A0A077ZGN8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZGN8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 115 aa.

						>A0A077ZGN8_TRITR|A0A077ZGN8
MPGLTDCQTAMTEPKLDLAASSDLIINDSKLFTVSDNNNGDTESHRVPLMKIELSDEESVVDGNITELDEELAAVSSSVMALVDPYGQSDLNDTNFMKENKESLVVDRHSPCSFS
					

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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	40	Very low	46.9	Very low	202 Å²	202	113.7 Å²	113.7	100%	0.995	66%	0.66	S	S	*	*				0	102.7	0	-80.8	175.4	69.8	0	0	108.8
2	P	48.5	Very low	47.3	Very low	117 Å²	117	112.2 Å²	112.2	76%	0.76	65%	0.654	S	S	*	*			trans	-86.8	-1	-179.2	-8.2	27.3	0	0	0	115.2	L4 T5	P2-L4 PolarHBondContact O-N 3.09Å; P2-T5 PolarHBondContact O-OG1 3.42Å
3	G	50.3	Low	47.6	Very low	51 Å²	51	116.2 Å²	116.2	53%	0.526	66%	0.663	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.1	6.1	-166.7	0	0	0	0	0	117.7
4	L	48.9	Very low	47.5	Very low	121 Å²	121	116.8 Å²	116.8	63%	0.634	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-20.3	-177.7	-83.4	160.7	0	0	0	113.6	P2	P2-L4 PolarHBondContact O-N 3.09Å
5	T	48.8	Very low	47.5	Very low	98 Å²	98	122.7 Å²	122.7	60%	0.601	69%	0.687	S	S	*	*	S	Bend	trans	-80.5	-19.2	176	27.9	0	0	0	0	113.4	P2 C7 T9	P2-T5 PolarHBondContact O-OG1 3.42Å; T5-C7 VanDerWaalsContact C-N 3.28Å; T5-C7 PolarHBondContact O-N 3.08Å; T5-T9 PolarHBondContact O-OG1 3.28Å
6	D	43.4	Very low	47.5	Very low	118 Å²	118	124.1 Å²	124.1	63%	0.631	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-18	179.6	-63.6	-30.9	0	0	0	112.7
7	C	44	Very low	47.5	Very low	36 Å²	36	125.3 Å²	125.3	24%	0.243	70%	0.697	C	S	.	*	T	Hydrogen-bonded Turn	trans	-83.8	-16.4	-176.4	-146.4	0	0	0	0	113.3	T5 C112	T5-C7 VanDerWaalsContact C-N 3.28Å; T5-C7 PolarHBondContact O-N 3.08Å; C7-C112 HydrophobicContact CB-CB 3.75Å; C7-C112 WeakPolarHBondContact CB-SG 3.34Å; C7-C112 VanDerWaalsContact SG-CA 3.58Å; C7-C112 WeakPolarHBondContact SG-CB 3.46Å; C7-C112 CovalentContact SG-SG 2.03Å; C7-C112 PolarHBondContact SG-SG 3.06Å
8	Q	46.8	Very low	47.7	Very low	175 Å²	175	125.7 Å²	125.7	82%	0.818	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-16.6	176.1	-89.4	179.1	-0	0	0	113.9
9	T	49.5	Very low	47.8	Very low	102 Å²	102	123.3 Å²	123.3	63%	0.626	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-18.3	-174.3	-39.5	0	0	0	0	112.5	T5 T12	T5-T9 PolarHBondContact O-OG1 3.28Å; T9-T12 PolarHBondContact O-OG1 3.19Å
10	A	48.4	Very low	47.8	Very low	87 Å²	87	121.9 Å²	121.9	72%	0.719	70%	0.7	S	S	*	*	S	Bend	trans	-89.7	-1.6	-173.1	0	0	0	0	0	115.7
11	M	47.3	Very low	47.7	Very low	144 Å²	144	121 Å²	121	71%	0.709	70%	0.7	S	S	*	*			trans	-105.7	37.8	173.6	-66.5	-158.3	-165.7	0	0	112.4	E13 P111	M11-E13 PolarHBondContact O-N 3.36Å; M11-P111 HydrophobicContact CE-CG 3.93Å
12	T	51.5	Low	47.8	Very low	95 Å²	95	115.9 Å²	115.9	58%	0.583	69%	0.685	S	S	*	*			trans	-76.7	103.6	168.8	-48.1	0	0	0	0	107.1	T9	T9-T12 PolarHBondContact O-OG1 3.19Å
13	E	50.9	Low	47.5	Very low	165 Å²	165	116.7 Å²	116.7	77%	0.771	68%	0.683	S	S	*	*			trans	-45.3	132.3	169.4	-75.7	179.8	157.7	0	0	109.1	M11 K15	M11-E13 PolarHBondContact O-N 3.36Å; E13-K15 PolarHBondContact O-N 3.12Å
14	P	46.9	Very low	47.3	Very low	124 Å²	124	121.7 Å²	121.7	81%	0.805	70%	0.696	S	S	*	*			trans	-62.5	102.9	173.2	25.3	-31.1	0	0	0	107.7	L16	P14-L16 PolarHBondContact O-N 2.87Å
15	K	46.8	Very low	47.3	Very low	205 Å²	205	122.1 Å²	122.1	89%	0.891	70%	0.698	S	S	*	*			trans	-64.9	102.3	169.8	-104.3	-178.8	175.5	177.8	0	107.3	E13 D17	E13-K15 PolarHBondContact O-N 3.12Å; K15-D17 VanDerWaalsContact C-N 3.28Å; K15-D17 PolarHBondContact O-N 3.26Å
16	L	47.4	Very low	47.5	Very low	146 Å²	146	124 Å²	124	76%	0.764	70%	0.703	S	S	*	*			trans	-72.4	90.8	164.9	-162.6	72.7	0	0	0	107.1	P14 L18	P14-L16 PolarHBondContact O-N 2.87Å; L16-L18 VanDerWaalsContact C-N 3.34Å; L16-L18 HydrophobicContact CB-CD1 4.3Å; L16-L18 HydrophobicContact CD2-CD1 3.46Å; L16-L18 VanDerWaalsContact CD2-CD1 3.46Å; L16-L18 HydrophobicContact CG-CD1 3.63Å; L16-L18 PolarHBondContact O-N 3.47Å
17	D	47.6	Very low	47.8	Very low	144 Å²	144	124.4 Å²	124.4	77%	0.77	71%	0.705	S	S	*	*			trans	-77.4	89.2	172.3	-163.3	5.6	0	0	0	108.2	K15 A19	K15-D17 VanDerWaalsContact C-N 3.28Å; K15-D17 PolarHBondContact O-N 3.26Å; D17-A19 PolarHBondContact O-N 3.32Å
18	L	51.4	Low	48.3	Very low	132 Å²	132	129 Å²	129	69%	0.691	73%	0.727	S	S	*	*			trans	-72.5	84.7	163	-76.8	93.4	0	0	0	106.9	L16 A20	L16-L18 VanDerWaalsContact C-N 3.34Å; L16-L18 HydrophobicContact CB-CD1 4.3Å; L16-L18 HydrophobicContact CD2-CD1 3.46Å; L16-L18 VanDerWaalsContact CD2-CD1 3.46Å; L16-L18 HydrophobicContact CG-CD1 3.63Å; L16-L18 PolarHBondContact O-N 3.47Å; L18-A20 PolarHBondContact O-N 3.04Å
19	A	49.8	Very low	48.5	Very low	81 Å²	81	123.4 Å²	123.4	67%	0.669	71%	0.708	S	S	*	*			trans	-60.4	87.2	156.9	0	0	0	0	0	106.8	D17 S21	D17-A19 PolarHBondContact O-N 3.32Å; A19-S21 PolarHBondContact O-N 2.86Å
20	A	47.5	Very low	48.8	Very low	95 Å²	95	123.7 Å²	123.7	79%	0.785	70%	0.7	S	S	*	*			trans	-68.4	74.5	168	0	0	0	0	0	106.8	L18 S22	L18-A20 PolarHBondContact O-N 3.04Å; A20-S22 PolarHBondContact O-N 3.15Å
21	S	46.7	Very low	49.1	Very low	102 Å²	102	124.8 Å²	124.8	71%	0.713	69%	0.693	S	S	*	*			trans	-67.9	88.5	158.8	73.5	0	0	0	0	105.9	A19 D23	A19-S21 PolarHBondContact O-N 2.86Å; S21-D23 PolarHBondContact O-N 3.01Å; S21-D23 VanDerWaalsContact O-N 3.08Å
22	S	41.7	Very low	49.5	Very low	96 Å²	96	123.7 Å²	123.7	67%	0.671	69%	0.685	S	S	*	*			trans	-37.6	112.1	140.6	171.9	0	0	0	0	106.6	A20	A20-S22 PolarHBondContact O-N 3.15Å
23	D	42.7	Very low	49.6	Very low	134 Å²	134	124 Å²	124	72%	0.717	69%	0.687	S	S	*	*	S	Bend	trans	151.7	108.7	147.3	-70.4	-11.3	0	0	0	108.6	S21	S21-D23 PolarHBondContact O-N 3.01Å; S21-D23 VanDerWaalsContact O-N 3.08Å
24	L	45.7	Very low	49.7	Very low	155 Å²	155	120.2 Å²	120.2	81%	0.812	68%	0.675	S	S	*	*			trans	46.3	92.4	170.2	-91.6	80.1	0	0	0	116.3	I26	L24-I26 VanDerWaalsContact C-N 3.35Å; L24-I26 PolarHBondContact O-N 3.14Å
25	I	48.1	Very low	50.1	Low	131 Å²	131	117.9 Å²	117.9	67%	0.672	66%	0.661	S	S	*	*			trans	-71.5	95.5	158.3	-58.6	-179.8	0	0	0	107.6	N27	I25-N27 PolarHBondContact O-N 3.41Å
26	I	52.9	Low	50.2	Low	136 Å²	136	113.9 Å²	113.9	70%	0.697	65%	0.65	S	S	*	*			trans	-69.5	108.7	162.2	-62.3	175.1	0	0	0	106.2	L24 D28	L24-I26 VanDerWaalsContact C-N 3.35Å; L24-I26 PolarHBondContact O-N 3.14Å; I26-D28 PolarHBondContact O-N 3.33Å
27	N	49.4	Very low	50.6	Low	127 Å²	127	113 Å²	113	68%	0.679	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	79.2	-169	-170.5	21.5	0	0	0	113.3	I25	I25-N27 PolarHBondContact O-N 3.41Å
28	D	54.6	Low	51.2	Low	133 Å²	133	113.6 Å²	113.6	71%	0.711	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.5	-16.4	168.4	-91	-34.1	0	0	0	116.7	I26	I26-D28 PolarHBondContact O-N 3.33Å
29	S	51.9	Low	51.4	Low	58 Å²	58	113.1 Å²	113.1	41%	0.406	65%	0.647	S	S	.	*			trans	-168.5	137.5	170.1	42.4	0	0	0	0	112.3
30	K	56.6	Low	51.5	Low	108 Å²	108	113.4 Å²	113.4	47%	0.47	66%	0.658	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.7	122.1	161.3	-74.2	-172.2	177.5	-176.3	0	107.9	F32	K30-F32 HydrophobicContact CB-CD2 4.44Å; K30-F32 HydrophobicContact CB-CE2 3.77Å; K30-F32 HydrophobicContact CB-CZ 4.15Å; K30-F32 HydrophobicContact CD-CZ 4.27Å
31	L	53.8	Low	51.5	Low	110 Å²	110	114.8 Å²	114.8	58%	0.576	65%	0.652	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.9	121.4	171.8	-71.8	164.2	0	0	0	107.7	R46	L31-R46 HydrophobicContact CD2-CG 4.29Å
32	F	55.2	Low	51.9	Low	121 Å²	121	114.4 Å²	114.4	53%	0.531	65%	0.646	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.2	125.5	163.6	-61.6	-83.3	0	0	0	107.2	K30	K30-F32 HydrophobicContact CB-CD2 4.44Å; K30-F32 HydrophobicContact CB-CE2 3.77Å; K30-F32 HydrophobicContact CB-CZ 4.15Å; K30-F32 HydrophobicContact CD-CZ 4.27Å
33	T	54.7	Low	52.5	Low	102 Å²	102	116.1 Å²	116.1	63%	0.626	64%	0.643	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.8	115.3	170.2	28.2	0	0	0	0	107.9
34	V	53.5	Low	53	Low	85 Å²	85	112.9 Å²	112.9	52%	0.515	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.3	115.1	165.3	-177.8	0	0	0	0	105.7
35	S	53.2	Low	53.4	Low	75 Å²	75	110.2 Å²	110.2	52%	0.524	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.1	114.7	173.2	56.1	0	0	0	0	108.6	N37	S35-N37 PolarHBondContact O-OD1 3.36Å
36	D	50.2	Low	53.5	Low	120 Å²	120	113 Å²	113	64%	0.642	62%	0.616	S	S	*	*			trans	-80.1	121.7	166.7	-86.2	-29.5	0	0	0	109.1	N38	D36-N38 PolarHBondContact O-N 3.38Å
37	N	56.4	Low	53.6	Low	128 Å²	128	110.3 Å²	110.3	68%	0.684	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-5.9	-174.1	-58.1	-12.2	0	0	0	113.6	S35	S35-N37 PolarHBondContact O-OD1 3.36Å
38	N	59.4	Low	53.7	Low	156 Å²	156	108.7 Å²	108.7	83%	0.834	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-7.8	-167.8	-99.7	-0.6	0	0	0	115.5	D36	D36-N38 PolarHBondContact O-N 3.38Å
39	N	55.5	Low	53.7	Low	123 Å²	123	104.7 Å²	104.7	66%	0.658	58%	0.581	S	S	*	*	S	Bend	trans	-162	126.4	171.1	-107.4	11.3	0	0	0	104.2	D41	N39-D41 PolarHBondContact O-N 3.49Å
40	G	52.7	Low	53.7	Low	87 Å²	87	110.4 Å²	110.4	90%	0.897	60%	0.603	S	S	*	*	S	Bend	trans	-64.5	28.5	-173.3	0	0	0	0	0	116.9
41	D	46.8	Very low	53.4	Low	124 Å²	124	114.7 Å²	114.7	66%	0.663	62%	0.622	S	S	*	*			trans	-83.7	107.7	169.1	-84	-39.9	0	0	0	109.4	N39	N39-D41 PolarHBondContact O-N 3.49Å
42	T	56	Low	53.2	Low	94 Å²	94	114.2 Å²	114.2	58%	0.577	62%	0.619	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84	108.5	165.6	53.7	0	0	0	0	108.5
43	E	53.9	Low	52.7	Low	131 Å²	131	117 Å²	117	61%	0.612	63%	0.634	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.4	122.7	166.4	-71.9	-160.9	160.5	0	0	109.5	H45	E43-H45 IonicContact OE2-CE1 3.48Å; E43-H45 PolarHBondContact OE2-CE1 2.87Å; E43-H45 IonicContact OE2-NE2 3.75Å
44	S	53.5	Low	52.5	Low	67 Å²	67	118.7 Å²	118.7	47%	0.469	64%	0.638	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.7	107.9	174.5	-174	0	0	0	0	109.1
45	H	53.3	Low	52.1	Low	98 Å²	98	118.9 Å²	118.9	45%	0.454	64%	0.643	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.8	110.4	173.6	-62.3	-65	0	0	0	109.8	E43 V47	E43-H45 IonicContact OE2-CE1 3.48Å; E43-H45 PolarHBondContact OE2-CE1 2.87Å; E43-H45 IonicContact OE2-NE2 3.75Å; H45-V47 PolarHBondContact O-N 2.85Å
46	R	50.9	Low	51.8	Low	190 Å²	190	122.8 Å²	122.8	72%	0.717	66%	0.658	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.1	108.8	166.3	-72.9	-171.6	-178.2	-153	0.1	108.7	L31 P48	L31-R46 HydrophobicContact CD2-CG 4.29Å; R46-P48 WeakPolarHBondContact O-CD 3.21Å
47	V	53.6	Low	51.6	Low	79 Å²	79	124.3 Å²	124.3	48%	0.479	66%	0.661	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.1	115.1	168.6	-178.3	0	0	0	0	107.9	H45 L49	H45-V47 PolarHBondContact O-N 2.85Å; V47-L49 PolarHBondContact O-N 3.25Å
48	P	52.5	Low	51.1	Low	94 Å²	94	128 Å²	128	61%	0.61	67%	0.674	S	S	*	*			trans	-61.9	125.2	174	-18.6	30.9	0	0	0	109.9	R46 M50	R46-P48 WeakPolarHBondContact O-CD 3.21Å; P48-M50 PolarHBondContact O-N 2.98Å
49	L	55.3	Low	50.6	Low	48 Å²	48	125.1 Å²	125.1	25%	0.251	67%	0.667	S	S	.	*	G	3₁₀ helix	trans	-67.9	-4.1	-179.9	-65.3	172.2	0	0	0	113.3	V47 K51 I52	V47-L49 PolarHBondContact O-N 3.25Å; L49-K51 PolarHBondContact O-N 3.37Å; L49-I52 HydrophobicContact CD2-CD1 3.77Å; L49-I52 PolarHBondContact O-N 3.2Å; L49-I52 VanDerWaalsContact O-N 3.11Å
50	M	49.8	Very low	50.3	Low	178 Å²	178	125.6 Å²	125.6	88%	0.877	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-68.2	7.6	-178.4	-67.9	-178.6	177.1	0	0	115.4	P48	P48-M50 PolarHBondContact O-N 2.98Å
51	K	51.9	Low	50.1	Low	199 Å²	199	127.9 Å²	127.9	87%	0.865	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-126.2	5.9	171.9	-73.6	-172.2	178	-178	0	114	L49 E53	L49-K51 PolarHBondContact O-N 3.37Å; K51-E53 VanDerWaalsContact C-N 3.34Å; K51-E53 PolarHBondContact O-N 3.03Å
52	I	50	Low	50	Low	99 Å²	99	129.3 Å²	129.3	51%	0.508	68%	0.678	S	S	.	*			trans	-96.1	77.1	170.9	-45.7	-178.9	0	0	0	106.2	L49 L54	L49-I52 HydrophobicContact CD2-CD1 3.77Å; L49-I52 PolarHBondContact O-N 3.2Å; L49-I52 VanDerWaalsContact O-N 3.11Å; I52-L54 HydrophobicContact CG2-CD2 3.85Å; I52-L54 HydrophobicContact CG2-CG 3.95Å; I52-L54 PolarHBondContact O-N 3.19Å
53	E	43.1	Very low	49.7	Very low	181 Å²	181	127.9 Å²	127.9	85%	0.846	68%	0.682	S	S	*	*			trans	-61.9	95.4	157.3	-89.7	177.8	155.9	0	0	106.2	K51 S55	K51-E53 VanDerWaalsContact C-N 3.34Å; K51-E53 PolarHBondContact O-N 3.03Å; E53-S55 PolarHBondContact O-N 3.4Å
54	L	50.7	Low	49.6	Very low	136 Å²	136	127.4 Å²	127.4	71%	0.712	68%	0.683	S	S	*	*			trans	-71.7	90.8	159.4	-65.7	172.1	0	0	0	104.8	I52 D56	I52-L54 HydrophobicContact CG2-CD2 3.85Å; I52-L54 HydrophobicContact CG2-CG 3.95Å; I52-L54 PolarHBondContact O-N 3.19Å; L54-D56 PolarHBondContact O-N 3.19Å
55	S	45	Very low	49.7	Very low	90 Å²	90	131.1 Å²	131.1	63%	0.629	70%	0.696	S	S	*	*			trans	-63.6	87.5	165.3	-58.2	0	0	0	0	107.2	E53 E57	E53-S55 PolarHBondContact O-N 3.4Å; S55-E57 PolarHBondContact O-N 3.31Å
56	D	46.5	Very low	49.8	Very low	156 Å²	156	132 Å²	132	83%	0.834	71%	0.709	S	S	*	*			trans	-69.2	63.3	159.9	-77.5	-27.7	0	0	0	107.7	L54	L54-D56 PolarHBondContact O-N 3.19Å
57	E	46.4	Very low	49.9	Very low	152 Å²	152	130 Å²	130	71%	0.71	71%	0.707	S	S	*	*			trans	-109.2	85.1	169.6	-59.1	-155.2	149.5	0	0	107.2	S55 S59	S55-E57 PolarHBondContact O-N 3.31Å; E57-S59 PolarHBondContact O-N 2.78Å
58	E	47.1	Very low	50	Low	205 Å²	205	131.7 Å²	131.7	96%	0.958	71%	0.713	S	S	*	*			trans	-53.6	65.4	157.2	-164.6	-173.6	173.1	0	0	109.7
59	S	47.3	Very low	50.1	Low	96 Å²	96	132.8 Å²	132.8	67%	0.671	71%	0.714	S	S	*	*			trans	-164.9	24.8	-169.9	-170.7	0	0	0	0	116.4	E57	E57-S59 PolarHBondContact O-N 2.78Å
60	V	51	Low	50.2	Low	133 Å²	133	137.8 Å²	137.8	81%	0.806	74%	0.736	S	S	*	*			trans	-114.4	54.7	169.2	-159.5	0	0	0	0	110.8
61	V	47.6	Very low	50.5	Low	135 Å²	135	135.9 Å²	135.9	82%	0.818	73%	0.725	S	S	*	*			trans	-103.5	75.9	154.5	-179.4	0	0	0	0	105.7
62	D	44.1	Very low	50.7	Low	155 Å²	155	132.1 Å²	132.1	83%	0.829	71%	0.714	S	S	*	*	S	Bend	trans	-165.2	126.4	163.8	-116.9	-18.8	0	0	0	111.3
63	G	51.1	Low	51.1	Low	64 Å²	64	130.3 Å²	130.3	66%	0.66	71%	0.714	S	S	*	*	S	Bend	trans	113.7	-38.7	152	0	0	0	0	0	119.4
64	N	51.9	Low	51.9	Low	120 Å²	120	124.5 Å²	124.5	64%	0.642	70%	0.697	S	S	*	*	S	Bend	trans	-117.6	4.2	-161	-115.1	44.4	0	0	0	117.3
65	I	55	Low	52.2	Low	146 Å²	146	122.3 Å²	122.3	75%	0.749	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-17.3	-175.7	-54	172.6	0	0	0	111.8
66	T	54.3	Low	52.8	Low	116 Å²	116	121.3 Å²	121.3	71%	0.712	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-21.8	-176.5	-0.2	0	0	0	0	114.7
67	E	53.5	Low	53.2	Low	147 Å²	147	117.9 Å²	117.9	69%	0.687	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-25.2	-179.4	-68.9	-175.5	169.8	0	0	113.1	D69	E67-D69 VanDerWaalsContact C-N 3.28Å; E67-D69 PolarHBondContact O-N 3.34Å
68	L	55.1	Low	53.7	Low	116 Å²	116	114.2 Å²	114.2	61%	0.607	66%	0.661	S	S	*	*	H	α-helix	trans	-71.8	-20.1	177.8	-85.8	156.4	0	0	0	113.6	L72	L68-L72 WeakPolarHBondContact O-CB 3.49Å; L68-L72 PolarHBondContact O-N 3.39Å
69	D	56.3	Low	54.1	Low	116 Å²	116	108.8 Å²	108.8	62%	0.62	64%	0.642	S	S	*	*	H	α-helix	trans	-79.1	-31.8	-178.9	-153.2	31.6	0	0	0	112.1	E67 A73	E67-D69 VanDerWaalsContact C-N 3.28Å; E67-D69 PolarHBondContact O-N 3.34Å; D69-A73 PolarHBondContact O-N 3.17Å
70	E	55.6	Low	54.6	Low	154 Å²	154	111 Å²	111	72%	0.72	64%	0.643	S	S	*	*	H	α-helix	trans	-73.4	-37.7	176.9	-68.3	-172.1	171.4	0	0	112.2	A74	E70-A74 PolarHBondContact O-N 3.43Å
71	E	56.5	Low	54.9	Low	137 Å²	137	108.7 Å²	108.7	64%	0.64	64%	0.638	S	S	*	*	H	α-helix	trans	-70	-37.4	176.7	-66.5	-168	160.3	0	0	112.1	A74 V75	E71-A74 PolarHBondContact O-N 3.21Å; E71-V75 VanDerWaalsContact O-CG2 3.28Å; E71-V75 WeakPolarHBondContact O-CG2 3.44Å; E71-V75 PolarHBondContact O-N 3.45Å
72	L	56.7	Low	55.2	Low	120 Å²	120	109.3 Å²	109.3	63%	0.628	64%	0.636	S	S	*	*	H	α-helix	trans	-67.5	-37.2	178.2	-166.2	69.1	0	0	0	112	L68 S76	L68-L72 WeakPolarHBondContact O-CB 3.49Å; L68-L72 PolarHBondContact O-N 3.39Å; L72-S76 WeakPolarHBondContact O-CB 3.39Å; L72-S76 PolarHBondContact O-N 2.03Å
73	A	58.4	Low	55.7	Low	62 Å²	62	106.7 Å²	106.7	51%	0.512	63%	0.626	S	S	.	*	H	α-helix	trans	-66.6	-39.7	175.1	0	0	0	0	0	112.5	D69 S77	D69-A73 PolarHBondContact O-N 3.17Å; A73-S77 PolarHBondContact O-N 3.37Å; A73-S77 VanDerWaalsContact O-N 3.14Å
74	A	59.2	Low	55.8	Low	59 Å²	59	108.4 Å²	108.4	49%	0.488	62%	0.619	S	S	.	*	H	α-helix	trans	-66.1	-43.2	176.6	0	0	0	0	0	112	E70 E71 S77 S78	E70-A74 PolarHBondContact O-N 3.43Å; E71-A74 PolarHBondContact O-N 3.21Å; A74-S77 PolarHBondContact O-N 2.97Å; A74-S78 PolarHBondContact O-N 2.85Å; A74-S78 PolarHBondContact O-OG 2.72Å
75	V	57.8	Low	55.8	Low	90 Å²	90	108 Å²	108	55%	0.545	62%	0.624	S	S	.	*	H	α-helix	trans	-66.5	-39.7	177.4	174.9	0	0	0	0	111.4	E71 S77 S78 V79	E71-V75 VanDerWaalsContact O-CG2 3.28Å; E71-V75 WeakPolarHBondContact O-CG2 3.44Å; E71-V75 PolarHBondContact O-N 3.45Å; V75-S77 VanDerWaalsContact C-N 3.31Å; V75-S77 PolarHBondContact O-N 2.83Å; V75-S78 PolarHBondContact O-N 2.95Å; V75-V79 WeakPolarHBondContact O-CG2 3.28Å; V75-V79 PolarHBondContact O-N 3.06Å
76	S	57.3	Low	55.6	Low	69 Å²	69	109.7 Å²	109.7	48%	0.483	62%	0.622	S	S	.	*	H	α-helix	trans	-64.3	-34.4	176.2	-175.1	0	0	0	0	113	L72 M80	L72-S76 WeakPolarHBondContact O-CB 3.39Å; L72-S76 PolarHBondContact O-N 2.03Å; S76-M80 WeakPolarHBondContact O-CG 3.33Å; S76-M80 PolarHBondContact O-N 3.01Å
77	S	54.5	Low	55.3	Low	83 Å²	83	107.3 Å²	107.3	58%	0.58	62%	0.621	S	S	*	*	H	α-helix	trans	-70.7	-40	178.5	-173.5	0	0	0	0	112.1	A73 A74 V75 M80 A81	A73-S77 PolarHBondContact O-N 3.37Å; A73-S77 VanDerWaalsContact O-N 3.14Å; A74-S77 PolarHBondContact O-N 2.97Å; V75-S77 VanDerWaalsContact C-N 3.31Å; V75-S77 PolarHBondContact O-N 2.83Å; S77-M80 PolarHBondContact O-N 3.31Å; S77-A81 PolarHBondContact O-N 2.77Å
78	S	56.9	Low	55	Low	76 Å²	76	108.2 Å²	108.2	53%	0.531	63%	0.625	S	S	.	*	H	α-helix	trans	-69.2	-31.2	177	-59.7	0	0	0	0	113.6	A74 V75	A74-S78 PolarHBondContact O-N 2.85Å; A74-S78 PolarHBondContact O-OG 2.72Å; V75-S78 PolarHBondContact O-N 2.95Å
79	V	56.9	Low	54.7	Low	91 Å²	91	107.1 Å²	107.1	55%	0.552	63%	0.627	S	S	*	*	H	α-helix	trans	-71.9	-38	177.2	173.2	0	0	0	0	111.7	V75 A81 L82	V75-V79 WeakPolarHBondContact O-CG2 3.28Å; V75-V79 PolarHBondContact O-N 3.06Å; V79-A81 VanDerWaalsContact C-N 3.34Å; V79-L82 PolarHBondContact O-N 3.22Å
80	M	56.7	Low	54.2	Low	141 Å²	141	108.5 Å²	108.5	70%	0.695	63%	0.634	S	S	*	*	H	α-helix	trans	-69.5	-29.9	176	-70.4	-80.1	-169.9	0	0	112.8	S76 S77 L82 V83	S76-M80 WeakPolarHBondContact O-CG 3.33Å; S76-M80 PolarHBondContact O-N 3.01Å; S77-M80 PolarHBondContact O-N 3.31Å; M80-L82 VanDerWaalsContact C-N 3.29Å; M80-L82 PolarHBondContact O-N 3.08Å; M80-V83 PolarHBondContact O-N 2.84Å
81	A	57.6	Low	54.1	Low	85 Å²	85	107.9 Å²	107.9	70%	0.702	64%	0.635	S	S	*	*	H	α-helix	trans	-74.8	-16.2	177.5	0	0	0	0	0	114	S77 V79	S77-A81 PolarHBondContact O-N 2.77Å; V79-A81 VanDerWaalsContact C-N 3.34Å
82	L	53	Low	53.8	Low	149 Å²	149	108.8 Å²	108.8	78%	0.78	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-6.5	173.2	-75.4	163.3	0	0	0	112.8	V79 M80 D84	V79-L82 PolarHBondContact O-N 3.22Å; M80-L82 VanDerWaalsContact C-N 3.29Å; M80-L82 PolarHBondContact O-N 3.08Å; L82-D84 VanDerWaalsContact C-N 3.3Å; L82-D84 PolarHBondContact O-N 2.79Å
83	V	54.5	Low	53.3	Low	100 Å²	100	109.2 Å²	109.2	61%	0.606	65%	0.647	S	S	*	*	S	Bend	trans	-78.9	89.4	168.1	-178.4	0	0	0	0	107	M80 P85	M80-V83 PolarHBondContact O-N 2.84Å; V83-P85 WeakPolarHBondContact O-CD 3.48Å; V83-P85 VanDerWaalsContact O-N 3.14Å
84	D	53.1	Low	52.7	Low	99 Å²	99	111.1 Å²	111.1	53%	0.529	65%	0.652	S	S	.	*			trans	-43.4	113.3	176.8	-175.8	8.7	0	0	0	111.9	L82 Y86	L82-D84 VanDerWaalsContact C-N 3.3Å; L82-D84 PolarHBondContact O-N 2.79Å; D84-Y86 PolarHBondContact O-N 3.45Å; D84-Y86 VanDerWaalsContact O-N 3.12Å; D84-Y86 WeakPolarHBondContact OD1-CA 2.95Å; D84-Y86 WeakPolarHBondContact OD1-CB 3Å; D84-Y86 WeakPolarHBondContact OD1-CD2 3.47Å; D84-Y86 PolarHBondContact OD1-N 2.97Å
85	P	53.6	Low	52	Low	113 Å²	113	115.6 Å²	115.6	73%	0.734	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-3	173.8	27.4	-31.5	0	0	0	112.8	V83	V83-P85 WeakPolarHBondContact O-CD 3.48Å; V83-P85 VanDerWaalsContact O-N 3.14Å
86	Y	50	Low	51.6	Low	181 Å²	181	121.1 Å²	121.1	71%	0.71	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	0.3	-177.6	-67.6	-84.7	0	0	0	115.6	D84 Q88 S89	D84-Y86 PolarHBondContact O-N 3.45Å; D84-Y86 VanDerWaalsContact O-N 3.12Å; D84-Y86 WeakPolarHBondContact OD1-CA 2.95Å; D84-Y86 WeakPolarHBondContact OD1-CB 3Å; D84-Y86 WeakPolarHBondContact OD1-CD2 3.47Å; D84-Y86 PolarHBondContact OD1-N 2.97Å; Y86-Q88 PolarHBondContact O-N 3.18Å; Y86-S89 PolarHBondContact O-OG 2.83Å
87	G	48.3	Very low	51.4	Low	66 Å²	66	124.7 Å²	124.7	68%	0.68	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-6.4	-174.8	0	0	0	0	0	117.6
88	Q	47.2	Very low	50.8	Low	166 Å²	166	129.8 Å²	129.8	78%	0.776	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	20.2	-178.6	-74	-164.7	31	0	0	114.4	Y86 D90	Y86-Q88 PolarHBondContact O-N 3.18Å; Q88-D90 VanDerWaalsContact C-N 3.32Å; Q88-D90 PolarHBondContact O-N 2.92Å
89	S	48.5	Very low	50.3	Low	93 Å²	93	134.6 Å²	134.6	65%	0.65	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	1.2	-175.6	-47.7	0	0	0	0	114.8	Y86	Y86-S89 PolarHBondContact O-OG 2.83Å
90	D	46.3	Very low	49.7	Very low	145 Å²	145	137.3 Å²	137.3	78%	0.775	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	21.6	-172.1	-147.4	12.1	0	0	0	114	Q88	Q88-D90 VanDerWaalsContact C-N 3.32Å; Q88-D90 PolarHBondContact O-N 2.92Å
91	L	53.2	Low	49.2	Very low	141 Å²	141	140.8 Å²	140.8	74%	0.738	75%	0.745	S	S	*	*	S	Bend	trans	-93.4	4.2	-178.1	-87.1	164.7	0	0	0	114.5
92	N	50.5	Low	48.7	Very low	156 Å²	156	144.7 Å²	144.7	83%	0.834	75%	0.748	S	S	*	*	S	Bend	trans	-146.4	0.7	-172.6	-125.7	0.8	0	0	0	117.6
93	D	46.9	Very low	48.3	Very low	128 Å²	128	142.8 Å²	142.8	68%	0.684	75%	0.747	S	S	*	*			trans	-107.7	95.5	-175.9	-100.6	-25.7	0	0	0	113.7
94	T	44.5	Very low	47.8	Very low	102 Å²	102	146.2 Å²	146.2	63%	0.626	76%	0.762	S	S	*	*			trans	55.5	110.9	132	64.9	0	0	0	0	120.2	F96	T94-F96 PolarHBondContact O-N 3.06Å; T94-F96 VanDerWaalsContact O-N 3.09Å
95	N	44.8	Very low	47.4	Very low	154 Å²	154	147.7 Å²	147.7	82%	0.824	77%	0.774	S	S	*	*			trans	57.3	35.4	134.7	-70.1	-48.4	0	0	0	119.1	M97	N95-M97 VanDerWaalsContact C-N 3.25Å; N95-M97 PolarHBondContact O-N 2.68Å; N95-M97 VanDerWaalsContact O-N 3.08Å
96	F	49.1	Very low	47	Very low	205 Å²	205	147.9 Å²	147.9	90%	0.899	77%	0.772	S	S	*	*			trans	-82.4	81.5	156.8	-148.5	-92.8	0	0	0	109.6	T94	T94-F96 PolarHBondContact O-N 3.06Å; T94-F96 VanDerWaalsContact O-N 3.09Å
97	M	54.3	Low	46.6	Very low	144 Å²	144	145.7 Å²	145.7	71%	0.709	77%	0.773	S	S	*	*			trans	21.6	110.2	141.3	-56.9	-68.7	-158.3	0	0	115.2	N95	N95-M97 VanDerWaalsContact C-N 3.25Å; N95-M97 PolarHBondContact O-N 2.68Å; N95-M97 VanDerWaalsContact O-N 3.08Å
98	K	41.9	Very low	46.6	Very low	190 Å²	190	153.2 Å²	153.2	83%	0.826	78%	0.781	S	S	*	*	S	Bend		56.7	117.3	100.8	-121.4	178.3	-179.2	-180	0	112.4
99	E	44.6	Very low	46.3	Very low	177 Å²	177	152.8 Å²	152.8	83%	0.827	78%	0.779	S	S	*	*			trans	81.2	88.2	173.1	-62.8	177.6	145.6	0	0	116.2
100	N	46.1	Very low	46.1	Very low	149 Å²	149	151.8 Å²	151.8	80%	0.797	77%	0.772	S	S	*	*				-177	90.4	119.5	-88.4	-9.9	0	0	0	109.6	E102	N100-E102 PolarHBondContact O-N 3.02Å
101	K	45.5	Very low	46.3	Very low	214 Å²	214	149.7 Å²	149.7	93%	0.93	77%	0.766	S	S	*	*			trans	-84.2	56.9	167.8	-78	-173.4	174	179	0	110.2
102	E	47.3	Very low	46	Very low	166 Å²	166	144.3 Å²	144.3	78%	0.776	74%	0.74	S	S	*	*			trans	-120.2	98.2	172.9	-73.2	-171.6	166.9	0	0	110.1	N100	N100-E102 PolarHBondContact O-N 3.02Å
103	S	44.9	Very low	45.7	Very low	109 Å²	109	141.5 Å²	141.5	76%	0.762	73%	0.732	S	S	*	*			trans	50.9	83.1	134.5	-165.6	0	0	0	0	117.3
104	L	44	Very low	45.8	Very low	173 Å²	173	143.9 Å²	143.9	91%	0.906	74%	0.737	S	S	*	*			trans	-118.8	49.3	155.1	-131.1	108.4	0	0	0	109.8	V106	L104-V106 VanDerWaalsContact C-N 3.34Å; L104-V106 PolarHBondContact O-N 2.95Å; L104-V106 VanDerWaalsContact O-N 3.15Å
105	V	45	Very low	45.6	Very low	129 Å²	129	147.9 Å²	147.9	78%	0.782	77%	0.769	S	S	*	*			trans	-76	98.9	160.3	-178.4	0	0	0	0	105.6	D107	V105-D107 PolarHBondContact O-N 2.9Å
106	V	43.8	Very low	45.6	Very low	117 Å²	117	147.6 Å²	147.6	71%	0.709	77%	0.766	S	S	*	*			trans	-11	99.7	159.8	179.9	0	0	0	0	111.6	L104 R108	L104-V106 VanDerWaalsContact C-N 3.34Å; L104-V106 PolarHBondContact O-N 2.95Å; L104-V106 VanDerWaalsContact O-N 3.15Å; V106-R108 HydrophobicContact CG1-CG 4.34Å; V106-R108 PolarHBondContact O-N 3.11Å
107	D	41.6	Very low	45.4	Very low	135 Å²	135	144.5 Å²	144.5	72%	0.722	76%	0.759	S	S	*	*			trans	-70.1	90.5	171.7	-140.9	-11.8	0	0	0	106.4	V105 H109	V105-D107 PolarHBondContact O-N 2.9Å; D107-H109 VanDerWaalsContact C-N 3.25Å; D107-H109 PolarHBondContact O-N 3.35Å
108	R	47.9	Very low	44.9	Very low	224 Å²	224	144.6 Å²	144.6	85%	0.845	76%	0.762	S	S	*	*			trans	-63.7	92.8	170.7	-87.2	-172.5	176.8	-176.4	-0.5	106.7	V106 S110	V106-R108 HydrophobicContact CG1-CG 4.34Å; V106-R108 PolarHBondContact O-N 3.11Å; R108-S110 VanDerWaalsContact C-N 3.31Å; R108-S110 PolarHBondContact O-N 3.31Å
109	H	41.8	Very low	45.1	Very low	157 Å²	157	141.9 Å²	141.9	73%	0.727	76%	0.758	S	S	*	*			trans	-61.1	98.4	165.6	-72.3	-63	0	0	0	108.9	D107	D107-H109 VanDerWaalsContact C-N 3.25Å; D107-H109 PolarHBondContact O-N 3.35Å
110	S	45.2	Very low	45.2	Very low	73 Å²	73	139.7 Å²	139.7	51%	0.51	75%	0.754	S	S	.	*			trans	-64.9	137.8	166.1	-173.6	0	0	0	0	108.5	R108 C112	R108-S110 VanDerWaalsContact C-N 3.31Å; R108-S110 PolarHBondContact O-N 3.31Å; S110-C112 PolarHBondContact O-N 3.35Å
111	P	49.9	Very low	45.1	Very low	100 Å²	100	139.1 Å²	139.1	65%	0.649	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	20.9	-174.5	28.2	-34.5	0	0	0	114.8	M11	M11-P111 HydrophobicContact CE-CG 3.93Å
112	C	46.2	Very low	45.1	Very low	29 Å²	29	133.7 Å²	133.7	20%	0.196	74%	0.738	C	S	.	*	T	Hydrogen-bonded Turn	trans	-126.3	20	-174.5	-61.1	0	0	0	0	113.4	C7 S110 F114	C7-C112 HydrophobicContact CB-CB 3.75Å; C7-C112 WeakPolarHBondContact CB-SG 3.34Å; C7-C112 VanDerWaalsContact SG-CA 3.58Å; C7-C112 WeakPolarHBondContact SG-CB 3.46Å; C7-C112 CovalentContact SG-SG 2.03Å; C7-C112 PolarHBondContact SG-SG 3.06Å; S110-C112 PolarHBondContact O-N 3.35Å; C112-F114 PolarHBondContact O-N 3.48Å
113	S	44.8	Very low	44.9	Very low	96 Å²	96	131.2 Å²	131.2	67%	0.671	74%	0.735	S	S	*	*			trans	-83.9	87.3	173.5	-65.9	0	0	0	0	110.4
114	F	47.8	Very low	44.9	Very low	178 Å²	178	133.1 Å²	133.1	78%	0.781	73%	0.733	S	S	*	*			trans	-90.1	113.7	158.7	-66.7	-82.1	0	0	0	108	C112	C112-F114 PolarHBondContact O-N 3.48Å
115	S	41	Very low	45	Very low	186 Å²	186	129.5 Å²	129.5	100%	1.301	72%	0.718	S	S	*	*			trans	-54.9	0	159.7	52.6	0	0	0	0	112.1

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