A0A077Z880_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z880, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 113 aa.

						>A0A077Z880_TRITR|A0A077Z880
MVMADPDNLILLGCIVAMPYDEALTTSLKLDGHKFMTRGWLKLHKMKPKYLNDYVHLKEDVLCSLCPKIVKIVPEVLINRKVRQFTIYSFLNLEEEEEEEEEEEEEEEEEEEE
					

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(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	28.4	Very low	27.1	Very low	226 Å²	226	143.8 Å²	143.8	100%	1.113	79%	0.794	S	S	*	*				0	94.6	0	-163.8	173.3	-179.8	0	0	106.6
2	V	23.8	Very low	26.9	Very low	145 Å²	145	144.2 Å²	144.2	88%	0.879	79%	0.792	S	S	*	*			trans	-94.4	107.6	179.7	-179	0	0	0	0	106
3	M	23.2	Very low	26.7	Very low	167 Å²	167	138.2 Å²	138.2	82%	0.823	79%	0.785	S	S	*	*			trans	-85.3	107.5	173.1	-63.7	-162.9	-56.6	0	0	107.3
4	A	26.3	Very low	26.8	Very low	91 Å²	91	134.6 Å²	134.6	75%	0.752	77%	0.77	S	S	*	*			trans	-81.5	127	168.1	0	0	0	0	0	108.6
5	D	27.3	Very low	26.9	Very low	89 Å²	89	136.3 Å²	136.3	48%	0.476	77%	0.774	S	S	.	*			trans	-65.8	124.4	-178.5	-176.1	-5	0	0	0	110.9	D7 N8	D5-D7 PolarHBondContact O-N 3.5Å; D5-D7 VanDerWaalsContact O-N 3.07Å; D5-D7 PolarHBondContact OD1-N 3.45Å; D5-N8 HydrophobicContact CB-CB 4.48Å; D5-N8 PolarHBondContact O-N 2.59Å; D5-N8 PolarHBondContact OD2-ND2 2.98Å; D5-N8 VanDerWaalsContact OD2-ND2 3.07Å
6	P	31.9	Very low	27	Very low	123 Å²	123	134.4 Å²	134.4	80%	0.799	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-6.8	-173.7	25	-33.8	0	0	0	115.5
7	D	33.4	Very low	26.9	Very low	148 Å²	148	132.1 Å²	132.1	79%	0.791	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	1.4	177.6	-68.6	-39.9	0	0	0	114	D5	D5-D7 PolarHBondContact O-N 3.5Å; D5-D7 VanDerWaalsContact O-N 3.07Å; D5-D7 PolarHBondContact OD1-N 3.45Å
8	N	25.4	Very low	26.9	Very low	114 Å²	114	129.7 Å²	129.7	61%	0.61	75%	0.749	S	S	*	*			trans	-129.3	90.6	-176.8	-76.2	-58.6	0	0	0	112.3	D5	D5-N8 HydrophobicContact CB-CB 4.48Å; D5-N8 PolarHBondContact O-N 2.59Å; D5-N8 PolarHBondContact OD2-ND2 2.98Å; D5-N8 VanDerWaalsContact OD2-ND2 3.07Å
9	L	28.6	Very low	26.9	Very low	158 Å²	158	129 Å²	129	83%	0.827	75%	0.749	S	S	*	*			trans	-111.6	124.3	163.5	-91.3	160.6	0	0	0	110.4
10	I	25.9	Very low	27	Very low	158 Å²	158	132.1 Å²	132.1	81%	0.81	75%	0.749	S	S	*	*			trans	-70.4	136.6	-168.5	-67.9	167.2	0	0	0	111.4
11	L	24.5	Very low	27.2	Very low	163 Å²	163	134.2 Å²	134.2	85%	0.853	76%	0.759	S	S	*	*			trans	-57.6	128.6	169.1	-96.7	103.6	0	0	0	111.7
12	L	24.9	Very low	27.4	Very low	148 Å²	148	130.6 Å²	130.6	78%	0.775	74%	0.739	S	S	*	*			trans	-144.2	118.5	147.2	-91.2	162.3	0	0	0	107.5
13	G	24.2	Very low	27.9	Very low	67 Å²	67	127.5 Å²	127.5	69%	0.691	73%	0.728	S	S	*	*			trans	-86.1	160.3	-174.6	0	0	0	0	0	113.3
14	C	27.1	Very low	28.3	Very low	87 Å²	87	122.7 Å²	122.7	59%	0.588	71%	0.706	S	S	*	*			trans	-145.1	125.1	155.6	-94.6	0	0	0	0	109.1
15	I	28.4	Very low	28.8	Very low	160 Å²	160	123.6 Å²	123.6	82%	0.821	70%	0.702	S	S	*	*			trans	-94.9	127.7	168.5	-68.2	169	0	0	0	105.4	A17	I15-A17 PolarHBondContact O-N 3.43Å
16	V	28.8	Very low	29.3	Very low	107 Å²	107	121.6 Å²	121.6	65%	0.648	69%	0.693	S	S	*	*			trans	-74.7	110	166.5	177.7	0	0	0	0	107.2	M18	V16-M18 HydrophobicContact CG1-CG 4.29Å; V16-M18 PolarHBondContact O-N 3.2Å
17	A	25.9	Very low	29.5	Very low	95 Å²	95	119.1 Å²	119.1	79%	0.785	68%	0.679	S	S	*	*			trans	-71.5	112.8	167.5	0	0	0	0	0	108.6	I15	I15-A17 PolarHBondContact O-N 3.43Å
18	M	27.3	Very low	29.7	Very low	88 Å²	88	113.5 Å²	113.5	43%	0.433	65%	0.648	S	S	.	*			trans	-111	144.7	156	-67.1	-155.1	-56.8	0	0	107.6	V16 Y20 L65	V16-M18 HydrophobicContact CG1-CG 4.29Å; V16-M18 PolarHBondContact O-N 3.2Å; M18-Y20 PolarHBondContact O-N 3.27Å; M18-L65 HydrophobicContact CE-CD1 4.4Å
19	P	26.4	Very low	30.2	Very low	117 Å²	117	114.8 Å²	114.8	76%	0.76	65%	0.649	S	S	*	*	S	Bend	trans	-74.4	29.9	178.5	29.6	-32.4	0	0	0	113.7
20	Y	29.1	Very low	30.8	Very low	190 Å²	190	108.9 Å²	108.9	75%	0.745	62%	0.618	S	S	*	*	S	Bend	trans	-144.9	128.1	179.3	-62.7	-77	0	0	0	110.9	M18 E22	M18-Y20 PolarHBondContact O-N 3.27Å; Y20-E22 PolarHBondContact O-N 3.48Å
21	D	30.2	Very low	31.4	Very low	178 Å²	178	105.7 Å²	105.7	95%	0.952	60%	0.602	S	S	*	*	S	Bend	trans	-69.5	36.9	-167.7	-123.5	-16.2	0	0	0	115.4
22	E	32.1	Very low	32.2	Very low	150 Å²	150	100.7 Å²	100.7	70%	0.701	59%	0.59	S	S	*	*			trans	-126.4	97.7	-176.2	-68.2	-169.6	174.8	0	0	112.6	Y20 L24	Y20-E22 PolarHBondContact O-N 3.48Å; E22-L24 PolarHBondContact O-N 3.23Å
23	A	35.9	Very low	32.8	Very low	79 Å²	79	97.3 Å²	97.3	65%	0.653	57%	0.57	S	S	*	*			trans	-66.4	91	171.1	0	0	0	0	0	110.9	T25	A23-T25 PolarHBondContact O-N 3.29Å
24	L	31.8	Very low	33.6	Very low	66 Å²	66	101 Å²	101	35%	0.346	57%	0.567	S	S	.	*			trans	-71.9	115.8	175.1	-75.2	157.2	0	0	0	110.5	E22 G39 W40 L65	E22-L24 PolarHBondContact O-N 3.23Å; L24-G39 PolarHBondContact O-N 3.37Å; L24-W40 HydrophobicContact CB-CZ2 4.32Å; L24-W40 HydrophobicContact CD1-CZ2 3.88Å; L24-W40 HydrophobicContact CD2-CZ2 3.95Å; L24-W40 HydrophobicContact CG-CZ2 4.25Å; L24-L65 HydrophobicContact CD1-CD1 3.89Å
25	T	36.1	Very low	34.3	Very low	110 Å²	110	97.3 Å²	97.3	68%	0.675	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	124.6	176.2	-33.4	0	0	0	0	108.1	A23	A23-T25 PolarHBondContact O-N 3.29Å
26	T	37.5	Very low	34.8	Very low	47 Å²	47	97.4 Å²	97.4	29%	0.288	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	160	171.2	-169.9	0	0	0	0	111.7	T37 G39	T26-T37 WeakPolarHBondContact CG2-OG1 3.49Å; T26-T37 PolarHBondContact N-O 3.2Å; T26-T37 PolarHBondContact O-N 3.16Å; T26-T37 PolarHBondContact O-OG1 2.88Å; T26-G39 WeakPolarHBondContact CG2-O 3.41Å
27	S	35.8	Very low	35.4	Very low	71 Å²	71	93.1 Å²	93.1	50%	0.497	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	119	-176.8	67	0	0	0	0	111.1	F35	S27-F35 CarbonylContact C-O 3.52Å; S27-F35 WeakPolarHBondContact CA-O 3Å
28	L	38.2	Very low	36.1	Very low	30 Å²	30	99.3 Å²	99.3	16%	0.157	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	137.6	163.7	170.2	73.5	0	0	0	108.8	K34 F35 T37 L43 F85	L28-K34 CarbonylContact O-C 3.49Å; L28-K34 WeakPolarHBondContact O-CA 3.47Å; L28-F35 HydrophobicContact CB-CB 4.02Å; L28-F35 HydrophobicContact CD2-CB 4.4Å; L28-F35 HydrophobicContact CD2-CG 4.48Å; L28-F35 HydrophobicContact CG-CB 4.47Å; L28-F35 PolarHBondContact N-O 3.49Å; L28-F35 PolarHBondContact O-N 3.31Å; L28-T37 HydrophobicContact CB-CG2 4.12Å; L28-L43 HydrophobicContact CD1-CD1 3.3Å; L28-L43 HydrophobicContact CD1-CG 4.46Å; L28-F85 HydrophobicContact CB-CE1 3.94Å; L28-F85 HydrophobicContact CB-CZ 4.32Å; L28-F85 HydrophobicContact CD2-CD1 3.81Å; L28-F85 HydrophobicContact CD2-CE1 3.21Å; L28-F85 HydrophobicContact CD2-CZ 3.72Å; L28-F85 HydrophobicContact CG-CE1 4.17Å
29	K	36.5	Very low	36.7	Very low	142 Å²	142	96.4 Å²	96.4	62%	0.617	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117	117.5	171.6	-162.5	179.4	-180	-174.9	0	110	H33 K34	K29-H33 CarbonylContact C-O 3.41Å; K29-H33 VanDerWaalsContact CA-O 3.23Å; K29-H33 WeakPolarHBondContact CA-O 2.99Å; K29-H33 WeakPolarHBondContact CG-O 3.43Å; K29-K34 HydrophobicContact CG-CG 4.39Å
30	L	39.8	Very low	37	Very low	33 Å²	33	95.7 Å²	95.7	17%	0.173	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	131	179	-166.5	82.4	0	0	0	109.3	G32 H33 F35 V55 I78	L30-G32 PolarHBondContact O-N 3.48Å; L30-G32 VanDerWaalsContact O-N 3.12Å; L30-H33 PolarHBondContact N-O 3.34Å; L30-H33 WeakPolarHBondContact O-CA 3.25Å; L30-H33 WeakPolarHBondContact O-CB 3.38Å; L30-H33 PolarHBondContact O-N 3.47Å; L30-F35 HydrophobicContact CB-CD2 4.31Å; L30-F35 HydrophobicContact CB-CE2 3.8Å; L30-V55 HydrophobicContact CD2-CG2 3.98Å; L30-I78 HydrophobicContact CD2-CD1 3.77Å
31	D	39.1	Very low	37.4	Very low	91 Å²	91	89.5 Å²	89.5	49%	0.487	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	38.4	-178.4	-63.4	-25.6	0	0	0	114.7	H33 Y50	D31-H33 PolarHBondContact O-CD2 3.48Å; D31-H33 VanDerWaalsContact O-CD2 3.3Å; D31-H33 PolarHBondContact O-N 2.94Å; D31-Y50 PolarHBondContact OD1-OH 3.32Å; D31-Y50 VanDerWaalsContact OD1-OH 3.05Å; D31-Y50 PolarHBondContact OD2-OH 3.46Å
32	G	41.2	Very low	37.7	Very low	59 Å²	59	86.6 Å²	86.6	61%	0.608	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	-8.2	-177.9	0	0	0	0	0	114.9	L30	L30-G32 PolarHBondContact O-N 3.48Å; L30-G32 VanDerWaalsContact O-N 3.12Å
33	H	38.4	Very low	38	Very low	76 Å²	76	82.6 Å²	82.6	35%	0.352	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	138.5	176.9	-63.4	-78.6	0	0	0	111.5	K29 L30 D31 F35 R83	K29-H33 CarbonylContact C-O 3.41Å; K29-H33 VanDerWaalsContact CA-O 3.23Å; K29-H33 WeakPolarHBondContact CA-O 2.99Å; K29-H33 WeakPolarHBondContact CG-O 3.43Å; L30-H33 PolarHBondContact N-O 3.34Å; L30-H33 WeakPolarHBondContact O-CA 3.25Å; L30-H33 WeakPolarHBondContact O-CB 3.38Å; L30-H33 PolarHBondContact O-N 3.47Å; D31-H33 PolarHBondContact O-CD2 3.48Å; D31-H33 VanDerWaalsContact O-CD2 3.3Å; D31-H33 PolarHBondContact O-N 2.94Å; H33-F35 HydrophobicContact CB-CD2 4.42Å; H33-F35 HydrophobicContact CB-CE2 3.7Å; H33-F35 HydrophobicContact CB-CZ 4.25Å; H33-F35 WeakPolarHBondContact O-CD2 3.47Å; H33-R83 PolarHBondContact ND1-NH2 3.46Å
34	K	40.7	Very low	37.9	Very low	144 Å²	144	84.4 Å²	84.4	63%	0.626	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	134.5	170.6	-68.7	-176.1	-179.8	-176.7	0	109.7	L28 K29	L28-K34 CarbonylContact O-C 3.49Å; L28-K34 WeakPolarHBondContact O-CA 3.47Å; K29-K34 HydrophobicContact CG-CG 4.39Å
35	F	41.1	Very low	38	Very low	11 Å²	11	91.5 Å²	91.5	5%	0.048	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	131.3	176.7	-63.9	-104.8	0	0	0	106.9	S27 L28 L30 H33 I78 R83 F85	S27-F35 CarbonylContact C-O 3.52Å; S27-F35 WeakPolarHBondContact CA-O 3Å; L28-F35 HydrophobicContact CB-CB 4.02Å; L28-F35 HydrophobicContact CD2-CB 4.4Å; L28-F35 HydrophobicContact CD2-CG 4.48Å; L28-F35 HydrophobicContact CG-CB 4.47Å; L28-F35 PolarHBondContact N-O 3.49Å; L28-F35 PolarHBondContact O-N 3.31Å; L30-F35 HydrophobicContact CB-CD2 4.31Å; L30-F35 HydrophobicContact CB-CE2 3.8Å; H33-F35 HydrophobicContact CB-CD2 4.42Å; H33-F35 HydrophobicContact CB-CE2 3.7Å; H33-F35 HydrophobicContact CB-CZ 4.25Å; H33-F35 WeakPolarHBondContact O-CD2 3.47Å; F35-I78 HydrophobicContact CD1-CG2 4.36Å; F35-I78 HydrophobicContact CE1-CG2 3.6Å; F35-I78 HydrophobicContact CZ-CG2 4.09Å; F35-R83 VanDerWaalsContact CD1-C 3.41Å; F35-R83 HydrophobicContact CD1-CB 3.98Å; F35-R83 VanDerWaalsContact CD1-O 3.26Å; F35-R83 WeakPolarHBondContact CD1-O 2.99Å; F35-R83 HydrophobicContact CE1-CB 3.98Å; F35-R83 HydrophobicContact CE1-CG 4.37Å; F35-F85 HydrophobicContact CB-CE1 4.31Å
36	M	38.8	Very low	38.3	Very low	161 Å²	161	88.3 Å²	88.3	79%	0.793	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	140.4	174.5	-65.9	-171	-53.7	0	0	109.4
37	T	41.7	Very low	38.4	Very low	18 Å²	18	95.2 Å²	95.2	11%	0.11	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	142.8	-178.1	61.9	0	0	0	0	108.4	T26 L28 G39 F85	T26-T37 WeakPolarHBondContact CG2-OG1 3.49Å; T26-T37 PolarHBondContact N-O 3.2Å; T26-T37 PolarHBondContact O-N 3.16Å; T26-T37 PolarHBondContact O-OG1 2.88Å; L28-T37 HydrophobicContact CB-CG2 4.12Å; T37-G39 PolarHBondContact OG1-O 3.38Å; T37-F85 HydrophobicContact CG2-CD1 4.45Å; T37-F85 HydrophobicContact CG2-CE1 3.28Å; T37-F85 HydrophobicContact CG2-CE2 4.36Å; T37-F85 HydrophobicContact CG2-CZ 3.25Å
38	R	39.8	Very low	38.9	Very low	224 Å²	224	94 Å²	94	85%	0.845	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	107.2	164.7	-81.1	179.4	160.5	174.3	-6.7	106
39	G	39.5	Very low	39	Very low	28 Å²	28	100.4 Å²	100.4	29%	0.289	48%	0.478	S	S	.	.	S	Bend	trans	117.1	152.4	-177	0	0	0	0	0	114.5	L24 T26 T37	L24-G39 PolarHBondContact O-N 3.37Å; T26-G39 WeakPolarHBondContact CG2-O 3.41Å; T37-G39 PolarHBondContact OG1-O 3.38Å
40	W	33.9	Very low	39.4	Very low	101 Å²	101	98.4 Å²	98.4	38%	0.383	47%	0.467	S	S	.	.			trans	-93.3	120.6	-171.5	-65.6	70.9	0	0	0	112.1	L24 L65	L24-W40 HydrophobicContact CB-CZ2 4.32Å; L24-W40 HydrophobicContact CD1-CZ2 3.88Å; L24-W40 HydrophobicContact CD2-CZ2 3.95Å; L24-W40 HydrophobicContact CG-CZ2 4.25Å; W40-L65 HydrophobicContact CB-CG 4.3Å; W40-L65 HydrophobicContact CD2-CD1 3.98Å; W40-L65 HydrophobicContact CD2-CD2 4.28Å; W40-L65 HydrophobicContact CD2-CG 3.87Å; W40-L65 HydrophobicContact CG-CD1 3.69Å; W40-L65 HydrophobicContact CG-CG 3.74Å; W40-L65 HydrophobicContact CZ2-CD1 4.41Å; W40-L65 HydrophobicContact CZ2-CD2 4.33Å
41	L	37.5	Very low	39.6	Very low	60 Å²	60	101.8 Å²	101.8	31%	0.314	49%	0.485	S	S	.	.			trans	-125.7	121.2	164.7	-68.4	127.2	0	0	0	109.2	V61 I72 F85 I87	L41-V61 HydrophobicContact CB-CG1 3.93Å; L41-V61 HydrophobicContact CD2-CB 3.74Å; L41-V61 HydrophobicContact CD2-CG1 3.29Å; L41-V61 HydrophobicContact CD2-CG2 4.11Å; L41-V61 HydrophobicContact CG-CG1 4.13Å; L41-I72 HydrophobicContact CD2-CD1 3.87Å; L41-F85 HydrophobicContact CD1-CE2 4.29Å; L41-F85 HydrophobicContact CD1-CZ 4.45Å; L41-I87 HydrophobicContact CD1-CD1 3.46Å; L41-I87 VanDerWaalsContact CD1-CD1 3.46Å; L41-I87 HydrophobicContact CD2-CD1 3.71Å; L41-I87 HydrophobicContact CG-CD1 4.2Å
42	K	36	Very low	40.2	Very low	117 Å²	117	104.2 Å²	104.2	51%	0.509	50%	0.498	S	S	.	.			trans	-99.4	100.4	172.5	-171.7	178.3	179.1	-174.9	0	108.8	H44	K42-H44 WeakPolarHBondContact CE-NE2 3.36Å; K42-H44 PolarHBondContact O-N 3.25Å
43	L	38	Very low	40.5	Very low	66 Å²	66	106.5 Å²	106.5	35%	0.346	50%	0.496	S	S	.	.			trans	-77.4	112.9	175.9	-64.4	172.5	0	0	0	110.1	L28 M46 V61	L28-L43 HydrophobicContact CD1-CD1 3.3Å; L28-L43 HydrophobicContact CD1-CG 4.46Å; L43-M46 HydrophobicContact CD2-CE 3.77Å; L43-M46 HydrophobicContact CD2-CG 4.26Å; L43-V61 HydrophobicContact CD2-CG1 4.47Å; L43-V61 HydrophobicContact CD2-CG2 4.24Å
44	H	35	Very low	40.7	Very low	118 Å²	118	107.1 Å²	107.1	55%	0.546	50%	0.496	S	S	.	.			trans	-84.1	121.9	166.8	-82.3	-94.7	0	0	0	109.1	K42 M46	K42-H44 WeakPolarHBondContact CE-NE2 3.36Å; K42-H44 PolarHBondContact O-N 3.25Å; H44-M46 PolarHBondContact O-N 2.99Å
45	K	33.3	Very low	41.1	Very low	215 Å²	215	100.5 Å²	100.5	94%	0.935	47%	0.467	S	S	*	.	S	Bend	trans	20.7	63.1	170.5	-66.5	-174.8	179.5	176.6	0	116.9
46	M	42	Very low	41.2	Very low	43 Å²	43	102.6 Å²	102.6	21%	0.212	48%	0.478	C	S	.	.			trans	-83.6	139.2	177.1	-73.5	-103.8	-147.2	0	0	112.1	L43 H44 L57 E59 V61	L43-M46 HydrophobicContact CD2-CE 3.77Å; L43-M46 HydrophobicContact CD2-CG 4.26Å; H44-M46 PolarHBondContact O-N 2.99Å; M46-L57 HydrophobicContact CE-CB 4.43Å; M46-L57 HydrophobicContact CE-CD2 4.22Å; M46-L57 HydrophobicContact SD-CD2 4.02Å; M46-E59 HydrophobicContact CE-CB 3.78Å; M46-E59 HydrophobicContact SD-CB 3.75Å; M46-E59 HydrophobicContact SD-CG 4.07Å; M46-E59 VanDerWaalsContact SD-OE2 3.39Å; M46-V61 HydrophobicContact CE-CG2 4.13Å
47	K	40.2	Very low	41.7	Very low	191 Å²	191	96.6 Å²	96.6	83%	0.83	45%	0.448	S	S	*	.			trans	-98.5	105.1	164.8	-77.6	-176.8	-179.6	176.3	0	109.2	K49	K47-K49 PolarHBondContact O-N 3.36Å
48	P	45.3	Very low	42	Very low	45 Å²	45	104.5 Å²	104.5	29%	0.292	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-63.6	131.2	-179.7	25.5	-32.5	0	0	0	110.6	Y50 V55	P48-Y50 HydrophobicContact CB-CE2 3.85Å; P48-Y50 HydrophobicContact CG-CE2 3.8Å; P48-Y50 WeakPolarHBondContact CG-OH 3.44Å; P48-V55 HydrophobicContact CB-CG1 4.02Å
49	K	40.5	Very low	42.2	Very low	166 Å²	166	99 Å²	99	72%	0.722	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	120.4	164	-74.2	-171	-179.4	177.9	0	108.5	K47 H56	K47-K49 PolarHBondContact O-N 3.36Å; K49-H56 PolarHBondContact O-N 2.6Å
50	Y	46.5	Very low	42.5	Very low	99 Å²	99	102.8 Å²	102.8	39%	0.388	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	129.1	178.6	-59.7	-91.8	0	0	0	109.4	D31 P48 Y54 V55	D31-Y50 PolarHBondContact OD1-OH 3.32Å; D31-Y50 VanDerWaalsContact OD1-OH 3.05Å; D31-Y50 PolarHBondContact OD2-OH 3.46Å; P48-Y50 HydrophobicContact CB-CE2 3.85Å; P48-Y50 HydrophobicContact CG-CE2 3.8Å; P48-Y50 WeakPolarHBondContact CG-OH 3.44Å; Y50-Y54 WeakPolarHBondContact CA-O 3.5Å; Y50-V55 HydrophobicContact CD1-CG2 4Å; Y50-V55 HydrophobicContact CE1-CG2 3.84Å
51	L	43.4	Very low	43	Very low	105 Å²	105	98.4 Å²	98.4	55%	0.55	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	104	165.7	-155.2	88.8	0	0	0	106.7	D53 Y54 H56	L51-D53 PolarHBondContact O-N 2.77Å; L51-Y54 PolarHBondContact N-O 2.84Å; L51-Y54 WeakPolarHBondContact O-CB 3.48Å; L51-Y54 PolarHBondContact O-N 3.26Å; L51-H56 WeakPolarHBondContact CB-NE2 3.43Å
52	N	52.5	Low	43.2	Very low	142 Å²	142	99.8 Å²	99.8	76%	0.759	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	-125.3	-168.6	-56.4	-38.6	0	0	0	111.9	Y54	N52-Y54 VanDerWaalsContact C-N 3.26Å; N52-Y54 PolarHBondContact O-N 2.91Å
53	D	45.9	Very low	43.5	Very low	106 Å²	106	96 Å²	96	57%	0.567	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	5.5	179.3	-71.3	-42.7	0	0	0	113.5	L51	L51-D53 PolarHBondContact O-N 2.77Å
54	Y	42.8	Very low	43.6	Very low	89 Å²	89	95.6 Å²	95.6	35%	0.349	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	147.7	-172.6	-54.4	-77.5	0	0	0	112.6	Y50 L51 N52 L77	Y50-Y54 WeakPolarHBondContact CA-O 3.5Å; L51-Y54 PolarHBondContact N-O 2.84Å; L51-Y54 WeakPolarHBondContact O-CB 3.48Å; L51-Y54 PolarHBondContact O-N 3.26Å; N52-Y54 VanDerWaalsContact C-N 3.26Å; N52-Y54 PolarHBondContact O-N 2.91Å; Y54-L77 HydrophobicContact CD1-CB 3.67Å; Y54-L77 HydrophobicContact CD1-CD1 4.46Å; Y54-L77 HydrophobicContact CD1-CD2 3.28Å; Y54-L77 HydrophobicContact CD1-CG 3.94Å; Y54-L77 HydrophobicContact CE1-CB 3.98Å; Y54-L77 HydrophobicContact CE1-CD1 4.29Å; Y54-L77 HydrophobicContact CE1-CD2 3.87Å; Y54-L77 HydrophobicContact CE1-CG 4.24Å; Y54-L77 HydrophobicContact CG-CD2 3.65Å
55	V	49	Very low	43.7	Very low	5 Å²	5	93.7 Å²	93.7	3%	0.03	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	114	175.9	177.9	0	0	0	0	108.7	L30 P48 Y50 L57 I78	L30-V55 HydrophobicContact CD2-CG2 3.98Å; P48-V55 HydrophobicContact CB-CG1 4.02Å; Y50-V55 HydrophobicContact CD1-CG2 4Å; Y50-V55 HydrophobicContact CE1-CG2 3.84Å; V55-L57 HydrophobicContact CG1-CD2 3.86Å; V55-L57 HydrophobicContact CG1-CG 4.12Å; V55-L57 PolarHBondContact O-N 3.2Å; V55-I78 HydrophobicContact CB-CD1 3.88Å; V55-I78 HydrophobicContact CB-CG1 4.18Å; V55-I78 HydrophobicContact CG1-CD1 4.4Å; V55-I78 HydrophobicContact CG2-CB 4.47Å; V55-I78 HydrophobicContact CG2-CD1 3.9Å; V55-I78 HydrophobicContact CG2-CG1 4.34Å
56	H	44.7	Very low	44	Very low	56 Å²	56	86.1 Å²	86.1	26%	0.259	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	109.8	173.9	-73.6	-114.2	0	0	0	108.7	K49 L51 E75	K49-H56 PolarHBondContact O-N 2.6Å; L51-H56 WeakPolarHBondContact CB-NE2 3.43Å; H56-E75 IonicContact CE1-OE1 2.59Å; H56-E75 PolarHBondContact CE1-OE1 3.05Å; H56-E75 VanDerWaalsContact CE1-OE1 3.32Å; H56-E75 IonicContact ND1-OE1 2.98Å
57	L	48.9	Very low	44	Very low	34 Å²	34	90.4 Å²	90.4	18%	0.178	46%	0.459	C	S	.	.			trans	-95.3	120.7	167.2	-59.3	177.8	0	0	0	107.6	M46 V55 V76	M46-L57 HydrophobicContact CE-CB 4.43Å; M46-L57 HydrophobicContact CE-CD2 4.22Å; M46-L57 HydrophobicContact SD-CD2 4.02Å; V55-L57 HydrophobicContact CG1-CD2 3.86Å; V55-L57 HydrophobicContact CG1-CG 4.12Å; V55-L57 PolarHBondContact O-N 3.2Å; L57-V76 HydrophobicContact CD1-CB 4.04Å; L57-V76 HydrophobicContact CD1-CG1 4.45Å; L57-V76 HydrophobicContact CD1-CG2 3.97Å; L57-V76 HydrophobicContact CG-CB 4.45Å
58	K	47	Very low	44	Very low	185 Å²	185	86 Å²	86	80%	0.804	44%	0.44	S	S	*	.			trans	-118.6	20.7	-179.3	-94.2	-162.4	177.1	-165.2	0	112
59	E	45.3	Very low	43.6	Very low	107 Å²	107	88.3 Å²	88.3	50%	0.5	45%	0.449	S	S	.	.	S	Bend	trans	-125.2	143.7	-177	-58.4	-178.1	178.9	0	0	109.6	M46	M46-E59 HydrophobicContact CE-CB 3.78Å; M46-E59 HydrophobicContact SD-CB 3.75Å; M46-E59 HydrophobicContact SD-CG 4.07Å; M46-E59 VanDerWaalsContact SD-OE2 3.39Å
60	D	44	Very low	43.6	Very low	109 Å²	109	82.2 Å²	82.2	58%	0.583	43%	0.425	S	S	*	.			trans	-54.6	136.9	178.6	-56	-48	0	0	0	110.3
61	V	45.4	Very low	43.3	Very low	9 Å²	9	81.8 Å²	81.8	6%	0.055	43%	0.426	C	S	.	.			trans	-109.4	117.8	173	-169	0	0	0	0	109.9	L41 L43 M46 I72	L41-V61 HydrophobicContact CB-CG1 3.93Å; L41-V61 HydrophobicContact CD2-CB 3.74Å; L41-V61 HydrophobicContact CD2-CG1 3.29Å; L41-V61 HydrophobicContact CD2-CG2 4.11Å; L41-V61 HydrophobicContact CG-CG1 4.13Å; L43-V61 HydrophobicContact CD2-CG1 4.47Å; L43-V61 HydrophobicContact CD2-CG2 4.24Å; M46-V61 HydrophobicContact CE-CG2 4.13Å; V61-I72 HydrophobicContact CB-CD1 3.5Å; V61-I72 VanDerWaalsContact CB-CD1 3.5Å; V61-I72 HydrophobicContact CB-CG1 4.15Å; V61-I72 HydrophobicContact CG2-CD1 3.55Å; V61-I72 HydrophobicContact CG2-CG1 4.33Å
62	L	42.7	Very low	43.4	Very low	89 Å²	89	78.2 Å²	78.2	47%	0.466	41%	0.407	S	S	.	.			trans	-76.7	124.4	175.4	-64.1	167.8	0	0	0	109.7	S64 I69	L62-S64 PolarHBondContact O-N 2.97Å; L62-I69 HydrophobicContact CD2-CG1 4.47Å
63	C	41.5	Very low	43.2	Very low	36 Å²	36	74.4 Å²	74.4	24%	0.243	39%	0.388	C	S	.	.			trans	-67.8	126.6	166.5	-174.7	0	0	0	0	108.4	L65 C66 V70	C63-L65 VanDerWaalsContact C-N 3.25Å; C63-L65 PolarHBondContact O-N 3.06Å; C63-L65 PolarHBondContact SG-N 3.34Å; C63-C66 HydrophobicContact CB-CB 4.1Å; C63-C66 PolarHBondContact SG-N 3.26Å; C63-V70 HydrophobicContact CB-CG2 4.34Å
64	S	39.8	Very low	43.1	Very low	59 Å²	59	73.3 Å²	73.3	41%	0.413	39%	0.387	S	S	.	.	S	Bend	trans	-79.8	-9	176.6	57.4	0	0	0	0	113.6	L62	L62-S64 PolarHBondContact O-N 2.97Å
65	L	37.6	Very low	43.2	Very low	77 Å²	77	73.7 Å²	73.7	40%	0.403	39%	0.392	S	S	.	.	S	Bend	trans	-106	-22.2	179.2	-68.8	-170.2	0	0	0	113.8	M18 L24 W40 C63	M18-L65 HydrophobicContact CE-CD1 4.4Å; L24-L65 HydrophobicContact CD1-CD1 3.89Å; W40-L65 HydrophobicContact CB-CG 4.3Å; W40-L65 HydrophobicContact CD2-CD1 3.98Å; W40-L65 HydrophobicContact CD2-CD2 4.28Å; W40-L65 HydrophobicContact CD2-CG 3.87Å; W40-L65 HydrophobicContact CG-CD1 3.69Å; W40-L65 HydrophobicContact CG-CG 3.74Å; W40-L65 HydrophobicContact CZ2-CD1 4.41Å; W40-L65 HydrophobicContact CZ2-CD2 4.33Å; C63-L65 VanDerWaalsContact C-N 3.25Å; C63-L65 PolarHBondContact O-N 3.06Å; C63-L65 PolarHBondContact SG-N 3.34Å
66	C	39.3	Very low	43.1	Very low	56 Å²	56	73.8 Å²	73.8	38%	0.378	39%	0.393	S	S	.	.			trans	-114.2	123.6	173.1	-88.9	0	0	0	0	108.7	C63 K68	C63-C66 HydrophobicContact CB-CB 4.1Å; C63-C66 PolarHBondContact SG-N 3.26Å; C66-K68 HydrophobicContact CB-CB 4.47Å; C66-K68 PolarHBondContact O-N 2.85Å
67	P	41.8	Very low	43.2	Very low	133 Å²	133	73.5 Å²	73.5	86%	0.864	39%	0.393	S	S	*	.	S	Bend	trans	-67.9	-9.1	169.8	27.6	-32.1	0	0	0	112.7	I69	P67-I69 PolarHBondContact O-N 3.28Å
68	K	40.6	Very low	43.3	Very low	99 Å²	99	72.2 Å²	72.2	43%	0.43	39%	0.386	S	S	.	.	S	Bend	trans	-71.6	122.2	174	-57.4	-172.4	177.7	-158.6	0	109.6	C66 V70 E94	C66-K68 HydrophobicContact CB-CB 4.47Å; C66-K68 PolarHBondContact O-N 2.85Å; K68-V70 PolarHBondContact O-N 3.12Å; K68-E94 VanDerWaalsContact CD-OE1 3.25Å; K68-E94 WeakPolarHBondContact CD-OE1 3.48Å; K68-E94 WeakPolarHBondContact CD-OE2 3.35Å; K68-E94 WeakPolarHBondContact CE-OE1 3.49Å; K68-E94 WeakPolarHBondContact CE-OE2 3.35Å; K68-E94 IonicContact NZ-OE1 3.96Å; K68-E94 PolarHBondContact NZ-OE1 3.2Å; K68-E94 IonicContact NZ-OE2 3.32Å; K68-E94 PolarHBondContact NZ-OE2 3.22Å
69	I	36.3	Very low	43.4	Very low	93 Å²	93	67 Å²	67	48%	0.477	37%	0.367	S	S	.	.			trans	-64	122	178.5	-62.3	173.5	0	0	0	107.6	L62 P67 L93	L62-I69 HydrophobicContact CD2-CG1 4.47Å; P67-I69 PolarHBondContact O-N 3.28Å; I69-L93 HydrophobicContact CB-CD1 3.87Å; I69-L93 HydrophobicContact CG2-CD1 3.59Å
70	V	40.9	Very low	43.5	Very low	39 Å²	39	69 Å²	69	24%	0.236	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	105.9	172.6	-177.4	0	0	0	0	106.8	C63 K68 I72 F90	C63-V70 HydrophobicContact CB-CG2 4.34Å; K68-V70 PolarHBondContact O-N 3.12Å; V70-I72 PolarHBondContact O-N 3.3Å; V70-F90 HydrophobicContact CG1-CB 3.56Å
71	K	40.4	Very low	43.8	Very low	90 Å²	90	73.2 Å²	73.2	39%	0.391	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	114.3	174.5	-164	176.5	-178	-177.9	0	107.3	V73 L91 L93	K71-V73 PolarHBondContact O-N 2.9Å; K71-L91 HydrophobicContact CB-CB 4.24Å; K71-L91 HydrophobicContact CD-CD1 4.39Å; K71-L91 PolarHBondContact N-O 2.89Å; K71-L91 PolarHBondContact O-N 3.28Å; K71-L91 VanDerWaalsContact O-N 3.16Å; K71-L93 HydrophobicContact CB-CD1 4.15Å; K71-L93 HydrophobicContact CB-CG 4.34Å; K71-L93 HydrophobicContact CD-CD2 4.21Å
72	I	45.7	Very low	44.2	Very low	30 Å²	30	76.4 Å²	76.4	15%	0.154	40%	0.402	C	S	.	.			trans	-85.3	115	179.5	-65.3	-157.4	0	0	0	108.9	L41 V61 V70 I87	L41-I72 HydrophobicContact CD2-CD1 3.87Å; V61-I72 HydrophobicContact CB-CD1 3.5Å; V61-I72 VanDerWaalsContact CB-CD1 3.5Å; V61-I72 HydrophobicContact CB-CG1 4.15Å; V61-I72 HydrophobicContact CG2-CD1 3.55Å; V61-I72 HydrophobicContact CG2-CG1 4.33Å; V70-I72 PolarHBondContact O-N 3.3Å; I72-I87 HydrophobicContact CD1-CD1 4.5Å
73	V	46.9	Very low	44.3	Very low	61 Å²	61	78.4 Å²	78.4	37%	0.37	40%	0.404	S	S	.	.			trans	-69.2	143.1	170.3	178.3	0	0	0	0	109.2	K71 E75 L91	K71-V73 PolarHBondContact O-N 2.9Å; V73-E75 PolarHBondContact O-N 2.79Å; V73-L91 HydrophobicContact CG2-CD1 3.53Å; V73-L91 HydrophobicContact CG2-CG 3.73Å
74	P	44.8	Very low	44.5	Very low	83 Å²	83	82.7 Å²	82.7	54%	0.539	42%	0.42	S	S	.	.	S	Bend	trans	-96.4	88.2	-141.3	36.1	-32.3	0	0	0	112.4
75	E	44.2	Very low	44.7	Very low	97 Å²	97	81.7 Å²	81.7	45%	0.453	41%	0.408	S	S	.	.			trans	-175.1	121.5	148	-112.1	168.3	-172.8	0	0	111.3	H56 V73 L77	H56-E75 IonicContact CE1-OE1 2.59Å; H56-E75 PolarHBondContact CE1-OE1 3.05Å; H56-E75 VanDerWaalsContact CE1-OE1 3.32Å; H56-E75 IonicContact ND1-OE1 2.98Å; V73-E75 PolarHBondContact O-N 2.79Å; E75-L77 HydrophobicContact CG-CD2 4.34Å
76	V	47.2	Very low	45.1	Very low	8 Å²	8	81.1 Å²	81.1	5%	0.048	41%	0.408	C	S	.	.	B	Isolated β-bridge	trans	-110.7	94.8	168.7	-179.1	0	0	0	0	108.2	L57 I78 F85 I87	L57-V76 HydrophobicContact CD1-CB 4.04Å; L57-V76 HydrophobicContact CD1-CG1 4.45Å; L57-V76 HydrophobicContact CD1-CG2 3.97Å; L57-V76 HydrophobicContact CG-CB 4.45Å; V76-I78 HydrophobicContact CG1-CD1 4.46Å; V76-I78 HydrophobicContact CG1-CG1 3.93Å; V76-I78 PolarHBondContact O-N 2.72Å; V76-F85 HydrophobicContact CG1-CB 3.88Å; V76-F85 HydrophobicContact CG1-CD2 3.64Å; V76-F85 HydrophobicContact CG1-CE2 4.49Å; V76-F85 HydrophobicContact CG1-CG 4.04Å; V76-I87 HydrophobicContact CG2-CG1 4.5Å
77	L	47.7	Very low	45.4	Very low	50 Å²	50	81 Å²	81	26%	0.262	40%	0.403	S	S	.	.			trans	-78.5	105.4	176.7	-59.4	176.5	0	0	0	109.2	Y54 E75	Y54-L77 HydrophobicContact CD1-CB 3.67Å; Y54-L77 HydrophobicContact CD1-CD1 4.46Å; Y54-L77 HydrophobicContact CD1-CD2 3.28Å; Y54-L77 HydrophobicContact CD1-CG 3.94Å; Y54-L77 HydrophobicContact CE1-CB 3.98Å; Y54-L77 HydrophobicContact CE1-CD1 4.29Å; Y54-L77 HydrophobicContact CE1-CD2 3.87Å; Y54-L77 HydrophobicContact CE1-CG 4.24Å; Y54-L77 HydrophobicContact CG-CD2 3.65Å; E75-L77 HydrophobicContact CG-CD2 4.34Å
78	I	50.1	Low	45.6	Very low	6 Å²	6	80.8 Å²	80.8	3%	0.031	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	110.9	178.4	-53	-174	0	0	0	109.4	L30 F35 V55 V76 R80 F85	L30-I78 HydrophobicContact CD2-CD1 3.77Å; F35-I78 HydrophobicContact CD1-CG2 4.36Å; F35-I78 HydrophobicContact CE1-CG2 3.6Å; F35-I78 HydrophobicContact CZ-CG2 4.09Å; V55-I78 HydrophobicContact CB-CD1 3.88Å; V55-I78 HydrophobicContact CB-CG1 4.18Å; V55-I78 HydrophobicContact CG1-CD1 4.4Å; V55-I78 HydrophobicContact CG2-CB 4.47Å; V55-I78 HydrophobicContact CG2-CD1 3.9Å; V55-I78 HydrophobicContact CG2-CG1 4.34Å; V76-I78 HydrophobicContact CG1-CD1 4.46Å; V76-I78 HydrophobicContact CG1-CG1 3.93Å; V76-I78 PolarHBondContact O-N 2.72Å; I78-R80 PolarHBondContact O-N 2.97Å; I78-F85 HydrophobicContact CB-CB 4.37Å; I78-F85 HydrophobicContact CG1-CB 3.84Å; I78-F85 HydrophobicContact CG2-CB 4.5Å
79	N	49.3	Very low	45.6	Very low	76 Å²	76	78.2 Å²	78.2	41%	0.406	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	109.2	173.7	-174.2	-34	0	0	0	110.2	K81 V82 R83 Q84	N79-K81 VanDerWaalsContact C-N 3.26Å; N79-K81 PolarHBondContact O-N 3.27Å; N79-K81 WeakPolarHBondContact OD1-CA 3.23Å; N79-K81 WeakPolarHBondContact OD1-CB 3.47Å; N79-K81 PolarHBondContact OD1-N 3.47Å; N79-V82 HydrophobicContact CB-CB 4.23Å; N79-V82 HydrophobicContact CB-CG2 4.39Å; N79-V82 PolarHBondContact O-N 3.36Å; N79-V82 PolarHBondContact OD1-N 3.25Å; N79-R83 PolarHBondContact O-N 3.14Å; N79-Q84 PolarHBondContact N-O 2.79Å; N79-Q84 VanDerWaalsContact N-O 3.14Å
80	R	47.6	Very low	45.8	Very low	149 Å²	149	79.5 Å²	79.5	56%	0.562	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.2	-179.1	-63.5	-172.5	75.6	178.8	6.4	114.2	I78	I78-R80 PolarHBondContact O-N 2.97Å
81	K	49.9	Very low	45.6	Very low	198 Å²	198	80.4 Å²	80.4	86%	0.861	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-39.6	176.4	-63.3	-179.3	-179.8	173.6	0	111.4	N79	N79-K81 VanDerWaalsContact C-N 3.26Å; N79-K81 PolarHBondContact O-N 3.27Å; N79-K81 WeakPolarHBondContact OD1-CA 3.23Å; N79-K81 WeakPolarHBondContact OD1-CB 3.47Å; N79-K81 PolarHBondContact OD1-N 3.47Å
82	V	53.2	Low	45.6	Very low	75 Å²	75	79 Å²	79	46%	0.455	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-12.4	-172.4	-170.3	0	0	0	0	112.1	N79 Q84	N79-V82 HydrophobicContact CB-CB 4.23Å; N79-V82 HydrophobicContact CB-CG2 4.39Å; N79-V82 PolarHBondContact O-N 3.36Å; N79-V82 PolarHBondContact OD1-N 3.25Å; V82-Q84 HydrophobicContact CB-CB 4.45Å; V82-Q84 HydrophobicContact CG1-CB 4Å; V82-Q84 HydrophobicContact CG1-CG 3.91Å; V82-Q84 VanDerWaalsContact CG1-OE1 3.27Å; V82-Q84 PolarHBondContact O-N 3.21Å
83	R	46.3	Very low	45.2	Very low	132 Å²	132	79.9 Å²	79.9	50%	0.498	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	39.3	-174.2	-62.7	-173.7	179.9	175.9	3.7	112.2	H33 F35 N79	H33-R83 PolarHBondContact ND1-NH2 3.46Å; F35-R83 VanDerWaalsContact CD1-C 3.41Å; F35-R83 HydrophobicContact CD1-CB 3.98Å; F35-R83 VanDerWaalsContact CD1-O 3.26Å; F35-R83 WeakPolarHBondContact CD1-O 2.99Å; F35-R83 HydrophobicContact CE1-CB 3.98Å; F35-R83 HydrophobicContact CE1-CG 4.37Å; N79-R83 PolarHBondContact O-N 3.14Å
84	Q	43.9	Very low	45	Very low	125 Å²	125	81 Å²	81	58%	0.584	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	146	179	-75.5	178.1	-7.9	0	0	108.7	N79 V82	N79-Q84 PolarHBondContact N-O 2.79Å; N79-Q84 VanDerWaalsContact N-O 3.14Å; V82-Q84 HydrophobicContact CB-CB 4.45Å; V82-Q84 HydrophobicContact CG1-CB 4Å; V82-Q84 HydrophobicContact CG1-CG 3.91Å; V82-Q84 VanDerWaalsContact CG1-OE1 3.27Å; V82-Q84 PolarHBondContact O-N 3.21Å
85	F	44	Very low	44.9	Very low	38 Å²	38	83.4 Å²	83.4	17%	0.167	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	147.9	168	70.3	-88.8	0	0	0	107.6	L28 F35 T37 L41 V76 I78 I87	L28-F85 HydrophobicContact CB-CE1 3.94Å; L28-F85 HydrophobicContact CB-CZ 4.32Å; L28-F85 HydrophobicContact CD2-CD1 3.81Å; L28-F85 HydrophobicContact CD2-CE1 3.21Å; L28-F85 HydrophobicContact CD2-CZ 3.72Å; L28-F85 HydrophobicContact CG-CE1 4.17Å; F35-F85 HydrophobicContact CB-CE1 4.31Å; T37-F85 HydrophobicContact CG2-CD1 4.45Å; T37-F85 HydrophobicContact CG2-CE1 3.28Å; T37-F85 HydrophobicContact CG2-CE2 4.36Å; T37-F85 HydrophobicContact CG2-CZ 3.25Å; L41-F85 HydrophobicContact CD1-CE2 4.29Å; L41-F85 HydrophobicContact CD1-CZ 4.45Å; V76-F85 HydrophobicContact CG1-CB 3.88Å; V76-F85 HydrophobicContact CG1-CD2 3.64Å; V76-F85 HydrophobicContact CG1-CE2 4.49Å; V76-F85 HydrophobicContact CG1-CG 4.04Å; I78-F85 HydrophobicContact CB-CB 4.37Å; I78-F85 HydrophobicContact CG1-CB 3.84Å; I78-F85 HydrophobicContact CG2-CB 4.5Å; F85-I87 HydrophobicContact CD2-CG1 4.32Å; F85-I87 HydrophobicContact CE2-CD1 4.25Å; F85-I87 HydrophobicContact CE2-CG1 4.21Å
86	T	46	Very low	44.7	Very low	65 Å²	65	83.2 Å²	83.2	40%	0.399	39%	0.392	S	S	.	.			trans	-122.5	139	178.5	-54.5	0	0	0	0	107.1	Y88	T86-Y88 HydrophobicContact CG2-CD1 4.3Å; T86-Y88 HydrophobicContact CG2-CE1 3.98Å; T86-Y88 WeakPolarHBondContact O-CD2 3.18Å; T86-Y88 WeakPolarHBondContact O-CE2 3.26Å
87	I	47.2	Very low	44.5	Very low	53 Å²	53	89.3 Å²	89.3	27%	0.272	42%	0.42	S	S	.	.			trans	-99.2	126.5	172.2	-62	176.1	0	0	0	106.3	L41 I72 V76 F85	L41-I87 HydrophobicContact CD1-CD1 3.46Å; L41-I87 VanDerWaalsContact CD1-CD1 3.46Å; L41-I87 HydrophobicContact CD2-CD1 3.71Å; L41-I87 HydrophobicContact CG-CD1 4.2Å; I72-I87 HydrophobicContact CD1-CD1 4.5Å; V76-I87 HydrophobicContact CG2-CG1 4.5Å; F85-I87 HydrophobicContact CD2-CG1 4.32Å; F85-I87 HydrophobicContact CE2-CD1 4.25Å; F85-I87 HydrophobicContact CE2-CG1 4.21Å
88	Y	45.3	Very low	44.4	Very low	129 Å²	129	93.4 Å²	93.4	51%	0.506	44%	0.438	S	S	.	.			trans	-99	-13.9	-166.8	-65.8	-79.1	0	0	0	114.3	T86	T86-Y88 HydrophobicContact CG2-CD1 4.3Å; T86-Y88 HydrophobicContact CG2-CE1 3.98Å; T86-Y88 WeakPolarHBondContact O-CD2 3.18Å; T86-Y88 WeakPolarHBondContact O-CE2 3.26Å
89	S	40.7	Very low	44.3	Very low	46 Å²	46	100 Å²	100	32%	0.322	47%	0.468	S	S	.	.			trans	-161.7	145.7	-178.2	173.3	0	0	0	0	111.1
90	F	41.5	Very low	44.3	Very low	119 Å²	119	103.3 Å²	103.3	52%	0.522	48%	0.481	S	S	.	.			trans	-125	138	163.2	50.8	-87.4	0	0	0	107	V70	V70-F90 HydrophobicContact CG1-CB 3.56Å
91	L	35.7	Very low	44.5	Very low	58 Å²	58	102.9 Å²	102.9	30%	0.304	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	127.7	160.3	-73.1	163.1	0	0	0	106.9	K71 V73	K71-L91 HydrophobicContact CB-CB 4.24Å; K71-L91 HydrophobicContact CD-CD1 4.39Å; K71-L91 PolarHBondContact N-O 2.89Å; K71-L91 PolarHBondContact O-N 3.28Å; K71-L91 VanDerWaalsContact O-N 3.16Å; V73-L91 HydrophobicContact CG2-CD1 3.53Å; V73-L91 HydrophobicContact CG2-CG 3.73Å
92	N	39.7	Very low	44.7	Very low	61 Å²	61	100.4 Å²	100.4	33%	0.326	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	114.4	166.1	-164.1	24	0	0	0	106.5	E94 E95	N92-E94 PolarHBondContact O-N 2.93Å; N92-E95 PolarHBondContact O-N 3.07Å
93	L	37.9	Very low	44.7	Very low	48 Å²	48	103.9 Å²	103.9	25%	0.251	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-7.7	-177.5	-82.2	161.8	0	0	0	113.4	I69 K71	I69-L93 HydrophobicContact CB-CD1 3.87Å; I69-L93 HydrophobicContact CG2-CD1 3.59Å; K71-L93 HydrophobicContact CB-CD1 4.15Å; K71-L93 HydrophobicContact CB-CG 4.34Å; K71-L93 HydrophobicContact CD-CD2 4.21Å
94	E	42.1	Very low	45.1	Very low	85 Å²	85	104.5 Å²	104.5	40%	0.397	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-8.6	177.7	-73.1	176.9	171.4	0	0	114.1	K68 N92	K68-E94 VanDerWaalsContact CD-OE1 3.25Å; K68-E94 WeakPolarHBondContact CD-OE1 3.48Å; K68-E94 WeakPolarHBondContact CD-OE2 3.35Å; K68-E94 WeakPolarHBondContact CE-OE1 3.49Å; K68-E94 WeakPolarHBondContact CE-OE2 3.35Å; K68-E94 IonicContact NZ-OE1 3.96Å; K68-E94 PolarHBondContact NZ-OE1 3.2Å; K68-E94 IonicContact NZ-OE2 3.32Å; K68-E94 PolarHBondContact NZ-OE2 3.22Å; N92-E94 PolarHBondContact O-N 2.93Å
95	E	43.3	Very low	45.7	Very low	133 Å²	133	105.6 Å²	105.6	62%	0.621	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-13.6	176.6	-76.2	173.5	167.8	0	0	112.9	N92	N92-E95 PolarHBondContact O-N 3.07Å
96	E	41	Very low	46.3	Very low	94 Å²	94	111.2 Å²	111.2	44%	0.439	53%	0.529	S	S	.	.	H	α-helix	trans	-87.1	-21.4	172.2	-80	-178.3	166.9	0	0	112.3
97	E	42.1	Very low	46.9	Very low	135 Å²	135	115.6 Å²	115.6	63%	0.631	55%	0.545	S	S	*	.	H	α-helix	trans	-87.1	-21	177	-69.9	-176.7	174.8	0	0	112.9
98	E	45.1	Very low	47.5	Very low	136 Å²	136	120.4 Å²	120.4	64%	0.636	57%	0.566	S	S	*	*	H	α-helix	trans	-84	-28.6	175.2	-70.8	-176.2	176.1	0	0	112.5	E102	E98-E102 PolarHBondContact O-N 3.45Å
99	E	49.2	Very low	48.2	Very low	145 Å²	145	121.9 Å²	121.9	68%	0.678	58%	0.578	S	S	*	*	H	α-helix	trans	-76.8	-26.6	176.5	-72	-174.7	174.7	0	0	113
100	E	48.6	Very low	49.1	Very low	145 Å²	145	128.1 Å²	128.1	68%	0.678	60%	0.602	S	S	*	*	H	α-helix	trans	-78.3	-24.9	174.5	-72.9	-172.8	172.5	0	0	112.6
101	E	52.7	Low	50.1	Low	140 Å²	140	131.2 Å²	131.2	65%	0.654	62%	0.618	S	S	*	*	H	α-helix	trans	-81.6	-30.8	178.4	-73.7	-173.7	173.6	0	0	112.9
102	E	53	Low	51.1	Low	147 Å²	147	137 Å²	137	69%	0.687	64%	0.643	S	S	*	*	H	α-helix	trans	-73.5	-29	177.4	-72.6	-171.2	170.5	0	0	113.2	E98	E98-E102 PolarHBondContact O-N 3.45Å
103	E	53.5	Low	51.5	Low	147 Å²	147	146.3 Å²	146.3	69%	0.687	69%	0.685	S	S	*	*	H	α-helix	trans	-73.7	-26.7	176.7	-72.2	-169.9	167.3	0	0	112.9
104	E	55	Low	52.2	Low	146 Å²	146	151.3 Å²	151.3	68%	0.682	71%	0.707	S	S	*	*	H	α-helix	trans	-78.4	-30.2	177.3	-72	-169.2	165.7	0	0	112.8
105	E	56.3	Low	52.7	Low	147 Å²	147	154.7 Å²	154.7	69%	0.687	72%	0.723	S	S	*	*	H	α-helix	trans	-75.8	-31.3	177.8	-70.5	-167.1	166	0	0	112.9	E109	E105-E109 PolarHBondContact O-N 3.07Å
106	E	57	Low	53.2	Low	157 Å²	157	155.9 Å²	155.9	73%	0.734	73%	0.729	S	S	*	*	H	α-helix	trans	-73.2	-29.4	176.6	-71.7	-165.7	165.6	0	0	113
107	E	58.6	Low	54	Low	157 Å²	157	159.6 Å²	159.6	73%	0.734	75%	0.746	S	S	*	*	H	α-helix	trans	-76	-27.6	176.4	-72.9	-164.4	164.9	0	0	113
108	E	59.1	Low	54.7	Low	154 Å²	154	161.1 Å²	161.1	72%	0.72	75%	0.753	S	S	*	*	H	α-helix	trans	-78.9	-26.9	177.4	-71.7	-163.8	163.9	0	0	113.4
109	E	59.2	Low	55.3	Low	160 Å²	160	162.8 Å²	162.8	75%	0.748	76%	0.761	S	S	*	*	H	α-helix	trans	-79.3	-22.2	178	-70	-163.7	163.6	0	0	113.9	E105	E105-E109 PolarHBondContact O-N 3.07Å
110	E	60.4	Low	55.8	Low	177 Å²	177	164.1 Å²	164.1	83%	0.827	77%	0.767	S	S	*	*	S	Bend	trans	-82	-12.6	176.4	-72.9	-160.4	161.3	0	0	114.1
111	E	61.6	Low	56.3	Low	184 Å²	184	165.5 Å²	165.5	86%	0.86	77%	0.774	S	S	*	*	S	Bend	trans	-93.5	-5.7	176	-69.6	-157.9	157.9	0	0	114.4
112	E	57.8	Low	56.6	Low	179 Å²	179	167.7 Å²	167.7	84%	0.836	78%	0.783	S	S	*	*			trans	-109.4	4.1	-177	-69.1	-154.3	156	0	0	117.3
113	E	48.3	Very low	57	Low	257 Å²	257	169.5 Å²	169.5	100%	1.201	79%	0.792	S	S	*	*			trans	-102.5	0	174	-74	-154.8	151.8	0	0	116.7

Retrieved 113 of 113 residues in 23.3 ms (Link to these results)

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