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Atypical chemokine receptor 1

Atypical chemokine receptor that controls chemokine levels and localization via high-affinity chemokine binding that is uncoupled from classic ligand-driven signal transduction cascades, resulting instead in chemokine sequestration, degradation, or transcytosis. Also known as interceptor (internalizing receptor) or chemokine-scavenging receptor or chemokine decoy receptor. Has a promiscuous chemokine-binding profile, interacting with inflammatory chemokines of both the CXC and the CC subfamilies but not with homeostatic chemokines. Acts as a receptor for chemokines including CCL2, CCL5, CCL7, CCL11, CCL13, CCL14, CCL17, CXCL5, CXCL6, IL8/CXCL8, CXCL11, GRO, RANTES, MCP-1 and TARC. May regulate chemokine bioavailability and, consequently, leukocyte recruitment through two distinct mechanisms: when expressed in endothelial cells, it sustains the abluminal to luminal transcytosis of tissue-derived chemokines and their subsequent presentation to circulating leukocytes; when expressed in erythrocytes, serves as blood reservoir of cognate chemokines but also as a chemokine sink, buffering potential surges in plasma chemokine levels.

AlphaFold DB , UniProt , Accession A0A059TA67, Species HUMAN (Homo sapiens, Human), Gene DARC, Length 97 aa.

						>A0A059TA67_HUMAN|A0A059TA67|DARC
MASSGYVLQAELSPSTENSSQLDFEDVWNSSYGVNDSFPDGDYGANLEAAAPCHSCNLLDDSALPFFILTSVLGILASSTVLFMLFRPLFRWQLCPG
					

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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	39	Very low	41.5	Very low	250 Å²	250	133.4 Å²	133.4	100%	1.232	78%	0.784	S	S	*	*				0	100.6	0	-148.4	149.3	166.5	0	0	106.2
2	A	33.9	Very low	42.7	Very low	98 Å²	98	136.3 Å²	136.3	81%	0.81	79%	0.792	S	S	*	*			trans	-68.4	166	176.2	0	0	0	0	0	109.5
3	S	34.8	Very low	42.2	Very low	108 Å²	108	132.3 Å²	132.3	76%	0.755	78%	0.776	S	S	*	*			cis	-164.9	148.5	8.6	-157	0	0	0	0	108.5
4	S	35.7	Very low	42.8	Very low	97 Å²	97	131 Å²	131	68%	0.678	77%	0.774	S	S	*	*				38.7	123.3	129.5	-160.6	0	0	0	0	120.4
5	G	49.7	Very low	42.2	Very low	70 Å²	70	130.4 Å²	130.4	72%	0.722	78%	0.779	S	S	*	*			trans	-62.6	168	168.4	0	0	0	0	0	114.8
6	Y	43.8	Very low	42.3	Very low	189 Å²	189	128.7 Å²	128.7	74%	0.741	77%	0.77	S	S	*	*			trans	-157.1	134.8	160.1	49.4	-87.1	0	0	0	109.5	L8	Y6-L8 HydrophobicContact CD2-CD1 4.14Å; Y6-L8 HydrophobicContact CD2-CD2 4.01Å; Y6-L8 HydrophobicContact CD2-CG 3.84Å; Y6-L8 HydrophobicContact CE2-CD1 3.84Å; Y6-L8 HydrophobicContact CE2-CD2 4.43Å; Y6-L8 HydrophobicContact CE2-CG 4.08Å
7	V	45.5	Very low	42.4	Very low	124 Å²	124	131.2 Å²	131.2	75%	0.752	77%	0.772	S	S	*	*			trans	-64.6	138.5	165.1	173.2	0	0	0	0	108.5
8	L	49.9	Very low	42.3	Very low	142 Å²	142	132.1 Å²	132.1	74%	0.743	77%	0.772	S	S	*	*			trans	-132.9	94.5	158.3	-60.1	176.3	0	0	0	105.2	Y6	Y6-L8 HydrophobicContact CD2-CD1 4.14Å; Y6-L8 HydrophobicContact CD2-CD2 4.01Å; Y6-L8 HydrophobicContact CD2-CG 3.84Å; Y6-L8 HydrophobicContact CE2-CD1 3.84Å; Y6-L8 HydrophobicContact CE2-CD2 4.43Å; Y6-L8 HydrophobicContact CE2-CG 4.08Å
9	Q	42.4	Very low	42.7	Very low	153 Å²	153	131.2 Å²	131.2	72%	0.715	77%	0.774	S	S	*	*				33.8	95.3	79.8	-86.5	-173.2	28.4	0	0	112.9
10	A	41.7	Very low	43.4	Very low	103 Å²	103	128.7 Å²	128.7	85%	0.851	76%	0.764	S	S	*	*			trans	-95.3	89.5	139.7	0	0	0	0	0	106
11	E	40	Very low	43.9	Very low	133 Å²	133	130.8 Å²	130.8	62%	0.621	77%	0.766	S	S	*	*			trans	-51.9	135.6	160.2	-97.5	-126.5	100.4	0	0	109.9	S13	E11-S13 PolarHBondContact O-N 3.35Å; E11-S13 PolarHBondContact OE2-OG 3.3Å
12	L	55.9	Low	44.9	Very low	168 Å²	168	125.3 Å²	125.3	88%	0.88	74%	0.741	S	S	*	*			trans	-72.1	103.7	149.7	-80.5	112.1	0	0	0	106.9
13	S	35.9	Very low	46.2	Very low	85 Å²	85	124.4 Å²	124.4	59%	0.594	72%	0.723	S	S	*	*			trans	-102.3	118.8	164.4	-51.8	0	0	0	0	109.1	E11 S15	E11-S13 PolarHBondContact O-N 3.35Å; E11-S13 PolarHBondContact OE2-OG 3.3Å; S13-S15 PolarHBondContact O-N 3.14Å
14	P	50.6	Low	47.5	Very low	114 Å²	114	126.8 Å²	126.8	74%	0.74	72%	0.72	S	S	*	*			trans	-80.3	112.5	173.7	31.9	-27.1	0	0	0	107.9	T16	P14-T16 PolarHBondContact O-N 3.43Å; P14-T16 VanDerWaalsContact O-N 3.14Å
15	S	34.8	Very low	48.7	Very low	122 Å²	122	128.2 Å²	128.2	85%	0.853	72%	0.716	S	S	*	*			trans	-79.1	97.2	165.5	57.7	0	0	0	0	108.1	S13	S13-S15 PolarHBondContact O-N 3.14Å
16	T	42.7	Very low	49.1	Very low	103 Å²	103	130.4 Å²	130.4	63%	0.632	71%	0.711	S	S	*	*			trans	-53.8	144.3	164	-47.9	0	0	0	0	110.1	P14	P14-T16 PolarHBondContact O-N 3.43Å; P14-T16 VanDerWaalsContact O-N 3.14Å
17	E	45.3	Very low	50.1	Low	172 Å²	172	125.9 Å²	125.9	80%	0.804	70%	0.702	S	S	*	*			trans	60.1	90.9	155.8	66.7	-145.1	114.4	0	0	120.6
18	N	40	Very low	50.8	Low	146 Å²	146	126.9 Å²	126.9	78%	0.781	69%	0.693	S	S	*	*				-154.9	114.7	115.4	-167	-41.1	0	0	0	109.5	S20	N18-S20 PolarHBondContact O-N 2.98Å; N18-S20 PolarHBondContact OD1-N 3.45Å
19	S	50.6	Low	51.1	Low	115 Å²	115	124.7 Å²	124.7	80%	0.804	68%	0.682	S	S	*	*			trans	-64.3	80.2	164.5	-70.3	0	0	0	0	109.8	Q21	S19-Q21 PolarHBondContact O-N 3.34Å
20	S	55	Low	51.8	Low	82 Å²	82	121.7 Å²	121.7	57%	0.573	68%	0.678	S	S	*	*			trans	-71.9	89.1	145.4	59.8	0	0	0	0	104.9	N18 L22	N18-S20 PolarHBondContact O-N 2.98Å; N18-S20 PolarHBondContact OD1-N 3.45Å; S20-L22 PolarHBondContact O-N 3.2Å
21	Q	55.2	Low	52.7	Low	173 Å²	173	121.3 Å²	121.3	81%	0.808	67%	0.669	S	S	*	*			trans	-56.6	92.7	164.4	-179.2	173.7	-1.7	0	0	105.4	S19 D23	S19-Q21 PolarHBondContact O-N 3.34Å; Q21-D23 VanDerWaalsContact C-N 3.35Å; Q21-D23 PolarHBondContact O-N 3.08Å
22	L	60.5	Low	53.3	Low	134 Å²	134	120.1 Å²	120.1	70%	0.702	66%	0.66	S	S	*	*			trans	-67.8	103	176.6	-65.5	176.1	0	0	0	105.1	S20 F24	S20-L22 PolarHBondContact O-N 3.2Å; L22-F24 PolarHBondContact O-N 3.19Å; L22-F24 VanDerWaalsContact O-N 3.13Å
23	D	60.8	Low	53	Low	79 Å²	79	114.6 Å²	114.6	42%	0.422	64%	0.643	S	S	.	*			trans	-67	113.8	177.2	-155	-80.4	0	0	0	107.2	Q21 E25 D26 V27	Q21-D23 VanDerWaalsContact C-N 3.35Å; Q21-D23 PolarHBondContact O-N 3.08Å; D23-E25 PolarHBondContact O-N 2.98Å; D23-E25 VanDerWaalsContact O-N 3.15Å; D23-E25 WeakPolarHBondContact OD1-CB 3.42Å; D23-E25 PolarHBondContact OD1-N 3.36Å; D23-D26 PolarHBondContact O-N 3.09Å; D23-V27 PolarHBondContact O-N 2.81Å
24	F	60.8	Low	53.6	Low	158 Å²	158	115 Å²	115	69%	0.693	64%	0.642	S	S	*	*	H	α-helix	trans	-60.5	-28.3	-171	-169.7	-96.1	0	0	0	111	L22 W28	L22-F24 PolarHBondContact O-N 3.19Å; L22-F24 VanDerWaalsContact O-N 3.13Å; F24-W28 WeakPolarHBondContact O-CB 3.45Å; F24-W28 PolarHBondContact O-N 3.32Å
25	E	60.8	Low	53.8	Low	128 Å²	128	116.5 Å²	116.5	60%	0.598	64%	0.643	S	S	*	*	H	α-helix	trans	-69.7	-33.7	178	-67.3	-83.9	95.5	0	0	112.4	D23 N29	D23-E25 PolarHBondContact O-N 2.98Å; D23-E25 VanDerWaalsContact O-N 3.15Å; D23-E25 WeakPolarHBondContact OD1-CB 3.42Å; D23-E25 PolarHBondContact OD1-N 3.36Å; E25-N29 WeakPolarHBondContact O-CB 3.32Å; E25-N29 PolarHBondContact O-N 2.82Å
26	D	60	Low	54.2	Low	116 Å²	116	116.3 Å²	116.3	62%	0.62	63%	0.633	S	S	*	*	H	α-helix	trans	-73.4	-39.4	179.2	-85.6	-38.7	0	0	0	112.2	D23 N29 S30	D23-D26 PolarHBondContact O-N 3.09Å; D26-N29 PolarHBondContact O-N 3.24Å; D26-S30 WeakPolarHBondContact O-CB 3.09Å; D26-S30 PolarHBondContact O-N 3.4Å
27	V	62.8	Low	54.7	Low	93 Å²	93	116.8 Å²	116.8	56%	0.564	64%	0.64	S	S	*	*	H	α-helix	trans	-68.1	-42.3	175.7	169.4	0	0	0	0	110.8	D23 S31	D23-V27 PolarHBondContact O-N 2.81Å; V27-S31 PolarHBondContact O-N 3.33Å
28	W	60.2	Low	54.6	Low	146 Å²	146	114.9 Å²	114.9	55%	0.553	63%	0.63	S	S	*	*	H	α-helix	trans	-57.6	-56.6	171.8	-167.2	-125.6	0	0	0	106	F24 S30 S31 Y32	F24-W28 WeakPolarHBondContact O-CB 3.45Å; F24-W28 PolarHBondContact O-N 3.32Å; W28-S30 VanDerWaalsContact C-N 3.31Å; W28-S30 PolarHBondContact O-N 3.24Å; W28-S31 WeakPolarHBondContact O-CA 3.37Å; W28-S31 VanDerWaalsContact O-CB 3.26Å; W28-S31 WeakPolarHBondContact O-CB 3.48Å; W28-S31 PolarHBondContact O-N 2.82Å; W28-Y32 WeakPolarHBondContact CA-OH 3.05Å; W28-Y32 HydrophobicContact CB-CE1 3.74Å; W28-Y32 WeakPolarHBondContact CB-OH 3.47Å; W28-Y32 AromaticContact CD1-CE1 3.49Å; W28-Y32 VanDerWaalsContact CD1-CE1 3.49Å; W28-Y32 AromaticContact CD1-CZ 3.32Å; W28-Y32 HydrophobicContact CD2-CD1 4.22Å; W28-Y32 AromaticContact CD2-CE1 3.23Å; W28-Y32 HydrophobicContact CD2-CE1 3.23Å; W28-Y32 AromaticContact CD2-CZ 3.93Å; W28-Y32 AromaticContact CE2-CE1 3.3Å; W28-Y32 AromaticContact CE2-CZ 3.89Å; W28-Y32 AromaticContact CE3-CE1 3.93Å; W28-Y32 HydrophobicContact CE3-CE1 3.93Å; W28-Y32 HydrophobicContact CG-CD1 4.45Å; W28-Y32 AromaticContact CG-CE1 3.17Å; W28-Y32 HydrophobicContact CG-CE1 3.17Å; W28-Y32 AromaticContact CG-CZ 3.39Å; W28-Y32 HydrophobicContact CZ2-CD1 4.49Å; W28-Y32 HydrophobicContact CZ2-CE1 4.01Å; W28-Y32 AromaticContact NE1-CE1 3.39Å; W28-Y32 AromaticContact NE1-CZ 3.45Å; W28-Y32 PolarHBondContact NE1-OH 2.93Å; W28-Y32 WeakPolarHBondContact O-CD1 3.44Å; W28-Y32 WeakPolarHBondContact O-CE1 3.37Å; W28-Y32 PolarHBondContact O-OH 3.41Å
29	N	57	Low	54.8	Low	96 Å²	96	112.2 Å²	112.2	51%	0.513	62%	0.621	S	S	.	*	H	α-helix	trans	-65.7	-30.2	-169.4	-161.9	46.8	0	0	0	114.6	E25 D26 S31 Y32 G33	E25-N29 WeakPolarHBondContact O-CB 3.32Å; E25-N29 PolarHBondContact O-N 2.82Å; D26-N29 PolarHBondContact O-N 3.24Å; N29-S31 VanDerWaalsContact C-N 3.3Å; N29-S31 PolarHBondContact O-N 2.94Å; N29-Y32 WeakPolarHBondContact CA-OH 3.23Å; N29-Y32 HydrophobicContact CB-CE2 4.12Å; N29-Y32 VanDerWaalsContact N-CZ 3.3Å; N29-Y32 PolarHBondContact N-OH 3.47Å; N29-Y32 WeakPolarHBondContact OD1-CE2 3.34Å; N29-G33 WeakPolarHBondContact O-CA 3.29Å; N29-G33 PolarHBondContact O-N 3.07Å
30	S	57.8	Low	54.7	Low	89 Å²	89	115.4 Å²	115.4	62%	0.622	63%	0.629	S	S	*	*	H	α-helix	trans	-69.9	-25.4	171.2	-172	0	0	0	0	113.5	D26 W28	D26-S30 WeakPolarHBondContact O-CB 3.09Å; D26-S30 PolarHBondContact O-N 3.4Å; W28-S30 VanDerWaalsContact C-N 3.31Å; W28-S30 PolarHBondContact O-N 3.24Å
31	S	59.3	Low	54.4	Low	96 Å²	96	113.6 Å²	113.6	67%	0.671	62%	0.622	S	S	*	*	H	α-helix	trans	-79.2	-24.5	-176.3	-173.8	0	0	0	0	113.6	V27 W28 N29	V27-S31 PolarHBondContact O-N 3.33Å; W28-S31 WeakPolarHBondContact O-CA 3.37Å; W28-S31 VanDerWaalsContact O-CB 3.26Å; W28-S31 WeakPolarHBondContact O-CB 3.48Å; W28-S31 PolarHBondContact O-N 2.82Å; N29-S31 VanDerWaalsContact C-N 3.3Å; N29-S31 PolarHBondContact O-N 2.94Å
32	Y	54.4	Low	54.1	Low	108 Å²	108	111.9 Å²	111.9	42%	0.424	62%	0.619	S	S	.	*	H	α-helix	trans	-125	-0.2	-179.1	42.1	-102.2	0	0	0	113.6	W28 N29 V34	W28-Y32 WeakPolarHBondContact CA-OH 3.05Å; W28-Y32 HydrophobicContact CB-CE1 3.74Å; W28-Y32 WeakPolarHBondContact CB-OH 3.47Å; W28-Y32 AromaticContact CD1-CE1 3.49Å; W28-Y32 VanDerWaalsContact CD1-CE1 3.49Å; W28-Y32 AromaticContact CD1-CZ 3.32Å; W28-Y32 HydrophobicContact CD2-CD1 4.22Å; W28-Y32 AromaticContact CD2-CE1 3.23Å; W28-Y32 HydrophobicContact CD2-CE1 3.23Å; W28-Y32 AromaticContact CD2-CZ 3.93Å; W28-Y32 AromaticContact CE2-CE1 3.3Å; W28-Y32 AromaticContact CE2-CZ 3.89Å; W28-Y32 AromaticContact CE3-CE1 3.93Å; W28-Y32 HydrophobicContact CE3-CE1 3.93Å; W28-Y32 HydrophobicContact CG-CD1 4.45Å; W28-Y32 AromaticContact CG-CE1 3.17Å; W28-Y32 HydrophobicContact CG-CE1 3.17Å; W28-Y32 AromaticContact CG-CZ 3.39Å; W28-Y32 HydrophobicContact CZ2-CD1 4.49Å; W28-Y32 HydrophobicContact CZ2-CE1 4.01Å; W28-Y32 AromaticContact NE1-CE1 3.39Å; W28-Y32 AromaticContact NE1-CZ 3.45Å; W28-Y32 PolarHBondContact NE1-OH 2.93Å; W28-Y32 WeakPolarHBondContact O-CD1 3.44Å; W28-Y32 WeakPolarHBondContact O-CE1 3.37Å; W28-Y32 PolarHBondContact O-OH 3.41Å; N29-Y32 WeakPolarHBondContact CA-OH 3.23Å; N29-Y32 HydrophobicContact CB-CE2 4.12Å; N29-Y32 VanDerWaalsContact N-CZ 3.3Å; N29-Y32 PolarHBondContact N-OH 3.47Å; N29-Y32 WeakPolarHBondContact OD1-CE2 3.34Å; Y32-V34 VanDerWaalsContact C-N 3.3Å
33	G	47.9	Very low	53.6	Low	52 Å²	52	110.9 Å²	110.9	54%	0.536	61%	0.607	S	S	.	*			trans	-81.4	0.5	173	0	0	0	0	0	115	N29 N35	N29-G33 WeakPolarHBondContact O-CA 3.29Å; N29-G33 PolarHBondContact O-N 3.07Å; G33-N35 PolarHBondContact O-N 3.44Å
34	V	48.5	Very low	53.2	Low	92 Å²	92	109.6 Å²	109.6	56%	0.558	61%	0.612	S	S	*	*			trans	-86.3	97.4	176.9	-165.2	0	0	0	0	109.1	Y32 D36	Y32-V34 VanDerWaalsContact C-N 3.3Å; V34-D36 WeakPolarHBondContact CG1-OD2 3.33Å; V34-D36 PolarHBondContact O-N 3.41Å
35	N	56.4	Low	52.7	Low	146 Å²	146	104.8 Å²	104.8	78%	0.781	60%	0.602	S	S	*	*			trans	-66	75.6	173.6	-176.6	34.4	0	0	0	110.7	G33 S37	G33-N35 PolarHBondContact O-N 3.44Å; N35-S37 PolarHBondContact O-N 2.84Å
36	D	41.9	Very low	52.2	Low	118 Å²	118	104.2 Å²	104.2	63%	0.631	60%	0.603	S	S	*	*			trans	-95.5	92.4	174.1	-68.3	-44.9	0	0	0	109.3	V34 F38	V34-D36 WeakPolarHBondContact CG1-OD2 3.33Å; V34-D36 PolarHBondContact O-N 3.41Å; D36-F38 PolarHBondContact O-N 2.88Å
37	S	53.5	Low	51.7	Low	113 Å²	113	104.3 Å²	104.3	79%	0.79	60%	0.602	S	S	*	*			trans	-55.6	94.3	155.8	-73	0	0	0	0	107.9	N35	N35-S37 PolarHBondContact O-N 2.84Å
38	F	43.1	Very low	51.1	Low	133 Å²	133	107.4 Å²	107.4	58%	0.583	61%	0.611	S	S	*	*			trans	-93.3	126.8	-178.3	-150.3	-73.8	0	0	0	111	D36 Y43	D36-F38 PolarHBondContact O-N 2.88Å; F38-Y43 AromaticContact CD1-CE2 3.43Å; F38-Y43 HydrophobicContact CD1-CE2 3.43Å; F38-Y43 VanDerWaalsContact CD1-CE2 3.43Å; F38-Y43 AromaticContact CD1-CZ 3.35Å; F38-Y43 WeakPolarHBondContact CD1-OH 3.29Å; F38-Y43 VanDerWaalsContact CD2-OH 3.3Å; F38-Y43 WeakPolarHBondContact CD2-OH 3.24Å; F38-Y43 HydrophobicContact CE1-CE1 4.25Å; F38-Y43 AromaticContact CE1-CE2 3.63Å; F38-Y43 HydrophobicContact CE1-CE2 3.63Å; F38-Y43 AromaticContact CE1-CZ 3.26Å; F38-Y43 WeakPolarHBondContact CE1-OH 3.26Å; F38-Y43 WeakPolarHBondContact CE2-OH 3.23Å; F38-Y43 HydrophobicContact CG-CE2 4.3Å; F38-Y43 AromaticContact CG-CZ 4Å; F38-Y43 WeakPolarHBondContact CG-OH 3.34Å; F38-Y43 AromaticContact CZ-CZ 3.85Å; F38-Y43 WeakPolarHBondContact CZ-OH 3.19Å
39	P	45	Very low	50.8	Low	90 Å²	90	104.8 Å²	104.8	58%	0.584	62%	0.62	S	S	*	*			trans	-64.6	142	-178.7	24.6	-34.9	0	0	0	113	G41	P39-G41 VanDerWaalsContact C-N 3.34Å; P39-G41 PolarHBondContact O-N 3.48Å
40	D	47.9	Very low	50.7	Low	182 Å²	182	103 Å²	103	97%	0.973	62%	0.619	S	S	*	*	S	Bend	trans	-55.8	91	170.5	-162.6	-114.8	0	0	0	109.6
41	G	48.7	Very low	50.6	Low	43 Å²	43	102.4 Å²	102.4	44%	0.443	62%	0.62	S	S	.	*			trans	-154.7	81.3	-166.9	0	0	0	0	0	111.5	P39 Y43	P39-G41 VanDerWaalsContact C-N 3.34Å; P39-G41 PolarHBondContact O-N 3.48Å; G41-Y43 PolarHBondContact O-N 3.48Å
42	D	49.4	Very low	50.2	Low	138 Å²	138	103.7 Å²	103.7	74%	0.738	63%	0.625	S	S	*	*			trans	44.4	57.5	158	-144.3	-14.4	0	0	0	116.5	G44	D42-G44 PolarHBondContact O-N 2.88Å
43	Y	49.8	Very low	50.4	Low	112 Å²	112	104.7 Å²	104.7	44%	0.439	65%	0.647	S	S	.	*			trans	-81.5	6.7	169.7	-72.3	-74.5	0	0	0	113.6	F38 G41 L47	F38-Y43 AromaticContact CD1-CE2 3.43Å; F38-Y43 HydrophobicContact CD1-CE2 3.43Å; F38-Y43 VanDerWaalsContact CD1-CE2 3.43Å; F38-Y43 AromaticContact CD1-CZ 3.35Å; F38-Y43 WeakPolarHBondContact CD1-OH 3.29Å; F38-Y43 VanDerWaalsContact CD2-OH 3.3Å; F38-Y43 WeakPolarHBondContact CD2-OH 3.24Å; F38-Y43 HydrophobicContact CE1-CE1 4.25Å; F38-Y43 AromaticContact CE1-CE2 3.63Å; F38-Y43 HydrophobicContact CE1-CE2 3.63Å; F38-Y43 AromaticContact CE1-CZ 3.26Å; F38-Y43 WeakPolarHBondContact CE1-OH 3.26Å; F38-Y43 WeakPolarHBondContact CE2-OH 3.23Å; F38-Y43 HydrophobicContact CG-CE2 4.3Å; F38-Y43 AromaticContact CG-CZ 4Å; F38-Y43 WeakPolarHBondContact CG-OH 3.34Å; F38-Y43 AromaticContact CZ-CZ 3.85Å; F38-Y43 WeakPolarHBondContact CZ-OH 3.19Å; G41-Y43 PolarHBondContact O-N 3.48Å; Y43-L47 WeakPolarHBondContact O-CD1 3.3Å; Y43-L47 WeakPolarHBondContact O-CG 3.43Å
44	G	51.1	Low	50.6	Low	53 Å²	53	109.7 Å²	109.7	55%	0.546	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.6	-42.4	-175.1	0	0	0	0	0	113.4	D42	D42-G44 PolarHBondContact O-N 2.88Å
45	A	52	Low	51.1	Low	56 Å²	56	111 Å²	111	46%	0.463	67%	0.669	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.8	-15.9	-170.3	0	0	0	0	0	114.6	E48	A45-E48 WeakPolarHBondContact O-CG 3.41Å
46	N	49.3	Very low	51.2	Low	116 Å²	116	108 Å²	108	62%	0.62	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	-13.6	-175.9	-51.3	-25.2	0	0	0	112.3
47	L	50.3	Low	51.9	Low	118 Å²	118	108 Å²	108	62%	0.618	66%	0.659	S	S	*	*	S	Bend	trans	-88.8	-11.9	179.1	-68	175.8	0	0	0	112.8	Y43 A49	Y43-L47 WeakPolarHBondContact O-CD1 3.3Å; Y43-L47 WeakPolarHBondContact O-CG 3.43Å; L47-A49 VanDerWaalsContact C-N 3.32Å
48	E	49.3	Very low	52.1	Low	159 Å²	159	110.8 Å²	110.8	74%	0.743	66%	0.664	S	S	*	*	S	Bend	trans	-76.9	-18.4	170.3	51.4	168.1	92.5	0	0	113.2	A45	A45-E48 WeakPolarHBondContact O-CG 3.41Å
49	A	54	Low	52.8	Low	90 Å²	90	106.9 Å²	106.9	74%	0.744	65%	0.649	S	S	*	*	S	Bend	trans	-95.4	-15	178.9	0	0	0	0	0	114.1	L47	L47-A49 VanDerWaalsContact C-N 3.32Å
50	A	55.5	Low	53.5	Low	59 Å²	59	107.5 Å²	107.5	49%	0.488	65%	0.647	S	S	.	*	S	Bend	trans	-86.1	115.4	162.9	0	0	0	0	0	107.1
51	A	55	Low	54.3	Low	77 Å²	77	104.9 Å²	104.9	64%	0.636	63%	0.633	S	S	*	*			trans	-41.7	129	-176.8	0	0	0	0	0	111.3	C53	A51-C53 PolarHBondContact O-N 3.46Å
52	P	52	Low	55.2	Low	122 Å²	122	107.1 Å²	107.1	79%	0.792	64%	0.642	S	S	*	*			trans	-45.6	109.6	179.8	-31.2	33.8	0	0	0	111.3	H54	P52-H54 PolarHBondContact O-N 2.9Å
53	C	58.5	Low	56.2	Low	129 Å²	129	102.6 Å²	102.6	87%	0.872	62%	0.623	S	S	*	*			trans	-75.4	67.2	171.6	-63.2	0	0	0	0	108.6	A51 S55	A51-C53 PolarHBondContact O-N 3.46Å; C53-S55 VanDerWaalsContact C-N 3.29Å; C53-S55 PolarHBondContact O-N 2.89Å; C53-S55 VanDerWaalsContact O-N 3.12Å
54	H	51.4	Low	57.6	Low	158 Å²	158	100.3 Å²	100.3	73%	0.731	62%	0.619	S	S	*	*			trans	-75.5	95.9	158.1	-158.2	33.8	0	0	0	105.7	P52 C56	P52-H54 PolarHBondContact O-N 2.9Å; H54-C56 PolarHBondContact CD2-SG 2.99Å; H54-C56 PolarHBondContact O-N 3.45Å
55	S	59.2	Low	59.1	Low	120 Å²	120	101.1 Å²	101.1	84%	0.839	61%	0.614	S	S	*	*			trans	-64.8	75.9	170.8	-174.9	0	0	0	0	108.6	C53 N57	C53-S55 VanDerWaalsContact C-N 3.29Å; C53-S55 PolarHBondContact O-N 2.89Å; C53-S55 VanDerWaalsContact O-N 3.12Å; S55-N57 PolarHBondContact O-N 3.45Å
56	C	57.5	Low	60.7	Low	83 Å²	83	105.4 Å²	105.4	56%	0.561	62%	0.623	S	S	*	*			trans	-68	127.6	164.6	-67.8	0	0	0	0	107	H54 L58	H54-C56 PolarHBondContact CD2-SG 2.99Å; H54-C56 PolarHBondContact O-N 3.45Å; C56-L58 PolarHBondContact O-N 2.84Å
57	N	58.2	Low	62.5	Low	118 Å²	118	105.4 Å²	105.4	63%	0.631	62%	0.617	S	S	*	*			trans	-55.1	107	169.3	-160.8	4.3	0	0	0	107.1	S55 L59 D60	S55-N57 PolarHBondContact O-N 3.45Å; N57-L59 PolarHBondContact ND2-O 2.79Å; N57-L59 CarbonylContact O-C 3.3Å; N57-L59 VanDerWaalsContact O-C 3.3Å; N57-L59 PolarHBondContact O-N 2.99Å; N57-D60 PolarHBondContact O-N 3Å
58	L	57.4	Low	64.4	Low	170 Å²	170	104.5 Å²	104.5	89%	0.89	61%	0.612	S	S	*	*	S	Bend	trans	-69.4	-5.3	-173.8	-146.7	141.9	0	0	0	111.6	C56	C56-L58 PolarHBondContact O-N 2.84Å
59	L	57.9	Low	66.5	Low	52 Å²	52	102 Å²	102	27%	0.272	60%	0.604	S	S	.	*	S	Bend	trans	-105.6	93.4	155.5	-91.7	66	0	0	0	107.8	N57 L64 F67	N57-L59 PolarHBondContact ND2-O 2.79Å; N57-L59 CarbonylContact O-C 3.3Å; N57-L59 VanDerWaalsContact O-C 3.3Å; N57-L59 PolarHBondContact O-N 2.99Å; L59-L64 HydrophobicContact CB-CD2 4.17Å; L59-L64 HydrophobicContact CB-CG 4.14Å; L59-L64 HydrophobicContact CD2-CD2 3.55Å; L59-L64 HydrophobicContact CD2-CG 4.17Å; L59-L64 HydrophobicContact CG-CD2 4.47Å; L59-F67 HydrophobicContact CD2-CB 3.96Å; L59-F67 HydrophobicContact CD2-CD1 3.94Å; L59-F67 HydrophobicContact CD2-CG 3.91Å
60	D	60.1	Low	68.3	Low	102 Å²	102	100.4 Å²	100.4	55%	0.545	59%	0.585	S	S	.	*			trans	-51.1	147.3	161.6	-173.1	62.7	0	0	0	108.9	N57 S62 A63 L64	N57-D60 PolarHBondContact O-N 3Å; D60-S62 PolarHBondContact O-N 3.02Å; D60-S62 VanDerWaalsContact OD2-CB 3.29Å; D60-S62 WeakPolarHBondContact OD2-CB 3.36Å; D60-S62 PolarHBondContact OD2-OG 2.77Å; D60-A63 PolarHBondContact O-N 2.81Å; D60-L64 PolarHBondContact O-N 3.21Å
61	D	63.2	Low	70.1	Confident	128 Å²	128	100.2 Å²	100.2	68%	0.684	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	-25.9	-175.4	-74.5	-48.5	0	0	0	112.7	P65	D61-P65 WeakPolarHBondContact O-CD 3.4Å
62	S	67.3	Low	72.1	Confident	90 Å²	90	100.8 Å²	100.8	63%	0.629	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-30.2	175.3	-43.2	0	0	0	0	114.2	D60 P65	D60-S62 PolarHBondContact O-N 3.02Å; D60-S62 VanDerWaalsContact OD2-CB 3.29Å; D60-S62 WeakPolarHBondContact OD2-CB 3.36Å; D60-S62 PolarHBondContact OD2-OG 2.77Å; S62-P65 WeakPolarHBondContact O-CD 3.37Å; S62-P65 WeakPolarHBondContact O-CG 3.42Å
63	A	72.1	Confident	74.2	Confident	42 Å²	42	100.2 Å²	100.2	35%	0.347	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93	-22.9	-174.8	0	0	0	0	0	113.5	D60 F66 F67	D60-A63 PolarHBondContact O-N 2.81Å; A63-F66 PolarHBondContact O-N 2.96Å; A63-F67 PolarHBondContact O-N 3.34Å
64	L	77.8	Confident	76	Confident	65 Å²	65	96 Å²	96	34%	0.34	54%	0.543	S	S	.	.	H	α-helix	trans	-48.2	-51.8	172.6	-81.8	167.2	0	0	0	114.2	L59 D60 F66 F67 I68	L59-L64 HydrophobicContact CB-CD2 4.17Å; L59-L64 HydrophobicContact CB-CG 4.14Å; L59-L64 HydrophobicContact CD2-CD2 3.55Å; L59-L64 HydrophobicContact CD2-CG 4.17Å; L59-L64 HydrophobicContact CG-CD2 4.47Å; D60-L64 PolarHBondContact O-N 3.21Å; L64-F66 VanDerWaalsContact C-N 3.33Å; L64-F66 PolarHBondContact O-N 3.46Å; L64-F67 PolarHBondContact O-N 3.46Å; L64-I68 WeakPolarHBondContact O-CG1 3.31Å; L64-I68 PolarHBondContact O-N 3.35Å
65	P	82.5	Confident	78.2	Confident	70 Å²	70	93.8 Å²	93.8	46%	0.455	54%	0.535	S	S	.	.	H	α-helix	trans	-64.8	-37.8	-177.9	24	-34.1	0	0	0	112.2	D61 S62 I68 L69	D61-P65 WeakPolarHBondContact O-CD 3.4Å; S62-P65 WeakPolarHBondContact O-CD 3.37Å; S62-P65 WeakPolarHBondContact O-CG 3.42Å; P65-I68 PolarHBondContact O-N 2.89Å; P65-L69 VanDerWaalsContact O-CG 3.28Å; P65-L69 WeakPolarHBondContact O-CG 3.46Å; P65-L69 PolarHBondContact O-N 2.83Å
66	F	87.1	Confident	80	Confident	145 Å²	145	93.1 Å²	93.1	64%	0.636	52%	0.522	S	S	*	.	H	α-helix	trans	-68	-38.9	177.9	-177.1	-97.4	0	0	0	112	A63 L64 L69 T70	A63-F66 PolarHBondContact O-N 2.96Å; L64-F66 VanDerWaalsContact C-N 3.33Å; L64-F66 PolarHBondContact O-N 3.46Å; F66-L69 PolarHBondContact O-N 3.4Å; F66-T70 HydrophobicContact CD1-CG2 4.05Å; F66-T70 HydrophobicContact CD2-CG2 4.49Å; F66-T70 HydrophobicContact CE1-CG2 3.59Å; F66-T70 HydrophobicContact CE2-CG2 4.07Å; F66-T70 HydrophobicContact CG-CG2 4.49Å; F66-T70 HydrophobicContact CZ-CG2 3.6Å; F66-T70 WeakPolarHBondContact O-CB 3.2Å; F66-T70 WeakPolarHBondContact O-CG2 3.3Å; F66-T70 PolarHBondContact O-N 2.91Å; F66-T70 PolarHBondContact O-OG1 2.97Å
67	F	85.6	Confident	81.8	Confident	116 Å²	116	91.7 Å²	91.7	51%	0.509	52%	0.516	S	S	.	.	H	α-helix	trans	-62.2	-43.2	174.7	179.1	-100.7	0	0	0	112.1	L59 A63 L64 T70 S71	L59-F67 HydrophobicContact CD2-CB 3.96Å; L59-F67 HydrophobicContact CD2-CD1 3.94Å; L59-F67 HydrophobicContact CD2-CG 3.91Å; A63-F67 PolarHBondContact O-N 3.34Å; L64-F67 PolarHBondContact O-N 3.46Å; F67-T70 WeakPolarHBondContact CA-OG1 3.28Å; F67-T70 PolarHBondContact O-N 2.9Å; F67-T70 PolarHBondContact O-OG1 3.13Å; F67-S71 WeakPolarHBondContact O-CB 3.2Å; F67-S71 PolarHBondContact O-N 3.04Å
68	I	90.3	Very high	83.6	Confident	99 Å²	99	89.4 Å²	89.4	51%	0.508	51%	0.509	S	S	.	.	H	α-helix	trans	-63.2	-46.8	176.6	-65.3	165.3	0	0	0	110.4	L64 P65 T70 S71 V72	L64-I68 WeakPolarHBondContact O-CG1 3.31Å; L64-I68 PolarHBondContact O-N 3.35Å; P65-I68 PolarHBondContact O-N 2.89Å; I68-T70 PolarHBondContact O-N 2.92Å; I68-S71 PolarHBondContact O-N 3.42Å; I68-V72 HydrophobicContact CG2-CG2 4.39Å; I68-V72 VanDerWaalsContact O-CG2 3.3Å; I68-V72 WeakPolarHBondContact O-CG2 3.43Å; I68-V72 PolarHBondContact O-N 3.48Å
69	L	93.2	Very high	85.4	Confident	108 Å²	108	84.1 Å²	84.1	57%	0.565	49%	0.487	S	S	*	.	H	α-helix	trans	-60.5	-47	179.2	-71.9	172.9	0	0	0	111.9	P65 F66 V72 L73	P65-L69 VanDerWaalsContact O-CG 3.28Å; P65-L69 WeakPolarHBondContact O-CG 3.46Å; P65-L69 PolarHBondContact O-N 2.83Å; F66-L69 PolarHBondContact O-N 3.4Å; L69-V72 PolarHBondContact O-N 2.93Å; L69-L73 VanDerWaalsContact O-CB 3.31Å; L69-L73 WeakPolarHBondContact O-CB 3.46Å; L69-L73 WeakPolarHBondContact O-CG 3.26Å; L69-L73 PolarHBondContact O-N 3.44Å
70	T	92.9	Very high	87.2	Confident	56 Å²	56	85 Å²	85	34%	0.344	49%	0.494	S	S	.	.	H	α-helix	trans	-66.8	-37.5	179.1	49.3	0	0	0	0	112.4	F66 F67 I68 G74	F66-T70 HydrophobicContact CD1-CG2 4.05Å; F66-T70 HydrophobicContact CD2-CG2 4.49Å; F66-T70 HydrophobicContact CE1-CG2 3.59Å; F66-T70 HydrophobicContact CE2-CG2 4.07Å; F66-T70 HydrophobicContact CG-CG2 4.49Å; F66-T70 HydrophobicContact CZ-CG2 3.6Å; F66-T70 WeakPolarHBondContact O-CB 3.2Å; F66-T70 WeakPolarHBondContact O-CG2 3.3Å; F66-T70 PolarHBondContact O-N 2.91Å; F66-T70 PolarHBondContact O-OG1 2.97Å; F67-T70 WeakPolarHBondContact CA-OG1 3.28Å; F67-T70 PolarHBondContact O-N 2.9Å; F67-T70 PolarHBondContact O-OG1 3.13Å; I68-T70 PolarHBondContact O-N 2.92Å; T70-G74 PolarHBondContact O-N 3.25Å
71	S	93.9	Very high	88.8	Confident	55 Å²	55	84.2 Å²	84.2	39%	0.385	49%	0.493	S	S	.	.	H	α-helix	trans	-61.6	-50.3	173.5	-179.2	0	0	0	0	111.8	F67 I68 L73 G74 I75	F67-S71 WeakPolarHBondContact O-CB 3.2Å; F67-S71 PolarHBondContact O-N 3.04Å; I68-S71 PolarHBondContact O-N 3.42Å; S71-L73 PolarHBondContact O-N 3.48Å; S71-G74 PolarHBondContact O-N 3.3Å; S71-I75 WeakPolarHBondContact O-CG1 3.42Å; S71-I75 PolarHBondContact O-N 3.48Å
72	V	96.5	Very high	90.2	Very high	88 Å²	88	82.3 Å²	82.3	53%	0.533	48%	0.482	S	S	.	.	H	α-helix	trans	-61.8	-45.2	178	173	0	0	0	0	111.1	I68 L69 G74 I75 L76	I68-V72 HydrophobicContact CG2-CG2 4.39Å; I68-V72 VanDerWaalsContact O-CG2 3.3Å; I68-V72 WeakPolarHBondContact O-CG2 3.43Å; I68-V72 PolarHBondContact O-N 3.48Å; L69-V72 PolarHBondContact O-N 2.93Å; V72-G74 VanDerWaalsContact C-N 3.32Å; V72-G74 PolarHBondContact O-N 3.38Å; V72-I75 PolarHBondContact O-N 2.96Å; V72-L76 WeakPolarHBondContact O-CB 3.14Å; V72-L76 PolarHBondContact O-N 3.33Å
73	L	96.3	Very high	91.2	Very high	110 Å²	110	83.6 Å²	83.6	58%	0.576	48%	0.477	S	S	*	.	H	α-helix	trans	-62.9	-39	176.9	-73.5	171.7	0	0	0	111.9	L69 S71 L76 A77	L69-L73 VanDerWaalsContact O-CB 3.31Å; L69-L73 WeakPolarHBondContact O-CB 3.46Å; L69-L73 WeakPolarHBondContact O-CG 3.26Å; L69-L73 PolarHBondContact O-N 3.44Å; S71-L73 PolarHBondContact O-N 3.48Å; L73-L76 PolarHBondContact O-N 2.96Å; L73-A77 VanDerWaalsContact O-CB 3.23Å; L73-A77 WeakPolarHBondContact O-CB 3.35Å; L73-A77 PolarHBondContact O-N 3.47Å
74	G	95.9	Very high	92	Very high	41 Å²	41	86.9 Å²	86.9	42%	0.423	49%	0.486	S	S	.	.	H	α-helix	trans	-62.5	-45.3	175.8	0	0	0	0	0	112.2	T70 S71 V72 A77 S78	T70-G74 PolarHBondContact O-N 3.25Å; S71-G74 PolarHBondContact O-N 3.3Å; V72-G74 VanDerWaalsContact C-N 3.32Å; V72-G74 PolarHBondContact O-N 3.38Å; G74-A77 PolarHBondContact O-N 3.39Å; G74-S78 VanDerWaalsContact O-CB 3.29Å; G74-S78 WeakPolarHBondContact O-CB 3.29Å; G74-S78 PolarHBondContact O-N 3.02Å
75	I	96.9	Very high	92.4	Very high	111 Å²	111	89.4 Å²	89.4	57%	0.569	50%	0.499	S	S	*	.	H	α-helix	trans	-64.5	-43.9	176.6	-64.7	165.2	0	0	0	110.6	S71 V72 S78 S79	S71-I75 WeakPolarHBondContact O-CG1 3.42Å; S71-I75 PolarHBondContact O-N 3.48Å; V72-I75 PolarHBondContact O-N 2.96Å; I75-S78 PolarHBondContact O-N 3.35Å; I75-S79 VanDerWaalsContact O-CB 3.26Å; I75-S79 WeakPolarHBondContact O-CB 3.47Å; I75-S79 PolarHBondContact O-N 2.73Å; I75-S79 PolarHBondContact O-OG 2.91Å
76	L	96.6	Very high	92.5	Very high	107 Å²	107	90.5 Å²	90.5	56%	0.56	50%	0.497	S	S	*	.	H	α-helix	trans	-64.1	-44	178.8	-159.4	85.5	0	0	0	111.5	V72 L73 S79 T80	V72-L76 WeakPolarHBondContact O-CB 3.14Å; V72-L76 PolarHBondContact O-N 3.33Å; L73-L76 PolarHBondContact O-N 2.96Å; L76-S79 WeakPolarHBondContact CA-OG 3.45Å; L76-S79 PolarHBondContact O-OG 3.07Å; L76-T80 WeakPolarHBondContact O-CB 3.11Å; L76-T80 WeakPolarHBondContact O-CG2 3.16Å; L76-T80 PolarHBondContact O-N 3.15Å; L76-T80 PolarHBondContact O-OG1 3.45Å
77	A	96.3	Very high	91.8	Very high	53 Å²	53	89 Å²	89	44%	0.438	49%	0.487	S	S	.	.	H	α-helix	trans	-64.1	-47.1	176.7	0	0	0	0	0	111.5	L73 G74 S79 T80 V81	L73-A77 VanDerWaalsContact O-CB 3.23Å; L73-A77 WeakPolarHBondContact O-CB 3.35Å; L73-A77 PolarHBondContact O-N 3.47Å; G74-A77 PolarHBondContact O-N 3.39Å; A77-S79 PolarHBondContact O-N 2.81Å; A77-T80 PolarHBondContact O-N 3.04Å; A77-T80 PolarHBondContact O-OG1 3.33Å; A77-V81 VanDerWaalsContact O-CG2 3.3Å; A77-V81 WeakPolarHBondContact O-CG2 3.34Å; A77-V81 PolarHBondContact O-N 3.38Å; A77-V81 VanDerWaalsContact O-N 3.07Å
78	S	95.9	Very high	91.3	Very high	69 Å²	69	86.7 Å²	86.7	48%	0.483	48%	0.484	S	S	.	.	H	α-helix	trans	-63.2	-44.7	179.4	-172.3	0	0	0	0	111.7	G74 I75 V81 L82	G74-S78 VanDerWaalsContact O-CB 3.29Å; G74-S78 WeakPolarHBondContact O-CB 3.29Å; G74-S78 PolarHBondContact O-N 3.02Å; I75-S78 PolarHBondContact O-N 3.35Å; S78-V81 PolarHBondContact O-N 2.9Å; S78-L82 WeakPolarHBondContact O-CB 3.08Å; S78-L82 PolarHBondContact O-N 2.74Å
79	S	94.6	Very high	90.1	Very high	60 Å²	60	87.3 Å²	87.3	42%	0.42	49%	0.488	S	S	.	.	H	α-helix	trans	-66.4	-39.5	179.8	57.6	0	0	0	0	112.8	I75 L76 A77 L82 F83	I75-S79 VanDerWaalsContact O-CB 3.26Å; I75-S79 WeakPolarHBondContact O-CB 3.47Å; I75-S79 PolarHBondContact O-N 2.73Å; I75-S79 PolarHBondContact O-OG 2.91Å; L76-S79 WeakPolarHBondContact CA-OG 3.45Å; L76-S79 PolarHBondContact O-OG 3.07Å; A77-S79 PolarHBondContact O-N 2.81Å; S79-L82 PolarHBondContact O-N 3.39Å; S79-F83 VanDerWaalsContact O-CB 3.24Å; S79-F83 WeakPolarHBondContact O-CB 3.44Å; S79-F83 PolarHBondContact O-N 3Å
80	T	95.1	Very high	88.5	Confident	71 Å²	71	87.9 Å²	87.9	44%	0.436	49%	0.486	S	S	.	.	H	α-helix	trans	-67	-41.2	176.8	52.5	0	0	0	0	112.3	L76 A77 F83 M84	L76-T80 WeakPolarHBondContact O-CB 3.11Å; L76-T80 WeakPolarHBondContact O-CG2 3.16Å; L76-T80 PolarHBondContact O-N 3.15Å; L76-T80 PolarHBondContact O-OG1 3.45Å; A77-T80 PolarHBondContact O-N 3.04Å; A77-T80 PolarHBondContact O-OG1 3.33Å; T80-F83 PolarHBondContact O-N 3.18Å; T80-M84 WeakPolarHBondContact O-CG 3.19Å; T80-M84 PolarHBondContact O-N 2.86Å
81	V	94.3	Very high	86.9	Confident	84 Å²	84	93.1 Å²	93.1	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-62.9	-48.6	174.1	172.1	0	0	0	0	110.5	A77 S78 F83 M84 L85	A77-V81 VanDerWaalsContact O-CG2 3.3Å; A77-V81 WeakPolarHBondContact O-CG2 3.34Å; A77-V81 PolarHBondContact O-N 3.38Å; A77-V81 VanDerWaalsContact O-N 3.07Å; S78-V81 PolarHBondContact O-N 2.9Å; V81-F83 VanDerWaalsContact C-N 3.31Å; V81-F83 PolarHBondContact O-N 3.49Å; V81-M84 PolarHBondContact O-N 3.05Å; V81-L85 HydrophobicContact CG1-CD1 4.1Å; V81-L85 WeakPolarHBondContact O-CG 3.35Å; V81-L85 PolarHBondContact O-N 2.79Å
82	L	92.8	Very high	85.1	Confident	88 Å²	88	101.6 Å²	101.6	46%	0.461	52%	0.523	S	S	.	.	H	α-helix	trans	-54.7	-49.8	173.6	-111	86.7	0	0	0	110.6	S78 S79 M84 L85 F86	S78-L82 WeakPolarHBondContact O-CB 3.08Å; S78-L82 PolarHBondContact O-N 2.74Å; S79-L82 PolarHBondContact O-N 3.39Å; L82-M84 VanDerWaalsContact C-N 3.3Å; L82-M84 PolarHBondContact O-N 2.77Å; L82-L85 CarbonylContact O-C 3.59Å; L82-L85 WeakPolarHBondContact O-CB 3.09Å; L82-L85 PolarHBondContact O-N 2.81Å; L82-L85 VanDerWaalsContact O-N 3.08Å; L82-F86 HydrophobicContact CB-CD2 4.18Å; L82-F86 HydrophobicContact CB-CE2 4.31Å; L82-F86 HydrophobicContact CD2-CD2 4.24Å; L82-F86 HydrophobicContact CD2-CE2 3.65Å; L82-F86 HydrophobicContact CG-CD2 4.17Å; L82-F86 HydrophobicContact CG-CE2 3.79Å; L82-F86 WeakPolarHBondContact O-CB 3.43Å; L82-F86 WeakPolarHBondContact O-CD2 2.77Å; L82-F86 PolarHBondContact O-N 2.9Å
83	F	87.9	Confident	83.3	Confident	118 Å²	118	104.9 Å²	104.9	52%	0.518	53%	0.532	S	S	.	.	H	α-helix	trans	-59.9	-39.4	-178.6	-179.8	-107.9	0	0	0	112.4	S79 T80 V81 F86 R87	S79-F83 VanDerWaalsContact O-CB 3.24Å; S79-F83 WeakPolarHBondContact O-CB 3.44Å; S79-F83 PolarHBondContact O-N 3Å; T80-F83 PolarHBondContact O-N 3.18Å; V81-F83 VanDerWaalsContact C-N 3.31Å; V81-F83 PolarHBondContact O-N 3.49Å; F83-F86 PolarHBondContact O-N 3.39Å; F83-R87 HydrophobicContact CD1-CG 4.32Å; F83-R87 HydrophobicContact CE1-CG 4.05Å; F83-R87 HydrophobicContact CZ-CG 4.2Å; F83-R87 WeakPolarHBondContact O-CB 2.7Å; F83-R87 WeakPolarHBondContact O-CG 3.15Å; F83-R87 PolarHBondContact O-N 3.22Å
84	M	88.9	Confident	81.6	Confident	110 Å²	110	106.2 Å²	106.2	54%	0.542	54%	0.54	S	S	.	.	H	α-helix	trans	-67.3	-37.4	174.8	-71.8	-68.3	-179.5	0	0	112.6	T80 V81 L82 R87 P88	T80-M84 WeakPolarHBondContact O-CG 3.19Å; T80-M84 PolarHBondContact O-N 2.86Å; V81-M84 PolarHBondContact O-N 3.05Å; L82-M84 VanDerWaalsContact C-N 3.3Å; L82-M84 PolarHBondContact O-N 2.77Å; M84-R87 PolarHBondContact SD-NH1 3.12Å; M84-R87 VanDerWaalsContact SD-NH1 3.44Å; M84-P88 WeakPolarHBondContact O-CD 2.96Å
85	L	87.6	Confident	79.7	Confident	118 Å²	118	109.3 Å²	109.3	62%	0.618	55%	0.553	S	S	*	*	H	α-helix	trans	-68.7	-36.3	174.3	-72.6	170.5	0	0	0	112.4	V81 L82 P88	V81-L85 HydrophobicContact CG1-CD1 4.1Å; V81-L85 WeakPolarHBondContact O-CG 3.35Å; V81-L85 PolarHBondContact O-N 2.79Å; L82-L85 CarbonylContact O-C 3.59Å; L82-L85 WeakPolarHBondContact O-CB 3.09Å; L82-L85 PolarHBondContact O-N 2.81Å; L82-L85 VanDerWaalsContact O-N 3.08Å; L85-P88 VanDerWaalsContact O-CD 3.23Å; L85-P88 WeakPolarHBondContact O-CD 3.45Å; L85-P88 VanDerWaalsContact O-CG 3.29Å; L85-P88 WeakPolarHBondContact O-CG 3.3Å
86	F	82.8	Confident	78.1	Confident	94 Å²	94	109.9 Å²	109.9	41%	0.412	57%	0.565	S	S	.	*	H	α-helix	trans	-83	-20.6	178.3	-76.1	-68.7	0	0	0	113.7	L82 F83 L89 F90	L82-F86 HydrophobicContact CB-CD2 4.18Å; L82-F86 HydrophobicContact CB-CE2 4.31Å; L82-F86 HydrophobicContact CD2-CD2 4.24Å; L82-F86 HydrophobicContact CD2-CE2 3.65Å; L82-F86 HydrophobicContact CG-CD2 4.17Å; L82-F86 HydrophobicContact CG-CE2 3.79Å; L82-F86 WeakPolarHBondContact O-CB 3.43Å; L82-F86 WeakPolarHBondContact O-CD2 2.77Å; L82-F86 PolarHBondContact O-N 2.9Å; F83-F86 PolarHBondContact O-N 3.39Å; F86-L89 HydrophobicContact CD1-CD1 3.65Å; F86-L89 HydrophobicContact CE1-CD1 4.06Å; F86-L89 WeakPolarHBondContact O-CB 2.68Å; F86-L89 PolarHBondContact O-N 3.49Å; F86-F90 HydrophobicContact CB-CD2 4.21Å; F86-F90 HydrophobicContact CB-CE2 3.96Å; F86-F90 WeakPolarHBondContact O-CD2 3.1Å; F86-F90 PolarHBondContact O-N 3.43Å
87	R	74.1	Confident	76.1	Confident	113 Å²	113	111.8 Å²	111.8	43%	0.426	61%	0.61	S	S	.	*	H	α-helix	trans	-49.8	-42.6	175.3	-101.1	-179.6	169.8	-170	-2.9	115.6	F83 M84 R91	F83-R87 HydrophobicContact CD1-CG 4.32Å; F83-R87 HydrophobicContact CE1-CG 4.05Å; F83-R87 HydrophobicContact CZ-CG 4.2Å; F83-R87 WeakPolarHBondContact O-CB 2.7Å; F83-R87 WeakPolarHBondContact O-CG 3.15Å; F83-R87 PolarHBondContact O-N 3.22Å; M84-R87 PolarHBondContact SD-NH1 3.12Å; M84-R87 VanDerWaalsContact SD-NH1 3.44Å; R87-R91 WeakPolarHBondContact O-CG 3.17Å; R87-R91 PolarHBondContact O-N 2.88Å; R87-R91 PolarHBondContact O-NE 3.45Å; R87-R91 VanDerWaalsContact O-NE 3.09Å
88	P	74.4	Confident	75.1	Confident	68 Å²	68	114.8 Å²	114.8	44%	0.442	62%	0.619	S	S	.	*	H	α-helix	trans	-68.3	-30.5	174.4	24.6	-34.1	0	0	0	113.4	M84 L85	M84-P88 WeakPolarHBondContact O-CD 2.96Å; L85-P88 VanDerWaalsContact O-CD 3.23Å; L85-P88 WeakPolarHBondContact O-CD 3.45Å; L85-P88 VanDerWaalsContact O-CG 3.29Å; L85-P88 WeakPolarHBondContact O-CG 3.3Å
89	L	64.3	Low	74	Confident	112 Å²	112	117.2 Å²	117.2	59%	0.586	63%	0.626	S	S	*	*	H	α-helix	trans	-69.1	-42.8	-179.6	-70.6	168	0	0	0	112	F86 W92	F86-L89 HydrophobicContact CD1-CD1 3.65Å; F86-L89 HydrophobicContact CE1-CD1 4.06Å; F86-L89 WeakPolarHBondContact O-CB 2.68Å; F86-L89 PolarHBondContact O-N 3.49Å; L89-W92 PolarHBondContact O-N 3.22Å
90	F	59.6	Low	72.8	Confident	119 Å²	119	120.3 Å²	120.3	52%	0.522	64%	0.637	S	S	.	*	H	α-helix	trans	-78.3	-25.8	179.8	-68	-67.8	0	0	0	114.1	F86 W92 Q93	F86-F90 HydrophobicContact CB-CD2 4.21Å; F86-F90 HydrophobicContact CB-CE2 3.96Å; F86-F90 WeakPolarHBondContact O-CD2 3.1Å; F86-F90 PolarHBondContact O-N 3.43Å; F90-W92 PolarHBondContact O-N 2.85Å; F90-Q93 PolarHBondContact O-N 2.85Å
91	R	60.1	Low	71.5	Confident	166 Å²	166	123.2 Å²	123.2	63%	0.626	65%	0.649	S	S	*	*	H	α-helix	trans	-66.2	-24.1	173.1	-78.8	-176.5	-70.8	171.6	0.2	112.7	R87	R87-R91 WeakPolarHBondContact O-CG 3.17Å; R87-R91 PolarHBondContact O-N 2.88Å; R87-R91 PolarHBondContact O-NE 3.45Å; R87-R91 VanDerWaalsContact O-NE 3.09Å
92	W	57.2	Low	70.1	Confident	233 Å²	233	125.7 Å²	125.7	88%	0.883	66%	0.658	S	S	*	*	H	α-helix	trans	-77.1	-23.6	175.6	-136.4	61.4	0	0	0	112.9	L89 F90	L89-W92 PolarHBondContact O-N 3.22Å; F90-W92 PolarHBondContact O-N 2.85Å
93	Q	58.7	Low	68.6	Low	157 Å²	157	128.2 Å²	128.2	73%	0.734	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-10.2	173.3	-84.6	-173.9	-66.1	0	0	114.3	F90	F90-Q93 PolarHBondContact O-N 2.85Å
94	L	59.2	Low	67.2	Low	139 Å²	139	128.9 Å²	128.9	73%	0.728	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	7.1	-177.6	-81.9	149.5	0	0	0	114.1	P96	L94-P96 VanDerWaalsContact C-CD 3.48Å; L94-P96 WeakPolarHBondContact O-CD 3.13Å
95	C	56.8	Low	65.6	Low	105 Å²	105	130.4 Å²	130.4	71%	0.709	69%	0.693	S	S	*	*			trans	-96.5	96.2	164.8	-77.1	0	0	0	0	110	G97	C95-G97 VanDerWaalsContact C-N 3.34Å; C95-G97 PolarHBondContact O-N 3.25Å
96	P	63.6	Low	63.7	Low	124 Å²	124	131.4 Å²	131.4	81%	0.805	70%	0.699	S	S	*	*			trans	-70.7	98.9	149	29.5	-27.7	0	0	0	106.8	L94	L94-P96 VanDerWaalsContact C-CD 3.48Å; L94-P96 WeakPolarHBondContact O-CD 3.13Å
97	G	53.9	Low	62	Low	147 Å²	147	134.8 Å²	134.8	100%	1.515	73%	0.725	S	S	*	*			trans	-78.3	0	156.5	0	0	0	0	0	109.5	C95	C95-G97 VanDerWaalsContact C-N 3.34Å; C95-G97 PolarHBondContact O-N 3.25Å

Retrieved 97 of 97 residues in 113.5 ms (Link to these results)

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