A0A077ZCS8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZCS8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 95 aa.

						>A0A077ZCS8_TRITR|A0A077ZCS8
MISLPRCDDATAEMQRLQRGDVVISMSRCDDVTAEMWRREYGDVMISMPRCGDVSTEDVAMSARRRDDINAEVRRFHCREAEISERRCDGLNAEL
					

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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	26.9	Very low	30.5	Very low	225 Å²	225	141.5 Å²	141.5	100%	1.108	78%	0.782	S	S	*	*				0	97.8	0	-163.9	172.6	-155.6	0	0	107.1
2	I	24.8	Very low	31	Very low	120 Å²	120	136.3 Å²	136.3	62%	0.615	77%	0.771	S	S	*	*			trans	-99.5	117	175.2	-66.9	173.1	0	0	0	105.6	L4 L95	I2-L4 HydrophobicContact CG2-CD1 4.25Å; I2-L4 HydrophobicContact CG2-CG 4.31Å; I2-L95 HydrophobicContact CD1-CD1 3.63Å; I2-L95 HydrophobicContact CD1-CD2 3.75Å; I2-L95 HydrophobicContact CD1-CG 4.36Å; I2-L95 HydrophobicContact CG1-CD2 4.36Å
3	S	25.8	Very low	31.3	Very low	100 Å²	100	138.6 Å²	138.6	70%	0.699	77%	0.771	S	S	*	*			trans	-104.1	123.4	178	-61.1	0	0	0	0	108.2
4	L	32	Very low	31.9	Very low	154 Å²	154	138.6 Å²	138.6	81%	0.806	77%	0.765	S	S	*	*			trans	-133.1	151.1	172.6	-75.2	172.7	0	0	0	110.9	I2	I2-L4 HydrophobicContact CG2-CD1 4.25Å; I2-L4 HydrophobicContact CG2-CG 4.31Å
5	P	34.1	Very low	32.2	Very low	114 Å²	114	141.5 Å²	141.5	74%	0.74	77%	0.771	S	S	*	*			trans	-81.2	150.8	-140.8	30.9	-34.8	0	0	0	114.5	C7	P5-C7 PolarHBondContact O-N 3.12Å
6	R	29.2	Very low	32.6	Very low	230 Å²	230	144.9 Å²	144.9	87%	0.868	77%	0.769	S	S	*	*			trans	-65.8	119.9	177	-69.1	-170.2	174.6	-172	-1.6	110.7	D8	R6-D8 PolarHBondContact O-N 2.69Å; R6-D8 VanDerWaalsContact O-N 3.16Å
7	C	35.4	Very low	32.8	Very low	113 Å²	113	143.9 Å²	143.9	76%	0.764	76%	0.763	S	S	*	*			trans	-74.4	92.5	159.5	-73.6	0	0	0	0	108.5	P5	P5-C7 PolarHBondContact O-N 3.12Å
8	D	30.6	Very low	33	Very low	131 Å²	131	145.5 Å²	145.5	70%	0.701	77%	0.765	S	S	*	*			trans	-77.1	144.6	161.8	-110.5	-95.6	0	0	0	108.6	R6	R6-D8 PolarHBondContact O-N 2.69Å; R6-D8 VanDerWaalsContact O-N 3.16Å
9	D	30.7	Very low	32.9	Very low	158 Å²	158	150.1 Å²	150.1	85%	0.845	77%	0.771	S	S	*	*			trans	77.2	86.4	173.2	-107.6	-71.7	0	0	0	118.4
10	A	33.9	Very low	32.9	Very low	73 Å²	73	145.6 Å²	145.6	60%	0.603	76%	0.764	S	S	*	*			trans	-163.4	126.9	146.6	0	0	0	0	0	111.8	A12	A10-A12 PolarHBondContact O-N 2.73Å
11	T	31.9	Very low	33.3	Very low	139 Å²	139	146.7 Å²	146.7	85%	0.853	77%	0.77	S	S	*	*			trans	-57.3	121.1	-177	-43.8	0	0	0	0	112.5	E13	T11-E13 PolarHBondContact O-N 3.31Å
12	A	36.5	Very low	33.7	Very low	78 Å²	78	137.7 Å²	137.7	65%	0.645	73%	0.728	S	S	*	*			trans	-85	102.9	-171.9	0	0	0	0	0	113.5	A10 M14	A10-A12 PolarHBondContact O-N 2.73Å; A12-M14 PolarHBondContact O-N 3.02Å
13	E	35.4	Very low	34.3	Very low	167 Å²	167	138.4 Å²	138.4	78%	0.78	74%	0.737	S	S	*	*			trans	-86.9	92.4	165.7	-72.2	-78	115.8	0	0	109.6	T11 Q15	T11-E13 PolarHBondContact O-N 3.31Å; E13-Q15 PolarHBondContact O-N 3.3Å
14	M	38.9	Very low	34.9	Very low	139 Å²	139	135.8 Å²	135.8	69%	0.685	72%	0.715	S	S	*	*			trans	-77.3	93.4	176.5	-68.5	-174.8	-160.1	0	0	111.5	A12 R16	A12-M14 PolarHBondContact O-N 3.02Å; M14-R16 PolarHBondContact O-N 3.09Å
15	Q	36.7	Very low	35.2	Very low	181 Å²	181	133.6 Å²	133.6	85%	0.846	71%	0.713	S	S	*	*			trans	-83.4	92.9	166.6	-71.1	-171.7	28	0	0	110.6	E13 L17	E13-Q15 PolarHBondContact O-N 3.3Å; Q15-L17 PolarHBondContact O-N 2.8Å
16	R	38.8	Very low	35.5	Very low	196 Å²	196	133 Å²	133	74%	0.74	70%	0.701	S	S	*	*			trans	-78	110.1	171.4	-67.9	-179.5	176.4	176.9	-1.5	109.9	M14	M14-R16 PolarHBondContact O-N 3.09Å
17	L	35.9	Very low	36	Very low	128 Å²	128	126.7 Å²	126.7	67%	0.67	69%	0.692	S	S	*	*			trans	-93.6	97	166.2	-152.8	86.9	0	0	0	108.6	Q15 R19	Q15-L17 PolarHBondContact O-N 2.8Å; L17-R19 PolarHBondContact O-N 3.24Å
18	Q	36	Very low	36.2	Very low	173 Å²	173	128.7 Å²	128.7	81%	0.808	68%	0.684	S	S	*	*			trans	-76.8	104.6	175.4	-80.7	178.4	8.1	0	0	110.6
19	R	32.8	Very low	36.6	Very low	233 Å²	233	125.1 Å²	125.1	88%	0.879	67%	0.669	S	S	*	*			trans	-149.6	110.7	154.2	-85	-158	172.4	-115.4	0.1	109.3	L17	L17-R19 PolarHBondContact O-N 3.24Å
20	G	33	Very low	36.8	Very low	60 Å²	60	123.9 Å²	123.9	62%	0.619	66%	0.662	S	S	*	*	S	Bend	trans	76.5	108.9	165.6	0	0	0	0	0	115.5	V22	G20-V22 VanDerWaalsContact C-N 3.27Å; G20-V22 PolarHBondContact O-N 3.45Å
21	D	40.4	Very low	36.9	Very low	169 Å²	169	127.8 Å²	127.8	90%	0.904	67%	0.672	S	S	*	*	S	Bend	trans	31.3	7.6	157.8	-69.2	-88.3	0	0	0	124.4
22	V	35.6	Very low	37	Very low	36 Å²	36	125.5 Å²	125.5	22%	0.218	66%	0.658	C	S	.	*			trans	-140.7	118.8	176.8	-179.1	0	0	0	0	111.9	G20 I24 D43 V44	G20-V22 VanDerWaalsContact C-N 3.27Å; G20-V22 PolarHBondContact O-N 3.45Å; V22-I24 HydrophobicContact CG1-CD1 4.41Å; V22-I24 HydrophobicContact CG1-CG1 4.07Å; V22-D43 WeakPolarHBondContact CB-O 3.41Å; V22-D43 WeakPolarHBondContact CG2-O 3.42Å; V22-V44 HydrophobicContact CG1-CG1 4.34Å; V22-V44 HydrophobicContact CG2-CG2 4.29Å
23	V	37.4	Very low	36.9	Very low	134 Å²	134	126.9 Å²	126.9	81%	0.812	66%	0.659	S	S	*	*			trans	-105.9	119.9	178.8	178.6	0	0	0	0	109.1
24	I	38.7	Very low	37	Very low	46 Å²	46	121.4 Å²	121.4	24%	0.236	64%	0.642	C	S	.	*			trans	-122.7	120.7	171.5	-55.8	-145.8	0	0	0	109.7	V22 M45 V59	V22-I24 HydrophobicContact CG1-CD1 4.41Å; V22-I24 HydrophobicContact CG1-CG1 4.07Å; I24-M45 WeakPolarHBondContact CB-O 3.09Å; I24-M45 WeakPolarHBondContact CD1-O 3.17Å; I24-M45 WeakPolarHBondContact CG1-O 3.43Å; I24-V59 HydrophobicContact CD1-CG2 4Å
25	S	37.9	Very low	37	Very low	107 Å²	107	118.9 Å²	118.9	75%	0.748	63%	0.628	S	S	*	*			trans	-80.8	138.1	177.8	-81.5	0	0	0	0	111.5
26	M	40.6	Very low	37.2	Very low	103 Å²	103	115.3 Å²	115.3	51%	0.507	61%	0.613	S	S	.	*			trans	-103.4	121.7	174.3	-74.1	167.1	26.3	0	0	109.8	R28	M26-R28 HydrophobicContact CE-CG 4.32Å
27	S	40	Very low	37.4	Very low	97 Å²	97	111.6 Å²	111.6	68%	0.678	60%	0.599	S	S	*	*			trans	-100.3	109.8	156.6	-58.6	0	0	0	0	106.7
28	R	39.6	Very low	37.9	Very low	155 Å²	155	114.7 Å²	114.7	59%	0.585	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-82.2	117.4	174.1	-80.3	-173	170.4	-170.8	-1.7	108.5	M26	M26-R28 HydrophobicContact CE-CG 4.32Å
29	C	37.3	Very low	38.4	Very low	56 Å²	56	112.7 Å²	112.7	38%	0.378	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-77.5	116.3	157.4	-68.5	0	0	0	0	107.4
30	D	36.4	Very low	39	Very low	132 Å²	132	110.2 Å²	110.2	71%	0.706	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.6	143.4	166.4	-107.8	-116	0	0	0	109.6
31	D	35.4	Very low	39.7	Very low	154 Å²	154	110.6 Å²	110.6	82%	0.824	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	92.6	5.9	167.3	-112.4	-85.6	0	0	0	122.2
32	V	33.1	Very low	39.9	Very low	91 Å²	91	105.1 Å²	105.1	55%	0.552	55%	0.553	S	S	*	*	S	Bend	trans	-140.6	107.7	167	-160.8	0	0	0	0	111	A34 R50	V32-A34 VanDerWaalsContact C-N 3.35Å; V32-A34 PolarHBondContact O-N 2.55Å; V32-R50 WeakPolarHBondContact O-CD 3.33Å
33	T	35.2	Very low	40.4	Very low	107 Å²	107	109.1 Å²	109.1	66%	0.656	57%	0.572	S	S	*	*			trans	1.1	76.5	168	-32.5	0	0	0	0	113.6	E35 R50	T33-E35 PolarHBondContact O-N 3.21Å; T33-R50 WeakPolarHBondContact O-CD 3.02Å; T33-R50 PolarHBondContact O-NE 2.63Å; T33-R50 PolarHBondContact O-NH1 3.24Å; T33-R50 PolarHBondContact O-NH2 3.01Å
34	A	37.1	Very low	40.5	Very low	52 Å²	52	103.2 Å²	103.2	43%	0.43	54%	0.537	S	S	.	.			trans	-70.1	84.9	-177.1	0	0	0	0	0	108.7	V32 M36	V32-A34 VanDerWaalsContact C-N 3.35Å; V32-A34 PolarHBondContact O-N 2.55Å; A34-M36 VanDerWaalsContact C-N 3.29Å; A34-M36 PolarHBondContact O-N 3.43Å
35	E	39	Very low	40.8	Very low	86 Å²	86	104.7 Å²	104.7	40%	0.402	54%	0.544	S	S	.	.			trans	-64.6	94.3	171.9	-81.1	-174.4	77.5	0	0	107.7	T33 W37 R50	T33-E35 PolarHBondContact O-N 3.21Å; E35-W37 VanDerWaalsContact C-N 3.34Å; E35-W37 VanDerWaalsContact O-CD1 3.3Å; E35-W37 PolarHBondContact O-N 3.39Å; E35-R50 IonicContact OE2-NH2 3.06Å; E35-R50 PolarHBondContact OE2-NH2 2.94Å
36	M	41.8	Very low	41.2	Very low	106 Å²	106	100.8 Å²	100.8	52%	0.522	51%	0.514	S	S	.	.			trans	-67.8	93	171.5	-72.9	179.6	-70.6	0	0	108.6	A34 R38	A34-M36 VanDerWaalsContact C-N 3.29Å; A34-M36 PolarHBondContact O-N 3.43Å; M36-R38 VanDerWaalsContact C-N 3.33Å; M36-R38 PolarHBondContact O-N 3.23Å
37	W	42.7	Very low	41.4	Very low	119 Å²	119	97.7 Å²	97.7	45%	0.451	50%	0.503	S	S	.	.			trans	-76.3	85.4	170	-73.8	88.3	0	0	0	109.8	E35 R39 M48 F76	E35-W37 VanDerWaalsContact C-N 3.34Å; E35-W37 VanDerWaalsContact O-CD1 3.3Å; E35-W37 PolarHBondContact O-N 3.39Å; W37-R39 VanDerWaalsContact C-N 3.31Å; W37-R39 PolarHBondContact O-N 3.09Å; W37-M48 HydrophobicContact CB-CE 4.25Å; W37-M48 HydrophobicContact CG-CE 4.21Å; W37-F76 AromaticContact NE1-CE2 3.42Å
38	R	46.4	Very low	41.7	Very low	192 Å²	192	95.6 Å²	95.6	73%	0.725	48%	0.483	S	S	*	.			trans	-74.1	87.1	165	-73.8	-172.2	173	165.7	-0.5	108.8	M36	M36-R38 VanDerWaalsContact C-N 3.33Å; M36-R38 PolarHBondContact O-N 3.23Å
39	R	45.5	Very low	42.1	Very low	132 Å²	132	91 Å²	91	50%	0.498	47%	0.473	S	S	.	.			trans	-96.2	116.2	164.6	-127.3	-176.2	-163.3	-178.4	12.6	109.2	W37 Y41 E72	W37-R39 VanDerWaalsContact C-N 3.31Å; W37-R39 PolarHBondContact O-N 3.09Å; R39-Y41 HydrophobicContact CB-CD2 4.23Å; R39-Y41 HydrophobicContact CB-CE2 4.13Å; R39-Y41 PolarHBondContact O-N 3.48Å; R39-Y41 VanDerWaalsContact O-N 3.09Å; R39-E72 IonicContact CZ-OE1 3.61Å; R39-E72 VanDerWaalsContact NH1-CD 3.29Å; R39-E72 IonicContact NH1-OE1 3.24Å; R39-E72 PolarHBondContact NH1-OE1 3.47Å; R39-E72 IonicContact NH1-OE2 2.63Å; R39-E72 PolarHBondContact NH1-OE2 3.33Å
40	E	46.7	Very low	42.1	Very low	181 Å²	181	90.6 Å²	90.6	85%	0.846	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	92.6	179	-161.4	175.3	109.3	0	0	108.7	G42	E40-G42 PolarHBondContact O-N 2.9Å; E40-G42 VanDerWaalsContact O-N 3.12Å
41	Y	46.3	Very low	42.3	Very low	67 Å²	67	89.9 Å²	89.9	26%	0.263	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	60.2	172.7	-87.1	-77.5	0	0	0	110.3	R39 D43 V44 I46 R65 E72	R39-Y41 HydrophobicContact CB-CD2 4.23Å; R39-Y41 HydrophobicContact CB-CE2 4.13Å; R39-Y41 PolarHBondContact O-N 3.48Å; R39-Y41 VanDerWaalsContact O-N 3.09Å; Y41-D43 PolarHBondContact O-N 3.15Å; Y41-V44 PolarHBondContact N-O 3Å; Y41-V44 PolarHBondContact O-N 2.84Å; Y41-I46 HydrophobicContact CD2-CD1 4.18Å; Y41-R65 PolarHBondContact O-NH1 3.25Å; Y41-E72 PolarHBondContact OH-OE2 3.49Å
42	G	45	Very low	42.5	Very low	55 Å²	55	85.6 Å²	85.6	57%	0.567	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	-34.7	172.5	0	0	0	0	0	116.7	E40	E40-G42 PolarHBondContact O-N 2.9Å; E40-G42 VanDerWaalsContact O-N 3.12Å
43	D	46.1	Very low	43	Very low	119 Å²	119	88.2 Å²	88.2	64%	0.636	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-157	-1.2	-177.9	-61.2	-78.9	0	0	0	111.8	V22 Y41	V22-D43 WeakPolarHBondContact CB-O 3.41Å; V22-D43 WeakPolarHBondContact CG2-O 3.42Å; Y41-D43 PolarHBondContact O-N 3.15Å
44	V	39.8	Very low	43.3	Very low	10 Å²	10	85.6 Å²	85.6	6%	0.061	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	118.9	-171.6	-177.2	0	0	0	0	109.8	V22 Y41 I46	V22-V44 HydrophobicContact CG1-CG1 4.34Å; V22-V44 HydrophobicContact CG2-CG2 4.29Å; Y41-V44 PolarHBondContact N-O 3Å; Y41-V44 PolarHBondContact O-N 2.84Å; V44-I46 HydrophobicContact CG1-CD1 4.32Å; V44-I46 HydrophobicContact CG1-CG1 3.84Å
45	M	45.2	Very low	43.5	Very low	77 Å²	77	86.7 Å²	86.7	38%	0.379	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	114.2	171.1	-71.3	-166	-64.2	0	0	109.7	I24	I24-M45 WeakPolarHBondContact CB-O 3.09Å; I24-M45 WeakPolarHBondContact CD1-O 3.17Å; I24-M45 WeakPolarHBondContact CG1-O 3.43Å
46	I	47	Very low	43.9	Very low	25 Å²	25	83.6 Å²	83.6	13%	0.128	45%	0.446	C	S	.	.			trans	-102.7	126	178.9	-54.5	150	0	0	0	109.4	Y41 V44 I69	Y41-I46 HydrophobicContact CD2-CD1 4.18Å; V44-I46 HydrophobicContact CG1-CD1 4.32Å; V44-I46 HydrophobicContact CG1-CG1 3.84Å; I46-I69 HydrophobicContact CD1-CB 4.2Å; I46-I69 HydrophobicContact CD1-CD1 3.17Å; I46-I69 HydrophobicContact CD1-CG1 3.32Å; I46-I69 HydrophobicContact CD1-CG2 3.82Å; I46-I69 HydrophobicContact CG1-CD1 4.08Å; I46-I69 HydrophobicContact CG2-CG2 4.24Å
47	S	44.5	Very low	44	Very low	39 Å²	39	85.9 Å²	85.9	27%	0.273	46%	0.455	S	S	.	.			trans	-111	112.1	172.7	-64.6	0	0	0	0	108	P49	S47-P49 WeakPolarHBondContact O-CD 3.5Å
48	M	46.3	Very low	43.9	Very low	53 Å²	53	87.9 Å²	87.9	26%	0.261	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-80.2	118.3	172.8	-78.4	126.2	49.6	0	0	109.8	W37 R50 V54 V73 F76	W37-M48 HydrophobicContact CB-CE 4.25Å; W37-M48 HydrophobicContact CG-CE 4.21Å; M48-R50 PolarHBondContact O-N 3.5Å; M48-V54 HydrophobicContact CG-CG2 4.39Å; M48-V73 HydrophobicContact CG-CG2 3.95Å; M48-V73 HydrophobicContact SD-CG2 4.08Å; M48-F76 HydrophobicContact CE-CD1 4.32Å; M48-F76 HydrophobicContact CE-CG 4.31Å
49	P	46.7	Very low	44.1	Very low	59 Å²	59	80.7 Å²	80.7	38%	0.383	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-70.7	124.8	161.6	30.1	-29.3	0	0	0	107.4	S47 C51	S47-P49 WeakPolarHBondContact O-CD 3.5Å; P49-C51 PolarHBondContact O-N 2.7Å
50	R	38.9	Very low	44.1	Very low	47 Å²	47	79.9 Å²	79.9	18%	0.177	47%	0.473	C	S	.	.	S	Bend	trans	-63.4	136.4	162.2	-79.8	-170.4	170.6	-167.6	2.6	107.7	V32 T33 E35 M48 E80	V32-R50 WeakPolarHBondContact O-CD 3.33Å; T33-R50 WeakPolarHBondContact O-CD 3.02Å; T33-R50 PolarHBondContact O-NE 2.63Å; T33-R50 PolarHBondContact O-NH1 3.24Å; T33-R50 PolarHBondContact O-NH2 3.01Å; E35-R50 IonicContact OE2-NH2 3.06Å; E35-R50 PolarHBondContact OE2-NH2 2.94Å; M48-R50 PolarHBondContact O-N 3.5Å; R50-E80 IonicContact CZ-OE1 3.76Å; R50-E80 IonicContact CZ-OE2 2.98Å; R50-E80 IonicContact NE-OE2 3.33Å; R50-E80 PolarHBondContact NE-OE2 2.83Å; R50-E80 IonicContact NH1-OE2 3.55Å; R50-E80 IonicContact NH2-OE1 2.97Å; R50-E80 PolarHBondContact NH2-OE1 2.79Å; R50-E80 IonicContact NH2-OE2 2.75Å; R50-E80 PolarHBondContact NH2-OE2 3.17Å
51	C	40.2	Very low	44.6	Very low	117 Å²	117	72.7 Å²	72.7	79%	0.791	44%	0.44	S	S	*	.	S	Bend	trans	92.5	84.5	177.6	-136.8	0	0	0	0	115.8	P49	P49-C51 PolarHBondContact O-N 2.7Å
52	G	39.5	Very low	45	Very low	63 Å²	63	73.5 Å²	73.5	65%	0.649	46%	0.456	S	S	*	.	S	Bend	trans	76.1	116.7	157.9	0	0	0	0	0	116.1
53	D	42.8	Very low	45.6	Very low	147 Å²	147	73.6 Å²	73.6	79%	0.786	45%	0.451	S	S	*	.			trans	72.8	98.7	171.2	-68	-78.7	0	0	0	117.6
54	V	42.2	Very low	46.1	Very low	52 Å²	52	77.9 Å²	77.9	32%	0.315	46%	0.458	S	S	.	.			trans	-93.2	86	157.5	178.2	0	0	0	0	107.7	M48 T56 V73	M48-V54 HydrophobicContact CG-CG2 4.39Å; V54-T56 HydrophobicContact CG1-CG2 3.99Å; V54-T56 PolarHBondContact O-N 2.95Å; V54-V73 HydrophobicContact CB-CG1 4.3Å; V54-V73 HydrophobicContact CG1-CG2 4.36Å; V54-V73 HydrophobicContact CG2-CG1 3.86Å; V54-V73 HydrophobicContact CG2-CG2 4.22Å
55	S	41	Very low	46.9	Very low	74 Å²	74	81.3 Å²	81.3	52%	0.517	47%	0.47	S	S	.	.			trans	-82.3	97.2	164.9	-99.7	0	0	0	0	109.1	E57	S55-E57 PolarHBondContact O-N 2.87Å; S55-E57 PolarHBondContact OG-OE2 3.19Å; S55-E57 VanDerWaalsContact OG-OE2 3.12Å
56	T	46.5	Very low	47.5	Very low	21 Å²	21	82.6 Å²	82.6	13%	0.129	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-68.6	13.1	167	39.9	0	0	0	0	114	V54 D58 V59 M61 R66 I69	V54-T56 HydrophobicContact CG1-CG2 3.99Å; V54-T56 PolarHBondContact O-N 2.95Å; T56-D58 PolarHBondContact O-N 3.37Å; T56-V59 PolarHBondContact O-N 3.05Å; T56-M61 HydrophobicContact CG2-CE 3.21Å; T56-R66 HydrophobicContact CG2-CG 4.45Å; T56-R66 WeakPolarHBondContact OG1-CG 2.84Å; T56-I69 HydrophobicContact CG2-CG2 4.25Å
57	E	44.1	Very low	48.3	Very low	155 Å²	155	85.3 Å²	85.3	72%	0.724	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-69.8	-19.6	-175	-63.5	-171.5	99.7	0	0	113	S55	S55-E57 PolarHBondContact O-N 2.87Å; S55-E57 PolarHBondContact OG-OE2 3.19Å; S55-E57 VanDerWaalsContact OG-OE2 3.12Å
58	D	41.8	Very low	49.2	Very low	161 Å²	161	87.8 Å²	87.8	86%	0.861	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-99.4	-2.3	-178.9	-104.5	-91.6	0	0	0	114.7	T56	T56-D58 PolarHBondContact O-N 3.37Å
59	V	49.2	Very low	49.9	Very low	40 Å²	40	85.6 Å²	85.6	24%	0.242	49%	0.485	C	S	.	.	S	Bend	trans	-96	117.8	176.7	-170	0	0	0	0	108	I24 T56 M61	I24-V59 HydrophobicContact CD1-CG2 4Å; T56-V59 PolarHBondContact O-N 3.05Å; V59-M61 HydrophobicContact CB-CE 4.28Å; V59-M61 HydrophobicContact CB-CG 4.03Å; V59-M61 HydrophobicContact CB-SD 4.15Å; V59-M61 HydrophobicContact CG1-CB 4.11Å; V59-M61 HydrophobicContact CG1-CG 3.94Å; V59-M61 HydrophobicContact CG1-SD 3.96Å; V59-M61 PolarHBondContact O-N 2.92Å
60	A	46.4	Very low	50.6	Low	115 Å²	115	85.2 Å²	85.2	95%	0.95	48%	0.48	S	S	*	.			trans	-65	73.7	169.5	0	0	0	0	0	110.2
61	M	56.6	Low	51.9	Low	31 Å²	31	84.9 Å²	84.9	15%	0.153	49%	0.487	C	S	.	.			trans	-127.7	148.3	176.6	61.6	179.7	-178.2	0	0	109.7	T56 V59 A63 R65 R66 I69	T56-M61 HydrophobicContact CG2-CE 3.21Å; V59-M61 HydrophobicContact CB-CE 4.28Å; V59-M61 HydrophobicContact CB-CG 4.03Å; V59-M61 HydrophobicContact CB-SD 4.15Å; V59-M61 HydrophobicContact CG1-CB 4.11Å; V59-M61 HydrophobicContact CG1-CG 3.94Å; V59-M61 HydrophobicContact CG1-SD 3.96Å; V59-M61 PolarHBondContact O-N 2.92Å; M61-A63 PolarHBondContact O-N 3.41Å; M61-R65 HydrophobicContact CB-CB 4.33Å; M61-R65 HydrophobicContact SD-CB 4.34Å; M61-R66 HydrophobicContact CE-CB 3.82Å; M61-R66 HydrophobicContact CE-CG 3.96Å; M61-I69 HydrophobicContact CE-CD1 3.61Å; M61-I69 HydrophobicContact SD-CD1 3.33Å; M61-I69 WeakPolarHBondContact SD-CD1 3.33Å
62	S	54.7	Low	53	Low	84 Å²	84	82.1 Å²	82.1	59%	0.587	46%	0.463	S	S	*	.			trans	-56.4	142.3	179.9	-49.1	0	0	0	0	110.7	R64 R65 R66	S62-R64 PolarHBondContact O-N 2.87Å; S62-R65 WeakPolarHBondContact O-CB 3.01Å; S62-R65 PolarHBondContact O-N 2.96Å; S62-R66 PolarHBondContact O-N 2.88Å; S62-R66 VanDerWaalsContact O-N 3.09Å
63	A	57.7	Low	54.1	Low	57 Å²	57	80.4 Å²	80.4	47%	0.471	44%	0.44	S	S	.	.	H	α-helix	trans	-47.5	-37.4	178.1	0	0	0	0	0	112.7	M61 R66 D67	M61-A63 PolarHBondContact O-N 3.41Å; A63-R66 VanDerWaalsContact O-CB 3.26Å; A63-R66 WeakPolarHBondContact O-CB 3.34Å; A63-R66 PolarHBondContact O-N 3.49Å; A63-D67 PolarHBondContact O-N 2.9Å
64	R	57.3	Low	55	Low	208 Å²	208	78.7 Å²	78.7	79%	0.785	42%	0.422	S	S	*	.	H	α-helix	trans	-57.7	-49.9	173.2	-72.4	-169.7	174.7	-176.3	-1.3	114	S62 R66 D67 D68	S62-R64 PolarHBondContact O-N 2.87Å; R64-R66 VanDerWaalsContact C-N 3.26Å; R64-R66 PolarHBondContact O-N 2.89Å; R64-D67 PolarHBondContact O-N 3.46Å; R64-D67 VanDerWaalsContact O-N 3.15Å; R64-D68 VanDerWaalsContact O-CG 3.31Å; R64-D68 PolarHBondContact O-N 3.12Å; R64-D68 VanDerWaalsContact O-OD2 3.09Å
65	R	57.1	Low	56	Low	83 Å²	83	84.8 Å²	84.8	31%	0.313	44%	0.44	S	S	.	.	H	α-helix	trans	-61.8	-40	177.8	-77.5	-175.3	175	-145.3	1.2	110.4	Y41 M61 S62 D67 D68 I69	Y41-R65 PolarHBondContact O-NH1 3.25Å; M61-R65 HydrophobicContact CB-CB 4.33Å; M61-R65 HydrophobicContact SD-CB 4.34Å; S62-R65 WeakPolarHBondContact O-CB 3.01Å; S62-R65 PolarHBondContact O-N 2.96Å; R65-D67 VanDerWaalsContact C-N 3.35Å; R65-D67 PolarHBondContact O-N 3.48Å; R65-D68 PolarHBondContact O-N 3.39Å; R65-I69 WeakPolarHBondContact O-CB 3.45Å; R65-I69 WeakPolarHBondContact O-CD1 3.49Å; R65-I69 WeakPolarHBondContact O-CG1 3.31Å; R65-I69 PolarHBondContact O-N 3.06Å
66	R	57.6	Low	56.8	Low	103 Å²	103	83.2 Å²	83.2	39%	0.389	42%	0.423	S	S	.	.	H	α-helix	trans	-57	-47.9	173.7	-171.4	-170.8	64.9	-179	-0.4	111.9	T56 M61 S62 A63 R64 I69 N70	T56-R66 HydrophobicContact CG2-CG 4.45Å; T56-R66 WeakPolarHBondContact OG1-CG 2.84Å; M61-R66 HydrophobicContact CE-CB 3.82Å; M61-R66 HydrophobicContact CE-CG 3.96Å; S62-R66 PolarHBondContact O-N 2.88Å; S62-R66 VanDerWaalsContact O-N 3.09Å; A63-R66 VanDerWaalsContact O-CB 3.26Å; A63-R66 WeakPolarHBondContact O-CB 3.34Å; A63-R66 PolarHBondContact O-N 3.49Å; R64-R66 VanDerWaalsContact C-N 3.26Å; R64-R66 PolarHBondContact O-N 2.89Å; R66-I69 PolarHBondContact O-N 2.79Å; R66-N70 WeakPolarHBondContact O-CB 3.19Å; R66-N70 PolarHBondContact O-N 2.96Å
67	D	62.3	Low	57.4	Low	82 Å²	82	87.8 Å²	87.8	44%	0.439	44%	0.443	S	S	.	.	H	α-helix	trans	-65.8	-39.5	179.1	-69	-50.4	0	0	0	112	A63 R64 R65 N70 A71	A63-D67 PolarHBondContact O-N 2.9Å; R64-D67 PolarHBondContact O-N 3.46Å; R64-D67 VanDerWaalsContact O-N 3.15Å; R65-D67 VanDerWaalsContact C-N 3.35Å; R65-D67 PolarHBondContact O-N 3.48Å; D67-N70 PolarHBondContact O-N 3.03Å; D67-A71 VanDerWaalsContact O-CB 3.31Å; D67-A71 WeakPolarHBondContact O-CB 3.26Å; D67-A71 PolarHBondContact O-N 2.7Å
68	D	64.2	Low	58.1	Low	92 Å²	92	81.5 Å²	81.5	49%	0.492	42%	0.416	S	S	.	.	H	α-helix	trans	-60.8	-48.2	174.9	-68.8	-44.3	0	0	0	111.3	R64 R65 A71 E72	R64-D68 VanDerWaalsContact O-CG 3.31Å; R64-D68 PolarHBondContact O-N 3.12Å; R64-D68 VanDerWaalsContact O-OD2 3.09Å; R65-D68 PolarHBondContact O-N 3.39Å; D68-A71 WeakPolarHBondContact O-CB 3.43Å; D68-A71 PolarHBondContact O-N 3.45Å; D68-E72 WeakPolarHBondContact O-CG 3.13Å; D68-E72 PolarHBondContact O-N 3.33Å
69	I	61.2	Low	58.9	Low	7 Å²	7	83.7 Å²	83.7	4%	0.036	41%	0.412	C	S	.	.	H	α-helix	trans	-65.7	-45	-179.7	-65.1	159.7	0	0	0	110.5	I46 T56 M61 R65 R66 A71 E72 V73	I46-I69 HydrophobicContact CD1-CB 4.2Å; I46-I69 HydrophobicContact CD1-CD1 3.17Å; I46-I69 HydrophobicContact CD1-CG1 3.32Å; I46-I69 HydrophobicContact CD1-CG2 3.82Å; I46-I69 HydrophobicContact CG1-CD1 4.08Å; I46-I69 HydrophobicContact CG2-CG2 4.24Å; T56-I69 HydrophobicContact CG2-CG2 4.25Å; M61-I69 HydrophobicContact CE-CD1 3.61Å; M61-I69 HydrophobicContact SD-CD1 3.33Å; M61-I69 WeakPolarHBondContact SD-CD1 3.33Å; R65-I69 WeakPolarHBondContact O-CB 3.45Å; R65-I69 WeakPolarHBondContact O-CD1 3.49Å; R65-I69 WeakPolarHBondContact O-CG1 3.31Å; R65-I69 PolarHBondContact O-N 3.06Å; R66-I69 PolarHBondContact O-N 2.79Å; I69-A71 VanDerWaalsContact C-N 3.27Å; I69-A71 PolarHBondContact O-N 3.07Å; I69-E72 PolarHBondContact O-N 3.4Å; I69-E72 VanDerWaalsContact O-N 3.12Å; I69-V73 HydrophobicContact CG2-CG2 4.35Å; I69-V73 WeakPolarHBondContact O-CG2 3.43Å; I69-V73 PolarHBondContact O-N 3.15Å
70	N	61.9	Low	59.2	Low	51 Å²	51	86.1 Å²	86.1	27%	0.273	42%	0.421	S	S	.	.	H	α-helix	trans	-59.2	-41.5	175.6	-177.3	28.8	0	0	0	110.7	R66 D67 E72 V73 R74	R66-N70 WeakPolarHBondContact O-CB 3.19Å; R66-N70 PolarHBondContact O-N 2.96Å; D67-N70 PolarHBondContact O-N 3.03Å; N70-E72 PolarHBondContact O-N 3.39Å; N70-V73 PolarHBondContact O-N 2.78Å; N70-R74 PolarHBondContact ND2-NE 2.92Å; N70-R74 PolarHBondContact ND2-NH2 2.91Å; N70-R74 WeakPolarHBondContact O-CB 3.39Å; N70-R74 WeakPolarHBondContact O-CD 3.47Å; N70-R74 WeakPolarHBondContact O-CG 3.38Å; N70-R74 PolarHBondContact O-N 3.39Å; N70-R74 PolarHBondContact OD1-NE 3.34Å
71	A	66	Low	59.6	Low	40 Å²	40	82.9 Å²	82.9	33%	0.331	39%	0.394	S	S	.	.	H	α-helix	trans	-62.7	-39.7	174.4	0	0	0	0	0	112.5	D67 D68 I69 R75	D67-A71 VanDerWaalsContact O-CB 3.31Å; D67-A71 WeakPolarHBondContact O-CB 3.26Å; D67-A71 PolarHBondContact O-N 2.7Å; D68-A71 WeakPolarHBondContact O-CB 3.43Å; D68-A71 PolarHBondContact O-N 3.45Å; I69-A71 VanDerWaalsContact C-N 3.27Å; I69-A71 PolarHBondContact O-N 3.07Å; A71-R75 WeakPolarHBondContact O-CG 3.47Å; A71-R75 PolarHBondContact O-N 3.47Å
72	E	63.1	Low	59.4	Low	59 Å²	59	90.5 Å²	90.5	28%	0.276	43%	0.429	S	S	.	.	H	α-helix	trans	-68.2	-44.1	176.1	-67.5	-151.1	98.5	0	0	112.9	R39 Y41 D68 I69 N70 R74 R75 F76	R39-E72 IonicContact CZ-OE1 3.61Å; R39-E72 VanDerWaalsContact NH1-CD 3.29Å; R39-E72 IonicContact NH1-OE1 3.24Å; R39-E72 PolarHBondContact NH1-OE1 3.47Å; R39-E72 IonicContact NH1-OE2 2.63Å; R39-E72 PolarHBondContact NH1-OE2 3.33Å; Y41-E72 PolarHBondContact OH-OE2 3.49Å; D68-E72 WeakPolarHBondContact O-CG 3.13Å; D68-E72 PolarHBondContact O-N 3.33Å; I69-E72 PolarHBondContact O-N 3.4Å; I69-E72 VanDerWaalsContact O-N 3.12Å; N70-E72 PolarHBondContact O-N 3.39Å; E72-R74 VanDerWaalsContact C-N 3.28Å; E72-R74 PolarHBondContact O-N 3.06Å; E72-R75 WeakPolarHBondContact O-CB 3.39Å; E72-R75 PolarHBondContact O-N 3.39Å; E72-R75 VanDerWaalsContact O-N 3.15Å; E72-F76 PolarHBondContact O-N 3Å
73	V	62.1	Low	59.2	Low	27 Å²	27	88.3 Å²	88.3	16%	0.164	41%	0.41	C	S	.	.	H	α-helix	trans	-59.4	-42.8	175.6	171.4	0	0	0	0	110.4	M48 V54 I69 N70 R75 F76 H77	M48-V73 HydrophobicContact CG-CG2 3.95Å; M48-V73 HydrophobicContact SD-CG2 4.08Å; V54-V73 HydrophobicContact CB-CG1 4.3Å; V54-V73 HydrophobicContact CG1-CG2 4.36Å; V54-V73 HydrophobicContact CG2-CG1 3.86Å; V54-V73 HydrophobicContact CG2-CG2 4.22Å; I69-V73 HydrophobicContact CG2-CG2 4.35Å; I69-V73 WeakPolarHBondContact O-CG2 3.43Å; I69-V73 PolarHBondContact O-N 3.15Å; N70-V73 PolarHBondContact O-N 2.78Å; V73-R75 PolarHBondContact O-N 3.24Å; V73-F76 PolarHBondContact O-N 3.32Å; V73-H77 PolarHBondContact O-N 2.97Å
74	R	61.6	Low	58.8	Low	111 Å²	111	89.7 Å²	89.7	42%	0.419	42%	0.417	S	S	.	.	H	α-helix	trans	-59.3	-46.8	174.5	-72.8	165.4	-175.1	-142.9	-12.8	111.6	N70 E72 F76 H77 C78 N92	N70-R74 PolarHBondContact ND2-NE 2.92Å; N70-R74 PolarHBondContact ND2-NH2 2.91Å; N70-R74 WeakPolarHBondContact O-CB 3.39Å; N70-R74 WeakPolarHBondContact O-CD 3.47Å; N70-R74 WeakPolarHBondContact O-CG 3.38Å; N70-R74 PolarHBondContact O-N 3.39Å; N70-R74 PolarHBondContact OD1-NE 3.34Å; E72-R74 VanDerWaalsContact C-N 3.28Å; E72-R74 PolarHBondContact O-N 3.06Å; R74-F76 VanDerWaalsContact C-N 3.3Å; R74-F76 PolarHBondContact O-N 2.96Å; R74-H77 PolarHBondContact O-N 2.75Å; R74-C78 WeakPolarHBondContact O-CB 3.38Å; R74-C78 PolarHBondContact O-N 3.33Å; R74-C78 PolarHBondContact O-SG 3.44Å; R74-N92 PolarHBondContact NH1-ND2 2.92Å; R74-N92 PolarHBondContact NH1-OD1 3.31Å
75	R	62.7	Low	58.6	Low	180 Å²	180	88 Å²	88	68%	0.679	42%	0.417	S	S	*	.	H	α-helix	trans	-60.1	-40.3	176.6	-73.8	174.2	-175.8	174.6	3.1	112.1	A71 E72 V73 C78 R79	A71-R75 WeakPolarHBondContact O-CG 3.47Å; A71-R75 PolarHBondContact O-N 3.47Å; E72-R75 WeakPolarHBondContact O-CB 3.39Å; E72-R75 PolarHBondContact O-N 3.39Å; E72-R75 VanDerWaalsContact O-N 3.15Å; V73-R75 PolarHBondContact O-N 3.24Å; R75-C78 WeakPolarHBondContact O-CB 3.48Å; R75-C78 PolarHBondContact O-N 3Å; R75-R79 WeakPolarHBondContact O-CB 3.12Å; R75-R79 PolarHBondContact O-N 3.27Å
76	F	59.6	Low	58.2	Low	41 Å²	41	94.8 Å²	94.8	18%	0.18	44%	0.443	C	S	.	.	H	α-helix	trans	-65.1	-47.9	177.3	-172.9	-96.1	0	0	0	111.5	W37 M48 E72 V73 R74 C78 R79 E80	W37-F76 AromaticContact NE1-CE2 3.42Å; M48-F76 HydrophobicContact CE-CD1 4.32Å; M48-F76 HydrophobicContact CE-CG 4.31Å; E72-F76 PolarHBondContact O-N 3Å; V73-F76 PolarHBondContact O-N 3.32Å; R74-F76 VanDerWaalsContact C-N 3.3Å; R74-F76 PolarHBondContact O-N 2.96Å; F76-C78 VanDerWaalsContact C-N 3.28Å; F76-C78 PolarHBondContact O-N 3.28Å; F76-R79 WeakPolarHBondContact O-CB 3.38Å; F76-R79 PolarHBondContact O-N 3.48Å; F76-E80 HydrophobicContact CD1-CG 4.01Å; F76-E80 HydrophobicContact CE1-CG 3.56Å; F76-E80 VanDerWaalsContact CE1-OE2 3.23Å; F76-E80 WeakPolarHBondContact CE1-OE2 3.46Å; F76-E80 HydrophobicContact CE2-CG 4.22Å; F76-E80 VanDerWaalsContact CZ-CD 3.49Å; F76-E80 HydrophobicContact CZ-CG 3.68Å; F76-E80 WeakPolarHBondContact CZ-OE2 2.87Å; F76-E80 WeakPolarHBondContact O-CG 3.23Å; F76-E80 PolarHBondContact O-N 3.12Å
77	H	58.1	Low	57.8	Low	117 Å²	117	98.4 Å²	98.4	54%	0.542	46%	0.457	S	S	.	.	H	α-helix	trans	-60.3	-38.8	177.1	-167.7	-76.8	0	0	0	112.1	V73 R74 A81	V73-H77 PolarHBondContact O-N 2.97Å; R74-H77 PolarHBondContact O-N 2.75Å; H77-A81 WeakPolarHBondContact O-CB 3.38Å; H77-A81 PolarHBondContact O-N 3.36Å
78	C	58.1	Low	57.3	Low	22 Å²	22	95.6 Å²	95.6	15%	0.149	44%	0.443	C	S	.	.	H	α-helix	trans	-62.4	-41.2	173	-73.8	0	0	0	0	113.3	R74 R75 F76 I83 C88	R74-C78 WeakPolarHBondContact O-CB 3.38Å; R74-C78 PolarHBondContact O-N 3.33Å; R74-C78 PolarHBondContact O-SG 3.44Å; R75-C78 WeakPolarHBondContact O-CB 3.48Å; R75-C78 PolarHBondContact O-N 3Å; F76-C78 VanDerWaalsContact C-N 3.28Å; F76-C78 PolarHBondContact O-N 3.28Å; C78-I83 PolarHBondContact O-N 3.39Å; C78-C88 HydrophobicContact CB-CB 4.17Å; C78-C88 WeakPolarHBondContact CB-SG 3.34Å; C78-C88 WeakPolarHBondContact SG-CB 3.42Å; C78-C88 CovalentContact SG-SG 1.99Å; C78-C88 PolarHBondContact SG-SG 3.44Å
79	R	59.5	Low	56.6	Low	208 Å²	208	97.1 Å²	97.1	79%	0.785	45%	0.452	S	S	*	.	H	α-helix	trans	-70.1	-40.1	179.9	-171.2	177.3	-177.3	176.3	0	112.4	R75 F76	R75-R79 WeakPolarHBondContact O-CB 3.12Å; R75-R79 PolarHBondContact O-N 3.27Å; F76-R79 WeakPolarHBondContact O-CB 3.38Å; F76-R79 PolarHBondContact O-N 3.48Å
80	E	55.4	Low	56	Low	91 Å²	91	99 Å²	99	43%	0.425	47%	0.472	S	S	.	.	H	α-helix	trans	-77.2	-32.5	-178.9	-68.7	-120	105.7	0	0	113	R50 F76 E82	R50-E80 IonicContact CZ-OE1 3.76Å; R50-E80 IonicContact CZ-OE2 2.98Å; R50-E80 IonicContact NE-OE2 3.33Å; R50-E80 PolarHBondContact NE-OE2 2.83Å; R50-E80 IonicContact NH1-OE2 3.55Å; R50-E80 IonicContact NH2-OE1 2.97Å; R50-E80 PolarHBondContact NH2-OE1 2.79Å; R50-E80 IonicContact NH2-OE2 2.75Å; R50-E80 PolarHBondContact NH2-OE2 3.17Å; F76-E80 HydrophobicContact CD1-CG 4.01Å; F76-E80 HydrophobicContact CE1-CG 3.56Å; F76-E80 VanDerWaalsContact CE1-OE2 3.23Å; F76-E80 WeakPolarHBondContact CE1-OE2 3.46Å; F76-E80 HydrophobicContact CE2-CG 4.22Å; F76-E80 VanDerWaalsContact CZ-CD 3.49Å; F76-E80 HydrophobicContact CZ-CG 3.68Å; F76-E80 WeakPolarHBondContact CZ-OE2 2.87Å; F76-E80 WeakPolarHBondContact O-CG 3.23Å; F76-E80 PolarHBondContact O-N 3.12Å; E80-E82 PolarHBondContact O-N 3.37Å
81	A	54	Low	54.9	Low	47 Å²	47	102 Å²	102	39%	0.388	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	5.1	-177.7	0	0	0	0	0	114.1	H77 I83	H77-A81 WeakPolarHBondContact O-CB 3.38Å; H77-A81 PolarHBondContact O-N 3.36Å; A81-I83 HydrophobicContact CB-CB 4.25Å; A81-I83 HydrophobicContact CB-CD1 3.46Å; A81-I83 VanDerWaalsContact CB-CD1 3.46Å; A81-I83 HydrophobicContact CB-CG1 3.54Å; A81-I83 WeakPolarHBondContact O-CG1 2.88Å; A81-I83 PolarHBondContact O-N 2.99Å
82	E	52.8	Low	54	Low	190 Å²	190	104.5 Å²	104.5	89%	0.888	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	28.2	-167.8	-67.7	-172	89.3	0	0	112.4	E80 S84	E80-E82 PolarHBondContact O-N 3.37Å; E82-S84 PolarHBondContact O-N 3.39Å
83	I	52.1	Low	52.7	Low	38 Å²	38	105.8 Å²	105.8	20%	0.195	52%	0.516	C	S	.	.			trans	-86.3	111.8	179.8	-65.6	175.1	0	0	0	106.3	C78 A81 E85 R87	C78-I83 PolarHBondContact O-N 3.39Å; A81-I83 HydrophobicContact CB-CB 4.25Å; A81-I83 HydrophobicContact CB-CD1 3.46Å; A81-I83 VanDerWaalsContact CB-CD1 3.46Å; A81-I83 HydrophobicContact CB-CG1 3.54Å; A81-I83 WeakPolarHBondContact O-CG1 2.88Å; A81-I83 PolarHBondContact O-N 2.99Å; I83-E85 PolarHBondContact O-N 3.34Å; I83-R87 HydrophobicContact CG2-CB 3.29Å; I83-R87 HydrophobicContact CG2-CG 4.38Å
84	S	49.3	Very low	51.3	Low	86 Å²	86	112.4 Å²	112.4	60%	0.601	55%	0.545	S	S	*	.			trans	-44.7	134.6	172.7	-170.1	0	0	0	0	110.1	E82 R86 R87	E82-S84 PolarHBondContact O-N 3.39Å; S84-R86 PolarHBondContact O-N 1.99Å; S84-R87 PolarHBondContact O-N 3.15Å
85	E	51.2	Low	49.9	Very low	172 Å²	172	116.5 Å²	116.5	80%	0.804	57%	0.574	S	S	*	*	H	α-helix	trans	-46.8	-29.7	-176.4	-66.7	-177	110.6	0	0	112.7	I83 R87 C88	I83-E85 PolarHBondContact O-N 3.34Å; E85-R87 VanDerWaalsContact C-N 3.33Å; E85-R87 PolarHBondContact O-N 3.23Å; E85-C88 WeakPolarHBondContact O-CB 3.18Å; E85-C88 PolarHBondContact O-N 3.05Å
86	R	49.4	Very low	49.3	Very low	226 Å²	226	113.3 Å²	113.3	85%	0.853	57%	0.569	S	S	*	*	H	α-helix	trans	-66.9	-22.3	177.8	-152.1	-178.3	-79.2	166.8	-6.3	115.2	S84	S84-R86 PolarHBondContact O-N 1.99Å
87	R	49.1	Very low	48.8	Very low	180 Å²	180	117.1 Å²	117.1	68%	0.679	59%	0.59	S	S	*	*	H	α-helix	trans	-89.9	-14.8	173.8	-87.3	-177	80.7	-178.9	5.6	112.6	I83 S84 E85 G90	I83-R87 HydrophobicContact CG2-CB 3.29Å; I83-R87 HydrophobicContact CG2-CG 4.38Å; S84-R87 PolarHBondContact O-N 3.15Å; E85-R87 VanDerWaalsContact C-N 3.33Å; E85-R87 PolarHBondContact O-N 3.23Å; R87-G90 PolarHBondContact O-N 3.23Å
88	C	51.3	Low	48.3	Very low	22 Å²	22	117.1 Å²	117.1	15%	0.149	59%	0.592	C	S	.	*	H	α-helix	trans	-73.5	-31.1	179.9	-72.5	0	0	0	0	113.4	C78 E85 G90	C78-C88 HydrophobicContact CB-CB 4.17Å; C78-C88 WeakPolarHBondContact CB-SG 3.34Å; C78-C88 WeakPolarHBondContact SG-CB 3.42Å; C78-C88 CovalentContact SG-SG 1.99Å; C78-C88 PolarHBondContact SG-SG 3.44Å; E85-C88 WeakPolarHBondContact O-CB 3.18Å; E85-C88 PolarHBondContact O-N 3.05Å; C88-G90 PolarHBondContact O-N 3.35Å
89	D	50.4	Low	47.7	Very low	125 Å²	125	122.7 Å²	122.7	67%	0.668	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-23.6	170.5	-69.1	-58.7	0	0	0	112.6
90	G	47.7	Very low	46.9	Very low	45 Å²	45	117.4 Å²	117.4	46%	0.464	61%	0.608	S	S	.	*	G	3₁₀ helix	trans	-79.5	-20.7	-179.6	0	0	0	0	0	114.9	R87 C88 N92	R87-G90 PolarHBondContact O-N 3.23Å; C88-G90 PolarHBondContact O-N 3.35Å; G90-N92 PolarHBondContact O-N 3.16Å
91	L	39.8	Very low	46.4	Very low	115 Å²	115	119.1 Å²	119.1	60%	0.602	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-76.2	-4.7	173.8	-72.4	170.6	0	0	0	112.9
92	N	45.9	Very low	45.8	Very low	92 Å²	92	124.3 Å²	124.3	49%	0.492	64%	0.637	S	S	.	*	G	3₁₀ helix	trans	-90.1	-3.7	176.6	-91.5	-42.4	0	0	0	114.3	R74 G90	R74-N92 PolarHBondContact NH1-ND2 2.92Å; R74-N92 PolarHBondContact NH1-OD1 3.31Å; G90-N92 PolarHBondContact O-N 3.16Å
93	A	36.6	Very low	45.3	Very low	86 Å²	86	119.2 Å²	119.2	71%	0.711	62%	0.617	S	S	*	*	S	Bend	trans	-109.9	-10	-173.3	0	0	0	0	0	114.6
94	E	32.7	Very low	44.7	Very low	166 Å²	166	126 Å²	126	78%	0.776	65%	0.653	S	S	*	*			trans	-141.2	65.6	-175.7	-66.2	-169.7	98.3	0	0	111.5
95	L	33.4	Very low	44.3	Very low	197 Å²	197	129.6 Å²	129.6	100%	1.031	66%	0.657	S	S	*	*			trans	173.3	0	154.5	-94.2	149.2	0	0	0	111.1	I2	I2-L95 HydrophobicContact CD1-CD1 3.63Å; I2-L95 HydrophobicContact CD1-CD2 3.75Å; I2-L95 HydrophobicContact CD1-CG 4.36Å; I2-L95 HydrophobicContact CG1-CD2 4.36Å

Retrieved 95 of 95 residues in 16.8 ms (Link to these results)

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