DPY30_HUMAN Loading...

Protein dpy-30 homolog

As part of the MLL1/MLL complex, involved in the methylation of histone H3 at 'Lys-4', particularly trimethylation. Histone H3 'Lys-4' methylation represents a specific tag for epigenetic transcriptional activation. May play some role in histone H3 acetylation. In a teratocarcinoma cell, plays a crucial role in retinoic acid-induced differentiation along the neural lineage, regulating gene induction and H3 'Lys-4' methylation at key developmental loci. May also play an indirect or direct role in endosomal transport.

AlphaFold DB , UniProt , Accession Q9C005, Species HUMAN (Homo sapiens, Human), Gene DPY30, Length 99 aa.

						>DPY30_HUMAN|Q9C005|DPY30
MEPEQMLEGQTQVAENPHSEYGLTDNVERIVENEKINAEKSSKQKVDLQSLPTRAYLDQTVVPILLQGLAVLAKERPPNPIEFLASYLLKNKAQFEDRN
					

Structure Viewer

Loading PAE data...

(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	48.4	Very low	237 Å²	237	163.5 Å²	163.5	100%	1.167	86%	0.856	S	S	*	*				0	100.9	0	-85.8	-173.2	-90	0	0	106.9
2	E	43.9	Very low	48.2	Very low	187 Å²	187	166.3 Å²	166.3	87%	0.874	86%	0.862	S	S	*	*			trans	58.5	150.5	139.1	-67.8	-143	112.9	0	0	121.7
3	P	54.3	Low	48.4	Very low	108 Å²	108	163.9 Å²	163.9	70%	0.701	86%	0.858	S	S	*	*				-131.7	163.4	-121.8	40.3	-24.5	0	0	0	115.3
4	E	47.6	Very low	49	Very low	189 Å²	189	159 Å²	159	88%	0.883	85%	0.853	S	S	*	*			trans	-146.4	110.3	161.3	-70.8	-172.5	105.7	0	0	108.1
5	Q	52.3	Low	49	Very low	183 Å²	183	160.6 Å²	160.6	86%	0.855	85%	0.853	S	S	*	*				39.9	122.2	101.8	-70.9	-179.4	35.3	0	0	111.8
6	M	53.1	Low	49.3	Very low	174 Å²	174	158.8 Å²	158.8	86%	0.857	84%	0.844	S	S	*	*				-174.1	157.7	72.1	-66.7	-177.2	-58.2	0	0	111.4
7	L	56.4	Low	49.9	Very low	165 Å²	165	155.4 Å²	155.4	86%	0.864	83%	0.833	S	S	*	*			trans	106.7	102.8	140.4	-142	69.5	0	0	0	118.8
8	E	44.2	Very low	50.2	Low	170 Å²	170	155.3 Å²	155.3	79%	0.794	83%	0.826	S	S	*	*			trans	-61.6	140.8	173.2	-66.4	152.9	109.2	0	0	113.1
9	G	46.7	Very low	50.4	Low	76 Å²	76	153.3 Å²	153.3	78%	0.784	83%	0.826	S	S	*	*			trans	-139.3	69.1	164.7	0	0	0	0	0	108.8	T11	G9-T11 PolarHBondContact O-N 3.42Å
10	Q	44.9	Very low	50.5	Low	179 Å²	179	154.3 Å²	154.3	84%	0.836	83%	0.825	S	S	*	*			trans	-68.7	119.8	172.1	-84.1	179.8	-14.5	0	0	109.6	Q12	Q10-Q12 PolarHBondContact O-N 3.42Å
11	T	49.9	Very low	50.6	Low	130 Å²	130	154.8 Å²	154.8	80%	0.798	82%	0.816	S	S	*	*			trans	-64.2	123.3	173.2	28.7	0	0	0	0	110.9	G9 V13	G9-T11 PolarHBondContact O-N 3.42Å; T11-V13 PolarHBondContact O-N 3.49Å
12	Q	45.6	Very low	51.3	Low	198 Å²	198	146.2 Å²	146.2	93%	0.925	79%	0.788	S	S	*	*			trans	-57.9	113.1	171.4	-74.7	166.3	5	0	0	110.3	Q10	Q10-Q12 PolarHBondContact O-N 3.42Å
13	V	51.6	Low	51.9	Low	135 Å²	135	143.1 Å²	143.1	82%	0.818	78%	0.777	S	S	*	*			trans	-92.5	117.6	164.9	-170.6	0	0	0	0	106.2	T11 E15	T11-V13 PolarHBondContact O-N 3.49Å; V13-E15 PolarHBondContact O-N 3.37Å; V13-E15 VanDerWaalsContact O-N 3.08Å
14	A	56.5	Low	52.2	Low	95 Å²	95	142 Å²	142	79%	0.785	77%	0.769	S	S	*	*			trans	-55.2	111.2	-175.3	0	0	0	0	0	111.7	N16	A14-N16 PolarHBondContact O-N 2.69Å
15	E	49	Very low	52.9	Low	183 Å²	183	137 Å²	137	86%	0.855	75%	0.748	S	S	*	*			trans	-69.3	105.5	170	-140.6	177.6	103.8	0	0	107.5	V13 P17	V13-E15 PolarHBondContact O-N 3.37Å; V13-E15 VanDerWaalsContact O-N 3.08Å; E15-P17 WeakPolarHBondContact O-CD 3.32Å
16	N	54	Low	53.4	Low	131 Å²	131	132.3 Å²	132.3	70%	0.701	73%	0.729	S	S	*	*			trans	-95.9	100.7	173	-145.1	-5.6	0	0	0	106.4	A14 H18 S19	A14-N16 PolarHBondContact O-N 2.69Å; N16-H18 PolarHBondContact O-N 3.19Å; N16-S19 PolarHBondContact O-N 3.5Å; N16-S19 PolarHBondContact O-OG 2.8Å
17	P	59	Low	54.1	Low	102 Å²	102	127.6 Å²	127.6	66%	0.662	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	27.2	-161.1	31.2	-36.7	0	0	0	114.5	E15	E15-P17 WeakPolarHBondContact O-CD 3.32Å
18	H	56.1	Low	54.5	Low	154 Å²	154	126 Å²	126	71%	0.713	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.7	3.7	177.1	-123.2	3.2	0	0	0	114.3	N16 E20 Y21	N16-H18 PolarHBondContact O-N 3.19Å; H18-E20 VanDerWaalsContact C-N 3.25Å; H18-E20 PolarHBondContact O-N 3.21Å; H18-Y21 AromaticContact ND1-CD2 3.94Å
19	S	53.5	Low	55.6	Low	116 Å²	116	124.9 Å²	124.9	81%	0.811	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-7.2	172.4	40	0	0	0	0	114.4	N16	N16-S19 PolarHBondContact O-N 3.5Å; N16-S19 PolarHBondContact O-OG 2.8Å
20	E	52.9	Low	56.7	Low	174 Å²	174	126.4 Å²	126.4	81%	0.813	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-11	-171.8	-160.7	173.9	103.3	0	0	114.7	H18 G22	H18-E20 VanDerWaalsContact C-N 3.25Å; H18-E20 PolarHBondContact O-N 3.21Å; E20-G22 PolarHBondContact O-N 3.08Å
21	Y	52.4	Low	57.9	Low	165 Å²	165	122 Å²	122	65%	0.647	66%	0.66	S	S	*	*	S	Bend	trans	-92.8	103.1	174.4	-69	-87.9	0	0	0	109	H18 L23	H18-Y21 AromaticContact ND1-CD2 3.94Å; Y21-L23 PolarHBondContact O-N 3.21Å
22	G	53.3	Low	58.7	Low	56 Å²	56	121.5 Å²	121.5	58%	0.577	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	44.5	176.7	0	0	0	0	0	115.4	E20	E20-G22 PolarHBondContact O-N 3.08Å
23	L	57.1	Low	59.6	Low	122 Å²	122	117.6 Å²	117.6	64%	0.639	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-14.5	173.4	-140.9	72.8	0	0	0	111.1	Y21 V27	Y21-L23 PolarHBondContact O-N 3.21Å; L23-V27 HydrophobicContact CG-CG2 4.45Å; L23-V27 WeakPolarHBondContact O-CB 3.18Å; L23-V27 WeakPolarHBondContact O-CG2 3.17Å; L23-V27 PolarHBondContact O-N 3.02Å; L23-V27 VanDerWaalsContact O-N 3.11Å
24	T	60.8	Low	60.1	Low	86 Å²	86	117.9 Å²	117.9	53%	0.528	63%	0.627	S	S	.	*	H	α-helix	trans	-65.4	-46.5	-179.2	50.8	0	0	0	0	112.1	N26 V27 E28	T24-N26 PolarHBondContact O-N 3.07Å; T24-V27 PolarHBondContact O-N 2.83Å; T24-E28 WeakPolarHBondContact O-CB 3.41Å; T24-E28 WeakPolarHBondContact O-CG 3.36Å; T24-E28 PolarHBondContact O-N 3.35Å
25	D	61.8	Low	60.3	Low	83 Å²	83	119 Å²	119	44%	0.444	61%	0.614	S	S	.	*	H	α-helix	trans	-65.3	-37.6	-177.4	-66	-86	0	0	0	113	R29	D25-R29 WeakPolarHBondContact O-CB 3.36Å; D25-R29 WeakPolarHBondContact O-CG 3.34Å; D25-R29 PolarHBondContact O-N 3.11Å
26	N	63.7	Low	60.8	Low	84 Å²	84	113.2 Å²	113.2	45%	0.449	59%	0.588	S	S	.	*	H	α-helix	trans	-76.2	-37	-179.9	-68.4	-36.4	0	0	0	111.4	T24 I30	T24-N26 PolarHBondContact O-N 3.07Å; N26-I30 WeakPolarHBondContact O-CD1 3.35Å; N26-I30 WeakPolarHBondContact O-CG1 3.47Å; N26-I30 PolarHBondContact O-N 3.46Å
27	V	66.8	Low	61	Low	76 Å²	76	112.6 Å²	112.6	46%	0.461	59%	0.585	S	S	.	*	H	α-helix	trans	-68.9	-43.4	175.3	173.8	0	0	0	0	110.7	L23 T24 R29 I30 V31	L23-V27 HydrophobicContact CG-CG2 4.45Å; L23-V27 WeakPolarHBondContact O-CB 3.18Å; L23-V27 WeakPolarHBondContact O-CG2 3.17Å; L23-V27 PolarHBondContact O-N 3.02Å; L23-V27 VanDerWaalsContact O-N 3.11Å; T24-V27 PolarHBondContact O-N 2.83Å; V27-R29 PolarHBondContact O-N 3.38Å; V27-I30 PolarHBondContact O-N 3.29Å; V27-V31 HydrophobicContact CG1-CG2 4.32Å; V27-V31 WeakPolarHBondContact O-CB 3.23Å; V27-V31 VanDerWaalsContact O-CG2 3.26Å; V27-V31 WeakPolarHBondContact O-CG2 3.26Å; V27-V31 PolarHBondContact O-N 3.47Å
28	E	65.4	Low	60.9	Low	130 Å²	130	110.8 Å²	110.8	61%	0.607	58%	0.579	S	S	*	*	H	α-helix	trans	-59.2	-44.6	173.7	-82.1	178.8	158.7	0	0	111.5	T24 I30 V31 E32	T24-E28 WeakPolarHBondContact O-CB 3.41Å; T24-E28 WeakPolarHBondContact O-CG 3.36Å; T24-E28 PolarHBondContact O-N 3.35Å; E28-I30 PolarHBondContact O-N 2.9Å; E28-V31 PolarHBondContact O-N 2.79Å; E28-E32 VanDerWaalsContact O-CB 3.23Å; E28-E32 WeakPolarHBondContact O-CB 3.14Å; E28-E32 PolarHBondContact O-N 3.35Å
29	R	67	Low	60.7	Low	148 Å²	148	109 Å²	109	56%	0.558	57%	0.571	S	S	*	*	H	α-helix	trans	-63.1	-37.3	175.6	-74.3	174.7	-157	161.1	7.3	113.4	D25 V27 N33	D25-R29 WeakPolarHBondContact O-CB 3.36Å; D25-R29 WeakPolarHBondContact O-CG 3.34Å; D25-R29 PolarHBondContact O-N 3.11Å; V27-R29 PolarHBondContact O-N 3.38Å; R29-N33 WeakPolarHBondContact O-CB 3.42Å; R29-N33 PolarHBondContact O-N 3.22Å
30	I	68.9	Low	60.6	Low	107 Å²	107	110.3 Å²	110.3	55%	0.549	56%	0.562	S	S	.	*	H	α-helix	trans	-68.3	-45.7	177.2	-68.8	162.1	0	0	0	110.1	N26 V27 E28 E32 N33 E34	N26-I30 WeakPolarHBondContact O-CD1 3.35Å; N26-I30 WeakPolarHBondContact O-CG1 3.47Å; N26-I30 PolarHBondContact O-N 3.46Å; V27-I30 PolarHBondContact O-N 3.29Å; E28-I30 PolarHBondContact O-N 2.9Å; I30-E32 VanDerWaalsContact C-N 3.33Å; I30-E32 PolarHBondContact O-N 2.91Å; I30-N33 PolarHBondContact O-N 3.25Å; I30-E34 PolarHBondContact O-N 2.97Å
31	V	70.4	Confident	60.5	Low	87 Å²	87	106.9 Å²	106.9	53%	0.527	56%	0.557	S	S	.	*	H	α-helix	trans	-63.1	-39.8	176.7	173.8	0	0	0	0	111	V27 E28 E34 K35	V27-V31 HydrophobicContact CG1-CG2 4.32Å; V27-V31 WeakPolarHBondContact O-CB 3.23Å; V27-V31 VanDerWaalsContact O-CG2 3.26Å; V27-V31 WeakPolarHBondContact O-CG2 3.26Å; V27-V31 PolarHBondContact O-N 3.47Å; E28-V31 PolarHBondContact O-N 2.79Å; V31-E34 PolarHBondContact O-N 3.46Å; V31-K35 WeakPolarHBondContact O-CB 3.44Å; V31-K35 PolarHBondContact O-N 2.83Å
32	E	66.9	Low	60.5	Low	119 Å²	119	102.9 Å²	102.9	56%	0.556	55%	0.553	S	S	*	*	H	α-helix	trans	-67.6	-41.2	176	-164.8	177.1	172.2	0	0	111.4	E28 I30 K35 I36	E28-E32 VanDerWaalsContact O-CB 3.23Å; E28-E32 WeakPolarHBondContact O-CB 3.14Å; E28-E32 PolarHBondContact O-N 3.35Å; I30-E32 VanDerWaalsContact C-N 3.33Å; I30-E32 PolarHBondContact O-N 2.91Å; E32-K35 PolarHBondContact O-N 3.43Å; E32-I36 HydrophobicContact CG-CD1 4Å; E32-I36 WeakPolarHBondContact O-CB 3.35Å; E32-I36 WeakPolarHBondContact O-CD1 3.36Å; E32-I36 WeakPolarHBondContact O-CG1 3.48Å; E32-I36 PolarHBondContact O-N 2.87Å
33	N	63.8	Low	60.5	Low	116 Å²	116	109.5 Å²	109.5	62%	0.62	57%	0.566	S	S	*	*	H	α-helix	trans	-64.4	-40	173.9	-105.7	-6.3	0	0	0	112.7	R29 I30 I36 N37	R29-N33 WeakPolarHBondContact O-CB 3.42Å; R29-N33 PolarHBondContact O-N 3.22Å; I30-N33 PolarHBondContact O-N 3.25Å; N33-I36 PolarHBondContact O-N 3.45Å; N33-N37 WeakPolarHBondContact O-CB 3.23Å; N33-N37 PolarHBondContact O-N 2.91Å
34	E	63.9	Low	60.5	Low	142 Å²	142	111.6 Å²	111.6	66%	0.664	57%	0.572	S	S	*	*	H	α-helix	trans	-65	-41.3	173.3	-87.9	-155.8	99.2	0	0	111.7	I30 V31 N37 A38	I30-E34 PolarHBondContact O-N 2.97Å; V31-E34 PolarHBondContact O-N 3.46Å; E34-N37 PolarHBondContact O-N 3.29Å; E34-A38 WeakPolarHBondContact O-CB 3.35Å; E34-A38 PolarHBondContact O-N 3.47Å
35	K	60.6	Low	60.9	Low	117 Å²	117	117 Å²	117	51%	0.509	59%	0.589	S	S	.	*	H	α-helix	trans	-63.9	-42	175.9	-171.5	173.2	179.9	-68.8	0	111.7	V31 E32 N37 A38 E39	V31-K35 WeakPolarHBondContact O-CB 3.44Å; V31-K35 PolarHBondContact O-N 2.83Å; E32-K35 PolarHBondContact O-N 3.43Å; K35-N37 VanDerWaalsContact C-N 3.33Å; K35-N37 PolarHBondContact O-N 2.91Å; K35-A38 PolarHBondContact O-N 3.06Å; K35-E39 IonicContact NZ-OE1 3.8Å; K35-E39 IonicContact NZ-OE2 3.96Å; K35-E39 PolarHBondContact NZ-OE2 2.94Å; K35-E39 WeakPolarHBondContact O-CB 3.16Å; K35-E39 WeakPolarHBondContact O-CG 3.35Å; K35-E39 PolarHBondContact O-N 3.32Å
36	I	59.3	Low	61.7	Low	63 Å²	63	115.9 Å²	115.9	32%	0.323	58%	0.584	S	S	.	*	H	α-helix	trans	-64.6	-37.2	175.4	-67.9	163.6	0	0	0	111	E32 N33 K40	E32-I36 HydrophobicContact CG-CD1 4Å; E32-I36 WeakPolarHBondContact O-CB 3.35Å; E32-I36 WeakPolarHBondContact O-CD1 3.36Å; E32-I36 WeakPolarHBondContact O-CG1 3.48Å; E32-I36 PolarHBondContact O-N 2.87Å; N33-I36 PolarHBondContact O-N 3.45Å; I36-K40 HydrophobicContact CG2-CD 3.98Å; I36-K40 HydrophobicContact CG2-CG 4.41Å; I36-K40 WeakPolarHBondContact O-CB 3.34Å; I36-K40 VanDerWaalsContact O-CG 3.23Å; I36-K40 WeakPolarHBondContact O-CG 3.42Å; I36-K40 PolarHBondContact O-N 3.47Å
37	N	56.5	Low	62.9	Low	118 Å²	118	116.3 Å²	116.3	63%	0.631	59%	0.587	S	S	*	*	H	α-helix	trans	-74.9	-35.2	179.7	-151.4	24.3	0	0	0	112.3	N33 E34 K35 S41	N33-N37 WeakPolarHBondContact O-CB 3.23Å; N33-N37 PolarHBondContact O-N 2.91Å; E34-N37 PolarHBondContact O-N 3.29Å; K35-N37 VanDerWaalsContact C-N 3.33Å; K35-N37 PolarHBondContact O-N 2.91Å; N37-S41 PolarHBondContact O-OG 2.74Å; N37-S41 VanDerWaalsContact O-OG 3.06Å
38	A	56.9	Low	64.1	Low	64 Å²	64	115.3 Å²	115.3	53%	0.529	58%	0.579	S	S	.	*	H	α-helix	trans	-67	-39.1	172.2	0	0	0	0	0	112.1	E34 K35 S42	E34-A38 WeakPolarHBondContact O-CB 3.35Å; E34-A38 PolarHBondContact O-N 3.47Å; K35-A38 PolarHBondContact O-N 3.06Å; A38-S42 PolarHBondContact O-OG 3.41Å
39	E	53.3	Low	65.4	Low	116 Å²	116	116.7 Å²	116.7	54%	0.542	59%	0.585	S	S	.	*	H	α-helix	trans	-80.6	-24.1	179.7	-68.1	-167.4	106.5	0	0	113.8	K35 S41 S42	K35-E39 IonicContact NZ-OE1 3.8Å; K35-E39 IonicContact NZ-OE2 3.96Å; K35-E39 PolarHBondContact NZ-OE2 2.94Å; K35-E39 WeakPolarHBondContact O-CB 3.16Å; K35-E39 WeakPolarHBondContact O-CG 3.35Å; K35-E39 PolarHBondContact O-N 3.32Å; E39-S41 PolarHBondContact O-N 3.41Å; E39-S42 PolarHBondContact O-N 3.07Å; E39-S42 PolarHBondContact O-OG 2.98Å
40	K	50.9	Low	66.7	Low	144 Å²	144	113.5 Å²	113.5	63%	0.626	59%	0.586	S	S	*	*	H	α-helix	trans	-71.6	-17.8	172	-79.8	177.6	-178.7	177.4	0	113.6	I36 S42	I36-K40 HydrophobicContact CG2-CD 3.98Å; I36-K40 HydrophobicContact CG2-CG 4.41Å; I36-K40 WeakPolarHBondContact O-CB 3.34Å; I36-K40 VanDerWaalsContact O-CG 3.23Å; I36-K40 WeakPolarHBondContact O-CG 3.42Å; I36-K40 PolarHBondContact O-N 3.47Å; K40-S42 PolarHBondContact O-N 3.43Å
41	S	51.6	Low	67.8	Low	101 Å²	101	110.4 Å²	110.4	71%	0.706	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-5.5	175	-56.3	0	0	0	0	112.8	N37 E39	N37-S41 PolarHBondContact O-OG 2.74Å; N37-S41 VanDerWaalsContact O-OG 3.06Å; E39-S41 PolarHBondContact O-N 3.41Å
42	S	51.3	Low	69.1	Low	81 Å²	81	110.8 Å²	110.8	57%	0.566	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-6.3	-165.3	-44.4	0	0	0	0	116.4	A38 E39 K40	A38-S42 PolarHBondContact O-OG 3.41Å; E39-S42 PolarHBondContact O-N 3.07Å; E39-S42 PolarHBondContact O-OG 2.98Å; K40-S42 PolarHBondContact O-N 3.43Å
43	K	52.9	Low	70.6	Confident	195 Å²	195	110.4 Å²	110.4	85%	0.848	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.8	-0.9	-174.3	-65.8	-171.8	-177.9	169.6	0	117.4	K45	K43-K45 PolarHBondContact O-N 3.02Å; K43-K45 VanDerWaalsContact O-N 3.1Å
44	Q	58.9	Low	72.2	Confident	166 Å²	166	114.3 Å²	114.3	78%	0.776	59%	0.586	S	S	*	*			trans	-80.4	100.1	175.3	-164.1	167	-1	0	0	107.8	V46	Q44-V46 PolarHBondContact O-N 2.94Å
45	K	69	Low	73.7	Confident	201 Å²	201	109 Å²	109	87%	0.874	57%	0.567	S	S	*	*			trans	-50	103.4	170.8	-67.4	-175.4	177.7	-173.1	0	107.6	K43 D47	K43-K45 PolarHBondContact O-N 3.02Å; K43-K45 VanDerWaalsContact O-N 3.1Å; K45-D47 PolarHBondContact O-N 3.49Å
46	V	78.1	Confident	75.4	Confident	58 Å²	58	107.7 Å²	107.7	35%	0.352	56%	0.559	S	S	.	*			trans	-66.7	124.1	178	179.5	0	0	0	0	106.4	Q44 L48 L51	Q44-V46 PolarHBondContact O-N 2.94Å; V46-L48 VanDerWaalsContact C-N 3.33Å; V46-L48 PolarHBondContact O-N 2.82Å; V46-L51 HydrophobicContact CG1-CD1 3.77Å; V46-L51 HydrophobicContact CG1-CD2 3.8Å; V46-L51 HydrophobicContact CG1-CG 4Å
47	D	89	Confident	77.2	Confident	93 Å²	93	108.1 Å²	108.1	50%	0.497	56%	0.562	S	S	.	*			trans	-72.3	94.2	172.8	173	30.5	0	0	0	108.9	K45 Q49 S50	K45-D47 PolarHBondContact O-N 3.49Å; D47-Q49 PolarHBondContact O-N 3.14Å; D47-Q49 PolarHBondContact OD1-N 3Å; D47-S50 PolarHBondContact O-N 3.06Å; D47-S50 VanDerWaalsContact O-N 3.14Å; D47-S50 PolarHBondContact O-OG 2.81Å; D47-S50 WeakPolarHBondContact OD2-CB 3.21Å; D47-S50 PolarHBondContact OD2-N 3.28Å; D47-S50 PolarHBondContact OD2-OG 3.1Å
48	L	91	Very high	79.1	Confident	56 Å²	56	106.2 Å²	106.2	29%	0.293	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.4	-26.1	-177	-65.8	178.9	0	0	0	113	V46 L51 Y56 Q59 T60	V46-L48 VanDerWaalsContact C-N 3.33Å; V46-L48 PolarHBondContact O-N 2.82Å; L48-L51 HydrophobicContact CD2-CD1 3.92Å; L48-Y56 HydrophobicContact CB-CD2 4.2Å; L48-Y56 HydrophobicContact CB-CE2 4.25Å; L48-Y56 WeakPolarHBondContact O-CD2 3.28Å; L48-Q59 HydrophobicContact CD2-CB 4.5Å; L48-T60 HydrophobicContact CD1-CG2 4.07Å; L48-T60 HydrophobicContact CD2-CG2 4.16Å
49	Q	92.4	Very high	80.8	Confident	158 Å²	158	106.2 Å²	106.2	74%	0.738	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-22	-177	-64	-59.7	-62.5	0	0	113.5	D47	D47-Q49 PolarHBondContact O-N 3.14Å; D47-Q49 PolarHBondContact OD1-N 3Å
50	S	94.4	Very high	82.7	Confident	82 Å²	82	102.8 Å²	102.8	57%	0.573	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-6.8	177.2	55.9	0	0	0	0	113.5	D47	D47-S50 PolarHBondContact O-N 3.06Å; D47-S50 VanDerWaalsContact O-N 3.14Å; D47-S50 PolarHBondContact O-OG 2.81Å; D47-S50 WeakPolarHBondContact OD2-CB 3.21Å; D47-S50 PolarHBondContact OD2-N 3.28Å; D47-S50 PolarHBondContact OD2-OG 3.1Å
51	L	93.4	Very high	84.9	Confident	41 Å²	41	98.5 Å²	98.5	22%	0.215	51%	0.514	C	S	.	.	S	Bend	trans	-69	141.4	-179.3	-68.5	180	0	0	0	112	V46 L48 A55	V46-L51 HydrophobicContact CG1-CD1 3.77Å; V46-L51 HydrophobicContact CG1-CD2 3.8Å; V46-L51 HydrophobicContact CG1-CG 4Å; L48-L51 HydrophobicContact CD2-CD1 3.92Å; L51-A55 HydrophobicContact CB-CB 4.26Å; L51-A55 HydrophobicContact CD1-CB 4.47Å; L51-A55 HydrophobicContact CD2-CB 4.34Å
52	P	97.7	Very high	87.1	Confident	96 Å²	96	95.7 Å²	95.7	62%	0.623	49%	0.492	S	S	*	.			trans	-54.9	147.4	162.3	-23.3	33.6	0	0	0	111	R54 A55 Y56	P52-R54 VanDerWaalsContact C-N 3.26Å; P52-R54 PolarHBondContact O-N 2.92Å; P52-R54 VanDerWaalsContact O-N 3.07Å; P52-A55 PolarHBondContact O-N 3.32Å; P52-Y56 PolarHBondContact O-N 3.09Å
53	T	97.5	Very high	89.3	Confident	111 Å²	111	94.8 Å²	94.8	68%	0.681	48%	0.484	S	S	*	.	H	α-helix	trans	-48.8	-44.3	-173.7	-52.3	0	0	0	0	113.7	Y56 L57	T53-Y56 PolarHBondContact O-N 3.4Å; T53-L57 HydrophobicContact CG2-CD1 4.22Å; T53-L57 WeakPolarHBondContact O-CG 3.37Å; T53-L57 PolarHBondContact O-N 3.31Å; T53-L57 VanDerWaalsContact O-N 3.09Å
54	R	97.9	Very high	91.4	Very high	197 Å²	197	86.1 Å²	86.1	74%	0.743	45%	0.447	S	S	*	.	H	α-helix	trans	-61.5	-47	179.3	-177.8	176.7	177.9	175.4	2.1	111.9	P52 Y56 L57 D58	P52-R54 VanDerWaalsContact C-N 3.26Å; P52-R54 PolarHBondContact O-N 2.92Å; P52-R54 VanDerWaalsContact O-N 3.07Å; R54-Y56 PolarHBondContact O-N 3.3Å; R54-L57 PolarHBondContact O-N 3.49Å; R54-D58 IonicContact NE-OD2 2.74Å; R54-D58 WeakPolarHBondContact O-CB 3.42Å; R54-D58 PolarHBondContact O-N 3.41Å
55	A	95.3	Very high	93.3	Very high	31 Å²	31	80.9 Å²	80.9	26%	0.256	42%	0.424	S	S	.	.	H	α-helix	trans	-65.8	-39.1	-179.9	0	0	0	0	0	111.8	L51 P52 L57 D58 Q59	L51-A55 HydrophobicContact CB-CB 4.26Å; L51-A55 HydrophobicContact CD1-CB 4.47Å; L51-A55 HydrophobicContact CD2-CB 4.34Å; P52-A55 PolarHBondContact O-N 3.32Å; A55-L57 PolarHBondContact O-N 3.47Å; A55-D58 PolarHBondContact O-N 2.94Å; A55-Q59 WeakPolarHBondContact O-CB 3.39Å; A55-Q59 WeakPolarHBondContact O-CG 3.24Å; A55-Q59 PolarHBondContact O-N 3.09Å
56	Y	96.8	Very high	94.7	Very high	90 Å²	90	76.7 Å²	76.7	35%	0.353	41%	0.41	S	S	.	.	H	α-helix	trans	-57.6	-47.6	173.9	173	-98.3	0	0	0	111.6	L48 P52 T53 R54 Q59 T60	L48-Y56 HydrophobicContact CB-CD2 4.2Å; L48-Y56 HydrophobicContact CB-CE2 4.25Å; L48-Y56 WeakPolarHBondContact O-CD2 3.28Å; P52-Y56 PolarHBondContact O-N 3.09Å; T53-Y56 PolarHBondContact O-N 3.4Å; R54-Y56 PolarHBondContact O-N 3.3Å; Y56-Q59 PolarHBondContact O-N 3.33Å; Y56-T60 HydrophobicContact CD2-CG2 4.05Å; Y56-T60 HydrophobicContact CE2-CG2 3.79Å; Y56-T60 WeakPolarHBondContact O-CB 3.48Å; Y56-T60 VanDerWaalsContact O-CG2 3.28Å; Y56-T60 WeakPolarHBondContact O-CG2 3.36Å; Y56-T60 PolarHBondContact O-N 3.32Å; Y56-T60 PolarHBondContact O-OG1 2.98Å
57	L	97.1	Very high	95.6	Very high	72 Å²	72	77.6 Å²	77.6	38%	0.377	41%	0.411	S	S	.	.	H	α-helix	trans	-67.9	-43.1	179.6	-65.1	174.2	0	0	0	111.9	T53 R54 A55 Q59 T60 V61 V62	T53-L57 HydrophobicContact CG2-CD1 4.22Å; T53-L57 WeakPolarHBondContact O-CG 3.37Å; T53-L57 PolarHBondContact O-N 3.31Å; T53-L57 VanDerWaalsContact O-N 3.09Å; R54-L57 PolarHBondContact O-N 3.49Å; A55-L57 PolarHBondContact O-N 3.47Å; L57-Q59 PolarHBondContact O-N 2.66Å; L57-T60 PolarHBondContact O-N 3.05Å; L57-V61 HydrophobicContact CD2-CG2 3.87Å; L57-V61 PolarHBondContact O-N 3.5Å; L57-V61 VanDerWaalsContact O-N 3.09Å; L57-V62 HydrophobicContact CB-CG2 4.04Å; L57-V62 WeakPolarHBondContact O-CB 3.41Å; L57-V62 VanDerWaalsContact O-CG2 3.24Å; L57-V62 WeakPolarHBondContact O-CG2 3.46Å; L57-V62 PolarHBondContact O-N 3.03Å
58	D	95.1	Very high	96.1	Very high	77 Å²	77	73.2 Å²	73.2	41%	0.412	39%	0.387	S	S	.	.	H	α-helix	trans	-59.3	-35.6	179.2	-73.5	-12.3	0	0	0	111.8	R54 A55 P63	R54-D58 IonicContact NE-OD2 2.74Å; R54-D58 WeakPolarHBondContact O-CB 3.42Å; R54-D58 PolarHBondContact O-N 3.41Å; A55-D58 PolarHBondContact O-N 2.94Å; D58-P63 WeakPolarHBondContact O-CD 3.41Å
59	Q	92.7	Very high	96.4	Very high	64 Å²	64	74.6 Å²	74.6	30%	0.299	40%	0.395	S	S	.	.	H	α-helix	trans	-83.9	-32.8	178.5	-72.7	-172.4	19	0	0	114.3	L48 A55 Y56 L57 N99	L48-Q59 HydrophobicContact CD2-CB 4.5Å; A55-Q59 WeakPolarHBondContact O-CB 3.39Å; A55-Q59 WeakPolarHBondContact O-CG 3.24Å; A55-Q59 PolarHBondContact O-N 3.09Å; Y56-Q59 PolarHBondContact O-N 3.33Å; L57-Q59 PolarHBondContact O-N 2.66Å; Q59-N99 WeakPolarHBondContact CB-OD1 3.43Å; Q59-N99 PolarHBondContact O-OD1 3.43Å; Q59-N99 PolarHBondContact OE1-ND2 3.02Å
60	T	94.2	Very high	96.7	Very high	44 Å²	44	70.1 Å²	70.1	27%	0.27	39%	0.385	S	S	.	.	H	α-helix	trans	-96.6	-47.9	-169.2	55.5	0	0	0	0	114.1	L48 Y56 L57	L48-T60 HydrophobicContact CD1-CG2 4.07Å; L48-T60 HydrophobicContact CD2-CG2 4.16Å; Y56-T60 HydrophobicContact CD2-CG2 4.05Å; Y56-T60 HydrophobicContact CE2-CG2 3.79Å; Y56-T60 WeakPolarHBondContact O-CB 3.48Å; Y56-T60 VanDerWaalsContact O-CG2 3.28Å; Y56-T60 WeakPolarHBondContact O-CG2 3.36Å; Y56-T60 PolarHBondContact O-N 3.32Å; Y56-T60 PolarHBondContact O-OG1 2.98Å; L57-T60 PolarHBondContact O-N 3.05Å
61	V	97	Very high	96.9	Very high	55 Å²	55	67.9 Å²	67.9	33%	0.333	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.6	-23.9	-164.3	-63.8	0	0	0	0	114.2	L57 I64 L65	L57-V61 HydrophobicContact CD2-CG2 3.87Å; L57-V61 PolarHBondContact O-N 3.5Å; L57-V61 VanDerWaalsContact O-N 3.09Å; V61-I64 WeakPolarHBondContact O-CG2 3.46Å; V61-I64 PolarHBondContact O-N 3.19Å; V61-L65 HydrophobicContact CB-CD1 3.92Å; V61-L65 HydrophobicContact CB-CG 4.44Å; V61-L65 HydrophobicContact CG2-CD1 3.86Å; V61-L65 WeakPolarHBondContact O-CB 3.23Å; V61-L65 VanDerWaalsContact O-CG 3.23Å; V61-L65 WeakPolarHBondContact O-CG 3.33Å; V61-L65 PolarHBondContact O-N 3.23Å
62	V	97.3	Very high	97.1	Very high	42 Å²	42	67.2 Å²	67.2	26%	0.255	36%	0.364	S	S	.	.	H	α-helix	trans	-59.4	-46.4	-175.3	167.6	0	0	0	0	112.8	L57 I64 L65 L66	L57-V62 HydrophobicContact CB-CG2 4.04Å; L57-V62 WeakPolarHBondContact O-CB 3.41Å; L57-V62 VanDerWaalsContact O-CG2 3.24Å; L57-V62 WeakPolarHBondContact O-CG2 3.46Å; L57-V62 PolarHBondContact O-N 3.03Å; V62-I64 PolarHBondContact O-N 2.92Å; V62-L65 PolarHBondContact O-N 2.96Å; V62-L66 HydrophobicContact CG1-CD1 3.96Å; V62-L66 HydrophobicContact CG1-CG 4.16Å; V62-L66 WeakPolarHBondContact O-CG 3.38Å; V62-L66 PolarHBondContact O-N 3.5Å
63	P	97.3	Very high	97.2	Very high	62 Å²	62	65.8 Å²	65.8	40%	0.403	36%	0.36	S	S	.	.	H	α-helix	trans	-58.5	-45.2	-178.1	-26.7	36.3	0	0	0	113.1	D58 Q67 F95	D58-P63 WeakPolarHBondContact O-CD 3.41Å; P63-Q67 PolarHBondContact O-N 3.33Å; P63-F95 HydrophobicContact CB-CD1 3.83Å; P63-F95 HydrophobicContact CB-CE1 3.86Å
64	I	97.5	Very high	97.2	Very high	13 Å²	13	69.2 Å²	69.2	7%	0.067	37%	0.366	C	S	.	.	H	α-helix	trans	-72.5	-35.4	179.6	-168.8	176.2	0	0	0	112	V61 V62 Q67 G68 L88 N91 F95	V61-I64 WeakPolarHBondContact O-CG2 3.46Å; V61-I64 PolarHBondContact O-N 3.19Å; V62-I64 PolarHBondContact O-N 2.92Å; I64-Q67 PolarHBondContact O-N 3.01Å; I64-G68 PolarHBondContact O-N 2.83Å; I64-L88 HydrophobicContact CB-CD2 4.28Å; I64-L88 HydrophobicContact CD1-CB 4.46Å; I64-L88 HydrophobicContact CD1-CD2 3.84Å; I64-L88 HydrophobicContact CG1-CD2 3.64Å; I64-L88 HydrophobicContact CG2-CD2 3.92Å; I64-N91 HydrophobicContact CD1-CB 4.29Å; I64-F95 HydrophobicContact CB-CB 4.36Å; I64-F95 HydrophobicContact CB-CD1 3.99Å; I64-F95 HydrophobicContact CB-CD2 3.75Å; I64-F95 HydrophobicContact CB-CE1 4.16Å; I64-F95 HydrophobicContact CB-CE2 3.95Å; I64-F95 HydrophobicContact CB-CG 3.77Å; I64-F95 HydrophobicContact CB-CZ 4.13Å; I64-F95 HydrophobicContact CD1-CD2 3.76Å; I64-F95 HydrophobicContact CD1-CE2 4.19Å; I64-F95 HydrophobicContact CD1-CG 4.39Å; I64-F95 HydrophobicContact CG1-CD2 3.66Å; I64-F95 HydrophobicContact CG1-CE2 3.7Å; I64-F95 HydrophobicContact CG1-CG 4.21Å; I64-F95 HydrophobicContact CG1-CZ 4.26Å
65	L	98.4	Very high	97.2	Very high	55 Å²	55	65.5 Å²	65.5	29%	0.288	36%	0.356	S	S	.	.	H	α-helix	trans	-64.6	-44	176	-76.8	169.7	0	0	0	111.6	V61 V62 Q67 G68 L69 L84 L88	V61-L65 HydrophobicContact CB-CD1 3.92Å; V61-L65 HydrophobicContact CB-CG 4.44Å; V61-L65 HydrophobicContact CG2-CD1 3.86Å; V61-L65 WeakPolarHBondContact O-CB 3.23Å; V61-L65 VanDerWaalsContact O-CG 3.23Å; V61-L65 WeakPolarHBondContact O-CG 3.33Å; V61-L65 PolarHBondContact O-N 3.23Å; V62-L65 PolarHBondContact O-N 2.96Å; L65-Q67 VanDerWaalsContact C-N 3.32Å; L65-Q67 PolarHBondContact O-N 3.35Å; L65-G68 PolarHBondContact O-N 3.43Å; L65-L69 WeakPolarHBondContact O-CB 3.21Å; L65-L69 WeakPolarHBondContact O-CG 3.33Å; L65-L69 PolarHBondContact O-N 3.07Å; L65-L84 HydrophobicContact CD2-CD2 4.5Å; L65-L88 HydrophobicContact CD2-CD1 4.01Å; L65-L88 HydrophobicContact CD2-CD2 4.15Å
66	L	98.1	Very high	97.3	Very high	113 Å²	113	74 Å²	74	59%	0.592	38%	0.382	S	S	*	.	H	α-helix	trans	-59.6	-44	176.6	-70.4	179.9	0	0	0	111.4	V62 L69 A70	V62-L66 HydrophobicContact CG1-CD1 3.96Å; V62-L66 HydrophobicContact CG1-CG 4.16Å; V62-L66 WeakPolarHBondContact O-CG 3.38Å; V62-L66 PolarHBondContact O-N 3.5Å; L66-L69 PolarHBondContact O-N 3.29Å; L66-A70 PolarHBondContact O-N 3.41Å
67	Q	98	Very high	97.4	Very high	78 Å²	78	71.1 Å²	71.1	36%	0.364	37%	0.374	S	S	.	.	H	α-helix	trans	-64.6	-45.6	176.7	-166	176.6	-67.8	0	0	111.8	P63 I64 L65 L69 A70 V71 Y87 F95	P63-Q67 PolarHBondContact O-N 3.33Å; I64-Q67 PolarHBondContact O-N 3.01Å; L65-Q67 VanDerWaalsContact C-N 3.32Å; L65-Q67 PolarHBondContact O-N 3.35Å; Q67-L69 PolarHBondContact O-N 3.43Å; Q67-A70 PolarHBondContact O-N 3.38Å; Q67-V71 PolarHBondContact O-N 3.16Å; Q67-V71 VanDerWaalsContact O-N 3.16Å; Q67-Y87 WeakPolarHBondContact CG-OH 3.42Å; Q67-Y87 PolarHBondContact NE2-OH 2.89Å; Q67-F95 HydrophobicContact CB-CZ 4.32Å
68	G	98.4	Very high	97.4	Very high	0 Å²	0	73.6 Å²	73.6	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-62.5	-40.5	178.1	0	0	0	0	0	112.9	I64 L65 V71 L72 Y87	I64-G68 PolarHBondContact O-N 2.83Å; L65-G68 PolarHBondContact O-N 3.43Å; G68-V71 PolarHBondContact O-N 3.29Å; G68-L72 VanDerWaalsContact O-CB 3.27Å; G68-L72 WeakPolarHBondContact O-CB 3.15Å; G68-L72 PolarHBondContact O-N 3.29Å; G68-Y87 VanDerWaalsContact CA-CD1 3.46Å
69	L	98.7	Very high	97.6	Very high	86 Å²	86	74.4 Å²	74.4	45%	0.45	40%	0.399	S	S	.	.	H	α-helix	trans	-66.4	-37	176.5	-72.7	173	0	0	0	112.2	L65 L66 Q67 L72 A73 L84	L65-L69 WeakPolarHBondContact O-CB 3.21Å; L65-L69 WeakPolarHBondContact O-CG 3.33Å; L65-L69 PolarHBondContact O-N 3.07Å; L66-L69 PolarHBondContact O-N 3.29Å; Q67-L69 PolarHBondContact O-N 3.43Å; L69-L72 HydrophobicContact CD2-CD2 4.21Å; L69-L72 PolarHBondContact O-N 2.89Å; L69-A73 VanDerWaalsContact O-CB 3.29Å; L69-A73 WeakPolarHBondContact O-CB 3.41Å; L69-A73 PolarHBondContact O-N 3.44Å; L69-L84 HydrophobicContact CD2-CD2 4.2Å
70	A	98.5	Very high	97.8	Very high	63 Å²	63	74.2 Å²	74.2	52%	0.521	40%	0.403	S	S	.	.	H	α-helix	trans	-62.9	-44.3	174.8	0	0	0	0	0	111.9	L66 Q67 K74	L66-A70 PolarHBondContact O-N 3.41Å; Q67-A70 PolarHBondContact O-N 3.38Å; A70-K74 PolarHBondContact O-N 2.99Å
71	V	98.3	Very high	98	Very high	35 Å²	35	79 Å²	79	21%	0.212	43%	0.426	C	S	.	.	H	α-helix	trans	-66.1	-44.9	175.8	178.3	0	0	0	0	110.9	Q67 G68 A73 K74 E75 F83 Y87	Q67-V71 PolarHBondContact O-N 3.16Å; Q67-V71 VanDerWaalsContact O-N 3.16Å; G68-V71 PolarHBondContact O-N 3.29Å; V71-A73 VanDerWaalsContact C-N 3.32Å; V71-A73 PolarHBondContact O-N 2.87Å; V71-K74 WeakPolarHBondContact O-CB 3.5Å; V71-K74 PolarHBondContact O-N 3.09Å; V71-K74 VanDerWaalsContact O-N 3.11Å; V71-E75 HydrophobicContact CG1-CG 4.4Å; V71-E75 PolarHBondContact O-N 3.47Å; V71-F83 HydrophobicContact CG1-CE1 4Å; V71-F83 HydrophobicContact CG1-CZ 3.86Å; V71-Y87 HydrophobicContact CB-CE2 4.06Å; V71-Y87 HydrophobicContact CG1-CD2 4.42Å; V71-Y87 HydrophobicContact CG1-CE2 4.11Å; V71-Y87 HydrophobicContact CG2-CE2 3.83Å
72	L	98.3	Very high	98.1	Very high	28 Å²	28	82.1 Å²	82.1	15%	0.147	44%	0.437	C	S	.	.	H	α-helix	trans	-57.9	-44	177.3	-179.1	71	0	0	0	111.9	G68 L69 K74 E75 R76 P77 P80 F83	G68-L72 VanDerWaalsContact O-CB 3.27Å; G68-L72 WeakPolarHBondContact O-CB 3.15Å; G68-L72 PolarHBondContact O-N 3.29Å; L69-L72 HydrophobicContact CD2-CD2 4.21Å; L69-L72 PolarHBondContact O-N 2.89Å; L72-K74 VanDerWaalsContact C-N 3.26Å; L72-K74 PolarHBondContact O-N 3.42Å; L72-E75 PolarHBondContact O-N 2.87Å; L72-R76 WeakPolarHBondContact O-CA 3.29Å; L72-R76 PolarHBondContact O-N 2.9Å; L72-P77 HydrophobicContact CD1-CG 3.6Å; L72-P80 HydrophobicContact CD1-CB 3.78Å; L72-P80 HydrophobicContact CD2-CB 4.19Å; L72-P80 HydrophobicContact CG-CB 4.45Å; L72-F83 HydrophobicContact CB-CD1 4.41Å; L72-F83 HydrophobicContact CB-CE1 4.46Å; L72-F83 HydrophobicContact CD1-CB 4.26Å; L72-F83 HydrophobicContact CD1-CD1 3.64Å; L72-F83 HydrophobicContact CD1-CE1 4.35Å; L72-F83 HydrophobicContact CD1-CG 4.21Å
73	A	98.3	Very high	98.2	Very high	65 Å²	65	82.4 Å²	82.4	54%	0.537	44%	0.435	S	S	.	.	H	α-helix	trans	-64.8	-31.4	178.3	0	0	0	0	0	112.7	L69 V71 R76	L69-A73 VanDerWaalsContact O-CB 3.29Å; L69-A73 WeakPolarHBondContact O-CB 3.41Å; L69-A73 PolarHBondContact O-N 3.44Å; V71-A73 VanDerWaalsContact C-N 3.32Å; V71-A73 PolarHBondContact O-N 2.87Å; A73-R76 WeakPolarHBondContact O-CG 3.27Å
74	K	98.4	Very high	98.2	Very high	184 Å²	184	81 Å²	81	80%	0.8	42%	0.423	S	S	*	.	H	α-helix	trans	-74.5	-47	176.5	-175.9	-177.3	178.4	-176.7	0	112.2	A70 V71 L72	A70-K74 PolarHBondContact O-N 2.99Å; V71-K74 WeakPolarHBondContact O-CB 3.5Å; V71-K74 PolarHBondContact O-N 3.09Å; V71-K74 VanDerWaalsContact O-N 3.11Å; L72-K74 VanDerWaalsContact C-N 3.26Å; L72-K74 PolarHBondContact O-N 3.42Å
75	E	97.9	Very high	98.3	Very high	118 Å²	118	82.7 Å²	82.7	55%	0.551	44%	0.439	S	S	*	.	H	α-helix	trans	-85.3	-29.5	-173.5	-67.6	-170	-163.7	0	0	113.8	V71 L72 F83	V71-E75 HydrophobicContact CG1-CG 4.4Å; V71-E75 PolarHBondContact O-N 3.47Å; L72-E75 PolarHBondContact O-N 2.87Å; E75-F83 WeakPolarHBondContact OE2-CE2 3.38Å; E75-F83 VanDerWaalsContact OE2-CZ 3.29Å; E75-F83 WeakPolarHBondContact OE2-CZ 3.32Å
76	R	97.7	Very high	98.3	Very high	211 Å²	211	82.4 Å²	82.4	80%	0.796	44%	0.442	S	S	*	.			trans	45.4	55.1	-177.5	-58.6	-171.9	175.4	-168.2	-2.6	113.7	L72 A73	L72-R76 WeakPolarHBondContact O-CA 3.29Å; L72-R76 PolarHBondContact O-N 2.9Å; A73-R76 WeakPolarHBondContact O-CG 3.27Å
77	P	97.9	Very high	98.3	Very high	28 Å²	28	78.4 Å²	78.4	18%	0.182	42%	0.419	C	S	.	.			trans	-64.8	156.6	-179.2	30.7	-37.2	0	0	0	111.8	L72 N79 F83	L72-P77 HydrophobicContact CD1-CG 3.6Å; P77-N79 VanDerWaalsContact C-N 3.26Å; P77-N79 PolarHBondContact O-N 3.1Å; P77-F83 HydrophobicContact CB-CB 4.27Å; P77-F83 HydrophobicContact CB-CD2 4.04Å; P77-F83 HydrophobicContact CB-CG 4.28Å; P77-F83 HydrophobicContact CG-CB 3.6Å; P77-F83 HydrophobicContact CG-CD1 4.09Å; P77-F83 HydrophobicContact CG-CD2 3.75Å; P77-F83 HydrophobicContact CG-CE2 4.43Å; P77-F83 HydrophobicContact CG-CG 3.55Å
78	P	98	Very high	98.3	Very high	124 Å²	124	77 Å²	77	81%	0.805	41%	0.414	S	S	*	.	S	Bend	trans	-62.9	-30.2	-178.5	24.5	-34.2	0	0	0	113.6	P80	P78-P80 VanDerWaalsContact O-CD 3.29Å; P78-P80 WeakPolarHBondContact O-CD 3.48Å
79	N	98.2	Very high	98.3	Very high	94 Å²	94	83.1 Å²	83.1	50%	0.503	45%	0.446	S	S	.	.	S	Bend	trans	-115	80.7	178	-63.3	-19.5	0	0	0	110.4	P77 I81 E82 F83	P77-N79 VanDerWaalsContact C-N 3.26Å; P77-N79 PolarHBondContact O-N 3.1Å; N79-I81 VanDerWaalsContact C-N 3.33Å; N79-I81 PolarHBondContact O-N 2.87Å; N79-E82 HydrophobicContact CB-CB 3.99Å; N79-E82 PolarHBondContact ND2-OE2 3.34Å; N79-E82 PolarHBondContact O-N 2.99Å; N79-F83 WeakPolarHBondContact O-CB 3.38Å; N79-F83 PolarHBondContact O-N 2.91Å
80	P	98.3	Very high	98.2	Very high	61 Å²	61	87.2 Å²	87.2	40%	0.396	46%	0.46	S	S	.	.	H	α-helix	trans	-63.6	-34.9	-171	23.1	-34.2	0	0	0	113.9	L72 P78 L84	L72-P80 HydrophobicContact CD1-CB 3.78Å; L72-P80 HydrophobicContact CD2-CB 4.19Å; L72-P80 HydrophobicContact CG-CB 4.45Å; P78-P80 VanDerWaalsContact O-CD 3.29Å; P78-P80 WeakPolarHBondContact O-CD 3.48Å; P80-L84 WeakPolarHBondContact O-CB 3.47Å; P80-L84 PolarHBondContact O-N 3.44Å
81	I	98.5	Very high	98.2	Very high	145 Å²	145	85.6 Å²	85.6	74%	0.744	44%	0.443	S	S	*	.	H	α-helix	trans	-69.7	-47.4	-179.5	-59.8	176.7	0	0	0	110.7	N79 F83 L84 A85	N79-I81 VanDerWaalsContact C-N 3.33Å; N79-I81 PolarHBondContact O-N 2.87Å; I81-F83 VanDerWaalsContact C-N 3.33Å; I81-F83 PolarHBondContact O-N 3.48Å; I81-L84 PolarHBondContact O-N 3.27Å; I81-A85 WeakPolarHBondContact O-CB 3.4Å; I81-A85 PolarHBondContact O-N 2.89Å
82	E	98.6	Very high	98.1	Very high	119 Å²	119	88.7 Å²	88.7	56%	0.556	45%	0.453	S	S	*	.	H	α-helix	trans	-64.1	-40.5	179.2	-174.2	178.5	-169.4	0	0	111.4	N79 S86	N79-E82 HydrophobicContact CB-CB 3.99Å; N79-E82 PolarHBondContact ND2-OE2 3.34Å; N79-E82 PolarHBondContact O-N 2.99Å; E82-S86 VanDerWaalsContact O-CB 3.28Å; E82-S86 WeakPolarHBondContact O-CB 3.48Å; E82-S86 PolarHBondContact O-N 3.11Å; E82-S86 PolarHBondContact O-OG 3.49Å
83	F	98.7	Very high	97.9	Very high	49 Å²	49	90.4 Å²	90.4	22%	0.215	47%	0.472	C	S	.	.	H	α-helix	trans	-59.8	-49.8	173.3	-179	-86.8	0	0	0	111.4	V71 L72 E75 P77 N79 I81 S86 Y87	V71-F83 HydrophobicContact CG1-CE1 4Å; V71-F83 HydrophobicContact CG1-CZ 3.86Å; L72-F83 HydrophobicContact CB-CD1 4.41Å; L72-F83 HydrophobicContact CB-CE1 4.46Å; L72-F83 HydrophobicContact CD1-CB 4.26Å; L72-F83 HydrophobicContact CD1-CD1 3.64Å; L72-F83 HydrophobicContact CD1-CE1 4.35Å; L72-F83 HydrophobicContact CD1-CG 4.21Å; E75-F83 WeakPolarHBondContact OE2-CE2 3.38Å; E75-F83 VanDerWaalsContact OE2-CZ 3.29Å; E75-F83 WeakPolarHBondContact OE2-CZ 3.32Å; P77-F83 HydrophobicContact CB-CB 4.27Å; P77-F83 HydrophobicContact CB-CD2 4.04Å; P77-F83 HydrophobicContact CB-CG 4.28Å; P77-F83 HydrophobicContact CG-CB 3.6Å; P77-F83 HydrophobicContact CG-CD1 4.09Å; P77-F83 HydrophobicContact CG-CD2 3.75Å; P77-F83 HydrophobicContact CG-CE2 4.43Å; P77-F83 HydrophobicContact CG-CG 3.55Å; N79-F83 WeakPolarHBondContact O-CB 3.38Å; N79-F83 PolarHBondContact O-N 2.91Å; I81-F83 VanDerWaalsContact C-N 3.33Å; I81-F83 PolarHBondContact O-N 3.48Å; F83-S86 WeakPolarHBondContact O-CB 3.42Å; F83-S86 PolarHBondContact O-N 3.39Å; F83-Y87 HydrophobicContact CE1-CD2 4.48Å; F83-Y87 WeakPolarHBondContact O-CB 3.43Å; F83-Y87 PolarHBondContact O-N 2.9Å
84	L	98.6	Very high	97.7	Very high	31 Å²	31	92.6 Å²	92.6	16%	0.162	47%	0.471	C	S	.	.	H	α-helix	trans	-63.8	-45.6	-179.2	-176.6	62.1	0	0	0	111.2	L65 L69 P80 I81 S86 Y87 L88	L65-L84 HydrophobicContact CD2-CD2 4.5Å; L69-L84 HydrophobicContact CD2-CD2 4.2Å; P80-L84 WeakPolarHBondContact O-CB 3.47Å; P80-L84 PolarHBondContact O-N 3.44Å; I81-L84 PolarHBondContact O-N 3.27Å; L84-S86 VanDerWaalsContact C-N 3.32Å; L84-S86 PolarHBondContact O-N 3.08Å; L84-Y87 WeakPolarHBondContact O-CA 3.32Å; L84-Y87 VanDerWaalsContact O-CB 3.32Å; L84-Y87 WeakPolarHBondContact O-CB 3.5Å; L84-Y87 PolarHBondContact O-N 3.26Å; L84-Y87 VanDerWaalsContact O-N 3.08Å; L84-L88 WeakPolarHBondContact O-CG 3.48Å; L84-L88 PolarHBondContact O-N 3.39Å
85	A	98.6	Very high	97.4	Very high	49 Å²	49	85.7 Å²	85.7	41%	0.405	44%	0.441	S	S	.	.	H	α-helix	trans	-57.5	-45.5	175.9	0	0	0	0	0	111.8	I81 Y87 L88 L89	I81-A85 WeakPolarHBondContact O-CB 3.4Å; I81-A85 PolarHBondContact O-N 2.89Å; A85-Y87 VanDerWaalsContact C-N 3.32Å; A85-Y87 PolarHBondContact O-N 3.38Å; A85-L88 PolarHBondContact O-N 3.11Å; A85-L89 WeakPolarHBondContact O-CG 3.37Å; A85-L89 PolarHBondContact O-N 2.82Å; A85-L89 VanDerWaalsContact O-N 3.11Å
86	S	98.3	Very high	96.8	Very high	49 Å²	49	85.7 Å²	85.7	34%	0.343	44%	0.441	S	S	.	.	H	α-helix	trans	-61.3	-39.9	174.5	-63.5	0	0	0	0	112.3	E82 F83 L84 K90	E82-S86 VanDerWaalsContact O-CB 3.28Å; E82-S86 WeakPolarHBondContact O-CB 3.48Å; E82-S86 PolarHBondContact O-N 3.11Å; E82-S86 PolarHBondContact O-OG 3.49Å; F83-S86 WeakPolarHBondContact O-CB 3.42Å; F83-S86 PolarHBondContact O-N 3.39Å; L84-S86 VanDerWaalsContact C-N 3.32Å; L84-S86 PolarHBondContact O-N 3.08Å; S86-K90 WeakPolarHBondContact O-CB 3.42Å; S86-K90 VanDerWaalsContact O-CG 3.24Å; S86-K90 WeakPolarHBondContact O-CG 3.29Å; S86-K90 PolarHBondContact O-N 2.8Å
87	Y	98.4	Very high	95.3	Very high	30 Å²	30	82.7 Å²	82.7	12%	0.118	44%	0.441	C	S	.	.	H	α-helix	trans	-62	-47.4	177.2	-173.3	-86.4	0	0	0	111.1	Q67 G68 V71 F83 L84 A85 L89 K90 N91	Q67-Y87 WeakPolarHBondContact CG-OH 3.42Å; Q67-Y87 PolarHBondContact NE2-OH 2.89Å; G68-Y87 VanDerWaalsContact CA-CD1 3.46Å; V71-Y87 HydrophobicContact CB-CE2 4.06Å; V71-Y87 HydrophobicContact CG1-CD2 4.42Å; V71-Y87 HydrophobicContact CG1-CE2 4.11Å; V71-Y87 HydrophobicContact CG2-CE2 3.83Å; F83-Y87 HydrophobicContact CE1-CD2 4.48Å; F83-Y87 WeakPolarHBondContact O-CB 3.43Å; F83-Y87 PolarHBondContact O-N 2.9Å; L84-Y87 WeakPolarHBondContact O-CA 3.32Å; L84-Y87 VanDerWaalsContact O-CB 3.32Å; L84-Y87 WeakPolarHBondContact O-CB 3.5Å; L84-Y87 PolarHBondContact O-N 3.26Å; L84-Y87 VanDerWaalsContact O-N 3.08Å; A85-Y87 VanDerWaalsContact C-N 3.32Å; A85-Y87 PolarHBondContact O-N 3.38Å; Y87-L89 PolarHBondContact O-N 2.94Å; Y87-K90 PolarHBondContact O-N 3.05Å; Y87-N91 HydrophobicContact CE1-CB 4.31Å; Y87-N91 WeakPolarHBondContact O-CB 3.28Å; Y87-N91 PolarHBondContact O-N 3.36Å; Y87-N91 PolarHBondContact O-ND2 3.39Å
88	L	98.3	Very high	93.5	Very high	48 Å²	48	91.4 Å²	91.4	25%	0.251	47%	0.47	S	S	.	.	H	α-helix	trans	-59.2	-49.1	178.6	-64.3	178.4	0	0	0	111	I64 L65 L84 A85 K90 N91 K92	I64-L88 HydrophobicContact CB-CD2 4.28Å; I64-L88 HydrophobicContact CD1-CB 4.46Å; I64-L88 HydrophobicContact CD1-CD2 3.84Å; I64-L88 HydrophobicContact CG1-CD2 3.64Å; I64-L88 HydrophobicContact CG2-CD2 3.92Å; L65-L88 HydrophobicContact CD2-CD1 4.01Å; L65-L88 HydrophobicContact CD2-CD2 4.15Å; L84-L88 WeakPolarHBondContact O-CG 3.48Å; L84-L88 PolarHBondContact O-N 3.39Å; A85-L88 PolarHBondContact O-N 3.11Å; L88-K90 VanDerWaalsContact C-N 3.34Å; L88-K90 PolarHBondContact O-N 3.21Å; L88-N91 PolarHBondContact O-N 3.39Å; L88-K92 WeakPolarHBondContact O-CB 3.29Å; L88-K92 PolarHBondContact O-N 3.47Å
89	L	97.8	Very high	91.3	Very high	129 Å²	129	90.7 Å²	90.7	68%	0.675	46%	0.459	S	S	*	.	H	α-helix	trans	-63.3	-36.9	-179.5	-69.3	174.9	0	0	0	113.3	A85 Y87	A85-L89 WeakPolarHBondContact O-CG 3.37Å; A85-L89 PolarHBondContact O-N 2.82Å; A85-L89 VanDerWaalsContact O-N 3.11Å; Y87-L89 PolarHBondContact O-N 2.94Å
90	K	97.5	Very high	91	Very high	171 Å²	171	90.6 Å²	90.6	74%	0.743	46%	0.457	S	S	*	.	H	α-helix	trans	-72.6	-30.7	178.2	-72.7	174.1	-175.8	179.4	0	113.2	S86 Y87 L88	S86-K90 WeakPolarHBondContact O-CB 3.42Å; S86-K90 VanDerWaalsContact O-CG 3.24Å; S86-K90 WeakPolarHBondContact O-CG 3.29Å; S86-K90 PolarHBondContact O-N 2.8Å; Y87-K90 PolarHBondContact O-N 3.05Å; L88-K90 VanDerWaalsContact C-N 3.34Å; L88-K90 PolarHBondContact O-N 3.21Å
91	N	97.2	Very high	90.6	Very high	30 Å²	30	92.1 Å²	92.1	16%	0.16	46%	0.461	C	S	.	.	H	α-helix	trans	-107.5	-6.7	-171.6	-65.2	-82.6	0	0	0	114.1	I64 Y87 L88 A93 Q94 F95	I64-N91 HydrophobicContact CD1-CB 4.29Å; Y87-N91 HydrophobicContact CE1-CB 4.31Å; Y87-N91 WeakPolarHBondContact O-CB 3.28Å; Y87-N91 PolarHBondContact O-N 3.36Å; Y87-N91 PolarHBondContact O-ND2 3.39Å; L88-N91 PolarHBondContact O-N 3.39Å; N91-A93 PolarHBondContact O-N 3.07Å; N91-A93 VanDerWaalsContact O-N 3.09Å; N91-Q94 WeakPolarHBondContact O-CB 3.38Å; N91-Q94 PolarHBondContact O-N 3.12Å; N91-Q94 PolarHBondContact OD1-NE2 3.28Å; N91-Q94 VanDerWaalsContact OD1-NE2 3.12Å; N91-F95 WeakPolarHBondContact O-CD2 3.17Å
92	K	95.7	Very high	90.1	Very high	99 Å²	99	89.2 Å²	89.2	43%	0.43	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	-38.9	-176	68.3	179.1	-168.8	161	0	114.7	L88 Q94 F95 E96	L88-K92 WeakPolarHBondContact O-CB 3.29Å; L88-K92 PolarHBondContact O-N 3.47Å; K92-Q94 PolarHBondContact O-N 3.3Å; K92-Q94 VanDerWaalsContact O-N 3.1Å; K92-F95 PolarHBondContact O-N 3.02Å; K92-E96 WeakPolarHBondContact O-CG 3.24Å; K92-E96 PolarHBondContact O-N 3.32Å
93	A	95.2	Very high	89.7	Confident	64 Å²	64	87.4 Å²	87.4	53%	0.529	44%	0.438	S	S	.	.	H	α-helix	trans	-60.8	-24.9	-178.5	0	0	0	0	0	113	N91 F95	N91-A93 PolarHBondContact O-N 3.07Å; N91-A93 VanDerWaalsContact O-N 3.09Å; A93-F95 PolarHBondContact O-N 2.84Å
94	Q	93.9	Very high	89.1	Confident	112 Å²	112	89.8 Å²	89.8	52%	0.523	45%	0.452	S	S	.	.	H	α-helix	trans	-75.9	-13.8	177	-60.3	171.2	38.6	0	0	112.9	N91 K92	N91-Q94 WeakPolarHBondContact O-CB 3.38Å; N91-Q94 PolarHBondContact O-N 3.12Å; N91-Q94 PolarHBondContact OD1-NE2 3.28Å; N91-Q94 VanDerWaalsContact OD1-NE2 3.12Å; K92-Q94 PolarHBondContact O-N 3.3Å; K92-Q94 VanDerWaalsContact O-N 3.1Å
95	F	92.8	Very high	88.5	Confident	39 Å²	39	93.7 Å²	93.7	17%	0.171	47%	0.472	C	S	.	.	H	α-helix	trans	-119.5	-20.3	-173	-66.4	-90	0	0	0	113.6	P63 I64 Q67 N91 K92 A93	P63-F95 HydrophobicContact CB-CD1 3.83Å; P63-F95 HydrophobicContact CB-CE1 3.86Å; I64-F95 HydrophobicContact CB-CB 4.36Å; I64-F95 HydrophobicContact CB-CD1 3.99Å; I64-F95 HydrophobicContact CB-CD2 3.75Å; I64-F95 HydrophobicContact CB-CE1 4.16Å; I64-F95 HydrophobicContact CB-CE2 3.95Å; I64-F95 HydrophobicContact CB-CG 3.77Å; I64-F95 HydrophobicContact CB-CZ 4.13Å; I64-F95 HydrophobicContact CD1-CD2 3.76Å; I64-F95 HydrophobicContact CD1-CE2 4.19Å; I64-F95 HydrophobicContact CD1-CG 4.39Å; I64-F95 HydrophobicContact CG1-CD2 3.66Å; I64-F95 HydrophobicContact CG1-CE2 3.7Å; I64-F95 HydrophobicContact CG1-CG 4.21Å; I64-F95 HydrophobicContact CG1-CZ 4.26Å; Q67-F95 HydrophobicContact CB-CZ 4.32Å; N91-F95 WeakPolarHBondContact O-CD2 3.17Å; K92-F95 PolarHBondContact O-N 3.02Å; A93-F95 PolarHBondContact O-N 2.84Å
96	E	83.7	Confident	87.7	Confident	118 Å²	118	96.9 Å²	96.9	55%	0.551	48%	0.476	S	S	*	.	H	α-helix	trans	-68.7	-32.2	179.5	-75.5	175.4	166.8	0	0	113	K92 R98	K92-E96 WeakPolarHBondContact O-CG 3.24Å; K92-E96 PolarHBondContact O-N 3.32Å; E96-R98 VanDerWaalsContact C-N 3.3Å; E96-R98 PolarHBondContact O-N 2.94Å
97	D	66.7	Low	86.9	Confident	148 Å²	148	100.6 Å²	100.6	79%	0.791	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	2.4	-174.8	-69.7	-33.5	0	0	0	115
98	R	59.8	Low	86	Confident	210 Å²	210	106.5 Å²	106.5	79%	0.792	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	6	-175.6	-73	-172.7	175.4	-177.7	0.2	114.6	E96	E96-R98 VanDerWaalsContact C-N 3.3Å; E96-R98 PolarHBondContact O-N 2.94Å
99	N	52.9	Low	84.8	Confident	110 Å²	110	111.8 Å²	111.8	59%	0.588	54%	0.542	S	S	*	.			trans	-127.3	0	-175.4	-134.8	79.9	0	0	0	112.2	Q59	Q59-N99 WeakPolarHBondContact CB-OD1 3.43Å; Q59-N99 PolarHBondContact O-OD1 3.43Å; Q59-N99 PolarHBondContact OE1-ND2 3.02Å

Retrieved 99 of 99 residues in 57.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).