A0A096NX93_PAPAN Loading...

cAMP-dependent protein kinase inhibitor

Extremely potent competitive inhibitor of cAMP-dependent protein kinase activity, this protein interacts with the catalytic subunit of the enzyme after the cAMP-induced dissociation of its regulatory chains.

AlphaFold DB (Q9Y2B9), UniProt , Accession A0A096NX93, Species PAPAN (Papio anubis, Olive baboon), Gene PKIG, Length 76 aa.

						>A0A096NX93_PAPAN|A0A096NX93|PKIG
MMEVESSYSDFISCDRTGRRNAVPDIQGDSEAVSVRKLAGDMGELALEGAEGQVEGSAPDKEAGNQPQSSDGTTSS
					

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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	58.9	Low	67.6	Low	222 Å²	222	123.4 Å²	123.4	100%	1.094	63%	0.631	S	S	*	*				0	114.7	0	-160.3	66.3	166.6	0	0	105.7	E3	M1-E3 PolarHBondContact O-N 2.92Å
2	M	71.3	Confident	68.1	Low	170 Å²	170	122.1 Å²	122.1	84%	0.837	63%	0.625	S	S	*	*			trans	-71.4	124.7	170.2	-164.7	122.1	-174.2	0	0	105.6	V4	M2-V4 HydrophobicContact CB-CG2 4.5Å; M2-V4 WeakPolarHBondContact O-CG2 3.33Å; M2-V4 PolarHBondContact O-N 3.39Å
3	E	61.7	Low	68.5	Low	126 Å²	126	118.8 Å²	118.8	59%	0.589	62%	0.619	S	S	*	*			trans	-66.7	77.3	175.3	-66.4	-67.6	156.8	0	0	108.5	M1 E5 S6	M1-E3 PolarHBondContact O-N 2.92Å; E3-E5 PolarHBondContact O-N 3.13Å; E3-S6 PolarHBondContact O-N 2.91Å
4	V	65.3	Low	68.7	Low	109 Å²	109	112.9 Å²	112.9	66%	0.661	59%	0.593	S	S	*	*	H	α-helix	trans	-62.1	-30.7	179.7	177.5	0	0	0	0	110.1	M2 S7 Y8	M2-V4 HydrophobicContact CB-CG2 4.5Å; M2-V4 WeakPolarHBondContact O-CG2 3.33Å; M2-V4 PolarHBondContact O-N 3.39Å; V4-S7 PolarHBondContact O-N 2.83Å; V4-Y8 PolarHBondContact O-N 3.28Å
5	E	62.6	Low	68.5	Low	154 Å²	154	113.9 Å²	113.9	72%	0.72	60%	0.599	S	S	*	*	H	α-helix	trans	-70.1	-34.8	179.6	-69.4	177.4	165.8	0	0	113.1	E3 S7 Y8 S9	E3-E5 PolarHBondContact O-N 3.13Å; E5-S7 VanDerWaalsContact C-N 3.32Å; E5-S7 PolarHBondContact O-N 3.19Å; E5-Y8 PolarHBondContact O-N 3.07Å; E5-S9 PolarHBondContact O-N 3.42Å; E5-S9 PolarHBondContact O-OG 3.33Å
6	S	63.4	Low	68.3	Low	64 Å²	64	112.7 Å²	112.7	45%	0.448	58%	0.584	S	S	.	*	H	α-helix	trans	-64.1	-39.8	173.9	-66.1	0	0	0	0	111.4	E3 Y8 S9 D10	E3-S6 PolarHBondContact O-N 2.91Å; S6-Y8 PolarHBondContact O-N 3.09Å; S6-S9 PolarHBondContact O-N 2.76Å; S6-D10 PolarHBondContact O-N 3.31Å
7	S	71.8	Confident	67.9	Low	57 Å²	57	114.2 Å²	114.2	40%	0.399	60%	0.599	S	S	.	*	H	α-helix	trans	-63.8	-44.6	180	-140.3	0	0	0	0	111.3	V4 E5 S9 D10 F11	V4-S7 PolarHBondContact O-N 2.83Å; E5-S7 VanDerWaalsContact C-N 3.32Å; E5-S7 PolarHBondContact O-N 3.19Å; S7-S9 PolarHBondContact O-N 2.84Å; S7-D10 PolarHBondContact O-N 3.11Å; S7-F11 WeakPolarHBondContact O-CD2 3.24Å; S7-F11 WeakPolarHBondContact O-CE2 3.42Å; S7-F11 WeakPolarHBondContact O-CG 3.47Å; S7-F11 PolarHBondContact O-N 3.04Å; S7-F11 VanDerWaalsContact OG-CE2 3.24Å; S7-F11 WeakPolarHBondContact OG-CE2 3.41Å
8	Y	74.5	Confident	67.5	Low	160 Å²	160	111.6 Å²	111.6	63%	0.627	60%	0.604	S	S	*	*	H	α-helix	trans	-61.3	-42.3	177.8	-170.9	-113.5	0	0	0	112.8	V4 E5 S6 D10 F11 I12	V4-Y8 PolarHBondContact O-N 3.28Å; E5-Y8 PolarHBondContact O-N 3.07Å; S6-Y8 PolarHBondContact O-N 3.09Å; Y8-D10 VanDerWaalsContact C-N 3.34Å; Y8-D10 PolarHBondContact O-N 2.97Å; Y8-F11 PolarHBondContact O-N 2.92Å; Y8-I12 HydrophobicContact CD1-CD1 3.59Å; Y8-I12 HydrophobicContact CD2-CD1 4.19Å; Y8-I12 HydrophobicContact CE1-CD1 3.11Å; Y8-I12 HydrophobicContact CE1-CG1 4.41Å; Y8-I12 HydrophobicContact CE2-CD1 3.77Å; Y8-I12 HydrophobicContact CE2-CG1 4.39Å; Y8-I12 HydrophobicContact CG-CD1 4.12Å; Y8-I12 PolarHBondContact O-N 3.22Å; Y8-I12 VanDerWaalsContact O-N 3.09Å
9	S	74.2	Confident	67.3	Low	70 Å²	70	116.2 Å²	116.2	49%	0.49	61%	0.612	S	S	.	*	H	α-helix	trans	-63.8	-41	178.2	-57.4	0	0	0	0	111.4	E5 S6 S7 S13	E5-S9 PolarHBondContact O-N 3.42Å; E5-S9 PolarHBondContact O-OG 3.33Å; S6-S9 PolarHBondContact O-N 2.76Å; S7-S9 PolarHBondContact O-N 2.84Å; S9-S13 VanDerWaalsContact O-CB 3.22Å; S9-S13 WeakPolarHBondContact O-CB 2.79Å; S9-S13 PolarHBondContact O-N 3.33Å; S9-S13 PolarHBondContact O-OG 3.36Å
10	D	70.5	Confident	67.2	Low	100 Å²	100	118.1 Å²	118.1	54%	0.535	61%	0.611	S	S	.	*	H	α-helix	trans	-66.2	-37.6	173.7	-72.9	-18.6	0	0	0	112	S6 S7 Y8 S13 C14	S6-D10 PolarHBondContact O-N 3.31Å; S7-D10 PolarHBondContact O-N 3.11Å; Y8-D10 VanDerWaalsContact C-N 3.34Å; Y8-D10 PolarHBondContact O-N 2.97Å; D10-S13 WeakPolarHBondContact CA-OG 3.44Å; D10-S13 PolarHBondContact O-OG 3.48Å; D10-C14 WeakPolarHBondContact O-CB 3.49Å; D10-C14 PolarHBondContact O-N 3.28Å; D10-C14 VanDerWaalsContact O-N 3.09Å; D10-C14 PolarHBondContact O-SG 3.47Å
11	F	69.8	Low	67	Low	125 Å²	125	120.2 Å²	120.2	55%	0.548	62%	0.623	S	S	.	*	H	α-helix	trans	-65.1	-40	178	-72.7	-65.4	0	0	0	113	S7 Y8	S7-F11 WeakPolarHBondContact O-CD2 3.24Å; S7-F11 WeakPolarHBondContact O-CE2 3.42Å; S7-F11 WeakPolarHBondContact O-CG 3.47Å; S7-F11 PolarHBondContact O-N 3.04Å; S7-F11 VanDerWaalsContact OG-CE2 3.24Å; S7-F11 WeakPolarHBondContact OG-CE2 3.41Å; Y8-F11 PolarHBondContact O-N 2.92Å
12	I	73.2	Confident	67.4	Low	108 Å²	108	111.7 Å²	111.7	55%	0.554	59%	0.588	S	S	*	*	H	α-helix	trans	-82.2	-38.1	-177.5	-63.2	163.9	0	0	0	112.2	Y8 C14	Y8-I12 HydrophobicContact CD1-CD1 3.59Å; Y8-I12 HydrophobicContact CD2-CD1 4.19Å; Y8-I12 HydrophobicContact CE1-CD1 3.11Å; Y8-I12 HydrophobicContact CE1-CG1 4.41Å; Y8-I12 HydrophobicContact CE2-CD1 3.77Å; Y8-I12 HydrophobicContact CE2-CG1 4.39Å; Y8-I12 HydrophobicContact CG-CD1 4.12Å; Y8-I12 PolarHBondContact O-N 3.22Å; Y8-I12 VanDerWaalsContact O-N 3.09Å; I12-C14 PolarHBondContact O-N 2.93Å
13	S	73.9	Confident	66.8	Low	79 Å²	79	108.1 Å²	108.1	55%	0.552	58%	0.575	S	S	*	*	H	α-helix	trans	-72.8	-17.8	176.7	61.6	0	0	0	0	112.9	S9 D10 D15	S9-S13 VanDerWaalsContact O-CB 3.22Å; S9-S13 WeakPolarHBondContact O-CB 2.79Å; S9-S13 PolarHBondContact O-N 3.33Å; S9-S13 PolarHBondContact O-OG 3.36Å; D10-S13 WeakPolarHBondContact CA-OG 3.44Å; D10-S13 PolarHBondContact O-OG 3.48Å; S13-D15 PolarHBondContact O-N 3.48Å; S13-D15 VanDerWaalsContact O-N 3.14Å
14	C	70.2	Confident	66.8	Low	37 Å²	37	108.1 Å²	108.1	25%	0.25	59%	0.586	C	S	.	*			trans	-67.7	110	172.8	-92.1	0	0	0	0	110.3	D10 I12 R16	D10-C14 WeakPolarHBondContact O-CB 3.49Å; D10-C14 PolarHBondContact O-N 3.28Å; D10-C14 VanDerWaalsContact O-N 3.09Å; D10-C14 PolarHBondContact O-SG 3.47Å; I12-C14 PolarHBondContact O-N 2.93Å; C14-R16 HydrophobicContact CB-CB 4.15Å; C14-R16 VanDerWaalsContact CB-CD 3.48Å; C14-R16 HydrophobicContact CB-CG 3.58Å; C14-R16 PolarHBondContact O-N 3.15Å; C14-R16 VanDerWaalsContact SG-CZ 3.54Å; C14-R16 PolarHBondContact SG-NE 3.45Å
15	D	66.9	Low	66.7	Low	128 Å²	128	108.7 Å²	108.7	68%	0.684	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	35.4	162.5	-64.6	-38.8	0	0	0	113	S13 T17	S13-D15 PolarHBondContact O-N 3.48Å; S13-D15 VanDerWaalsContact O-N 3.14Å; D15-T17 PolarHBondContact O-N 2.74Å
16	R	64.2	Low	66.6	Low	94 Å²	94	108 Å²	108	36%	0.355	59%	0.585	S	S	.	*	H	α-helix	trans	-69.6	-20.9	-178.6	-79.8	174	-177.5	-175.3	7.5	111.9	C14 G18 R20	C14-R16 HydrophobicContact CB-CB 4.15Å; C14-R16 VanDerWaalsContact CB-CD 3.48Å; C14-R16 HydrophobicContact CB-CG 3.58Å; C14-R16 PolarHBondContact O-N 3.15Å; C14-R16 VanDerWaalsContact SG-CZ 3.54Å; C14-R16 PolarHBondContact SG-NE 3.45Å; R16-G18 PolarHBondContact O-N 2.91Å; R16-R20 HydrophobicContact CB-CB 4.45Å; R16-R20 HydrophobicContact CB-CG 4Å; R16-R20 VanDerWaalsContact CD-CD 3.44Å; R16-R20 HydrophobicContact CG-CG 3.68Å; R16-R20 VanDerWaalsContact NH2-NH2 3.15Å
17	T	62.1	Low	66.2	Low	138 Å²	138	114 Å²	114	85%	0.847	61%	0.606	S	S	*	*	H	α-helix	trans	-66.4	95.1	171.4	53.9	0	0	0	0	108.7	D15	D15-T17 PolarHBondContact O-N 2.74Å
18	G	60.7	Low	65.7	Low	67 Å²	67	113.9 Å²	113.9	69%	0.691	61%	0.614	S	S	*	*	H	α-helix	trans	110.6	-32.5	176.5	0	0	0	0	0	115.3	R16	R16-G18 PolarHBondContact O-N 2.91Å
19	R	64.5	Low	65	Low	199 Å²	199	112.3 Å²	112.3	75%	0.751	62%	0.617	S	S	*	*	H	α-helix	trans	-86.9	-20.4	-179.9	-66.4	-178.1	67.1	113.9	2.1	114.7
20	R	64.9	Low	64.3	Low	155 Å²	155	114.6 Å²	114.6	59%	0.585	63%	0.633	S	S	*	*	S	Bend	trans	-81	-21.3	-167.1	-106.3	-167.5	166.8	-161.8	-14.3	116.7	R16	R16-R20 HydrophobicContact CB-CB 4.45Å; R16-R20 HydrophobicContact CB-CG 4Å; R16-R20 VanDerWaalsContact CD-CD 3.44Å; R16-R20 HydrophobicContact CG-CG 3.68Å; R16-R20 VanDerWaalsContact NH2-NH2 3.15Å
21	N	63.6	Low	63.7	Low	163 Å²	163	118.4 Å²	118.4	87%	0.872	65%	0.647	S	S	*	*	S	Bend	trans	-109.3	-11.2	175.8	-67.3	-9.4	0	0	0	112.1	V23	N21-V23 PolarHBondContact O-N 3.39Å
22	A	65.3	Low	63.3	Low	42 Å²	42	116 Å²	116	35%	0.347	65%	0.651	S	S	.	*	S	Bend	trans	-76.8	120.1	169.1	0	0	0	0	0	107.5	P24 I26	A22-P24 WeakPolarHBondContact O-CD 3.44Å; A22-I26 HydrophobicContact CB-CD1 4.46Å
23	V	60.7	Low	62.9	Low	95 Å²	95	115.7 Å²	115.7	58%	0.576	65%	0.653	S	S	*	*			trans	-51.3	127.1	175.3	-176.9	0	0	0	0	107.9	N21 D25 I26	N21-V23 PolarHBondContact O-N 3.39Å; V23-D25 HydrophobicContact CG1-CB 3.91Å; V23-D25 PolarHBondContact O-N 3.37Å; V23-I26 PolarHBondContact O-N 3.32Å
24	P	61.7	Low	62.7	Low	127 Å²	127	114.6 Å²	114.6	83%	0.825	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	11.2	177.1	-25.5	35.2	0	0	0	116.2	A22	A22-P24 WeakPolarHBondContact O-CD 3.44Å
25	D	62.1	Low	63	Low	121 Å²	121	118.7 Å²	118.7	65%	0.647	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.3	14	-170.6	-56.1	-53.4	0	0	0	113.6	V23 Q27	V23-D25 HydrophobicContact CG1-CB 3.91Å; V23-D25 PolarHBondContact O-N 3.37Å; D25-Q27 PolarHBondContact O-N 3.18Å
26	I	59.7	Low	63.7	Low	138 Å²	138	123.1 Å²	123.1	71%	0.708	68%	0.677	S	S	*	*			trans	-72	75.2	157.7	32.5	172.8	0	0	0	108.6	A22 V23 G28	A22-I26 HydrophobicContact CB-CD1 4.46Å; V23-I26 PolarHBondContact O-N 3.32Å; I26-G28 VanDerWaalsContact C-N 3.26Å; I26-G28 PolarHBondContact O-N 3.19Å
27	Q	56.1	Low	64.5	Low	190 Å²	190	125 Å²	125	89%	0.888	69%	0.687	S	S	*	*			trans	-65.3	91.7	159.9	-66.8	-177.5	1.1	0	0	107.1	D25	D25-Q27 PolarHBondContact O-N 3.18Å
28	G	61.7	Low	65.5	Low	55 Å²	55	122.5 Å²	122.5	57%	0.567	67%	0.668	S	S	*	*	S	Bend	trans	-170.7	118.5	180	0	0	0	0	0	109.6	I26 S30	I26-G28 VanDerWaalsContact C-N 3.26Å; I26-G28 PolarHBondContact O-N 3.19Å; G28-S30 PolarHBondContact O-N 3.17Å
29	D	59	Low	66.7	Low	128 Å²	128	122.6 Å²	122.6	68%	0.684	66%	0.663	S	S	*	*			trans	-46.9	125.9	170.6	-63	-44.6	0	0	0	108.1	E31 A32	D29-E31 HydrophobicContact CB-CB 4.39Å; D29-E31 PolarHBondContact O-N 3.36Å; D29-A32 HydrophobicContact CB-CB 4.47Å; D29-A32 WeakPolarHBondContact O-CB 3.47Å; D29-A32 PolarHBondContact O-N 3Å
30	S	59.2	Low	67.7	Low	117 Å²	117	114.9 Å²	114.9	82%	0.818	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-15.1	173.9	-172.7	0	0	0	0	111.9	G28	G28-S30 PolarHBondContact O-N 3.17Å
31	E	58.9	Low	68.7	Low	180 Å²	180	111 Å²	111	84%	0.841	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-24	173.2	-55.9	-157.5	153.5	0	0	114.5	D29 V33	D29-E31 HydrophobicContact CB-CB 4.39Å; D29-E31 PolarHBondContact O-N 3.36Å; E31-V33 PolarHBondContact O-N 3.44Å
32	A	61	Low	69.7	Low	75 Å²	75	108.7 Å²	108.7	62%	0.62	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-21.4	178.8	0	0	0	0	0	112.5	D29 S34	D29-A32 HydrophobicContact CB-CB 4.47Å; D29-A32 WeakPolarHBondContact O-CB 3.47Å; D29-A32 PolarHBondContact O-N 3Å; A32-S34 PolarHBondContact O-N 3.19Å
33	V	64.7	Low	70.6	Confident	101 Å²	101	110 Å²	110	61%	0.612	64%	0.638	S	S	*	*	S	Bend	trans	-89.6	83.1	172	-173.2	0	0	0	0	108.3	E31 V35	E31-V33 PolarHBondContact O-N 3.44Å; V33-V35 PolarHBondContact O-N 3.09Å
34	S	69.6	Low	71.7	Confident	57 Å²	57	113 Å²	113	40%	0.399	65%	0.646	S	S	.	*			trans	-63.6	128.1	176.5	80.8	0	0	0	0	110.1	A32 R36 K37 L38	A32-S34 PolarHBondContact O-N 3.19Å; S34-R36 PolarHBondContact O-N 2.68Å; S34-R36 VanDerWaalsContact O-N 3.1Å; S34-K37 WeakPolarHBondContact O-CB 3.22Å; S34-K37 PolarHBondContact O-N 3.48Å; S34-K37 WeakPolarHBondContact OG-CB 3.43Å; S34-K37 PolarHBondContact OG-N 3.42Å; S34-K37 VanDerWaalsContact OG-N 3.15Å; S34-L38 PolarHBondContact O-N 2.98Å; S34-L38 VanDerWaalsContact O-N 3.1Å
35	V	77.2	Confident	72.7	Confident	122 Å²	122	113.2 Å²	113.2	74%	0.739	64%	0.639	S	S	*	*	H	α-helix	trans	-53.2	-33.9	177.2	177.6	0	0	0	0	111.5	V33 L38 A39	V33-V35 PolarHBondContact O-N 3.09Å; V35-L38 PolarHBondContact O-N 3.42Å; V35-A39 WeakPolarHBondContact O-CB 3.06Å; V35-A39 PolarHBondContact O-N 3.38Å
36	R	81	Confident	73.5	Confident	222 Å²	222	111.7 Å²	111.7	84%	0.838	64%	0.644	S	S	*	*	H	α-helix	trans	-63.8	-43.6	176.2	-175.8	179.1	-67.6	180	-0.5	112.5	S34 A39 G40	S34-R36 PolarHBondContact O-N 2.68Å; S34-R36 VanDerWaalsContact O-N 3.1Å; R36-A39 PolarHBondContact O-N 2.96Å; R36-G40 PolarHBondContact O-N 3.45Å; R36-G40 VanDerWaalsContact O-N 3.08Å
37	K	81.7	Confident	74.4	Confident	132 Å²	132	112.8 Å²	112.8	57%	0.574	65%	0.651	S	S	*	*	H	α-helix	trans	-64.6	-46.4	176.5	-178.9	171	179.2	166.4	0	110.6	S34 A39 G40 D41	S34-K37 WeakPolarHBondContact O-CB 3.22Å; S34-K37 PolarHBondContact O-N 3.48Å; S34-K37 WeakPolarHBondContact OG-CB 3.43Å; S34-K37 PolarHBondContact OG-N 3.42Å; S34-K37 VanDerWaalsContact OG-N 3.15Å; K37-A39 VanDerWaalsContact C-N 3.3Å; K37-A39 PolarHBondContact O-N 3.33Å; K37-G40 WeakPolarHBondContact O-CA 3.48Å; K37-G40 PolarHBondContact O-N 3.49Å; K37-D41 VanDerWaalsContact O-CG 3.25Å; K37-D41 PolarHBondContact O-N 3.03Å
38	L	83	Confident	75	Confident	87 Å²	87	113.5 Å²	113.5	46%	0.455	65%	0.654	S	S	.	*	H	α-helix	trans	-57.5	-42.3	176.3	-179.6	62	0	0	0	112.5	S34 V35 G40 D41 M42	S34-L38 PolarHBondContact O-N 2.98Å; S34-L38 VanDerWaalsContact O-N 3.1Å; V35-L38 PolarHBondContact O-N 3.42Å; L38-G40 VanDerWaalsContact C-N 3.33Å; L38-G40 PolarHBondContact O-N 3.09Å; L38-D41 PolarHBondContact O-N 2.93Å; L38-M42 HydrophobicContact CD1-CE 4.1Å; L38-M42 WeakPolarHBondContact O-CB 3.44Å; L38-M42 PolarHBondContact O-N 2.7Å
39	A	84.2	Confident	74.7	Confident	69 Å²	69	113.7 Å²	113.7	57%	0.57	66%	0.656	S	S	*	*	H	α-helix	trans	-65	-35	176.1	0	0	0	0	0	112.9	V35 R36 K37 G43	V35-A39 WeakPolarHBondContact O-CB 3.06Å; V35-A39 PolarHBondContact O-N 3.38Å; R36-A39 PolarHBondContact O-N 2.96Å; K37-A39 VanDerWaalsContact C-N 3.3Å; K37-A39 PolarHBondContact O-N 3.33Å; A39-G43 PolarHBondContact O-N 2.91Å
40	G	85.9	Confident	74.7	Confident	36 Å²	36	111.2 Å²	111.2	37%	0.371	65%	0.653	S	S	.	*	H	α-helix	trans	-66.3	-52.2	173.7	0	0	0	0	0	111.8	R36 K37 L38 M42 G43 E44	R36-G40 PolarHBondContact O-N 3.45Å; R36-G40 VanDerWaalsContact O-N 3.08Å; K37-G40 WeakPolarHBondContact O-CA 3.48Å; K37-G40 PolarHBondContact O-N 3.49Å; L38-G40 VanDerWaalsContact C-N 3.33Å; L38-G40 PolarHBondContact O-N 3.09Å; G40-M42 PolarHBondContact O-N 3.33Å; G40-G43 WeakPolarHBondContact O-CA 3.5Å; G40-G43 PolarHBondContact O-N 3.24Å; G40-E44 PolarHBondContact O-N 3.08Å
41	D	86.4	Confident	74.3	Confident	74 Å²	74	115.8 Å²	115.8	40%	0.396	66%	0.661	S	S	.	*	H	α-helix	trans	-56.2	-40.4	179.1	-61	-11.5	0	0	0	110.7	K37 L38 G43 E44 L45	K37-D41 VanDerWaalsContact O-CG 3.25Å; K37-D41 PolarHBondContact O-N 3.03Å; L38-D41 PolarHBondContact O-N 2.93Å; D41-G43 VanDerWaalsContact C-N 3.29Å; D41-G43 PolarHBondContact O-N 3.03Å; D41-E44 PolarHBondContact O-N 3.49Å; D41-L45 WeakPolarHBondContact O-CG 3.34Å; D41-L45 PolarHBondContact O-N 3.04Å
42	M	84.8	Confident	74	Confident	115 Å²	115	110.4 Å²	110.4	57%	0.567	66%	0.655	S	S	*	*	H	α-helix	trans	-65.6	-28.4	176.6	-154	68.1	58.7	0	0	113.5	L38 G40 L45	L38-M42 HydrophobicContact CD1-CE 4.1Å; L38-M42 WeakPolarHBondContact O-CB 3.44Å; L38-M42 PolarHBondContact O-N 2.7Å; G40-M42 PolarHBondContact O-N 3.33Å; M42-L45 HydrophobicContact SD-CD1 3.6Å
43	G	84	Confident	73.3	Confident	69 Å²	69	114.9 Å²	114.9	71%	0.711	66%	0.663	S	S	*	*	H	α-helix	trans	-77.9	-23.4	174.9	0	0	0	0	0	113.6	A39 G40 D41	A39-G43 PolarHBondContact O-N 2.91Å; G40-G43 WeakPolarHBondContact O-CA 3.5Å; G40-G43 PolarHBondContact O-N 3.24Å; D41-G43 VanDerWaalsContact C-N 3.29Å; D41-G43 PolarHBondContact O-N 3.03Å
44	E	84.2	Confident	72.4	Confident	159 Å²	159	116.4 Å²	116.4	74%	0.743	67%	0.672	S	S	*	*	H	α-helix	trans	-83.3	-15.6	175.7	-66.5	-177.6	-170.2	0	0	113	G40 D41 A46	G40-E44 PolarHBondContact O-N 3.08Å; D41-E44 PolarHBondContact O-N 3.49Å; E44-A46 VanDerWaalsContact C-N 3.33Å; E44-A46 PolarHBondContact O-N 2.83Å
45	L	82.9	Confident	71.1	Confident	130 Å²	130	122.7 Å²	122.7	68%	0.681	70%	0.695	S	S	*	*			trans	-67.5	88.9	174.3	-66	177.1	0	0	0	110.6	D41 M42	D41-L45 WeakPolarHBondContact O-CG 3.34Å; D41-L45 PolarHBondContact O-N 3.04Å; M42-L45 HydrophobicContact SD-CD1 3.6Å
46	A	79.1	Confident	69.6	Low	90 Å²	90	120.3 Å²	120.3	74%	0.744	70%	0.695	S	S	*	*			trans	-88.8	143.9	167.5	0	0	0	0	0	110.5	E44 E48	E44-A46 VanDerWaalsContact C-N 3.33Å; E44-A46 PolarHBondContact O-N 2.83Å; A46-E48 PolarHBondContact O-N 2.99Å
47	L	76.8	Confident	67.8	Low	161 Å²	161	115.3 Å²	115.3	84%	0.843	69%	0.694	S	S	*	*			trans	-74.4	108.3	169	-63.8	176.8	0	0	0	108.5	G49	L47-G49 VanDerWaalsContact C-N 3.32Å; L47-G49 PolarHBondContact O-N 2.88Å
48	E	69.2	Low	66.1	Low	204 Å²	204	113.9 Å²	113.9	95%	0.953	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	92.5	165.1	-164.2	84.4	-139.9	0	0	107.6	A46	A46-E48 PolarHBondContact O-N 2.99Å
49	G	56.5	Low	64.7	Low	60 Å²	60	115 Å²	115	62%	0.619	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	154.4	15.6	177.4	0	0	0	0	0	120	L47	L47-G49 VanDerWaalsContact C-N 3.32Å; L47-G49 PolarHBondContact O-N 2.88Å
50	A	57.5	Low	63	Low	75 Å²	75	119.8 Å²	119.8	62%	0.62	74%	0.735	S	S	*	*			trans	-115.2	0.2	-179.7	0	0	0	0	0	115.6	G52	A50-G52 PolarHBondContact O-N 3.14Å
51	E	52.3	Low	61.5	Low	213 Å²	213	127 Å²	127	100%	0.995	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	12	178.9	-66.4	-169.9	139.8	0	0	114.4
52	G	51.8	Low	59.5	Low	68 Å²	68	132.4 Å²	132.4	70%	0.701	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.9	9.2	-176.5	0	0	0	0	0	116.5	A50	A50-G52 PolarHBondContact O-N 3.14Å
53	Q	47.1	Very low	58.1	Low	169 Å²	169	130.8 Å²	130.8	79%	0.79	79%	0.785	S	S	*	*			trans	-123	57.2	-175	-56.5	-172.8	-0.8	0	0	111.2
54	V	44.2	Very low	56.2	Low	132 Å²	132	130.8 Å²	130.8	80%	0.8	78%	0.784	S	S	*	*	S	Bend	trans	-91.5	120.6	157.3	-173.7	0	0	0	0	105.4
55	E	43.2	Very low	54.8	Low	189 Å²	189	130.6 Å²	130.6	88%	0.883	79%	0.788	S	S	*	*	S	Bend	trans	83.3	109.3	179	-45	-149.2	160.5	0	0	117.1
56	G	45.4	Very low	53.4	Low	72 Å²	72	132.7 Å²	132.7	74%	0.742	80%	0.795	S	S	*	*			trans	149.5	78.8	161.7	0	0	0	0	0	114.9
57	S	43.1	Very low	52.8	Low	117 Å²	117	133.7 Å²	133.7	82%	0.818	79%	0.794	S	S	*	*			trans	34.4	108.7	149.2	-59.9	0	0	0	0	118.4	P59	S57-P59 WeakPolarHBondContact O-CD 3.17Å
58	A	46.5	Very low	51.9	Low	102 Å²	102	135.2 Å²	135.2	84%	0.843	80%	0.796	S	S	*	*			trans	-55.1	131.3	158.9	0	0	0	0	0	110.8
59	P	54.7	Low	51.4	Low	110 Å²	110	130.3 Å²	130.3	71%	0.714	79%	0.785	S	S	*	*			trans	-94.6	123.7	146.6	31.1	-20.5	0	0	0	107.9	S57 K61	S57-P59 WeakPolarHBondContact O-CD 3.17Å; P59-K61 PolarHBondContact O-N 3.17Å
60	D	47.7	Very low	51.8	Low	170 Å²	170	133.1 Å²	133.1	91%	0.909	80%	0.795	S	S	*	*			trans	-36.2	105.6	153.3	-104.8	-91.9	0	0	0	109.4
61	K	54.4	Low	52	Low	188 Å²	188	136.4 Å²	136.4	82%	0.817	80%	0.802	S	S	*	*			trans	-125.8	84.2	167.2	-151.4	176	-172	177	0	107.4	P59 A63	P59-K61 PolarHBondContact O-N 3.17Å; K61-A63 VanDerWaalsContact C-N 3.26Å; K61-A63 PolarHBondContact O-N 3.3Å
62	E	44.9	Very low	52.1	Low	187 Å²	187	129.6 Å²	129.6	87%	0.874	79%	0.789	S	S	*	*			trans	-42.4	91.4	157.4	-170.7	179	160.9	0	0	109.2
63	A	54.9	Low	52.1	Low	82 Å²	82	132.6 Å²	132.6	68%	0.678	79%	0.794	S	S	*	*			trans	-100.6	71	170.6	0	0	0	0	0	107.2	K61 N65	K61-A63 VanDerWaalsContact C-N 3.26Å; K61-A63 PolarHBondContact O-N 3.3Å; A63-N65 VanDerWaalsContact C-N 3.26Å; A63-N65 PolarHBondContact O-N 3.46Å
64	G	43.8	Very low	52.1	Low	68 Å²	68	131.1 Å²	131.1	70%	0.701	80%	0.797	S	S	*	*			trans	-63.4	87.8	166.8	0	0	0	0	0	109.9	Q66	G64-Q66 VanDerWaalsContact C-N 3.33Å
65	N	54.2	Low	52.6	Low	155 Å²	155	129.8 Å²	129.8	83%	0.829	79%	0.793	S	S	*	*			trans	-99.8	63.1	161.2	-74.9	10	0	0	0	107.9	A63	A63-N65 VanDerWaalsContact C-N 3.26Å; A63-N65 PolarHBondContact O-N 3.46Å
66	Q	54.5	Low	52.9	Low	174 Å²	174	130 Å²	130	81%	0.813	82%	0.815	S	S	*	*			trans	-71.7	123.7	164.2	-168.7	175.6	10.6	0	0	106.9	G64 Q68	G64-Q66 VanDerWaalsContact C-N 3.33Å; Q66-Q68 PolarHBondContact O-N 3.1Å; Q66-Q68 VanDerWaalsContact O-N 3.13Å
67	P	65.5	Low	53.2	Low	112 Å²	112	132.9 Å²	132.9	73%	0.727	82%	0.819	S	S	*	*			trans	-61	121.8	176	23.6	-30.8	0	0	0	108.4	S69	P67-S69 PolarHBondContact O-N 3.1Å
68	Q	59.4	Low	53.8	Low	192 Å²	192	133.7 Å²	133.7	90%	0.897	82%	0.819	S	S	*	*			trans	-62.8	105.2	171	-83.5	173.2	-105.3	0	0	108.2	Q66 S70	Q66-Q68 PolarHBondContact O-N 3.1Å; Q66-Q68 VanDerWaalsContact O-N 3.13Å; Q68-S70 PolarHBondContact O-N 2.94Å; Q68-S70 VanDerWaalsContact O-N 3.09Å
69	S	57.8	Low	54.2	Low	101 Å²	101	135.4 Å²	135.4	71%	0.706	82%	0.818	S	S	*	*			trans	-53.5	112.6	159.2	-46.9	0	0	0	0	107.1	P67 D71	P67-S69 PolarHBondContact O-N 3.1Å; S69-D71 VanDerWaalsContact C-N 3.25Å; S69-D71 PolarHBondContact O-N 2.79Å; S69-D71 VanDerWaalsContact O-N 3.07Å
70	S	64.3	Low	54.1	Low	120 Å²	120	136.9 Å²	136.9	84%	0.839	82%	0.824	S	S	*	*			trans	-77.6	87.8	165.2	36.9	0	0	0	0	106.7	Q68 G72	Q68-S70 PolarHBondContact O-N 2.94Å; Q68-S70 VanDerWaalsContact O-N 3.09Å; S70-G72 PolarHBondContact O-N 3.27Å
71	D	61.8	Low	54.5	Low	144 Å²	144	134.9 Å²	134.9	77%	0.77	82%	0.818	S	S	*	*			trans	-62.1	121.4	165	-92.1	-58.2	0	0	0	108.4	S69 T73	S69-D71 VanDerWaalsContact C-N 3.25Å; S69-D71 PolarHBondContact O-N 2.79Å; S69-D71 VanDerWaalsContact O-N 3.07Å; D71-T73 PolarHBondContact O-N 3.35Å
72	G	54.3	Low	54.5	Low	70 Å²	70	131.3 Å²	131.3	72%	0.722	82%	0.818	S	S	*	*			trans	-56.8	110.3	-179.6	0	0	0	0	0	110.6	S70 T74	S70-G72 PolarHBondContact O-N 3.27Å; G72-T74 VanDerWaalsContact C-N 3.35Å; G72-T74 PolarHBondContact O-N 3.15Å; G72-T74 VanDerWaalsContact O-N 3.11Å
73	T	52	Low	55.2	Low	130 Å²	130	127.4 Å²	127.4	80%	0.798	81%	0.814	S	S	*	*			trans	-75.9	98	159.8	-53.4	0	0	0	0	106.8	D71 S75	D71-T73 PolarHBondContact O-N 3.35Å; T73-S75 PolarHBondContact O-N 2.87Å
74	T	47.4	Very low	55.3	Low	139 Å²	139	130.8 Å²	130.8	85%	0.853	83%	0.825	S	S	*	*			trans	-58	123.9	154.6	53	0	0	0	0	106.9	G72	G72-T74 VanDerWaalsContact C-N 3.35Å; G72-T74 PolarHBondContact O-N 3.15Å; G72-T74 VanDerWaalsContact O-N 3.11Å
75	S	55.7	Low	56.2	Low	104 Å²	104	136.1 Å²	136.1	73%	0.727	84%	0.835	S	S	*	*			trans	-127.4	112.4	173.4	-169.8	0	0	0	0	108	T73	T73-S75 PolarHBondContact O-N 2.87Å
76	S	48	Very low	56.4	Low	192 Å²	192	134.4 Å²	134.4	100%	1.343	84%	0.836	S	S	*	*			trans	69.8	0	173.8	-57.3	0	0	0	0	118.6

Retrieved 76 of 76 residues in 45.1 ms (Link to these results)

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