A0A077ZNH8_TRITR Loading...

Transient receptor potential cation channel subfa mily m member 2

AlphaFold DB , UniProt , Accession A0A077ZNH8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 116 aa.

						>A0A077ZNH8_TRITR|A0A077ZNH8
MTDVHTKTEGFTDLEDFNCKYHVHEEICNPKVEKCARNGGIQLPQLQLPEYLRSRDAKILWYEPANLESFNGYSSGSREVVTTRWIRNTYERTGFSGMGKLPEYGPNKALYLLITR
					

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	35.1	Very low	37.8	Very low	247 Å²	247	148.4 Å²	148.4	100%	1.217	79%	0.792	S	S	*	*				0	88.1	0	-140.2	155.1	-177.5	0	0	105.6
2	T	37.6	Very low	37.9	Very low	132 Å²	132	146.2 Å²	146.2	81%	0.81	79%	0.789	S	S	*	*			trans	-107.5	112.6	-169.2	27.9	0	0	0	0	108.3
3	D	35.9	Very low	37.9	Very low	163 Å²	163	143.1 Å²	143.1	87%	0.872	77%	0.771	S	S	*	*			trans	-78.5	116.4	173.7	-148	-22.2	0	0	0	108.1	H5	D3-H5 PolarHBondContact O-N 3.08Å
4	V	41.8	Very low	38.2	Very low	110 Å²	110	142.7 Å²	142.7	67%	0.667	77%	0.768	S	S	*	*			trans	-87.6	103	-177	177	0	0	0	0	107.4	T6	V4-T6 PolarHBondContact O-N 2.6Å
5	H	37.2	Very low	38.5	Very low	179 Å²	179	143.6 Å²	143.6	83%	0.829	77%	0.765	S	S	*	*			trans	-58.2	100	164.6	-98.3	-8.5	0	0	0	110.3	D3 K7	D3-H5 PolarHBondContact O-N 3.08Å; H5-K7 PolarHBondContact O-N 3.45Å
6	T	39.5	Very low	38.5	Very low	118 Å²	118	141.6 Å²	141.6	72%	0.724	76%	0.755	S	S	*	*			trans	-79.4	94.8	157.1	44.8	0	0	0	0	108.2	V4 T8	V4-T6 PolarHBondContact O-N 2.6Å; T6-T8 PolarHBondContact O-N 3.39Å; T6-T8 VanDerWaalsContact O-N 3.12Å
7	K	35.6	Very low	38.5	Very low	174 Å²	174	139.1 Å²	139.1	76%	0.757	74%	0.736	S	S	*	*			trans	-66.7	99.7	160.5	-88.3	-177	171.4	-176	0	108	H5 E9	H5-K7 PolarHBondContact O-N 3.45Å; K7-E9 PolarHBondContact O-N 2.92Å
8	T	37.9	Very low	38.4	Very low	132 Å²	132	136.9 Å²	136.9	81%	0.81	73%	0.725	S	S	*	*			trans	-75.7	93	160.7	-18.2	0	0	0	0	106.4	T6 G10	T6-T8 PolarHBondContact O-N 3.39Å; T6-T8 VanDerWaalsContact O-N 3.12Å; T8-G10 VanDerWaalsContact C-N 3.33Å; T8-G10 PolarHBondContact O-N 2.7Å
9	E	39.8	Very low	38.2	Very low	157 Å²	157	136.1 Å²	136.1	73%	0.734	73%	0.73	S	S	*	*			trans	-70.2	95.6	168.5	-70.7	-175.6	171.1	0	0	107.5	K7 F11	K7-E9 PolarHBondContact O-N 2.92Å; E9-F11 PolarHBondContact O-N 3.2Å
10	G	36.8	Very low	38	Very low	56 Å²	56	137.9 Å²	137.9	58%	0.577	73%	0.731	S	S	*	*			trans	-68.5	118	170.1	0	0	0	0	0	109.2	T8 T12	T8-G10 VanDerWaalsContact C-N 3.33Å; T8-G10 PolarHBondContact O-N 2.7Å; G10-T12 PolarHBondContact O-N 3.15Å; G10-T12 VanDerWaalsContact O-N 3.11Å
11	F	38.5	Very low	37.9	Very low	164 Å²	164	137.7 Å²	137.7	72%	0.719	72%	0.721	S	S	*	*			trans	-65.3	105.7	165.6	-89.7	-97.9	0	0	0	108.3	E9 D16	E9-F11 PolarHBondContact O-N 3.2Å; F11-D16 HydrophobicContact CD1-CB 4.46Å; F11-D16 HydrophobicContact CE1-CB 4.4Å
12	T	38.6	Very low	37.7	Very low	122 Å²	122	134.1 Å²	134.1	75%	0.748	70%	0.701	S	S	*	*			trans	-93.5	-8.4	-175.9	42.6	0	0	0	0	114.7	G10	G10-T12 PolarHBondContact O-N 3.15Å; G10-T12 VanDerWaalsContact O-N 3.11Å
13	D	37.9	Very low	37.8	Very low	106 Å²	106	131.2 Å²	131.2	57%	0.567	68%	0.683	S	S	*	*			trans	-136.4	135	-177.4	-78.6	-51	0	0	0	114.2	E15 D16	D13-E15 PolarHBondContact O-N 3.31Å; D13-D16 PolarHBondContact O-N 3.24Å
14	L	42.7	Very low	37.8	Very low	138 Å²	138	129 Å²	129	72%	0.723	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-19	176.8	-149.5	83.4	0	0	0	112
15	E	43.1	Very low	37.7	Very low	156 Å²	156	133.5 Å²	133.5	73%	0.729	68%	0.681	S	S	*	*	H	α-helix	trans	-74.3	-34.3	-178.5	-68.8	-170.4	155.3	0	0	112.8	D13 F17 N18	D13-E15 PolarHBondContact O-N 3.31Å; E15-F17 PolarHBondContact O-N 2.72Å; E15-N18 PolarHBondContact O-N 2.67Å
16	D	37.8	Very low	38	Very low	112 Å²	112	132.9 Å²	132.9	60%	0.599	68%	0.678	S	S	*	*	H	α-helix	trans	-69.8	-22.1	178.1	-90	-17.3	0	0	0	112.9	F11 D13	F11-D16 HydrophobicContact CD1-CB 4.46Å; F11-D16 HydrophobicContact CE1-CB 4.4Å; D13-D16 PolarHBondContact O-N 3.24Å
17	F	37.8	Very low	38.7	Very low	98 Å²	98	131.2 Å²	131.2	43%	0.43	66%	0.664	S	S	.	*	H	α-helix	trans	-77.4	-31.4	178.2	-151.4	-90.8	0	0	0	112.4	E15	E15-F17 PolarHBondContact O-N 2.72Å
18	N	38.3	Very low	39.2	Very low	100 Å²	100	124.5 Å²	124.5	54%	0.535	64%	0.638	S	S	.	*	H	α-helix	trans	-81.3	-22.7	-176.7	-79.4	-16.6	0	0	0	113.8	E15	E15-N18 PolarHBondContact O-N 2.67Å
19	C	33.9	Very low	39.7	Very low	122 Å²	122	122 Å²	122	82%	0.824	62%	0.62	S	S	*	*	H	α-helix	trans	-87.3	-18.2	-177.5	-81.2	0	0	0	0	114.7
20	K	34.5	Very low	40.1	Very low	171 Å²	171	119.9 Å²	119.9	74%	0.743	62%	0.62	S	S	*	*	H	α-helix	trans	-98.7	-22.2	-174.8	-159.4	173.2	-174.6	179	0	114.3
21	Y	35.7	Very low	40.6	Very low	135 Å²	135	126.4 Å²	126.4	53%	0.529	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	-117.6	117.2	176.5	-57.2	-81.3	0	0	0	105.2	V23	Y21-V23 PolarHBondContact O-N 2.96Å
22	H	30.4	Very low	41.3	Very low	171 Å²	171	122.6 Å²	122.6	79%	0.792	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	72.8	170.6	-104.3	-114	0	0	0	109.8	H24	H22-H24 AromaticContact CE1-NE2 3.85Å; H22-H24 AromaticContact ND1-CD2 3.45Å; H22-H24 PolarHBondContact ND1-CD2 2.71Å; H22-H24 AromaticContact ND1-NE2 3.08Å; H22-H24 PolarHBondContact ND1-NE2 2.96Å; H22-H24 PolarHBondContact O-N 3.05Å
23	V	40.4	Very low	42	Very low	72 Å²	72	119.2 Å²	119.2	44%	0.436	60%	0.598	S	S	.	*			trans	-75.7	79	161.6	-172.9	0	0	0	0	102.8	Y21 E25 I27	Y21-V23 PolarHBondContact O-N 2.96Å; V23-E25 PolarHBondContact O-N 2.98Å; V23-I27 HydrophobicContact CG1-CD1 3.77Å
24	H	35.3	Very low	42.8	Very low	116 Å²	116	121 Å²	121	54%	0.537	60%	0.601	S	S	.	*			trans	-47.2	129.1	165.9	-92.1	-96.1	0	0	0	106.7	H22 E26	H22-H24 AromaticContact CE1-NE2 3.85Å; H22-H24 AromaticContact ND1-CD2 3.45Å; H22-H24 PolarHBondContact ND1-CD2 2.71Å; H22-H24 AromaticContact ND1-NE2 3.08Å; H22-H24 PolarHBondContact ND1-NE2 2.96Å; H22-H24 PolarHBondContact O-N 3.05Å; H24-E26 PolarHBondContact O-N 3.31Å
25	E	40.8	Very low	43.3	Very low	204 Å²	204	117 Å²	117	95%	0.953	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	23.2	176.9	-73.1	177.3	127.7	0	0	114.2	V23	V23-E25 PolarHBondContact O-N 2.98Å
26	E	43.3	Very low	43.7	Very low	167 Å²	167	110.6 Å²	110.6	78%	0.78	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.8	21.7	-175	-83.2	-168.3	149.5	0	0	113.9	H24 C28	H24-E26 PolarHBondContact O-N 3.31Å; E26-C28 PolarHBondContact O-N 3.43Å
27	I	53.2	Low	44.5	Very low	83 Å²	83	114.7 Å²	114.7	43%	0.426	57%	0.565	S	S	.	*	S	Bend	trans	-70.5	-23.1	174.2	-59	-176.6	0	0	0	111.5	V23 P44	V23-I27 HydrophobicContact CG1-CD1 3.77Å; I27-P44 HydrophobicContact CG2-CG 3.79Å
28	C	47.3	Very low	44.9	Very low	32 Å²	32	112.8 Å²	112.8	22%	0.216	56%	0.559	C	S	.	*			trans	-99.4	112.4	175.8	-78.8	0	0	0	0	111.9	E26 P30 C35	E26-C28 PolarHBondContact O-N 3.43Å; C28-P30 VanDerWaalsContact O-CD 3.24Å; C28-P30 WeakPolarHBondContact O-CD 3.41Å; C28-C35 HydrophobicContact CB-CB 4.37Å; C28-C35 WeakPolarHBondContact CB-SG 3.42Å; C28-C35 WeakPolarHBondContact SG-CA 3.03Å; C28-C35 WeakPolarHBondContact SG-CB 3.03Å; C28-C35 CovalentContact SG-SG 2Å; C28-C35 PolarHBondContact SG-SG 3.34Å
29	N	48	Very low	45.6	Very low	79 Å²	79	110.7 Å²	110.7	42%	0.422	56%	0.562	S	S	.	*			trans	-87.7	106	161.7	-174.6	-12.2	0	0	0	109.4	K31 V32 E33	N29-K31 PolarHBondContact O-N 3.23Å; N29-K31 WeakPolarHBondContact OD1-CB 3.45Å; N29-K31 PolarHBondContact OD1-N 2.73Å; N29-K31 VanDerWaalsContact OD1-N 3.15Å; N29-V32 HydrophobicContact CB-CG2 4.4Å; N29-V32 PolarHBondContact O-N 2Å; N29-E33 PolarHBondContact O-N 2.78Å
30	P	48.2	Very low	46.7	Very low	113 Å²	113	106.4 Å²	106.4	73%	0.734	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-15.4	-175.2	26.2	-34.9	0	0	0	113.5	C28 V32 E33	C28-P30 VanDerWaalsContact O-CD 3.24Å; C28-P30 WeakPolarHBondContact O-CD 3.41Å; P30-V32 VanDerWaalsContact C-N 3.31Å; P30-E33 WeakPolarHBondContact CA-O 3.24Å
31	K	47.1	Very low	47.8	Very low	193 Å²	193	101.7 Å²	101.7	84%	0.839	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-18.6	178	-63.9	-172.1	-179	178.3	0	113.4	N29	N29-K31 PolarHBondContact O-N 3.23Å; N29-K31 WeakPolarHBondContact OD1-CB 3.45Å; N29-K31 PolarHBondContact OD1-N 2.73Å; N29-K31 VanDerWaalsContact OD1-N 3.15Å
32	V	52.8	Low	49.1	Very low	84 Å²	84	102 Å²	102	51%	0.509	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.1	-25.2	-173.3	-147.4	0	0	0	0	111.5	N29 P30	N29-V32 HydrophobicContact CB-CG2 4.4Å; N29-V32 PolarHBondContact O-N 2Å; P30-V32 VanDerWaalsContact C-N 3.31Å
33	E	53.3	Low	50.9	Low	51 Å²	51	94.3 Å²	94.3	24%	0.238	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	145.2	-170.4	-66.2	166.1	170.2	0	0	110.1	N29 P30 P44 Q45	N29-E33 PolarHBondContact O-N 2.78Å; P30-E33 WeakPolarHBondContact CA-O 3.24Å; E33-P44 HydrophobicContact CB-CB 4.23Å; E33-P44 HydrophobicContact CG-CB 4.27Å; E33-P44 WeakPolarHBondContact OE2-CB 2.8Å; E33-Q45 WeakPolarHBondContact CA-O 3.1Å
34	K	53.9	Low	52.2	Low	143 Å²	143	91.3 Å²	91.3	62%	0.622	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	137	160.4	-65.8	-178.7	176.4	179.3	0	107.8	A36 Q45 Q47	K34-A36 PolarHBondContact O-N 3.4Å; K34-Q45 PolarHBondContact N-O 3.27Å; K34-Q45 WeakPolarHBondContact O-CB 3.36Å; K34-Q45 PolarHBondContact O-N 3.39Å; K34-Q47 HydrophobicContact CB-CG 4.31Å; K34-Q47 HydrophobicContact CG-CG 3.99Å
35	C	54.4	Low	54.4	Low	55 Å²	55	88.1 Å²	88.1	37%	0.372	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	104.2	165.2	-43.7	0	0	0	0	107.8	C28 Q42	C28-C35 HydrophobicContact CB-CB 4.37Å; C28-C35 WeakPolarHBondContact CB-SG 3.42Å; C28-C35 WeakPolarHBondContact SG-CA 3.03Å; C28-C35 WeakPolarHBondContact SG-CB 3.03Å; C28-C35 CovalentContact SG-SG 2Å; C28-C35 PolarHBondContact SG-SG 3.34Å; C35-Q42 HydrophobicContact CB-CB 4.33Å; C35-Q42 HydrophobicContact CB-CG 4.49Å
36	A	51.8	Low	56.4	Low	22 Å²	22	80.3 Å²	80.3	18%	0.182	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	136.5	169.7	0	0	0	0	0	108.7	K34 N38 L43 Q45 F95	K34-A36 PolarHBondContact O-N 3.4Å; A36-N38 PolarHBondContact O-N 3.17Å; A36-L43 PolarHBondContact N-O 3.44Å; A36-L43 VanDerWaalsContact N-O 3.12Å; A36-L43 PolarHBondContact O-N 2.78Å; A36-Q45 HydrophobicContact CB-CB 4.01Å; A36-F95 HydrophobicContact CB-CE2 4.33Å; A36-F95 HydrophobicContact CB-CZ 4.05Å
37	R	53.1	Low	58.4	Low	197 Å²	197	75.6 Å²	75.6	74%	0.743	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	99.5	179.1	-167.4	176.9	-173.4	-171.3	-1.9	108.7	I41	R37-I41 WeakPolarHBondContact CA-O 3.41Å
38	N	46.8	Very low	59.8	Low	58 Å²	58	72.8 Å²	72.8	31%	0.31	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	106.1	171.9	-84.2	-16.8	0	0	0	109.5	A36 G40 I41 F95	A36-N38 PolarHBondContact O-N 3.17Å; N38-G40 PolarHBondContact O-N 3.37Å; N38-I41 PolarHBondContact N-O 3.09Å; N38-I41 PolarHBondContact O-N 2.96Å; N38-I41 VanDerWaalsContact O-N 3.13Å; N38-F95 WeakPolarHBondContact ND2-CD2 3.47Å; N38-F95 WeakPolarHBondContact ND2-CE2 3.19Å; N38-F95 WeakPolarHBondContact ND2-CZ 3.23Å
39	G	54.2	Low	61.6	Low	57 Å²	57	74 Å²	74	59%	0.588	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	22.7	174.8	0	0	0	0	0	115.2	K100	G39-K100 VanDerWaalsContact O-CE 3.26Å; G39-K100 WeakPolarHBondContact O-CE 3.49Å; G39-K100 PolarHBondContact O-NZ 2.9Å
40	G	57.1	Low	63.5	Low	32 Å²	32	78.3 Å²	78.3	33%	0.33	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	111.6	-19.1	-179.2	0	0	0	0	0	114.9	N38	N38-G40 PolarHBondContact O-N 3.37Å
41	I	57	Low	65.3	Low	71 Å²	71	81.2 Å²	81.2	36%	0.364	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	130.2	179.8	-51.1	176.9	0	0	0	108.7	R37 N38 L43	R37-I41 WeakPolarHBondContact CA-O 3.41Å; N38-I41 PolarHBondContact N-O 3.09Å; N38-I41 PolarHBondContact O-N 2.96Å; N38-I41 VanDerWaalsContact O-N 3.13Å; I41-L43 HydrophobicContact CB-CD1 4.33Å; I41-L43 HydrophobicContact CB-CG 4.21Å; I41-L43 HydrophobicContact CG2-CD1 4.08Å; I41-L43 HydrophobicContact CG2-CD2 3.63Å; I41-L43 HydrophobicContact CG2-CG 3.66Å; I41-L43 PolarHBondContact O-N 3.4Å
42	Q	63.6	Low	67.3	Low	143 Å²	143	73.7 Å²	73.7	67%	0.668	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	113.7	169.2	-77.2	-174.8	33.3	0	0	108.3	C35	C35-Q42 HydrophobicContact CB-CB 4.33Å; C35-Q42 HydrophobicContact CB-CG 4.49Å
43	L	66.4	Low	69	Low	9 Å²	9	74.4 Å²	74.4	5%	0.047	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	143.7	179.1	-64.5	174.8	0	0	0	109.8	A36 I41 Q45 L67 F70 F95	A36-L43 PolarHBondContact N-O 3.44Å; A36-L43 VanDerWaalsContact N-O 3.12Å; A36-L43 PolarHBondContact O-N 2.78Å; I41-L43 HydrophobicContact CB-CD1 4.33Å; I41-L43 HydrophobicContact CB-CG 4.21Å; I41-L43 HydrophobicContact CG2-CD1 4.08Å; I41-L43 HydrophobicContact CG2-CD2 3.63Å; I41-L43 HydrophobicContact CG2-CG 3.66Å; I41-L43 PolarHBondContact O-N 3.4Å; L43-Q45 PolarHBondContact O-N 2.98Å; L43-L67 HydrophobicContact CB-CD2 4.36Å; L43-L67 HydrophobicContact CD1-CD2 3.27Å; L43-L67 HydrophobicContact CG-CD2 4.41Å; L43-F70 HydrophobicContact CD1-CB 4.45Å; L43-F70 HydrophobicContact CD1-CD2 4.05Å; L43-F70 HydrophobicContact CD1-CG 4.3Å; L43-F70 HydrophobicContact CD2-CB 4.02Å; L43-F70 HydrophobicContact CD2-CD1 3.42Å; L43-F70 VanDerWaalsContact CD2-CD1 3.42Å; L43-F70 HydrophobicContact CD2-CD2 3.57Å; L43-F70 HydrophobicContact CD2-CE1 3.65Å; L43-F70 HydrophobicContact CD2-CE2 3.79Å; L43-F70 HydrophobicContact CD2-CG 3.37Å; L43-F70 HydrophobicContact CD2-CZ 3.82Å; L43-F70 HydrophobicContact CG-CD2 4.42Å; L43-F95 HydrophobicContact CB-CE1 4.08Å
44	P	69	Low	70.6	Confident	8 Å²	8	74.6 Å²	74.6	5%	0.052	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	120.4	176.8	24.2	-31.3	0	0	0	109.3	I27 E33 A65 F95	I27-P44 HydrophobicContact CG2-CG 3.79Å; E33-P44 HydrophobicContact CB-CB 4.23Å; E33-P44 HydrophobicContact CG-CB 4.27Å; E33-P44 WeakPolarHBondContact OE2-CB 2.8Å; P44-A65 HydrophobicContact CG-CB 3.86Å; P44-A65 WeakPolarHBondContact O-CB 3.35Å; P44-F95 VanDerWaalsContact O-CE1 3.28Å; P44-F95 WeakPolarHBondContact O-CE1 3.25Å
45	Q	81.7	Confident	71.9	Confident	50 Å²	50	72.8 Å²	72.8	23%	0.234	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123.2	172.2	-171.1	-179.3	27.2	0	0	109	E33 K34 A36 L43 Q47 T93 F95	E33-Q45 WeakPolarHBondContact CA-O 3.1Å; K34-Q45 PolarHBondContact N-O 3.27Å; K34-Q45 WeakPolarHBondContact O-CB 3.36Å; K34-Q45 PolarHBondContact O-N 3.39Å; A36-Q45 HydrophobicContact CB-CB 4.01Å; L43-Q45 PolarHBondContact O-N 2.98Å; Q45-Q47 PolarHBondContact O-N 3.12Å; Q45-Q47 VanDerWaalsContact O-N 3.11Å; Q45-T93 PolarHBondContact NE2-O 3.13Å; Q45-F95 HydrophobicContact CB-CE1 3.89Å; Q45-F95 HydrophobicContact CB-CE2 3.79Å; Q45-F95 HydrophobicContact CB-CZ 3.39Å; Q45-F95 HydrophobicContact CG-CD2 3.98Å; Q45-F95 HydrophobicContact CG-CE1 4.24Å; Q45-F95 HydrophobicContact CG-CE2 3.45Å; Q45-F95 VanDerWaalsContact CG-CE2 3.45Å; Q45-F95 HydrophobicContact CG-CZ 3.62Å
46	L	82.8	Confident	73.4	Confident	40 Å²	40	77.1 Å²	77.1	21%	0.209	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	114.6	172.3	179.5	61.8	0	0	0	109.3	L48 Y62 P64 G94	L46-L48 PolarHBondContact O-N 3.47Å; L46-Y62 HydrophobicContact CD2-CD2 3.81Å; L46-Y62 HydrophobicContact CD2-CE2 3.72Å; L46-P64 HydrophobicContact CB-CB 4.2Å; L46-P64 HydrophobicContact CD2-CB 4.41Å; L46-G94 PolarHBondContact N-O 3.2Å; L46-G94 VanDerWaalsContact N-O 3.08Å; L46-G94 VanDerWaalsContact O-CA 3.31Å; L46-G94 WeakPolarHBondContact O-CA 3.44Å
47	Q	84	Confident	75.2	Confident	68 Å²	68	77 Å²	77	32%	0.318	39%	0.386	S	S	.	.			trans	-77.1	118.7	-179.9	-66.5	-60.2	-47.2	0	0	109.9	K34 Q45	K34-Q47 HydrophobicContact CB-CG 4.31Å; K34-Q47 HydrophobicContact CG-CG 3.99Å; Q45-Q47 PolarHBondContact O-N 3.12Å; Q45-Q47 VanDerWaalsContact O-N 3.11Å
48	L	82.8	Confident	76.7	Confident	23 Å²	23	77.3 Å²	77.3	12%	0.12	39%	0.393	C	S	.	.			trans	-104.1	128	175.2	-66.7	170.2	0	0	0	109.8	L46 L52 R53 I59 Y62 R92	L46-L48 PolarHBondContact O-N 3.47Å; L48-L52 HydrophobicContact CD2-CB 4.34Å; L48-R53 HydrophobicContact CB-CG 4Å; L48-I59 HydrophobicContact CD2-CD1 4.39Å; L48-Y62 HydrophobicContact CD1-CE2 3.75Å; L48-Y62 HydrophobicContact CD2-CD2 4.16Å; L48-Y62 HydrophobicContact CD2-CE2 3.98Å; L48-Y62 HydrophobicContact CG-CE2 4.25Å; L48-R92 HydrophobicContact CD1-CB 3.29Å; L48-R92 HydrophobicContact CD1-CG 4.31Å
49	P	85.5	Confident	78.5	Confident	57 Å²	57	76.9 Å²	76.9	37%	0.37	39%	0.39	S	S	.	.			trans	-50.3	145.6	161.5	-23.9	32.9	0	0	0	110.6	Y51 L52 R53	P49-Y51 HydrophobicContact CB-CD1 3.6Å; P49-Y51 HydrophobicContact CB-CE1 3.17Å; P49-Y51 HydrophobicContact CB-CG 4.44Å; P49-Y51 HydrophobicContact CG-CE1 3.96Å; P49-Y51 PolarHBondContact O-N 3.41Å; P49-Y51 VanDerWaalsContact O-N 3.15Å; P49-L52 HydrophobicContact CG-CD1 4.3Å; P49-L52 WeakPolarHBondContact O-CA 3.48Å; P49-L52 PolarHBondContact O-N 3.08Å; P49-R53 PolarHBondContact O-N 3.38Å
50	E	87.2	Confident	79.9	Confident	170 Å²	170	83 Å²	83	79%	0.794	41%	0.408	S	S	*	.	H	α-helix	trans	-52.6	-42.2	-174.4	-170.9	173.9	-175.8	0	0	112.6	L52 R53	E50-L52 PolarHBondContact O-N 3.01Å; E50-R53 WeakPolarHBondContact O-CB 3.09Å; E50-R53 PolarHBondContact O-N 3.43Å; E50-R53 VanDerWaalsContact O-N 3.13Å
51	Y	87.6	Confident	80.9	Confident	174 Å²	174	90.8 Å²	90.8	68%	0.682	43%	0.428	S	S	*	.	H	α-helix	trans	-65.7	-16.8	178.1	68.3	-92	0	0	0	114.6	P49 A57	P49-Y51 HydrophobicContact CB-CD1 3.6Å; P49-Y51 HydrophobicContact CB-CE1 3.17Å; P49-Y51 HydrophobicContact CB-CG 4.44Å; P49-Y51 HydrophobicContact CG-CE1 3.96Å; P49-Y51 PolarHBondContact O-N 3.41Å; P49-Y51 VanDerWaalsContact O-N 3.15Å; Y51-A57 WeakPolarHBondContact O-CB 3.45Å
52	L	89.1	Confident	82.1	Confident	36 Å²	36	90.8 Å²	90.8	19%	0.188	42%	0.424	C	S	.	.	H	α-helix	trans	-98	-9.1	176.1	-64.6	-172.6	0	0	0	113.8	L48 P49 E50 S54 A57 I59 R92	L48-L52 HydrophobicContact CD2-CB 4.34Å; P49-L52 HydrophobicContact CG-CD1 4.3Å; P49-L52 WeakPolarHBondContact O-CA 3.48Å; P49-L52 PolarHBondContact O-N 3.08Å; E50-L52 PolarHBondContact O-N 3.01Å; L52-S54 VanDerWaalsContact C-N 3.33Å; L52-A57 HydrophobicContact CD2-CB 4.1Å; L52-I59 HydrophobicContact CB-CD1 4.06Å; L52-I59 HydrophobicContact CD2-CD1 4.49Å; L52-I59 HydrophobicContact CD2-CG1 4.1Å; L52-R92 PolarHBondContact O-NH1 3.18Å
53	R	86.8	Confident	82.9	Confident	99 Å²	99	90.4 Å²	90.4	37%	0.374	42%	0.422	S	S	.	.	H	α-helix	trans	-67.3	-36.5	176.7	-68	-170.8	-177.6	-169.9	1.3	111.8	L48 P49 E50 R55 E91 R92	L48-R53 HydrophobicContact CB-CG 4Å; P49-R53 PolarHBondContact O-N 3.38Å; E50-R53 WeakPolarHBondContact O-CB 3.09Å; E50-R53 PolarHBondContact O-N 3.43Å; E50-R53 VanDerWaalsContact O-N 3.13Å; R53-R55 PolarHBondContact O-N 2.96Å; R53-E91 HydrophobicContact CB-CB 4.2Å; R53-E91 WeakPolarHBondContact CD-OE2 3.49Å; R53-E91 CarbonylContact O-C 3.57Å; R53-E91 WeakPolarHBondContact O-CA 3.08Å; R53-E91 WeakPolarHBondContact O-CB 3.2Å; R53-R92 PolarHBondContact O-N 3.01Å
54	S	87.7	Confident	83.6	Confident	55 Å²	55	90.7 Å²	90.7	39%	0.385	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-57.3	130.6	176.5	172.3	0	0	0	0	110.9	L52 D56 A57 R92	L52-S54 VanDerWaalsContact C-N 3.33Å; S54-D56 PolarHBondContact O-N 3.22Å; S54-D56 VanDerWaalsContact O-N 3.1Å; S54-D56 PolarHBondContact OG-N 3.11Å; S54-A57 VanDerWaalsContact O-CB 3.23Å; S54-A57 WeakPolarHBondContact O-CB 3.28Å; S54-A57 PolarHBondContact O-N 3.19Å; S54-R92 PolarHBondContact O-NH1 3.29Å
55	R	81.9	Confident	84	Confident	105 Å²	105	91.3 Å²	91.3	40%	0.396	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-32.2	177	-71.2	-178.2	58.1	166.9	-11.3	113.7	R53 A57 N88 T89 R92	R53-R55 PolarHBondContact O-N 2.96Å; R55-A57 VanDerWaalsContact C-N 3.26Å; R55-A57 PolarHBondContact O-N 3.12Å; R55-N88 VanDerWaalsContact CD-O 3.3Å; R55-N88 WeakPolarHBondContact CD-O 3.49Å; R55-T89 WeakPolarHBondContact CD-O 3.36Å; R55-R92 PolarHBondContact O-NH2 3.02Å; R55-R92 VanDerWaalsContact O-NH2 3.09Å
56	D	85.9	Confident	83.9	Confident	145 Å²	145	90 Å²	90	78%	0.775	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-11.3	-175.5	-55.7	-42.4	0	0	0	112.4	S54 K58	S54-D56 PolarHBondContact O-N 3.22Å; S54-D56 VanDerWaalsContact O-N 3.1Å; S54-D56 PolarHBondContact OG-N 3.11Å; D56-K58 PolarHBondContact O-N 3.11Å
57	A	88	Confident	83.5	Confident	19 Å²	19	89.2 Å²	89.2	16%	0.157	42%	0.421	C	S	.	.	S	Bend	trans	-62.7	129.9	170.3	0	0	0	0	0	110.2	Y51 L52 S54 R55 I59 R92	Y51-A57 WeakPolarHBondContact O-CB 3.45Å; L52-A57 HydrophobicContact CD2-CB 4.1Å; S54-A57 VanDerWaalsContact O-CB 3.23Å; S54-A57 WeakPolarHBondContact O-CB 3.28Å; S54-A57 PolarHBondContact O-N 3.19Å; R55-A57 VanDerWaalsContact C-N 3.26Å; R55-A57 PolarHBondContact O-N 3.12Å; A57-I59 PolarHBondContact O-N 3.08Å; A57-R92 PolarHBondContact O-NH2 3.35Å
58	K	86.3	Confident	82.8	Confident	205 Å²	205	88.2 Å²	88.2	89%	0.891	42%	0.416	S	S	*	.			trans	-80.3	116.1	175.4	-64.6	-176	-178.1	-179.8	0	109	D56	D56-K58 PolarHBondContact O-N 3.11Å
59	I	83.5	Confident	81.6	Confident	48 Å²	48	90.6 Å²	90.6	25%	0.246	43%	0.434	C	S	.	.			trans	-117.9	130.3	175.8	-56.4	-179.8	0	0	0	107.4	L48 L52 A57 W61 Y62	L48-I59 HydrophobicContact CD2-CD1 4.39Å; L52-I59 HydrophobicContact CB-CD1 4.06Å; L52-I59 HydrophobicContact CD2-CD1 4.49Å; L52-I59 HydrophobicContact CD2-CG1 4.1Å; A57-I59 PolarHBondContact O-N 3.08Å; I59-W61 WeakPolarHBondContact CG2-O 3.43Å; I59-Y62 HydrophobicContact CD1-CD2 4.41Å
60	L	83.2	Confident	80.3	Confident	185 Å²	185	90.9 Å²	90.9	97%	0.969	43%	0.43	S	S	*	.	S	Bend	trans	-70.3	-39.1	179.3	-67.1	174.4	0	0	0	111.9
61	W	79.6	Confident	78.6	Confident	197 Å²	197	86.7 Å²	86.7	75%	0.746	41%	0.413	S	S	*	.			trans	-140.4	124.1	178.9	-162.3	-95.6	0	0	0	110.6	I59 E63	I59-W61 WeakPolarHBondContact CG2-O 3.43Å; W61-E63 PolarHBondContact NE1-OE2 3.24Å
62	Y	81	Confident	76.8	Confident	70 Å²	70	81.4 Å²	81.4	28%	0.275	41%	0.411	S	S	.	.			trans	-138.6	102.8	178.7	179	-107.4	0	0	0	110	L46 L48 I59 P64 R92 G94	L46-Y62 HydrophobicContact CD2-CD2 3.81Å; L46-Y62 HydrophobicContact CD2-CE2 3.72Å; L48-Y62 HydrophobicContact CD1-CE2 3.75Å; L48-Y62 HydrophobicContact CD2-CD2 4.16Å; L48-Y62 HydrophobicContact CD2-CE2 3.98Å; L48-Y62 HydrophobicContact CG-CE2 4.25Å; I59-Y62 HydrophobicContact CD1-CD2 4.41Å; Y62-P64 HydrophobicContact CD1-CG 4.4Å; Y62-P64 HydrophobicContact CE1-CG 3.68Å; Y62-P64 HydrophobicContact CE2-CB 4.46Å; Y62-P64 HydrophobicContact CE2-CG 4.37Å; Y62-R92 HydrophobicContact CE1-CG 4.33Å; Y62-R92 HydrophobicContact CE2-CB 4.34Å; Y62-G94 WeakPolarHBondContact OH-CA 3.35Å; Y62-G94 PolarHBondContact OH-N 3.46Å
63	E	81.7	Confident	74.9	Confident	135 Å²	135	89.1 Å²	89.1	63%	0.631	44%	0.44	S	S	*	.			trans	-134.4	80.8	-175.5	-170.6	167.6	-155.9	0	0	109.8	W61	W61-E63 PolarHBondContact NE1-OE2 3.24Å
64	P	81.3	Confident	72.7	Confident	16 Å²	16	89.4 Å²	89.4	10%	0.104	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-78.7	159.2	177.9	33.9	-37.3	0	0	0	111.6	L46 Y62 N66 G94 S96	L46-P64 HydrophobicContact CB-CB 4.2Å; L46-P64 HydrophobicContact CD2-CB 4.41Å; Y62-P64 HydrophobicContact CD1-CG 4.4Å; Y62-P64 HydrophobicContact CE1-CG 3.68Å; Y62-P64 HydrophobicContact CE2-CB 4.46Å; Y62-P64 HydrophobicContact CE2-CG 4.37Å; P64-N66 PolarHBondContact O-N 3.36Å; P64-G94 VanDerWaalsContact CB-O 3.26Å; P64-G94 WeakPolarHBondContact CB-O 3Å; P64-S96 PolarHBondContact O-OG 2.72Å
65	A	76.7	Confident	70.2	Confident	20 Å²	20	92.7 Å²	92.7	17%	0.165	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	135.1	173.8	0	0	0	0	0	112.1	P44 F70 S96	P44-A65 HydrophobicContact CG-CB 3.86Å; P44-A65 WeakPolarHBondContact O-CB 3.35Å; A65-F70 HydrophobicContact CB-CE2 4.5Å; A65-S96 PolarHBondContact O-N 3.15Å; A65-S96 PolarHBondContact O-OG 3.25Å
66	N	78.4	Confident	68.2	Low	24 Å²	24	90.3 Å²	90.3	13%	0.128	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	120.4	179.1	-174.3	-13.4	0	0	0	110.3	P64 E68 S69 F70 W85 S96	P64-N66 PolarHBondContact O-N 3.36Å; N66-E68 VanDerWaalsContact C-N 3.26Å; N66-E68 PolarHBondContact O-N 3.47Å; N66-E68 WeakPolarHBondContact OD1-CB 3.4Å; N66-E68 PolarHBondContact OD1-N 3.18Å; N66-S69 PolarHBondContact O-N 2.76Å; N66-S69 PolarHBondContact O-OG 3.35Å; N66-F70 WeakPolarHBondContact O-CD2 3.37Å; N66-F70 WeakPolarHBondContact O-CE2 3.31Å; N66-W85 WeakPolarHBondContact ND2-CH2 3.22Å; N66-S96 VanDerWaalsContact CA-OG 3.25Å; N66-S96 WeakPolarHBondContact CA-OG 3.28Å
67	L	76.2	Confident	66.1	Low	22 Å²	22	88.7 Å²	88.7	12%	0.115	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-71.8	-20.3	-177.4	-61.3	179.4	0	0	0	113	L43 S69 F70 F95 S96	L43-L67 HydrophobicContact CB-CD2 4.36Å; L43-L67 HydrophobicContact CD1-CD2 3.27Å; L43-L67 HydrophobicContact CG-CD2 4.41Å; L67-S69 VanDerWaalsContact C-N 3.34Å; L67-F70 PolarHBondContact O-N 2.64Å; L67-F95 HydrophobicContact CD1-CB 4.01Å; L67-F95 HydrophobicContact CD1-CD1 4.44Å; L67-F95 HydrophobicContact CD1-CG 4.26Å; L67-F95 HydrophobicContact CD2-CD1 3.65Å; L67-F95 HydrophobicContact CD2-CE1 4.05Å; L67-F95 HydrophobicContact CD2-CG 4.27Å; L67-F95 HydrophobicContact CG-CB 4.21Å; L67-F95 HydrophobicContact CG-CD1 4.19Å; L67-F95 HydrophobicContact CG-CG 4.43Å; L67-S96 WeakPolarHBondContact CB-O 3.37Å; L67-S96 VanDerWaalsContact CG-O 3.28Å; L67-S96 WeakPolarHBondContact CG-O 3.42Å; L67-S96 PolarHBondContact N-O 2.9Å
68	E	69	Low	64.1	Low	47 Å²	47	97.3 Å²	97.3	22%	0.22	52%	0.516	C	S	.	.	G	3₁₀ helix	trans	-69.7	-32	176.1	-60.1	-49	140.9	0	0	112.5	N66 F70 N71 W85 M98	N66-E68 VanDerWaalsContact C-N 3.26Å; N66-E68 PolarHBondContact O-N 3.47Å; N66-E68 WeakPolarHBondContact OD1-CB 3.4Å; N66-E68 PolarHBondContact OD1-N 3.18Å; E68-F70 PolarHBondContact O-N 3.39Å; E68-F70 VanDerWaalsContact O-N 3.09Å; E68-N71 PolarHBondContact O-N 3.44Å; E68-W85 HydrophobicContact CG-CH2 4.46Å; E68-M98 WeakPolarHBondContact OE1-CA 3.26Å; E68-M98 WeakPolarHBondContact OE1-CB 3.49Å; E68-M98 PolarHBondContact OE1-N 3.19Å
69	S	57.4	Low	62.2	Low	73 Å²	73	96.5 Å²	96.5	51%	0.51	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-68.2	-10	179.9	48.1	0	0	0	0	113.3	N66 L67	N66-S69 PolarHBondContact O-N 2.76Å; N66-S69 PolarHBondContact O-OG 3.35Å; L67-S69 VanDerWaalsContact C-N 3.34Å
70	F	57.3	Low	60.7	Low	64 Å²	64	97 Å²	97	28%	0.281	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-102.4	-5	178.5	-56.7	-78.9	0	0	0	113.4	L43 A65 N66 L67 E68 G72	L43-F70 HydrophobicContact CD1-CB 4.45Å; L43-F70 HydrophobicContact CD1-CD2 4.05Å; L43-F70 HydrophobicContact CD1-CG 4.3Å; L43-F70 HydrophobicContact CD2-CB 4.02Å; L43-F70 HydrophobicContact CD2-CD1 3.42Å; L43-F70 VanDerWaalsContact CD2-CD1 3.42Å; L43-F70 HydrophobicContact CD2-CD2 3.57Å; L43-F70 HydrophobicContact CD2-CE1 3.65Å; L43-F70 HydrophobicContact CD2-CE2 3.79Å; L43-F70 HydrophobicContact CD2-CG 3.37Å; L43-F70 HydrophobicContact CD2-CZ 3.82Å; L43-F70 HydrophobicContact CG-CD2 4.42Å; A65-F70 HydrophobicContact CB-CE2 4.5Å; N66-F70 WeakPolarHBondContact O-CD2 3.37Å; N66-F70 WeakPolarHBondContact O-CE2 3.31Å; L67-F70 PolarHBondContact O-N 2.64Å; E68-F70 PolarHBondContact O-N 3.39Å; E68-F70 VanDerWaalsContact O-N 3.09Å; F70-G72 PolarHBondContact O-N 3.13Å
71	N	52.3	Low	59.4	Low	81 Å²	81	93.1 Å²	93.1	43%	0.433	51%	0.505	S	S	.	.	S	Bend	trans	-88.5	106.8	175	-163.7	13.2	0	0	0	108.7	E68 Y73	E68-N71 PolarHBondContact O-N 3.44Å; N71-Y73 PolarHBondContact O-N 3.05Å; N71-Y73 WeakPolarHBondContact OD1-CD2 3.26Å
72	G	50.3	Low	58.5	Low	63 Å²	63	86.7 Å²	86.7	65%	0.649	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	16.7	-168.7	0	0	0	0	0	117.6	F70	F70-G72 PolarHBondContact O-N 3.13Å
73	Y	48.5	Very low	57.6	Low	199 Å²	199	87.9 Å²	87.9	78%	0.78	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-7.4	-176.6	-78.1	-74	0	0	0	115.4	N71	N71-Y73 PolarHBondContact O-N 3.05Å; N71-Y73 WeakPolarHBondContact OD1-CD2 3.26Å
74	S	41.3	Very low	56.9	Low	105 Å²	105	92.5 Å²	92.5	73%	0.734	51%	0.513	S	S	*	.	S	Bend	trans	-160.6	117.4	172.9	-79.5	0	0	0	0	112.3
75	S	34.7	Very low	56.5	Low	123 Å²	123	94.4 Å²	94.4	86%	0.86	52%	0.519	S	S	*	.			trans	-52	137.9	172.6	63.5	0	0	0	0	112.7
76	G	40.1	Very low	56.7	Low	55 Å²	55	98.9 Å²	98.9	57%	0.567	54%	0.538	S	S	*	.			trans	117.9	104.8	170.1	0	0	0	0	0	110.1	R78	G76-R78 PolarHBondContact O-N 3Å
77	S	42.1	Very low	57	Low	112 Å²	112	105.5 Å²	105.5	78%	0.783	56%	0.562	S	S	*	*			trans	-54.8	77.4	153.7	50.7	0	0	0	0	108.1	E79	S77-E79 PolarHBondContact O-N 2.96Å
78	R	44.3	Very low	57.5	Low	199 Å²	199	107.8 Å²	107.8	75%	0.751	57%	0.574	S	S	*	*			trans	-68.8	118	166.8	-80.7	-177.5	164.4	129	-2.8	104.2	G76 V80	G76-R78 PolarHBondContact O-N 3Å; R78-V80 HydrophobicContact CB-CG2 3.95Å; R78-V80 WeakPolarHBondContact O-CG2 3.14Å; R78-V80 PolarHBondContact O-N 3.2Å
79	E	47.6	Very low	58.3	Low	189 Å²	189	110.1 Å²	110.1	88%	0.883	59%	0.592	S	S	*	*			trans	-53.8	88.4	154.3	-72.4	179.9	174.1	0	0	106.4	S77 V81	S77-E79 PolarHBondContact O-N 2.96Å; E79-V81 PolarHBondContact O-N 3.19Å
80	V	51.6	Low	59.8	Low	58 Å²	58	115.9 Å²	115.9	35%	0.352	60%	0.604	S	S	.	*			trans	-79.9	115.4	177.4	-173.4	0	0	0	0	105.5	R78 T82 W85	R78-V80 HydrophobicContact CB-CG2 3.95Å; R78-V80 WeakPolarHBondContact O-CG2 3.14Å; R78-V80 PolarHBondContact O-N 3.2Å; V80-T82 VanDerWaalsContact C-N 3.3Å; V80-T82 VanDerWaalsContact O-CG2 3.23Å; V80-T82 WeakPolarHBondContact O-CG2 3.46Å; V80-T82 PolarHBondContact O-N 3.01Å; V80-W85 HydrophobicContact CB-CH2 4.31Å; V80-W85 HydrophobicContact CB-CZ2 3.75Å; V80-W85 HydrophobicContact CG1-CH2 4.33Å; V80-W85 HydrophobicContact CG1-CZ2 3.33Å; V80-W85 HydrophobicContact CG2-CZ2 4.3Å
81	V	55.1	Low	61.3	Low	104 Å²	104	116.6 Å²	116.6	63%	0.63	61%	0.608	S	S	*	*			trans	-58.6	96.3	171.6	177.4	0	0	0	0	108.2	E79 T83	E79-V81 PolarHBondContact O-N 3.19Å; V81-T83 HydrophobicContact CG1-CG2 4.05Å; V81-T83 WeakPolarHBondContact CG1-OG1 3.04Å; V81-T83 PolarHBondContact O-N 3.09Å
82	T	61.2	Low	63	Low	61 Å²	61	115 Å²	115	37%	0.374	60%	0.595	S	S	.	*	G	3₁₀ helix	trans	-76	-2.6	-175.8	60.9	0	0	0	0	112.7	V80 R84 W85	V80-T82 VanDerWaalsContact C-N 3.3Å; V80-T82 VanDerWaalsContact O-CG2 3.23Å; V80-T82 WeakPolarHBondContact O-CG2 3.46Å; V80-T82 PolarHBondContact O-N 3.01Å; T82-R84 PolarHBondContact O-N 3.47Å; T82-R84 VanDerWaalsContact O-N 3.08Å; T82-W85 HydrophobicContact CG2-CD2 3.89Å; T82-W85 HydrophobicContact CG2-CE3 3.56Å; T82-W85 HydrophobicContact CG2-CH2 4.19Å; T82-W85 HydrophobicContact CG2-CZ2 4.46Å; T82-W85 HydrophobicContact CG2-CZ3 3.67Å; T82-W85 WeakPolarHBondContact O-CB 3.25Å; T82-W85 PolarHBondContact O-N 3.37Å
83	T	62.1	Low	64.8	Low	95 Å²	95	114.6 Å²	114.6	58%	0.583	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-59.9	-26.8	-174.2	60	0	0	0	0	113.3	V81	V81-T83 HydrophobicContact CG1-CG2 4.05Å; V81-T83 WeakPolarHBondContact CG1-OG1 3.04Å; V81-T83 PolarHBondContact O-N 3.09Å
84	R	68.1	Low	66.6	Low	233 Å²	233	105.1 Å²	105.1	88%	0.879	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-98.8	0.9	177.9	-61.7	-173.1	-179.8	-168.2	0.8	114.3	T82	T82-R84 PolarHBondContact O-N 3.47Å; T82-R84 VanDerWaalsContact O-N 3.08Å
85	W	72.9	Confident	68.7	Low	56 Å²	56	101.2 Å²	101.2	21%	0.212	51%	0.513	C	S	.	.	S	Bend	trans	-69.8	146.8	-178.6	-73.4	6.1	0	0	0	111.5	N66 E68 V80 T82 R87 G97	N66-W85 WeakPolarHBondContact ND2-CH2 3.22Å; E68-W85 HydrophobicContact CG-CH2 4.46Å; V80-W85 HydrophobicContact CB-CH2 4.31Å; V80-W85 HydrophobicContact CB-CZ2 3.75Å; V80-W85 HydrophobicContact CG1-CH2 4.33Å; V80-W85 HydrophobicContact CG1-CZ2 3.33Å; V80-W85 HydrophobicContact CG2-CZ2 4.3Å; T82-W85 HydrophobicContact CG2-CD2 3.89Å; T82-W85 HydrophobicContact CG2-CE3 3.56Å; T82-W85 HydrophobicContact CG2-CH2 4.19Å; T82-W85 HydrophobicContact CG2-CZ2 4.46Å; T82-W85 HydrophobicContact CG2-CZ3 3.67Å; T82-W85 WeakPolarHBondContact O-CB 3.25Å; T82-W85 PolarHBondContact O-N 3.37Å; W85-R87 PolarHBondContact O-N 2.82Å; W85-G97 VanDerWaalsContact CZ3-CA 3.46Å
86	I	80.1	Confident	71	Confident	113 Å²	113	96.2 Å²	96.2	58%	0.579	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-58.6	123	171.4	-59.9	173.3	0	0	0	107.3
87	R	84.8	Confident	72.9	Confident	164 Å²	164	95 Å²	95	62%	0.619	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-91	136.7	-179.6	-60.4	-176.7	-175.1	-178.6	2.3	109.2	W85 T89	W85-R87 PolarHBondContact O-N 2.82Å; R87-T89 PolarHBondContact O-N 3.18Å
88	N	86.4	Confident	74.6	Confident	70 Å²	70	91.6 Å²	91.6	37%	0.374	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-51	129.4	166.3	-177	-3	0	0	0	108.7	R55 Y90 E91 T93	R55-N88 VanDerWaalsContact CD-O 3.3Å; R55-N88 WeakPolarHBondContact CD-O 3.49Å; N88-Y90 VanDerWaalsContact C-N 3.29Å; N88-Y90 PolarHBondContact O-N 2.63Å; N88-Y90 WeakPolarHBondContact OD1-CD2 3.23Å; N88-Y90 PolarHBondContact OD1-N 2.98Å; N88-Y90 VanDerWaalsContact OD1-N 3.08Å; N88-E91 WeakPolarHBondContact CB-O 3.42Å; N88-E91 PolarHBondContact ND2-O 3.1Å; N88-T93 WeakPolarHBondContact ND2-CG2 3.38Å
89	T	87.1	Confident	76.3	Confident	96 Å²	96	83.1 Å²	83.1	59%	0.589	41%	0.413	S	S	*	.	S	Bend	trans	-73	-21.7	-177.2	47.8	0	0	0	0	113.3	R55 R87	R55-T89 WeakPolarHBondContact CD-O 3.36Å; R87-T89 PolarHBondContact O-N 3.18Å
90	Y	87.3	Confident	77.7	Confident	194 Å²	194	81 Å²	81	76%	0.761	40%	0.4	S	S	*	.	S	Bend	trans	-90.9	-61.7	-173.7	-62.3	-81.2	0	0	0	112.6	N88	N88-Y90 VanDerWaalsContact C-N 3.29Å; N88-Y90 PolarHBondContact O-N 2.63Å; N88-Y90 WeakPolarHBondContact OD1-CD2 3.23Å; N88-Y90 PolarHBondContact OD1-N 2.98Å; N88-Y90 VanDerWaalsContact OD1-N 3.08Å
91	E	89.8	Confident	79.1	Confident	79 Å²	79	82.4 Å²	82.4	37%	0.369	41%	0.405	S	S	.	.	B	Isolated β-bridge	trans	-154.5	163.6	-174.1	60.7	173.4	-164.5	0	0	112.3	R53 N88	R53-E91 HydrophobicContact CB-CB 4.2Å; R53-E91 WeakPolarHBondContact CD-OE2 3.49Å; R53-E91 CarbonylContact O-C 3.57Å; R53-E91 WeakPolarHBondContact O-CA 3.08Å; R53-E91 WeakPolarHBondContact O-CB 3.2Å; N88-E91 WeakPolarHBondContact CB-O 3.42Å; N88-E91 PolarHBondContact ND2-O 3.1Å
92	R	88.3	Confident	80.2	Confident	46 Å²	46	82.6 Å²	82.6	17%	0.174	41%	0.409	C	S	.	.			trans	-71.2	126.1	165	-65.6	-173.5	-175.7	80.4	4.9	109.1	L48 L52 R53 S54 R55 A57 Y62	L48-R92 HydrophobicContact CD1-CB 3.29Å; L48-R92 HydrophobicContact CD1-CG 4.31Å; L52-R92 PolarHBondContact O-NH1 3.18Å; R53-R92 PolarHBondContact O-N 3.01Å; S54-R92 PolarHBondContact O-NH1 3.29Å; R55-R92 PolarHBondContact O-NH2 3.02Å; R55-R92 VanDerWaalsContact O-NH2 3.09Å; A57-R92 PolarHBondContact O-NH2 3.35Å; Y62-R92 HydrophobicContact CE1-CG 4.33Å; Y62-R92 HydrophobicContact CE2-CB 4.34Å
93	T	87.1	Confident	81.2	Confident	55 Å²	55	85.9 Å²	85.9	34%	0.337	42%	0.42	S	S	.	.			trans	-96.8	-4.2	-174.9	57.6	0	0	0	0	113.6	Q45 N88 F95	Q45-T93 PolarHBondContact NE2-O 3.13Å; N88-T93 WeakPolarHBondContact ND2-CG2 3.38Å; T93-F95 PolarHBondContact O-N 3.35Å; T93-F95 PolarHBondContact OG1-N 3.17Å; T93-F95 PolarHBondContact OG1-O 2.85Å
94	G	86.7	Confident	82.2	Confident	0 Å²	0	87 Å²	87	0%	0	41%	0.414	C	S	.	.	S	Bend	trans	72.7	12	-171.7	0	0	0	0	0	114.3	L46 Y62 P64	L46-G94 PolarHBondContact N-O 3.2Å; L46-G94 VanDerWaalsContact N-O 3.08Å; L46-G94 VanDerWaalsContact O-CA 3.31Å; L46-G94 WeakPolarHBondContact O-CA 3.44Å; Y62-G94 WeakPolarHBondContact OH-CA 3.35Å; Y62-G94 PolarHBondContact OH-N 3.46Å; P64-G94 VanDerWaalsContact CB-O 3.26Å; P64-G94 WeakPolarHBondContact CB-O 3Å
95	F	85.6	Confident	83	Confident	24 Å²	24	77.3 Å²	77.3	11%	0.105	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	154.4	172.8	-66.5	-66.5	0	0	0	110.7	A36 N38 L43 P44 Q45 L67 T93	A36-F95 HydrophobicContact CB-CE2 4.33Å; A36-F95 HydrophobicContact CB-CZ 4.05Å; N38-F95 WeakPolarHBondContact ND2-CD2 3.47Å; N38-F95 WeakPolarHBondContact ND2-CE2 3.19Å; N38-F95 WeakPolarHBondContact ND2-CZ 3.23Å; L43-F95 HydrophobicContact CB-CE1 4.08Å; P44-F95 VanDerWaalsContact O-CE1 3.28Å; P44-F95 WeakPolarHBondContact O-CE1 3.25Å; Q45-F95 HydrophobicContact CB-CE1 3.89Å; Q45-F95 HydrophobicContact CB-CE2 3.79Å; Q45-F95 HydrophobicContact CB-CZ 3.39Å; Q45-F95 HydrophobicContact CG-CD2 3.98Å; Q45-F95 HydrophobicContact CG-CE1 4.24Å; Q45-F95 HydrophobicContact CG-CE2 3.45Å; Q45-F95 VanDerWaalsContact CG-CE2 3.45Å; Q45-F95 HydrophobicContact CG-CZ 3.62Å; L67-F95 HydrophobicContact CD1-CB 4.01Å; L67-F95 HydrophobicContact CD1-CD1 4.44Å; L67-F95 HydrophobicContact CD1-CG 4.26Å; L67-F95 HydrophobicContact CD2-CD1 3.65Å; L67-F95 HydrophobicContact CD2-CE1 4.05Å; L67-F95 HydrophobicContact CD2-CG 4.27Å; L67-F95 HydrophobicContact CG-CB 4.21Å; L67-F95 HydrophobicContact CG-CD1 4.19Å; L67-F95 HydrophobicContact CG-CG 4.43Å; T93-F95 PolarHBondContact O-N 3.35Å; T93-F95 PolarHBondContact OG1-N 3.17Å; T93-F95 PolarHBondContact OG1-O 2.85Å
96	S	82.4	Confident	83.7	Confident	17 Å²	17	79.8 Å²	79.8	12%	0.119	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	159	164.1	66.5	0	0	0	0	110.2	P64 A65 N66 L67	P64-S96 PolarHBondContact O-OG 2.72Å; A65-S96 PolarHBondContact O-N 3.15Å; A65-S96 PolarHBondContact O-OG 3.25Å; N66-S96 VanDerWaalsContact CA-OG 3.25Å; N66-S96 WeakPolarHBondContact CA-OG 3.28Å; L67-S96 WeakPolarHBondContact CB-O 3.37Å; L67-S96 VanDerWaalsContact CG-O 3.28Å; L67-S96 WeakPolarHBondContact CG-O 3.42Å; L67-S96 PolarHBondContact N-O 2.9Å
97	G	80.4	Confident	84	Confident	29 Å²	29	76.9 Å²	76.9	30%	0.299	40%	0.396	S	S	.	.	S	Bend	trans	98.6	178.1	178.3	0	0	0	0	0	113	W85	W85-G97 VanDerWaalsContact CZ3-CA 3.46Å
98	M	78.5	Confident	84	Confident	42 Å²	42	78.9 Å²	78.9	21%	0.207	41%	0.409	C	S	.	.			trans	-83.9	-30.9	-178.8	-165.3	175	64.2	0	0	111.6	E68 K100 L101 Y104	E68-M98 WeakPolarHBondContact OE1-CA 3.26Å; E68-M98 WeakPolarHBondContact OE1-CB 3.49Å; E68-M98 PolarHBondContact OE1-N 3.19Å; M98-K100 PolarHBondContact O-N 2.82Å; M98-L101 VanDerWaalsContact CE-O 3.25Å; M98-L101 WeakPolarHBondContact CE-O 3.43Å; M98-L101 HydrophobicContact CG-CB 3.88Å; M98-L101 VanDerWaalsContact CG-O 3.22Å; M98-L101 WeakPolarHBondContact CG-O 3.09Å; M98-L101 WeakPolarHBondContact O-CB 3.2Å; M98-L101 WeakPolarHBondContact O-CG 3.3Å; M98-L101 PolarHBondContact O-N 3.31Å; M98-Y104 HydrophobicContact CB-CD1 3.97Å; M98-Y104 HydrophobicContact CB-CE1 3.76Å; M98-Y104 HydrophobicContact CG-CD1 4.43Å; M98-Y104 HydrophobicContact SD-CD2 4.46Å
99	G	79.7	Confident	84.1	Confident	21 Å²	21	78.7 Å²	78.7	22%	0.216	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	-122	-176.5	0	0	0	0	0	111.3
100	K	76.7	Confident	84.1	Confident	143 Å²	143	81.7 Å²	81.7	62%	0.622	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	5.3	178.6	-62.5	-159.3	178.3	-161.3	0	114.2	G39 M98	G39-K100 VanDerWaalsContact O-CE 3.26Å; G39-K100 WeakPolarHBondContact O-CE 3.49Å; G39-K100 PolarHBondContact O-NZ 2.9Å; M98-K100 PolarHBondContact O-N 2.82Å
101	L	81.1	Confident	84.3	Confident	88 Å²	88	82 Å²	82	46%	0.461	43%	0.43	S	S	.	.			trans	-73.5	147.4	177.6	-62.8	171.5	0	0	0	109.9	M98 E103 N107	M98-L101 VanDerWaalsContact CE-O 3.25Å; M98-L101 WeakPolarHBondContact CE-O 3.43Å; M98-L101 HydrophobicContact CG-CB 3.88Å; M98-L101 VanDerWaalsContact CG-O 3.22Å; M98-L101 WeakPolarHBondContact CG-O 3.09Å; M98-L101 WeakPolarHBondContact O-CB 3.2Å; M98-L101 WeakPolarHBondContact O-CG 3.3Å; M98-L101 PolarHBondContact O-N 3.31Å; L101-E103 VanDerWaalsContact C-N 3.35Å; L101-N107 HydrophobicContact CD2-CB 4.21Å
102	P	77.6	Confident	84.4	Confident	108 Å²	108	85.5 Å²	85.5	70%	0.701	45%	0.451	S	S	*	.	S	Bend	trans	-73.1	-25	177.4	26.3	-34	0	0	0	113.6	N107	P102-N107 WeakPolarHBondContact CD-OD1 3.46Å; P102-N107 WeakPolarHBondContact CG-OD1 3.49Å
103	E	82.5	Confident	84.5	Confident	130 Å²	130	90.6 Å²	90.6	61%	0.607	48%	0.481	S	S	*	.	S	Bend	trans	-137.4	152.5	-177.8	-63.4	178.5	-168.6	0	0	112.5	L101 N107	L101-E103 VanDerWaalsContact C-N 3.35Å; E103-N107 PolarHBondContact N-OD1 3.08Å; E103-N107 PolarHBondContact O-ND2 3.31Å
104	Y	83.3	Confident	84.6	Confident	118 Å²	118	95.5 Å²	95.5	46%	0.463	50%	0.503	S	S	.	.	S	Bend	trans	-67.9	135.6	168.5	-69.6	-73.9	0	0	0	110.8	M98	M98-Y104 HydrophobicContact CB-CD1 3.97Å; M98-Y104 HydrophobicContact CB-CE1 3.76Å; M98-Y104 HydrophobicContact CG-CD1 4.43Å; M98-Y104 HydrophobicContact SD-CD2 4.46Å
105	G	85.8	Confident	84.9	Confident	31 Å²	31	101 Å²	101	32%	0.32	54%	0.537	S	S	.	.	S	Bend	trans	87.9	-144.6	177.3	0	0	0	0	0	113.2	N107	G105-N107 PolarHBondContact O-N 3.48Å; G105-N107 PolarHBondContact O-ND2 3.36Å
106	P	85.8	Confident	85.1	Confident	107 Å²	107	114.8 Å²	114.8	70%	0.695	59%	0.588	S	S	*	*			trans	-65.9	122	-175.7	-20.8	33.1	0	0	0	112.6
107	N	87	Confident	85.2	Confident	52 Å²	52	119.7 Å²	119.7	28%	0.278	61%	0.612	S	S	.	*			trans	-107	108.7	172.7	-73.4	-99.8	0	0	0	108.3	L101 P102 E103 G105	L101-N107 HydrophobicContact CD2-CB 4.21Å; P102-N107 WeakPolarHBondContact CD-OD1 3.46Å; P102-N107 WeakPolarHBondContact CG-OD1 3.49Å; E103-N107 PolarHBondContact N-OD1 3.08Å; E103-N107 PolarHBondContact O-ND2 3.31Å; G105-N107 PolarHBondContact O-N 3.48Å; G105-N107 PolarHBondContact O-ND2 3.36Å
108	K	85.7	Confident	85.4	Confident	206 Å²	206	124.5 Å²	124.5	90%	0.896	63%	0.628	S	S	*	*			trans	-79.7	135.6	-173.5	-63.1	-178.7	-176.1	176	0	110.5
109	A	87.7	Confident	85.8	Confident	67 Å²	67	129.1 Å²	129.1	55%	0.554	65%	0.652	S	S	*	*			trans	-124.3	139.4	170.3	0	0	0	0	0	109.4	Y111	A109-Y111 HydrophobicContact CB-CD2 4.33Å; A109-Y111 HydrophobicContact CB-CE2 3.64Å
110	L	87.6	Confident	86.2	Confident	158 Å²	158	135.4 Å²	135.4	83%	0.827	68%	0.677	S	S	*	*			trans	-99.5	119.3	171.6	179.6	66.3	0	0	0	108.3
111	Y	91.2	Very high	86.8	Confident	200 Å²	200	134.9 Å²	134.9	78%	0.784	68%	0.681	S	S	*	*			trans	-103.4	119.9	173.5	-63.7	-89.5	0	0	0	108.9	A109 L113	A109-Y111 HydrophobicContact CB-CD2 4.33Å; A109-Y111 HydrophobicContact CB-CE2 3.64Å; Y111-L113 PolarHBondContact O-N 3.48Å
112	L	90.9	Very high	87.2	Confident	153 Å²	153	138.1 Å²	138.1	80%	0.801	70%	0.696	S	S	*	*			trans	-85.5	106.9	167.7	-69.6	170.5	0	0	0	108.1
113	L	91.8	Very high	87.9	Confident	154 Å²	154	140.2 Å²	140.2	81%	0.806	70%	0.695	S	S	*	*			trans	-93.6	108.2	172.5	-174.7	67.4	0	0	0	108.8	Y111 T115	Y111-L113 PolarHBondContact O-N 3.48Å; L113-T115 HydrophobicContact CD2-CG2 4.21Å; L113-T115 HydrophobicContact CG-CG2 4.06Å
114	I	89.9	Confident	88.3	Confident	158 Å²	158	141 Å²	141	81%	0.81	70%	0.702	S	S	*	*			trans	-98.8	113	174.6	-57.5	173.3	0	0	0	107.4
115	T	92.4	Very high	88.7	Confident	115 Å²	115	142.9 Å²	142.9	71%	0.706	72%	0.722	S	S	*	*			trans	-101.1	155	174.9	58	0	0	0	0	110.3	L113	L113-T115 HydrophobicContact CD2-CG2 4.21Å; L113-T115 HydrophobicContact CG-CG2 4.06Å
116	R	88.4	Confident	88.9	Confident	314 Å²	314	153.1 Å²	153.1	100%	1.185	76%	0.758	S	S	*	*			trans	-98.5	0	171.3	-178.7	178.3	177.8	162.2	0.6	110.6

Retrieved 116 of 116 residues in 19.6 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).