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Calcium/calmodulin-dependent protein kinase II inhibitor 1

Potent and specific inhibitor of CaM-kinase II (CAMK2) (By similarity). Plays a role in the maintenance of long-term retrieval-induced memory in response to contextual fear (By similarity). Modulates blood pressure and vascular reactivity via regulation of CAMK2 activity in addition to regulation of left ventricular mass (By similarity). Mediates the NLRP3 inflammasome in cardiomyocytes via acting as an inhibitor of the MAPK14/p38 and MAPK8/JNK pathways, thereby regulating ventricular remodeling and cardiac rhythm post-myocardial infarction (By similarity). Negatively effects insulin sensitivity and promotes lipid formation in adipose tissues independent of CAMK2 signaling (By similarity).

AlphaFold DB , UniProt , Accession Q7Z7J9, Species HUMAN (Homo sapiens, Human), Gene CAMK2N1, Length 78 aa.

						>CK2N1_HUMAN|Q7Z7J9|CAMK2N1
MSEVLPYGDEKLSPYGDGGDVGQIFSCRLQDTNNFFGAGQNKRPPKLGQIGRSKRVVIEDDRIDDVLKNMTDKAPPGV
					

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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	51.3	Low	63.6	Low	225 Å²	225	143.3 Å²	143.3	100%	1.108	75%	0.749	S	S	*	*				0	117.1	0	-71	162.9	164.6	0	0	105.4	E3	M1-E3 PolarHBondContact O-N 3.2Å
2	S	63.3	Low	62.9	Low	114 Å²	114	138 Å²	138	80%	0.797	72%	0.721	S	S	*	*			trans	-74.5	112.1	173.7	51.2	0	0	0	0	106.8	V4	S2-V4 PolarHBondContact O-N 2.64Å
3	E	65.8	Low	62.7	Low	155 Å²	155	133.5 Å²	133.5	72%	0.724	71%	0.708	S	S	*	*			trans	-58.3	108.5	171.2	-59.7	-61.6	123	0	0	107.3	M1 L5	M1-E3 PolarHBondContact O-N 3.2Å; E3-L5 VanDerWaalsContact C-N 3.34Å; E3-L5 PolarHBondContact O-N 3.16Å
4	V	68.2	Low	62.2	Low	130 Å²	130	132.1 Å²	132.1	79%	0.788	71%	0.711	S	S	*	*			trans	-66.9	102.9	166	147.9	0	0	0	0	105.1	S2	S2-V4 PolarHBondContact O-N 2.64Å
5	L	67.3	Low	61.6	Low	137 Å²	137	138.1 Å²	138.1	72%	0.717	72%	0.722	S	S	*	*			trans	-63	138.6	172.7	-67.5	175.3	0	0	0	108.2	E3 Y7	E3-L5 VanDerWaalsContact C-N 3.34Å; E3-L5 PolarHBondContact O-N 3.16Å; L5-Y7 PolarHBondContact O-N 3.21Å; L5-Y7 VanDerWaalsContact O-N 3.14Å
6	P	62.7	Low	61.1	Low	120 Å²	120	133.3 Å²	133.3	78%	0.779	72%	0.715	S	S	*	*			trans	-52.1	123.7	175.5	-23.8	32.5	0	0	0	109.7	G8	P6-G8 PolarHBondContact O-N 3.11Å; P6-G8 VanDerWaalsContact O-N 3.11Å
7	Y	63.2	Low	61.1	Low	198 Å²	198	135.9 Å²	135.9	78%	0.776	73%	0.729	S	S	*	*			trans	-62.4	113.5	173.8	-108.1	-96.4	0	0	0	107.8	L5 D9	L5-Y7 PolarHBondContact O-N 3.21Å; L5-Y7 VanDerWaalsContact O-N 3.14Å; Y7-D9 PolarHBondContact O-N 3.49Å
8	G	66.1	Low	60.5	Low	34 Å²	34	132.3 Å²	132.3	35%	0.351	73%	0.729	S	S	.	*			trans	-68.4	122.1	176.9	0	0	0	0	0	110.7	P6 E10 K11	P6-G8 PolarHBondContact O-N 3.11Å; P6-G8 VanDerWaalsContact O-N 3.11Å; G8-E10 PolarHBondContact O-N 3.09Å; G8-K11 PolarHBondContact O-N 3.21Å
9	D	64.2	Low	59.9	Low	125 Å²	125	128.5 Å²	128.5	67%	0.668	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-58	-19.5	178.1	-65.6	-57.1	0	0	0	112.9	Y7 K11 L12	Y7-D9 PolarHBondContact O-N 3.49Å; D9-K11 PolarHBondContact O-N 3.05Å; D9-K11 VanDerWaalsContact O-N 3.09Å; D9-L12 HydrophobicContact CB-CD1 4.35Å; D9-L12 VanDerWaalsContact O-CB 3.31Å; D9-L12 WeakPolarHBondContact O-CB 3.38Å; D9-L12 PolarHBondContact O-N 3.36Å
10	E	67.6	Low	59.7	Low	182 Å²	182	130.9 Å²	130.9	85%	0.85	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-58.9	-20	176.6	64.5	-171.5	115.6	0	0	114.3	G8	G8-E10 PolarHBondContact O-N 3.09Å
11	K	59.5	Low	59.3	Low	156 Å²	156	130.2 Å²	130.2	68%	0.678	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-88	-9.2	175.6	-62.5	-114.1	-178.4	-175.9	0	113.1	G8 D9 S13	G8-K11 PolarHBondContact O-N 3.21Å; D9-K11 PolarHBondContact O-N 3.05Å; D9-K11 VanDerWaalsContact O-N 3.09Å; K11-S13 VanDerWaalsContact C-N 3.29Å; K11-S13 PolarHBondContact O-N 2.94Å; K11-S13 VanDerWaalsContact O-N 3.08Å
12	L	55.9	Low	59.6	Low	80 Å²	80	122.4 Å²	122.4	42%	0.419	71%	0.71	S	S	.	*			trans	-84.2	72.2	176.7	-63.1	166.2	0	0	0	109.3	D9 P14 Q23	D9-L12 HydrophobicContact CB-CD1 4.35Å; D9-L12 VanDerWaalsContact O-CB 3.31Å; D9-L12 WeakPolarHBondContact O-CB 3.38Å; D9-L12 PolarHBondContact O-N 3.36Å; L12-P14 VanDerWaalsContact O-CD 3.3Å; L12-P14 WeakPolarHBondContact O-CD 3.3Å; L12-Q23 HydrophobicContact CD2-CG 4.15Å
13	S	60.3	Low	59.3	Low	79 Å²	79	123.1 Å²	123.1	55%	0.552	70%	0.701	S	S	*	*			trans	-81.9	115.5	168.8	-167	0	0	0	0	108.6	K11 Y15	K11-S13 VanDerWaalsContact C-N 3.29Å; K11-S13 PolarHBondContact O-N 2.94Å; K11-S13 VanDerWaalsContact O-N 3.08Å; S13-Y15 PolarHBondContact O-N 2.82Å
14	P	55.8	Low	59	Low	114 Å²	114	121.6 Å²	121.6	74%	0.74	70%	0.697	S	S	*	*			trans	-65.7	118.4	176.9	25.9	-31.5	0	0	0	108.8	L12 G16	L12-P14 VanDerWaalsContact O-CD 3.3Å; L12-P14 WeakPolarHBondContact O-CD 3.3Å; P14-G16 PolarHBondContact O-N 3.16Å
15	Y	53.4	Low	58.9	Low	223 Å²	223	123.4 Å²	123.4	88%	0.875	69%	0.694	S	S	*	*			trans	-93.7	98.1	175.1	-136.3	-93.1	0	0	0	108.2	S13	S13-Y15 PolarHBondContact O-N 2.82Å
16	G	53.8	Low	58.7	Low	60 Å²	60	120 Å²	120	62%	0.619	68%	0.681	S	S	*	*	S	Bend	trans	134.5	113.8	177.8	0	0	0	0	0	111.7	P14 G18	P14-G16 PolarHBondContact O-N 3.16Å; G16-G18 PolarHBondContact O-N 2.74Å; G16-G18 VanDerWaalsContact O-N 3.16Å
17	D	60	Low	58.7	Low	179 Å²	179	120.2 Å²	120.2	96%	0.957	69%	0.685	S	S	*	*	S	Bend	trans	-67.3	102.6	164.1	-177.4	58.4	0	0	0	107.8
18	G	50.8	Low	58.5	Low	70 Å²	70	118 Å²	118	72%	0.722	68%	0.675	S	S	*	*	S	Bend	trans	108.5	117.1	167.3	0	0	0	0	0	116.3	G16	G16-G18 PolarHBondContact O-N 2.74Å; G16-G18 VanDerWaalsContact O-N 3.16Å
19	G	49.5	Very low	58.4	Low	60 Å²	60	123.5 Å²	123.5	62%	0.619	70%	0.696	S	S	*	*	S	Bend	trans	97.4	107.7	152.2	0	0	0	0	0	114.8	V21	G19-V21 WeakPolarHBondContact O-CG2 3.43Å; G19-V21 PolarHBondContact O-N 3.08Å
20	D	55.1	Low	58.5	Low	177 Å²	177	125.3 Å²	125.3	95%	0.947	70%	0.7	S	S	*	*			trans	24.5	23.4	142.1	-91.2	-56.7	0	0	0	122.4	G22	D20-G22 PolarHBondContact O-N 3.01Å
21	V	52.4	Low	58.4	Low	117 Å²	117	122 Å²	122	71%	0.709	69%	0.689	S	S	*	*			trans	-89.2	92.7	170.1	-161.6	0	0	0	0	107	G19 I24	G19-V21 WeakPolarHBondContact O-CG2 3.43Å; G19-V21 PolarHBondContact O-N 3.08Å; V21-I24 HydrophobicContact CG1-CD1 4.07Å
22	G	55.7	Low	58.5	Low	61 Å²	61	118.4 Å²	118.4	63%	0.629	68%	0.679	S	S	*	*			trans	-43	146.4	-174.5	0	0	0	0	0	114.3	D20 I24	D20-G22 PolarHBondContact O-N 3.01Å; G22-I24 WeakPolarHBondContact O-CG1 3.31Å; G22-I24 PolarHBondContact O-N 3.14Å
23	Q	58.9	Low	58.9	Low	128 Å²	128	120.3 Å²	120.3	60%	0.598	69%	0.69	S	S	*	*			trans	-17.9	86.3	178.4	-164.9	168.2	10.6	0	0	114.3	L12 F25	L12-Q23 HydrophobicContact CD2-CG 4.15Å; Q23-F25 PolarHBondContact O-N 2.7Å; Q23-F25 VanDerWaalsContact O-N 3.16Å
24	I	58.8	Low	58.9	Low	124 Å²	124	122.3 Å²	122.3	64%	0.636	70%	0.695	S	S	*	*			trans	-73.5	113.4	175.6	-62.2	175.4	0	0	0	106.6	V21 G22 S26	V21-I24 HydrophobicContact CG1-CD1 4.07Å; G22-I24 WeakPolarHBondContact O-CG1 3.31Å; G22-I24 PolarHBondContact O-N 3.14Å; I24-S26 PolarHBondContact O-N 2.88Å
25	F	65.1	Low	59.1	Low	167 Å²	167	123.3 Å²	123.3	73%	0.732	69%	0.687	S	S	*	*			trans	-63.9	81.4	166.8	-64.9	-87	0	0	0	108.4	Q23 C27	Q23-F25 PolarHBondContact O-N 2.7Å; Q23-F25 VanDerWaalsContact O-N 3.16Å; F25-C27 VanDerWaalsContact C-N 3.29Å; F25-C27 PolarHBondContact O-N 2.99Å
26	S	62.8	Low	59.5	Low	65 Å²	65	119.9 Å²	119.9	46%	0.455	68%	0.678	S	S	.	*			trans	-64	102.1	164.7	68.6	0	0	0	0	105.5	I24 R28	I24-S26 PolarHBondContact O-N 2.88Å; S26-R28 PolarHBondContact O-N 2.81Å
27	C	64	Low	59.7	Low	126 Å²	126	119.9 Å²	119.9	85%	0.851	68%	0.677	S	S	*	*			trans	-64.7	74	162.6	37.3	0	0	0	0	106.4	F25 L29	F25-C27 VanDerWaalsContact C-N 3.29Å; F25-C27 PolarHBondContact O-N 2.99Å; C27-L29 PolarHBondContact O-N 3.41Å
28	R	59.5	Low	59.6	Low	150 Å²	150	115.4 Å²	115.4	57%	0.566	67%	0.665	S	S	*	*			trans	-52.7	117.2	168.6	-69.1	-70.4	-178.8	113.6	-1.7	104.5	S26 Q30	S26-R28 PolarHBondContact O-N 2.81Å; R28-Q30 VanDerWaalsContact C-N 3.3Å; R28-Q30 PolarHBondContact O-N 3.28Å
29	L	64	Low	59.9	Low	151 Å²	151	114.1 Å²	114.1	79%	0.791	65%	0.652	S	S	*	*			trans	-51.1	104.5	168.5	-178.6	65.9	0	0	0	105.4	C27 D31	C27-L29 PolarHBondContact O-N 3.41Å; L29-D31 PolarHBondContact O-N 3Å
30	Q	65.9	Low	60.3	Low	162 Å²	162	120.4 Å²	120.4	76%	0.757	67%	0.665	S	S	*	*			trans	-56.2	139.7	178.3	-68.4	-178	-3.8	0	0	107	R28 T32	R28-Q30 VanDerWaalsContact C-N 3.3Å; R28-Q30 PolarHBondContact O-N 3.28Å; Q30-T32 PolarHBondContact O-N 2.92Å
31	D	64.4	Low	60.5	Low	114 Å²	114	119.3 Å²	119.3	61%	0.61	66%	0.659	S	S	*	*			trans	-46.5	112.7	179.7	-66.1	-56.1	0	0	0	109.5	L29 N33 N34	L29-D31 PolarHBondContact O-N 3Å; D31-N33 PolarHBondContact O-N 3.14Å; D31-N34 PolarHBondContact O-N 3.36Å; D31-N34 VanDerWaalsContact O-N 3.14Å
32	T	63	Low	61	Low	79 Å²	79	122.5 Å²	122.5	49%	0.485	66%	0.663	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.1	-11.1	-177	50.6	0	0	0	0	112	Q30 N34 F35 F36	Q30-T32 PolarHBondContact O-N 2.92Å; T32-N34 VanDerWaalsContact C-N 3.28Å; T32-N34 PolarHBondContact O-N 2.94Å; T32-F35 VanDerWaalsContact O-CB 3.27Å; T32-F35 WeakPolarHBondContact O-CB 3.33Å; T32-F35 PolarHBondContact O-N 3.05Å; T32-F35 VanDerWaalsContact O-N 3.1Å; T32-F36 WeakPolarHBondContact O-CD2 3.47Å
33	N	62.8	Low	61.7	Low	121 Å²	121	130.4 Å²	130.4	65%	0.647	67%	0.674	S	S	*	*	H	α-helix	trans	-57.3	-37.2	172.8	-69.1	-59.1	0	0	0	112.7	D31 F35 F36 G37	D31-N33 PolarHBondContact O-N 3.14Å; N33-F35 VanDerWaalsContact C-N 3.3Å; N33-F35 PolarHBondContact O-N 2.82Å; N33-F36 PolarHBondContact O-N 2.99Å; N33-G37 PolarHBondContact O-N 3.21Å
34	N	61.3	Low	62.2	Low	121 Å²	121	127.2 Å²	127.2	65%	0.647	67%	0.665	S	S	*	*	H	α-helix	trans	-71.9	-24.3	177.2	-79	72	0	0	0	113.1	D31 T32 F36 A38	D31-N34 PolarHBondContact O-N 3.36Å; D31-N34 VanDerWaalsContact O-N 3.14Å; T32-N34 VanDerWaalsContact C-N 3.28Å; T32-N34 PolarHBondContact O-N 2.94Å; N34-F36 VanDerWaalsContact C-N 3.29Å; N34-F36 PolarHBondContact O-N 2.95Å; N34-A38 WeakPolarHBondContact O-CB 3.27Å; N34-A38 PolarHBondContact O-N 3Å
35	F	59.9	Low	62.8	Low	134 Å²	134	125.2 Å²	125.2	59%	0.588	66%	0.66	S	S	*	*	H	α-helix	trans	-65.5	-33.6	176.5	-172.7	-100.5	0	0	0	112	T32 N33 P44	T32-F35 VanDerWaalsContact O-CB 3.27Å; T32-F35 WeakPolarHBondContact O-CB 3.33Å; T32-F35 PolarHBondContact O-N 3.05Å; T32-F35 VanDerWaalsContact O-N 3.1Å; N33-F35 VanDerWaalsContact C-N 3.3Å; N33-F35 PolarHBondContact O-N 2.82Å; F35-P44 HydrophobicContact CE1-CB 3.76Å; F35-P44 HydrophobicContact CE1-CG 3.66Å; F35-P44 HydrophobicContact CZ-CB 3.9Å; F35-P44 HydrophobicContact CZ-CG 4.23Å
36	F	62	Low	63.2	Low	152 Å²	152	125 Å²	125	67%	0.667	66%	0.659	S	S	*	*	H	α-helix	trans	-94.5	-25.2	176.6	-61	-75.2	0	0	0	113.5	T32 N33 N34	T32-F36 WeakPolarHBondContact O-CD2 3.47Å; N33-F36 PolarHBondContact O-N 2.99Å; N34-F36 VanDerWaalsContact C-N 3.29Å; N34-F36 PolarHBondContact O-N 2.95Å
37	G	57.6	Low	63.6	Low	59 Å²	59	129.2 Å²	129.2	61%	0.608	68%	0.675	S	S	*	*	H	α-helix	trans	-84	-30.7	-174.9	0	0	0	0	0	115.3	N33 G39	N33-G37 PolarHBondContact O-N 3.21Å; G37-G39 VanDerWaalsContact C-N 3.31Å; G37-G39 PolarHBondContact O-N 3.45Å
38	A	58.4	Low	64	Low	85 Å²	85	127 Å²	127	70%	0.702	67%	0.673	S	S	*	*	S	Bend	trans	-83.7	70.8	-176	0	0	0	0	0	112.1	N34	N34-A38 WeakPolarHBondContact O-CB 3.27Å; N34-A38 PolarHBondContact O-N 3Å
39	G	56.4	Low	64.8	Low	43 Å²	43	126.2 Å²	126.2	44%	0.443	68%	0.676	S	S	.	*			trans	105.9	95.6	166.1	0	0	0	0	0	113.7	G37 N41 K42	G37-G39 VanDerWaalsContact C-N 3.31Å; G37-G39 PolarHBondContact O-N 3.45Å; G39-N41 PolarHBondContact O-N 3.4Å; G39-K42 PolarHBondContact O-N 3.43Å; G39-K42 VanDerWaalsContact O-N 3.09Å
40	Q	59.3	Low	65.1	Low	192 Å²	192	123.9 Å²	123.9	90%	0.897	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-2.9	177.3	-54.3	-152.8	-73.8	0	0	115.6
41	N	59	Low	65.4	Low	154 Å²	154	119 Å²	119	82%	0.824	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	-2.7	-178	-69.2	-52.5	0	0	0	114.6	G39	G39-N41 PolarHBondContact O-N 3.4Å
42	K	62.9	Low	65.7	Low	184 Å²	184	125.3 Å²	125.3	80%	0.8	67%	0.672	S	S	*	*			trans	-108.4	79.9	174	-61.9	-61.5	-172.7	180	0	108.6	G39	G39-K42 PolarHBondContact O-N 3.43Å; G39-K42 VanDerWaalsContact O-N 3.09Å
43	R	70.3	Confident	66.2	Low	227 Å²	227	126.6 Å²	126.6	86%	0.857	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-47.3	131.9	169.2	-68.6	-179.1	-178.9	-178.3	-0.8	108.2
44	P	69	Low	66.8	Low	62 Å²	62	130 Å²	130	40%	0.403	69%	0.693	S	S	.	*	P	Polyproline II helix	trans	-49.5	134.9	175.3	-28.5	34.8	0	0	0	110.1	F35 K46	F35-P44 HydrophobicContact CE1-CB 3.76Å; F35-P44 HydrophobicContact CE1-CG 3.66Å; F35-P44 HydrophobicContact CZ-CB 3.9Å; F35-P44 HydrophobicContact CZ-CG 4.23Å; P44-K46 PolarHBondContact O-N 3.1Å
45	P	71.4	Confident	67.6	Low	81 Å²	81	135.2 Å²	135.2	53%	0.526	70%	0.704	S	S	.	*	P	Polyproline II helix	trans	-58.9	127.4	179.3	24.1	-32	0	0	0	108.5	Q49 I50	P45-Q49 VanDerWaalsContact CA-OE1 3.29Å; P45-Q49 HydrophobicContact CB-CB 4.26Å; P45-I50 HydrophobicContact CB-CG2 4.5Å
46	K	73.7	Confident	68.7	Low	163 Å²	163	134.7 Å²	134.7	71%	0.709	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-60.4	152.1	174.2	-67.5	-177.6	176.3	-178.7	0	108.5	P44 G48 Q49 I50	P44-K46 PolarHBondContact O-N 3.1Å; K46-G48 PolarHBondContact O-N 2.89Å; K46-Q49 HydrophobicContact CB-CG 4.33Å; K46-Q49 WeakPolarHBondContact O-CA 3.4Å; K46-Q49 WeakPolarHBondContact O-CB 2.97Å; K46-Q49 PolarHBondContact O-N 3.02Å; K46-I50 PolarHBondContact O-N 3.45Å
47	L	70.2	Confident	69.8	Low	153 Å²	153	133.3 Å²	133.3	80%	0.801	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.2	-27.6	174.9	-71.5	172.6	0	0	0	112.9	Q49 I50	L47-Q49 VanDerWaalsContact C-N 3.33Å; L47-I50 HydrophobicContact CD2-CD1 4.11Å; L47-I50 WeakPolarHBondContact O-CG1 3.22Å
48	G	73.6	Confident	71.1	Confident	79 Å²	79	135.1 Å²	135.1	81%	0.814	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-11	173.4	0	0	0	0	0	115.8	K46	K46-G48 PolarHBondContact O-N 2.89Å
49	Q	76.7	Confident	72.5	Confident	135 Å²	135	139.8 Å²	139.8	63%	0.631	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-20.1	177.5	-67.8	179.4	-49.7	0	0	112.8	P45 K46 L47 G51	P45-Q49 VanDerWaalsContact CA-OE1 3.29Å; P45-Q49 HydrophobicContact CB-CB 4.26Å; K46-Q49 HydrophobicContact CB-CG 4.33Å; K46-Q49 WeakPolarHBondContact O-CA 3.4Å; K46-Q49 WeakPolarHBondContact O-CB 2.97Å; K46-Q49 PolarHBondContact O-N 3.02Å; L47-Q49 VanDerWaalsContact C-N 3.33Å; Q49-G51 PolarHBondContact O-N 3.43Å
50	I	70	Confident	74.2	Confident	101 Å²	101	140.7 Å²	140.7	52%	0.518	71%	0.712	S	S	.	*	S	Bend	trans	-73.8	110.6	167.7	60.2	167.9	0	0	0	106.9	P45 K46 L47	P45-I50 HydrophobicContact CB-CG2 4.5Å; K46-I50 PolarHBondContact O-N 3.45Å; L47-I50 HydrophobicContact CD2-CD1 4.11Å; L47-I50 WeakPolarHBondContact O-CG1 3.22Å
51	G	71.3	Confident	75.6	Confident	59 Å²	59	138.6 Å²	138.6	61%	0.608	71%	0.707	S	S	*	*			trans	-55.5	146.4	-178.5	0	0	0	0	0	111.7	Q49 S53	Q49-G51 PolarHBondContact O-N 3.43Å; G51-S53 PolarHBondContact O-N 3.09Å
52	R	72	Confident	77.1	Confident	248 Å²	248	139.6 Å²	139.6	94%	0.936	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	20.1	175.8	-65.9	179.1	68.1	153.4	0.8	113.5	K54	R52-K54 VanDerWaalsContact C-N 3.31Å; R52-K54 PolarHBondContact O-N 2.76Å
53	S	72.7	Confident	78.4	Confident	105 Å²	105	132.8 Å²	132.8	73%	0.734	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-16.6	-168.3	55.2	0	0	0	0	114.1	G51 R55	G51-S53 PolarHBondContact O-N 3.09Å; S53-R55 PolarHBondContact O-N 2.99Å
54	K	75.3	Confident	79.1	Confident	194 Å²	194	127.2 Å²	127.2	84%	0.843	66%	0.658	S	S	*	*			trans	-78.3	88.1	175.6	-63.5	-171.9	-177.8	-176.7	0	109.6	R52	R52-K54 VanDerWaalsContact C-N 3.31Å; R52-K54 PolarHBondContact O-N 2.76Å
55	R	77.7	Confident	80.1	Confident	230 Å²	230	129.6 Å²	129.6	87%	0.868	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-79.9	123.1	164.7	-63.1	-174.6	-177.7	-160.1	0.7	107.6	S53	S53-R55 PolarHBondContact O-N 2.99Å
56	V	82.5	Confident	80.9	Confident	122 Å²	122	129 Å²	129	74%	0.739	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-81.6	123.5	168.5	-176.4	0	0	0	0	106.4	I58	V56-I58 HydrophobicContact CG1-CG1 4.21Å
57	V	85.2	Confident	81.5	Confident	123 Å²	123	125.2 Å²	125.2	75%	0.745	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-81.3	126.1	167.8	-179.7	0	0	0	0	106.4	E59	V57-E59 HydrophobicContact CG1-CG 4.28Å
58	I	86.2	Confident	82.3	Confident	97 Å²	97	124.6 Å²	124.6	50%	0.497	64%	0.64	S	S	.	*			trans	-111.6	120	175.5	-57.5	173.4	0	0	0	106.1	V56 D60 I63	V56-I58 HydrophobicContact CG1-CG1 4.21Å; I58-D60 VanDerWaalsContact C-N 3.33Å; I58-D60 HydrophobicContact CG2-CB 4.18Å; I58-I63 HydrophobicContact CB-CG2 4.44Å; I58-I63 HydrophobicContact CD1-CG1 4.22Å; I58-I63 HydrophobicContact CG2-CB 4.2Å; I58-I63 HydrophobicContact CG2-CG1 4.09Å; I58-I63 HydrophobicContact CG2-CG2 4.17Å
59	E	87.3	Confident	82.7	Confident	183 Å²	183	126.5 Å²	126.5	86%	0.855	63%	0.631	S	S	*	*			trans	-95.6	22.5	-176.2	-58.1	176.4	150.7	0	0	112.3	V57	V57-E59 HydrophobicContact CG1-CG 4.28Å
60	D	91.2	Very high	82.9	Confident	63 Å²	63	126.3 Å²	126.3	34%	0.337	63%	0.632	S	S	.	*			trans	-94.4	109.7	174.2	-172.7	-21.6	0	0	0	108.8	I58 R62 I63	I58-D60 VanDerWaalsContact C-N 3.33Å; I58-D60 HydrophobicContact CG2-CB 4.18Å; D60-R62 PolarHBondContact O-N 3.36Å; D60-R62 WeakPolarHBondContact OD1-CB 3.1Å; D60-R62 IonicContact OD1-CZ 3.84Å; D60-R62 PolarHBondContact OD1-N 3.22Å; D60-R62 IonicContact OD1-NE 3.05Å; D60-R62 PolarHBondContact OD1-NE 3.42Å; D60-R62 IonicContact OD1-NH2 3.71Å; D60-R62 IonicContact OD2-CZ 3.62Å; D60-R62 IonicContact OD2-NE 3.55Å; D60-R62 IonicContact OD2-NH2 2.82Å; D60-R62 PolarHBondContact OD2-NH2 2.87Å; D60-I63 HydrophobicContact CB-CB 4.46Å; D60-I63 VanDerWaalsContact O-CB 3.22Å; D60-I63 WeakPolarHBondContact O-CB 3.37Å; D60-I63 WeakPolarHBondContact O-CG2 3.41Å; D60-I63 PolarHBondContact O-N 3.01Å
61	D	88.6	Confident	83	Confident	148 Å²	148	126.2 Å²	126.2	79%	0.791	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-23	-178.7	-61.2	-33	0	0	0	113.5	I63	D61-I63 VanDerWaalsContact C-N 3.26Å; D61-I63 PolarHBondContact O-N 3.43Å
62	R	91.3	Very high	82.9	Confident	174 Å²	174	129.6 Å²	129.6	66%	0.657	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-11.7	177.8	-56.3	170.8	-62	170.2	6.8	112.6	D60 D64	D60-R62 PolarHBondContact O-N 3.36Å; D60-R62 WeakPolarHBondContact OD1-CB 3.1Å; D60-R62 IonicContact OD1-CZ 3.84Å; D60-R62 PolarHBondContact OD1-N 3.22Å; D60-R62 IonicContact OD1-NE 3.05Å; D60-R62 PolarHBondContact OD1-NE 3.42Å; D60-R62 IonicContact OD1-NH2 3.71Å; D60-R62 IonicContact OD2-CZ 3.62Å; D60-R62 IonicContact OD2-NE 3.55Å; D60-R62 IonicContact OD2-NH2 2.82Å; D60-R62 PolarHBondContact OD2-NH2 2.87Å; R62-D64 VanDerWaalsContact C-N 3.29Å; R62-D64 PolarHBondContact O-N 3.35Å
63	I	89.6	Confident	82.6	Confident	42 Å²	42	126.5 Å²	126.5	22%	0.215	63%	0.634	C	S	.	*	H	α-helix	trans	-67.3	-32.2	-175.9	-162.1	59.5	0	0	0	112	I58 D60 D61 D65 V66 L67	I58-I63 HydrophobicContact CB-CG2 4.44Å; I58-I63 HydrophobicContact CD1-CG1 4.22Å; I58-I63 HydrophobicContact CG2-CB 4.2Å; I58-I63 HydrophobicContact CG2-CG1 4.09Å; I58-I63 HydrophobicContact CG2-CG2 4.17Å; D60-I63 HydrophobicContact CB-CB 4.46Å; D60-I63 VanDerWaalsContact O-CB 3.22Å; D60-I63 WeakPolarHBondContact O-CB 3.37Å; D60-I63 WeakPolarHBondContact O-CG2 3.41Å; D60-I63 PolarHBondContact O-N 3.01Å; D61-I63 VanDerWaalsContact C-N 3.26Å; D61-I63 PolarHBondContact O-N 3.43Å; I63-D65 VanDerWaalsContact C-N 3.34Å; I63-D65 PolarHBondContact O-N 3.47Å; I63-V66 PolarHBondContact O-N 3.05Å; I63-L67 HydrophobicContact CG1-CD1 3.78Å; I63-L67 HydrophobicContact CG1-CG 4.12Å; I63-L67 HydrophobicContact CG2-CD1 4.33Å; I63-L67 WeakPolarHBondContact O-CB 3.39Å; I63-L67 WeakPolarHBondContact O-CG 3.47Å; I63-L67 PolarHBondContact O-N 3Å
64	D	86.6	Confident	82.2	Confident	110 Å²	110	125 Å²	125	59%	0.588	63%	0.628	S	S	*	*	H	α-helix	trans	-62.8	-41.6	-177.8	-74.9	-25.1	0	0	0	111.6	R62 V66 L67 K68	R62-D64 VanDerWaalsContact C-N 3.29Å; R62-D64 PolarHBondContact O-N 3.35Å; D64-V66 VanDerWaalsContact C-N 3.34Å; D64-V66 PolarHBondContact O-N 2.92Å; D64-L67 PolarHBondContact O-N 3.2Å; D64-K68 VanDerWaalsContact O-CB 3.28Å; D64-K68 WeakPolarHBondContact O-CB 3.28Å; D64-K68 PolarHBondContact O-N 3.43Å
65	D	89.4	Confident	81.8	Confident	111 Å²	111	120.8 Å²	120.8	59%	0.594	62%	0.62	S	S	*	*	H	α-helix	trans	-64.2	-40	176.7	-69.7	-30.5	0	0	0	111.7	I63 N69	I63-D65 VanDerWaalsContact C-N 3.34Å; I63-D65 PolarHBondContact O-N 3.47Å; D65-N69 VanDerWaalsContact O-CG 3.27Å; D65-N69 PolarHBondContact O-N 3.2Å; D65-N69 PolarHBondContact O-ND2 3.33Å
66	V	88.2	Confident	81.2	Confident	70 Å²	70	116 Å²	116	42%	0.424	62%	0.619	S	S	.	*	H	α-helix	trans	-68.1	-45.2	177.9	178.3	0	0	0	0	111	I63 D64 N69 M70	I63-V66 PolarHBondContact O-N 3.05Å; D64-V66 VanDerWaalsContact C-N 3.34Å; D64-V66 PolarHBondContact O-N 2.92Å; V66-N69 PolarHBondContact O-N 3.49Å; V66-M70 HydrophobicContact CG1-CE 3.88Å; V66-M70 PolarHBondContact O-N 2.76Å
67	L	85.4	Confident	80.5	Confident	83 Å²	83	113.4 Å²	113.4	44%	0.435	62%	0.617	S	S	.	*	H	α-helix	trans	-65.4	-38	179.6	-77.6	167.2	0	0	0	112.4	I63 D64 M70 T71	I63-L67 HydrophobicContact CG1-CD1 3.78Å; I63-L67 HydrophobicContact CG1-CG 4.12Å; I63-L67 HydrophobicContact CG2-CD1 4.33Å; I63-L67 WeakPolarHBondContact O-CB 3.39Å; I63-L67 WeakPolarHBondContact O-CG 3.47Å; I63-L67 PolarHBondContact O-N 3Å; D64-L67 PolarHBondContact O-N 3.2Å; L67-M70 PolarHBondContact O-N 3.07Å; L67-T71 PolarHBondContact O-N 3.21Å; L67-T71 VanDerWaalsContact O-N 3.1Å; L67-T71 PolarHBondContact O-OG1 3.16Å
68	K	86.8	Confident	78.7	Confident	139 Å²	139	118.2 Å²	118.2	60%	0.604	65%	0.646	S	S	*	*	H	α-helix	trans	-60.4	-48.2	176.7	-173.4	173.4	-178.9	-179.3	0	111.3	D64 M70 T71 D72	D64-K68 VanDerWaalsContact O-CB 3.28Å; D64-K68 WeakPolarHBondContact O-CB 3.28Å; D64-K68 PolarHBondContact O-N 3.43Å; K68-M70 PolarHBondContact O-N 3.1Å; K68-M70 VanDerWaalsContact O-N 3.16Å; K68-T71 PolarHBondContact O-N 3.44Å; K68-D72 PolarHBondContact O-N 2.99Å
69	N	83.8	Confident	78.3	Confident	119 Å²	119	119.3 Å²	119.3	64%	0.636	65%	0.654	S	S	*	*	H	α-helix	trans	-61.5	-24.9	178	-67.2	-29.1	0	0	0	113.4	D65 V66	D65-N69 VanDerWaalsContact O-CG 3.27Å; D65-N69 PolarHBondContact O-N 3.2Å; D65-N69 PolarHBondContact O-ND2 3.33Å; V66-N69 PolarHBondContact O-N 3.49Å
70	M	79.5	Confident	77.8	Confident	131 Å²	131	115.9 Å²	115.9	65%	0.645	64%	0.643	S	S	*	*	H	α-helix	trans	-82.5	-31.5	175.2	-67.2	-177.1	-176.7	0	0	113.3	V66 L67 K68 K73	V66-M70 HydrophobicContact CG1-CE 3.88Å; V66-M70 PolarHBondContact O-N 2.76Å; L67-M70 PolarHBondContact O-N 3.07Å; K68-M70 PolarHBondContact O-N 3.1Å; K68-M70 VanDerWaalsContact O-N 3.16Å; M70-K73 PolarHBondContact O-N 3.16Å
71	T	72.3	Confident	77.1	Confident	100 Å²	100	118.8 Å²	118.8	61%	0.613	66%	0.66	S	S	*	*	H	α-helix	trans	-70.6	-36.5	-176	-57.5	0	0	0	0	112	L67 K68 K73 A74	L67-T71 PolarHBondContact O-N 3.21Å; L67-T71 VanDerWaalsContact O-N 3.1Å; L67-T71 PolarHBondContact O-OG1 3.16Å; K68-T71 PolarHBondContact O-N 3.44Å; T71-K73 PolarHBondContact O-N 3.07Å; T71-K73 VanDerWaalsContact O-N 3.16Å; T71-A74 PolarHBondContact O-N 3.42Å
72	D	69.5	Low	76.4	Confident	129 Å²	129	117.1 Å²	117.1	69%	0.69	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-18	-179.8	-65.9	-34.6	0	0	0	113	K68	K68-D72 PolarHBondContact O-N 2.99Å
73	K	66.3	Low	75.4	Confident	183 Å²	183	113.6 Å²	113.6	80%	0.796	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	32.2	173.4	-112.1	-136.4	179.8	-173	0	112.9	M70 T71 P75	M70-K73 PolarHBondContact O-N 3.16Å; T71-K73 PolarHBondContact O-N 3.07Å; T71-K73 VanDerWaalsContact O-N 3.16Å; K73-P75 WeakPolarHBondContact O-CD 3.33Å; K73-P75 VanDerWaalsContact O-N 3.11Å
74	A	63.7	Low	74.5	Confident	73 Å²	73	118.3 Å²	118.3	60%	0.603	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-54.9	118.9	161.2	0	0	0	0	0	107.9	T71	T71-A74 PolarHBondContact O-N 3.42Å
75	P	65.8	Low	73.6	Confident	106 Å²	106	118.9 Å²	118.9	69%	0.688	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-58.9	139	175.1	23.9	-30.8	0	0	0	107.8	K73 G77	K73-P75 WeakPolarHBondContact O-CD 3.33Å; K73-P75 VanDerWaalsContact O-N 3.11Å; P75-G77 PolarHBondContact O-N 2.96Å
76	P	65.7	Low	72.4	Confident	129 Å²	129	119.5 Å²	119.5	84%	0.838	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-53.6	118.5	168.6	22.5	-30	0	0	0	106.4
77	G	68.2	Low	71.1	Confident	69 Å²	69	123.7 Å²	123.7	71%	0.711	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-53.4	142.6	-175.8	0	0	0	0	0	110.6	P75	P75-G77 PolarHBondContact O-N 2.96Å
78	V	46.3	Very low	69.8	Low	223 Å²	223	127.4 Å²	127.4	100%	1.352	74%	0.743	S	S	*	*			trans	-39.6	0	158.9	-83.3	0	0	0	0	113

Retrieved 78 of 78 residues in 71.2 ms (Link to these results)

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