A0A075B6G8_HUMAN Loading...

Tight junction associated protein 1

AlphaFold DB , UniProt , Accession A0A075B6G8, Species HUMAN (Homo sapiens, Human), Gene TJAP1, Length 100 aa.

						>A0A075B6G8_HUMAN|A0A075B6G8|TJAP1
MTSAAPAKKPYRKAPPEHRELRLEIPGSRLEQEEPLTDAERMKLLQEENEELRRRLASATRRTEALERELEIGQDCLELELGQSREELDKFKDKFRRLQN
					

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	48.6	Very low	56.4	Low	241 Å²	241	148.6 Å²	148.6	100%	1.187	85%	0.852	S	S	*	*				0	110.6	0	-61.8	-152.8	89.5	0	0	107.6
2	T	44.4	Very low	56.7	Low	144 Å²	144	157.5 Å²	157.5	88%	0.883	86%	0.861	S	S	*	*			trans	-142.8	103.9	176.7	-38.2	0	0	0	0	108.1
3	S	46.4	Very low	57.2	Low	119 Å²	119	159.2 Å²	159.2	83%	0.832	86%	0.855	S	S	*	*			trans	-76.8	120.1	-179	-178.9	0	0	0	0	109.5	A5	S3-A5 PolarHBondContact O-N 2.95Å
4	A	53.9	Low	57.6	Low	100 Å²	100	152.9 Å²	152.9	83%	0.826	84%	0.836	S	S	*	*			trans	-82	107.7	171.2	0	0	0	0	0	108.9
5	A	61.2	Low	57.8	Low	88 Å²	88	150 Å²	150	73%	0.727	83%	0.827	S	S	*	*			trans	-71.4	143.2	176.5	0	0	0	0	0	111.3	S3 A7	S3-A5 PolarHBondContact O-N 2.95Å; A5-A7 PolarHBondContact O-N 2.72Å
6	P	55.5	Low	58.1	Low	122 Å²	122	148.2 Å²	148.2	79%	0.792	83%	0.825	S	S	*	*			trans	-74.2	129.2	-178.9	28.4	-31.8	0	0	0	111.4	K8	P6-K8 PolarHBondContact O-N 3.21Å
7	A	57.1	Low	58.2	Low	101 Å²	101	149.7 Å²	149.7	84%	0.835	82%	0.824	S	S	*	*			trans	-63.6	113.2	176.4	0	0	0	0	0	111	A5 K9	A5-A7 PolarHBondContact O-N 2.72Å; A7-K9 PolarHBondContact O-N 2.65Å
8	K	60.3	Low	57.9	Low	204 Å²	204	150.8 Å²	150.8	89%	0.887	82%	0.822	S	S	*	*			trans	-72.9	113.8	173.5	-68.6	176.3	179.5	177.1	0	108.9	P6	P6-K8 PolarHBondContact O-N 3.21Å
9	K	66.2	Low	57.8	Low	200 Å²	200	154.8 Å²	154.8	87%	0.87	82%	0.824	S	S	*	*			trans	-60.7	126.6	173.6	-63.3	175.8	-178.9	176.7	0	109.2	A7 Y11	A7-K9 PolarHBondContact O-N 2.65Å; K9-Y11 PolarHBondContact O-N 3.34Å
10	P	66.6	Low	57.6	Low	113 Å²	113	155.8 Å²	155.8	73%	0.734	82%	0.823	S	S	*	*			trans	-80.7	121.1	-179.2	32.1	-30.2	0	0	0	109.2
11	Y	59.9	Low	57.5	Low	203 Å²	203	154.9 Å²	154.9	80%	0.796	82%	0.818	S	S	*	*			trans	45.5	82.6	163.3	-60.6	-86	0	0	0	117.3	K9 K13	K9-Y11 PolarHBondContact O-N 3.34Å; Y11-K13 VanDerWaalsContact C-N 3.3Å; Y11-K13 PolarHBondContact O-N 3.5Å
12	R	60.7	Low	57.8	Low	255 Å²	255	154.5 Å²	154.5	96%	0.962	80%	0.803	S	S	*	*			trans	-79.8	88.7	140.6	-82.4	-166.5	177.9	-179.6	-0.9	106.9	A14	R12-A14 PolarHBondContact O-N 3.02Å; R12-A14 VanDerWaalsContact O-N 3.15Å
13	K	62.3	Low	58.3	Low	179 Å²	179	154.3 Å²	154.3	78%	0.778	80%	0.796	S	S	*	*			trans	-67.2	110.6	155.4	-68.3	-160.3	-179.1	-174.8	0	104.6	Y11	Y11-K13 VanDerWaalsContact C-N 3.3Å; Y11-K13 PolarHBondContact O-N 3.5Å
14	A	63.3	Low	58.3	Low	71 Å²	71	156.1 Å²	156.1	59%	0.587	79%	0.792	S	S	*	*			trans	-51.2	143.6	166.5	0	0	0	0	0	107.6	R12	R12-A14 PolarHBondContact O-N 3.02Å; R12-A14 VanDerWaalsContact O-N 3.15Å
15	P	61.3	Low	58.2	Low	110 Å²	110	157.3 Å²	157.3	71%	0.714	78%	0.783	S	S	*	*			trans	-45.1	136.8	169.4	-25.6	34.2	0	0	0	108.5	E17	P15-E17 PolarHBondContact O-N 3.44Å
16	P	61.8	Low	57.5	Low	121 Å²	121	157.9 Å²	157.9	79%	0.786	78%	0.779	S	S	*	*			trans	-48.3	112.8	-179.7	-22	30.6	0	0	0	106.8	H18	P16-H18 PolarHBondContact O-N 3.4Å
17	E	60.1	Low	57.1	Low	174 Å²	174	153.9 Å²	153.9	81%	0.813	76%	0.76	S	S	*	*			trans	-48.7	121.6	178.4	-72.6	-174.9	161.7	0	0	104.9	P15 R19	P15-E17 PolarHBondContact O-N 3.44Å; E17-R19 PolarHBondContact O-N 3.5Å
18	H	53.4	Low	56.6	Low	169 Å²	169	153.5 Å²	153.5	78%	0.782	75%	0.751	S	S	*	*			trans	-40.7	114.9	169.7	-72	-90.8	0	0	0	104.3	P16 E20	P16-H18 PolarHBondContact O-N 3.4Å; H18-E20 PolarHBondContact O-N 3.47Å
19	R	55.9	Low	55.9	Low	228 Å²	228	153.4 Å²	153.4	86%	0.86	75%	0.745	S	S	*	*			trans	-65.1	83.1	175.6	-164.6	-178.5	-167.9	177.6	2.6	102.2	E17 L21	E17-R19 PolarHBondContact O-N 3.5Å; R19-L21 PolarHBondContact O-N 3.31Å
20	E	53.5	Low	55	Low	174 Å²	174	149.3 Å²	149.3	81%	0.813	73%	0.732	S	S	*	*			trans	-59.6	95.1	174.2	-74.1	-172.6	-178.3	0	0	101.2	H18 R22	H18-E20 PolarHBondContact O-N 3.47Å; E20-R22 PolarHBondContact O-N 2.96Å
21	L	55.7	Low	54	Low	136 Å²	136	153.1 Å²	153.1	71%	0.712	74%	0.74	S	S	*	*			trans	-54.9	97.4	160.4	-66.2	169.2	0	0	0	100.9	R19 L23	R19-L21 PolarHBondContact O-N 3.31Å; L21-L23 PolarHBondContact O-N 3.1Å
22	R	54.6	Low	53.5	Low	233 Å²	233	151.1 Å²	151.1	88%	0.879	74%	0.738	S	S	*	*			trans	-50.8	87.9	151.3	-92.6	-170.3	173	-175.6	-1.4	102.6	E20 E24	E20-R22 PolarHBondContact O-N 2.96Å; R22-E24 PolarHBondContact O-N 2.87Å
23	L	54.8	Low	52.9	Low	141 Å²	141	143 Å²	143	74%	0.738	71%	0.711	S	S	*	*			trans	-55.9	100.3	156	-102	110.9	0	0	0	100.9	L21 I25	L21-L23 PolarHBondContact O-N 3.1Å; L23-I25 PolarHBondContact O-N 3.01Å
24	E	47.2	Very low	52.8	Low	157 Å²	157	142.6 Å²	142.6	73%	0.734	71%	0.712	S	S	*	*			trans	-55.9	99	159.6	-68.7	-151.8	166.3	0	0	104	R22 P26	R22-E24 PolarHBondContact O-N 2.87Å; E24-P26 VanDerWaalsContact O-CD 3.31Å; E24-P26 WeakPolarHBondContact O-CD 3.28Å
25	I	51.1	Low	53	Low	124 Å²	124	144.8 Å²	144.8	64%	0.636	72%	0.72	S	S	*	*			trans	-53.6	122.5	167.1	-59.2	170.4	0	0	0	103	L23 G27 S28	L23-I25 PolarHBondContact O-N 3.01Å; I25-G27 PolarHBondContact O-N 2.75Å; I25-S28 PolarHBondContact O-N 3.07Å
26	P	46.3	Very low	53.4	Low	101 Å²	101	142.6 Å²	142.6	66%	0.656	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	10.4	-179.2	-22.2	33.1	0	0	0	114.8	E24	E24-P26 VanDerWaalsContact O-CD 3.31Å; E24-P26 WeakPolarHBondContact O-CD 3.28Å
27	G	46.7	Very low	54.6	Low	37 Å²	37	140.6 Å²	140.6	38%	0.381	69%	0.688	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.7	-5.5	177.1	0	0	0	0	0	115.3	I25 R29	I25-G27 PolarHBondContact O-N 2.75Å; G27-R29 PolarHBondContact O-N 2.82Å
28	S	48	Very low	56.1	Low	93 Å²	93	138 Å²	138	65%	0.65	68%	0.679	S	S	*	*	S	Bend	trans	-80.2	10.6	178.1	58	0	0	0	0	114.6	I25	I25-S28 PolarHBondContact O-N 3.07Å
29	R	44.9	Very low	57.9	Low	203 Å²	203	132.9 Å²	132.9	77%	0.766	67%	0.666	S	S	*	*			trans	-106.7	49.1	174.1	-162.6	-176	177.8	174.5	-1.2	111.4	G27	G27-R29 PolarHBondContact O-N 2.82Å
30	L	47.4	Very low	59.7	Low	113 Å²	113	126.6 Å²	126.6	59%	0.592	65%	0.647	S	S	*	*			trans	-99.8	10.5	172.7	-76.7	169.3	0	0	0	113.4	Q32 E33	L30-Q32 VanDerWaalsContact C-N 3.28Å; L30-Q32 PolarHBondContact O-N 3.07Å; L30-E33 HydrophobicContact CD2-CG 3.8Å; L30-E33 WeakPolarHBondContact CD2-OE1 3.46Å
31	E	44.7	Very low	61.6	Low	193 Å²	193	122.6 Å²	122.6	90%	0.902	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	3.1	176.7	-70.4	-107.1	145.9	0	0	113.5
32	Q	48.9	Very low	63.5	Low	162 Å²	162	122.1 Å²	122.1	76%	0.757	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.6	61.1	173	-76.5	-174.9	-13	0	0	110.6	L30	L30-Q32 VanDerWaalsContact C-N 3.28Å; L30-Q32 PolarHBondContact O-N 3.07Å
33	E	49.6	Very low	65.4	Low	83 Å²	83	117.4 Å²	117.4	39%	0.388	61%	0.606	S	S	.	*			trans	-85.6	106.3	164.2	-79.6	-168.4	135.5	0	0	108.8	L30 R41	L30-E33 HydrophobicContact CD2-CG 3.8Å; L30-E33 WeakPolarHBondContact CD2-OE1 3.46Å; E33-R41 IonicContact OE1-CZ 3.97Å; E33-R41 IonicContact OE1-NE 3.18Å; E33-R41 PolarHBondContact OE1-NE 3.38Å; E33-R41 IonicContact OE1-NH2 3.4Å; E33-R41 IonicContact OE2-CZ 3.81Å; E33-R41 IonicContact OE2-NE 3.21Å; E33-R41 IonicContact OE2-NH2 3.57Å; E33-R41 PolarHBondContact OE2-NH2 3.38Å
34	E	60.4	Low	67.4	Low	171 Å²	171	115.5 Å²	115.5	80%	0.799	60%	0.596	S	S	*	*			trans	-49.6	143.9	137.9	-91	-163	143	0	0	107.3	L36	E34-L36 PolarHBondContact O-N 3Å
35	P	67.1	Low	69.7	Low	118 Å²	118	113.3 Å²	113.3	77%	0.766	59%	0.589	S	S	*	*			trans	-67.4	85.2	-179.2	28.9	-32.9	0	0	0	109.1	T37	P35-T37 PolarHBondContact O-N 3.21Å
36	L	69.5	Low	71.9	Confident	63 Å²	63	113.2 Å²	113.2	33%	0.33	59%	0.585	S	S	.	*			trans	-53.4	130.4	165.6	-79.5	152.8	0	0	0	106.3	E34 E40 R41	E34-L36 PolarHBondContact O-N 3Å; L36-E40 HydrophobicContact CB-CB 4.29Å; L36-E40 HydrophobicContact CD2-CB 3.59Å; L36-E40 HydrophobicContact CD2-CG 4.34Å; L36-R41 HydrophobicContact CB-CG 3.73Å
37	T	86.4	Confident	74.4	Confident	80 Å²	80	113 Å²	113	49%	0.491	58%	0.576	S	S	.	*			trans	-59.3	149.4	171.9	58.2	0	0	0	0	108.8	P35 A39 E40 R41	P35-T37 PolarHBondContact O-N 3.21Å; T37-A39 PolarHBondContact O-N 3.04Å; T37-E40 PolarHBondContact N-OE2 3.44Å; T37-E40 PolarHBondContact O-N 3.36Å; T37-E40 VanDerWaalsContact OG1-CG 3.3Å; T37-E40 WeakPolarHBondContact OG1-CG 3.47Å; T37-E40 PolarHBondContact OG1-OE2 2.91Å; T37-R41 PolarHBondContact O-N 3.45Å; T37-R41 VanDerWaalsContact O-N 3.1Å
38	D	91.4	Very high	76.8	Confident	119 Å²	119	114.8 Å²	114.8	64%	0.636	57%	0.574	S	S	*	*	H	α-helix	trans	-55	-29.9	-178.8	-67.4	-27.6	0	0	0	112.2	R41 M42	D38-R41 IonicContact OD1-NH1 3.92Å; D38-M42 WeakPolarHBondContact O-CB 3.4Å; D38-M42 VanDerWaalsContact O-CG 3.28Å; D38-M42 WeakPolarHBondContact O-CG 3.48Å; D38-M42 PolarHBondContact O-N 3.24Å
39	A	92.3	Very high	79.2	Confident	61 Å²	61	113.7 Å²	113.7	50%	0.504	56%	0.561	S	S	.	*	H	α-helix	trans	-62.8	-42.6	173.2	0	0	0	0	0	113.4	T37 M42 K43	T37-A39 PolarHBondContact O-N 3.04Å; A39-M42 PolarHBondContact O-N 3.5Å; A39-K43 WeakPolarHBondContact O-CB 3.43Å; A39-K43 PolarHBondContact O-N 3.24Å
40	E	93.6	Very high	81.7	Confident	96 Å²	96	108.1 Å²	108.1	45%	0.449	54%	0.543	S	S	.	.	H	α-helix	trans	-70.9	-39.3	178.8	-67.2	162.2	144.1	0	0	111.2	L36 T37 K43 L44	L36-E40 HydrophobicContact CB-CB 4.29Å; L36-E40 HydrophobicContact CD2-CB 3.59Å; L36-E40 HydrophobicContact CD2-CG 4.34Å; T37-E40 PolarHBondContact N-OE2 3.44Å; T37-E40 PolarHBondContact O-N 3.36Å; T37-E40 VanDerWaalsContact OG1-CG 3.3Å; T37-E40 WeakPolarHBondContact OG1-CG 3.47Å; T37-E40 PolarHBondContact OG1-OE2 2.91Å; E40-K43 PolarHBondContact O-N 3.46Å; E40-L44 WeakPolarHBondContact O-CB 3.3Å; E40-L44 PolarHBondContact O-N 3.42Å
41	R	93.7	Very high	84.1	Confident	90 Å²	90	105.6 Å²	105.6	34%	0.34	53%	0.529	S	S	.	.	H	α-helix	trans	-61.1	-45.4	172.9	-72	-179.8	166.8	157	-3	112	E33 L36 T37 D38 K43 L44 L45	E33-R41 IonicContact OE1-CZ 3.97Å; E33-R41 IonicContact OE1-NE 3.18Å; E33-R41 PolarHBondContact OE1-NE 3.38Å; E33-R41 IonicContact OE1-NH2 3.4Å; E33-R41 IonicContact OE2-CZ 3.81Å; E33-R41 IonicContact OE2-NE 3.21Å; E33-R41 IonicContact OE2-NH2 3.57Å; E33-R41 PolarHBondContact OE2-NH2 3.38Å; L36-R41 HydrophobicContact CB-CG 3.73Å; T37-R41 PolarHBondContact O-N 3.45Å; T37-R41 VanDerWaalsContact O-N 3.1Å; D38-R41 IonicContact OD1-NH1 3.92Å; R41-K43 VanDerWaalsContact C-N 3.34Å; R41-K43 PolarHBondContact O-N 3.37Å; R41-L44 PolarHBondContact O-N 2.99Å; R41-L45 WeakPolarHBondContact O-CG 3.5Å; R41-L45 PolarHBondContact O-N 2.95Å
42	M	94.4	Very high	86.7	Confident	126 Å²	126	100.8 Å²	100.8	62%	0.621	51%	0.509	S	S	*	.	H	α-helix	trans	-60.7	-43.4	176	-76.9	-170.2	-54.3	0	0	111.9	D38 A39 L45 Q46	D38-M42 WeakPolarHBondContact O-CB 3.4Å; D38-M42 VanDerWaalsContact O-CG 3.28Å; D38-M42 WeakPolarHBondContact O-CG 3.48Å; D38-M42 PolarHBondContact O-N 3.24Å; A39-M42 PolarHBondContact O-N 3.5Å; M42-L45 PolarHBondContact O-N 2.82Å; M42-Q46 WeakPolarHBondContact O-CB 3.29Å; M42-Q46 PolarHBondContact O-N 3.49Å
43	K	96	Very high	89.1	Confident	134 Å²	134	100.8 Å²	100.8	58%	0.583	50%	0.502	S	S	*	.	H	α-helix	trans	-63	-45.1	179	-169	-174.1	177.8	-159	0	111.5	A39 E40 R41 L45 Q46 E47	A39-K43 WeakPolarHBondContact O-CB 3.43Å; A39-K43 PolarHBondContact O-N 3.24Å; E40-K43 PolarHBondContact O-N 3.46Å; R41-K43 VanDerWaalsContact C-N 3.34Å; R41-K43 PolarHBondContact O-N 3.37Å; K43-L45 PolarHBondContact O-N 3.24Å; K43-Q46 PolarHBondContact O-N 2.93Å; K43-E47 WeakPolarHBondContact CE-OE1 3.39Å; K43-E47 IonicContact NZ-OE1 2.75Å; K43-E47 WeakPolarHBondContact O-CG 3.48Å; K43-E47 PolarHBondContact O-N 3.31Å
44	L	95.4	Very high	91.4	Very high	102 Å²	102	104.2 Å²	104.2	53%	0.534	51%	0.511	S	S	.	.	H	α-helix	trans	-61.1	-45.8	178.2	-175	66.5	0	0	0	111.7	E40 R41 Q46 E47 E48	E40-L44 WeakPolarHBondContact O-CB 3.3Å; E40-L44 PolarHBondContact O-N 3.42Å; R41-L44 PolarHBondContact O-N 2.99Å; L44-Q46 VanDerWaalsContact C-N 3.28Å; L44-Q46 PolarHBondContact O-N 2.95Å; L44-E47 PolarHBondContact O-N 2.98Å; L44-E48 PolarHBondContact O-N 2.72Å
45	L	96.7	Very high	93.2	Very high	111 Å²	111	102.5 Å²	102.5	58%	0.581	50%	0.498	S	S	*	.	H	α-helix	trans	-61.4	-37.2	176.4	-76	171.6	0	0	0	112.3	R41 M42 K43 N49	R41-L45 WeakPolarHBondContact O-CG 3.5Å; R41-L45 PolarHBondContact O-N 2.95Å; M42-L45 PolarHBondContact O-N 2.82Å; K43-L45 PolarHBondContact O-N 3.24Å; L45-N49 WeakPolarHBondContact O-CB 3.46Å; L45-N49 PolarHBondContact O-N 3.34Å
46	Q	97.4	Very high	94.7	Very high	121 Å²	121	102.4 Å²	102.4	57%	0.565	49%	0.49	S	S	*	.	H	α-helix	trans	-67.5	-44.9	177.9	-171.9	171.9	-20.2	0	0	111.6	M42 K43 L44 E48 N49 E50	M42-Q46 WeakPolarHBondContact O-CB 3.29Å; M42-Q46 PolarHBondContact O-N 3.49Å; K43-Q46 PolarHBondContact O-N 2.93Å; L44-Q46 VanDerWaalsContact C-N 3.28Å; L44-Q46 PolarHBondContact O-N 2.95Å; Q46-E48 VanDerWaalsContact C-N 3.35Å; Q46-E48 PolarHBondContact O-N 3.01Å; Q46-N49 PolarHBondContact O-N 3.39Å; Q46-E50 WeakPolarHBondContact O-CG 3.29Å; Q46-E50 PolarHBondContact O-N 2.85Å
47	E	97.3	Very high	96.1	Very high	97 Å²	97	101.6 Å²	101.6	45%	0.453	49%	0.492	S	S	.	.	H	α-helix	trans	-60.8	-43	175.1	-71.5	175	-172	0	0	111.5	K43 L44 N49 E50 E51	K43-E47 WeakPolarHBondContact CE-OE1 3.39Å; K43-E47 IonicContact NZ-OE1 2.75Å; K43-E47 WeakPolarHBondContact O-CG 3.48Å; K43-E47 PolarHBondContact O-N 3.31Å; L44-E47 PolarHBondContact O-N 2.98Å; E47-N49 PolarHBondContact O-N 2.95Å; E47-E50 PolarHBondContact O-N 3.46Å; E47-E51 WeakPolarHBondContact O-CB 3.47Å; E47-E51 PolarHBondContact O-N 2.77Å
48	E	97.4	Very high	96.7	Very high	74 Å²	74	101.6 Å²	101.6	35%	0.346	50%	0.496	S	S	.	.	H	α-helix	trans	-62.7	-42.4	175.3	-173.7	177.5	-165.6	0	0	111.5	L44 Q46 E50 E51 L52	L44-E48 PolarHBondContact O-N 2.72Å; Q46-E48 VanDerWaalsContact C-N 3.35Å; Q46-E48 PolarHBondContact O-N 3.01Å; E48-E50 VanDerWaalsContact C-N 3.35Å; E48-E50 PolarHBondContact O-N 3.17Å; E48-E51 PolarHBondContact O-N 2.84Å; E48-L52 HydrophobicContact CG-CD1 4.2Å; E48-L52 HydrophobicContact CG-CG 4.41Å; E48-L52 WeakPolarHBondContact O-CB 3.43Å; E48-L52 VanDerWaalsContact O-CG 3.29Å; E48-L52 WeakPolarHBondContact O-CG 3.31Å; E48-L52 PolarHBondContact O-N 3.19Å
49	N	98.3	Very high	97	Very high	71 Å²	71	98.4 Å²	98.4	38%	0.38	49%	0.486	S	S	.	.	H	α-helix	trans	-63.7	-41.2	178.4	-153.3	-80.2	0	0	0	112	L45 Q46 E47 E51 L52 R53	L45-N49 WeakPolarHBondContact O-CB 3.46Å; L45-N49 PolarHBondContact O-N 3.34Å; Q46-N49 PolarHBondContact O-N 3.39Å; E47-N49 PolarHBondContact O-N 2.95Å; N49-E51 VanDerWaalsContact C-N 3.35Å; N49-L52 PolarHBondContact O-N 2.86Å; N49-R53 WeakPolarHBondContact O-CB 3.42Å; N49-R53 VanDerWaalsContact O-CG 3.29Å; N49-R53 WeakPolarHBondContact O-CG 3.49Å; N49-R53 PolarHBondContact O-N 2.95Å; N49-R53 PolarHBondContact OD1-NE 3.44Å; N49-R53 VanDerWaalsContact OD1-NE 3.07Å; N49-R53 PolarHBondContact OD1-NH2 3.39Å; N49-R53 VanDerWaalsContact OD1-NH2 3.07Å
50	E	98.4	Very high	97.3	Very high	85 Å²	85	98.1 Å²	98.1	40%	0.397	48%	0.478	S	S	.	.	H	α-helix	trans	-64.3	-39.9	174.9	-73.3	176.8	-169.4	0	0	112.1	Q46 E47 E48 R53 R54	Q46-E50 WeakPolarHBondContact O-CG 3.29Å; Q46-E50 PolarHBondContact O-N 2.85Å; E47-E50 PolarHBondContact O-N 3.46Å; E48-E50 VanDerWaalsContact C-N 3.35Å; E48-E50 PolarHBondContact O-N 3.17Å; E50-R53 PolarHBondContact O-N 2.6Å; E50-R54 WeakPolarHBondContact O-CG 3.3Å; E50-R54 PolarHBondContact O-N 2.7Å
51	E	98.3	Very high	97.5	Very high	61 Å²	61	102.4 Å²	102.4	29%	0.285	49%	0.49	S	S	.	.	H	α-helix	trans	-65.2	-44.1	173.8	179.6	58.1	-165.4	0	0	111.9	E47 E48 N49 R53 R54 R55	E47-E51 WeakPolarHBondContact O-CB 3.47Å; E47-E51 PolarHBondContact O-N 2.77Å; E48-E51 PolarHBondContact O-N 2.84Å; N49-E51 VanDerWaalsContact C-N 3.35Å; E51-R53 VanDerWaalsContact C-N 3.32Å; E51-R53 PolarHBondContact O-N 2.73Å; E51-R54 PolarHBondContact O-N 3.2Å; E51-R54 IonicContact OE2-CZ 3.25Å; E51-R54 VanDerWaalsContact OE2-CZ 3.29Å; E51-R54 IonicContact OE2-NE 2.81Å; E51-R54 PolarHBondContact OE2-NE 2.96Å; E51-R54 IonicContact OE2-NH1 3.09Å; E51-R54 IonicContact OE2-NH2 2.76Å; E51-R54 PolarHBondContact OE2-NH2 2.96Å; E51-R55 WeakPolarHBondContact O-CB 3.49Å; E51-R55 WeakPolarHBondContact O-CG 3.2Å; E51-R55 PolarHBondContact O-N 2.83Å; E51-R55 IonicContact OE1-CZ 3.62Å; E51-R55 IonicContact OE1-NE 3.8Å; E51-R55 PolarHBondContact OE1-NE 2.91Å; E51-R55 IonicContact OE1-NH2 2.72Å; E51-R55 PolarHBondContact OE1-NH2 2.83Å
52	L	98.6	Very high	97.8	Very high	92 Å²	92	106.9 Å²	106.9	48%	0.482	51%	0.507	S	S	.	.	H	α-helix	trans	-60.3	-42.5	175.1	-72.2	172.3	0	0	0	111.4	E48 N49 R55 L56	E48-L52 HydrophobicContact CG-CD1 4.2Å; E48-L52 HydrophobicContact CG-CG 4.41Å; E48-L52 WeakPolarHBondContact O-CB 3.43Å; E48-L52 VanDerWaalsContact O-CG 3.29Å; E48-L52 WeakPolarHBondContact O-CG 3.31Å; E48-L52 PolarHBondContact O-N 3.19Å; N49-L52 PolarHBondContact O-N 2.86Å; L52-R55 PolarHBondContact O-N 3.18Å; L52-L56 VanDerWaalsContact O-CB 3.3Å; L52-L56 WeakPolarHBondContact O-CB 3.35Å; L52-L56 PolarHBondContact O-N 3.34Å
53	R	98.5	Very high	98	Very high	161 Å²	161	104.3 Å²	104.3	61%	0.608	50%	0.498	S	S	*	.	H	α-helix	trans	-61.9	-43.2	174.6	-74.4	172.5	-177.5	151.1	3	112	N49 E50 E51 L56 A57	N49-R53 WeakPolarHBondContact O-CB 3.42Å; N49-R53 VanDerWaalsContact O-CG 3.29Å; N49-R53 WeakPolarHBondContact O-CG 3.49Å; N49-R53 PolarHBondContact O-N 2.95Å; N49-R53 PolarHBondContact OD1-NE 3.44Å; N49-R53 VanDerWaalsContact OD1-NE 3.07Å; N49-R53 PolarHBondContact OD1-NH2 3.39Å; N49-R53 VanDerWaalsContact OD1-NH2 3.07Å; E50-R53 PolarHBondContact O-N 2.6Å; E51-R53 VanDerWaalsContact C-N 3.32Å; E51-R53 PolarHBondContact O-N 2.73Å; R53-L56 PolarHBondContact O-N 3.17Å; R53-A57 WeakPolarHBondContact O-CB 3.46Å; R53-A57 PolarHBondContact O-N 2.9Å
54	R	98.6	Very high	98.1	Very high	155 Å²	155	102 Å²	102	59%	0.585	49%	0.489	S	S	*	.	H	α-helix	trans	-63.2	-45.1	176.3	-78.6	-175.8	-73.3	173.7	-3.3	111.9	E50 E51 A57 S58	E50-R54 WeakPolarHBondContact O-CG 3.3Å; E50-R54 PolarHBondContact O-N 2.7Å; E51-R54 PolarHBondContact O-N 3.2Å; E51-R54 IonicContact OE2-CZ 3.25Å; E51-R54 VanDerWaalsContact OE2-CZ 3.29Å; E51-R54 IonicContact OE2-NE 2.81Å; E51-R54 PolarHBondContact OE2-NE 2.96Å; E51-R54 IonicContact OE2-NH1 3.09Å; E51-R54 IonicContact OE2-NH2 2.76Å; E51-R54 PolarHBondContact OE2-NH2 2.96Å; R54-A57 PolarHBondContact O-N 3.17Å; R54-S58 WeakPolarHBondContact O-CB 3.44Å; R54-S58 PolarHBondContact O-N 2.64Å
55	R	98.6	Very high	98.2	Very high	136 Å²	136	99.2 Å²	99.2	51%	0.513	48%	0.481	S	S	.	.	H	α-helix	trans	-61.8	-45	176.2	-73.2	178.5	-173.6	-173.7	5.8	111.8	E51 L52 S58 A59	E51-R55 WeakPolarHBondContact O-CB 3.49Å; E51-R55 WeakPolarHBondContact O-CG 3.2Å; E51-R55 PolarHBondContact O-N 2.83Å; E51-R55 IonicContact OE1-CZ 3.62Å; E51-R55 IonicContact OE1-NE 3.8Å; E51-R55 PolarHBondContact OE1-NE 2.91Å; E51-R55 IonicContact OE1-NH2 2.72Å; E51-R55 PolarHBondContact OE1-NH2 2.83Å; L52-R55 PolarHBondContact O-N 3.18Å; R55-S58 PolarHBondContact O-N 2.75Å; R55-A59 WeakPolarHBondContact O-CB 3.36Å; R55-A59 PolarHBondContact O-N 3.34Å
56	L	98.6	Very high	98.3	Very high	116 Å²	116	98.4 Å²	98.4	61%	0.607	48%	0.477	S	S	*	.	H	α-helix	trans	-59.6	-50	176.8	-178.4	60.3	0	0	0	110.7	L52 R53 S58 A59 T60	L52-L56 VanDerWaalsContact O-CB 3.3Å; L52-L56 WeakPolarHBondContact O-CB 3.35Å; L52-L56 PolarHBondContact O-N 3.34Å; R53-L56 PolarHBondContact O-N 3.17Å; L56-S58 VanDerWaalsContact C-N 3.31Å; L56-S58 PolarHBondContact O-N 3.31Å; L56-A59 PolarHBondContact O-N 2.91Å; L56-T60 WeakPolarHBondContact O-CB 3.45Å; L56-T60 PolarHBondContact O-N 3.23Å; L56-T60 PolarHBondContact O-OG1 2.86Å
57	A	98.6	Very high	98.4	Very high	46 Å²	46	98.5 Å²	98.5	38%	0.38	48%	0.477	S	S	.	.	H	α-helix	trans	-59.8	-40	178	0	0	0	0	0	112.8	R53 R54 R61	R53-A57 WeakPolarHBondContact O-CB 3.46Å; R53-A57 PolarHBondContact O-N 2.9Å; R54-A57 PolarHBondContact O-N 3.17Å; A57-R61 VanDerWaalsContact O-CG 3.31Å; A57-R61 WeakPolarHBondContact O-CG 3.37Å; A57-R61 PolarHBondContact O-N 3.37Å
58	S	98.5	Very high	98.5	Very high	80 Å²	80	101.9 Å²	101.9	56%	0.559	49%	0.486	S	S	*	.	H	α-helix	trans	-64.7	-45.8	175.5	-177.3	0	0	0	0	111.8	R54 R55 L56 R61 R62	R54-S58 WeakPolarHBondContact O-CB 3.44Å; R54-S58 PolarHBondContact O-N 2.64Å; R55-S58 PolarHBondContact O-N 2.75Å; L56-S58 VanDerWaalsContact C-N 3.31Å; L56-S58 PolarHBondContact O-N 3.31Å; S58-R61 PolarHBondContact O-N 2.99Å; S58-R62 WeakPolarHBondContact O-CB 3.4Å; S58-R62 PolarHBondContact O-N 3.17Å
59	A	98.3	Very high	98.5	Very high	52 Å²	52	104.5 Å²	104.5	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-61.2	-46	176.9	0	0	0	0	0	111.3	R55 L56 R61 R62 T63	R55-A59 WeakPolarHBondContact O-CB 3.36Å; R55-A59 PolarHBondContact O-N 3.34Å; L56-A59 PolarHBondContact O-N 2.91Å; A59-R61 PolarHBondContact O-N 3.48Å; A59-R62 WeakPolarHBondContact O-CB 3.43Å; A59-R62 PolarHBondContact O-N 3.06Å; A59-R62 VanDerWaalsContact O-N 3.17Å; A59-T63 WeakPolarHBondContact O-CG2 3.49Å; A59-T63 PolarHBondContact O-N 3.5Å; A59-T63 PolarHBondContact O-OG1 3.15Å
60	T	98.4	Very high	98.5	Very high	55 Å²	55	106.3 Å²	106.3	34%	0.337	51%	0.507	S	S	.	.	H	α-helix	trans	-58.8	-46.9	176	-59.6	0	0	0	0	111.9	L56 R62 T63 E64	L56-T60 WeakPolarHBondContact O-CB 3.45Å; L56-T60 PolarHBondContact O-N 3.23Å; L56-T60 PolarHBondContact O-OG1 2.86Å; T60-R62 VanDerWaalsContact C-N 3.27Å; T60-R62 PolarHBondContact O-N 3.02Å; T60-T63 WeakPolarHBondContact CA-OG1 3.45Å; T60-T63 PolarHBondContact O-N 3.21Å; T60-T63 PolarHBondContact O-OG1 2.84Å; T60-E64 HydrophobicContact CG2-CG 4.41Å; T60-E64 WeakPolarHBondContact CG2-OE1 3.46Å; T60-E64 WeakPolarHBondContact O-CB 3.34Å; T60-E64 VanDerWaalsContact O-CG 3.29Å; T60-E64 WeakPolarHBondContact O-CG 3.47Å; T60-E64 PolarHBondContact O-N 2.83Å
61	R	98.6	Very high	98.5	Very high	186 Å²	186	108 Å²	108	70%	0.702	52%	0.515	S	S	*	.	H	α-helix	trans	-61.6	-37.8	176.6	-73.2	176	-174.8	-145.1	2	112.4	A57 S58 A59 A65	A57-R61 VanDerWaalsContact O-CG 3.31Å; A57-R61 WeakPolarHBondContact O-CG 3.37Å; A57-R61 PolarHBondContact O-N 3.37Å; S58-R61 PolarHBondContact O-N 2.99Å; A59-R61 PolarHBondContact O-N 3.48Å; R61-A65 WeakPolarHBondContact O-CB 3.44Å; R61-A65 PolarHBondContact O-N 3.3Å
62	R	98.6	Very high	98.5	Very high	184 Å²	184	110 Å²	110	69%	0.694	53%	0.527	S	S	*	.	H	α-helix	trans	-66.3	-42.9	177	-175	-175.7	178	104	3.2	111.3	S58 A59 T60 A65 L66	S58-R62 WeakPolarHBondContact O-CB 3.4Å; S58-R62 PolarHBondContact O-N 3.17Å; A59-R62 WeakPolarHBondContact O-CB 3.43Å; A59-R62 PolarHBondContact O-N 3.06Å; A59-R62 VanDerWaalsContact O-N 3.17Å; T60-R62 VanDerWaalsContact C-N 3.27Å; T60-R62 PolarHBondContact O-N 3.02Å; R62-A65 PolarHBondContact O-N 3.43Å; R62-L66 HydrophobicContact CG-CD1 4.44Å; R62-L66 WeakPolarHBondContact O-CG 3.31Å; R62-L66 PolarHBondContact O-N 3.35Å
63	T	98.4	Very high	98.5	Very high	71 Å²	71	107.1 Å²	107.1	44%	0.436	52%	0.519	S	S	.	.	H	α-helix	trans	-66.1	-44.7	177.8	54	0	0	0	0	111	A59 T60 A65 L66 E67	A59-T63 WeakPolarHBondContact O-CG2 3.49Å; A59-T63 PolarHBondContact O-N 3.5Å; A59-T63 PolarHBondContact O-OG1 3.15Å; T60-T63 WeakPolarHBondContact CA-OG1 3.45Å; T60-T63 PolarHBondContact O-N 3.21Å; T60-T63 PolarHBondContact O-OG1 2.84Å; T63-A65 VanDerWaalsContact C-N 3.28Å; T63-A65 PolarHBondContact O-N 3.33Å; T63-L66 PolarHBondContact O-N 3.46Å; T63-E67 WeakPolarHBondContact O-CG 3.43Å; T63-E67 PolarHBondContact O-N 3.3Å
64	E	98.6	Very high	98.5	Very high	86 Å²	86	104.7 Å²	104.7	40%	0.402	52%	0.515	S	S	.	.	H	α-helix	trans	-59	-37.9	176.2	-72.9	171.7	178.4	0	0	112.4	T60 R68	T60-E64 HydrophobicContact CG2-CG 4.41Å; T60-E64 WeakPolarHBondContact CG2-OE1 3.46Å; T60-E64 WeakPolarHBondContact O-CB 3.34Å; T60-E64 VanDerWaalsContact O-CG 3.29Å; T60-E64 WeakPolarHBondContact O-CG 3.47Å; T60-E64 PolarHBondContact O-N 2.83Å; E64-R68 WeakPolarHBondContact O-CG 3.29Å; E64-R68 PolarHBondContact O-N 2.92Å
65	A	98.5	Very high	98.5	Very high	44 Å²	44	101.9 Å²	101.9	36%	0.364	51%	0.511	S	S	.	.	H	α-helix	trans	-65.6	-44.9	176.6	0	0	0	0	0	111.9	R61 R62 T63 E67 R68 E69	R61-A65 WeakPolarHBondContact O-CB 3.44Å; R61-A65 PolarHBondContact O-N 3.3Å; R62-A65 PolarHBondContact O-N 3.43Å; T63-A65 VanDerWaalsContact C-N 3.28Å; T63-A65 PolarHBondContact O-N 3.33Å; A65-E67 VanDerWaalsContact C-N 3.35Å; A65-R68 PolarHBondContact O-N 2.9Å; A65-E69 PolarHBondContact O-N 3.29Å
66	L	98.6	Very high	98.5	Very high	93 Å²	93	98.5 Å²	98.5	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-66	-36.8	177.7	-68.9	171.5	0	0	0	112.3	R62 T63 R68 E69 L70	R62-L66 HydrophobicContact CG-CD1 4.44Å; R62-L66 WeakPolarHBondContact O-CG 3.31Å; R62-L66 PolarHBondContact O-N 3.35Å; T63-L66 PolarHBondContact O-N 3.46Å; L66-R68 VanDerWaalsContact C-N 3.34Å; L66-E69 PolarHBondContact O-N 3.19Å; L66-L70 WeakPolarHBondContact O-CB 3.49Å; L66-L70 PolarHBondContact O-N 2.97Å
67	E	98.5	Very high	98.5	Very high	124 Å²	124	97.9 Å²	97.9	58%	0.579	51%	0.505	S	S	*	.	H	α-helix	trans	-61.3	-43	174.9	-75.2	170.2	172.5	0	0	111.4	T63 A65 L70 E71	T63-E67 WeakPolarHBondContact O-CG 3.43Å; T63-E67 PolarHBondContact O-N 3.3Å; A65-E67 VanDerWaalsContact C-N 3.35Å; E67-L70 WeakPolarHBondContact O-CB 3.39Å; E67-L70 PolarHBondContact O-N 3.38Å; E67-E71 WeakPolarHBondContact O-CB 3.34Å; E67-E71 PolarHBondContact O-N 3.33Å
68	R	98.6	Very high	98.5	Very high	167 Å²	167	102.6 Å²	102.6	63%	0.63	52%	0.519	S	S	*	.	H	α-helix	trans	-64.8	-42.9	175.6	-68.9	173.4	-169.8	-138.9	2.7	112.5	E64 A65 L66 L70 E71 I72	E64-R68 WeakPolarHBondContact O-CG 3.29Å; E64-R68 PolarHBondContact O-N 2.92Å; A65-R68 PolarHBondContact O-N 2.9Å; L66-R68 VanDerWaalsContact C-N 3.34Å; R68-L70 VanDerWaalsContact C-N 3.25Å; R68-L70 PolarHBondContact O-N 3.18Å; R68-E71 PolarHBondContact O-N 2.99Å; R68-I72 WeakPolarHBondContact O-CD1 3.43Å; R68-I72 VanDerWaalsContact O-CG1 3.25Å; R68-I72 WeakPolarHBondContact O-CG1 3.49Å; R68-I72 PolarHBondContact O-N 3.25Å
69	E	98.6	Very high	98.5	Very high	130 Å²	130	104 Å²	104	61%	0.607	52%	0.519	S	S	*	.	H	α-helix	trans	-60.8	-38.9	175.8	-73.6	176.2	-161.6	0	0	111.4	A65 L66 G73	A65-E69 PolarHBondContact O-N 3.29Å; L66-E69 PolarHBondContact O-N 3.19Å; E69-G73 PolarHBondContact O-N 3.42Å
70	L	98.7	Very high	98.5	Very high	109 Å²	109	106.9 Å²	106.9	57%	0.571	52%	0.524	S	S	*	.	H	α-helix	trans	-66.8	-45.2	176.5	-176.7	66.4	0	0	0	112	L66 E67 R68 G73 Q74	L66-L70 WeakPolarHBondContact O-CB 3.49Å; L66-L70 PolarHBondContact O-N 2.97Å; E67-L70 WeakPolarHBondContact O-CB 3.39Å; E67-L70 PolarHBondContact O-N 3.38Å; R68-L70 VanDerWaalsContact C-N 3.25Å; R68-L70 PolarHBondContact O-N 3.18Å; L70-G73 PolarHBondContact O-N 3.44Å; L70-Q74 WeakPolarHBondContact O-CG 3.25Å; L70-Q74 PolarHBondContact O-N 2.97Å
71	E	98.6	Very high	98.6	Very high	119 Å²	119	110.1 Å²	110.1	56%	0.556	54%	0.539	S	S	*	.	H	α-helix	trans	-58.9	-48.1	177	-173.8	174.1	-156.9	0	0	111	E67 R68 G73 Q74 D75	E67-E71 WeakPolarHBondContact O-CB 3.34Å; E67-E71 PolarHBondContact O-N 3.33Å; R68-E71 PolarHBondContact O-N 2.99Å; E71-G73 VanDerWaalsContact C-N 3.3Å; E71-G73 PolarHBondContact O-N 3.07Å; E71-Q74 WeakPolarHBondContact O-CB 3.48Å; E71-Q74 PolarHBondContact O-N 3.43Å; E71-Q74 VanDerWaalsContact O-N 3.11Å; E71-D75 PolarHBondContact O-N 3.32Å
72	I	98.4	Very high	98.5	Very high	105 Å²	105	102.8 Å²	102.8	54%	0.538	52%	0.521	S	S	.	.	H	α-helix	trans	-58.4	-43.3	174.6	-66.8	164.7	0	0	0	111.1	R68 Q74 D75 C76	R68-I72 WeakPolarHBondContact O-CD1 3.43Å; R68-I72 VanDerWaalsContact O-CG1 3.25Å; R68-I72 WeakPolarHBondContact O-CG1 3.49Å; R68-I72 PolarHBondContact O-N 3.25Å; I72-Q74 VanDerWaalsContact C-N 3.32Å; I72-Q74 PolarHBondContact O-N 2.87Å; I72-D75 PolarHBondContact O-N 3.48Å; I72-C76 PolarHBondContact O-N 2.95Å; I72-C76 PolarHBondContact O-SG 2.9Å
73	G	98.4	Very high	98.5	Very high	31 Å²	31	98.8 Å²	98.8	32%	0.32	51%	0.51	S	S	.	.	H	α-helix	trans	-62.5	-38.5	177.4	0	0	0	0	0	112.9	E69 L70 E71 L77	E69-G73 PolarHBondContact O-N 3.42Å; L70-G73 PolarHBondContact O-N 3.44Å; E71-G73 VanDerWaalsContact C-N 3.3Å; E71-G73 PolarHBondContact O-N 3.07Å; G73-L77 VanDerWaalsContact O-CG 3.31Å; G73-L77 WeakPolarHBondContact O-CG 3.48Å; G73-L77 PolarHBondContact O-N 3.18Å; G73-L77 VanDerWaalsContact O-N 3.13Å
74	Q	98.6	Very high	98.5	Very high	110 Å²	110	98.7 Å²	98.7	51%	0.514	51%	0.512	S	S	.	.	H	α-helix	trans	-64.8	-48.9	175.8	-72.8	172.8	2.3	0	0	111.2	L70 E71 I72 C76 L77 E78	L70-Q74 WeakPolarHBondContact O-CG 3.25Å; L70-Q74 PolarHBondContact O-N 2.97Å; E71-Q74 WeakPolarHBondContact O-CB 3.48Å; E71-Q74 PolarHBondContact O-N 3.43Å; E71-Q74 VanDerWaalsContact O-N 3.11Å; I72-Q74 VanDerWaalsContact C-N 3.32Å; I72-Q74 PolarHBondContact O-N 2.87Å; Q74-C76 VanDerWaalsContact C-N 3.32Å; Q74-C76 PolarHBondContact O-N 3.4Å; Q74-L77 PolarHBondContact O-N 3.13Å; Q74-E78 WeakPolarHBondContact O-CB 3.26Å; Q74-E78 PolarHBondContact O-N 3Å
75	D	98.4	Very high	98.5	Very high	96 Å²	96	103.2 Å²	103.2	51%	0.513	53%	0.526	S	S	.	.	H	α-helix	trans	-58.8	-43.3	179	-69.6	-15.3	0	0	0	111.8	E71 I72 E78 L79	E71-D75 PolarHBondContact O-N 3.32Å; I72-D75 PolarHBondContact O-N 3.48Å; D75-E78 PolarHBondContact O-N 3.03Å; D75-L79 WeakPolarHBondContact O-CB 3.31Å; D75-L79 PolarHBondContact O-N 3.35Å
76	C	98.4	Very high	98.5	Very high	65 Å²	65	106.5 Å²	106.5	44%	0.439	53%	0.534	S	S	.	.	H	α-helix	trans	-60.2	-47.8	176	-73.6	0	0	0	0	111.9	I72 Q74 L79 E80	I72-C76 PolarHBondContact O-N 2.95Å; I72-C76 PolarHBondContact O-SG 2.9Å; Q74-C76 VanDerWaalsContact C-N 3.32Å; Q74-C76 PolarHBondContact O-N 3.4Å; C76-L79 PolarHBondContact O-N 3.04Å; C76-E80 WeakPolarHBondContact O-CG 3.47Å; C76-E80 PolarHBondContact O-N 3.42Å
77	L	98.6	Very high	98.5	Very high	103 Å²	103	108.2 Å²	108.2	54%	0.539	54%	0.539	S	S	.	.	H	α-helix	trans	-66.3	-39	179.8	-72.3	172.5	0	0	0	112	G73 Q74 L79 E80 L81	G73-L77 VanDerWaalsContact O-CG 3.31Å; G73-L77 WeakPolarHBondContact O-CG 3.48Å; G73-L77 PolarHBondContact O-N 3.18Å; G73-L77 VanDerWaalsContact O-N 3.13Å; Q74-L77 PolarHBondContact O-N 3.13Å; L77-L79 VanDerWaalsContact C-N 3.31Å; L77-L79 PolarHBondContact O-N 3.38Å; L77-E80 PolarHBondContact O-N 3.46Å; L77-L81 WeakPolarHBondContact O-CB 3.5Å; L77-L81 VanDerWaalsContact O-CG 3.26Å; L77-L81 WeakPolarHBondContact O-CG 3.36Å; L77-L81 PolarHBondContact O-N 3.11Å
78	E	98.6	Very high	98.5	Very high	144 Å²	144	107.1 Å²	107.1	67%	0.673	54%	0.536	S	S	*	.	H	α-helix	trans	-61.3	-43	176.1	-176.1	168.6	-167.4	0	0	111.1	Q74 D75 G82	Q74-E78 WeakPolarHBondContact O-CB 3.26Å; Q74-E78 PolarHBondContact O-N 3Å; D75-E78 PolarHBondContact O-N 3.03Å; E78-G82 PolarHBondContact O-N 2.76Å
79	L	98.6	Very high	98.5	Very high	109 Å²	109	102 Å²	102	57%	0.571	52%	0.522	S	S	*	.	H	α-helix	trans	-61.7	-49.3	175.9	-178.1	65.5	0	0	0	112.1	D75 C76 L77 L81 G82 Q83	D75-L79 WeakPolarHBondContact O-CB 3.31Å; D75-L79 PolarHBondContact O-N 3.35Å; C76-L79 PolarHBondContact O-N 3.04Å; L77-L79 VanDerWaalsContact C-N 3.31Å; L77-L79 PolarHBondContact O-N 3.38Å; L79-L81 PolarHBondContact O-N 2.81Å; L79-G82 PolarHBondContact O-N 3.09Å; L79-Q83 WeakPolarHBondContact O-CG 3.44Å; L79-Q83 PolarHBondContact O-N 3.34Å
80	E	98.6	Very high	98.5	Very high	113 Å²	113	101.4 Å²	101.4	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-62.1	-41.5	179.8	-73	178.6	-174.4	0	0	112.3	C76 L77 Q83 S84	C76-E80 WeakPolarHBondContact O-CG 3.47Å; C76-E80 PolarHBondContact O-N 3.42Å; L77-E80 PolarHBondContact O-N 3.46Å; E80-Q83 PolarHBondContact O-N 3.29Å; E80-S84 WeakPolarHBondContact O-CB 3.41Å; E80-S84 PolarHBondContact O-N 3.17Å; E80-S84 PolarHBondContact O-OG 3.26Å
81	L	98.6	Very high	98.5	Very high	124 Å²	124	101.6 Å²	101.6	65%	0.649	51%	0.514	S	S	*	.	H	α-helix	trans	-66.1	-40.7	175.6	-72.9	174.5	0	0	0	111.6	L77 L79 S84 R85	L77-L81 WeakPolarHBondContact O-CB 3.5Å; L77-L81 VanDerWaalsContact O-CG 3.26Å; L77-L81 WeakPolarHBondContact O-CG 3.36Å; L77-L81 PolarHBondContact O-N 3.11Å; L79-L81 PolarHBondContact O-N 2.81Å; L81-S84 PolarHBondContact O-N 3Å; L81-R85 WeakPolarHBondContact O-CB 3.46Å; L81-R85 PolarHBondContact O-N 2.96Å
82	G	98.4	Very high	98.4	Very high	32 Å²	32	100.8 Å²	100.8	33%	0.33	51%	0.508	S	S	.	.	H	α-helix	trans	-57.9	-50	174.2	0	0	0	0	0	111.8	E78 L79 S84 R85 E86	E78-G82 PolarHBondContact O-N 2.76Å; L79-G82 PolarHBondContact O-N 3.09Å; G82-S84 PolarHBondContact O-N 3.28Å; G82-R85 WeakPolarHBondContact O-CB 3.5Å; G82-R85 PolarHBondContact O-N 3Å; G82-E86 WeakPolarHBondContact O-CG 3.44Å; G82-E86 PolarHBondContact O-N 2.96Å
83	Q	98.5	Very high	98.4	Very high	99 Å²	99	99 Å²	99	46%	0.463	50%	0.499	S	S	.	.	H	α-helix	trans	-59.6	-48.9	177.1	-70.4	174.4	10.6	0	0	112	L79 E80 R85 E86 E87	L79-Q83 WeakPolarHBondContact O-CG 3.44Å; L79-Q83 PolarHBondContact O-N 3.34Å; E80-Q83 PolarHBondContact O-N 3.29Å; Q83-R85 PolarHBondContact O-N 3.47Å; Q83-E86 WeakPolarHBondContact O-CB 3.44Å; Q83-E86 PolarHBondContact O-N 3.5Å; Q83-E86 VanDerWaalsContact O-N 3.17Å; Q83-E87 WeakPolarHBondContact O-CG 3.34Å; Q83-E87 PolarHBondContact O-N 2.93Å
84	S	98.4	Very high	98.4	Very high	69 Å²	69	104.1 Å²	104.1	48%	0.483	51%	0.513	S	S	.	.	H	α-helix	trans	-58.3	-39.6	178.8	-61	0	0	0	0	111.8	E80 L81 G82 E87 L88	E80-S84 WeakPolarHBondContact O-CB 3.41Å; E80-S84 PolarHBondContact O-N 3.17Å; E80-S84 PolarHBondContact O-OG 3.26Å; L81-S84 PolarHBondContact O-N 3Å; G82-S84 PolarHBondContact O-N 3.28Å; S84-E87 PolarHBondContact O-N 3.48Å; S84-L88 WeakPolarHBondContact O-CB 3.26Å; S84-L88 PolarHBondContact O-N 3.29Å
85	R	98.5	Very high	98.3	Very high	181 Å²	181	103.5 Å²	103.5	68%	0.683	51%	0.509	S	S	*	.	H	α-helix	trans	-66.7	-44.3	177.5	-172.3	180	179.2	-146.6	-0.7	111.8	L81 G82 Q83 E87 L88 D89	L81-R85 WeakPolarHBondContact O-CB 3.46Å; L81-R85 PolarHBondContact O-N 2.96Å; G82-R85 WeakPolarHBondContact O-CB 3.5Å; G82-R85 PolarHBondContact O-N 3Å; Q83-R85 PolarHBondContact O-N 3.47Å; R85-E87 VanDerWaalsContact C-N 3.33Å; R85-E87 PolarHBondContact O-N 2.86Å; R85-L88 PolarHBondContact O-N 3.43Å; R85-D89 PolarHBondContact O-N 2.91Å
86	E	98.5	Very high	98.3	Very high	114 Å²	114	105.3 Å²	105.3	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-61.3	-41.9	175.4	-72.2	-179.4	-166.1	0	0	112.2	G82 Q83 L88 D89 K90	G82-E86 WeakPolarHBondContact O-CG 3.44Å; G82-E86 PolarHBondContact O-N 2.96Å; Q83-E86 WeakPolarHBondContact O-CB 3.44Å; Q83-E86 PolarHBondContact O-N 3.5Å; Q83-E86 VanDerWaalsContact O-N 3.17Å; E86-L88 VanDerWaalsContact C-N 3.34Å; E86-D89 PolarHBondContact O-N 2.94Å; E86-K90 VanDerWaalsContact O-CG 3.26Å; E86-K90 WeakPolarHBondContact O-CG 3.35Å; E86-K90 PolarHBondContact O-N 3.47Å; E86-K90 IonicContact OE2-NZ 3.82Å
87	E	98.4	Very high	98.2	Very high	129 Å²	129	111.5 Å²	111.5	60%	0.603	52%	0.523	S	S	*	.	H	α-helix	trans	-62.3	-42.6	175.6	-71.9	-174.2	170.2	0	0	111.9	Q83 S84 R85 K90 F91	Q83-E87 WeakPolarHBondContact O-CG 3.34Å; Q83-E87 PolarHBondContact O-N 2.93Å; S84-E87 PolarHBondContact O-N 3.48Å; R85-E87 VanDerWaalsContact C-N 3.33Å; R85-E87 PolarHBondContact O-N 2.86Å; E87-K90 WeakPolarHBondContact O-CB 3.32Å; E87-K90 PolarHBondContact O-N 3.46Å; E87-F91 WeakPolarHBondContact O-CB 3.37Å; E87-F91 PolarHBondContact O-N 2.95Å
88	L	98.6	Very high	98.1	Very high	100 Å²	100	113.5 Å²	113.5	52%	0.524	53%	0.533	S	S	.	.	H	α-helix	trans	-62.7	-41.9	175.4	-178.1	61.2	0	0	0	111.8	S84 R85 E86 F91 K92	S84-L88 WeakPolarHBondContact O-CB 3.26Å; S84-L88 PolarHBondContact O-N 3.29Å; R85-L88 PolarHBondContact O-N 3.43Å; E86-L88 VanDerWaalsContact C-N 3.34Å; L88-F91 WeakPolarHBondContact O-CB 3.46Å; L88-F91 PolarHBondContact O-N 3.05Å; L88-K92 HydrophobicContact CD1-CD 4.48Å; L88-K92 HydrophobicContact CG-CD 4.07Å; L88-K92 WeakPolarHBondContact O-CB 3.5Å; L88-K92 WeakPolarHBondContact O-CG 3.49Å; L88-K92 PolarHBondContact O-N 3.32Å
89	D	98.3	Very high	97.6	Very high	59 Å²	59	114.2 Å²	114.2	32%	0.316	54%	0.537	S	S	.	.	H	α-helix	trans	-66.6	-40.3	176.8	-77.4	-28.5	0	0	0	111.8	R85 E86 F91 K92 D93	R85-D89 PolarHBondContact O-N 2.91Å; E86-D89 PolarHBondContact O-N 2.94Å; D89-F91 VanDerWaalsContact C-N 3.29Å; D89-F91 PolarHBondContact O-N 3.32Å; D89-K92 PolarHBondContact O-N 3.27Å; D89-K92 IonicContact OD1-NZ 3.78Å; D89-K92 PolarHBondContact OD1-NZ 3.34Å; D89-D93 WeakPolarHBondContact O-CB 3.35Å; D89-D93 PolarHBondContact O-N 3.39Å
90	K	98.5	Very high	96.2	Very high	118 Å²	118	117.7 Å²	117.7	51%	0.513	56%	0.556	S	S	.	*	H	α-helix	trans	-58.3	-42	171	-71.9	165.1	-169.4	159.7	0	111.5	E86 E87 K94	E86-K90 VanDerWaalsContact O-CG 3.26Å; E86-K90 WeakPolarHBondContact O-CG 3.35Å; E86-K90 PolarHBondContact O-N 3.47Å; E86-K90 IonicContact OE2-NZ 3.82Å; E87-K90 WeakPolarHBondContact O-CB 3.32Å; E87-K90 PolarHBondContact O-N 3.46Å; K90-K94 WeakPolarHBondContact O-CG 3.48Å; K90-K94 PolarHBondContact O-N 3.15Å; K90-K94 VanDerWaalsContact O-N 3.09Å
91	F	98	Very high	96.1	Very high	114 Å²	114	118 Å²	118	50%	0.5	56%	0.557	S	S	.	*	H	α-helix	trans	-65.9	-47.2	177.3	-174.2	-97	0	0	0	111.4	E87 L88 D89 D93 K94 F95	E87-F91 WeakPolarHBondContact O-CB 3.37Å; E87-F91 PolarHBondContact O-N 2.95Å; L88-F91 WeakPolarHBondContact O-CB 3.46Å; L88-F91 PolarHBondContact O-N 3.05Å; D89-F91 VanDerWaalsContact C-N 3.29Å; D89-F91 PolarHBondContact O-N 3.32Å; F91-D93 VanDerWaalsContact C-N 3.29Å; F91-D93 PolarHBondContact O-N 2.93Å; F91-K94 WeakPolarHBondContact O-CB 3.48Å; F91-K94 PolarHBondContact O-N 3.09Å; F91-K94 VanDerWaalsContact O-N 3.15Å; F91-F95 AromaticContact CD1-CD2 3.69Å; F91-F95 HydrophobicContact CD1-CD2 3.69Å; F91-F95 AromaticContact CD1-CE2 3.81Å; F91-F95 HydrophobicContact CD1-CE2 3.81Å; F91-F95 HydrophobicContact CD2-CD2 4.3Å; F91-F95 HydrophobicContact CD2-CE2 4Å; F91-F95 AromaticContact CE1-CD2 3.46Å; F91-F95 HydrophobicContact CE1-CD2 3.46Å; F91-F95 VanDerWaalsContact CE1-CD2 3.46Å; F91-F95 AromaticContact CE1-CE2 3.14Å; F91-F95 HydrophobicContact CE1-CE2 3.14Å; F91-F95 HydrophobicContact CE1-CG 4.35Å; F91-F95 AromaticContact CE1-CZ 3.75Å; F91-F95 HydrophobicContact CE1-CZ 3.75Å; F91-F95 HydrophobicContact CE2-CD2 4.11Å; F91-F95 AromaticContact CE2-CE2 3.38Å; F91-F95 HydrophobicContact CE2-CE2 3.38Å; F91-F95 HydrophobicContact CE2-CZ 4.23Å; F91-F95 HydrophobicContact CG-CD2 4.14Å; F91-F95 HydrophobicContact CG-CE2 4.22Å; F91-F95 AromaticContact CZ-CD2 3.72Å; F91-F95 HydrophobicContact CZ-CD2 3.72Å; F91-F95 AromaticContact CZ-CE2 2.92Å; F91-F95 HydrophobicContact CZ-CE2 2.92Å; F91-F95 AromaticContact CZ-CZ 3.47Å; F91-F95 HydrophobicContact CZ-CZ 3.47Å; F91-F95 VanDerWaalsContact CZ-CZ 3.47Å; F91-F95 WeakPolarHBondContact O-CD2 3.48Å; F91-F95 PolarHBondContact O-N 3.09Å
92	K	97.9	Very high	95.9	Very high	102 Å²	102	117.6 Å²	117.6	44%	0.443	55%	0.552	S	S	.	*	H	α-helix	trans	-57.4	-41.3	176.2	-75.7	163.3	57.8	-159.1	0	112.1	L88 D89 F95 R96	L88-K92 HydrophobicContact CD1-CD 4.48Å; L88-K92 HydrophobicContact CG-CD 4.07Å; L88-K92 WeakPolarHBondContact O-CB 3.5Å; L88-K92 WeakPolarHBondContact O-CG 3.49Å; L88-K92 PolarHBondContact O-N 3.32Å; D89-K92 PolarHBondContact O-N 3.27Å; D89-K92 IonicContact OD1-NZ 3.78Å; D89-K92 PolarHBondContact OD1-NZ 3.34Å; K92-F95 PolarHBondContact O-N 3.39Å; K92-R96 PolarHBondContact O-N 3.33Å
93	D	97.9	Very high	95.8	Very high	66 Å²	66	122.4 Å²	122.4	35%	0.353	57%	0.565	S	S	.	*	H	α-helix	trans	-67.1	-39.4	177.3	-81	-11.8	0	0	0	112.4	D89 F91 R96 R97	D89-D93 WeakPolarHBondContact O-CB 3.35Å; D89-D93 PolarHBondContact O-N 3.39Å; F91-D93 VanDerWaalsContact C-N 3.29Å; F91-D93 PolarHBondContact O-N 2.93Å; D93-R96 PolarHBondContact O-N 2.91Å; D93-R96 IonicContact OD1-CZ 3.46Å; D93-R96 VanDerWaalsContact OD1-CZ 3.25Å; D93-R96 IonicContact OD1-NH1 3.29Å; D93-R96 PolarHBondContact OD1-NH1 3.29Å; D93-R96 IonicContact OD1-NH2 3.17Å; D93-R96 PolarHBondContact OD1-NH2 2.85Å; D93-R96 VanDerWaalsContact OD1-NH2 3.09Å; D93-R97 WeakPolarHBondContact O-CG 3.34Å; D93-R97 PolarHBondContact O-N 3.38Å; D93-R97 VanDerWaalsContact O-N 3.09Å
94	K	98.1	Very high	95.6	Very high	139 Å²	139	123.8 Å²	123.8	60%	0.604	57%	0.571	S	S	*	*	H	α-helix	trans	-60.9	-44.5	172.5	-72.2	172.1	-177	178.3	0	111.4	K90 F91 R97 L98	K90-K94 WeakPolarHBondContact O-CG 3.48Å; K90-K94 PolarHBondContact O-N 3.15Å; K90-K94 VanDerWaalsContact O-N 3.09Å; F91-K94 WeakPolarHBondContact O-CB 3.48Å; F91-K94 PolarHBondContact O-N 3.09Å; F91-K94 VanDerWaalsContact O-N 3.15Å; K94-R97 PolarHBondContact O-N 3.25Å; K94-L98 WeakPolarHBondContact O-CG 3.46Å; K94-L98 PolarHBondContact O-N 3.34Å; K94-L98 VanDerWaalsContact O-N 3.14Å
95	F	97.2	Very high	95.5	Very high	98 Å²	98	127.2 Å²	127.2	43%	0.43	58%	0.576	S	S	.	*	H	α-helix	trans	-60.9	-45.6	176.4	-93	-101	0	0	0	112.2	F91 K92 R97 L98 Q99	F91-F95 AromaticContact CD1-CD2 3.69Å; F91-F95 HydrophobicContact CD1-CD2 3.69Å; F91-F95 AromaticContact CD1-CE2 3.81Å; F91-F95 HydrophobicContact CD1-CE2 3.81Å; F91-F95 HydrophobicContact CD2-CD2 4.3Å; F91-F95 HydrophobicContact CD2-CE2 4Å; F91-F95 AromaticContact CE1-CD2 3.46Å; F91-F95 HydrophobicContact CE1-CD2 3.46Å; F91-F95 VanDerWaalsContact CE1-CD2 3.46Å; F91-F95 AromaticContact CE1-CE2 3.14Å; F91-F95 HydrophobicContact CE1-CE2 3.14Å; F91-F95 HydrophobicContact CE1-CG 4.35Å; F91-F95 AromaticContact CE1-CZ 3.75Å; F91-F95 HydrophobicContact CE1-CZ 3.75Å; F91-F95 HydrophobicContact CE2-CD2 4.11Å; F91-F95 AromaticContact CE2-CE2 3.38Å; F91-F95 HydrophobicContact CE2-CE2 3.38Å; F91-F95 HydrophobicContact CE2-CZ 4.23Å; F91-F95 HydrophobicContact CG-CD2 4.14Å; F91-F95 HydrophobicContact CG-CE2 4.22Å; F91-F95 AromaticContact CZ-CD2 3.72Å; F91-F95 HydrophobicContact CZ-CD2 3.72Å; F91-F95 AromaticContact CZ-CE2 2.92Å; F91-F95 HydrophobicContact CZ-CE2 2.92Å; F91-F95 AromaticContact CZ-CZ 3.47Å; F91-F95 HydrophobicContact CZ-CZ 3.47Å; F91-F95 VanDerWaalsContact CZ-CZ 3.47Å; F91-F95 WeakPolarHBondContact O-CD2 3.48Å; F91-F95 PolarHBondContact O-N 3.09Å; K92-F95 PolarHBondContact O-N 3.39Å; F95-R97 VanDerWaalsContact C-N 3.27Å; F95-R97 PolarHBondContact O-N 2.9Å; F95-L98 PolarHBondContact O-N 3.14Å; F95-L98 VanDerWaalsContact O-N 3.12Å; F95-Q99 PolarHBondContact O-N 3.12Å; F95-Q99 VanDerWaalsContact O-N 3.14Å
96	R	97.5	Very high	95.3	Very high	133 Å²	133	123.6 Å²	123.6	50%	0.502	57%	0.569	S	S	.	*	H	α-helix	trans	-57.7	-41.1	177.1	-167.5	-171.2	-57.6	126.6	11.5	111.7	K92 D93 L98 Q99 N100	K92-R96 PolarHBondContact O-N 3.33Å; D93-R96 PolarHBondContact O-N 2.91Å; D93-R96 IonicContact OD1-CZ 3.46Å; D93-R96 VanDerWaalsContact OD1-CZ 3.25Å; D93-R96 IonicContact OD1-NH1 3.29Å; D93-R96 PolarHBondContact OD1-NH1 3.29Å; D93-R96 IonicContact OD1-NH2 3.17Å; D93-R96 PolarHBondContact OD1-NH2 2.85Å; D93-R96 VanDerWaalsContact OD1-NH2 3.09Å; R96-L98 VanDerWaalsContact C-N 3.34Å; R96-Q99 PolarHBondContact O-N 3.35Å; R96-N100 PolarHBondContact O-N 2.95Å; R96-N100 PolarHBondContact O-ND2 3.14Å
97	R	97	Very high	95	Very high	196 Å²	196	124.3 Å²	124.3	74%	0.74	57%	0.572	S	S	*	*	H	α-helix	trans	-69.7	-27.5	178.5	-69.7	176.3	-171.3	-155.4	3	113.9	D93 K94 F95	D93-R97 WeakPolarHBondContact O-CG 3.34Å; D93-R97 PolarHBondContact O-N 3.38Å; D93-R97 VanDerWaalsContact O-N 3.09Å; K94-R97 PolarHBondContact O-N 3.25Å; F95-R97 VanDerWaalsContact C-N 3.27Å; F95-R97 PolarHBondContact O-N 2.9Å
98	L	96.1	Very high	94.8	Very high	144 Å²	144	123.9 Å²	123.9	75%	0.754	57%	0.569	S	S	*	*	H	α-helix	trans	-81.3	-21.2	176.5	-70.1	172.4	0	0	0	112.9	K94 F95 R96	K94-L98 WeakPolarHBondContact O-CG 3.46Å; K94-L98 PolarHBondContact O-N 3.34Å; K94-L98 VanDerWaalsContact O-N 3.14Å; F95-L98 PolarHBondContact O-N 3.14Å; F95-L98 VanDerWaalsContact O-N 3.12Å; R96-L98 VanDerWaalsContact C-N 3.34Å
99	Q	88.3	Confident	94.5	Very high	160 Å²	160	125.9 Å²	125.9	75%	0.748	57%	0.573	S	S	*	*	H	α-helix	trans	-89	-15.7	178.4	-73.4	-177.2	-21.6	0	0	113.9	F95 R96	F95-Q99 PolarHBondContact O-N 3.12Å; F95-Q99 VanDerWaalsContact O-N 3.14Å; R96-Q99 PolarHBondContact O-N 3.35Å
100	N	68.8	Low	94.1	Very high	182 Å²	182	132 Å²	132	97%	0.973	60%	0.596	S	S	*	*			trans	-95.9	0	172.9	-66.1	-28.8	0	0	0	110.5	R96	R96-N100 PolarHBondContact O-N 2.95Å; R96-N100 PolarHBondContact O-ND2 3.14Å

Retrieved 100 of 100 residues in 58.2 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).