A0A077Z568_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z568, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 84 aa.

						>A0A077Z568_TRITR|A0A077Z568
MGEMLSLYQMTNAAVDRPCDAGDCPSGMACRQKVCNSGSPLLFCQLQSDQTDPPSARPVDPCGARPNSSDIRIIFVTPRDELRS
					

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	38.8	Very low	34.3	Very low	253 Å²	253	137.9 Å²	137.9	100%	1.246	71%	0.711	S	S	*	*				0	83.9	0	-63.5	173.3	-174.7	0	0	107.6
2	G	38.9	Very low	34.9	Very low	59 Å²	59	130.7 Å²	130.7	61%	0.608	67%	0.674	S	S	*	*			trans	-122.3	7.1	-169.8	0	0	0	0	0	114.8	M4	G2-M4 PolarHBondContact O-N 3.4Å
3	E	40	Very low	35.4	Very low	191 Å²	191	126.4 Å²	126.4	89%	0.893	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	15.2	-162.7	-56.6	-149.5	96.3	0	0	114.6
4	M	35.6	Very low	36.3	Very low	156 Å²	156	119.2 Å²	119.2	77%	0.768	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	-9.2	-179.2	-151.4	168.9	-175.7	0	0	114.1	G2	G2-M4 PolarHBondContact O-N 3.4Å
5	L	32.9	Very low	37.1	Very low	137 Å²	137	117 Å²	117	72%	0.717	63%	0.63	S	S	*	*	S	Bend	trans	-85.3	-23.1	176.3	-78.7	150.4	0	0	0	112.8	Q9	L5-Q9 PolarHBondContact O-N 3.49Å
6	S	32.8	Very low	38	Very low	63 Å²	63	114.8 Å²	114.8	44%	0.441	62%	0.617	S	S	.	*	H	α-helix	trans	-76	-32.5	-173	-125	0	0	0	0	113.5	Q9 M10	S6-Q9 PolarHBondContact O-N 2.92Å; S6-M10 PolarHBondContact O-N 3.12Å
7	L	29.3	Very low	38.7	Very low	130 Å²	130	116.8 Å²	116.8	68%	0.681	61%	0.614	S	S	*	*	H	α-helix	trans	-71.4	-34.9	-179.9	-144	79.8	0	0	0	112.3	Q9 T11	L7-Q9 VanDerWaalsContact C-N 3.31Å; L7-Q9 PolarHBondContact O-N 2.99Å; L7-T11 PolarHBondContact O-N 2.81Å; L7-T11 PolarHBondContact O-OG1 3.2Å
8	Y	31.8	Very low	39.7	Very low	172 Å²	172	116.8 Å²	116.8	68%	0.675	62%	0.622	S	S	*	*	H	α-helix	trans	-70	-27.5	174.8	-81.3	-84.8	0	0	0	112.7
9	Q	31.8	Very low	40.8	Very low	152 Å²	152	112 Å²	112	71%	0.71	60%	0.599	S	S	*	*	H	α-helix	trans	-81.1	-35.8	174.5	-84.2	-178.6	5.6	0	0	113.3	L5 S6 L7	L5-Q9 PolarHBondContact O-N 3.49Å; S6-Q9 PolarHBondContact O-N 2.92Å; L7-Q9 VanDerWaalsContact C-N 3.31Å; L7-Q9 PolarHBondContact O-N 2.99Å
10	M	30	Very low	41.8	Very low	143 Å²	143	111.8 Å²	111.8	70%	0.704	60%	0.598	S	S	*	*	H	α-helix	trans	-74.7	-28.5	-176.9	-75.2	179.3	-172.1	0	0	113.7	S6	S6-M10 PolarHBondContact O-N 3.12Å
11	T	35.9	Very low	42.6	Very low	61 Å²	61	111.4 Å²	111.4	37%	0.374	61%	0.61	S	S	.	*	S	Bend	trans	-89	-13.4	-178	-19.8	0	0	0	0	113.3	L7 A13 N36	L7-T11 PolarHBondContact O-N 2.81Å; L7-T11 PolarHBondContact O-OG1 3.2Å; T11-A13 PolarHBondContact O-N 3.35Å; T11-N36 HydrophobicContact CG2-CB 4.34Å; T11-N36 VanDerWaalsContact CG2-CG 3.47Å; T11-N36 VanDerWaalsContact CG2-ND2 3.29Å; T11-N36 WeakPolarHBondContact CG2-ND2 3.45Å
12	N	40.8	Very low	43.6	Very low	51 Å²	51	102.7 Å²	102.7	27%	0.273	59%	0.585	S	S	.	*			trans	-92.1	48.2	171.8	-70.5	12.8	0	0	0	110.2	A14 D60	N12-A14 PolarHBondContact O-N 3.31Å; N12-D60 PolarHBondContact ND2-OD1 2Å; N12-D60 VanDerWaalsContact ND2-OD1 3.17Å; N12-D60 PolarHBondContact ND2-OD2 2.95Å; N12-D60 VanDerWaalsContact ND2-OD2 3.13Å
13	A	41.8	Very low	44.7	Very low	75 Å²	75	100.8 Å²	100.8	62%	0.62	56%	0.561	S	S	*	*			trans	-68.3	64	164	0	0	0	0	0	108.6	T11 V15	T11-A13 PolarHBondContact O-N 3.35Å; A13-V15 PolarHBondContact O-N 3.18Å
14	A	48.5	Very low	45.7	Very low	26 Å²	26	92.6 Å²	92.6	22%	0.215	52%	0.524	C	S	.	.			trans	-68.8	92.1	175	0	0	0	0	0	105.9	N12 D16 K33	N12-A14 PolarHBondContact O-N 3.31Å; A14-D16 PolarHBondContact O-N 3.46Å; A14-K33 HydrophobicContact CB-CB 4.07Å; A14-K33 HydrophobicContact CB-CD 3.45Å; A14-K33 VanDerWaalsContact CB-CD 3.45Å; A14-K33 HydrophobicContact CB-CG 4.22Å
15	V	47.5	Very low	46.8	Very low	86 Å²	86	88.6 Å²	88.6	52%	0.521	51%	0.51	S	S	.	.			trans	-62.3	105.8	169.8	-178	0	0	0	0	105.6	A13 R17 Q32	A13-V15 PolarHBondContact O-N 3.18Å; V15-R17 HydrophobicContact CG1-CG 4.17Å; V15-R17 PolarHBondContact O-N 2.84Å; V15-Q32 VanDerWaalsContact O-O 3.07Å
16	D	51.3	Low	48.2	Very low	81 Å²	81	88.3 Å²	88.3	43%	0.433	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	99.2	172.8	-159.3	-106.9	0	0	0	105.9	A14 R31	A14-D16 PolarHBondContact O-N 3.46Å; D16-R31 IonicContact OD1-NE 3.66Å; D16-R31 IonicContact OD2-NE 3.62Å
17	R	51.3	Low	49.5	Very low	150 Å²	150	87.5 Å²	87.5	57%	0.566	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	136.7	169.9	-87.4	-156.8	167.8	-175.4	-2	108.8	V15 C19 Q32	V15-R17 HydrophobicContact CG1-CG 4.17Å; V15-R17 PolarHBondContact O-N 2.84Å; R17-C19 PolarHBondContact O-N 2.76Å; R17-Q32 HydrophobicContact CB-CB 4.17Å; R17-Q32 PolarHBondContact N-O 3.31Å; R17-Q32 PolarHBondContact O-N 2.03Å; R17-Q32 VanDerWaalsContact O-N 3.14Å
18	P	56.5	Low	51	Low	116 Å²	116	83.4 Å²	83.4	75%	0.753	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.4	133.4	165.2	27.4	-32.8	0	0	0	107.2
19	C	59.6	Low	52.4	Low	26 Å²	26	77 Å²	77	18%	0.176	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-70.3	154.7	173.1	-57.7	0	0	0	0	110.9	R17 D23 C30 R31 Q32 L42	R17-C19 PolarHBondContact O-N 2.76Å; C19-D23 HydrophobicContact CB-CB 4.15Å; C19-C30 HydrophobicContact CB-CB 3.28Å; C19-C30 WeakPolarHBondContact CB-SG 3.4Å; C19-C30 WeakPolarHBondContact SG-CB 3.01Å; C19-C30 PolarHBondContact SG-O 3.43Å; C19-C30 CovalentContact SG-SG 1.98Å; C19-C30 PolarHBondContact SG-SG 3.17Å; C19-R31 WeakPolarHBondContact SG-CA 3.28Å; C19-R31 PolarHBondContact SG-N 2.98Å; C19-Q32 PolarHBondContact SG-N 3.02Å; C19-Q32 VanDerWaalsContact SG-N 3.43Å; C19-L42 HydrophobicContact CB-CD1 4.27Å; C19-L42 WeakPolarHBondContact SG-CD1 2.99Å
20	D	60.7	Low	53.8	Low	108 Å²	108	71.2 Å²	71.2	58%	0.578	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-76.2	155.5	174.8	-132.9	-74.6	0	0	0	110.9	G22 D23	D20-G22 PolarHBondContact O-N 2.86Å; D20-G22 VanDerWaalsContact O-N 3.1Å; D20-D23 WeakPolarHBondContact O-CB 3.3Å; D20-D23 PolarHBondContact O-N 2.68Å; D20-D23 VanDerWaalsContact O-N 3.17Å
21	A	58.3	Low	55.4	Low	103 Å²	103	71.4 Å²	71.4	85%	0.851	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	111.7	177.7	0	0	0	0	0	109.2
22	G	61.6	Low	56.4	Low	70 Å²	70	68.7 Å²	68.7	72%	0.722	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	114.6	-10.1	-176.7	0	0	0	0	0	114.7	D20 C24	D20-G22 PolarHBondContact O-N 2.86Å; D20-G22 VanDerWaalsContact O-N 3.1Å; G22-C24 VanDerWaalsContact C-N 3.3Å
23	D	61.9	Low	57.3	Low	19 Å²	19	68.7 Å²	68.7	10%	0.102	43%	0.431	C	S	.	.	S	Bend	trans	-70.1	-32.4	175.9	-132	-174.2	0	0	0	111	C19 D20 L42	C19-D23 HydrophobicContact CB-CB 4.15Å; D20-D23 WeakPolarHBondContact O-CB 3.3Å; D20-D23 PolarHBondContact O-N 2.68Å; D20-D23 VanDerWaalsContact O-N 3.17Å; D23-L42 HydrophobicContact CB-CD1 4.11Å; D23-L42 HydrophobicContact CB-CD2 3.61Å; D23-L42 HydrophobicContact CB-CG 4.46Å; D23-L42 VanDerWaalsContact CG-CD1 3.48Å; D23-L42 WeakPolarHBondContact O-CD2 3.29Å; D23-L42 WeakPolarHBondContact OD1-CD1 3.49Å; D23-L42 WeakPolarHBondContact OD1-CD2 3.46Å; D23-L42 WeakPolarHBondContact OD2-CD2 3.49Å
24	C	59.3	Low	58.1	Low	19 Å²	19	67.4 Å²	67.4	13%	0.128	42%	0.415	C	S	.	.	S	Bend	trans	-120.8	151.5	171.2	-67.7	0	0	0	0	113.1	G22 M28 C30 C44	G22-C24 VanDerWaalsContact C-N 3.3Å; C24-M28 HydrophobicContact CB-CB 4.09Å; C24-C30 HydrophobicContact CB-CB 3.83Å; C24-C30 WeakPolarHBondContact SG-CB 3.43Å; C24-C30 PolarHBondContact SG-SG 3.3Å; C24-C44 WeakPolarHBondContact CA-SG 2.82Å; C24-C44 HydrophobicContact CB-CB 3.82Å; C24-C44 WeakPolarHBondContact CB-SG 3.13Å; C24-C44 WeakPolarHBondContact SG-CA 3.37Å; C24-C44 WeakPolarHBondContact SG-CB 3.43Å; C24-C44 CovalentContact SG-SG 2Å; C24-C44 PolarHBondContact SG-SG 2.76Å
25	P	58.6	Low	58.5	Low	73 Å²	73	66.7 Å²	66.7	47%	0.474	41%	0.409	S	S	.	.			trans	-54.1	146.4	171	-19.9	28.4	0	0	0	112.1	G27 M28	P25-G27 PolarHBondContact O-N 2.88Å; P25-M28 HydrophobicContact CB-CE 4.07Å; P25-M28 HydrophobicContact CB-CG 4.21Å; P25-M28 HydrophobicContact CB-SD 4.06Å; P25-M28 VanDerWaalsContact CD-SD 3.59Å; P25-M28 HydrophobicContact CG-CE 3.8Å; P25-M28 HydrophobicContact CG-CG 4.41Å; P25-M28 HydrophobicContact CG-SD 3.65Å; P25-M28 WeakPolarHBondContact O-CB 3.47Å; P25-M28 PolarHBondContact O-N 3.36Å; P25-M28 VanDerWaalsContact O-N 3.11Å
26	S	63.1	Low	58.9	Low	131 Å²	131	68.5 Å²	68.5	92%	0.916	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	132.4	173.7	-56.8	0	0	0	0	111.2
27	G	60.9	Low	59.2	Low	46 Å²	46	68.8 Å²	68.8	47%	0.474	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	6.8	-174	0	0	0	0	0	114.5	P25 Q47	P25-G27 PolarHBondContact O-N 2.88Å; G27-Q47 WeakPolarHBondContact O-CB 3.25Å; G27-Q47 PolarHBondContact O-N 3.36Å
28	M	60.9	Low	59.3	Low	44 Å²	44	64.2 Å²	64.2	22%	0.217	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.6	171.1	-55.4	-164.9	176.9	0	0	110.7	C24 P25 C30 C44 Q45 L46	C24-M28 HydrophobicContact CB-CB 4.09Å; P25-M28 HydrophobicContact CB-CE 4.07Å; P25-M28 HydrophobicContact CB-CG 4.21Å; P25-M28 HydrophobicContact CB-SD 4.06Å; P25-M28 VanDerWaalsContact CD-SD 3.59Å; P25-M28 HydrophobicContact CG-CE 3.8Å; P25-M28 HydrophobicContact CG-CG 4.41Å; P25-M28 HydrophobicContact CG-SD 3.65Å; P25-M28 WeakPolarHBondContact O-CB 3.47Å; P25-M28 PolarHBondContact O-N 3.36Å; P25-M28 VanDerWaalsContact O-N 3.11Å; M28-C30 PolarHBondContact O-N 3.02Å; M28-C44 HydrophobicContact CB-CB 4.47Å; M28-C44 HydrophobicContact SD-CB 3.78Å; M28-Q45 CarbonylContact C-O 3.56Å; M28-Q45 WeakPolarHBondContact CA-O 3.45Å; M28-Q45 WeakPolarHBondContact CB-O 3.4Å; M28-L46 HydrophobicContact CE-CD1 3.78Å; M28-L46 HydrophobicContact CG-CB 4.49Å; M28-L46 HydrophobicContact CG-CD1 3.89Å
29	A	60.9	Low	59.2	Low	37 Å²	37	61.3 Å²	61.3	31%	0.306	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	122.7	164.7	0	0	0	0	0	107.8	Q45 Q47	A29-Q45 PolarHBondContact N-O 3.49Å; A29-Q45 PolarHBondContact O-N 3.48Å; A29-Q47 HydrophobicContact CB-CG 3.63Å
30	C	60.2	Low	59.1	Low	30 Å²	30	62 Å²	62	20%	0.203	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	135.8	177.3	-171.6	0	0	0	0	111.6	C19 C24 M28 L42 F43	C19-C30 HydrophobicContact CB-CB 3.28Å; C19-C30 WeakPolarHBondContact CB-SG 3.4Å; C19-C30 WeakPolarHBondContact SG-CB 3.01Å; C19-C30 PolarHBondContact SG-O 3.43Å; C19-C30 CovalentContact SG-SG 1.98Å; C19-C30 PolarHBondContact SG-SG 3.17Å; C24-C30 HydrophobicContact CB-CB 3.83Å; C24-C30 WeakPolarHBondContact SG-CB 3.43Å; C24-C30 PolarHBondContact SG-SG 3.3Å; M28-C30 PolarHBondContact O-N 3.02Å; C30-L42 WeakPolarHBondContact SG-CD1 2.92Å; C30-F43 CarbonylContact C-O 3.53Å; C30-F43 VanDerWaalsContact CA-O 3.27Å; C30-F43 WeakPolarHBondContact CA-O 3.22Å
31	R	63	Low	59.1	Low	147 Å²	147	58.5 Å²	58.5	56%	0.555	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	134.3	166.5	-71.7	-174.2	148.3	147.9	0.5	110.7	D16 C19 F43	D16-R31 IonicContact OD1-NE 3.66Å; D16-R31 IonicContact OD2-NE 3.62Å; C19-R31 WeakPolarHBondContact SG-CA 3.28Å; C19-R31 PolarHBondContact SG-N 2.98Å; R31-F43 HydrophobicContact CB-CB 4.43Å; R31-F43 PolarHBondContact N-O 2.8Å; R31-F43 WeakPolarHBondContact O-CA 3.48Å; R31-F43 VanDerWaalsContact O-CB 3.24Å; R31-F43 WeakPolarHBondContact O-CB 3.17Å; R31-F43 WeakPolarHBondContact O-CD2 3.25Å; R31-F43 PolarHBondContact O-N 3.3Å
32	Q	57.6	Low	59.1	Low	5 Å²	5	53.6 Å²	53.6	2%	0.023	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125	173	-176.1	166.2	93.4	0	0	108.6	V15 R17 C19 P40 L41 L42	V15-Q32 VanDerWaalsContact O-O 3.07Å; R17-Q32 HydrophobicContact CB-CB 4.17Å; R17-Q32 PolarHBondContact N-O 3.31Å; R17-Q32 PolarHBondContact O-N 2.03Å; R17-Q32 VanDerWaalsContact O-N 3.14Å; C19-Q32 PolarHBondContact SG-N 3.02Å; C19-Q32 VanDerWaalsContact SG-N 3.43Å; Q32-P40 HydrophobicContact CG-CB 3.92Å; Q32-L41 WeakPolarHBondContact CA-O 2.77Å; Q32-L42 HydrophobicContact CB-CD1 4.04Å; Q32-L42 HydrophobicContact CG-CD1 4.36Å
33	K	60.8	Low	59	Low	50 Å²	50	51.1 Å²	51.1	22%	0.217	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.5	176.5	-64.3	-136.2	-143.3	163.4	0	110.1	A14 L41 F43 P61	A14-K33 HydrophobicContact CB-CB 4.07Å; A14-K33 HydrophobicContact CB-CD 3.45Å; A14-K33 VanDerWaalsContact CB-CD 3.45Å; A14-K33 HydrophobicContact CB-CG 4.22Å; K33-L41 PolarHBondContact N-O 3.47Å; K33-L41 PolarHBondContact O-N 3.17Å; K33-F43 HydrophobicContact CB-CD2 4.3Å; K33-F43 HydrophobicContact CB-CE2 4.1Å; K33-F43 HydrophobicContact CG-CD2 4.38Å; K33-P61 HydrophobicContact CB-CB 4.16Å; K33-P61 HydrophobicContact CB-CG 3.53Å; K33-P61 HydrophobicContact CD-CG 3.25Å; K33-P61 VanDerWaalsContact CE-CG 3.44Å; K33-P61 HydrophobicContact CG-CB 4.43Å; K33-P61 HydrophobicContact CG-CG 3.56Å; K33-P61 VanDerWaalsContact NZ-CD 3.34Å
34	V	57.1	Low	58.9	Low	48 Å²	48	50.5 Å²	50.5	29%	0.291	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	115.3	173.7	-174.6	0	0	0	0	108.1	P40	V34-P40 HydrophobicContact CG2-CB 4.25Å
35	C	58	Low	58.8	Low	12 Å²	12	53.8 Å²	53.8	8%	0.081	33%	0.33	C	S	.	.			trans	-88.5	168.5	176.7	-64.4	0	0	0	0	111.2	S37 G38 S39 L41 C62	C35-S37 PolarHBondContact O-N 3.07Å; C35-G38 PolarHBondContact O-N 2.96Å; C35-S39 PolarHBondContact N-O 2.64Å; C35-L41 HydrophobicContact CB-CD1 4.42Å; C35-L41 VanDerWaalsContact SG-CD1 3.53Å; C35-C62 WeakPolarHBondContact CA-SG 3.25Å; C35-C62 HydrophobicContact CB-CB 3.73Å; C35-C62 WeakPolarHBondContact CB-SG 3.22Å; C35-C62 WeakPolarHBondContact SG-CA 3.28Å; C35-C62 WeakPolarHBondContact SG-CB 2.97Å; C35-C62 CovalentContact SG-SG 2.03Å; C35-C62 PolarHBondContact SG-SG 3.17Å
36	N	56	Low	58.6	Low	123 Å²	123	54.2 Å²	54.2	66%	0.658	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-18.5	-178	-163.2	27	0	0	0	113.8	T11 G38	T11-N36 HydrophobicContact CG2-CB 4.34Å; T11-N36 VanDerWaalsContact CG2-CG 3.47Å; T11-N36 VanDerWaalsContact CG2-ND2 3.29Å; T11-N36 WeakPolarHBondContact CG2-ND2 3.45Å; N36-G38 PolarHBondContact O-N 3.21Å
37	S	56	Low	58.1	Low	88 Å²	88	54.4 Å²	54.4	62%	0.615	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-6.1	170.1	56.2	0	0	0	0	114.1	C35 S39	C35-S37 PolarHBondContact O-N 3.07Å; S37-S39 PolarHBondContact O-N 3Å; S37-S39 VanDerWaalsContact O-N 3.12Å
38	G	53.8	Low	57.5	Low	53 Å²	53	54.8 Å²	54.8	55%	0.546	31%	0.31	S	S	.	.	S	Bend	trans	73.1	-9.4	-172.4	0	0	0	0	0	113.5	C35 N36 P40	C35-G38 PolarHBondContact O-N 2.96Å; N36-G38 PolarHBondContact O-N 3.21Å; G38-P40 WeakPolarHBondContact O-CD 3.49Å
39	S	55.2	Low	56.9	Low	56 Å²	56	60.7 Å²	60.7	39%	0.392	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-77.3	121.1	177.1	-53	0	0	0	0	109.8	C35 S37 L41	C35-S39 PolarHBondContact N-O 2.64Å; S37-S39 PolarHBondContact O-N 3Å; S37-S39 VanDerWaalsContact O-N 3.12Å; S39-L41 PolarHBondContact O-N 3.13Å
40	P	57.4	Low	56	Low	41 Å²	41	66.2 Å²	66.2	27%	0.266	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	116.8	167.9	27	-31.3	0	0	0	108.3	Q32 V34 G38 R79	Q32-P40 HydrophobicContact CG-CB 3.92Å; V34-P40 HydrophobicContact CG2-CB 4.25Å; G38-P40 WeakPolarHBondContact O-CD 3.49Å; P40-R79 HydrophobicContact CG-CB 4.05Å
41	L	60.3	Low	55	Low	33 Å²	33	70.1 Å²	70.1	17%	0.173	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	129.4	171.5	-65.5	-170.6	0	0	0	108.2	Q32 K33 C35 S39 F43 V76	Q32-L41 WeakPolarHBondContact CA-O 2.77Å; K33-L41 PolarHBondContact N-O 3.47Å; K33-L41 PolarHBondContact O-N 3.17Å; C35-L41 HydrophobicContact CB-CD1 4.42Å; C35-L41 VanDerWaalsContact SG-CD1 3.53Å; S39-L41 PolarHBondContact O-N 3.13Å; L41-F43 HydrophobicContact CB-CD2 4.44Å; L41-F43 HydrophobicContact CB-CE2 3.31Å; L41-F43 HydrophobicContact CB-CZ 3.58Å; L41-F43 HydrophobicContact CD1-CZ 4.06Å; L41-F43 HydrophobicContact CG-CZ 4.49Å; L41-F43 WeakPolarHBondContact O-CD2 3.08Å; L41-F43 VanDerWaalsContact O-CE2 3.25Å; L41-F43 WeakPolarHBondContact O-CE2 3.41Å; L41-V76 HydrophobicContact CB-CG1 3.99Å; L41-V76 HydrophobicContact CD1-CG1 3.98Å; L41-V76 HydrophobicContact CD2-CG1 3.63Å; L41-V76 HydrophobicContact CG-CG1 4.06Å
42	L	57.8	Low	54	Low	1 Å²	1	68.4 Å²	68.4	1%	0.005	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	136	175.9	-161.2	70.6	0	0	0	110.9	C19 D23 C30 Q32 V76 L82	C19-L42 HydrophobicContact CB-CD1 4.27Å; C19-L42 WeakPolarHBondContact SG-CD1 2.99Å; D23-L42 HydrophobicContact CB-CD1 4.11Å; D23-L42 HydrophobicContact CB-CD2 3.61Å; D23-L42 HydrophobicContact CB-CG 4.46Å; D23-L42 VanDerWaalsContact CG-CD1 3.48Å; D23-L42 WeakPolarHBondContact O-CD2 3.29Å; D23-L42 WeakPolarHBondContact OD1-CD1 3.49Å; D23-L42 WeakPolarHBondContact OD1-CD2 3.46Å; D23-L42 WeakPolarHBondContact OD2-CD2 3.49Å; C30-L42 WeakPolarHBondContact SG-CD1 2.92Å; Q32-L42 HydrophobicContact CB-CD1 4.04Å; Q32-L42 HydrophobicContact CG-CD1 4.36Å; L42-V76 WeakPolarHBondContact O-CA 3.03Å; L42-L82 HydrophobicContact CD2-CD1 3.79Å
43	F	61.1	Low	53.1	Low	17 Å²	17	70.8 Å²	70.8	8%	0.075	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	99.6	178.2	-63.7	-92.2	0	0	0	109	C30 R31 K33 L41 P61 I74 V76	C30-F43 CarbonylContact C-O 3.53Å; C30-F43 VanDerWaalsContact CA-O 3.27Å; C30-F43 WeakPolarHBondContact CA-O 3.22Å; R31-F43 HydrophobicContact CB-CB 4.43Å; R31-F43 PolarHBondContact N-O 2.8Å; R31-F43 WeakPolarHBondContact O-CA 3.48Å; R31-F43 VanDerWaalsContact O-CB 3.24Å; R31-F43 WeakPolarHBondContact O-CB 3.17Å; R31-F43 WeakPolarHBondContact O-CD2 3.25Å; R31-F43 PolarHBondContact O-N 3.3Å; K33-F43 HydrophobicContact CB-CD2 4.3Å; K33-F43 HydrophobicContact CB-CE2 4.1Å; K33-F43 HydrophobicContact CG-CD2 4.38Å; L41-F43 HydrophobicContact CB-CD2 4.44Å; L41-F43 HydrophobicContact CB-CE2 3.31Å; L41-F43 HydrophobicContact CB-CZ 3.58Å; L41-F43 HydrophobicContact CD1-CZ 4.06Å; L41-F43 HydrophobicContact CG-CZ 4.49Å; L41-F43 WeakPolarHBondContact O-CD2 3.08Å; L41-F43 VanDerWaalsContact O-CE2 3.25Å; L41-F43 WeakPolarHBondContact O-CE2 3.41Å; F43-P61 HydrophobicContact CD1-CB 3.81Å; F43-P61 HydrophobicContact CD2-CB 3.78Å; F43-P61 HydrophobicContact CD2-CG 4.48Å; F43-P61 HydrophobicContact CE1-CB 3.19Å; F43-P61 HydrophobicContact CE2-CB 3.09Å; F43-P61 HydrophobicContact CE2-CG 4.04Å; F43-P61 HydrophobicContact CG-CB 4.15Å; F43-P61 HydrophobicContact CZ-CB 2.85Å; F43-P61 HydrophobicContact CZ-CG 4.18Å; F43-I74 HydrophobicContact CB-CG2 4.31Å; F43-I74 HydrophobicContact CD1-CB 4.39Å; F43-I74 HydrophobicContact CD1-CD1 4.13Å; F43-I74 HydrophobicContact CD1-CG1 4.46Å; F43-I74 HydrophobicContact CD1-CG2 3.14Å; F43-I74 HydrophobicContact CE1-CG2 3.49Å; F43-I74 VanDerWaalsContact CE1-CG2 3.49Å; F43-I74 HydrophobicContact CG-CG2 4.09Å; F43-V76 HydrophobicContact CD1-CG2 4.43Å; F43-V76 HydrophobicContact CE1-CG2 3.62Å; F43-V76 HydrophobicContact CZ-CG1 4.36Å; F43-V76 HydrophobicContact CZ-CG2 3.92Å
44	C	58.2	Low	52.4	Low	6 Å²	6	74.9 Å²	74.9	4%	0.041	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	108.8	166.8	-56.7	0	0	0	0	109.1	C24 M28	C24-C44 WeakPolarHBondContact CA-SG 2.82Å; C24-C44 HydrophobicContact CB-CB 3.82Å; C24-C44 WeakPolarHBondContact CB-SG 3.13Å; C24-C44 WeakPolarHBondContact SG-CA 3.37Å; C24-C44 WeakPolarHBondContact SG-CB 3.43Å; C24-C44 CovalentContact SG-SG 2Å; C24-C44 PolarHBondContact SG-SG 2.76Å; M28-C44 HydrophobicContact CB-CB 4.47Å; M28-C44 HydrophobicContact SD-CB 3.78Å
45	Q	57.8	Low	51.5	Low	88 Å²	88	76.3 Å²	76.3	41%	0.411	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.8	170.4	-172.1	175.5	1	0	0	108.8	M28 A29 Q47	M28-Q45 CarbonylContact C-O 3.56Å; M28-Q45 WeakPolarHBondContact CA-O 3.45Å; M28-Q45 WeakPolarHBondContact CB-O 3.4Å; A29-Q45 PolarHBondContact N-O 3.49Å; A29-Q45 PolarHBondContact O-N 3.48Å; Q45-Q47 PolarHBondContact O-N 3.1Å; Q45-Q47 VanDerWaalsContact O-N 3.11Å
46	L	54.1	Low	50.7	Low	82 Å²	82	77.5 Å²	77.5	43%	0.429	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	118.1	173.5	-170.2	68.7	0	0	0	109.4	M28 S48	M28-L46 HydrophobicContact CE-CD1 3.78Å; M28-L46 HydrophobicContact CG-CB 4.49Å; M28-L46 HydrophobicContact CG-CD1 3.89Å; L46-S48 VanDerWaalsContact CD2-OG 3.31Å; L46-S48 WeakPolarHBondContact CD2-OG 3.48Å; L46-S48 PolarHBondContact O-N 2.8Å
47	Q	53.4	Low	50	Low	135 Å²	135	81.7 Å²	81.7	63%	0.631	46%	0.464	S	S	*	.			trans	-74.4	68.3	168	-79	179.2	-51.5	0	0	107.5	G27 A29 Q45 D49	G27-Q47 WeakPolarHBondContact O-CB 3.25Å; G27-Q47 PolarHBondContact O-N 3.36Å; A29-Q47 HydrophobicContact CB-CG 3.63Å; Q45-Q47 PolarHBondContact O-N 3.1Å; Q45-Q47 VanDerWaalsContact O-N 3.11Å; Q47-D49 PolarHBondContact O-N 1.98Å; Q47-D49 VanDerWaalsContact O-N 3.12Å
48	S	48	Very low	49.5	Very low	55 Å²	55	83.6 Å²	83.6	39%	0.385	47%	0.474	S	S	.	.			trans	-67.8	111.4	162.5	-69	0	0	0	0	106.9	L46 Q50	L46-S48 VanDerWaalsContact CD2-OG 3.31Å; L46-S48 WeakPolarHBondContact CD2-OG 3.48Å; L46-S48 PolarHBondContact O-N 2.8Å; S48-Q50 CarbonylContact O-C 3.39Å; S48-Q50 PolarHBondContact O-N 3.22Å
49	D	48	Very low	49.3	Very low	167 Å²	167	83.4 Å²	83.4	89%	0.893	46%	0.463	S	S	*	.	S	Bend	trans	-50.6	-11.6	166.9	-170.8	-107	0	0	0	112.9	Q47 T51	Q47-D49 PolarHBondContact O-N 1.98Å; Q47-D49 VanDerWaalsContact O-N 3.12Å; D49-T51 PolarHBondContact O-N 3.48Å
50	Q	42.7	Very low	49.2	Very low	153 Å²	153	83.7 Å²	83.7	72%	0.715	46%	0.46	S	S	*	.	S	Bend	trans	-83.3	99.6	169.2	-66	-155.1	-9.8	0	0	112.1	S48 R72	S48-Q50 CarbonylContact O-C 3.39Å; S48-Q50 PolarHBondContact O-N 3.22Å; Q50-R72 PolarHBondContact O-NH1 2.83Å; Q50-R72 VanDerWaalsContact O-NH1 3.13Å; Q50-R72 PolarHBondContact O-NH2 3.01Å
51	T	39.6	Very low	49	Very low	112 Å²	112	82.1 Å²	82.1	69%	0.687	45%	0.449	S	S	*	.			trans	52.3	90.4	139	-51.2	0	0	0	0	112.9	D49 P53 R72	D49-T51 PolarHBondContact O-N 3.48Å; T51-P53 WeakPolarHBondContact O-CD 3.27Å; T51-P53 VanDerWaalsContact O-N 3.08Å; T51-R72 PolarHBondContact O-NH2 3.11Å
52	D	41.2	Very low	48.6	Very low	111 Å²	111	82.5 Å²	82.5	59%	0.594	45%	0.454	S	S	*	.			trans	-47.9	111	150.4	-110.4	-99.9	0	0	0	107.7
53	P	38.3	Very low	48.3	Very low	56 Å²	56	85 Å²	85	36%	0.364	48%	0.48	S	S	.	.			trans	-62.3	133.6	153.7	28.3	-30.6	0	0	0	105.3	T51 S55 A56 R72	T51-P53 WeakPolarHBondContact O-CD 3.27Å; T51-P53 VanDerWaalsContact O-N 3.08Å; P53-S55 PolarHBondContact O-N 3.43Å; P53-A56 WeakPolarHBondContact O-CB 3.24Å; P53-A56 PolarHBondContact O-N 3.31Å; P53-R72 VanDerWaalsContact CD-NH2 3.26Å
54	P	46	Very low	47.8	Very low	135 Å²	135	85.5 Å²	85.5	88%	0.877	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-6.2	177	23.2	-34.1	0	0	0	113.7
55	S	38.8	Very low	47	Very low	79 Å²	79	95 Å²	95	55%	0.552	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-7.6	173.1	-49.7	0	0	0	0	114.7	P53 R57	P53-S55 PolarHBondContact O-N 3.43Å; S55-R57 PolarHBondContact O-N 3.14Å
56	A	41.2	Very low	46.3	Very low	36 Å²	36	96.5 Å²	96.5	30%	0.298	54%	0.54	S	S	.	.			trans	-67.7	82.2	174.3	0	0	0	0	0	109	P53	P53-A56 WeakPolarHBondContact O-CB 3.24Å; P53-A56 PolarHBondContact O-N 3.31Å
57	R	41.5	Very low	45.5	Very low	212 Å²	212	100 Å²	100	80%	0.8	56%	0.559	S	S	*	*			trans	-63.3	135.7	176.9	-71.1	-176.7	173.2	-117.8	-2.3	107.6	S55 V59	S55-R57 PolarHBondContact O-N 3.14Å; R57-V59 PolarHBondContact O-N 2.93Å
58	P	45.5	Very low	44.7	Very low	127 Å²	127	96.1 Å²	96.1	83%	0.825	55%	0.547	S	S	*	.			trans	-57.6	106.6	171.3	24.3	-32	0	0	0	107.1	D60	P58-D60 PolarHBondContact O-N 3.38Å
59	V	49.5	Very low	44	Very low	50 Å²	50	99.7 Å²	99.7	30%	0.303	57%	0.572	S	S	.	*			trans	-69	119.7	175.8	-78.4	0	0	0	0	106.7	R57 P61 A64 I71 I74	R57-V59 PolarHBondContact O-N 2.93Å; V59-P61 WeakPolarHBondContact O-CD 3.28Å; V59-P61 VanDerWaalsContact O-N 3.14Å; V59-A64 HydrophobicContact CB-CB 4.48Å; V59-I71 HydrophobicContact CG1-CG1 4.1Å; V59-I74 HydrophobicContact CB-CD1 4.44Å; V59-I74 HydrophobicContact CG2-CD1 3.19Å
60	D	52.1	Low	43.4	Very low	62 Å²	62	96.7 Å²	96.7	33%	0.332	56%	0.556	S	S	.	*			trans	-64.9	115.3	173.3	-173.4	-77	0	0	0	106.6	N12 P58 C62 G63 A64	N12-D60 PolarHBondContact ND2-OD1 2Å; N12-D60 VanDerWaalsContact ND2-OD1 3.17Å; N12-D60 PolarHBondContact ND2-OD2 2.95Å; N12-D60 VanDerWaalsContact ND2-OD2 3.13Å; P58-D60 PolarHBondContact O-N 3.38Å; D60-C62 PolarHBondContact O-N 3.04Å; D60-C62 WeakPolarHBondContact OD1-CA 3.34Å; D60-C62 WeakPolarHBondContact OD1-CB 3.39Å; D60-C62 PolarHBondContact OD1-N 2.86Å; D60-G63 CarbonylContact O-C 3.29Å; D60-G63 VanDerWaalsContact O-C 3.29Å; D60-G63 PolarHBondContact O-N 3.22Å; D60-G63 PolarHBondContact OD1-N 3.07Å; D60-A64 VanDerWaalsContact O-CA 3.25Å; D60-A64 WeakPolarHBondContact O-CA 3.39Å; D60-A64 WeakPolarHBondContact O-CB 3.22Å; D60-A64 PolarHBondContact O-N 3.11Å
61	P	53	Low	43.3	Very low	7 Å²	7	91 Å²	91	5%	0.045	53%	0.529	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-28.3	-173.3	20.1	-30.4	0	0	0	114	K33 F43 V59	K33-P61 HydrophobicContact CB-CB 4.16Å; K33-P61 HydrophobicContact CB-CG 3.53Å; K33-P61 HydrophobicContact CD-CG 3.25Å; K33-P61 VanDerWaalsContact CE-CG 3.44Å; K33-P61 HydrophobicContact CG-CB 4.43Å; K33-P61 HydrophobicContact CG-CG 3.56Å; K33-P61 VanDerWaalsContact NZ-CD 3.34Å; F43-P61 HydrophobicContact CD1-CB 3.81Å; F43-P61 HydrophobicContact CD2-CB 3.78Å; F43-P61 HydrophobicContact CD2-CG 4.48Å; F43-P61 HydrophobicContact CE1-CB 3.19Å; F43-P61 HydrophobicContact CE2-CB 3.09Å; F43-P61 HydrophobicContact CE2-CG 4.04Å; F43-P61 HydrophobicContact CG-CB 4.15Å; F43-P61 HydrophobicContact CZ-CB 2.85Å; F43-P61 HydrophobicContact CZ-CG 4.18Å; V59-P61 WeakPolarHBondContact O-CD 3.28Å; V59-P61 VanDerWaalsContact O-N 3.14Å
62	C	53.3	Low	43.5	Very low	42 Å²	42	89.7 Å²	89.7	28%	0.284	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-24.8	179.1	-53.8	0	0	0	0	111.4	C35 D60	C35-C62 WeakPolarHBondContact CA-SG 3.25Å; C35-C62 HydrophobicContact CB-CB 3.73Å; C35-C62 WeakPolarHBondContact CB-SG 3.22Å; C35-C62 WeakPolarHBondContact SG-CA 3.28Å; C35-C62 WeakPolarHBondContact SG-CB 2.97Å; C35-C62 CovalentContact SG-SG 2.03Å; C35-C62 PolarHBondContact SG-SG 3.17Å; D60-C62 PolarHBondContact O-N 3.04Å; D60-C62 WeakPolarHBondContact OD1-CA 3.34Å; D60-C62 WeakPolarHBondContact OD1-CB 3.39Å; D60-C62 PolarHBondContact OD1-N 2.86Å
63	G	51.2	Low	43.6	Very low	52 Å²	52	89.9 Å²	89.9	54%	0.536	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	0.8	172.2	0	0	0	0	0	114.7	D60 R65	D60-G63 CarbonylContact O-C 3.29Å; D60-G63 VanDerWaalsContact O-C 3.29Å; D60-G63 PolarHBondContact O-N 3.22Å; D60-G63 PolarHBondContact OD1-N 3.07Å; G63-R65 VanDerWaalsContact C-N 3.32Å; G63-R65 PolarHBondContact O-N 2.72Å
64	A	50.3	Low	44	Very low	28 Å²	28	88.9 Å²	88.9	23%	0.231	50%	0.503	C	S	.	.			trans	-69.9	93.2	-172.3	0	0	0	0	0	107.4	V59 D60 P66	V59-A64 HydrophobicContact CB-CB 4.48Å; D60-A64 VanDerWaalsContact O-CA 3.25Å; D60-A64 WeakPolarHBondContact O-CA 3.39Å; D60-A64 WeakPolarHBondContact O-CB 3.22Å; D60-A64 PolarHBondContact O-N 3.11Å; A64-P66 VanDerWaalsContact O-CD 3.22Å; A64-P66 WeakPolarHBondContact O-CD 3.21Å
65	R	41.3	Very low	44.2	Very low	206 Å²	206	87.6 Å²	87.6	78%	0.777	48%	0.484	S	S	*	.			trans	-62.4	117.9	162.7	-78.7	176.3	139.1	-146.2	-3.6	105.7	G63 N67 S68 I71	G63-R65 VanDerWaalsContact C-N 3.32Å; G63-R65 PolarHBondContact O-N 2.72Å; R65-N67 PolarHBondContact O-N 2.9Å; R65-S68 PolarHBondContact O-N 2.82Å; R65-I71 VanDerWaalsContact O-CD1 3.28Å; R65-I71 WeakPolarHBondContact O-CD1 3.42Å
66	P	43.1	Very low	44.7	Very low	120 Å²	120	87 Å²	87	78%	0.779	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-1.2	-178.8	22.9	-32.7	0	0	0	114	A64	A64-P66 VanDerWaalsContact O-CD 3.22Å; A64-P66 WeakPolarHBondContact O-CD 3.21Å
67	N	37.9	Very low	45.1	Very low	154 Å²	154	87.5 Å²	87.5	82%	0.824	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	9.6	-178.2	-95.7	-23.1	0	0	0	115.3	R65	R65-N67 PolarHBondContact O-N 2.9Å
68	S	35.3	Very low	45.5	Very low	55 Å²	55	79.9 Å²	79.9	39%	0.385	45%	0.454	S	S	.	.			trans	-86.7	115.7	169.7	-146.7	0	0	0	0	108.9	R65 D70 I71	R65-S68 PolarHBondContact O-N 2.82Å; S68-D70 PolarHBondContact O-N 2.93Å; S68-D70 PolarHBondContact OG-OD2 3.37Å; S68-I71 WeakPolarHBondContact O-CB 3.31Å; S68-I71 VanDerWaalsContact O-CG1 3.28Å; S68-I71 WeakPolarHBondContact O-CG1 3.46Å; S68-I71 PolarHBondContact O-N 2.75Å
69	S	34	Very low	45.7	Very low	129 Å²	129	77.5 Å²	77.5	90%	0.902	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-8.6	176.5	-50.2	0	0	0	0	114.4	I71	S69-I71 VanDerWaalsContact C-N 3.3Å
70	D	35.5	Very low	45.7	Very low	105 Å²	105	82.3 Å²	82.3	56%	0.561	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-8.9	171.6	-58.7	-85.1	0	0	0	113.9	S68 R72	S68-D70 PolarHBondContact O-N 2.93Å; S68-D70 PolarHBondContact OG-OD2 3.37Å; D70-R72 PolarHBondContact O-N 3.48Å
71	I	41.4	Very low	45.6	Very low	32 Å²	32	86.2 Å²	86.2	16%	0.164	47%	0.469	C	S	.	.			trans	-74.4	95.6	178.2	-64.6	165.2	0	0	0	107	V59 R65 S68 S69 I73 I74	V59-I71 HydrophobicContact CG1-CG1 4.1Å; R65-I71 VanDerWaalsContact O-CD1 3.28Å; R65-I71 WeakPolarHBondContact O-CD1 3.42Å; S68-I71 WeakPolarHBondContact O-CB 3.31Å; S68-I71 VanDerWaalsContact O-CG1 3.28Å; S68-I71 WeakPolarHBondContact O-CG1 3.46Å; S68-I71 PolarHBondContact O-N 2.75Å; S69-I71 VanDerWaalsContact C-N 3.3Å; I71-I73 PolarHBondContact O-N 2.84Å; I71-I74 HydrophobicContact CG2-CB 3.74Å; I71-I74 HydrophobicContact CG2-CD1 3.83Å; I71-I74 HydrophobicContact CG2-CG1 3.69Å
72	R	42.9	Very low	45.5	Very low	86 Å²	86	88.8 Å²	88.8	33%	0.325	48%	0.482	S	S	.	.			trans	-56	89.8	158	-70.2	-171	-179.6	-155.2	-0.2	106.8	Q50 T51 P53 D70 I74	Q50-R72 PolarHBondContact O-NH1 2.83Å; Q50-R72 VanDerWaalsContact O-NH1 3.13Å; Q50-R72 PolarHBondContact O-NH2 3.01Å; T51-R72 PolarHBondContact O-NH2 3.11Å; P53-R72 VanDerWaalsContact CD-NH2 3.26Å; D70-R72 PolarHBondContact O-N 3.48Å; R72-I74 PolarHBondContact O-N 2.93Å; R72-I74 VanDerWaalsContact O-N 3.07Å
73	I	43.1	Very low	45.2	Very low	115 Å²	115	97.5 Å²	97.5	59%	0.59	51%	0.509	S	S	*	.			trans	9.7	82.2	179.4	-43.5	174.5	0	0	0	112.5	I71 F75	I71-I73 PolarHBondContact O-N 2.84Å; I73-F75 HydrophobicContact CB-CE2 4.13Å; I73-F75 HydrophobicContact CG2-CD1 4.43Å; I73-F75 HydrophobicContact CG2-CD2 3.8Å; I73-F75 HydrophobicContact CG2-CE1 3.95Å; I73-F75 HydrophobicContact CG2-CE2 3.25Å; I73-F75 HydrophobicContact CG2-CG 4.37Å; I73-F75 HydrophobicContact CG2-CZ 3.34Å; I73-F75 PolarHBondContact O-N 2.75Å
74	I	48.2	Very low	44.9	Very low	34 Å²	34	103.2 Å²	103.2	17%	0.174	54%	0.541	C	S	.	.			trans	-82.1	106.8	168.6	-67.1	170	0	0	0	106.1	F43 V59 I71 R72 V76	F43-I74 HydrophobicContact CB-CG2 4.31Å; F43-I74 HydrophobicContact CD1-CB 4.39Å; F43-I74 HydrophobicContact CD1-CD1 4.13Å; F43-I74 HydrophobicContact CD1-CG1 4.46Å; F43-I74 HydrophobicContact CD1-CG2 3.14Å; F43-I74 HydrophobicContact CE1-CG2 3.49Å; F43-I74 VanDerWaalsContact CE1-CG2 3.49Å; F43-I74 HydrophobicContact CG-CG2 4.09Å; V59-I74 HydrophobicContact CB-CD1 4.44Å; V59-I74 HydrophobicContact CG2-CD1 3.19Å; I71-I74 HydrophobicContact CG2-CB 3.74Å; I71-I74 HydrophobicContact CG2-CD1 3.83Å; I71-I74 HydrophobicContact CG2-CG1 3.69Å; R72-I74 PolarHBondContact O-N 2.93Å; R72-I74 VanDerWaalsContact O-N 3.07Å; I74-V76 HydrophobicContact CG2-CG2 3.5Å; I74-V76 VanDerWaalsContact CG2-CG2 3.5Å; I74-V76 PolarHBondContact O-N 3.12Å; I74-V76 VanDerWaalsContact O-N 3.17Å
75	F	48.7	Very low	44.6	Very low	109 Å²	109	107 Å²	107	48%	0.478	56%	0.556	S	S	.	*	B	Isolated β-bridge	trans	-74.6	102.7	164.5	-65.4	-82.4	0	0	0	107.7	I73 T77	I73-F75 HydrophobicContact CB-CE2 4.13Å; I73-F75 HydrophobicContact CG2-CD1 4.43Å; I73-F75 HydrophobicContact CG2-CD2 3.8Å; I73-F75 HydrophobicContact CG2-CE1 3.95Å; I73-F75 HydrophobicContact CG2-CE2 3.25Å; I73-F75 HydrophobicContact CG2-CG 4.37Å; I73-F75 HydrophobicContact CG2-CZ 3.34Å; I73-F75 PolarHBondContact O-N 2.75Å; F75-T77 PolarHBondContact O-N 3.48Å
76	V	49.4	Very low	44.8	Very low	65 Å²	65	101.8 Å²	101.8	39%	0.394	55%	0.545	S	S	.	.			trans	-89.8	91.5	169.9	-175	0	0	0	0	107.5	L41 L42 F43 I74	L41-V76 HydrophobicContact CB-CG1 3.99Å; L41-V76 HydrophobicContact CD1-CG1 3.98Å; L41-V76 HydrophobicContact CD2-CG1 3.63Å; L41-V76 HydrophobicContact CG-CG1 4.06Å; L42-V76 WeakPolarHBondContact O-CA 3.03Å; F43-V76 HydrophobicContact CD1-CG2 4.43Å; F43-V76 HydrophobicContact CE1-CG2 3.62Å; F43-V76 HydrophobicContact CZ-CG1 4.36Å; F43-V76 HydrophobicContact CZ-CG2 3.92Å; I74-V76 HydrophobicContact CG2-CG2 3.5Å; I74-V76 VanDerWaalsContact CG2-CG2 3.5Å; I74-V76 PolarHBondContact O-N 3.12Å; I74-V76 VanDerWaalsContact O-N 3.17Å
77	T	50.8	Low	44.9	Very low	47 Å²	47	100.8 Å²	100.8	29%	0.288	53%	0.532	S	S	.	.			trans	-99.6	131.6	172	-42.7	0	0	0	0	108.1	F75 R79 E81 L82	F75-T77 PolarHBondContact O-N 3.48Å; T77-R79 PolarHBondContact O-N 2.8Å; T77-E81 HydrophobicContact CG2-CB 4.13Å; T77-L82 HydrophobicContact CG2-CD1 3.83Å; T77-L82 HydrophobicContact CG2-CG 4.11Å
78	P	49.3	Very low	45.3	Very low	52 Å²	52	97.6 Å²	97.6	34%	0.338	52%	0.515	S	S	.	.	B	Isolated β-bridge	trans	-59.4	130.2	167.5	-7.7	19.2	0	0	0	108	D80 E81	P78-D80 PolarHBondContact O-N 3.13Å; P78-E81 HydrophobicContact CG-CG 4.4Å; P78-E81 PolarHBondContact O-N 2.9Å
79	R	48.9	Very low	45.9	Very low	78 Å²	78	100.3 Å²	100.3	29%	0.294	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-26.4	-178.8	-160.3	-171.6	-178.4	163.3	-7.6	113	P40 T77 E81 L82	P40-R79 HydrophobicContact CG-CB 4.05Å; T77-R79 PolarHBondContact O-N 2.8Å; R79-E81 VanDerWaalsContact C-N 3.31Å; R79-E81 PolarHBondContact O-N 2.77Å; R79-L82 PolarHBondContact O-N 3.26Å
80	D	49.8	Very low	46.7	Very low	151 Å²	151	98.4 Å²	98.4	81%	0.807	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-35.9	176.6	-133.8	-103.6	0	0	0	112.3	P78	P78-D80 PolarHBondContact O-N 3.13Å
81	E	50.8	Low	47.5	Very low	144 Å²	144	97.9 Å²	97.9	67%	0.673	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-77.5	-21.8	178.4	-73.7	-163.2	90.2	0	0	113.4	T77 P78 R79 R83	T77-E81 HydrophobicContact CG2-CB 4.13Å; P78-E81 HydrophobicContact CG-CG 4.4Å; P78-E81 PolarHBondContact O-N 2.9Å; R79-E81 VanDerWaalsContact C-N 3.31Å; R79-E81 PolarHBondContact O-N 2.77Å; E81-R83 VanDerWaalsContact C-N 3.27Å; E81-R83 PolarHBondContact O-N 2.86Å
82	L	50.3	Low	48	Very low	61 Å²	61	103 Å²	103	32%	0.319	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-73.7	-14.2	177.7	-93	133.4	0	0	0	113.8	L42 T77 R79	L42-L82 HydrophobicContact CD2-CD1 3.79Å; T77-L82 HydrophobicContact CG2-CD1 3.83Å; T77-L82 HydrophobicContact CG2-CG 4.11Å; R79-L82 PolarHBondContact O-N 3.26Å
83	R	47.7	Very low	48.4	Very low	224 Å²	224	104.4 Å²	104.4	85%	0.845	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-93.5	10.4	-175.9	-63.4	-172.5	90.1	-168	7	114.8	E81	E81-R83 VanDerWaalsContact C-N 3.27Å; E81-R83 PolarHBondContact O-N 2.86Å
84	S	44.3	Very low	48.9	Very low	173 Å²	173	103.5 Å²	103.5	100%	1.21	53%	0.529	S	S	*	.			trans	-91.6	0	176	-166.1	0	0	0	0	113.1

Retrieved 84 of 84 residues in 20.7 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).