrophobicContact CG-CE1 4.13Å
52	D	91.6	Very high	87.1	Confident	103 Å²	103	70.7 Å²	70.7	55%	0.551	36%	0.356	S	S	*	.	H	α-helix	trans	-61.1	-46.1	177.1	-166	42.3	0	0	0	111.2	D48 L54 I55 V56	D48-D52 WeakPolarHBondContact O-CB 3.01Å; D48-D52 PolarHBondContact O-N 3.27Å; D52-L54 VanDerWaalsContact C-N 3.33Å; D52-L54 PolarHBondContact O-N 3.41Å; D52-I55 PolarHBondContact O-N 3.4Å; D52-V56 WeakPolarHBondContact O-CG2 3.32Å; D52-V56 PolarHBondContact O-N 3.13Å
53	T	90.9	Very high	88.1	Confident	66 Å²	66	66.9 Å²	66.9	41%	0.405	34%	0.34	S	S	.	.	H	α-helix	trans	-57.5	-46	174.3	-55	0	0	0	0	111.5	D49 A50 L51 I55 V56 D57	D49-T53 WeakPolarHBondContact O-CB 3.28Å; D49-T53 PolarHBondContact O-N 2.88Å; D49-T53 PolarHBondContact O-OG1 3.23Å; A50-T53 PolarHBondContact O-N 2.93Å; L51-T53 PolarHBondContact O-N 3.32Å; T53-I55 VanDerWaalsContact C-N 3.3Å; T53-I55 PolarHBondContact O-N 3.02Å; T53-V56 PolarHBondContact O-N 3.01Å; T53-D57 WeakPolarHBondContact O-CB 3.46Å; T53-D57 VanDerWaalsContact O-CG 3.23Å; T53-D57 PolarHBondContact O-N 3.4Å
54	L	89.9	Confident	88.9	Confident	6 Å²	6	72.1 Å²	72.1	3%	0.031	37%	0.369	C	S	.	.	H	α-helix	trans	-68.3	-28.1	-179.3	-70.4	171.3	0	0	0	113.3	V12 I13 A50 L51 D52 G58 V59 I60	V12-L54 HydrophobicContact CB-CD1 4.26Å; V12-L54 HydrophobicContact CG1-CD1 3.91Å; I13-L54 HydrophobicContact CD1-CD1 4.49Å; I13-L54 HydrophobicContact CD1-CD2 3.71Å; I13-L54 HydrophobicContact CG1-CD1 3.98Å; I13-L54 HydrophobicContact CG1-CD2 4.05Å; A50-L54 WeakPolarHBondContact O-CB 3.43Å; A50-L54 WeakPolarHBondContact O-CG 3.3Å; A50-L54 PolarHBondContact O-N 3.47Å; L51-L54 PolarHBondContact O-N 3.32Å; D52-L54 VanDerWaalsContact C-N 3.33Å; D52-L54 PolarHBondContact O-N 3.41Å; L54-G58 PolarHBondContact O-N 2.98Å; L54-V59 HydrophobicContact CB-CB 4.44Å; L54-V59 HydrophobicContact CD2-CB 3.94Å; L54-V59 HydrophobicContact CD2-CG1 4.01Å; L54-V59 HydrophobicContact CD2-CG2 4.21Å; L54-V59 PolarHBondContact O-N 3.29Å; L54-I60 HydrophobicContact CB-CD1 3.62Å; L54-I60 HydrophobicContact CB-CG1 3.68Å; L54-I60 HydrophobicContact CB-CG2 4.35Å; L54-I60 HydrophobicContact CD1-CD1 4.18Å; L54-I60 PolarHBondContact O-N 3.37Å; L54-I60 VanDerWaalsContact O-N 3.13Å
55	I	91.9	Very high	89.3	Confident	64 Å²	64	78 Å²	78	33%	0.328	40%	0.396	S	S	.	.	H	α-helix	trans	-70.8	-47.5	172.5	-70.3	165.5	0	0	0	109.8	L51 D52 T53 D57 G58 I60 Y67	L51-I55 VanDerWaalsContact O-CG1 3.27Å; L51-I55 WeakPolarHBondContact O-CG1 3.35Å; L51-I55 PolarHBondContact O-N 3.02Å; D52-I55 PolarHBondContact O-N 3.4Å; T53-I55 VanDerWaalsContact C-N 3.3Å; T53-I55 PolarHBondContact O-N 3.02Å; I55-D57 VanDerWaalsContact C-N 3.28Å; I55-D57 PolarHBondContact O-N 2.93Å; I55-G58 PolarHBondContact O-N 3.34Å; I55-I60 HydrophobicContact CG1-CD1 4.16Å; I55-I60 HydrophobicContact CG1-CG1 3.7Å; I55-Y67 HydrophobicContact CD1-CD1 4.34Å; I55-Y67 HydrophobicContact CD1-CE1 3.94Å
56	V	90.6	Very high	89.7	Confident	114 Å²	114	70.3 Å²	70.3	69%	0.691	37%	0.37	S	S	*	.	H	α-helix	trans	-60.8	-40.1	178.1	172.2	0	0	0	0	111.1	D52 T53 G58	D52-V56 WeakPolarHBondContact O-CG2 3.32Å; D52-V56 PolarHBondContact O-N 3.13Å; T53-V56 PolarHBondContact O-N 3.01Å; V56-G58 PolarHBondContact O-N 2.9Å
57	D	88.2	Confident	90	Very high	108 Å²	108	65.4 Å²	65.4	58%	0.578	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-8.1	176.9	-68.5	-17.2	0	0	0	113.1	T53 I55 V59	T53-D57 WeakPolarHBondContact O-CB 3.46Å; T53-D57 VanDerWaalsContact O-CG 3.23Å; T53-D57 PolarHBondContact O-N 3.4Å; I55-D57 VanDerWaalsContact C-N 3.28Å; I55-D57 PolarHBondContact O-N 2.93Å; D57-V59 VanDerWaalsContact C-N 3.25Å; D57-V59 HydrophobicContact CB-CG2 3.94Å; D57-V59 PolarHBondContact O-N 2.87Å
58	G	89.4	Confident	90.3	Very high	36 Å²	36	68 Å²	68	37%	0.371	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	15	-179.1	0	0	0	0	0	114.6	L54 I55 V56 N70	L54-G58 PolarHBondContact O-N 2.98Å; I55-G58 PolarHBondContact O-N 3.34Å; V56-G58 PolarHBondContact O-N 2.9Å; G58-N70 WeakPolarHBondContact O-CB 3.35Å; G58-N70 PolarHBondContact O-ND2 3.29Å
59	V	90.3	Very high	90.4	Very high	51 Å²	51	66.5 Å²	66.5	31%	0.309	35%	0.354	S	S	.	.	S	Bend	trans	-78.1	-36.4	179	-179.5	0	0	0	0	111.2	I13 L54 D57 L69 N70	I13-V59 HydrophobicContact CD1-CG1 3.91Å; I13-V59 HydrophobicContact CG1-CG1 4.17Å; L54-V59 HydrophobicContact CB-CB 4.44Å; L54-V59 HydrophobicContact CD2-CB 3.94Å; L54-V59 HydrophobicContact CD2-CG1 4.01Å; L54-V59 HydrophobicContact CD2-CG2 4.21Å; L54-V59 PolarHBondContact O-N 3.29Å; D57-V59 VanDerWaalsContact C-N 3.25Å; D57-V59 HydrophobicContact CB-CG2 3.94Å; D57-V59 PolarHBondContact O-N 2.87Å; V59-L69 HydrophobicContact CG1-CD2 4.43Å; V59-N70 VanDerWaalsContact O-CB 3.29Å; V59-N70 WeakPolarHBondContact O-CB 2.95Å; V59-N70 PolarHBondContact O-N 2.94Å
60	I	91.2	Very high	90.3	Very high	4 Å²	4	65.5 Å²	65.5	2%	0.021	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	157.4	173.7	71.3	-175.3	0	0	0	110.5	I16 L51 L54 I55 Y67 Y68 L69	I16-I60 HydrophobicContact CD1-CG2 4.13Å; L51-I60 HydrophobicContact CB-CD1 4.41Å; L51-I60 HydrophobicContact CD2-CD1 3.57Å; L54-I60 HydrophobicContact CB-CD1 3.62Å; L54-I60 HydrophobicContact CB-CG1 3.68Å; L54-I60 HydrophobicContact CB-CG2 4.35Å; L54-I60 HydrophobicContact CD1-CD1 4.18Å; L54-I60 PolarHBondContact O-N 3.37Å; L54-I60 VanDerWaalsContact O-N 3.13Å; I55-I60 HydrophobicContact CG1-CD1 4.16Å; I55-I60 HydrophobicContact CG1-CG1 3.7Å; I60-Y67 HydrophobicContact CD1-CD1 3.68Å; I60-Y67 HydrophobicContact CD1-CE1 4.48Å; I60-Y67 HydrophobicContact CD1-CG 4.35Å; I60-Y67 HydrophobicContact CG1-CD1 4.42Å; I60-Y68 CarbonylContact C-O 3.5Å; I60-Y68 WeakPolarHBondContact CA-O 3.23Å; I60-Y68 WeakPolarHBondContact CB-O 3.29Å; I60-L69 HydrophobicContact CG2-CD2 3.84Å
61	R	91.9	Very high	89.2	Confident	148 Å²	148	70.7 Å²	70.7	56%	0.558	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.4	143.8	172.6	60.7	-175.2	178.4	-173.8	-2.4	110.3	Y67 Y68	R61-Y67 CarbonylContact O-C 3.59Å; R61-Y67 WeakPolarHBondContact O-CA 3.16Å; R61-Y68 PolarHBondContact N-O 2.86Å; R61-Y68 PolarHBondContact O-N 2.95Å
62	T	90.3	Very high	87.6	Confident	75 Å²	75	77.6 Å²	77.6	46%	0.46	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	131.7	172	-85.6	0	0	0	0	109.9	N66 Y67	T62-N66 CarbonylContact C-O 3.59Å; T62-N66 WeakPolarHBondContact CA-O 3.37Å; T62-Y67 WeakPolarHBondContact OG1-CD1 3.38Å; T62-Y67 VanDerWaalsContact OG1-CE1 3.28Å; T62-Y67 WeakPolarHBondContact OG1-CE1 3.28Å
63	H	89.1	Confident	85.6	Confident	104 Å²	104	81 Å²	81	48%	0.481	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	126.5	171.4	177.3	-96	0	0	0	109.8	D65 N66 Y68	H63-D65 PolarHBondContact O-N 3.02Å; H63-N66 PolarHBondContact N-O 2.86Å; H63-N66 WeakPolarHBondContact O-CB 3.17Å; H63-N66 PolarHBondContact O-N 2.85Å; H63-Y68 HydrophobicContact CB-CD2 4.11Å; H63-Y68 HydrophobicContact CB-CE2 3.7Å
64	N	88.8	Confident	83.6	Confident	121 Å²	121	86.9 Å²	86.9	65%	0.647	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	51.7	-177.8	-63.3	-15	0	0	0	113.5	N66	N64-N66 PolarHBondContact O-N 2.84Å; N64-N66 PolarHBondContact O-ND2 2.93Å
65	D	86.8	Confident	81.5	Confident	141 Å²	141	91.7 Å²	91.7	75%	0.754	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	13.6	-178.1	-59.9	-45.8	0	0	0	115.9	H63	H63-D65 PolarHBondContact O-N 3.02Å
66	N	91.3	Very high	79.3	Confident	44 Å²	44	93.3 Å²	93.3	24%	0.235	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	145.6	173.9	-62.3	-66.9	0	0	0	110.6	S24 T62 H63 N64 Y68	S24-N66 WeakPolarHBondContact CA-OD1 3.37Å; S24-N66 VanDerWaalsContact CB-OD1 3.25Å; S24-N66 WeakPolarHBondContact CB-OD1 3.48Å; S24-N66 PolarHBondContact N-OD1 3.18Å; T62-N66 CarbonylContact C-O 3.59Å; T62-N66 WeakPolarHBondContact CA-O 3.37Å; H63-N66 PolarHBondContact N-O 2.86Å; H63-N66 WeakPolarHBondContact O-CB 3.17Å; H63-N66 PolarHBondContact O-N 2.85Å; N64-N66 PolarHBondContact O-N 2.84Å; N64-N66 PolarHBondContact O-ND2 2.93Å; N66-Y68 HydrophobicContact CB-CD2 4.46Å; N66-Y68 HydrophobicContact CB-CE2 3.62Å
67	Y	93	Very high	77.4	Confident	32 Å²	32	93 Å²	93	13%	0.125	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	131.5	174.3	-58.1	-92.6	0	0	0	108.6	F22 A23 K25 I28 L51 I55 I60 R61 T62	F22-Y67 CarbonylContact C-O 3.49Å; F22-Y67 WeakPolarHBondContact CA-O 3.39Å; A23-Y67 PolarHBondContact N-O 3.02Å; A23-Y67 PolarHBondContact O-N 3.47Å; K25-Y67 HydrophobicContact CB-CE2 3.91Å; I28-Y67 HydrophobicContact CD1-CD2 3.51Å; I28-Y67 HydrophobicContact CD1-CE2 4.34Å; I28-Y67 HydrophobicContact CD1-CG 3.94Å; L51-Y67 HydrophobicContact CB-CD1 4.48Å; L51-Y67 HydrophobicContact CB-CE1 3.89Å; L51-Y67 HydrophobicContact CD1-CE1 4.02Å; L51-Y67 HydrophobicContact CD1-CE2 3.98Å; L51-Y67 HydrophobicContact CD2-CD1 3.72Å; L51-Y67 HydrophobicContact CD2-CD2 4.28Å; L51-Y67 HydrophobicContact CD2-CE1 3.86Å; L51-Y67 HydrophobicContact CD2-CE2 4.44Å; L51-Y67 HydrophobicContact CD2-CG 3.93Å; L51-Y67 HydrophobicContact CG-CD1 4.49Å; L51-Y67 HydrophobicContact CG-CE1 4.13Å; I55-Y67 HydrophobicContact CD1-CD1 4.34Å; I55-Y67 HydrophobicContact CD1-CE1 3.94Å; I60-Y67 HydrophobicContact CD1-CD1 3.68Å; I60-Y67 HydrophobicContact CD1-CE1 4.48Å; I60-Y67 HydrophobicContact CD1-CG 4.35Å; I60-Y67 HydrophobicContact CG1-CD1 4.42Å; R61-Y67 CarbonylContact O-C 3.59Å; R61-Y67 WeakPolarHBondContact O-CA 3.16Å; T62-Y67 WeakPolarHBondContact OG1-CD1 3.38Å; T62-Y67 VanDerWaalsContact OG1-CE1 3.28Å; T62-Y67 WeakPolarHBondContact OG1-CE1 3.28Å
68	Y	93.4	Very high	75.6	Confident	56 Å²	56	91.3 Å²	91.3	22%	0.22	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134.2	178	-59.2	-101.7	0	0	0	108.2	G21 F22 I60 R61 H63 N66 N70	G21-Y68 CarbonylContact O-C 3.57Å; G21-Y68 WeakPolarHBondContact O-CA 3.35Å; F22-Y68 HydrophobicContact CB-CD1 3.31Å; F22-Y68 HydrophobicContact CB-CE1 3.51Å; F22-Y68 HydrophobicContact CB-CG 3.96Å; F22-Y68 HydrophobicContact CD2-CE1 4.25Å; F22-Y68 HydrophobicContact CG-CD1 4.13Å; F22-Y68 AromaticContact CG-CE1 3.9Å; F22-Y68 HydrophobicContact CG-CE1 3.9Å; I60-Y68 CarbonylContact C-O 3.5Å; I60-Y68 WeakPolarHBondContact CA-O 3.23Å; I60-Y68 WeakPolarHBondContact CB-O 3.29Å; R61-Y68 PolarHBondContact N-O 2.86Å; R61-Y68 PolarHBondContact O-N 2.95Å; H63-Y68 HydrophobicContact CB-CD2 4.11Å; H63-Y68 HydrophobicContact CB-CE2 3.7Å; N66-Y68 HydrophobicContact CB-CD2 4.46Å; N66-Y68 HydrophobicContact CB-CE2 3.62Å; Y68-N70 PolarHBondContact O-N 2.92Å
69	L	91.1	Very high	73.8	Confident	21 Å²	21	93.9 Å²	93.9	11%	0.11	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	127.4	166.8	-79.6	166.7	0	0	0	108.4	I13 I16 D17 G21 V59 I60 M71	I13-L69 HydrophobicContact CB-CD2 4.42Å; I13-L69 HydrophobicContact CG1-CD2 4.34Å; I13-L69 HydrophobicContact CG2-CD2 3.86Å; I16-L69 HydrophobicContact CB-CD1 4.13Å; I16-L69 HydrophobicContact CB-CG 4.12Å; I16-L69 HydrophobicContact CG2-CB 4.49Å; I16-L69 HydrophobicContact CG2-CD1 3.95Å; I16-L69 HydrophobicContact CG2-CG 3.69Å; D17-L69 HydrophobicContact CB-CD1 3.66Å; G21-L69 PolarHBondContact O-N 2.83Å; V59-L69 HydrophobicContact CG1-CD2 4.43Å; I60-L69 HydrophobicContact CG2-CD2 3.84Å; L69-M71 HydrophobicContact CB-CE 4.37Å; L69-M71 HydrophobicContact CB-CG 4Å; L69-M71 HydrophobicContact CD1-CE 3.82Å; L69-M71 PolarHBondContact O-N 3.02Å
70	N	86.5	Confident	71.8	Confident	76 Å²	76	99.8 Å²	99.8	41%	0.406	54%	0.538	S	S	.	.			trans	-78.7	67.7	165.1	-161.2	36	0	0	0	106.2	G58 V59 Y68 L72	G58-N70 WeakPolarHBondContact O-CB 3.35Å; G58-N70 PolarHBondContact O-ND2 3.29Å; V59-N70 VanDerWaalsContact O-CB 3.29Å; V59-N70 WeakPolarHBondContact O-CB 2.95Å; V59-N70 PolarHBondContact O-N 2.94Å; Y68-N70 PolarHBondContact O-N 2.92Å; N70-L72 PolarHBondContact O-N 2.82Å
71	M	67.5	Low	70	Confident	111 Å²	111	104.1 Å²	104.1	55%	0.547	57%	0.567	S	S	.	*			trans	-63.1	95.9	163.9	-67	-176.8	-175.6	0	0	104.4	D17 L69 E73	D17-M71 WeakPolarHBondContact OD1-CE 3.3Å; L69-M71 HydrophobicContact CB-CE 4.37Å; L69-M71 HydrophobicContact CB-CG 4Å; L69-M71 HydrophobicContact CD1-CE 3.82Å; L69-M71 PolarHBondContact O-N 3.02Å; M71-E73 PolarHBondContact O-N 2.93Å
72	L	55.3	Low	68.2	Low	148 Å²	148	103.7 Å²	103.7	78%	0.775	58%	0.577	S	S	*	*			trans	-44.6	118.9	149.2	-119.2	111.2	0	0	0	103.2	N70 E74	N70-L72 PolarHBondContact O-N 2.82Å; L72-E74 PolarHBondContact O-N 2.68Å
73	E	49.8	Very low	66.7	Low	175 Å²	175	105 Å²	105	82%	0.818	59%	0.588	S	S	*	*			trans	-45.2	104.4	168.4	-68.7	178.8	118	0	0	104.8	M71 T75	M71-E73 PolarHBondContact O-N 2.93Å; E73-T75 PolarHBondContact O-N 2.87Å
74	E	49.6	Very low	65.2	Low	190 Å²	190	103.2 Å²	103.2	89%	0.888	60%	0.598	S	S	*	*			trans	-66.4	90.6	168.3	-166.8	175.1	116.9	0	0	100.3	L72 A76	L72-E74 PolarHBondContact O-N 2.68Å; E74-A76 PolarHBondContact O-N 2.67Å
75	T	45.2	Very low	63.9	Low	107 Å²	107	102.4 Å²	102.4	66%	0.656	60%	0.602	S	S	*	*			trans	-38	113.9	-170.6	39.3	0	0	0	0	104.7	E73 S77	E73-T75 PolarHBondContact O-N 2.87Å; T75-S77 PolarHBondContact O-N 3.37Å; T75-S77 PolarHBondContact O-OG 2.56Å
76	A	46.3	Very low	62.5	Low	97 Å²	97	103 Å²	103	80%	0.802	61%	0.606	S	S	*	*			trans	-52	83.8	174.4	0	0	0	0	0	106.4	E74 A78	E74-A76 PolarHBondContact O-N 2.67Å; A76-A78 PolarHBondContact O-N 2.88Å
77	S	49.5	Very low	61	Low	108 Å²	108	105.8 Å²	105.8	76%	0.755	63%	0.628	S	S	*	*			trans	-78.6	71.8	164.4	-65.9	0	0	0	0	101.9	T75 S79	T75-S77 PolarHBondContact O-N 3.37Å; T75-S77 PolarHBondContact O-OG 2.56Å; S77-S79 VanDerWaalsContact C-N 3.33Å; S77-S79 PolarHBondContact O-N 2.82Å
78	A	51.9	Low	59.6	Low	73 Å²	73	112 Å²	112	60%	0.603	66%	0.664	S	S	*	*			trans	-42.9	105.8	165.9	0	0	0	0	0	105.9	A76 H80	A76-A78 PolarHBondContact O-N 2.88Å; A78-H80 PolarHBondContact O-N 3.03Å
79	S	50.3	Low	58.4	Low	90 Å²	90	114.6 Å²	114.6	63%	0.629	69%	0.69	S	S	*	*			trans	26.9	80.3	131.3	58.6	0	0	0	0	113.2	S77 C81	S77-S79 VanDerWaalsContact C-N 3.33Å; S77-S79 PolarHBondContact O-N 2.82Å; S79-C81 PolarHBondContact O-N 2.93Å
80	H	49.8	Very low	57	Low	175 Å²	175	125 Å²	125	81%	0.81	75%	0.745	S	S	*	*			trans	-73.7	80.2	153.6	-123.2	-93.4	0	0	0	106.1	A78 N82	A78-H80 PolarHBondContact O-N 3.03Å; H80-N82 PolarHBondContact ND1-OD1 2.94Å; H80-N82 PolarHBondContact O-N 3.47Å
81	C	52.7	Low	55.6	Low	94 Å²	94	127.4 Å²	127.4	64%	0.635	76%	0.762	S	S	*	*			trans	-64.4	94.7	162.5	-52.4	0	0	0	0	105.2	S79 S83	S79-C81 PolarHBondContact O-N 2.93Å; C81-S83 PolarHBondContact O-N 2.85Å
82	N	53	Low	54.9	Low	140 Å²	140	128.3 Å²	128.3	75%	0.749	77%	0.774	S	S	*	*			trans	-66.2	88.4	163.9	-86.9	32.9	0	0	0	106.7	H80 G84	H80-N82 PolarHBondContact ND1-OD1 2.94Å; H80-N82 PolarHBondContact O-N 3.47Å; N82-G84 PolarHBondContact O-N 2.82Å
83	S	59.3	Low	54.9	Low	101 Å²	101	127.2 Å²	127.2	71%	0.706	77%	0.774	S	S	*	*			trans	-65	81.9	161.4	-57.3	0	0	0	0	106.9	C81 S85	C81-S83 PolarHBondContact O-N 2.85Å; S83-S85 PolarHBondContact O-N 2.99Å
84	G	58.4	Low	55.2	Low	67 Å²	67	124.4 Å²	124.4	69%	0.691	77%	0.771	S	S	*	*			trans	-61.8	102.7	166.8	0	0	0	0	0	107.1	N82 D86	N82-G84 PolarHBondContact O-N 2.82Å; G84-D86 PolarHBondContact O-N 3.26Å
85	S	61.1	Low	55.6	Low	104 Å²	104	120.3 Å²	120.3	73%	0.727	76%	0.764	S	S	*	*			trans	-65	114.4	175.3	-53.3	0	0	0	0	108.8	S83 S87	S83-S85 PolarHBondContact O-N 2.99Å; S85-S87 VanDerWaalsContact C-N 3.34Å; S85-S87 PolarHBondContact O-N 3.34Å
86	D	58.1	Low	56.3	Low	155 Å²	155	121.1 Å²	121.1	83%	0.829	77%	0.771	S	S	*	*			trans	-64.9	96.6	162	-65.6	-59	0	0	0	107.7	G84 D88	G84-D86 PolarHBondContact O-N 3.26Å; D86-D88 PolarHBondContact O-N 3.03Å
87	S	60.2	Low	57	Low	102 Å²	102	122.9 Å²	122.9	71%	0.713	77%	0.769	S	S	*	*			trans	-87.6	84.8	166.7	-65	0	0	0	0	108.1	S85 S89	S85-S87 VanDerWaalsContact C-N 3.34Å; S85-S87 PolarHBondContact O-N 3.34Å; S87-S89 PolarHBondContact O-N 3.15Å; S87-S89 VanDerWaalsContact O-N 3.15Å
88	D	63.5	Low	57.6	Low	163 Å²	163	124 Å²	124	87%	0.872	77%	0.77	S	S	*	*			trans	-66	100.1	156.7	-87.1	-47.5	0	0	0	107.4	D86	D86-D88 PolarHBondContact O-N 3.03Å
89	S	66.8	Low	58	Low	110 Å²	110	128.3 Å²	128.3	77%	0.769	78%	0.784	S	S	*	*			trans	-90.4	117.6	168.1	-66.7	0	0	0	0	108.4	S87	S87-S89 PolarHBondContact O-N 3.15Å; S87-S89 VanDerWaalsContact O-N 3.15Å
90	D	63	Low	58.7	Low	238 Å²	238	131.7 Å²	131.7	100%	1.273	80%	0.798	S	S	*	*			trans	-42.7	0	173	-160	-106.8	0	0	0	115

Retrieved 90 of 90 residues in 117.6 ms (Link to these results)

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