A0A077Z6X4_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z6X4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 117 aa.

						>A0A077Z6X4_TRITR|A0A077Z6X4
MNVVGWTTGICRRLIVGAELVMSLLGVTKLLGGPKPNGRSSDEPSSAAIRHNNPRDIIATIDHTQLNYAATPQHNAQTSYETAMSFKCNDEDDAQVCVISSKRNSTNCPTCIDRLYQ
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.8	Very low	43.3	Very low	236 Å²	236	135 Å²	135	100%	1.163	77%	0.771	S	S	*	*				0	109.1	0	-68.7	166.3	172.8	0	0	106.7	V3	M1-V3 PolarHBondContact O-N 3.08Å
2	N	35.4	Very low	43.4	Very low	166 Å²	166	141.7 Å²	141.7	89%	0.888	77%	0.774	S	S	*	*			trans	-76.2	107.4	-176.8	-90.6	-32.3	0	0	0	109.8
3	V	45.8	Very low	43.5	Very low	139 Å²	139	147.7 Å²	147.7	84%	0.842	78%	0.778	S	S	*	*			trans	-115.1	67.4	171.3	-163.5	0	0	0	0	107.8	M1	M1-V3 PolarHBondContact O-N 3.08Å
4	V	42.9	Very low	43.6	Very low	140 Å²	140	146.1 Å²	146.1	85%	0.848	77%	0.77	S	S	*	*			trans	-120.6	109.6	172.6	-177.8	0	0	0	0	106
5	G	42.5	Very low	43.9	Very low	52 Å²	52	144.3 Å²	144.3	54%	0.536	76%	0.759	S	S	.	*	S	Bend	trans	158.6	-7.9	166	0	0	0	0	0	119.7
6	W	41.8	Very low	44.1	Very low	243 Å²	243	141.4 Å²	141.4	92%	0.92	75%	0.749	S	S	*	*	S	Bend	trans	-111.5	-2.5	-167	-68	3.1	0	0	0	116.5
7	T	49.7	Very low	44	Very low	119 Å²	119	135.4 Å²	135.4	73%	0.73	73%	0.728	S	S	*	*	S	Bend	trans	-98.6	-14.8	-172.4	49	0	0	0	0	115.2	G9	T7-G9 VanDerWaalsContact C-N 3.33Å; T7-G9 PolarHBondContact O-N 2.68Å
8	T	48.9	Very low	44	Very low	129 Å²	129	131.3 Å²	131.3	79%	0.791	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-10.8	-175.9	33.9	0	0	0	0	114.9
9	G	40.8	Very low	44.1	Very low	53 Å²	53	132.1 Å²	132.1	55%	0.546	72%	0.715	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.3	-20.1	-175.6	0	0	0	0	0	116.2	T7	T7-G9 VanDerWaalsContact C-N 3.33Å; T7-G9 PolarHBondContact O-N 2.68Å
10	I	49.3	Very low	44.2	Very low	118 Å²	118	131.1 Å²	131.1	61%	0.605	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-30.6	-164.1	-55.8	170.6	0	0	0	111.7	R12 R13	I10-R12 PolarHBondContact O-N 3.04Å; I10-R13 PolarHBondContact O-N 3.36Å
11	C	42.7	Very low	44.6	Very low	90 Å²	90	129 Å²	129	61%	0.608	70%	0.699	S	S	*	*	H	α-helix	trans	-68.1	-30.3	-178.5	-66.2	0	0	0	0	113.9	R13 L14	C11-R13 VanDerWaalsContact C-N 3.25Å; C11-R13 PolarHBondContact O-N 3.14Å; C11-L14 PolarHBondContact O-N 3.5Å
12	R	44.7	Very low	45.2	Very low	215 Å²	215	124.9 Å²	124.9	81%	0.811	68%	0.679	S	S	*	*	H	α-helix	trans	-67.6	-21	179.4	-96.8	-173.5	174.8	-175.4	-0.7	114.2	I10	I10-R12 PolarHBondContact O-N 3.04Å
13	R	44.2	Very low	45.9	Very low	220 Å²	220	121.9 Å²	121.9	83%	0.83	67%	0.671	S	S	*	*	H	α-helix	trans	-86.6	-21.4	-179.6	-72.1	-169.1	174.7	-158.8	-0.8	113.7	I10 C11	I10-R13 PolarHBondContact O-N 3.36Å; C11-R13 VanDerWaalsContact C-N 3.25Å; C11-R13 PolarHBondContact O-N 3.14Å
14	L	44.5	Very low	46.2	Very low	126 Å²	126	122 Å²	122	66%	0.66	67%	0.667	S	S	*	*	H	α-helix	trans	-80.5	-31.5	179.8	-83	152.3	0	0	0	112.6	C11 G17	C11-L14 PolarHBondContact O-N 3.5Å; L14-G17 PolarHBondContact O-N 3.29Å
15	I	48.9	Very low	46.6	Very low	118 Å²	118	120.7 Å²	120.7	61%	0.605	65%	0.654	S	S	*	*	H	α-helix	trans	-69.2	-37.9	-178.4	-61.9	170.3	0	0	0	111.6	G17 A18	I15-G17 PolarHBondContact O-N 3.2Å; I15-A18 PolarHBondContact O-N 3.22Å
16	V	46.3	Very low	46.4	Very low	98 Å²	98	121.2 Å²	121.2	59%	0.594	66%	0.66	S	S	*	*	H	α-helix	trans	-68.5	-25	176.9	-176	0	0	0	0	112.1
17	G	42.3	Very low	46.8	Very low	39 Å²	39	116 Å²	116	40%	0.402	66%	0.655	S	S	.	*	H	α-helix	trans	-74.5	-31.7	179	0	0	0	0	0	114.1	L14 I15 V21	L14-G17 PolarHBondContact O-N 3.29Å; I15-G17 PolarHBondContact O-N 3.2Å; G17-V21 WeakPolarHBondContact O-CG2 3.22Å; G17-V21 PolarHBondContact O-N 3.44Å
18	A	45.2	Very low	46.4	Very low	62 Å²	62	116.2 Å²	116.2	51%	0.512	66%	0.656	S	S	.	*	H	α-helix	trans	-75.3	-35.6	-176.8	0	0	0	0	0	113.1	I15 L20 V21 M22	I15-A18 PolarHBondContact O-N 3.22Å; A18-L20 VanDerWaalsContact C-N 3.35Å; A18-V21 PolarHBondContact O-N 2.85Å; A18-M22 PolarHBondContact O-N 3.04Å
19	E	45.8	Very low	46.4	Very low	147 Å²	147	118.9 Å²	118.9	69%	0.687	66%	0.656	S	S	*	*	H	α-helix	trans	-71.6	-30.1	177.3	-62.9	-160.4	125.6	0	0	112.6	S23	E19-S23 PolarHBondContact O-N 2.93Å; E19-S23 PolarHBondContact O-OG 3.27Å
20	L	45.2	Very low	46.6	Very low	111 Å²	111	123.2 Å²	123.2	58%	0.581	67%	0.666	S	S	*	*	H	α-helix	trans	-68.5	-36.2	176.2	-136.7	90.8	0	0	0	111.7	A18 S23 L24	A18-L20 VanDerWaalsContact C-N 3.35Å; L20-S23 PolarHBondContact O-N 3.41Å; L20-L24 HydrophobicContact CD2-CD1 4.25Å; L20-L24 HydrophobicContact CG-CD1 4.36Å; L20-L24 WeakPolarHBondContact O-CD1 3.35Å; L20-L24 PolarHBondContact O-N 3.49Å; L20-L24 VanDerWaalsContact O-N 3.14Å
21	V	52.1	Low	46.5	Very low	87 Å²	87	125.7 Å²	125.7	53%	0.527	68%	0.68	S	S	.	*	H	α-helix	trans	-71.6	-34.5	-179.4	176.6	0	0	0	0	111.6	G17 A18 S23 L24 L25	G17-V21 WeakPolarHBondContact O-CG2 3.22Å; G17-V21 PolarHBondContact O-N 3.44Å; A18-V21 PolarHBondContact O-N 2.85Å; V21-S23 VanDerWaalsContact C-N 3.33Å; V21-L24 PolarHBondContact O-N 3.33Å; V21-L25 HydrophobicContact CG1-CD1 4.04Å; V21-L25 PolarHBondContact O-N 2.85Å
22	M	50.7	Low	46.2	Very low	150 Å²	150	125.5 Å²	125.5	74%	0.739	69%	0.693	S	S	*	*	H	α-helix	trans	-72.7	-24.1	175.1	-70	-70.4	-81.8	0	0	113.2	A18	A18-M22 PolarHBondContact O-N 3.04Å
23	S	50.2	Low	45.8	Very low	103 Å²	103	118.9 Å²	118.9	72%	0.72	69%	0.691	S	S	*	*	H	α-helix	trans	-85	-25.4	175.3	-62.7	0	0	0	0	113.5	E19 L20 V21	E19-S23 PolarHBondContact O-N 2.93Å; E19-S23 PolarHBondContact O-OG 3.27Å; L20-S23 PolarHBondContact O-N 3.41Å; V21-S23 VanDerWaalsContact C-N 3.33Å
24	L	52.5	Low	45.8	Very low	142 Å²	142	114.6 Å²	114.6	74%	0.743	69%	0.692	S	S	*	*	H	α-helix	trans	-82.6	-27.4	176	-96.7	124	0	0	0	113.3	L20 V21 G26	L20-L24 HydrophobicContact CD2-CD1 4.25Å; L20-L24 HydrophobicContact CG-CD1 4.36Å; L20-L24 WeakPolarHBondContact O-CD1 3.35Å; L20-L24 PolarHBondContact O-N 3.49Å; L20-L24 VanDerWaalsContact O-N 3.14Å; V21-L24 PolarHBondContact O-N 3.33Å; L24-G26 VanDerWaalsContact C-N 3.3Å; L24-G26 PolarHBondContact O-N 3.43Å; L24-G26 VanDerWaalsContact O-N 3.08Å
25	L	49.6	Very low	45.5	Very low	112 Å²	112	116.9 Å²	116.9	59%	0.586	70%	0.697	S	S	*	*	S	Bend	trans	-81.7	78.7	170	-71.8	162.9	0	0	0	108.8	V21 V27	V21-L25 HydrophobicContact CG1-CD1 4.04Å; V21-L25 PolarHBondContact O-N 2.85Å; L25-V27 PolarHBondContact O-N 2.88Å
26	G	40	Very low	45.4	Very low	63 Å²	63	117.1 Å²	117.1	65%	0.649	71%	0.706	S	S	*	*			trans	-58.7	70.8	-179.4	0	0	0	0	0	115.1	L24 T28	L24-G26 VanDerWaalsContact C-N 3.3Å; L24-G26 PolarHBondContact O-N 3.43Å; L24-G26 VanDerWaalsContact O-N 3.08Å; G26-T28 PolarHBondContact O-N 2.89Å
27	V	48.3	Very low	45	Very low	135 Å²	135	119.1 Å²	119.1	82%	0.818	71%	0.714	S	S	*	*			trans	-84.3	70.1	170.3	-172.3	0	0	0	0	108.1	L25	L25-V27 PolarHBondContact O-N 2.88Å
28	T	42.2	Very low	44.8	Very low	122 Å²	122	120.8 Å²	120.8	75%	0.748	73%	0.73	S	S	*	*			trans	-112	79.8	164.7	31	0	0	0	0	108.3	G26	G26-T28 PolarHBondContact O-N 2.89Å
29	K	47.9	Very low	44.4	Very low	186 Å²	186	129.5 Å²	129.5	81%	0.809	75%	0.75	S	S	*	*			trans	-144.8	103.3	163	-72.6	-169.5	177.2	171.8	0	107.7
30	L	45.2	Very low	43.9	Very low	144 Å²	144	127.4 Å²	127.4	75%	0.754	75%	0.752	S	S	*	*				70.5	125.7	81.8	-76.9	161.4	0	0	0	112.4
31	L	47.8	Very low	43.4	Very low	169 Å²	169	126.7 Å²	126.7	89%	0.885	76%	0.756	S	S	*	*			trans	82.9	110.3	159.2	-50.8	138.8	0	0	0	113.6
32	G	36.5	Very low	42.8	Very low	86 Å²	86	129.8 Å²	129.8	89%	0.887	77%	0.769	S	S	*	*				96.9	102.7	51.2	0	0	0	0	0	109.6
33	G	37.3	Very low	42.2	Very low	76 Å²	76	130 Å²	130	78%	0.784	77%	0.769	S	S	*	*			trans	161.3	147.5	168.1	0	0	0	0	0	114.9
34	P	43.1	Very low	41.9	Very low	131 Å²	131	130.6 Å²	130.6	85%	0.851	77%	0.77	S	S	*	*			trans	-104.7	164.5	-142.7	36.3	-27	0	0	0	116.7
35	K	39.2	Very low	41.1	Very low	173 Å²	173	128 Å²	128	75%	0.752	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-48.9	133.8	178.4	-173.9	178.7	-171.9	175.4	0	115.6	N37	K35-N37 VanDerWaalsContact CE-OD1 3.22Å; K35-N37 WeakPolarHBondContact CE-OD1 3.37Å
36	P	46.9	Very low	40.6	Very low	124 Å²	124	127.9 Å²	127.9	81%	0.805	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-96.6	122.9	150.9	27.4	-16.5	0	0	0	110.9
37	N	37.4	Very low	40.5	Very low	140 Å²	140	128.7 Å²	128.7	75%	0.749	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-74.6	128.9	160.1	-82.9	-23	0	0	0	108.2	K35	K35-N37 VanDerWaalsContact CE-OD1 3.22Å; K35-N37 WeakPolarHBondContact CE-OD1 3.37Å
38	G	37.8	Very low	40	Very low	73 Å²	73	126 Å²	126	75%	0.753	77%	0.765	S	S	*	*			trans	172	75.2	175.6	0	0	0	0	0	116.2
39	R	35.9	Very low	39.8	Very low	246 Å²	246	125.9 Å²	125.9	93%	0.928	76%	0.759	S	S	*	*				58.3	116.1	130	-145.7	176	-178.6	160.6	-0.6	119.7
40	S	35	Very low	39.2	Very low	102 Å²	102	127.4 Å²	127.4	71%	0.713	76%	0.759	S	S	*	*			trans	89.1	121.3	143.6	-129.3	0	0	0	0	119.5
41	S	35.3	Very low	38.8	Very low	97 Å²	97	126.4 Å²	126.4	68%	0.678	75%	0.75	S	S	*	*			trans	55.3	112	137.1	-44.3	0	0	0	0	116
42	D	39.8	Very low	38.2	Very low	151 Å²	151	126 Å²	126	81%	0.807	75%	0.749	S	S	*	*			cis	-151.5	141.5	42.3	-88.6	-96.8	0	0	0	108.7
43	E	38.8	Very low	38.1	Very low	154 Å²	154	126.3 Å²	126.3	72%	0.72	73%	0.731	S	S	*	*			trans	-38.5	125.9	159.5	-169.4	177.3	99.9	0	0	109.8	S45	E43-S45 PolarHBondContact O-N 3.42Å
44	P	42.5	Very low	38.1	Very low	116 Å²	116	129.3 Å²	129.3	75%	0.753	74%	0.736	S	S	*	*			trans	-66.5	93.9	156.7	27.8	-26.5	0	0	0	103.8	S46	P44-S46 PolarHBondContact O-N 2.99Å
45	S	37	Very low	37.7	Very low	88 Å²	88	132.7 Å²	132.7	62%	0.615	73%	0.732	S	S	*	*			trans	-59.6	89.6	171.8	-153.6	0	0	0	0	104.9	E43 A47	E43-S45 PolarHBondContact O-N 3.42Å; S45-A47 PolarHBondContact O-N 3.43Å
46	S	39.5	Very low	37.5	Very low	109 Å²	109	126.4 Å²	126.4	76%	0.762	71%	0.707	S	S	*	*			trans	-63.9	85.8	162.6	-64.8	0	0	0	0	102.2	P44 A48	P44-S46 PolarHBondContact O-N 2.99Å; S46-A48 PolarHBondContact O-N 3.04Å
47	A	36.9	Very low	37.1	Very low	81 Å²	81	123.8 Å²	123.8	67%	0.669	69%	0.685	S	S	*	*			trans	-63.3	81.7	170.1	0	0	0	0	0	104.9	S45 I49	S45-A47 PolarHBondContact O-N 3.43Å; A47-I49 PolarHBondContact O-N 2.66Å
48	A	38.7	Very low	37.2	Very low	78 Å²	78	121.7 Å²	121.7	65%	0.645	67%	0.673	S	S	*	*			trans	-59.4	98.7	162	0	0	0	0	0	103.4	S46 R50	S46-A48 PolarHBondContact O-N 3.04Å; A48-R50 PolarHBondContact O-N 3.37Å
49	I	38.3	Very low	37.5	Very low	119 Å²	119	120.1 Å²	120.1	61%	0.61	65%	0.653	S	S	*	*			trans	-61.6	91.8	169.5	-61.7	175	0	0	0	104.1	A47 H51	A47-I49 PolarHBondContact O-N 2.66Å; I49-H51 HydrophobicContact CG2-CB 4.23Å; I49-H51 WeakPolarHBondContact CG2-CD2 3.39Å; I49-H51 PolarHBondContact O-N 2.77Å
50	R	34.1	Very low	37.9	Very low	219 Å²	219	112.1 Å²	112.1	83%	0.826	63%	0.632	S	S	*	*			trans	-73.7	84.5	175.5	-80.3	-171.8	178.2	-123.3	3.2	106.7	A48	A48-R50 PolarHBondContact O-N 3.37Å
51	H	36.4	Very low	38.4	Very low	122 Å²	122	111.3 Å²	111.3	57%	0.565	62%	0.618	S	S	*	*			trans	-90.5	119.4	173.9	-125	-112.2	0	0	0	102.3	I49 D56	I49-H51 HydrophobicContact CG2-CB 4.23Å; I49-H51 WeakPolarHBondContact CG2-CD2 3.39Å; I49-H51 PolarHBondContact O-N 2.77Å; H51-D56 VanDerWaalsContact CA-OD2 3.24Å; H51-D56 WeakPolarHBondContact CA-OD2 3.38Å; H51-D56 HydrophobicContact CB-CB 3.67Å; H51-D56 WeakPolarHBondContact CB-OD1 3.42Å; H51-D56 VanDerWaalsContact CB-OD2 3.29Å; H51-D56 WeakPolarHBondContact CB-OD2 3.27Å; H51-D56 IonicContact CE1-OD1 3.91Å; H51-D56 IonicContact CG-OD1 3.91Å; H51-D56 VanDerWaalsContact CG-OD1 3.29Å; H51-D56 IonicContact CG-OD2 3.87Å; H51-D56 IonicContact ND1-OD1 2.71Å; H51-D56 PolarHBondContact ND1-OD1 2.79Å; H51-D56 IonicContact ND1-OD2 3.29Å; H51-D56 WeakPolarHBondContact O-CB 3.36Å
52	N	34.9	Very low	38.8	Very low	161 Å²	161	110.8 Å²	110.8	86%	0.861	61%	0.608	S	S	*	*			trans	-101.6	46	-166.3	-103.1	-22.1	0	0	0	112.6	D56	N52-D56 PolarHBondContact N-OD2 3.12Å
53	N	35.4	Very low	38.9	Very low	93 Å²	93	110.5 Å²	110.5	50%	0.497	60%	0.601	S	S	.	*	S	Bend	trans	-139	136.9	-178	-166.5	-19.8	0	0	0	107.6	R55 D56	N53-R55 PolarHBondContact O-N 3.39Å; N53-D56 VanDerWaalsContact CA-OD2 3.23Å; N53-D56 WeakPolarHBondContact CA-OD2 3.04Å; N53-D56 WeakPolarHBondContact CB-OD2 3.37Å; N53-D56 PolarHBondContact N-OD2 3.26Å; N53-D56 WeakPolarHBondContact O-CB 3.46Å; N53-D56 PolarHBondContact O-N 3.4Å
54	P	36.5	Very low	39	Very low	139 Å²	139	106.8 Å²	106.8	90%	0.903	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	14.7	174.5	22.9	-35	0	0	0	115.5
55	R	35.7	Very low	38.8	Very low	202 Å²	202	110 Å²	110	76%	0.762	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	10.3	170.3	-73.1	-170.7	170.4	-156	-2.8	113.4	N53 I57	N53-R55 PolarHBondContact O-N 3.39Å; R55-I57 PolarHBondContact O-N 2.95Å; R55-I57 VanDerWaalsContact O-N 3.15Å
56	D	35.4	Very low	38.9	Very low	41 Å²	41	110.3 Å²	110.3	22%	0.219	59%	0.589	C	S	.	*			trans	-89.8	98.7	-163.2	-76.6	-38.6	0	0	0	114.2	H51 N52 N53 I58	H51-D56 VanDerWaalsContact CA-OD2 3.24Å; H51-D56 WeakPolarHBondContact CA-OD2 3.38Å; H51-D56 HydrophobicContact CB-CB 3.67Å; H51-D56 WeakPolarHBondContact CB-OD1 3.42Å; H51-D56 VanDerWaalsContact CB-OD2 3.29Å; H51-D56 WeakPolarHBondContact CB-OD2 3.27Å; H51-D56 IonicContact CE1-OD1 3.91Å; H51-D56 IonicContact CG-OD1 3.91Å; H51-D56 VanDerWaalsContact CG-OD1 3.29Å; H51-D56 IonicContact CG-OD2 3.87Å; H51-D56 IonicContact ND1-OD1 2.71Å; H51-D56 PolarHBondContact ND1-OD1 2.79Å; H51-D56 IonicContact ND1-OD2 3.29Å; H51-D56 WeakPolarHBondContact O-CB 3.36Å; N52-D56 PolarHBondContact N-OD2 3.12Å; N53-D56 VanDerWaalsContact CA-OD2 3.23Å; N53-D56 WeakPolarHBondContact CA-OD2 3.04Å; N53-D56 WeakPolarHBondContact CB-OD2 3.37Å; N53-D56 PolarHBondContact N-OD2 3.26Å; N53-D56 WeakPolarHBondContact O-CB 3.46Å; N53-D56 PolarHBondContact O-N 3.4Å; D56-I58 PolarHBondContact O-N 2.72Å
57	I	37.1	Very low	38.7	Very low	69 Å²	69	112.8 Å²	112.8	35%	0.354	59%	0.593	S	S	.	*			trans	-50.5	104.3	164	-59.7	174	0	0	0	108	R55 A59 F86	R55-I57 PolarHBondContact O-N 2.95Å; R55-I57 VanDerWaalsContact O-N 3.15Å; I57-A59 VanDerWaalsContact C-N 3.31Å; I57-A59 HydrophobicContact CG2-CB 4.36Å; I57-A59 PolarHBondContact O-N 3.09Å; I57-F86 HydrophobicContact CG2-CD1 3.51Å; I57-F86 HydrophobicContact CG2-CE1 4.19Å
58	I	40.4	Very low	38.7	Very low	96 Å²	96	117 Å²	117	49%	0.492	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.7	91.9	166	-54.8	176.6	0	0	0	105.7	D56 K87	D56-I58 PolarHBondContact O-N 2.72Å; I58-K87 HydrophobicContact CB-CB 4.16Å; I58-K87 PolarHBondContact O-N 2.9Å; I58-K87 VanDerWaalsContact O-N 3.1Å
59	A	43.8	Very low	38.5	Very low	40 Å²	40	117.6 Å²	117.6	33%	0.331	60%	0.598	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.3	108.5	168.8	0	0	0	0	0	108.1	I57 S85 F86	I57-A59 VanDerWaalsContact C-N 3.31Å; I57-A59 HydrophobicContact CG2-CB 4.36Å; I57-A59 PolarHBondContact O-N 3.09Å; A59-S85 CarbonylContact C-O 3.6Å; A59-S85 WeakPolarHBondContact CA-O 3.18Å; A59-F86 HydrophobicContact CB-CD1 4.08Å; A59-F86 HydrophobicContact CB-CE1 3.99Å
60	T	43.8	Very low	38.4	Very low	78 Å²	78	116.4 Å²	116.4	48%	0.479	61%	0.606	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.7	107	166.2	-52.4	0	0	0	0	107.2	D62 S85	T60-D62 PolarHBondContact O-N 3.4Å; T60-S85 PolarHBondContact N-O 3.05Å; T60-S85 PolarHBondContact O-N 2.81Å
61	I	45.2	Very low	38.4	Very low	85 Å²	85	111.5 Å²	111.5	44%	0.436	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.1	106.1	172.7	-57.8	178.4	0	0	0	106.5	T82 M84	I61-T82 HydrophobicContact CG2-CG2 3.39Å; I61-M84 HydrophobicContact CG1-CG 4.18Å
62	D	43.5	Very low	38.2	Very low	85 Å²	85	111.5 Å²	111.5	46%	0.455	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.4	113.8	172.9	-155.1	-70.3	0	0	0	108.4	T60 T64 A83	T60-D62 PolarHBondContact O-N 3.4Å; D62-T64 PolarHBondContact O-N 2.76Å; D62-T64 WeakPolarHBondContact OD1-CG2 3.03Å; D62-T64 PolarHBondContact OD1-N 2.66Å; D62-A83 PolarHBondContact N-O 3.34Å; D62-A83 VanDerWaalsContact N-O 3.09Å
63	H	41.8	Very low	38	Very low	146 Å²	146	112.2 Å²	112.2	68%	0.676	61%	0.609	S	S	*	*			trans	-82.3	61.2	175.8	-73.8	-72.5	0	0	0	110.2	Q65	H63-Q65 PolarHBondContact O-N 3.37Å
64	T	41.3	Very low	37.8	Very low	76 Å²	76	116 Å²	116	47%	0.466	62%	0.623	S	S	.	*			trans	-74.3	120.6	168	32.1	0	0	0	0	110.2	D62 L66	D62-T64 PolarHBondContact O-N 2.76Å; D62-T64 WeakPolarHBondContact OD1-CG2 3.03Å; D62-T64 PolarHBondContact OD1-N 2.66Å; T64-L66 PolarHBondContact O-N 2.84Å
65	Q	38.4	Very low	37.5	Very low	183 Å²	183	115.6 Å²	115.6	86%	0.855	61%	0.614	S	S	*	*			trans	-63	104.7	159.5	-72	-168.8	39.9	0	0	107.8	H63 N67	H63-Q65 PolarHBondContact O-N 3.37Å; Q65-N67 VanDerWaalsContact C-N 3.29Å; Q65-N67 PolarHBondContact O-N 3.47Å
66	L	39.2	Very low	37.2	Very low	95 Å²	95	111.4 Å²	111.4	50%	0.497	62%	0.623	S	S	.	*			trans	-64.6	95.2	167.4	-88.3	133	0	0	0	108	T64 Y68 E81	T64-L66 PolarHBondContact O-N 2.84Å; L66-Y68 PolarHBondContact O-N 2.96Å; L66-E81 HydrophobicContact CD1-CB 3.84Å
67	N	35.8	Very low	37.2	Very low	160 Å²	160	116.2 Å²	116.2	86%	0.856	64%	0.643	S	S	*	*			trans	-72.1	85	172.3	-153	14.3	0	0	0	107.2	Q65 A69	Q65-N67 VanDerWaalsContact C-N 3.29Å; Q65-N67 PolarHBondContact O-N 3.47Å; N67-A69 PolarHBondContact O-N 3.13Å
68	Y	36.1	Very low	37.1	Very low	171 Å²	171	118.9 Å²	118.9	67%	0.671	66%	0.663	S	S	*	*			trans	-56.1	114.7	173	-104.4	-97.5	0	0	0	107.7	L66 A70	L66-Y68 PolarHBondContact O-N 2.96Å; Y68-A70 PolarHBondContact O-N 3.4Å
69	A	36.3	Very low	36.9	Very low	90 Å²	90	116.6 Å²	116.6	74%	0.744	66%	0.656	S	S	*	*			trans	-53.7	111.6	168.9	0	0	0	0	0	107.3	N67 T71	N67-A69 PolarHBondContact O-N 3.13Å; A69-T71 PolarHBondContact O-N 3.47Å
70	A	35.1	Very low	36.7	Very low	94 Å²	94	123.5 Å²	123.5	78%	0.777	68%	0.675	S	S	*	*			trans	-55.9	97.7	-168.7	0	0	0	0	0	111.4	Y68 P72	Y68-A70 PolarHBondContact O-N 3.4Å; A70-P72 WeakPolarHBondContact O-CD 3.2Å
71	T	33.3	Very low	36.6	Very low	116 Å²	116	121.6 Å²	121.6	71%	0.712	66%	0.661	S	S	*	*			trans	-69.4	117.4	155.5	42.3	0	0	0	0	106.7	A69 Q73	A69-T71 PolarHBondContact O-N 3.47Å; T71-Q73 PolarHBondContact O-N 2.69Å
72	P	32.6	Very low	36.6	Very low	121 Å²	121	118.8 Å²	118.8	79%	0.786	65%	0.647	S	S	*	*	S	Bend	trans	-81.1	73	-171.1	33.5	-33.4	0	0	0	108.8	A70	A70-P72 WeakPolarHBondContact O-CD 3.2Å
73	Q	31.8	Very low	36.7	Very low	176 Å²	176	115.5 Å²	115.5	82%	0.822	63%	0.632	S	S	*	*	S	Bend	trans	-167.5	109.4	165.1	-109.6	163.3	27.4	0	0	110	T71	T71-Q73 PolarHBondContact O-N 2.69Å
74	H	29.8	Very low	37	Very low	172 Å²	172	111.1 Å²	111.1	80%	0.796	61%	0.612	S	S	*	*	S	Bend	trans	74.1	115.2	154.8	-125.8	-113.5	0	0	0	117.1
75	N	31.1	Very low	37.2	Very low	131 Å²	131	109.2 Å²	109.2	70%	0.701	60%	0.602	S	S	*	*			trans	81.1	72.6	167.9	-55.8	-20.6	0	0	0	117.1	Q77	N75-Q77 PolarHBondContact O-N 3.32Å
76	A	30.4	Very low	37.6	Very low	115 Å²	115	101.5 Å²	101.5	95%	0.95	57%	0.566	S	S	*	*			trans	-64.9	70.2	150	0	0	0	0	0	109.6
77	Q	33.7	Very low	37.9	Very low	141 Å²	141	101.1 Å²	101.1	66%	0.659	56%	0.56	S	S	*	*			trans	-94.3	102.3	164	-145.4	176	38.2	0	0	104.4	N75 S79	N75-Q77 PolarHBondContact O-N 3.32Å; Q77-S79 PolarHBondContact O-N 3.1Å
78	T	36.6	Very low	38.3	Very low	125 Å²	125	94.6 Å²	94.6	77%	0.767	53%	0.527	S	S	*	.			trans	-58.8	83.4	170.8	39	0	0	0	0	108.8
79	S	36	Very low	38.7	Very low	49 Å²	49	91.1 Å²	91.1	34%	0.343	52%	0.52	S	S	.	.			trans	-84.4	110	168.5	52.3	0	0	0	0	107.1	Q77 E81	Q77-S79 PolarHBondContact O-N 3.1Å; S79-E81 PolarHBondContact O-N 2.91Å
80	Y	38.8	Very low	39.2	Very low	185 Å²	185	94.2 Å²	94.2	73%	0.725	52%	0.524	S	S	*	.			trans	-59.6	101.1	163.7	-61.4	-90.6	0	0	0	107.6	S101	Y80-S101 PolarHBondContact O-OG 2.99Å
81	E	42.4	Very low	39.6	Very low	38 Å²	38	97.8 Å²	97.8	18%	0.178	53%	0.525	C	S	.	.			trans	-87.6	105.2	168.2	-68.2	-164	119.5	0	0	107.1	L66 S79 A83 S100	L66-E81 HydrophobicContact CD1-CB 3.84Å; S79-E81 PolarHBondContact O-N 2.91Å; E81-A83 PolarHBondContact O-N 2.88Å; E81-S100 WeakPolarHBondContact OE1-CB 3.23Å; E81-S100 PolarHBondContact OE1-OG 3.15Å
82	T	45.6	Very low	40.1	Very low	25 Å²	25	99.8 Å²	99.8	15%	0.153	53%	0.531	C	S	.	.			trans	-83.8	105.2	176.5	-58	0	0	0	0	108.1	I61 M84	I61-T82 HydrophobicContact CG2-CG2 3.39Å; T82-M84 HydrophobicContact CG2-CE 3.89Å; T82-M84 HydrophobicContact CG2-CG 4.08Å; T82-M84 PolarHBondContact O-N 3.44Å
83	A	44.6	Very low	40.8	Very low	17 Å²	17	100.2 Å²	100.2	14%	0.14	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	119.9	172.9	0	0	0	0	0	109.1	D62 E81	D62-A83 PolarHBondContact N-O 3.34Å; D62-A83 VanDerWaalsContact N-O 3.09Å; E81-A83 PolarHBondContact O-N 2.88Å
84	M	47.8	Very low	41.4	Very low	53 Å²	53	94.8 Å²	94.8	26%	0.261	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	102	177.7	-62.1	-169.9	-164.3	0	0	109.3	I61 T82 F86 C97 I99	I61-M84 HydrophobicContact CG1-CG 4.18Å; T82-M84 HydrophobicContact CG2-CE 3.89Å; T82-M84 HydrophobicContact CG2-CG 4.08Å; T82-M84 PolarHBondContact O-N 3.44Å; M84-F86 HydrophobicContact CB-CD2 4.42Å; M84-F86 HydrophobicContact CB-CE2 3.58Å; M84-F86 HydrophobicContact CB-CZ 3.84Å; M84-F86 VanDerWaalsContact O-CD2 3.27Å; M84-F86 WeakPolarHBondContact O-CD2 3.29Å; M84-F86 WeakPolarHBondContact O-CE2 3.24Å; M84-F86 HydrophobicContact SD-CZ 4.2Å; M84-C97 CarbonylContact C-O 3.47Å; M84-I99 HydrophobicContact CB-CD1 4.13Å; M84-I99 HydrophobicContact CB-CG1 4.37Å; M84-I99 HydrophobicContact CG-CD1 4.39Å; M84-I99 HydrophobicContact SD-CD1 3.85Å
85	S	46	Very low	42.1	Very low	36 Å²	36	90.6 Å²	90.6	25%	0.252	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	121.4	176.6	-55.2	0	0	0	0	109.2	A59 T60	A59-S85 CarbonylContact C-O 3.6Å; A59-S85 WeakPolarHBondContact CA-O 3.18Å; T60-S85 PolarHBondContact N-O 3.05Å; T60-S85 PolarHBondContact O-N 2.81Å
86	F	46.8	Very low	42.7	Very low	22 Å²	22	89.3 Å²	89.3	10%	0.096	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	124.7	175.9	-62.4	-85.6	0	0	0	109.6	I57 A59 M84 C97 I99	I57-F86 HydrophobicContact CG2-CD1 3.51Å; I57-F86 HydrophobicContact CG2-CE1 4.19Å; A59-F86 HydrophobicContact CB-CD1 4.08Å; A59-F86 HydrophobicContact CB-CE1 3.99Å; M84-F86 HydrophobicContact CB-CD2 4.42Å; M84-F86 HydrophobicContact CB-CE2 3.58Å; M84-F86 HydrophobicContact CB-CZ 3.84Å; M84-F86 VanDerWaalsContact O-CD2 3.27Å; M84-F86 WeakPolarHBondContact O-CD2 3.29Å; M84-F86 WeakPolarHBondContact O-CE2 3.24Å; M84-F86 HydrophobicContact SD-CZ 4.2Å; F86-C97 HydrophobicContact CD2-CB 4.09Å; F86-I99 HydrophobicContact CE2-CD1 3.51Å; F86-I99 HydrophobicContact CE2-CG1 4.26Å; F86-I99 HydrophobicContact CZ-CD1 3.78Å
87	K	45.2	Very low	43.5	Very low	86 Å²	86	84.1 Å²	84.1	37%	0.374	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	110.6	165.2	-148.9	175.5	179.4	-169.6	0	108.2	I58 A94	I58-K87 HydrophobicContact CB-CB 4.16Å; I58-K87 PolarHBondContact O-N 2.9Å; I58-K87 VanDerWaalsContact O-N 3.1Å; K87-A94 HydrophobicContact CG-CB 4.26Å
88	C	45.3	Very low	43.9	Very low	23 Å²	23	81.3 Å²	81.3	16%	0.155	44%	0.438	C	S	.	.			trans	-88.6	-12.8	-172.1	-75.4	0	0	0	0	115.2	C111 R114	C88-C111 PolarHBondContact SG-SG 2.74Å; C88-R114 PolarHBondContact O-NH1 2.84Å
89	N	42.6	Very low	44.4	Very low	99 Å²	99	77.6 Å²	77.6	53%	0.529	41%	0.413	S	S	.	.			trans	-164.9	162.2	170.9	-84	-22.3	0	0	0	109.8	E91 R114	N89-E91 PolarHBondContact O-N 3.15Å; N89-R114 PolarHBondContact OD1-NH2 2.03Å
90	D	47.2	Very low	44.6	Very low	154 Å²	154	76.2 Å²	76.2	82%	0.824	40%	0.403	S	S	*	.	S	Bend	trans	-67.7	-13.9	176	-105.6	-76.8	0	0	0	113.9	D92	D90-D92 PolarHBondContact O-N 3.37Å
91	E	44.6	Very low	44.7	Very low	170 Å²	170	71.1 Å²	71.1	79%	0.794	40%	0.395	S	S	*	.	S	Bend	trans	-90.9	102.6	178.3	-61.2	-166	112.1	0	0	111.2	N89 D93	N89-E91 PolarHBondContact O-N 3.15Å; E91-D93 VanDerWaalsContact C-N 3.35Å; E91-D93 PolarHBondContact O-N 3.49Å
92	D	43.1	Very low	44.4	Very low	158 Å²	158	74.5 Å²	74.5	85%	0.845	41%	0.409	S	S	*	.	S	Bend	trans	47.9	-5.7	152.2	-97.7	-93.6	0	0	0	124.3	D90	D90-D92 PolarHBondContact O-N 3.37Å
93	D	47.1	Very low	44.1	Very low	129 Å²	129	84.5 Å²	84.5	69%	0.69	44%	0.444	S	S	*	.			trans	-130.5	87.6	177.4	-77.6	-68.2	0	0	0	112	E91 Q95	E91-D93 VanDerWaalsContact C-N 3.35Å; E91-D93 PolarHBondContact O-N 3.49Å; D93-Q95 PolarHBondContact O-N 2.92Å
94	A	44.5	Very low	44	Very low	63 Å²	63	91.5 Å²	91.5	52%	0.521	48%	0.479	S	S	.	.			trans	-64.5	99	165.8	0	0	0	0	0	109.1	K87 V96	K87-A94 HydrophobicContact CG-CB 4.26Å; A94-V96 PolarHBondContact O-N 3.4Å; A94-V96 VanDerWaalsContact O-N 3.12Å
95	Q	43.9	Very low	43.4	Very low	84 Å²	84	91.2 Å²	91.2	39%	0.393	48%	0.483	S	S	.	.			trans	-73.7	102.9	173.2	-69.6	-172.8	13.4	0	0	109.2	D93 C97	D93-Q95 PolarHBondContact O-N 2.92Å; Q95-C97 PolarHBondContact O-N 3.47Å; Q95-C97 VanDerWaalsContact O-N 3.13Å
96	V	45.4	Very low	43.4	Very low	104 Å²	104	93 Å²	93	63%	0.63	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	106.2	170.7	-177.4	0	0	0	0	108.1	A94	A94-V96 PolarHBondContact O-N 3.4Å; A94-V96 VanDerWaalsContact O-N 3.12Å
97	C	45.6	Very low	43.5	Very low	5 Å²	5	98.7 Å²	98.7	3%	0.034	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	122.8	176.4	-62.7	0	0	0	0	109.6	M84 F86 Q95 I99 C108 C111	M84-C97 CarbonylContact C-O 3.47Å; F86-C97 HydrophobicContact CD2-CB 4.09Å; Q95-C97 PolarHBondContact O-N 3.47Å; Q95-C97 VanDerWaalsContact O-N 3.13Å; C97-I99 PolarHBondContact O-N 3.46Å; C97-C108 HydrophobicContact CB-CB 3.97Å; C97-C108 WeakPolarHBondContact CB-SG 3.48Å; C97-C108 WeakPolarHBondContact SG-CB 3.21Å; C97-C108 CovalentContact SG-SG 2.03Å; C97-C108 PolarHBondContact SG-SG 3.5Å; C97-C111 VanDerWaalsContact SG-SG 3.65Å
98	V	43.6	Very low	43.4	Very low	82 Å²	82	95.4 Å²	95.4	50%	0.497	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	108.4	172.6	-176.7	0	0	0	0	108	S100	V98-S100 PolarHBondContact O-N 3.32Å
99	I	47	Very low	43.6	Very low	47 Å²	47	99 Å²	99	24%	0.241	53%	0.534	C	S	.	.			trans	-88.9	100	169.5	-60.5	-175.9	0	0	0	107.1	M84 F86 C97	M84-I99 HydrophobicContact CB-CD1 4.13Å; M84-I99 HydrophobicContact CB-CG1 4.37Å; M84-I99 HydrophobicContact CG-CD1 4.39Å; M84-I99 HydrophobicContact SD-CD1 3.85Å; F86-I99 HydrophobicContact CE2-CD1 3.51Å; F86-I99 HydrophobicContact CE2-CG1 4.26Å; F86-I99 HydrophobicContact CZ-CD1 3.78Å; C97-I99 PolarHBondContact O-N 3.46Å
100	S	40.1	Very low	43.6	Very low	20 Å²	20	97.6 Å²	97.6	14%	0.14	53%	0.529	C	S	.	.			trans	-75	130.7	169.6	-168.7	0	0	0	0	108.8	E81 V98 K102	E81-S100 WeakPolarHBondContact OE1-CB 3.23Å; E81-S100 PolarHBondContact OE1-OG 3.15Å; V98-S100 PolarHBondContact O-N 3.32Å; S100-K102 PolarHBondContact O-N 3Å
101	S	40.2	Very low	43.5	Very low	79 Å²	79	90.8 Å²	90.8	55%	0.552	49%	0.494	S	S	*	.	S	Bend	trans	-59.1	-6.3	175.2	-51.1	0	0	0	0	113.3	Y80 R103	Y80-S101 PolarHBondContact O-OG 2.99Å; S101-R103 PolarHBondContact O-N 2.62Å
102	K	36.4	Very low	43.5	Very low	109 Å²	109	85.3 Å²	85.3	47%	0.474	47%	0.469	S	S	.	.	S	Bend	trans	-89.3	101.9	173.7	-72	177.8	178.5	166.5	0	109.6	S100	S100-K102 PolarHBondContact O-N 3Å
103	R	39.2	Very low	43.5	Very low	235 Å²	235	82.6 Å²	82.6	89%	0.887	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	15.5	113.2	155.3	-63.5	-176.4	-171.7	-176.2	2.1	115	S101 S105	S101-R103 PolarHBondContact O-N 2.62Å; R103-S105 PolarHBondContact O-N 2.98Å
104	N	41.7	Very low	43.3	Very low	163 Å²	163	82.2 Å²	82.2	87%	0.872	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	9.5	161.7	-57.1	0.9	0	0	0	118.3	T106	N104-T106 PolarHBondContact O-N 3.14Å
105	S	37.2	Very low	43.2	Very low	48 Å²	48	84.2 Å²	84.2	34%	0.336	45%	0.445	S	S	.	.			trans	-97.3	70.8	174.8	170.6	0	0	0	0	111.2	R103	R103-S105 PolarHBondContact O-N 2.98Å
106	T	45.7	Very low	43.2	Very low	72 Å²	72	89.9 Å²	89.9	44%	0.442	46%	0.464	S	S	.	.			trans	-103.7	85.5	172.7	-30.2	0	0	0	0	109.1	N104 C108 I112	N104-T106 PolarHBondContact O-N 3.14Å; T106-C108 PolarHBondContact O-N 3.4Å; T106-C108 VanDerWaalsContact O-N 3.15Å; T106-I112 HydrophobicContact CG2-CD1 3.34Å; T106-I112 HydrophobicContact CG2-CG1 3.33Å
107	N	48.5	Very low	42.9	Very low	142 Å²	142	95 Å²	95	76%	0.759	48%	0.481	S	S	*	.			trans	-78	14	-178.9	-78.8	-16	0	0	0	114.1	P109	N107-P109 WeakPolarHBondContact O-CD 3.45Å
108	C	42.8	Very low	42.8	Very low	17 Å²	17	99.5 Å²	99.5	12%	0.115	50%	0.503	C	S	.	.			trans	-119.7	82.5	178.6	-76.1	0	0	0	0	110.9	C97 T106 T110 C111 I112	C97-C108 HydrophobicContact CB-CB 3.97Å; C97-C108 WeakPolarHBondContact CB-SG 3.48Å; C97-C108 WeakPolarHBondContact SG-CB 3.21Å; C97-C108 CovalentContact SG-SG 2.03Å; C97-C108 PolarHBondContact SG-SG 3.5Å; T106-C108 PolarHBondContact O-N 3.4Å; T106-C108 VanDerWaalsContact O-N 3.15Å; C108-T110 PolarHBondContact O-N 3.3Å; C108-T110 VanDerWaalsContact O-N 3.14Å; C108-C111 HydrophobicContact CB-CB 3.88Å; C108-C111 PolarHBondContact O-N 3.03Å; C108-I112 WeakPolarHBondContact O-CG1 3.38Å; C108-I112 PolarHBondContact O-N 3.33Å
109	P	48.5	Very low	42.7	Very low	98 Å²	98	100.4 Å²	100.4	64%	0.636	50%	0.504	S	S	*	.	H	α-helix	trans	-55.5	-31.1	176.2	21.1	-31.2	0	0	0	112	N107 C111 D113	N107-P109 WeakPolarHBondContact O-CD 3.45Å; P109-C111 PolarHBondContact O-N 3.23Å; P109-D113 PolarHBondContact O-N 3.47Å
110	T	44.1	Very low	42.5	Very low	71 Å²	71	103.3 Å²	103.3	44%	0.436	52%	0.518	S	S	.	.	H	α-helix	trans	-68.6	-30.6	177.8	-30.4	0	0	0	0	114	C108	C108-T110 PolarHBondContact O-N 3.3Å; C108-T110 VanDerWaalsContact O-N 3.14Å
111	C	45.3	Very low	42.6	Very low	11 Å²	11	108.2 Å²	108.2	7%	0.074	54%	0.54	C	S	.	.	H	α-helix	trans	-86.4	-32	-179.3	-70.1	0	0	0	0	112.2	C88 C97 C108 P109 R114 L115	C88-C111 PolarHBondContact SG-SG 2.74Å; C97-C111 VanDerWaalsContact SG-SG 3.65Å; C108-C111 HydrophobicContact CB-CB 3.88Å; C108-C111 PolarHBondContact O-N 3.03Å; P109-C111 PolarHBondContact O-N 3.23Å; C111-R114 PolarHBondContact O-N 2.69Å; C111-L115 WeakPolarHBondContact O-CG 3.43Å; C111-L115 PolarHBondContact O-N 2.71Å
112	I	44.5	Very low	42.8	Very low	55 Å²	55	110.1 Å²	110.1	28%	0.282	54%	0.54	S	S	.	.	H	α-helix	trans	-67.3	-41.9	178.7	-61.5	166.6	0	0	0	110.7	T106 C108 R114 L115 Y116	T106-I112 HydrophobicContact CG2-CD1 3.34Å; T106-I112 HydrophobicContact CG2-CG1 3.33Å; C108-I112 WeakPolarHBondContact O-CG1 3.38Å; C108-I112 PolarHBondContact O-N 3.33Å; I112-R114 PolarHBondContact O-N 3.33Å; I112-L115 PolarHBondContact O-N 2.98Å; I112-Y116 HydrophobicContact CG2-CD2 3.78Å; I112-Y116 HydrophobicContact CG2-CE2 3.99Å; I112-Y116 WeakPolarHBondContact O-CD2 3.45Å; I112-Y116 PolarHBondContact O-N 3.22Å
113	D	43.2	Very low	43.2	Very low	101 Å²	101	110.1 Å²	110.1	54%	0.54	54%	0.544	S	S	.	.	H	α-helix	trans	-62.8	-29.3	-177.9	-152.2	-94	0	0	0	112.3	P109 Q117	P109-D113 PolarHBondContact O-N 3.47Å; D113-Q117 PolarHBondContact OD1-NE2 3.04Å
114	R	42.4	Very low	43.5	Very low	121 Å²	121	101.2 Å²	101.2	46%	0.457	52%	0.52	S	S	.	.	H	α-helix	trans	-85.4	-15.8	175.1	-67.5	-158.6	-176.9	-171	9.4	114.7	C88 N89 C111 I112	C88-R114 PolarHBondContact O-NH1 2.84Å; N89-R114 PolarHBondContact OD1-NH2 2.03Å; C111-R114 PolarHBondContact O-N 2.69Å; I112-R114 PolarHBondContact O-N 3.33Å
115	L	42.6	Very low	43.6	Very low	104 Å²	104	96.5 Å²	96.5	55%	0.545	49%	0.492	S	S	.	.	H	α-helix	trans	-87.4	-17.2	178	-81	163.7	0	0	0	113.1	C111 I112	C111-L115 WeakPolarHBondContact O-CG 3.43Å; C111-L115 PolarHBondContact O-N 2.71Å; I112-L115 PolarHBondContact O-N 2.98Å
116	Y	43	Very low	44.2	Very low	204 Å²	204	100.5 Å²	100.5	80%	0.8	51%	0.506	S	S	*	.			trans	-115.9	8.1	-175.9	-74.9	-83.5	0	0	0	114.6	I112	I112-Y116 HydrophobicContact CG2-CD2 3.78Å; I112-Y116 HydrophobicContact CG2-CE2 3.99Å; I112-Y116 WeakPolarHBondContact O-CD2 3.45Å; I112-Y116 PolarHBondContact O-N 3.22Å
117	Q	39.3	Very low	44	Very low	210 Å²	210	103.1 Å²	103.1	98%	0.981	51%	0.511	S	S	*	.			trans	-98.1	0	168.3	-80.3	-172.8	45	0	0	111.2	D113	D113-Q117 PolarHBondContact OD1-NE2 3.04Å

Retrieved 117 of 117 residues in 173.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).