A0A077ZEI9_TRITR Loading...

Homeobox domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZEI9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 136 aa.

						>A0A077ZEI9_TRITR|A0A077ZEI9
MEIFAEQKTFLSNHYLCLKADVDINNTILLQPFPKPKRNRTAFSPFQLVELERAFDSNHYVVGNERRDLASRLQLSETQVKVWFQNRRTKHKRAKPEKPTLHTLNGATSSSEQKKIICPVPSVGEETSMLSQIGYL
					

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	47.9	Very low	47.5	Very low	221 Å²	221	126.7 Å²	126.7	100%	1.089	63%	0.626	S	S	*	*				0	-15.7	0	-77.5	-158.9	-92.2	0	0	113.6	I3	M1-I3 VanDerWaalsContact C-N 3.29Å; M1-I3 PolarHBondContact O-N 3Å
2	E	48.8	Very low	48.1	Very low	170 Å²	170	121.8 Å²	121.8	79%	0.794	61%	0.613	S	S	*	*	H	α-helix	trans	-66.2	-24.3	-179.6	-68.2	174.7	142.3	0	0	114.8	F4 A5 E6	E2-F4 VanDerWaalsContact C-N 3.25Å; E2-F4 PolarHBondContact O-N 2.83Å; E2-A5 PolarHBondContact O-N 3.08Å; E2-E6 PolarHBondContact O-N 3.07Å
3	I	47.2	Very low	48.6	Very low	129 Å²	129	121 Å²	121	66%	0.662	61%	0.611	S	S	*	*	H	α-helix	trans	-63.9	-28.3	-176.3	-48.9	173.8	0	0	0	112.3	M1 Q7	M1-I3 VanDerWaalsContact C-N 3.29Å; M1-I3 PolarHBondContact O-N 3Å; I3-Q7 WeakPolarHBondContact O-CG 3.2Å
4	F	46.5	Very low	48.7	Very low	172 Å²	172	117 Å²	117	75%	0.754	59%	0.589	S	S	*	*	H	α-helix	trans	-83.4	-24.4	176.4	-74.7	-82.3	0	0	0	113.3	E2 Q7 K8	E2-F4 VanDerWaalsContact C-N 3.25Å; E2-F4 PolarHBondContact O-N 2.83Å; F4-Q7 PolarHBondContact O-N 3.35Å; F4-K8 PolarHBondContact O-N 3.43Å; F4-K8 VanDerWaalsContact O-N 3.15Å
5	A	49.9	Very low	48.3	Very low	60 Å²	60	118.6 Å²	118.6	50%	0.496	59%	0.587	S	S	.	*	H	α-helix	trans	-73.5	-43.8	-177.5	0	0	0	0	0	111.2	E2 Q7 K8 T9	E2-A5 PolarHBondContact O-N 3.08Å; A5-Q7 VanDerWaalsContact C-N 3.26Å; A5-Q7 PolarHBondContact O-N 3.44Å; A5-K8 PolarHBondContact O-N 3.48Å; A5-T9 PolarHBondContact O-N 3.3Å; A5-T9 VanDerWaalsContact O-N 3.12Å; A5-T9 PolarHBondContact O-OG1 2.99Å
6	E	46.1	Very low	48.2	Very low	148 Å²	148	118.6 Å²	118.6	69%	0.692	59%	0.589	S	S	*	*	H	α-helix	trans	-63.7	-32.3	173.1	-77.4	-169.4	148.2	0	0	112.5	E2 T9 F10	E2-E6 PolarHBondContact O-N 3.07Å; E6-T9 WeakPolarHBondContact CA-OG1 3.44Å; E6-T9 PolarHBondContact O-OG1 3.14Å; E6-F10 VanDerWaalsContact O-CB 3.26Å; E6-F10 WeakPolarHBondContact O-CB 3.38Å; E6-F10 PolarHBondContact O-N 3.23Å
7	Q	45.1	Very low	48.4	Very low	57 Å²	57	117.3 Å²	117.3	27%	0.266	59%	0.593	S	S	.	*	H	α-helix	trans	-68.5	-35.8	177.1	-66.5	-79.2	21.2	0	0	111.8	I3 F4 A5 L11	I3-Q7 WeakPolarHBondContact O-CG 3.2Å; F4-Q7 PolarHBondContact O-N 3.35Å; A5-Q7 VanDerWaalsContact C-N 3.26Å; A5-Q7 PolarHBondContact O-N 3.44Å; Q7-L11 WeakPolarHBondContact O-CB 3.38Å; Q7-L11 WeakPolarHBondContact O-CG 3.29Å; Q7-L11 PolarHBondContact O-N 3.29Å; Q7-L11 VanDerWaalsContact O-N 3.09Å
8	K	48.2	Very low	48.4	Very low	172 Å²	172	116 Å²	116	75%	0.748	59%	0.587	S	S	*	*	H	α-helix	trans	-73.1	-38.4	177.8	-160.9	173	-177.3	-176.6	0	111.8	F4 A5 S12	F4-K8 PolarHBondContact O-N 3.43Å; F4-K8 VanDerWaalsContact O-N 3.15Å; A5-K8 PolarHBondContact O-N 3.48Å; K8-S12 VanDerWaalsContact O-CB 3.31Å; K8-S12 WeakPolarHBondContact O-CB 3.12Å; K8-S12 PolarHBondContact O-N 3.5Å
9	T	52.6	Low	48.6	Very low	80 Å²	80	118.1 Å²	118.1	49%	0.491	59%	0.592	S	S	.	*	H	α-helix	trans	-71.1	-35.8	175.6	59.9	0	0	0	0	112	A5 E6 S12 N13	A5-T9 PolarHBondContact O-N 3.3Å; A5-T9 VanDerWaalsContact O-N 3.12Å; A5-T9 PolarHBondContact O-OG1 2.99Å; E6-T9 WeakPolarHBondContact CA-OG1 3.44Å; E6-T9 PolarHBondContact O-OG1 3.14Å; T9-S12 PolarHBondContact O-N 3.21Å; T9-N13 WeakPolarHBondContact O-CB 3.42Å; T9-N13 PolarHBondContact O-N 3.33Å; T9-N13 PolarHBondContact O-ND2 2.85Å
10	F	43.3	Very low	48.3	Very low	92 Å²	92	115.7 Å²	115.7	40%	0.404	59%	0.591	S	S	.	*	H	α-helix	trans	-68.7	-42.9	177.3	-168.1	-99.1	0	0	0	112.2	E6 H14	E6-F10 VanDerWaalsContact O-CB 3.26Å; E6-F10 WeakPolarHBondContact O-CB 3.38Å; E6-F10 PolarHBondContact O-N 3.23Å; F10-H14 WeakPolarHBondContact O-CB 3.43Å; F10-H14 PolarHBondContact O-N 3.48Å
11	L	46.9	Very low	48	Very low	93 Å²	93	117.8 Å²	117.8	49%	0.487	60%	0.604	S	S	.	*	H	α-helix	trans	-67.1	-37.5	175	-69.7	174.7	0	0	0	112.2	Q7 Y15	Q7-L11 WeakPolarHBondContact O-CB 3.38Å; Q7-L11 WeakPolarHBondContact O-CG 3.29Å; Q7-L11 PolarHBondContact O-N 3.29Å; Q7-L11 VanDerWaalsContact O-N 3.09Å; L11-Y15 VanDerWaalsContact O-CB 3.3Å; L11-Y15 WeakPolarHBondContact O-CB 3.32Å; L11-Y15 PolarHBondContact O-N 3.18Å
12	S	54.4	Low	48	Very low	67 Å²	67	112.2 Å²	112.2	47%	0.469	58%	0.582	S	S	.	*	H	α-helix	trans	-65.1	-50.4	177.4	-168.7	0	0	0	0	112.2	K8 T9 H14 Y15 L16	K8-S12 VanDerWaalsContact O-CB 3.31Å; K8-S12 WeakPolarHBondContact O-CB 3.12Å; K8-S12 PolarHBondContact O-N 3.5Å; T9-S12 PolarHBondContact O-N 3.21Å; S12-H14 VanDerWaalsContact C-N 3.33Å; S12-H14 PolarHBondContact O-N 3.47Å; S12-Y15 PolarHBondContact O-N 2.95Å; S12-L16 WeakPolarHBondContact O-CG 3.46Å; S12-L16 PolarHBondContact O-N 3.38Å
13	N	54.2	Low	47.7	Very low	112 Å²	112	110 Å²	110	60%	0.599	58%	0.575	S	S	*	*	H	α-helix	trans	-67.9	-33.6	179.5	-75.6	-61.7	0	0	0	112.4	T9 C17	T9-N13 WeakPolarHBondContact O-CB 3.42Å; T9-N13 PolarHBondContact O-N 3.33Å; T9-N13 PolarHBondContact O-ND2 2.85Å; N13-C17 PolarHBondContact O-N 2.91Å
14	H	50	Low	48.2	Very low	65 Å²	65	111.4 Å²	111.4	30%	0.301	58%	0.583	S	S	.	*	H	α-helix	trans	-74.7	-32.6	178	-167.7	-77	0	0	0	112.6	F10 S12 L18 Q85	F10-H14 WeakPolarHBondContact O-CB 3.43Å; F10-H14 PolarHBondContact O-N 3.48Å; S12-H14 VanDerWaalsContact C-N 3.33Å; S12-H14 PolarHBondContact O-N 3.47Å; H14-L18 WeakPolarHBondContact O-CD1 3.38Å; H14-L18 PolarHBondContact O-N 3.34Å; H14-Q85 PolarHBondContact CE1-NE2 2.91Å; H14-Q85 PolarHBondContact NE2-NE2 3.11Å
15	Y	43	Very low	48	Very low	141 Å²	141	109.4 Å²	109.4	55%	0.553	58%	0.58	S	S	*	*	H	α-helix	trans	-74.7	-25.9	175.5	-148.9	-88.4	0	0	0	112.5	L11 S12	L11-Y15 VanDerWaalsContact O-CB 3.3Å; L11-Y15 WeakPolarHBondContact O-CB 3.32Å; L11-Y15 PolarHBondContact O-N 3.18Å; S12-Y15 PolarHBondContact O-N 2.95Å
16	L	47.2	Very low	47.6	Very low	118 Å²	118	113.2 Å²	113.2	62%	0.618	59%	0.592	S	S	*	*	H	α-helix	trans	-72.3	-34.9	172.6	-70.5	170.2	0	0	0	112.5	S12 L18 K19	S12-L16 WeakPolarHBondContact O-CG 3.46Å; S12-L16 PolarHBondContact O-N 3.38Å; L16-L18 VanDerWaalsContact C-N 3.29Å; L16-L18 PolarHBondContact O-N 2.63Å; L16-K19 PolarHBondContact O-N 2.82Å
17	C	51	Low	47.7	Very low	97 Å²	97	111.8 Å²	111.8	66%	0.655	59%	0.593	S	S	*	*	H	α-helix	trans	-67.7	-27.2	174.5	-172.3	0	0	0	0	113	N13 K19 A20	N13-C17 PolarHBondContact O-N 2.91Å; C17-K19 VanDerWaalsContact C-N 3.25Å; C17-K19 PolarHBondContact O-N 3.13Å; C17-A20 PolarHBondContact O-N 3.02Å
18	L	49.3	Very low	48	Very low	94 Å²	94	115.7 Å²	115.7	49%	0.492	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	-0.6	179.1	-90.1	149.4	0	0	0	114.8	H14 L16	H14-L18 WeakPolarHBondContact O-CD1 3.38Å; H14-L18 PolarHBondContact O-N 3.34Å; L16-L18 VanDerWaalsContact C-N 3.29Å; L16-L18 PolarHBondContact O-N 2.63Å
19	K	50.8	Low	48.3	Very low	156 Å²	156	114.3 Å²	114.3	68%	0.678	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118	4.5	175.2	-84	179.8	169.2	163.4	0	113.8	L16 C17 D21	L16-K19 PolarHBondContact O-N 2.82Å; C17-K19 VanDerWaalsContact C-N 3.25Å; C17-K19 PolarHBondContact O-N 3.13Å; K19-D21 PolarHBondContact O-N 3.36Å; K19-D21 VanDerWaalsContact O-N 3.09Å
20	A	44.4	Very low	48.2	Very low	70 Å²	70	118.4 Å²	118.4	58%	0.579	63%	0.633	S	S	*	*			trans	-82.2	78.1	166.3	0	0	0	0	0	108.2	C17 V22	C17-A20 PolarHBondContact O-N 3.02Å; A20-V22 VanDerWaalsContact C-N 3.25Å; A20-V22 PolarHBondContact O-N 3.21Å
21	D	40.4	Very low	48.6	Very low	159 Å²	159	121.6 Å²	121.6	85%	0.85	65%	0.649	S	S	*	*			trans	-64.2	92.1	161.1	-71.9	-54.5	0	0	0	107.3	K19	K19-D21 PolarHBondContact O-N 3.36Å; K19-D21 VanDerWaalsContact O-N 3.09Å
22	V	48.4	Very low	48.7	Very low	104 Å²	104	122.2 Å²	122.2	63%	0.63	66%	0.658	S	S	*	*			trans	-119.1	114.1	165.4	177.8	0	0	0	0	106.8	A20 I24	A20-V22 VanDerWaalsContact C-N 3.25Å; A20-V22 PolarHBondContact O-N 3.21Å; V22-I24 VanDerWaalsContact C-N 3.3Å; V22-I24 PolarHBondContact O-N 2.88Å
23	D	42.5	Very low	48.9	Very low	123 Å²	123	127.5 Å²	127.5	66%	0.658	67%	0.673	S	S	*	*			trans	-40.5	91.9	163.1	-86.8	-59	0	0	0	111.1	N25 N26	D23-N25 PolarHBondContact O-N 3.05Å; D23-N26 HydrophobicContact CB-CB 4.38Å; D23-N26 PolarHBondContact O-N 3.5Å
24	I	57.3	Low	49.3	Very low	160 Å²	160	127.2 Å²	127.2	82%	0.821	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-6	177.4	-103.6	164.4	0	0	0	111.9	V22	V22-I24 VanDerWaalsContact C-N 3.3Å; V22-I24 PolarHBondContact O-N 2.88Å
25	N	42.9	Very low	50.2	Low	130 Å²	130	133 Å²	133	70%	0.695	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-0.9	-178.4	-62.7	-35.3	0	0	0	114.5	D23	D23-N25 PolarHBondContact O-N 3.05Å
26	N	40.8	Very low	51.7	Low	139 Å²	139	132.1 Å²	132.1	74%	0.743	71%	0.713	S	S	*	*	S	Bend	trans	-123.2	12.6	-176.5	-110.7	5.3	0	0	0	116.5	D23	D23-N26 HydrophobicContact CB-CB 4.38Å; D23-N26 PolarHBondContact O-N 3.5Å
27	T	48.2	Very low	53	Low	118 Å²	118	135.9 Å²	135.9	72%	0.724	73%	0.725	S	S	*	*			trans	-112.1	73.7	167.4	-57	0	0	0	0	110.2	L29	T27-L29 VanDerWaalsContact C-N 3.32Å
28	I	51.9	Low	54	Low	139 Å²	139	142.4 Å²	142.4	71%	0.713	74%	0.736	S	S	*	*			trans	-86.1	5.9	178.1	-72.8	-179.4	0	0	0	112.4
29	L	55.3	Low	55.4	Low	144 Å²	144	145.2 Å²	145.2	75%	0.754	75%	0.751	S	S	*	*	S	Bend	trans	-109.7	12.3	-158.2	-82.3	-74.8	0	0	0	117.2	T27	T27-L29 VanDerWaalsContact C-N 3.32Å
30	L	50.7	Low	57	Low	165 Å²	165	149.4 Å²	149.4	86%	0.864	76%	0.763	S	S	*	*			trans	-143.5	87.9	169	-74.3	172.2	0	0	0	110.9
31	Q	50.3	Low	58.8	Low	159 Å²	159	149.7 Å²	149.7	74%	0.743	76%	0.757	S	S	*	*			trans	-68.5	140.6	159.3	-84.5	-160.1	-49.2	0	0	109
32	P	49.1	Very low	61.3	Low	106 Å²	106	146.8 Å²	146.8	69%	0.688	76%	0.755	S	S	*	*	S	Bend		-137.1	120.1	101.3	31.5	-15.7	0	0	0	111.9
33	F	58.6	Low	63.6	Low	178 Å²	178	144.4 Å²	144.4	78%	0.781	74%	0.737	S	S	*	*			trans	72.4	123.7	173.6	-55.3	-77.8	0	0	0	117.2	K35	F33-K35 PolarHBondContact O-N 3.36Å
34	P	63.8	Low	66.2	Low	106 Å²	106	140.8 Å²	140.8	69%	0.688	72%	0.721	S	S	*	*			trans	-63.3	107.2	170.2	27.1	-31.1	0	0	0	108.2
35	K	69.1	Low	68.1	Low	188 Å²	188	138.3 Å²	138.3	82%	0.817	72%	0.715	S	S	*	*			trans	-53	128.2	171	-66.7	176.2	-176	173.1	0	107.3	F33 K37	F33-K35 PolarHBondContact O-N 3.36Å; K35-K37 PolarHBondContact O-N 3.33Å; K35-K37 VanDerWaalsContact O-N 3.11Å
36	P	74.2	Confident	70.7	Confident	121 Å²	121	138.3 Å²	138.3	79%	0.786	71%	0.709	S	S	*	*			trans	-48.9	124.5	178.4	-28.1	33.8	0	0	0	109.8	R38	P36-R38 PolarHBondContact O-N 3.07Å
37	K	74.3	Confident	73.4	Confident	197 Å²	197	133.1 Å²	133.1	86%	0.857	68%	0.68	S	S	*	*			trans	-58.8	111.3	174.5	-73	-179.2	-179.3	177.1	0	106.6	K35 N39	K35-K37 PolarHBondContact O-N 3.33Å; K35-K37 VanDerWaalsContact O-N 3.11Å; K37-N39 PolarHBondContact O-N 3.48Å; K37-N39 VanDerWaalsContact O-N 3.1Å
38	R	72.2	Confident	75.8	Confident	235 Å²	235	131.1 Å²	131.1	89%	0.887	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-55.6	121.8	177.3	-71.8	-170.3	-71.1	116.8	-3.5	108.3	P36 R40	P36-R38 PolarHBondContact O-N 3.07Å; R38-R40 PolarHBondContact O-N 2.9Å
39	N	78.3	Confident	78	Confident	152 Å²	152	129.1 Å²	129.1	81%	0.813	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-53.6	125.9	176.2	-65.8	51.5	0	0	0	108.7	K37 T41	K37-N39 PolarHBondContact O-N 3.48Å; K37-N39 VanDerWaalsContact O-N 3.1Å; N39-T41 PolarHBondContact O-N 3.32Å
40	R	83.7	Confident	80	Confident	245 Å²	245	123.8 Å²	123.8	93%	0.925	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-69.5	119.3	177.3	-170.3	179.5	-176.6	-163.3	0.8	107.9	R38	R38-R40 PolarHBondContact O-N 2.9Å
41	T	83.5	Confident	82.3	Confident	76 Å²	76	115.9 Å²	115.9	47%	0.466	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-80.7	129.6	174.1	55.5	0	0	0	0	109.5	N39	N39-T41 PolarHBondContact O-N 3.32Å
42	A	92.8	Very high	84.6	Confident	98 Å²	98	111.2 Å²	111.2	81%	0.81	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-92.7	134.9	167.2	0	0	0	0	0	109.2
43	F	95.6	Very high	86.9	Confident	54 Å²	54	114.1 Å²	114.1	24%	0.237	56%	0.564	C	S	.	*	P	Polyproline II helix	trans	-89.8	142.5	173.2	-58.3	-56.1	0	0	0	109.7	Q47 L48 L75 Q79 W83	F43-Q47 VanDerWaalsContact CA-OE1 3.29Å; F43-Q47 HydrophobicContact CB-CB 4.22Å; F43-L48 HydrophobicContact CB-CD2 3.83Å; F43-L48 HydrophobicContact CB-CG 3.99Å; F43-L48 HydrophobicContact CD2-CD2 4.08Å; F43-L48 HydrophobicContact CG-CD2 4.38Å; F43-L75 HydrophobicContact CD1-CD1 4Å; F43-L75 HydrophobicContact CD1-CD2 3.83Å; F43-L75 HydrophobicContact CE1-CD1 3.91Å; F43-L75 HydrophobicContact CE1-CD2 3.79Å; F43-L75 HydrophobicContact CE1-CG 4.5Å; F43-Q79 HydrophobicContact CE1-CB 4.26Å; F43-Q79 HydrophobicContact CZ-CB 4.31Å; F43-W83 AromaticContact CD2-CD1 3.82Å; F43-W83 HydrophobicContact CE2-CB 4.4Å; F43-W83 AromaticContact CE2-CD1 3.58Å; F43-W83 HydrophobicContact CE2-CG 4.36Å
44	S	97.2	Very high	88.8	Confident	47 Å²	47	106.8 Å²	106.8	33%	0.329	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-67.7	157.2	173.9	79.3	0	0	0	0	111	F46 Q47 L48	S44-F46 PolarHBondContact O-N 3.4Å; S44-Q47 WeakPolarHBondContact O-CB 3.45Å; S44-Q47 PolarHBondContact O-N 2.97Å; S44-Q47 VanDerWaalsContact O-N 3.1Å; S44-Q47 WeakPolarHBondContact OG-CG 3.4Å; S44-Q47 PolarHBondContact OG-N 3.08Å; S44-L48 WeakPolarHBondContact O-CG 3.3Å; S44-L48 PolarHBondContact O-N 3.16Å
45	P	97.2	Very high	90.4	Very high	107 Å²	107	101.8 Å²	101.8	70%	0.695	50%	0.504	S	S	*	.	H	α-helix	trans	-55	-40.2	175.5	-26.7	35.4	0	0	0	112.8	L48 V49	P45-L48 PolarHBondContact O-N 2.94Å; P45-V49 WeakPolarHBondContact O-CG2 3.5Å; P45-V49 PolarHBondContact O-N 3.44Å
46	F	97.8	Very high	91.7	Very high	130 Å²	130	98.1 Å²	98.1	57%	0.57	49%	0.493	S	S	*	.	H	α-helix	trans	-60	-46.7	175.2	172.2	-101.1	0	0	0	112.2	S44 L48 V49 E50 L73	S44-F46 PolarHBondContact O-N 3.4Å; F46-L48 VanDerWaalsContact C-N 3.3Å; F46-L48 PolarHBondContact O-N 3.5Å; F46-V49 PolarHBondContact O-N 2.93Å; F46-E50 HydrophobicContact CE1-CG 4.35Å; F46-E50 HydrophobicContact CE2-CG 4.04Å; F46-E50 HydrophobicContact CZ-CG 3.92Å; F46-E50 PolarHBondContact O-N 3.03Å; F46-E50 VanDerWaalsContact O-N 3.12Å; F46-L73 HydrophobicContact CE1-CD2 4.06Å
47	Q	98.2	Very high	92.7	Very high	30 Å²	30	97.2 Å²	97.2	14%	0.14	49%	0.49	C	S	.	.	H	α-helix	trans	-60.2	-41.6	177.1	-72.8	171	-25.7	0	0	111.5	F43 S44 E50 L51 L73	F43-Q47 VanDerWaalsContact CA-OE1 3.29Å; F43-Q47 HydrophobicContact CB-CB 4.22Å; S44-Q47 WeakPolarHBondContact O-CB 3.45Å; S44-Q47 PolarHBondContact O-N 2.97Å; S44-Q47 VanDerWaalsContact O-N 3.1Å; S44-Q47 WeakPolarHBondContact OG-CG 3.4Å; S44-Q47 PolarHBondContact OG-N 3.08Å; Q47-E50 PolarHBondContact O-N 3.05Å; Q47-L51 WeakPolarHBondContact O-CB 3.34Å; Q47-L51 WeakPolarHBondContact O-CD1 3.37Å; Q47-L51 WeakPolarHBondContact O-CG 3.35Å; Q47-L51 PolarHBondContact O-N 2.81Å; Q47-L73 HydrophobicContact CG-CB 4.39Å; Q47-L73 PolarHBondContact NE2-O 3.21Å
48	L	97.9	Very high	93.7	Very high	77 Å²	77	90.7 Å²	90.7	40%	0.403	46%	0.464	S	S	.	.	H	α-helix	trans	-63.8	-42.6	178.6	-68	174.3	0	0	0	112.3	F43 S44 P45 F46 L51 E52	F43-L48 HydrophobicContact CB-CD2 3.83Å; F43-L48 HydrophobicContact CB-CG 3.99Å; F43-L48 HydrophobicContact CD2-CD2 4.08Å; F43-L48 HydrophobicContact CG-CD2 4.38Å; S44-L48 WeakPolarHBondContact O-CG 3.3Å; S44-L48 PolarHBondContact O-N 3.16Å; P45-L48 PolarHBondContact O-N 2.94Å; F46-L48 VanDerWaalsContact C-N 3.3Å; F46-L48 PolarHBondContact O-N 3.5Å; L48-L51 PolarHBondContact O-N 2.78Å; L48-E52 WeakPolarHBondContact O-CB 3.5Å; L48-E52 PolarHBondContact O-N 2.94Å
49	V	98	Very high	94.9	Very high	96 Å²	96	82.9 Å²	82.9	58%	0.582	44%	0.438	S	S	*	.	H	α-helix	trans	-61.8	-47.1	177.8	170.3	0	0	0	0	111.1	P45 F46 E52 R53	P45-V49 WeakPolarHBondContact O-CG2 3.5Å; P45-V49 PolarHBondContact O-N 3.44Å; F46-V49 PolarHBondContact O-N 2.93Å; V49-E52 PolarHBondContact O-N 3.47Å; V49-R53 WeakPolarHBondContact O-CB 3.42Å; V49-R53 PolarHBondContact O-N 3.43Å
50	E	98.1	Very high	95.8	Very high	32 Å²	32	79.9 Å²	79.9	15%	0.15	42%	0.416	C	S	.	.	H	α-helix	trans	-67.5	-37.3	179.3	-75.3	-68.5	115.1	0	0	112.8	F46 Q47 R53 A54 R72 L73	F46-E50 HydrophobicContact CE1-CG 4.35Å; F46-E50 HydrophobicContact CE2-CG 4.04Å; F46-E50 HydrophobicContact CZ-CG 3.92Å; F46-E50 PolarHBondContact O-N 3.03Å; F46-E50 VanDerWaalsContact O-N 3.12Å; Q47-E50 PolarHBondContact O-N 3.05Å; E50-R53 PolarHBondContact O-N 2.98Å; E50-A54 WeakPolarHBondContact O-CB 3.39Å; E50-A54 PolarHBondContact O-N 2.95Å; E50-R72 IonicContact OE2-NH1 3.47Å; E50-R72 PolarHBondContact OE2-NH1 3.34Å; E50-L73 HydrophobicContact CB-CD1 4.07Å; E50-L73 HydrophobicContact CB-CD2 3.53Å; E50-L73 HydrophobicContact CB-CG 4.4Å; E50-L73 HydrophobicContact CG-CD2 3.87Å
51	L	98.4	Very high	96.4	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-63.1	-42.2	173.6	-74.8	164.8	0	0	0	111.5	Q47 L48 A54 F55 L69 L73 L75 V80 W83 F84	Q47-L51 WeakPolarHBondContact O-CB 3.34Å; Q47-L51 WeakPolarHBondContact O-CD1 3.37Å; Q47-L51 WeakPolarHBondContact O-CG 3.35Å; Q47-L51 PolarHBondContact O-N 2.81Å; L48-L51 PolarHBondContact O-N 2.78Å; L51-A54 PolarHBondContact O-N 3.32Å; L51-F55 WeakPolarHBondContact O-CB 3.34Å; L51-F55 PolarHBondContact O-N 3.12Å; L51-L69 HydrophobicContact CD2-CD2 4.11Å; L51-L73 HydrophobicContact CD2-CD1 3.89Å; L51-L73 HydrophobicContact CG-CD1 3.71Å; L51-L75 HydrophobicContact CD1-CD1 4.23Å; L51-V80 HydrophobicContact CD2-CG1 4.48Å; L51-W83 VanDerWaalsContact C-CH2 3.42Å; L51-W83 HydrophobicContact CB-CD2 3.89Å; L51-W83 HydrophobicContact CB-CE3 3.94Å; L51-W83 HydrophobicContact CB-CH2 3.66Å; L51-W83 HydrophobicContact CB-CZ2 3.56Å; L51-W83 HydrophobicContact CB-CZ3 3.84Å; L51-W83 HydrophobicContact CD1-CD2 3.91Å; L51-W83 HydrophobicContact CD1-CG 3.84Å; L51-W83 HydrophobicContact CD2-CD2 4.13Å; L51-W83 HydrophobicContact CD2-CE3 4.05Å; L51-W83 HydrophobicContact CD2-CG 4.42Å; L51-W83 HydrophobicContact CG-CD2 4.2Å; L51-W83 HydrophobicContact CG-CE3 4.42Å; L51-W83 WeakPolarHBondContact O-CH2 3.49Å; L51-W83 WeakPolarHBondContact O-CZ3 3.26Å; L51-F84 HydrophobicContact CD2-CE2 4.19Å
52	E	98.2	Very high	96.9	Very high	60 Å²	60	68.4 Å²	68.4	28%	0.28	37%	0.373	S	S	.	.	H	α-helix	trans	-66.2	-44.9	176.9	-162.4	67.7	-162.2	0	0	111.3	L48 V49 A54 F55 D56 R87	L48-E52 WeakPolarHBondContact O-CB 3.5Å; L48-E52 PolarHBondContact O-N 2.94Å; V49-E52 PolarHBondContact O-N 3.47Å; E52-A54 VanDerWaalsContact C-N 3.32Å; E52-A54 PolarHBondContact O-N 2.94Å; E52-F55 WeakPolarHBondContact O-CA 3.31Å; E52-F55 WeakPolarHBondContact O-CB 3.45Å; E52-F55 PolarHBondContact O-N 3.32Å; E52-D56 PolarHBondContact O-N 3.39Å; E52-R87 VanDerWaalsContact CD-NE 3.28Å; E52-R87 IonicContact OE1-CZ 3.12Å; E52-R87 IonicContact OE1-NE 2.82Å; E52-R87 PolarHBondContact OE1-NE 3.15Å; E52-R87 IonicContact OE1-NH2 2.63Å; E52-R87 PolarHBondContact OE1-NH2 3.25Å; E52-R87 WeakPolarHBondContact OE2-CD 3.44Å; E52-R87 IonicContact OE2-CZ 3.94Å; E52-R87 IonicContact OE2-NE 2.91Å; E52-R87 PolarHBondContact OE2-NE 2.98Å
53	R	97.9	Very high	97.1	Very high	168 Å²	168	65.8 Å²	65.8	63%	0.634	36%	0.355	S	S	*	.	H	α-helix	trans	-57.1	-45	175	-178.9	-177.5	176.3	165.2	3.1	112.1	V49 E50 F55 D56 S57	V49-R53 WeakPolarHBondContact O-CB 3.42Å; V49-R53 PolarHBondContact O-N 3.43Å; E50-R53 PolarHBondContact O-N 2.98Å; R53-F55 VanDerWaalsContact C-N 3.33Å; R53-D56 PolarHBondContact O-N 3.28Å; R53-S57 PolarHBondContact O-N 3.03Å; R53-S57 PolarHBondContact O-OG 3.27Å; R53-S57 VanDerWaalsContact O-OG 3.07Å
54	A	97.5	Very high	97.1	Very high	24 Å²	24	68 Å²	68	20%	0.198	37%	0.369	C	S	.	.	H	α-helix	trans	-64.3	-39.3	175.8	0	0	0	0	0	111.7	E50 L51 E52 S57 N58 L69 F84	E50-A54 WeakPolarHBondContact O-CB 3.39Å; E50-A54 PolarHBondContact O-N 2.95Å; L51-A54 PolarHBondContact O-N 3.32Å; E52-A54 VanDerWaalsContact C-N 3.32Å; E52-A54 PolarHBondContact O-N 2.94Å; A54-S57 PolarHBondContact O-N 3.49Å; A54-N58 PolarHBondContact O-N 3.47Å; A54-L69 HydrophobicContact CB-CD1 4.23Å; A54-L69 HydrophobicContact CB-CD2 3.83Å; A54-F84 HydrophobicContact CB-CZ 4.12Å
55	F	97.8	Very high	97.1	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-62.2	-46.3	176.3	-172.7	-96.4	0	0	0	112.1	L51 E52 R53 S57 N58 H59 W83 F84 R87 R88 H91	L51-F55 WeakPolarHBondContact O-CB 3.34Å; L51-F55 PolarHBondContact O-N 3.12Å; E52-F55 WeakPolarHBondContact O-CA 3.31Å; E52-F55 WeakPolarHBondContact O-CB 3.45Å; E52-F55 PolarHBondContact O-N 3.32Å; R53-F55 VanDerWaalsContact C-N 3.33Å; F55-S57 PolarHBondContact O-N 3.29Å; F55-N58 CarbonylContact O-C 3.1Å; F55-N58 PolarHBondContact O-N 3.09Å; F55-N58 VanDerWaalsContact O-N 3.13Å; F55-H59 AromaticContact CD1-CD2 3.51Å; F55-H59 AromaticContact CD1-NE2 3.92Å; F55-H59 AromaticContact CE1-CD2 3.12Å; F55-H59 WeakPolarHBondContact CE1-CD2 3.48Å; F55-H59 AromaticContact CE1-CG 4Å; F55-H59 AromaticContact CE1-NE2 3.38Å; F55-H59 WeakPolarHBondContact CE1-NE2 3.33Å; F55-H59 HydrophobicContact CE2-CB 3.91Å; F55-H59 AromaticContact CE2-CD2 3.8Å; F55-H59 AromaticContact CG-CD2 3.98Å; F55-H59 HydrophobicContact CZ-CB 4.02Å; F55-H59 AromaticContact CZ-CD2 3.29Å; F55-H59 WeakPolarHBondContact CZ-CD2 3.41Å; F55-H59 AromaticContact CZ-CG 3.71Å; F55-H59 AromaticContact CZ-NE2 3.86Å; F55-H59 PolarHBondContact O-CD2 3.5Å; F55-H59 PolarHBondContact O-N 3.05Å; F55-W83 HydrophobicContact CB-CH2 4.03Å; F55-W83 HydrophobicContact CB-CZ3 3.96Å; F55-W83 HydrophobicContact CD2-CZ3 4.22Å; F55-W83 HydrophobicContact CG-CH2 4.48Å; F55-W83 HydrophobicContact CG-CZ3 4.35Å; F55-F84 HydrophobicContact CB-CE1 4.24Å; F55-F84 HydrophobicContact CB-CZ 4.5Å; F55-F84 AromaticContact CD2-CD1 3.85Å; F55-F84 HydrophobicContact CD2-CD1 3.85Å; F55-F84 AromaticContact CD2-CE1 3.87Å; F55-F84 HydrophobicContact CD2-CE1 3.87Å; F55-F84 HydrophobicContact CE2-CD1 4.5Å; F55-R87 HydrophobicContact CB-CG 4.48Å; F55-R87 HydrophobicContact CD1-CG 3.83Å; F55-R87 HydrophobicContact CD2-CB 4.14Å; F55-R87 HydrophobicContact CD2-CG 3.51Å; F55-R87 HydrophobicContact CE1-CG 3.86Å; F55-R87 VanDerWaalsContact CE1-CZ 3.41Å; F55-R87 VanDerWaalsContact CE1-NH1 3.31Å; F55-R87 HydrophobicContact CE2-CB 4.05Å; F55-R87 HydrophobicContact CE2-CG 3.54Å; F55-R87 HydrophobicContact CG-CG 3.66Å; F55-R87 HydrophobicContact CZ-CG 3.73Å; F55-R88 HydrophobicContact CE2-CG 3.86Å; F55-R88 HydrophobicContact CZ-CG 4.28Å; F55-H91 HydrophobicContact CE1-CB 4.49Å; F55-H91 HydrophobicContact CZ-CB 4.22Å
56	D	96.8	Very high	97.2	Very high	111 Å²	111	67.7 Å²	67.7	59%	0.594	35%	0.351	S	S	*	.	H	α-helix	trans	-61.4	-28.2	179.2	-68.4	-23.9	0	0	0	112.5	E52 R53	E52-D56 PolarHBondContact O-N 3.39Å; R53-D56 PolarHBondContact O-N 3.28Å
57	S	96.2	Very high	97.2	Very high	103 Å²	103	67.5 Å²	67.5	72%	0.72	35%	0.346	S	S	*	.	H	α-helix	trans	-77.7	-43.7	175.1	-54.1	0	0	0	0	111.4	R53 A54 F55	R53-S57 PolarHBondContact O-N 3.03Å; R53-S57 PolarHBondContact O-OG 3.27Å; R53-S57 VanDerWaalsContact O-OG 3.07Å; A54-S57 PolarHBondContact O-N 3.49Å; F55-S57 PolarHBondContact O-N 3.29Å
58	N	95.2	Very high	97.2	Very high	60 Å²	60	70.5 Å²	70.5	32%	0.321	36%	0.363	S	S	.	.			trans	-153.4	119.6	178.8	179.3	8	0	0	0	110.7	A54 F55 Y60 F84	A54-N58 PolarHBondContact O-N 3.47Å; F55-N58 CarbonylContact O-C 3.1Å; F55-N58 PolarHBondContact O-N 3.09Å; F55-N58 VanDerWaalsContact O-N 3.13Å; N58-Y60 VanDerWaalsContact CG-O 3.29Å; N58-Y60 PolarHBondContact ND2-O 2.95Å; N58-Y60 PolarHBondContact O-N 2.78Å; N58-Y60 PolarHBondContact OD1-N 3.01Å; N58-Y60 PolarHBondContact OD1-O 3.41Å; N58-F84 WeakPolarHBondContact O-CE1 3.32Å
59	H	96.5	Very high	97.2	Very high	70 Å²	70	67 Å²	67	32%	0.324	35%	0.345	S	S	.	.	S	Bend	trans	-67.4	-4.4	179.7	-63	160.9	0	0	0	114.4	F55 R88 H91	F55-H59 AromaticContact CD1-CD2 3.51Å; F55-H59 AromaticContact CD1-NE2 3.92Å; F55-H59 AromaticContact CE1-CD2 3.12Å; F55-H59 WeakPolarHBondContact CE1-CD2 3.48Å; F55-H59 AromaticContact CE1-CG 4Å; F55-H59 AromaticContact CE1-NE2 3.38Å; F55-H59 WeakPolarHBondContact CE1-NE2 3.33Å; F55-H59 HydrophobicContact CE2-CB 3.91Å; F55-H59 AromaticContact CE2-CD2 3.8Å; F55-H59 AromaticContact CG-CD2 3.98Å; F55-H59 HydrophobicContact CZ-CB 4.02Å; F55-H59 AromaticContact CZ-CD2 3.29Å; F55-H59 WeakPolarHBondContact CZ-CD2 3.41Å; F55-H59 AromaticContact CZ-CG 3.71Å; F55-H59 AromaticContact CZ-NE2 3.86Å; F55-H59 PolarHBondContact O-CD2 3.5Å; F55-H59 PolarHBondContact O-N 3.05Å; H59-R88 PolarHBondContact O-NH1 3.37Å; H59-H91 AromaticContact CE1-NE2 3.68Å
60	Y	97.4	Very high	97.2	Very high	89 Å²	89	62.7 Å²	62.7	35%	0.349	32%	0.319	S	S	.	.			trans	-136.7	108.7	-178.1	-61.9	-91.1	0	0	0	112.7	N58 R88	N58-Y60 VanDerWaalsContact CG-O 3.29Å; N58-Y60 PolarHBondContact ND2-O 2.95Å; N58-Y60 PolarHBondContact O-N 2.78Å; N58-Y60 PolarHBondContact OD1-N 3.01Å; N58-Y60 PolarHBondContact OD1-O 3.41Å; Y60-R88 VanDerWaalsContact CE1-CD 3.43Å
61	V	95.3	Very high	97.2	Very high	15 Å²	15	65.8 Å²	65.8	9%	0.091	35%	0.345	C	S	.	.			trans	-91	129.8	172.3	-69.4	0	0	0	0	112.9	R66 L69 V80 F84	V61-R66 HydrophobicContact CB-CB 4.37Å; V61-R66 HydrophobicContact CG2-CB 4.42Å; V61-R66 HydrophobicContact CG2-CG 4.45Å; V61-R66 PolarHBondContact O-NH2 3.17Å; V61-L69 HydrophobicContact CG1-CD2 4.38Å; V61-V80 HydrophobicContact CG2-CG1 3.94Å; V61-F84 HydrophobicContact CB-CE1 4.31Å; V61-F84 HydrophobicContact CB-CE2 4.37Å; V61-F84 HydrophobicContact CB-CZ 4.24Å; V61-F84 HydrophobicContact CG1-CD1 4.19Å; V61-F84 HydrophobicContact CG1-CD2 4.39Å; V61-F84 HydrophobicContact CG1-CE1 3.52Å; V61-F84 HydrophobicContact CG1-CE2 3.76Å; V61-F84 HydrophobicContact CG1-CZ 3.28Å; V61-F84 HydrophobicContact CG2-CB 4.31Å; V61-F84 HydrophobicContact CG2-CD1 3.87Å; V61-F84 HydrophobicContact CG2-CD2 3.47Å; V61-F84 VanDerWaalsContact CG2-CD2 3.47Å; V61-F84 HydrophobicContact CG2-CE1 4.04Å; V61-F84 HydrophobicContact CG2-CE2 3.67Å; V61-F84 HydrophobicContact CG2-CG 3.6Å; V61-F84 HydrophobicContact CG2-CZ 3.95Å
62	V	95.6	Very high	97.2	Very high	66 Å²	66	72.2 Å²	72.2	40%	0.4	37%	0.369	S	S	.	.			trans	-128	153.7	-177	-63.5	0	0	0	0	111.9	N64 E65 R66	V62-N64 PolarHBondContact O-N 3.06Å; V62-E65 PolarHBondContact O-N 3.39Å; V62-R66 PolarHBondContact O-N 3.44Å
63	G	95.6	Very high	97.1	Very high	42 Å²	42	69.6 Å²	69.6	43%	0.433	36%	0.357	S	S	.	.	H	α-helix	trans	34.8	-107	172	0	0	0	0	0	114.9	R66 R67	G63-R66 PolarHBondContact O-N 3.28Å; G63-R67 WeakPolarHBondContact O-CG 3.31Å; G63-R67 PolarHBondContact O-N 3.48Å
64	N	97	Very high	97.1	Very high	100 Å²	100	70.1 Å²	70.1	54%	0.535	37%	0.366	S	S	.	.	H	α-helix	trans	-62.2	-47.9	-176.2	-63.9	1.1	0	0	0	112.9	V62 R66 R67 D68	V62-N64 PolarHBondContact O-N 3.06Å; N64-R66 PolarHBondContact O-N 3.46Å; N64-R67 WeakPolarHBondContact O-CB 3.07Å; N64-R67 PolarHBondContact O-N 3.12Å; N64-R67 VanDerWaalsContact OD1-CZ 3.3Å; N64-R67 PolarHBondContact OD1-NH2 3.23Å; N64-D68 VanDerWaalsContact O-CG 3.22Å; N64-D68 PolarHBondContact O-N 3.15Å
65	E	96.9	Very high	97.1	Very high	92 Å²	92	70 Å²	70	43%	0.43	36%	0.362	S	S	.	.	H	α-helix	trans	-57.6	-38.4	-179.5	-59.3	176.4	111.6	0	0	111.5	V62 L69	V62-E65 PolarHBondContact O-N 3.39Å; E65-L69 VanDerWaalsContact O-CB 3.29Å; E65-L69 WeakPolarHBondContact O-CB 3.26Å; E65-L69 PolarHBondContact O-N 2.94Å
66	R	98.2	Very high	97.1	Very high	57 Å²	57	72.5 Å²	72.5	22%	0.215	38%	0.38	C	S	.	.	H	α-helix	trans	-66	-45.3	176.8	-173.6	-171.8	-57.8	151.2	6.7	111.6	V61 V62 G63 N64 A70 E77 V80	V61-R66 HydrophobicContact CB-CB 4.37Å; V61-R66 HydrophobicContact CG2-CB 4.42Å; V61-R66 HydrophobicContact CG2-CG 4.45Å; V61-R66 PolarHBondContact O-NH2 3.17Å; V62-R66 PolarHBondContact O-N 3.44Å; G63-R66 PolarHBondContact O-N 3.28Å; N64-R66 PolarHBondContact O-N 3.46Å; R66-A70 WeakPolarHBondContact O-CB 3.07Å; R66-A70 PolarHBondContact O-N 3Å; R66-E77 HydrophobicContact CG-CB 4.17Å; R66-E77 HydrophobicContact CG-CG 4.28Å; R66-V80 HydrophobicContact CG-CB 4.32Å; R66-V80 HydrophobicContact CG-CG1 4.13Å
67	R	98.2	Very high	97.1	Very high	126 Å²	126	71.3 Å²	71.3	48%	0.475	37%	0.371	S	S	.	.	H	α-helix	trans	-62.5	-44.5	178.3	-68.4	-177.8	-43.2	-172.5	9.5	111.3	G63 N64 A70 S71 E77	G63-R67 WeakPolarHBondContact O-CG 3.31Å; G63-R67 PolarHBondContact O-N 3.48Å; N64-R67 WeakPolarHBondContact O-CB 3.07Å; N64-R67 PolarHBondContact O-N 3.12Å; N64-R67 VanDerWaalsContact OD1-CZ 3.3Å; N64-R67 PolarHBondContact OD1-NH2 3.23Å; R67-A70 PolarHBondContact O-N 2.93Å; R67-S71 WeakPolarHBondContact O-CB 3.49Å; R67-S71 PolarHBondContact O-N 3.1Å; R67-E77 VanDerWaalsContact CG-CD 3.45Å; R67-E77 HydrophobicContact CG-CG 4.2Å; R67-E77 WeakPolarHBondContact CG-OE1 3.29Å
68	D	98.1	Very high	97.1	Very high	93 Å²	93	70.9 Å²	70.9	50%	0.497	36%	0.364	S	S	.	.	H	α-helix	trans	-65.9	-42.1	-178.4	-62.2	-19.1	0	0	0	111.1	N64 R72	N64-D68 VanDerWaalsContact O-CG 3.22Å; N64-D68 PolarHBondContact O-N 3.15Å; D68-R72 WeakPolarHBondContact O-CB 3.49Å; D68-R72 PolarHBondContact O-N 3.46Å
69	L	98	Very high	97.2	Very high	4 Å²	4	70.4 Å²	70.4	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-67.2	-42.4	175.8	-172.1	61.1	0	0	0	112	L51 A54 V61 E65 R72 L73 V80 F84	L51-L69 HydrophobicContact CD2-CD2 4.11Å; A54-L69 HydrophobicContact CB-CD1 4.23Å; A54-L69 HydrophobicContact CB-CD2 3.83Å; V61-L69 HydrophobicContact CG1-CD2 4.38Å; E65-L69 VanDerWaalsContact O-CB 3.29Å; E65-L69 WeakPolarHBondContact O-CB 3.26Å; E65-L69 PolarHBondContact O-N 2.94Å; L69-R72 PolarHBondContact O-N 3.38Å; L69-L73 HydrophobicContact CD1-CD1 3.72Å; L69-L73 HydrophobicContact CD1-CG 4.12Å; L69-L73 HydrophobicContact CG-CD1 4.05Å; L69-L73 WeakPolarHBondContact O-CB 3.35Å; L69-L73 WeakPolarHBondContact O-CG 3.35Å; L69-L73 PolarHBondContact O-N 3.09Å; L69-L73 VanDerWaalsContact O-N 3.08Å; L69-V80 HydrophobicContact CD2-CG1 3.91Å; L69-V80 HydrophobicContact CG-CG1 4.46Å; L69-F84 HydrophobicContact CD2-CE2 3.72Å; L69-F84 HydrophobicContact CD2-CZ 4.12Å
70	A	98.2	Very high	97.2	Very high	5 Å²	5	67.1 Å²	67.1	4%	0.041	34%	0.344	C	S	.	.	H	α-helix	trans	-59.8	-48.1	176.5	0	0	0	0	0	111.4	R66 R67 L73 Q74 L75 E77 V80	R66-A70 WeakPolarHBondContact O-CB 3.07Å; R66-A70 PolarHBondContact O-N 3Å; R67-A70 PolarHBondContact O-N 2.93Å; A70-L73 PolarHBondContact O-N 3.2Å; A70-Q74 PolarHBondContact O-N 3.3Å; A70-L75 CarbonylContact C-O 3.45Å; A70-L75 WeakPolarHBondContact CB-O 3.35Å; A70-L75 PolarHBondContact O-N 3.17Å; A70-L75 VanDerWaalsContact O-O 3.13Å; A70-E77 HydrophobicContact CB-CG 4.13Å; A70-V80 HydrophobicContact CB-CG2 3.97Å
71	S	98.1	Very high	97.2	Very high	97 Å²	97	67.6 Å²	67.6	68%	0.678	35%	0.348	S	S	*	.	H	α-helix	trans	-60	-50	177.3	-177.8	0	0	0	0	111.9	R67 L73 Q74	R67-S71 WeakPolarHBondContact O-CB 3.49Å; R67-S71 PolarHBondContact O-N 3.1Å; S71-L73 VanDerWaalsContact C-N 3.3Å; S71-L73 PolarHBondContact O-N 3.07Å; S71-Q74 PolarHBondContact O-N 3.46Å
72	R	97.8	Very high	97.2	Very high	135 Å²	135	70.3 Å²	70.3	51%	0.509	37%	0.365	S	S	.	.	H	α-helix	trans	-61.2	-37.1	-178.7	-163.1	-168.5	-37.7	133.1	12	113.1	E50 D68 L69	E50-R72 IonicContact OE2-NH1 3.47Å; E50-R72 PolarHBondContact OE2-NH1 3.34Å; D68-R72 WeakPolarHBondContact O-CB 3.49Å; D68-R72 PolarHBondContact O-N 3.46Å; L69-R72 PolarHBondContact O-N 3.38Å
73	L	97.6	Very high	97.3	Very high	5 Å²	5	68.5 Å²	68.5	3%	0.026	35%	0.351	C	S	.	.	H	α-helix	trans	-93.5	0.8	-177.1	-59.8	-175.3	0	0	0	113.9	F46 Q47 E50 L51 L69 A70 S71 L75	F46-L73 HydrophobicContact CE1-CD2 4.06Å; Q47-L73 HydrophobicContact CG-CB 4.39Å; Q47-L73 PolarHBondContact NE2-O 3.21Å; E50-L73 HydrophobicContact CB-CD1 4.07Å; E50-L73 HydrophobicContact CB-CD2 3.53Å; E50-L73 HydrophobicContact CB-CG 4.4Å; E50-L73 HydrophobicContact CG-CD2 3.87Å; L51-L73 HydrophobicContact CD2-CD1 3.89Å; L51-L73 HydrophobicContact CG-CD1 3.71Å; L69-L73 HydrophobicContact CD1-CD1 3.72Å; L69-L73 HydrophobicContact CD1-CG 4.12Å; L69-L73 HydrophobicContact CG-CD1 4.05Å; L69-L73 WeakPolarHBondContact O-CB 3.35Å; L69-L73 WeakPolarHBondContact O-CG 3.35Å; L69-L73 PolarHBondContact O-N 3.09Å; L69-L73 VanDerWaalsContact O-N 3.08Å; A70-L73 PolarHBondContact O-N 3.2Å; S71-L73 VanDerWaalsContact C-N 3.3Å; S71-L73 PolarHBondContact O-N 3.07Å; L73-L75 VanDerWaalsContact C-N 3.26Å; L73-L75 HydrophobicContact CB-CD1 4.06Å; L73-L75 HydrophobicContact CB-CG 4.04Å; L73-L75 HydrophobicContact CD1-CD1 4.45Å; L73-L75 PolarHBondContact O-N 2.93Å
74	Q	97.7	Very high	97.4	Very high	178 Å²	178	66.5 Å²	66.5	83%	0.832	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	44.6	-174.3	-55.2	177.5	22.9	0	0	112	A70 S71	A70-Q74 PolarHBondContact O-N 3.3Å; S71-Q74 PolarHBondContact O-N 3.46Å
75	L	96.8	Very high	97.4	Very high	22 Å²	22	63.5 Å²	63.5	12%	0.115	31%	0.313	C	S	.	.			trans	-116.7	159.3	176.7	-63.4	179.8	0	0	0	109.9	F43 L51 A70 L73 Q79 V80	F43-L75 HydrophobicContact CD1-CD1 4Å; F43-L75 HydrophobicContact CD1-CD2 3.83Å; F43-L75 HydrophobicContact CE1-CD1 3.91Å; F43-L75 HydrophobicContact CE1-CD2 3.79Å; F43-L75 HydrophobicContact CE1-CG 4.5Å; L51-L75 HydrophobicContact CD1-CD1 4.23Å; A70-L75 CarbonylContact C-O 3.45Å; A70-L75 WeakPolarHBondContact CB-O 3.35Å; A70-L75 PolarHBondContact O-N 3.17Å; A70-L75 VanDerWaalsContact O-O 3.13Å; L73-L75 VanDerWaalsContact C-N 3.26Å; L73-L75 HydrophobicContact CB-CD1 4.06Å; L73-L75 HydrophobicContact CB-CG 4.04Å; L73-L75 HydrophobicContact CD1-CD1 4.45Å; L73-L75 PolarHBondContact O-N 2.93Å; L75-Q79 HydrophobicContact CB-CB 4.4Å; L75-V80 HydrophobicContact CB-CG2 4.13Å; L75-V80 HydrophobicContact CD1-CG2 4.39Å
76	S	97.1	Very high	97.4	Very high	53 Å²	53	64 Å²	64	37%	0.371	32%	0.319	S	S	.	.			trans	-75.3	150	166.8	63.6	0	0	0	0	111.2	T78 Q79 V80	S76-T78 PolarHBondContact O-N 3.34Å; S76-T78 VanDerWaalsContact O-N 3.13Å; S76-Q79 WeakPolarHBondContact O-CB 3.14Å; S76-Q79 PolarHBondContact O-N 3.27Å; S76-Q79 VanDerWaalsContact OG-CG 3.25Å; S76-Q79 WeakPolarHBondContact OG-CG 3.34Å; S76-Q79 PolarHBondContact OG-N 2.98Å; S76-Q79 VanDerWaalsContact OG-N 3.15Å; S76-Q79 PolarHBondContact OG-OE1 3.48Å; S76-V80 PolarHBondContact O-N 2.93Å; S76-V80 VanDerWaalsContact O-N 3.09Å
77	E	97.8	Very high	97.4	Very high	85 Å²	85	63.2 Å²	63.2	40%	0.397	32%	0.316	S	S	.	.	H	α-helix	trans	-52.9	-35	171.8	-70.6	-171.8	-115.2	0	0	112.4	R66 R67 A70 V80 K81	R66-E77 HydrophobicContact CG-CB 4.17Å; R66-E77 HydrophobicContact CG-CG 4.28Å; R67-E77 VanDerWaalsContact CG-CD 3.45Å; R67-E77 HydrophobicContact CG-CG 4.2Å; R67-E77 WeakPolarHBondContact CG-OE1 3.29Å; A70-E77 HydrophobicContact CB-CG 4.13Å; E77-V80 PolarHBondContact O-N 3.03Å; E77-K81 VanDerWaalsContact O-CB 3.27Å; E77-K81 WeakPolarHBondContact O-CB 3.34Å; E77-K81 PolarHBondContact O-N 2.84Å
78	T	96.2	Very high	97.3	Very high	95 Å²	95	59.4 Å²	59.4	58%	0.583	30%	0.301	S	S	*	.	H	α-helix	trans	-64.9	-43.5	176	-59.5	0	0	0	0	111.9	S76 K81 V82	S76-T78 PolarHBondContact O-N 3.34Å; S76-T78 VanDerWaalsContact O-N 3.13Å; T78-K81 PolarHBondContact O-N 3.04Å; T78-V82 HydrophobicContact CG2-CG2 4.38Å; T78-V82 WeakPolarHBondContact O-CB 3.47Å; T78-V82 VanDerWaalsContact O-CG2 3.26Å; T78-V82 WeakPolarHBondContact O-CG2 3.47Å; T78-V82 PolarHBondContact O-N 3.18Å
79	Q	96.8	Very high	97.1	Very high	50 Å²	50	56.6 Å²	56.6	23%	0.234	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-44.3	175.9	-77.3	164.5	-58.8	0	0	111.3	F43 L75 S76 V82 W83	F43-Q79 HydrophobicContact CE1-CB 4.26Å; F43-Q79 HydrophobicContact CZ-CB 4.31Å; L75-Q79 HydrophobicContact CB-CB 4.4Å; S76-Q79 WeakPolarHBondContact O-CB 3.14Å; S76-Q79 PolarHBondContact O-N 3.27Å; S76-Q79 VanDerWaalsContact OG-CG 3.25Å; S76-Q79 WeakPolarHBondContact OG-CG 3.34Å; S76-Q79 PolarHBondContact OG-N 2.98Å; S76-Q79 VanDerWaalsContact OG-N 3.15Å; S76-Q79 PolarHBondContact OG-OE1 3.48Å; Q79-V82 PolarHBondContact O-N 3.1Å; Q79-W83 WeakPolarHBondContact O-CB 3.49Å; Q79-W83 PolarHBondContact O-N 3.04Å
80	V	97.4	Very high	96.9	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.8	-48.9	175.4	177.6	0	0	0	0	110.3	L51 V61 R66 L69 A70 L75 S76 E77 V82 W83 F84	L51-V80 HydrophobicContact CD2-CG1 4.48Å; V61-V80 HydrophobicContact CG2-CG1 3.94Å; R66-V80 HydrophobicContact CG-CB 4.32Å; R66-V80 HydrophobicContact CG-CG1 4.13Å; L69-V80 HydrophobicContact CD2-CG1 3.91Å; L69-V80 HydrophobicContact CG-CG1 4.46Å; A70-V80 HydrophobicContact CB-CG2 3.97Å; L75-V80 HydrophobicContact CB-CG2 4.13Å; L75-V80 HydrophobicContact CD1-CG2 4.39Å; S76-V80 PolarHBondContact O-N 2.93Å; S76-V80 VanDerWaalsContact O-N 3.09Å; E77-V80 PolarHBondContact O-N 3.03Å; V80-V82 VanDerWaalsContact C-N 3.34Å; V80-V82 PolarHBondContact O-N 3.36Å; V80-W83 PolarHBondContact O-N 3.2Å; V80-F84 HydrophobicContact CG1-CD2 3.83Å; V80-F84 HydrophobicContact CG1-CE2 3.91Å; V80-F84 WeakPolarHBondContact O-CD2 3.41Å; V80-F84 PolarHBondContact O-N 3.32Å
81	K	96.7	Very high	96.6	Very high	99 Å²	99	67.7 Å²	67.7	43%	0.43	34%	0.336	S	S	.	.	H	α-helix	trans	-55.2	-47.9	177	179.3	-176.3	175.4	-178.4	0	111.9	E77 T78 F84 Q85	E77-K81 VanDerWaalsContact O-CB 3.27Å; E77-K81 WeakPolarHBondContact O-CB 3.34Å; E77-K81 PolarHBondContact O-N 2.84Å; T78-K81 PolarHBondContact O-N 3.04Å; K81-F84 PolarHBondContact O-N 2.92Å; K81-Q85 WeakPolarHBondContact O-CB 3.41Å; K81-Q85 PolarHBondContact O-N 3.02Å
82	V	96	Very high	96.3	Very high	73 Å²	73	68.6 Å²	68.6	44%	0.442	33%	0.328	S	S	.	.	H	α-helix	trans	-66.8	-40.6	179.5	170.6	0	0	0	0	111.1	T78 Q79 V80 Q85 N86	T78-V82 HydrophobicContact CG2-CG2 4.38Å; T78-V82 WeakPolarHBondContact O-CB 3.47Å; T78-V82 VanDerWaalsContact O-CG2 3.26Å; T78-V82 WeakPolarHBondContact O-CG2 3.47Å; T78-V82 PolarHBondContact O-N 3.18Å; Q79-V82 PolarHBondContact O-N 3.1Å; V80-V82 VanDerWaalsContact C-N 3.34Å; V80-V82 PolarHBondContact O-N 3.36Å; V82-Q85 WeakPolarHBondContact O-CB 3.27Å; V82-Q85 PolarHBondContact O-N 3.42Å; V82-N86 PolarHBondContact O-N 2.88Å
83	W	97.6	Very high	95.8	Very high	27 Å²	27	71.5 Å²	71.5	10%	0.102	34%	0.339	C	S	.	.	H	α-helix	trans	-60.7	-48.2	176.2	-174.8	98.5	0	0	0	111	F43 L51 F55 Q79 V80 Q85 N86 R87	F43-W83 AromaticContact CD2-CD1 3.82Å; F43-W83 HydrophobicContact CE2-CB 4.4Å; F43-W83 AromaticContact CE2-CD1 3.58Å; F43-W83 HydrophobicContact CE2-CG 4.36Å; L51-W83 VanDerWaalsContact C-CH2 3.42Å; L51-W83 HydrophobicContact CB-CD2 3.89Å; L51-W83 HydrophobicContact CB-CE3 3.94Å; L51-W83 HydrophobicContact CB-CH2 3.66Å; L51-W83 HydrophobicContact CB-CZ2 3.56Å; L51-W83 HydrophobicContact CB-CZ3 3.84Å; L51-W83 HydrophobicContact CD1-CD2 3.91Å; L51-W83 HydrophobicContact CD1-CG 3.84Å; L51-W83 HydrophobicContact CD2-CD2 4.13Å; L51-W83 HydrophobicContact CD2-CE3 4.05Å; L51-W83 HydrophobicContact CD2-CG 4.42Å; L51-W83 HydrophobicContact CG-CD2 4.2Å; L51-W83 HydrophobicContact CG-CE3 4.42Å; L51-W83 WeakPolarHBondContact O-CH2 3.49Å; L51-W83 WeakPolarHBondContact O-CZ3 3.26Å; F55-W83 HydrophobicContact CB-CH2 4.03Å; F55-W83 HydrophobicContact CB-CZ3 3.96Å; F55-W83 HydrophobicContact CD2-CZ3 4.22Å; F55-W83 HydrophobicContact CG-CH2 4.48Å; F55-W83 HydrophobicContact CG-CZ3 4.35Å; Q79-W83 WeakPolarHBondContact O-CB 3.49Å; Q79-W83 PolarHBondContact O-N 3.04Å; V80-W83 PolarHBondContact O-N 3.2Å; W83-Q85 VanDerWaalsContact C-N 3.29Å; W83-Q85 PolarHBondContact O-N 3.2Å; W83-N86 PolarHBondContact O-N 3.37Å; W83-R87 HydrophobicContact CD2-CB 4.39Å; W83-R87 HydrophobicContact CE3-CB 4.02Å; W83-R87 HydrophobicContact CH2-CB 3.92Å; W83-R87 HydrophobicContact CH2-CG 3.59Å; W83-R87 HydrophobicContact CZ2-CB 4.32Å; W83-R87 HydrophobicContact CZ2-CG 4.2Å; W83-R87 HydrophobicContact CZ3-CB 3.77Å; W83-R87 HydrophobicContact CZ3-CG 3.8Å; W83-R87 VanDerWaalsContact O-CB 3.31Å; W83-R87 WeakPolarHBondContact O-CB 3.25Å; W83-R87 PolarHBondContact O-N 3.36Å
84	F	98.1	Very high	95	Very high	1 Å²	1	74.8 Å²	74.8	0%	0.004	37%	0.366	C	S	.	.	H	α-helix	trans	-60.7	-38.6	176.8	-90.8	-99	0	0	0	112.1	L51 A54 F55 N58 V61 L69 V80 K81 R87 R88	L51-F84 HydrophobicContact CD2-CE2 4.19Å; A54-F84 HydrophobicContact CB-CZ 4.12Å; F55-F84 HydrophobicContact CB-CE1 4.24Å; F55-F84 HydrophobicContact CB-CZ 4.5Å; F55-F84 AromaticContact CD2-CD1 3.85Å; F55-F84 HydrophobicContact CD2-CD1 3.85Å; F55-F84 AromaticContact CD2-CE1 3.87Å; F55-F84 HydrophobicContact CD2-CE1 3.87Å; F55-F84 HydrophobicContact CE2-CD1 4.5Å; N58-F84 WeakPolarHBondContact O-CE1 3.32Å; V61-F84 HydrophobicContact CB-CE1 4.31Å; V61-F84 HydrophobicContact CB-CE2 4.37Å; V61-F84 HydrophobicContact CB-CZ 4.24Å; V61-F84 HydrophobicContact CG1-CD1 4.19Å; V61-F84 HydrophobicContact CG1-CD2 4.39Å; V61-F84 HydrophobicContact CG1-CE1 3.52Å; V61-F84 HydrophobicContact CG1-CE2 3.76Å; V61-F84 HydrophobicContact CG1-CZ 3.28Å; V61-F84 HydrophobicContact CG2-CB 4.31Å; V61-F84 HydrophobicContact CG2-CD1 3.87Å; V61-F84 HydrophobicContact CG2-CD2 3.47Å; V61-F84 VanDerWaalsContact CG2-CD2 3.47Å; V61-F84 HydrophobicContact CG2-CE1 4.04Å; V61-F84 HydrophobicContact CG2-CE2 3.67Å; V61-F84 HydrophobicContact CG2-CG 3.6Å; V61-F84 HydrophobicContact CG2-CZ 3.95Å; L69-F84 HydrophobicContact CD2-CE2 3.72Å; L69-F84 HydrophobicContact CD2-CZ 4.12Å; V80-F84 HydrophobicContact CG1-CD2 3.83Å; V80-F84 HydrophobicContact CG1-CE2 3.91Å; V80-F84 WeakPolarHBondContact O-CD2 3.41Å; V80-F84 PolarHBondContact O-N 3.32Å; K81-F84 PolarHBondContact O-N 2.92Å; F84-R87 PolarHBondContact O-N 2.84Å; F84-R88 WeakPolarHBondContact O-CB 3.46Å; F84-R88 WeakPolarHBondContact O-CG 3.15Å; F84-R88 PolarHBondContact O-N 3.04Å
85	Q	96.3	Very high	93.5	Very high	37 Å²	37	73.4 Å²	73.4	17%	0.173	36%	0.358	C	S	.	.	H	α-helix	trans	-62.9	-45.9	175	-173	59.9	39.3	0	0	112.3	H14 K81 V82 W83 T89	H14-Q85 PolarHBondContact CE1-NE2 2.91Å; H14-Q85 PolarHBondContact NE2-NE2 3.11Å; K81-Q85 WeakPolarHBondContact O-CB 3.41Å; K81-Q85 PolarHBondContact O-N 3.02Å; V82-Q85 WeakPolarHBondContact O-CB 3.27Å; V82-Q85 PolarHBondContact O-N 3.42Å; W83-Q85 VanDerWaalsContact C-N 3.29Å; W83-Q85 PolarHBondContact O-N 3.2Å; Q85-T89 PolarHBondContact O-N 3.2Å; Q85-T89 VanDerWaalsContact O-N 3.08Å; Q85-T89 PolarHBondContact O-OG1 2.91Å
86	N	96.8	Very high	92	Very high	102 Å²	102	78 Å²	78	55%	0.545	39%	0.389	S	S	.	.	H	α-helix	trans	-66.4	-41.1	177	-71.3	-17.6	0	0	0	111.4	V82 W83 R88 T89 K90	V82-N86 PolarHBondContact O-N 2.88Å; W83-N86 PolarHBondContact O-N 3.37Å; N86-R88 PolarHBondContact O-N 3Å; N86-T89 WeakPolarHBondContact O-CB 3.49Å; N86-T89 PolarHBondContact O-N 3.18Å; N86-T89 VanDerWaalsContact O-N 3.16Å; N86-K90 PolarHBondContact O-N 2.9Å
87	R	97.3	Very high	90	Very high	40 Å²	40	83.4 Å²	83.4	15%	0.151	41%	0.408	C	S	.	.	H	α-helix	trans	-64	-40.5	178.6	-176.4	63.2	-172.3	69.3	6	112	E52 F55 W83 F84 K90 H91	E52-R87 VanDerWaalsContact CD-NE 3.28Å; E52-R87 IonicContact OE1-CZ 3.12Å; E52-R87 IonicContact OE1-NE 2.82Å; E52-R87 PolarHBondContact OE1-NE 3.15Å; E52-R87 IonicContact OE1-NH2 2.63Å; E52-R87 PolarHBondContact OE1-NH2 3.25Å; E52-R87 WeakPolarHBondContact OE2-CD 3.44Å; E52-R87 IonicContact OE2-CZ 3.94Å; E52-R87 IonicContact OE2-NE 2.91Å; E52-R87 PolarHBondContact OE2-NE 2.98Å; F55-R87 HydrophobicContact CB-CG 4.48Å; F55-R87 HydrophobicContact CD1-CG 3.83Å; F55-R87 HydrophobicContact CD2-CB 4.14Å; F55-R87 HydrophobicContact CD2-CG 3.51Å; F55-R87 HydrophobicContact CE1-CG 3.86Å; F55-R87 VanDerWaalsContact CE1-CZ 3.41Å; F55-R87 VanDerWaalsContact CE1-NH1 3.31Å; F55-R87 HydrophobicContact CE2-CB 4.05Å; F55-R87 HydrophobicContact CE2-CG 3.54Å; F55-R87 HydrophobicContact CG-CG 3.66Å; F55-R87 HydrophobicContact CZ-CG 3.73Å; W83-R87 HydrophobicContact CD2-CB 4.39Å; W83-R87 HydrophobicContact CE3-CB 4.02Å; W83-R87 HydrophobicContact CH2-CB 3.92Å; W83-R87 HydrophobicContact CH2-CG 3.59Å; W83-R87 HydrophobicContact CZ2-CB 4.32Å; W83-R87 HydrophobicContact CZ2-CG 4.2Å; W83-R87 HydrophobicContact CZ3-CB 3.77Å; W83-R87 HydrophobicContact CZ3-CG 3.8Å; W83-R87 VanDerWaalsContact O-CB 3.31Å; W83-R87 WeakPolarHBondContact O-CB 3.25Å; W83-R87 PolarHBondContact O-N 3.36Å; F84-R87 PolarHBondContact O-N 2.84Å; R87-K90 PolarHBondContact O-N 3.44Å; R87-H91 WeakPolarHBondContact O-CB 3.37Å; R87-H91 PolarHBondContact O-N 3.03Å
88	R	97.1	Very high	88.1	Confident	46 Å²	46	88 Å²	88	17%	0.174	43%	0.427	C	S	.	.	H	α-helix	trans	-62.9	-40.9	171	-75.1	-170.6	-65	-93.5	1.3	112.2	F55 H59 Y60 F84 N86 K90 H91 K92	F55-R88 HydrophobicContact CE2-CG 3.86Å; F55-R88 HydrophobicContact CZ-CG 4.28Å; H59-R88 PolarHBondContact O-NH1 3.37Å; Y60-R88 VanDerWaalsContact CE1-CD 3.43Å; F84-R88 WeakPolarHBondContact O-CB 3.46Å; F84-R88 WeakPolarHBondContact O-CG 3.15Å; F84-R88 PolarHBondContact O-N 3.04Å; N86-R88 PolarHBondContact O-N 3Å; R88-K90 VanDerWaalsContact C-N 3.34Å; R88-K90 PolarHBondContact O-N 3.31Å; R88-H91 PolarHBondContact O-N 2.89Å; R88-K92 WeakPolarHBondContact O-CB 3.37Å; R88-K92 PolarHBondContact O-N 3.47Å
89	T	94.5	Very high	86.1	Confident	35 Å²	35	89.3 Å²	89.3	22%	0.215	44%	0.437	C	S	.	.	H	α-helix	trans	-59.6	-45.8	174.9	-57.6	0	0	0	0	111.1	Q85 N86 K92 R93	Q85-T89 PolarHBondContact O-N 3.2Å; Q85-T89 VanDerWaalsContact O-N 3.08Å; Q85-T89 PolarHBondContact O-OG1 2.91Å; N86-T89 WeakPolarHBondContact O-CB 3.49Å; N86-T89 PolarHBondContact O-N 3.18Å; N86-T89 VanDerWaalsContact O-N 3.16Å; T89-K92 PolarHBondContact O-N 3.09Å; T89-R93 WeakPolarHBondContact O-CG 3.33Å; T89-R93 PolarHBondContact O-N 3.4Å
90	K	92.6	Very high	84	Confident	152 Å²	152	92.1 Å²	92.1	66%	0.661	46%	0.458	S	S	*	.	H	α-helix	trans	-63.5	-45.1	175.4	-172.5	-179.3	177.3	-173	0	112	N86 R87 R88 K92 R93 A94	N86-K90 PolarHBondContact O-N 2.9Å; R87-K90 PolarHBondContact O-N 3.44Å; R88-K90 VanDerWaalsContact C-N 3.34Å; R88-K90 PolarHBondContact O-N 3.31Å; K90-K92 VanDerWaalsContact C-N 3.31Å; K90-K92 PolarHBondContact O-N 3.08Å; K90-R93 PolarHBondContact O-N 2.92Å; K90-A94 PolarHBondContact O-N 3.22Å; K90-A94 VanDerWaalsContact O-N 3.14Å
91	H	93	Very high	81.6	Confident	89 Å²	89	100.2 Å²	100.2	41%	0.412	50%	0.5	S	S	.	.	H	α-helix	trans	-57.8	-44	178.2	-167.9	64	0	0	0	112	F55 H59 R87 R88 R93 A94	F55-H91 HydrophobicContact CE1-CB 4.49Å; F55-H91 HydrophobicContact CZ-CB 4.22Å; H59-H91 AromaticContact CE1-NE2 3.68Å; R87-H91 WeakPolarHBondContact O-CB 3.37Å; R87-H91 PolarHBondContact O-N 3.03Å; R88-H91 PolarHBondContact O-N 2.89Å; H91-R93 PolarHBondContact O-N 3.04Å; H91-A94 PolarHBondContact O-N 3.34Å
92	K	91.7	Very high	79.6	Confident	116 Å²	116	102.6 Å²	102.6	50%	0.504	51%	0.512	S	S	.	.	H	α-helix	trans	-64.2	-40.1	178.5	-174.7	175.1	64.6	179.8	0	112.2	R88 T89 K90 A94	R88-K92 WeakPolarHBondContact O-CB 3.37Å; R88-K92 PolarHBondContact O-N 3.47Å; T89-K92 PolarHBondContact O-N 3.09Å; K90-K92 VanDerWaalsContact C-N 3.31Å; K90-K92 PolarHBondContact O-N 3.08Å; K92-A94 VanDerWaalsContact C-N 3.26Å; K92-A94 PolarHBondContact O-N 3.04Å
93	R	87.4	Confident	77	Confident	197 Å²	197	104.4 Å²	104.4	74%	0.743	52%	0.524	S	S	*	.	H	α-helix	trans	-72	-17.2	178.9	-71.1	177.4	178.7	-177	-0.5	113.7	T89 K90 H91 K95	T89-R93 WeakPolarHBondContact O-CG 3.33Å; T89-R93 PolarHBondContact O-N 3.4Å; K90-R93 PolarHBondContact O-N 2.92Å; H91-R93 PolarHBondContact O-N 3.04Å; R93-K95 PolarHBondContact O-N 2.87Å
94	A	81	Confident	74.8	Confident	73 Å²	73	109.9 Å²	109.9	60%	0.603	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-0.8	-178.8	0	0	0	0	0	113.9	K90 H91 K92 P96	K90-A94 PolarHBondContact O-N 3.22Å; K90-A94 VanDerWaalsContact O-N 3.14Å; H91-A94 PolarHBondContact O-N 3.34Å; K92-A94 VanDerWaalsContact C-N 3.26Å; K92-A94 PolarHBondContact O-N 3.04Å; A94-P96 WeakPolarHBondContact O-CD 3.49Å
95	K	65.7	Low	72	Confident	150 Å²	150	117.1 Å²	117.1	65%	0.652	59%	0.593	S	S	*	*	S	Bend	trans	-76.3	115.2	170.9	-70.4	-174.7	178.4	-172.5	0	108.7	R93 E97	R93-K95 PolarHBondContact O-N 2.87Å; K95-E97 PolarHBondContact O-N 3.43Å
96	P	64.2	Low	69.2	Low	118 Å²	118	118.7 Å²	118.7	77%	0.766	62%	0.619	S	S	*	*			trans	-68.6	101.7	168.6	28.9	-31.1	0	0	0	107.2	A94 K98	A94-P96 WeakPolarHBondContact O-CD 3.49Å; P96-K98 PolarHBondContact O-N 3.31Å; P96-K98 VanDerWaalsContact O-N 3.08Å
97	E	56.7	Low	66.9	Low	166 Å²	166	118.2 Å²	118.2	78%	0.776	63%	0.629	S	S	*	*			trans	-56.3	116.1	154.1	-58.3	-60.9	153.8	0	0	105.2	K95	K95-E97 PolarHBondContact O-N 3.43Å
98	K	56.9	Low	64.6	Low	182 Å²	182	122.6 Å²	122.6	79%	0.791	66%	0.66	S	S	*	*			trans	-46.2	129.1	176.9	-66.7	170.2	177.5	174.9	0	107.6	P96 T100	P96-K98 PolarHBondContact O-N 3.31Å; P96-K98 VanDerWaalsContact O-N 3.08Å; K98-T100 PolarHBondContact O-N 3.1Å
99	P	53.5	Low	62.3	Low	123 Å²	123	125.7 Å²	125.7	80%	0.799	69%	0.69	S	S	*	*			trans	-60.8	106.3	173.2	24.9	-30	0	0	0	106.4	L101	P99-L101 PolarHBondContact O-N 3.13Å
100	T	53.8	Low	60.2	Low	108 Å²	108	129.7 Å²	129.7	66%	0.663	72%	0.719	S	S	*	*			trans	-66.3	109.7	166.9	15.9	0	0	0	0	104.9	K98 H102	K98-T100 PolarHBondContact O-N 3.1Å; T100-H102 PolarHBondContact O-N 2.82Å
101	L	47.5	Very low	58.1	Low	170 Å²	170	127.5 Å²	127.5	89%	0.89	72%	0.722	S	S	*	*			trans	-52.5	106.5	173.3	-87.3	163.3	0	0	0	109.3	P99	P99-L101 PolarHBondContact O-N 3.13Å
102	H	53.5	Low	55.9	Low	149 Å²	149	131.2 Å²	131.2	69%	0.69	74%	0.74	S	S	*	*			trans	-124.6	96.2	150.1	-13	-70	0	0	0	106.8	T100	T100-H102 PolarHBondContact O-N 2.82Å
103	T	42.7	Very low	53.8	Low	111 Å²	111	134.7 Å²	134.7	68%	0.681	76%	0.758	S	S	*	*			trans	75.1	93.8	130.2	-51.3	0	0	0	0	117.8
104	L	50.7	Low	52.4	Low	143 Å²	143	134.9 Å²	134.9	75%	0.749	76%	0.764	S	S	*	*				84.5	114	126.5	-59.8	179.4	0	0	0	120.2
105	N	38.5	Very low	51.3	Low	153 Å²	153	141.3 Å²	141.3	82%	0.818	78%	0.779	S	S	*	*				118.8	120.5	127.8	-69	-12.2	0	0	0	117.7
106	G	38.1	Very low	50.5	Low	69 Å²	69	141.5 Å²	141.5	71%	0.711	79%	0.785	S	S	*	*			trans	101.3	89.3	160.1	0	0	0	0	0	113.1
107	A	49.7	Very low	50.2	Low	93 Å²	93	143.7 Å²	143.7	77%	0.769	79%	0.789	S	S	*	*				49.1	122.2	84.7	0	0	0	0	0	111.5
108	T	47.1	Very low	49.9	Very low	131 Å²	131	140.8 Å²	140.8	80%	0.804	79%	0.785	S	S	*	*			cis	-174	152.8	21.8	21	0	0	0	0	106.9
109	S	50.1	Low	50.3	Low	112 Å²	112	138.2 Å²	138.2	78%	0.783	79%	0.787	S	S	*	*			trans	-13.7	134.2	163.3	55.4	0	0	0	0	119.9
110	S	49.3	Very low	50.5	Low	119 Å²	119	138.3 Å²	138.3	83%	0.832	79%	0.786	S	S	*	*				147.1	132.4	115.1	-164.2	0	0	0	0	112.1
111	S	48.2	Very low	50.8	Low	105 Å²	105	139 Å²	139	73%	0.734	79%	0.792	S	S	*	*			trans	-43.4	134.4	177	-63.6	0	0	0	0	114.7
112	E	47.8	Very low	51.3	Low	168 Å²	168	136.4 Å²	136.4	79%	0.785	79%	0.788	S	S	*	*			trans	-165.4	136.9	139.7	-145.5	81.4	105.5	0	0	110	K114	E112-K114 PolarHBondContact O-N 2.78Å
113	Q	47.1	Very low	51.1	Low	189 Å²	189	136.4 Å²	136.4	88%	0.883	80%	0.798	S	S	*	*			trans	-48.2	125.4	-176.3	-60	168.4	-1.7	0	0	113.5
114	K	58.5	Low	51.3	Low	200 Å²	200	133.9 Å²	133.9	87%	0.87	79%	0.794	S	S	*	*			trans	-131.6	116.3	167.7	-69.8	-173.4	-177	177.3	0	112	E112	E112-K114 PolarHBondContact O-N 2.78Å
115	K	58.3	Low	51.1	Low	209 Å²	209	136.3 Å²	136.3	91%	0.909	80%	0.802	S	S	*	*			trans	-55.8	144.3	170.1	-69.6	172.2	-179.1	175.1	0	110.4	I117	K115-I117 PolarHBondContact O-N 2.95Å
116	I	47.9	Very low	51.6	Low	153 Å²	153	137.2 Å²	137.2	79%	0.785	80%	0.801	S	S	*	*			trans	-57.3	126	176.6	-60.2	178.8	0	0	0	110.4
117	I	57.7	Low	52.3	Low	164 Å²	164	139.7 Å²	139.7	84%	0.841	80%	0.803	S	S	*	*			trans	-142.5	120.2	148	-124.5	119	0	0	0	107.8	K115	K115-I117 PolarHBondContact O-N 2.95Å
118	C	51.6	Low	52.4	Low	105 Å²	105	140 Å²	140	71%	0.709	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-78	141.3	170.1	-54.3	0	0	0	0	107.8	V120	C118-V120 PolarHBondContact O-N 3.11Å
119	P	64	Low	52.5	Low	128 Å²	128	142.9 Å²	142.9	83%	0.831	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-68.1	124.5	-177.2	-11.3	26.1	0	0	0	110.2
120	V	59.5	Low	52.4	Low	126 Å²	126	145.3 Å²	145.3	76%	0.764	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-83.5	132.8	162	81.9	0	0	0	0	107.3	C118 S122	C118-V120 PolarHBondContact O-N 3.11Å; V120-S122 PolarHBondContact O-N 2.95Å
121	P	58.6	Low	52.3	Low	122 Å²	122	144.1 Å²	144.1	79%	0.792	80%	0.8	S	S	*	*			trans	-73.9	112.3	172.5	27.8	-28.6	0	0	0	108.4
122	S	58.1	Low	52.4	Low	116 Å²	116	146.5 Å²	146.5	81%	0.811	80%	0.8	S	S	*	*			trans	-85.1	121.5	172.9	-164.6	0	0	0	0	109.6	V120	V120-S122 PolarHBondContact O-N 2.95Å
123	V	48.7	Very low	52.6	Low	149 Å²	149	146.5 Å²	146.5	90%	0.903	80%	0.804	S	S	*	*			trans	-80.5	132.9	165.4	-106.1	0	0	0	0	109.1
124	G	46.8	Very low	53	Low	58 Å²	58	140.8 Å²	140.8	60%	0.598	80%	0.796	S	S	*	*			trans	179.4	114	169.2	0	0	0	0	0	106.4
125	E	48.4	Very low	52.8	Low	194 Å²	194	142.4 Å²	142.4	91%	0.907	80%	0.798	S	S	*	*				51.4	111	85.7	-68.7	-175.6	149	0	0	108.7
126	E	48.1	Very low	52.6	Low	172 Å²	172	144.1 Å²	144.1	80%	0.804	82%	0.816	S	S	*	*			cis	-158.9	150.2	36.1	-79.4	-179.6	84.1	0	0	110.6
127	T	53.7	Low	52.8	Low	121 Å²	121	143.7 Å²	143.7	74%	0.742	82%	0.817	S	S	*	*			trans	34.4	136.4	138.8	75.8	0	0	0	0	122.9
128	S	50.5	Low	52.5	Low	98 Å²	98	142.6 Å²	142.6	69%	0.685	82%	0.816	S	S	*	*			trans	78.5	88.6	138.4	-154.9	0	0	0	0	118.6
129	M	49	Very low	52.6	Low	193 Å²	193	144.7 Å²	144.7	95%	0.951	82%	0.822	S	S	*	*			trans	-135.1	101	135.4	-83.7	-70.1	-156.8	0	0	107.8
130	L	49	Very low	51.9	Low	162 Å²	162	145.7 Å²	145.7	85%	0.848	82%	0.821	S	S	*	*			trans	-46.2	141.1	164.5	-87.1	152.4	0	0	0	111.6
131	S	47.5	Very low	51.4	Low	94 Å²	94	146.9 Å²	146.9	66%	0.657	83%	0.825	S	S	*	*				132.8	141.2	122.6	-156.6	0	0	0	0	113.1
132	Q	49	Very low	51	Low	155 Å²	155	148.6 Å²	148.6	72%	0.724	83%	0.827	S	S	*	*			trans	100.3	106.1	158.7	-118.5	88.1	-11	0	0	117.4
133	I	51.8	Low	50.4	Low	169 Å²	169	150.9 Å²	150.9	87%	0.867	83%	0.828	S	S	*	*			trans	79.3	120.8	142.7	-30.2	177.5	0	0	0	115.9
134	G	56.7	Low	50.6	Low	69 Å²	69	151.1 Å²	151.1	71%	0.711	82%	0.823	S	S	*	*			cis	166.4	126.5	4.8	0	0	0	0	0	106.1
135	Y	54.9	Low	50.9	Low	234 Å²	234	158.8 Å²	158.8	92%	0.918	84%	0.841	S	S	*	*			trans	-82	128.2	176.4	-87.9	-90.5	0	0	0	110.4
136	L	52.2	Low	51.1	Low	245 Å²	245	155.6 Å²	155.6	100%	1.283	84%	0.835	S	S	*	*			trans	-129.7	0	134.4	-91.1	171.4	0	0	0	107

Retrieved 136 of 136 residues in 32 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).