A0A077Z6Q3_TRITR Loading...

WW domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z6Q3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 209 aa.

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	50.7	Low	51.4	Low	244 Å²	244	156.2 Å²	156.2	100%	1.202	88%	0.88	S	S	*	*				0	114.4	0	-89.4	74.9	175.6	0	0	108.7
2	A	40	Very low	50.7	Low	87 Å²	87	149.9 Å²	149.9	72%	0.719	88%	0.876	S	S	*	*			trans	-86.1	143.9	171.7	0	0	0	0	0	109.5
3	L	60.9	Low	50.2	Low	180 Å²	180	145.2 Å²	145.2	94%	0.942	88%	0.879	S	S	*	*			trans	-132.8	127.8	163.5	-93.8	166.9	0	0	0	109.7
4	Y	43.8	Very low	49.6	Very low	229 Å²	229	140.4 Å²	140.4	90%	0.898	87%	0.874	S	S	*	*			trans	-86.5	164.7	-169.1	-96.2	-109.8	0	0	0	113.1
5	G	56.6	Low	49.1	Very low	66 Å²	66	136.7 Å²	136.7	68%	0.68	87%	0.874	S	S	*	*			trans	120.2	133.4	148.3	0	0	0	0	0	113.6
6	E	49.5	Very low	49.1	Very low	194 Å²	194	133 Å²	133	91%	0.907	87%	0.869	S	S	*	*			cis	-160.1	146.4	4.9	-92.3	178.1	107.3	0	0	107.1
7	Y	52.5	Low	48.6	Very low	230 Å²	230	134.6 Å²	134.6	90%	0.902	87%	0.869	S	S	*	*			trans	-103.8	140.5	166.1	-80.8	-93.7	0	0	0	108.7
8	P	65.5	Low	49.2	Very low	131 Å²	131	133.4 Å²	133.4	85%	0.851	87%	0.865	S	S	*	*			trans	-81.9	155	159.4	32.8	-27.7	0	0	0	111
9	Q	51.7	Low	49.1	Very low	195 Å²	195	137.2 Å²	137.2	91%	0.911	87%	0.869	S	S	*	*			trans	-112.6	149.8	-152.4	174.6	-164.4	74.5	0	0	110.2
10	G	49.4	Very low	49.6	Very low	79 Å²	79	136.4 Å²	136.4	81%	0.814	86%	0.862	S	S	*	*			trans	87.1	135.1	153	0	0	0	0	0	115.9
11	G	44.3	Very low	50.1	Low	83 Å²	83	135.2 Å²	135.2	86%	0.856	86%	0.856	S	S	*	*			cis	167.1	159.8	3.2	0	0	0	0	0	109.6
12	G	43.6	Very low	50.2	Low	81 Å²	81	131.4 Å²	131.4	84%	0.835	84%	0.839	S	S	*	*			trans	113.7	95.5	151.6	0	0	0	0	0	118.1
13	G	44.4	Very low	51.2	Low	88 Å²	88	132.6 Å²	132.6	91%	0.907	84%	0.837	S	S	*	*			trans	70.5	133.7	142.6	0	0	0	0	0	117.6
14	G	41.6	Very low	50.8	Low	79 Å²	79	132.3 Å²	132.3	81%	0.814	83%	0.831	S	S	*	*			cis	159.8	139.7	8.1	0	0	0	0	0	107.1
15	G	42.3	Very low	51.4	Low	85 Å²	85	128.8 Å²	128.8	88%	0.876	82%	0.822	S	S	*	*			trans	99.9	118	156.9	0	0	0	0	0	118.2
16	G	49.2	Very low	51.3	Low	77 Å²	77	134.2 Å²	134.2	79%	0.794	83%	0.83	S	S	*	*			trans	108.6	88.6	131.7	0	0	0	0	0	117.8
17	D	40.4	Very low	51.7	Low	160 Å²	160	134.8 Å²	134.8	86%	0.856	82%	0.824	S	S	*	*			trans	-3.2	128.5	151.7	-68.2	-43.6	0	0	0	119.5
18	S	58.9	Low	52.1	Low	114 Å²	114	129.2 Å²	129.2	80%	0.797	82%	0.818	S	S	*	*				-178.1	109.3	119	-79.9	0	0	0	0	110.9	V20	S18-V20 PolarHBondContact O-N 2.81Å; S18-V20 VanDerWaalsContact O-N 3.13Å
19	Q	47.7	Very low	51.9	Low	204 Å²	204	133.4 Å²	133.4	95%	0.953	82%	0.817	S	S	*	*			trans	-65.8	101.9	176.8	-163.7	179.7	13.7	0	0	109.9
20	V	59.2	Low	53	Low	121 Å²	121	128.6 Å²	128.6	73%	0.733	81%	0.805	S	S	*	*			trans	-79.4	130.5	172.5	-84.4	0	0	0	0	110.4	S18 I22	S18-V20 PolarHBondContact O-N 2.81Å; S18-V20 VanDerWaalsContact O-N 3.13Å; V20-I22 PolarHBondContact O-N 3.28Å
21	P	59.1	Low	54.3	Low	112 Å²	112	131.9 Å²	131.9	73%	0.727	80%	0.804	S	S	*	*			trans	-67.4	122.6	178.3	26.8	-31.8	0	0	0	109.8	V23	P21-V23 PolarHBondContact O-N 2.81Å
22	I	53.7	Low	56.2	Low	165 Å²	165	133.1 Å²	133.1	85%	0.846	80%	0.795	S	S	*	*			trans	-68.8	96.9	172.3	-61.3	171.2	0	0	0	107.3	V20 Q24	V20-I22 PolarHBondContact O-N 3.28Å; I22-Q24 PolarHBondContact O-N 3.05Å
23	V	60	Low	58.2	Low	112 Å²	112	134.7 Å²	134.7	68%	0.679	79%	0.788	S	S	*	*			trans	-72.2	98.4	168.4	-178.4	0	0	0	0	107.1	P21 H25	P21-V23 PolarHBondContact O-N 2.81Å; V23-H25 VanDerWaalsContact C-N 3.27Å; V23-H25 PolarHBondContact O-N 3.48Å
24	Q	52.9	Low	60.1	Low	174 Å²	174	137.7 Å²	137.7	81%	0.813	78%	0.782	S	S	*	*			trans	-66	90.3	171.8	-170.6	169.7	-26.7	0	0	108.1	I22 Q26	I22-Q24 PolarHBondContact O-N 3.05Å; Q24-Q26 VanDerWaalsContact C-N 3.31Å; Q24-Q26 PolarHBondContact O-N 2.82Å
25	H	56.9	Low	62.4	Low	155 Å²	155	144.3 Å²	144.3	72%	0.718	78%	0.782	S	S	*	*			trans	-63.7	96.8	173	-125.6	85	0	0	0	107.1	V23 R27	V23-H25 VanDerWaalsContact C-N 3.27Å; V23-H25 PolarHBondContact O-N 3.48Å; H25-R27 PolarHBondContact O-N 3.2Å
26	Q	55.5	Low	64.6	Low	180 Å²	180	144.3 Å²	144.3	84%	0.841	77%	0.769	S	S	*	*			trans	-65.4	77.4	169.8	-172.1	162.3	-53.2	0	0	107.2	Q24 S28	Q24-Q26 VanDerWaalsContact C-N 3.31Å; Q24-Q26 PolarHBondContact O-N 2.82Å; Q26-S28 VanDerWaalsContact C-N 3.32Å; Q26-S28 PolarHBondContact O-N 3.13Å
27	R	57.8	Low	66.5	Low	205 Å²	205	148.5 Å²	148.5	77%	0.774	77%	0.773	S	S	*	*			trans	-60	101.1	171.8	-74.4	-177.7	167.2	-123.9	0.1	105.8	H25 R29	H25-R27 PolarHBondContact O-N 3.2Å; R27-R29 VanDerWaalsContact C-N 3.34Å; R27-R29 WeakPolarHBondContact O-CG 3.38Å; R27-R29 PolarHBondContact O-N 2.92Å
28	S	61	Low	68.8	Low	113 Å²	113	145.4 Å²	145.4	79%	0.79	76%	0.76	S	S	*	*			trans	-47.9	103.1	166.8	-177.1	0	0	0	0	106.9	Q26 S30	Q26-S28 VanDerWaalsContact C-N 3.32Å; Q26-S28 PolarHBondContact O-N 3.13Å; S28-S30 VanDerWaalsContact C-N 3.28Å; S28-S30 PolarHBondContact O-N 2.85Å
29	R	61.3	Low	70.4	Confident	219 Å²	219	145 Å²	145	83%	0.826	75%	0.748	S	S	*	*			trans	-75.9	87.5	-177.1	-72.2	-171.3	165.6	163.8	-4	106.8	R27 N31	R27-R29 VanDerWaalsContact C-N 3.34Å; R27-R29 WeakPolarHBondContact O-CG 3.38Å; R27-R29 PolarHBondContact O-N 2.92Å; R29-N31 PolarHBondContact O-N 2.81Å; R29-N31 VanDerWaalsContact O-N 3.12Å
30	S	73.7	Confident	72.4	Confident	95 Å²	95	140.3 Å²	140.3	66%	0.664	73%	0.729	S	S	*	*			trans	-61.1	112.9	163.1	48	0	0	0	0	107.4	S28 V32	S28-S30 VanDerWaalsContact C-N 3.28Å; S28-S30 PolarHBondContact O-N 2.85Å; S30-V32 PolarHBondContact O-N 2.85Å
31	N	78	Confident	74	Confident	147 Å²	147	140 Å²	140	79%	0.786	72%	0.724	S	S	*	*			trans	-78.1	72.6	177.1	-65.3	-37.8	0	0	0	109	R29 V33	R29-N31 PolarHBondContact O-N 2.81Å; R29-N31 VanDerWaalsContact O-N 3.12Å; N31-V33 PolarHBondContact O-N 2.88Å
32	V	83.5	Confident	75.5	Confident	109 Å²	109	138.9 Å²	138.9	66%	0.661	71%	0.709	S	S	*	*			trans	-82.8	108.9	173.3	-176.5	0	0	0	0	107.9	S30 I34	S30-V32 PolarHBondContact O-N 2.85Å; V32-I34 HydrophobicContact CG1-CG1 4.09Å
33	V	85	Confident	77.3	Confident	114 Å²	114	133.1 Å²	133.1	69%	0.691	69%	0.686	S	S	*	*			trans	-97.8	107.8	173.2	-178.9	0	0	0	0	108.1	N31 R35	N31-V33 PolarHBondContact O-N 2.88Å; V33-R35 HydrophobicContact CG1-CG 4.28Å
34	I	85.1	Confident	78.7	Confident	151 Å²	151	131.6 Å²	131.6	77%	0.774	67%	0.673	S	S	*	*			trans	-88.4	124.2	171.6	-57.2	176.7	0	0	0	107.4	V32	V32-I34 HydrophobicContact CG1-CG1 4.09Å
35	R	88.9	Confident	80.5	Confident	219 Å²	219	126.9 Å²	126.9	83%	0.826	65%	0.654	S	S	*	*			trans	-104.6	121.1	174.8	-63.1	-177.8	177.8	-132.9	0.7	108.5	V33	V33-R35 HydrophobicContact CG1-CG 4.28Å
36	S	88.7	Confident	82	Confident	85 Å²	85	122.5 Å²	122.5	59%	0.594	64%	0.636	S	S	*	*			trans	-111	126.8	168.8	52.9	0	0	0	0	108.7	V38	S36-V38 VanDerWaalsContact C-N 3.26Å
37	N	89.4	Confident	83.6	Confident	164 Å²	164	119.7 Å²	119.7	88%	0.877	62%	0.622	S	S	*	*	S	Bend	trans	-89.1	1.3	175.5	-66.4	-5	0	0	0	112.2
38	V	89.5	Confident	85.2	Confident	96 Å²	96	115.6 Å²	115.6	58%	0.582	61%	0.611	S	S	*	*	S	Bend	trans	-138.3	156.4	-175.6	-62.9	0	0	0	0	109.2	S36 L40	S36-V38 VanDerWaalsContact C-N 3.26Å; V38-L40 PolarHBondContact O-N 3.01Å
39	D	91	Very high	86.5	Confident	105 Å²	105	116 Å²	116	56%	0.561	60%	0.595	S	S	*	*			trans	-68.9	108.1	164.7	-174.9	-24.7	0	0	0	108.4	D41 Q42 A43	D39-D41 VanDerWaalsContact C-N 3.33Å; D39-D41 PolarHBondContact OD1-N 3.36Å; D39-D41 VanDerWaalsContact OD1-N 3.08Å; D39-Q42 HydrophobicContact CB-CB 3.94Å; D39-Q42 PolarHBondContact OD1-N 2.95Å; D39-Q42 VanDerWaalsContact OD1-N 3.16Å; D39-A43 WeakPolarHBondContact O-CB 3.45Å; D39-A43 PolarHBondContact O-N 2.97Å
40	L	91	Very high	87.3	Confident	105 Å²	105	109.6 Å²	109.6	55%	0.55	57%	0.573	S	S	.	*	H	α-helix	trans	-66.1	-37.4	-175.7	-178.4	63.5	0	0	0	111.5	V38 A43 L44	V38-L40 PolarHBondContact O-N 3.01Å; L40-A43 PolarHBondContact O-N 3.13Å; L40-L44 HydrophobicContact CD1-CD1 4.33Å; L40-L44 HydrophobicContact CD1-CG 4.19Å; L40-L44 HydrophobicContact CG-CD1 4.03Å; L40-L44 HydrophobicContact CG-CG 4.33Å; L40-L44 WeakPolarHBondContact O-CB 3.5Å; L40-L44 VanDerWaalsContact O-CG 3.24Å; L40-L44 WeakPolarHBondContact O-CG 3.3Å; L40-L44 PolarHBondContact O-N 2.92Å
41	D	91.3	Very high	87.6	Confident	115 Å²	115	107.4 Å²	107.4	62%	0.615	56%	0.557	S	S	*	*	H	α-helix	trans	-68	-43.7	-178.5	-70.3	-37.3	0	0	0	109.9	D39 L44 N45	D39-D41 VanDerWaalsContact C-N 3.33Å; D39-D41 PolarHBondContact OD1-N 3.36Å; D39-D41 VanDerWaalsContact OD1-N 3.08Å; D41-L44 PolarHBondContact O-N 3.04Å; D41-N45 WeakPolarHBondContact O-CB 3.29Å; D41-N45 PolarHBondContact O-N 3.24Å; D41-N45 PolarHBondContact O-ND2 3.16Å
42	Q	92.1	Very high	87.9	Confident	88 Å²	88	106 Å²	106	41%	0.411	55%	0.549	S	S	.	.	H	α-helix	trans	-62.9	-46.2	174.3	-174.7	58.6	48.9	0	0	111.4	D39 L44 N45 D46	D39-Q42 HydrophobicContact CB-CB 3.94Å; D39-Q42 PolarHBondContact OD1-N 2.95Å; D39-Q42 VanDerWaalsContact OD1-N 3.16Å; Q42-L44 VanDerWaalsContact C-N 3.34Å; Q42-L44 PolarHBondContact O-N 3.05Å; Q42-N45 PolarHBondContact O-N 3.24Å; Q42-D46 PolarHBondContact NE2-OD1 3.16Å; Q42-D46 PolarHBondContact NE2-OD2 3.36Å; Q42-D46 VanDerWaalsContact NE2-OD2 3.08Å; Q42-D46 WeakPolarHBondContact O-CB 3.31Å; Q42-D46 VanDerWaalsContact O-CG 3.26Å; Q42-D46 PolarHBondContact O-N 3.45Å
43	A	90.1	Very high	87.6	Confident	45 Å²	45	105.9 Å²	105.9	37%	0.372	54%	0.541	S	S	.	.	H	α-helix	trans	-62.2	-38.7	179.5	0	0	0	0	0	112.9	D39 L40 H47	D39-A43 WeakPolarHBondContact O-CB 3.45Å; D39-A43 PolarHBondContact O-N 2.97Å; L40-A43 PolarHBondContact O-N 3.13Å; A43-H47 WeakPolarHBondContact O-CB 3.23Å; A43-H47 PolarHBondContact O-N 2.91Å
44	L	90.3	Very high	86.6	Confident	79 Å²	79	105.3 Å²	105.3	41%	0.414	54%	0.541	S	S	.	.	H	α-helix	trans	-66.7	-44.8	174.5	-74.6	174.6	0	0	0	111.3	L40 D41 Q42 D46 H47 F48	L40-L44 HydrophobicContact CD1-CD1 4.33Å; L40-L44 HydrophobicContact CD1-CG 4.19Å; L40-L44 HydrophobicContact CG-CD1 4.03Å; L40-L44 HydrophobicContact CG-CG 4.33Å; L40-L44 WeakPolarHBondContact O-CB 3.5Å; L40-L44 VanDerWaalsContact O-CG 3.24Å; L40-L44 WeakPolarHBondContact O-CG 3.3Å; L40-L44 PolarHBondContact O-N 2.92Å; D41-L44 PolarHBondContact O-N 3.04Å; Q42-L44 VanDerWaalsContact C-N 3.34Å; Q42-L44 PolarHBondContact O-N 3.05Å; L44-D46 VanDerWaalsContact C-N 3.33Å; L44-D46 PolarHBondContact O-N 2.71Å; L44-H47 WeakPolarHBondContact O-CB 3.22Å; L44-H47 PolarHBondContact O-N 3.05Å; L44-F48 HydrophobicContact CB-CE2 4.47Å; L44-F48 WeakPolarHBondContact O-CD2 3.37Å; L44-F48 PolarHBondContact O-N 3.49Å
45	N	90.8	Very high	85.4	Confident	76 Å²	76	105.5 Å²	105.5	41%	0.406	54%	0.543	S	S	.	.	H	α-helix	trans	-60.2	-43.8	176.1	-83.8	-71.1	0	0	0	111.8	D41 Q42 H47 F48 R49	D41-N45 WeakPolarHBondContact O-CB 3.29Å; D41-N45 PolarHBondContact O-N 3.24Å; D41-N45 PolarHBondContact O-ND2 3.16Å; Q42-N45 PolarHBondContact O-N 3.24Å; N45-H47 VanDerWaalsContact C-N 3.32Å; N45-H47 PolarHBondContact O-N 3.44Å; N45-F48 PolarHBondContact O-N 3.34Å; N45-R49 WeakPolarHBondContact O-CG 3.42Å; N45-R49 PolarHBondContact O-N 3.47Å
46	D	89.1	Confident	83.9	Confident	63 Å²	63	97.6 Å²	97.6	34%	0.337	53%	0.529	S	S	.	.	H	α-helix	trans	-64.8	-37.4	177.8	-68.4	-20.7	0	0	0	111.8	Q42 L44 R49 K50	Q42-D46 PolarHBondContact NE2-OD1 3.16Å; Q42-D46 PolarHBondContact NE2-OD2 3.36Å; Q42-D46 VanDerWaalsContact NE2-OD2 3.08Å; Q42-D46 WeakPolarHBondContact O-CB 3.31Å; Q42-D46 VanDerWaalsContact O-CG 3.26Å; Q42-D46 PolarHBondContact O-N 3.45Å; L44-D46 VanDerWaalsContact C-N 3.33Å; L44-D46 PolarHBondContact O-N 2.71Å; D46-R49 PolarHBondContact O-N 2.91Å; D46-R49 IonicContact OD1-NH1 3.43Å; D46-R49 PolarHBondContact OD1-NH1 3.1Å; D46-K50 VanDerWaalsContact O-CB 3.26Å; D46-K50 WeakPolarHBondContact O-CB 3.29Å; D46-K50 PolarHBondContact O-N 3.13Å
47	H	88.8	Confident	82	Confident	120 Å²	120	97.4 Å²	97.4	56%	0.556	53%	0.528	S	S	*	.	H	α-helix	trans	-61.9	-44.3	172.6	-178.4	-92.9	0	0	0	112.2	A43 L44 N45 S51	A43-H47 WeakPolarHBondContact O-CB 3.23Å; A43-H47 PolarHBondContact O-N 2.91Å; L44-H47 WeakPolarHBondContact O-CB 3.22Å; L44-H47 PolarHBondContact O-N 3.05Å; N45-H47 VanDerWaalsContact C-N 3.32Å; N45-H47 PolarHBondContact O-N 3.44Å; H47-S51 PolarHBondContact O-N 3.21Å
48	F	90.2	Very high	80.2	Confident	120 Å²	120	96.5 Å²	96.5	53%	0.526	53%	0.531	S	S	.	.	H	α-helix	trans	-66.5	-45	176.8	-71.2	-59.1	0	0	0	112.3	L44 N45 K50 S51 I52	L44-F48 HydrophobicContact CB-CE2 4.47Å; L44-F48 WeakPolarHBondContact O-CD2 3.37Å; L44-F48 PolarHBondContact O-N 3.49Å; N45-F48 PolarHBondContact O-N 3.34Å; F48-K50 VanDerWaalsContact C-N 3.34Å; F48-K50 PolarHBondContact O-N 3.34Å; F48-S51 PolarHBondContact O-N 3.45Å; F48-S51 VanDerWaalsContact O-N 3.14Å; F48-S51 PolarHBondContact O-OG 2.85Å; F48-I52 WeakPolarHBondContact O-CG1 3.28Å; F48-I52 PolarHBondContact O-N 3.04Å
49	R	88.8	Confident	78.1	Confident	121 Å²	121	96.3 Å²	96.3	46%	0.457	53%	0.534	S	S	.	.	H	α-helix	trans	-56.7	-48.4	175	-73	-176.7	-175.5	108.9	4.8	111.1	N45 D46 S51 I52 E53	N45-R49 WeakPolarHBondContact O-CG 3.42Å; N45-R49 PolarHBondContact O-N 3.47Å; D46-R49 PolarHBondContact O-N 2.91Å; D46-R49 IonicContact OD1-NH1 3.43Å; D46-R49 PolarHBondContact OD1-NH1 3.1Å; R49-S51 VanDerWaalsContact C-N 3.3Å; R49-S51 PolarHBondContact O-N 3.03Å; R49-I52 PolarHBondContact O-N 3.14Å; R49-I52 VanDerWaalsContact O-N 3.14Å; R49-E53 WeakPolarHBondContact O-CB 3.27Å; R49-E53 VanDerWaalsContact O-CG 3.31Å; R49-E53 WeakPolarHBondContact O-CG 3.16Å; R49-E53 PolarHBondContact O-N 3.3Å
50	K	77.7	Confident	76.2	Confident	84 Å²	84	97.2 Å²	97.2	37%	0.365	54%	0.543	S	S	.	.	H	α-helix	trans	-54.8	-44.5	175.5	-174.7	173.8	-177.3	174.2	0	112	D46 F48 C54 S68	D46-K50 VanDerWaalsContact O-CB 3.26Å; D46-K50 WeakPolarHBondContact O-CB 3.29Å; D46-K50 PolarHBondContact O-N 3.13Å; F48-K50 VanDerWaalsContact C-N 3.34Å; F48-K50 PolarHBondContact O-N 3.34Å; K50-C54 VanDerWaalsContact O-CB 3.3Å; K50-C54 WeakPolarHBondContact O-CB 3.39Å; K50-C54 PolarHBondContact O-N 3.14Å; K50-C54 PolarHBondContact O-SG 3.04Å; K50-S68 PolarHBondContact NZ-O 2.71Å
51	S	80.7	Confident	74	Confident	49 Å²	49	96.4 Å²	96.4	34%	0.343	55%	0.551	S	S	.	*	H	α-helix	trans	-66	-37.5	179.7	72.7	0	0	0	0	113.2	H47 F48 R49 L55	H47-S51 PolarHBondContact O-N 3.21Å; F48-S51 PolarHBondContact O-N 3.45Å; F48-S51 VanDerWaalsContact O-N 3.14Å; F48-S51 PolarHBondContact O-OG 2.85Å; R49-S51 VanDerWaalsContact C-N 3.3Å; R49-S51 PolarHBondContact O-N 3.03Å; S51-L55 WeakPolarHBondContact O-CD1 3.44Å; S51-L55 VanDerWaalsContact O-CG 3.24Å; S51-L55 WeakPolarHBondContact O-CG 3.33Å; S51-L55 PolarHBondContact O-N 3.44Å
52	I	82.9	Confident	71.7	Confident	118 Å²	118	101 Å²	101	61%	0.605	56%	0.56	S	S	*	*	H	α-helix	trans	-76.2	-43.2	179.9	-64.2	166.8	0	0	0	110.7	F48 R49 L55 G56	F48-I52 WeakPolarHBondContact O-CG1 3.28Å; F48-I52 PolarHBondContact O-N 3.04Å; R49-I52 PolarHBondContact O-N 3.14Å; R49-I52 VanDerWaalsContact O-N 3.14Å; I52-L55 PolarHBondContact O-N 2.91Å; I52-G56 PolarHBondContact O-N 3.02Å; I52-G56 VanDerWaalsContact O-N 3.13Å
53	E	78.6	Confident	69.4	Low	106 Å²	106	102.3 Å²	102.3	50%	0.495	58%	0.579	S	S	.	*	H	α-helix	trans	-64.4	-41.3	179.4	-72	172.6	-165.5	0	0	111.6	R49 L55 G56	R49-E53 WeakPolarHBondContact O-CB 3.27Å; R49-E53 VanDerWaalsContact O-CG 3.31Å; R49-E53 WeakPolarHBondContact O-CG 3.16Å; R49-E53 PolarHBondContact O-N 3.3Å; E53-L55 VanDerWaalsContact C-N 3.26Å; E53-L55 PolarHBondContact O-N 3.26Å; E53-G56 PolarHBondContact O-N 3.08Å; E53-G56 VanDerWaalsContact O-N 3.1Å
54	C	63.2	Low	67.3	Low	103 Å²	103	104.1 Å²	104.1	70%	0.696	60%	0.602	S	S	*	*	H	α-helix	trans	-65.9	-25.8	175.8	-69.6	0	0	0	0	113.6	K50	K50-C54 VanDerWaalsContact O-CB 3.3Å; K50-C54 WeakPolarHBondContact O-CB 3.39Å; K50-C54 PolarHBondContact O-N 3.14Å; K50-C54 PolarHBondContact O-SG 3.04Å
55	L	60	Low	65.5	Low	154 Å²	154	106.5 Å²	106.5	81%	0.806	61%	0.611	S	S	*	*	H	α-helix	trans	-82.8	-18.4	174.2	-69.2	169.3	0	0	0	112.5	S51 I52 E53	S51-L55 WeakPolarHBondContact O-CD1 3.44Å; S51-L55 VanDerWaalsContact O-CG 3.24Å; S51-L55 WeakPolarHBondContact O-CG 3.33Å; S51-L55 PolarHBondContact O-N 3.44Å; I52-L55 PolarHBondContact O-N 2.91Å; E53-L55 VanDerWaalsContact C-N 3.26Å; E53-L55 PolarHBondContact O-N 3.26Å
56	G	57.3	Low	63.5	Low	53 Å²	53	111 Å²	111	55%	0.546	64%	0.635	S	S	.	*	H	α-helix	trans	-87	-30.3	-165.4	0	0	0	0	0	116.6	I52 E53	I52-G56 PolarHBondContact O-N 3.02Å; I52-G56 VanDerWaalsContact O-N 3.13Å; E53-G56 PolarHBondContact O-N 3.08Å; E53-G56 VanDerWaalsContact O-N 3.1Å
57	S	49.5	Very low	61.8	Low	82 Å²	82	113 Å²	113	57%	0.573	65%	0.645	S	S	*	*			trans	168.8	138.3	170.7	-87.9	0	0	0	0	110.3	S59	S57-S59 PolarHBondContact O-N 2.82Å
58	P	50.7	Low	60.4	Low	144 Å²	144	112.2 Å²	112.2	94%	0.935	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	13.5	173.4	29.8	-34.3	0	0	0	114.4
59	S	47	Very low	59.2	Low	93 Å²	93	112.9 Å²	112.9	65%	0.65	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	0.6	-162.9	-167.9	0	0	0	0	116.5	S57	S57-S59 PolarHBondContact O-N 2.82Å
60	V	50.3	Low	58.5	Low	124 Å²	124	110.8 Å²	110.8	75%	0.752	68%	0.675	S	S	*	*			trans	-120.3	60.7	170.6	-169.9	0	0	0	0	109.9	R62	V60-R62 PolarHBondContact O-N 3.46Å
61	A	43.6	Very low	58.4	Low	87 Å²	87	110.3 Å²	110.3	72%	0.719	68%	0.682	S	S	*	*			trans	-65.6	95.1	147.3	0	0	0	0	0	106.6
62	R	44.8	Very low	58.5	Low	213 Å²	213	110.7 Å²	110.7	80%	0.804	69%	0.685	S	S	*	*			trans	-172.9	118.9	158.7	-105.5	165.2	-68.9	-167.5	6.7	112.2	V60	V60-R62 PolarHBondContact O-N 3.46Å
63	S	43.1	Very low	58.8	Low	114 Å²	114	112.3 Å²	112.3	80%	0.797	68%	0.683	S	S	*	*	S	Bend	trans	90.3	108.4	163.8	99.9	0	0	0	0	117.5
64	G	45.5	Very low	59.2	Low	83 Å²	83	115.8 Å²	115.8	86%	0.856	69%	0.692	S	S	*	*	S	Bend		129	-34.9	129.6	0	0	0	0	0	118.1
65	H	52.8	Low	60.3	Low	129 Å²	129	117.3 Å²	117.3	60%	0.597	69%	0.689	S	S	*	*			trans	-125.5	108.5	-168.7	48.2	-95.1	0	0	0	112.8	L67	H65-L67 PolarHBondContact O-N 2.87Å
66	N	47.9	Very low	61.7	Low	172 Å²	172	113 Å²	113	92%	0.92	66%	0.664	S	S	*	*			trans	-80.3	55.9	-174.5	-146.3	-59.8	0	0	0	111.8
67	L	54.6	Low	63.2	Low	105 Å²	105	118.6 Å²	118.6	55%	0.55	68%	0.681	S	S	.	*			trans	-97.3	117.7	179.8	-66.7	173.7	0	0	0	110	H65 V69	H65-L67 PolarHBondContact O-N 2.87Å; L67-V69 PolarHBondContact O-N 3.27Å
68	S	58.6	Low	65.2	Low	102 Å²	102	117.1 Å²	117.1	71%	0.713	67%	0.667	S	S	*	*			trans	-42.1	122.1	178.9	179.8	0	0	0	0	111.9	K50 A70	K50-S68 PolarHBondContact NZ-O 2.71Å; S68-A70 PolarHBondContact O-N 3.35Å
69	V	65.9	Low	67.2	Low	135 Å²	135	114.2 Å²	114.2	82%	0.818	65%	0.648	S	S	*	*			trans	-74.2	84.1	172.3	-177.2	0	0	0	0	106.6	L67 S71	L67-V69 PolarHBondContact O-N 3.27Å; V69-S71 PolarHBondContact O-N 3.39Å
70	A	73.8	Confident	69	Low	77 Å²	77	114.9 Å²	114.9	64%	0.636	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-62.7	121.8	173.9	0	0	0	0	0	108.9	S68	S68-A70 PolarHBondContact O-N 3.35Å
71	S	75	Confident	70.8	Confident	74 Å²	74	114.2 Å²	114.2	52%	0.517	64%	0.64	S	S	.	*	P	Polyproline II helix	trans	-49.9	142.1	172	-61.5	0	0	0	0	110.8	V69 W73 E75	V69-S71 PolarHBondContact O-N 3.39Å; S71-W73 PolarHBondContact O-N 3.02Å; S71-E75 WeakPolarHBondContact CB-OE2 3.24Å
72	S	83.3	Confident	73.1	Confident	57 Å²	57	115.9 Å²	115.9	40%	0.399	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-56.1	142.5	178.6	178.3	0	0	0	0	109.5	R74 E75	S72-R74 PolarHBondContact O-N 2.83Å; S72-R74 PolarHBondContact OG-N 3.42Å; S72-E75 PolarHBondContact N-OE2 2.72Å; S72-E75 VanDerWaalsContact N-OE2 3.13Å; S72-E75 WeakPolarHBondContact O-CB 3.27Å; S72-E75 PolarHBondContact O-N 2.97Å
73	W	88.8	Confident	75.4	Confident	151 Å²	151	108.7 Å²	108.7	57%	0.572	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-54	-30.9	175.5	-78.2	106.9	0	0	0	111.8	S71 E75 K76 L78 F83	S71-W73 PolarHBondContact O-N 3.02Å; W73-E75 VanDerWaalsContact C-N 3.26Å; W73-E75 PolarHBondContact O-N 3.38Å; W73-K76 HydrophobicContact CD2-CD 4.2Å; W73-K76 HydrophobicContact CE3-CD 3.45Å; W73-K76 VanDerWaalsContact CE3-CD 3.45Å; W73-K76 HydrophobicContact CE3-CG 4.47Å; W73-K76 VanDerWaalsContact CE3-NZ 3.33Å; W73-K76 VanDerWaalsContact CH2-NZ 3.32Å; W73-K76 HydrophobicContact CZ3-CD 3.66Å; W73-K76 VanDerWaalsContact CZ3-NZ 3.26Å; W73-K76 WeakPolarHBondContact O-CB 3.31Å; W73-K76 PolarHBondContact O-N 3.49Å; W73-K76 VanDerWaalsContact O-N 3.16Å; W73-L78 HydrophobicContact CE3-CD1 3.65Å; W73-L78 HydrophobicContact CZ3-CD1 4.27Å; W73-F83 VanDerWaalsContact C-CZ 3.41Å; W73-F83 HydrophobicContact CB-CE1 4.11Å; W73-F83 HydrophobicContact CB-CZ 4.12Å; W73-F83 VanDerWaalsContact O-CZ 3.27Å; W73-F83 WeakPolarHBondContact O-CZ 3.41Å
74	R	86.8	Confident	77.4	Confident	179 Å²	179	108.8 Å²	108.8	68%	0.675	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-65.7	-23.6	176.9	-66	-178	-177.8	-84	0.9	114.2	S72 K76 F83	S72-R74 PolarHBondContact O-N 2.83Å; S72-R74 PolarHBondContact OG-N 3.42Å; R74-K76 VanDerWaalsContact C-N 3.33Å; R74-F83 VanDerWaalsContact CA-CZ 3.47Å; R74-F83 HydrophobicContact CB-CE1 4.38Å; R74-F83 HydrophobicContact CB-CZ 4.29Å; R74-F83 HydrophobicContact CG-CD1 3.85Å; R74-F83 HydrophobicContact CG-CE1 3.56Å; R74-F83 HydrophobicContact CG-CE2 4.48Å; R74-F83 HydrophobicContact CG-CG 4.44Å; R74-F83 HydrophobicContact CG-CZ 3.94Å
75	E	86.7	Confident	79.1	Confident	136 Å²	136	110.1 Å²	110.1	64%	0.636	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-87.3	-9.7	177.5	-64.7	164.3	-178.8	0	0	111.9	S71 S72 W73	S71-E75 WeakPolarHBondContact CB-OE2 3.24Å; S72-E75 PolarHBondContact N-OE2 2.72Å; S72-E75 VanDerWaalsContact N-OE2 3.13Å; S72-E75 WeakPolarHBondContact O-CB 3.27Å; S72-E75 PolarHBondContact O-N 2.97Å; W73-E75 VanDerWaalsContact C-N 3.26Å; W73-E75 PolarHBondContact O-N 3.38Å
76	K	89.8	Confident	80.3	Confident	64 Å²	64	109.2 Å²	109.2	28%	0.278	59%	0.594	S	S	.	*	S	Bend	trans	-82.2	145.2	174.9	-54.5	-172.4	-164.3	172.2	0	108.6	W73 R74 L78	W73-K76 HydrophobicContact CD2-CD 4.2Å; W73-K76 HydrophobicContact CE3-CD 3.45Å; W73-K76 VanDerWaalsContact CE3-CD 3.45Å; W73-K76 HydrophobicContact CE3-CG 4.47Å; W73-K76 VanDerWaalsContact CE3-NZ 3.33Å; W73-K76 VanDerWaalsContact CH2-NZ 3.32Å; W73-K76 HydrophobicContact CZ3-CD 3.66Å; W73-K76 VanDerWaalsContact CZ3-NZ 3.26Å; W73-K76 WeakPolarHBondContact O-CB 3.31Å; W73-K76 PolarHBondContact O-N 3.49Å; W73-K76 VanDerWaalsContact O-N 3.16Å; R74-K76 VanDerWaalsContact C-N 3.33Å; K76-L78 HydrophobicContact CB-CD1 4.46Å; K76-L78 HydrophobicContact CB-CG 4.12Å; K76-L78 PolarHBondContact O-N 2.88Å
77	N	89.6	Confident	81.2	Confident	169 Å²	169	110.7 Å²	110.7	90%	0.904	59%	0.592	S	S	*	*			trans	-66.7	68.5	173.9	-66	-32.7	0	0	0	111.5
78	L	91.1	Very high	81.1	Confident	52 Å²	52	114.4 Å²	114.4	27%	0.272	61%	0.607	S	S	.	*			trans	-102.8	151	176.9	-68.1	-179.3	0	0	0	110	W73 K76 D80 F82 F83	W73-L78 HydrophobicContact CE3-CD1 3.65Å; W73-L78 HydrophobicContact CZ3-CD1 4.27Å; K76-L78 HydrophobicContact CB-CD1 4.46Å; K76-L78 HydrophobicContact CB-CG 4.12Å; K76-L78 PolarHBondContact O-N 2.88Å; L78-D80 PolarHBondContact O-N 3.23Å; L78-F82 HydrophobicContact CB-CB 4.31Å; L78-F82 HydrophobicContact CB-CG 4.44Å; L78-F82 HydrophobicContact CD1-CD1 3.7Å; L78-F82 HydrophobicContact CD1-CD2 4.26Å; L78-F82 HydrophobicContact CD1-CE1 3.75Å; L78-F82 HydrophobicContact CD1-CE2 4.31Å; L78-F82 HydrophobicContact CD1-CG 3.95Å; L78-F82 HydrophobicContact CD1-CZ 4.06Å; L78-F83 HydrophobicContact CB-CE2 4.14Å; L78-F83 HydrophobicContact CD1-CE2 4.41Å; L78-F83 HydrophobicContact CD1-CZ 4.03Å
79	P	91.7	Very high	80.5	Confident	83 Å²	83	113 Å²	113	54%	0.539	61%	0.609	S	S	.	*			trans	-54.9	140.3	173.1	-25.5	34.7	0	0	0	111.5	T81 F82	P79-T81 WeakPolarHBondContact CB-OG1 3.26Å; P79-T81 PolarHBondContact O-N 3.22Å; P79-F82 WeakPolarHBondContact O-CB 3.41Å; P79-F82 PolarHBondContact O-N 2.99Å
80	D	84.2	Confident	79.7	Confident	107 Å²	107	111.3 Å²	111.3	57%	0.572	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-52.2	-28.8	174.4	-100.4	15.9	0	0	0	113.3	L78 F82 F83 K84	L78-D80 PolarHBondContact O-N 3.23Å; D80-F82 PolarHBondContact O-N 3.46Å; D80-F83 PolarHBondContact O-N 3.43Å; D80-K84 HydrophobicContact CB-CD 4.39Å; D80-K84 WeakPolarHBondContact O-CD 3.3Å; D80-K84 VanDerWaalsContact O-CG 3.27Å; D80-K84 WeakPolarHBondContact O-CG 3.36Å; D80-K84 PolarHBondContact O-N 2.99Å; D80-K84 IonicContact OD2-NZ 2.71Å; D80-K84 PolarHBondContact OD2-NZ 3.47Å
81	T	89.1	Confident	78.4	Confident	109 Å²	109	115.6 Å²	115.6	67%	0.669	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-67	-20.7	176.2	52.7	0	0	0	0	113.2	P79 F83 K84	P79-T81 WeakPolarHBondContact CB-OG1 3.26Å; P79-T81 PolarHBondContact O-N 3.22Å; T81-F83 VanDerWaalsContact C-N 3.27Å; T81-F83 PolarHBondContact O-N 3.39Å; T81-K84 PolarHBondContact O-N 2.78Å
82	F	93	Very high	77.2	Confident	123 Å²	123	116.8 Å²	116.8	54%	0.539	62%	0.618	S	S	.	*	G	3₁₀ helix	trans	-64.6	-33.8	175.4	-172.4	-90.6	0	0	0	112	L78 P79 D80	L78-F82 HydrophobicContact CB-CB 4.31Å; L78-F82 HydrophobicContact CB-CG 4.44Å; L78-F82 HydrophobicContact CD1-CD1 3.7Å; L78-F82 HydrophobicContact CD1-CD2 4.26Å; L78-F82 HydrophobicContact CD1-CE1 3.75Å; L78-F82 HydrophobicContact CD1-CE2 4.31Å; L78-F82 HydrophobicContact CD1-CG 3.95Å; L78-F82 HydrophobicContact CD1-CZ 4.06Å; P79-F82 WeakPolarHBondContact O-CB 3.41Å; P79-F82 PolarHBondContact O-N 2.99Å; D80-F82 PolarHBondContact O-N 3.46Å
83	F	91.3	Very high	75.7	Confident	62 Å²	62	119.4 Å²	119.4	27%	0.272	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.8	-8	179.7	-56.9	-72.5	0	0	0	113.6	W73 R74 L78 D80 T81	W73-F83 VanDerWaalsContact C-CZ 3.41Å; W73-F83 HydrophobicContact CB-CE1 4.11Å; W73-F83 HydrophobicContact CB-CZ 4.12Å; W73-F83 VanDerWaalsContact O-CZ 3.27Å; W73-F83 WeakPolarHBondContact O-CZ 3.41Å; R74-F83 VanDerWaalsContact CA-CZ 3.47Å; R74-F83 HydrophobicContact CB-CE1 4.38Å; R74-F83 HydrophobicContact CB-CZ 4.29Å; R74-F83 HydrophobicContact CG-CD1 3.85Å; R74-F83 HydrophobicContact CG-CE1 3.56Å; R74-F83 HydrophobicContact CG-CE2 4.48Å; R74-F83 HydrophobicContact CG-CG 4.44Å; R74-F83 HydrophobicContact CG-CZ 3.94Å; L78-F83 HydrophobicContact CB-CE2 4.14Å; L78-F83 HydrophobicContact CD1-CE2 4.41Å; L78-F83 HydrophobicContact CD1-CZ 4.03Å; D80-F83 PolarHBondContact O-N 3.43Å; T81-F83 VanDerWaalsContact C-N 3.27Å; T81-F83 PolarHBondContact O-N 3.39Å
84	K	86.3	Confident	73.9	Confident	115 Å²	115	118 Å²	118	50%	0.5	64%	0.641	S	S	.	*	S	Bend	trans	-102.3	114.9	179.2	-68.5	171.1	-167.4	172.4	0	108.4	D80 T81 S86	D80-K84 HydrophobicContact CB-CD 4.39Å; D80-K84 WeakPolarHBondContact O-CD 3.3Å; D80-K84 VanDerWaalsContact O-CG 3.27Å; D80-K84 WeakPolarHBondContact O-CG 3.36Å; D80-K84 PolarHBondContact O-N 2.99Å; D80-K84 IonicContact OD2-NZ 2.71Å; D80-K84 PolarHBondContact OD2-NZ 3.47Å; T81-K84 PolarHBondContact O-N 2.78Å; K84-S86 PolarHBondContact O-N 3.16Å
85	P	80.6	Confident	72.1	Confident	112 Å²	112	112.3 Å²	112.3	73%	0.727	63%	0.632	S	S	*	*			trans	-56.9	141.5	171.2	26	-33.2	0	0	0	108.8	K87	P85-K87 PolarHBondContact O-N 3.44Å
86	S	78.9	Confident	70.2	Confident	109 Å²	109	114 Å²	114	76%	0.762	64%	0.64	S	S	*	*			trans	-57.4	125.4	178.7	50.5	0	0	0	0	109.6	K84 Q88	K84-S86 PolarHBondContact O-N 3.16Å; S86-Q88 PolarHBondContact O-N 2.88Å
87	K	65.2	Low	68.1	Low	204 Å²	204	114.4 Å²	114.4	89%	0.887	65%	0.651	S	S	*	*			trans	-82.4	13.1	180	-64.8	-175.1	179.4	-176.6	0	113.1	P85 G89	P85-K87 PolarHBondContact O-N 3.44Å; K87-G89 VanDerWaalsContact C-N 3.27Å; K87-G89 PolarHBondContact O-N 2.96Å
88	Q	53.6	Low	66.5	Low	182 Å²	182	117.7 Å²	117.7	85%	0.85	65%	0.651	S	S	*	*			trans	-68.6	91.2	177.2	-107.3	179.4	-23.8	0	0	108.7	S86 S90	S86-Q88 PolarHBondContact O-N 2.88Å; Q88-S90 PolarHBondContact O-N 3.38Å
89	G	46.2	Very low	64.4	Low	74 Å²	74	120.7 Å²	120.7	76%	0.763	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	125	168.1	0	0	0	0	0	109.4	K87	K87-G89 VanDerWaalsContact C-N 3.27Å; K87-G89 PolarHBondContact O-N 2.96Å
90	S	48.6	Very low	62.3	Low	98 Å²	98	119.9 Å²	119.9	69%	0.685	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	163.2	-13.8	143	-176.2	0	0	0	0	113.2	Q88	Q88-S90 PolarHBondContact O-N 3.38Å
91	H	46.3	Very low	60.8	Low	167 Å²	167	119.4 Å²	119.4	77%	0.773	68%	0.682	S	S	*	*	S	Bend	trans	-139.2	93.6	178.1	-74	-69	0	0	0	112.5
92	S	50.1	Low	58.9	Low	99 Å²	99	120.6 Å²	120.6	69%	0.692	69%	0.685	S	S	*	*			trans	59.9	135	163.3	43.2	0	0	0	0	117.1	V94	S92-V94 PolarHBondContact O-N 3.08Å; S92-V94 VanDerWaalsContact O-N 3.14Å
93	P	51.2	Low	56.5	Low	113 Å²	113	120.2 Å²	120.2	73%	0.734	70%	0.697	S	S	*	*			trans	-54.5	129.4	159.7	26.6	-30.7	0	0	0	106	A95	P93-A95 PolarHBondContact O-N 3.2Å
94	V	51.3	Low	54.6	Low	121 Å²	121	122.1 Å²	122.1	73%	0.733	72%	0.719	S	S	*	*			trans	-67.8	67.5	157.9	177.9	0	0	0	0	105.9	S92 H96	S92-V94 PolarHBondContact O-N 3.08Å; S92-V94 VanDerWaalsContact O-N 3.14Å; V94-H96 PolarHBondContact O-N 3.24Å
95	A	48.8	Very low	52.4	Low	59 Å²	59	119.5 Å²	119.5	49%	0.488	72%	0.724	S	S	.	*			trans	-68.6	116.5	151.5	0	0	0	0	0	103.1	P93 S97	P93-A95 PolarHBondContact O-N 3.2Å; A95-S97 PolarHBondContact O-N 3.42Å
96	H	48.1	Very low	50.4	Low	171 Å²	171	119.8 Å²	119.8	79%	0.792	73%	0.728	S	S	*	*			trans	-64.9	62.2	155.5	-57.1	-74.1	0	0	0	107.6	V94 R98	V94-H96 PolarHBondContact O-N 3.24Å; H96-R98 PolarHBondContact O-N 3.29Å
97	S	45.3	Very low	48.6	Very low	73 Å²	73	122.2 Å²	122.2	51%	0.51	73%	0.726	S	S	.	*			trans	-56.9	117.5	161.8	-73	0	0	0	0	103.7	A95 V99	A95-S97 PolarHBondContact O-N 3.42Å; S97-V99 VanDerWaalsContact CB-CG2 3.44Å; S97-V99 PolarHBondContact O-N 2.93Å
98	R	55.3	Low	47.3	Very low	239 Å²	239	118.6 Å²	118.6	90%	0.902	72%	0.722	S	S	*	*	S	Bend	trans	-59.3	21.1	174.7	-72.9	177.4	161.2	173.2	-6.1	113.2	H96 G100	H96-R98 PolarHBondContact O-N 3.29Å; R98-G100 VanDerWaalsContact C-N 3.31Å; R98-G100 PolarHBondContact O-N 3.35Å
99	V	46.4	Very low	46.9	Very low	114 Å²	114	115.6 Å²	115.6	69%	0.691	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	20.5	-169	-56.9	0	0	0	0	112.6	S97	S97-V99 VanDerWaalsContact CB-CG2 3.44Å; S97-V99 PolarHBondContact O-N 2.93Å
100	G	49.6	Very low	46.4	Very low	66 Å²	66	117.5 Å²	117.5	68%	0.68	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.7	14	-175.8	0	0	0	0	0	114.1	R98	R98-G100 VanDerWaalsContact C-N 3.31Å; R98-G100 PolarHBondContact O-N 3.35Å
101	S	50.8	Low	46	Very low	97 Å²	97	118.1 Å²	118.1	68%	0.678	72%	0.721	S	S	*	*			trans	-114.8	15	-178.1	-58.7	0	0	0	0	113.2	S103	S101-S103 PolarHBondContact O-N 3.11Å
102	D	49.3	Very low	45.7	Very low	134 Å²	134	116.1 Å²	116.1	72%	0.717	72%	0.723	S	S	*	*			trans	-80.6	-0.3	-173.6	-46	30.9	0	0	0	112.4	S104	D102-S104 PolarHBondContact O-N 3.16Å; D102-S104 VanDerWaalsContact O-N 3.07Å
103	S	43.4	Very low	45.3	Very low	115 Å²	115	117.4 Å²	117.4	80%	0.804	73%	0.731	S	S	*	*			trans	-85.8	54.5	178.2	60.9	0	0	0	0	112.1	S101	S101-S103 PolarHBondContact O-N 3.11Å
104	S	50.7	Low	44.6	Very low	103 Å²	103	116.9 Å²	116.9	72%	0.72	73%	0.73	S	S	*	*	S	Bend	trans	-164.2	100.9	165.6	41.3	0	0	0	0	113	D102	D102-S104 PolarHBondContact O-N 3.16Å; D102-S104 VanDerWaalsContact O-N 3.07Å
105	G	41.6	Very low	44.2	Very low	60 Å²	60	117.1 Å²	117.1	62%	0.619	73%	0.731	S	S	*	*			trans	80.4	71	142.2	0	0	0	0	0	117.7	H107	G105-H107 PolarHBondContact O-N 3.26Å; G105-H107 PolarHBondContact O-ND1 2.93Å; G105-H107 VanDerWaalsContact O-ND1 3.08Å
106	C	38	Very low	43.7	Very low	118 Å²	118	122.1 Å²	122.1	80%	0.797	75%	0.749	S	S	*	*			trans	-41.1	111.3	147.4	162.6	0	0	0	0	110.2	T108	C106-T108 PolarHBondContact SG-OG1 3.28Å; C106-T108 VanDerWaalsContact SG-OG1 3.38Å
107	H	41.1	Very low	43.9	Very low	159 Å²	159	120.1 Å²	120.1	74%	0.736	75%	0.754	S	S	*	*			trans	-126	89.6	158.2	55.4	-72.4	0	0	0	106	G105 V109	G105-H107 PolarHBondContact O-N 3.26Å; G105-H107 PolarHBondContact O-ND1 2.93Å; G105-H107 VanDerWaalsContact O-ND1 3.08Å; H107-V109 VanDerWaalsContact C-N 3.34Å; H107-V109 PolarHBondContact O-N 3.2Å
108	T	37.6	Very low	43.5	Very low	129 Å²	129	121.2 Å²	121.2	79%	0.791	77%	0.767	S	S	*	*			trans	-67.2	92.7	176.4	-9	0	0	0	0	108.7	C106	C106-T108 PolarHBondContact SG-OG1 3.28Å; C106-T108 VanDerWaalsContact SG-OG1 3.38Å
109	V	44.6	Very low	42.9	Very low	118 Å²	118	115.7 Å²	115.7	72%	0.715	76%	0.764	S	S	*	*			trans	-118.4	98	154.7	-67.2	0	0	0	0	106.7	H107 S111	H107-V109 VanDerWaalsContact C-N 3.34Å; H107-V109 PolarHBondContact O-N 3.2Å; V109-S111 PolarHBondContact O-N 3.41Å
110	S	36.2	Very low	42.8	Very low	115 Å²	115	115 Å²	115	80%	0.804	77%	0.77	S	S	*	*			trans	21.5	99.4	154	-50.5	0	0	0	0	117.1
111	S	40	Very low	42.3	Very low	110 Å²	110	119.3 Å²	119.3	77%	0.769	78%	0.784	S	S	*	*			trans	-166.4	122.1	142.2	-87.3	0	0	0	0	111.4	V109	V109-S111 PolarHBondContact O-N 3.41Å
112	P	41.1	Very low	41.9	Very low	125 Å²	125	117.9 Å²	117.9	81%	0.812	79%	0.785	S	S	*	*			trans	-89.5	112.2	173.1	33.6	-25.4	0	0	0	109.2
113	C	40.8	Very low	42.1	Very low	126 Å²	126	117.1 Å²	117.1	85%	0.851	79%	0.787	S	S	*	*			trans	-110.1	95.1	165.2	-70.3	0	0	0	0	108.6
114	S	36.7	Very low	42.4	Very low	102 Å²	102	118 Å²	118	71%	0.713	79%	0.79	S	S	*	*			trans	-56.9	142	157.8	-46.3	0	0	0	0	109.4
115	V	43.1	Very low	42.3	Very low	126 Å²	126	118.3 Å²	118.3	76%	0.764	79%	0.792	S	S	*	*				168.2	129	108.7	-77.8	0	0	0	0	112.4
116	L	39	Very low	42.3	Very low	165 Å²	165	127.8 Å²	127.8	86%	0.864	81%	0.809	S	S	*	*			trans	76.9	100.6	148.3	-58.6	153.6	0	0	0	120
117	S	51.4	Low	42.6	Very low	128 Å²	128	125.9 Å²	125.9	90%	0.895	81%	0.81	S	S	*	*				-154.2	116.7	127.7	-167.2	0	0	0	0	110.2
118	A	37.1	Very low	42.6	Very low	96 Å²	96	125.8 Å²	125.8	79%	0.793	82%	0.815	S	S	*	*			trans	-115.5	128.1	-179.2	0	0	0	0	0	109.4
119	C	42.1	Very low	43	Very low	124 Å²	124	124.4 Å²	124.4	84%	0.838	82%	0.816	S	S	*	*			trans	-157.4	133.7	148.4	62	0	0	0	0	111.9
120	A	45.1	Very low	42.9	Very low	98 Å²	98	124.8 Å²	124.8	81%	0.81	82%	0.819	S	S	*	*			trans	77.1	81.9	156.9	0	0	0	0	0	119.3
121	T	39.5	Very low	43.1	Very low	157 Å²	157	123.9 Å²	123.9	96%	0.963	82%	0.818	S	S	*	*			trans	-56.9	135.6	150.9	12.6	0	0	0	0	113.3
122	G	41.8	Very low	43.2	Very low	68 Å²	68	125.3 Å²	125.3	70%	0.701	82%	0.817	S	S	*	*			trans	-177.4	130.9	161.6	0	0	0	0	0	112
123	P	53.1	Low	43.4	Very low	118 Å²	118	123.7 Å²	123.7	77%	0.766	82%	0.815	S	S	*	*			trans	-84.4	154.6	-171.7	34.5	-33.4	0	0	0	112.7	S125	P123-S125 PolarHBondContact O-N 3.15Å
124	P	50.5	Low	43.7	Very low	132 Å²	132	124.2 Å²	124.2	86%	0.857	81%	0.809	S	S	*	*			trans	-79.3	122	-179	31.5	-31.4	0	0	0	110.9
125	S	47.6	Very low	44	Very low	110 Å²	110	123.9 Å²	123.9	77%	0.769	81%	0.812	S	S	*	*			trans	-124.7	108.9	171.1	-70.9	0	0	0	0	111.2	P123	P123-S125 PolarHBondContact O-N 3.15Å
126	R	42.8	Very low	43.9	Very low	259 Å²	259	122.6 Å²	122.6	98%	0.977	82%	0.815	S	S	*	*			trans	31.6	100.6	146.9	-57.2	-177.7	-176.9	-165.8	-0.2	117.2
127	G	44.3	Very low	43.8	Very low	79 Å²	79	119.8 Å²	119.8	81%	0.814	82%	0.815	S	S	*	*			trans	-146.2	118.8	166.7	0	0	0	0	0	110.6
128	N	40.4	Very low	43.1	Very low	157 Å²	157	117.4 Å²	117.4	84%	0.84	81%	0.812	S	S	*	*			trans	-67.8	124.1	-172.2	-160.2	24.4	0	0	0	112.1
129	A	45.7	Very low	43.1	Very low	99 Å²	99	121.3 Å²	121.3	82%	0.818	82%	0.818	S	S	*	*			trans	-143.2	96.1	160.8	0	0	0	0	0	109.1
130	T	42.9	Very low	43.2	Very low	127 Å²	127	118 Å²	118	78%	0.779	81%	0.806	S	S	*	*			trans	-51.5	132.8	174.7	19.8	0	0	0	0	113.8
131	A	39.8	Very low	43.7	Very low	96 Å²	96	119 Å²	119	79%	0.793	80%	0.804	S	S	*	*			trans	-0.9	124.3	155.8	0	0	0	0	0	119.2
132	N	43.5	Very low	44	Very low	139 Å²	139	117.8 Å²	117.8	74%	0.743	79%	0.791	S	S	*	*				-140.7	83.5	125.4	-167.7	18.5	0	0	0	109.1	N134	N132-N134 PolarHBondContact O-N 2.77Å
133	A	43.8	Very low	44.8	Very low	92 Å²	92	119 Å²	119	76%	0.76	79%	0.785	S	S	*	*			trans	-87.9	89.9	162.5	0	0	0	0	0	106.8
134	N	47.5	Very low	44.7	Very low	136 Å²	136	121.2 Å²	121.2	73%	0.727	79%	0.785	S	S	*	*			trans	-159.7	142.9	166.4	-83.4	-36.3	0	0	0	108.7	N132	N132-N134 PolarHBondContact O-N 2.77Å
135	A	44.2	Very low	44.4	Very low	95 Å²	95	122.1 Å²	122.1	79%	0.785	78%	0.777	S	S	*	*			trans	79.5	68.5	-177.4	0	0	0	0	0	114.4
136	A	39.4	Very low	44.9	Very low	99 Å²	99	121.7 Å²	121.7	82%	0.818	78%	0.781	S	S	*	*				64.2	107.7	77.1	0	0	0	0	0	113.3
137	A	38.4	Very low	45.3	Very low	106 Å²	106	119.1 Å²	119.1	88%	0.876	77%	0.771	S	S	*	*	S	Bend	trans	69	98	155.1	0	0	0	0	0	119.2
138	G	35.2	Very low	45.4	Very low	79 Å²	79	118.8 Å²	118.8	81%	0.814	76%	0.761	S	S	*	*			trans	122.7	-0.9	136.8	0	0	0	0	0	119	G140	G138-G140 PolarHBondContact O-N 3.38Å
139	L	37.6	Very low	45.7	Very low	177 Å²	177	120.6 Å²	120.6	93%	0.927	76%	0.764	S	S	*	*			trans	-85.4	71.5	-172.8	-59.2	174.5	0	0	0	112.8
140	G	43.4	Very low	45.5	Very low	56 Å²	56	120.5 Å²	120.5	58%	0.577	76%	0.757	S	S	*	*			trans	-73.4	141.6	155	0	0	0	0	0	108.9	G138 N142	G138-G140 PolarHBondContact O-N 3.38Å; G140-N142 VanDerWaalsContact C-N 3.31Å; G140-N142 PolarHBondContact O-N 3.22Å
141	P	55.9	Low	45.7	Very low	119 Å²	119	117.4 Å²	117.4	77%	0.773	74%	0.741	S	S	*	*			trans	-66.1	98.3	172.5	28.1	-31	0	0	0	107.3	V143	P141-V143 VanDerWaalsContact C-N 3.25Å; P141-V143 PolarHBondContact O-N 3.21Å
142	N	46.9	Very low	46.2	Very low	130 Å²	130	117.4 Å²	117.4	70%	0.695	73%	0.732	S	S	*	*			trans	-66.7	95.6	165.7	-173.6	-21.6	0	0	0	105.9	G140 Q144	G140-N142 VanDerWaalsContact C-N 3.31Å; G140-N142 PolarHBondContact O-N 3.22Å; N142-Q144 PolarHBondContact O-N 3.16Å
143	V	57.3	Low	46.6	Very low	94 Å²	94	113.2 Å²	113.2	57%	0.57	72%	0.717	S	S	*	*			trans	-67.6	88.2	174.1	-175.7	0	0	0	0	106.8	P141 H145	P141-V143 VanDerWaalsContact C-N 3.25Å; P141-V143 PolarHBondContact O-N 3.21Å; V143-H145 VanDerWaalsContact C-N 3.32Å; V143-H145 WeakPolarHBondContact CG1-CE1 3.5Å; V143-H145 PolarHBondContact O-CD2 3.12Å; V143-H145 PolarHBondContact O-N 3.42Å
144	Q	51.4	Low	47.2	Very low	164 Å²	164	112.6 Å²	112.6	77%	0.766	70%	0.704	S	S	*	*			trans	-73.5	92.2	168.7	-68.3	-179.4	-20	0	0	107.2	N142 A146	N142-Q144 PolarHBondContact O-N 3.16Å; Q144-A146 PolarHBondContact O-N 2.69Å; Q144-A146 VanDerWaalsContact O-N 3.12Å
145	H	45.1	Very low	47.4	Very low	151 Å²	151	111.8 Å²	111.8	70%	0.699	70%	0.699	S	S	*	*			trans	-62.3	115.3	165.2	-44.2	-74.1	0	0	0	106.8	V143 R147	V143-H145 VanDerWaalsContact C-N 3.32Å; V143-H145 WeakPolarHBondContact CG1-CE1 3.5Å; V143-H145 PolarHBondContact O-CD2 3.12Å; V143-H145 PolarHBondContact O-N 3.42Å; H145-R147 PolarHBondContact O-N 2.8Å
146	A	57.4	Low	47.9	Very low	102 Å²	102	113.3 Å²	113.3	84%	0.843	69%	0.69	S	S	*	*			trans	-60.8	87.7	153.9	0	0	0	0	0	105.3	Q144 A148	Q144-A146 PolarHBondContact O-N 2.69Å; Q144-A146 VanDerWaalsContact O-N 3.12Å; A146-A148 VanDerWaalsContact C-N 3.28Å; A146-A148 PolarHBondContact O-N 3.14Å
147	R	50.5	Low	49	Very low	204 Å²	204	116.3 Å²	116.3	77%	0.77	69%	0.692	S	S	*	*			trans	-59.1	101.5	174.6	-176.7	174.3	-174	99.9	-0.2	104.2	H145 H149	H145-R147 PolarHBondContact O-N 2.8Å; R147-H149 PolarHBondContact O-N 3.32Å
148	A	47	Very low	49.9	Very low	73 Å²	73	114.9 Å²	114.9	60%	0.603	69%	0.687	S	S	*	*			trans	-46.7	120.8	173.1	0	0	0	0	0	106.4	A146 S150	A146-A148 VanDerWaalsContact C-N 3.28Å; A146-A148 PolarHBondContact O-N 3.14Å; A148-S150 PolarHBondContact O-N 2.91Å
149	H	46.4	Very low	50.3	Low	195 Å²	195	117.8 Å²	117.8	90%	0.903	68%	0.68	S	S	*	*	S	Bend	trans	-68.7	28.3	-174.9	-71.8	-86.1	0	0	0	112.7	R147 S151	R147-H149 PolarHBondContact O-N 3.32Å; H149-S151 VanDerWaalsContact C-N 3.34Å; H149-S151 PolarHBondContact O-N 3.01Å; H149-S151 VanDerWaalsContact O-N 3.15Å
150	S	42.7	Very low	51.1	Low	96 Å²	96	114.4 Å²	114.4	67%	0.671	66%	0.662	S	S	*	*			trans	-78.4	86.8	162	57.6	0	0	0	0	108.2	A148 P152	A148-S150 PolarHBondContact O-N 2.91Å; S150-P152 WeakPolarHBondContact O-CD 3.43Å
151	S	45.9	Very low	51.4	Low	63 Å²	63	114.7 Å²	114.7	44%	0.441	65%	0.653	S	S	.	*	P	Polyproline II helix	trans	-58.6	125.4	162.7	-71.7	0	0	0	0	108.3	H149 A153	H149-S151 VanDerWaalsContact C-N 3.34Å; H149-S151 PolarHBondContact O-N 3.01Å; H149-S151 VanDerWaalsContact O-N 3.15Å; S151-A153 PolarHBondContact O-N 2.82Å
152	P	50.9	Low	51.4	Low	95 Å²	95	115.7 Å²	115.7	62%	0.617	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-59.1	132.6	169.7	-16.6	28.9	0	0	0	108.7	S150 T154	S150-P152 WeakPolarHBondContact O-CD 3.43Å; P152-T154 PolarHBondContact O-N 3.12Å
153	A	50.9	Low	51.6	Low	51 Å²	51	112.4 Å²	112.4	42%	0.421	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-62.5	119.4	167.1	0	0	0	0	0	108.1	S151 L160 F162	S151-A153 PolarHBondContact O-N 2.82Å; A153-L160 HydrophobicContact CB-CD2 4.18Å; A153-F162 HydrophobicContact CB-CE1 4.18Å; A153-F162 HydrophobicContact CB-CZ 4.39Å
154	T	56.2	Low	51.2	Low	79 Å²	79	111.6 Å²	111.6	49%	0.485	64%	0.635	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.5	116.7	171.8	-70.1	0	0	0	0	107.5	P152 Q156 T161	P152-T154 PolarHBondContact O-N 3.12Å; T154-Q156 HydrophobicContact CG2-CB 4.45Å; T154-Q156 PolarHBondContact O-N 2.71Å; T154-T161 PolarHBondContact N-O 3.41Å; T154-T161 PolarHBondContact O-N 2.94Å
155	L	53.6	Low	50.9	Low	120 Å²	120	109.3 Å²	109.3	63%	0.628	64%	0.637	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.7	99.9	168	-81.2	164.7	0	0	0	108.5	Q159 L160	L155-Q159 WeakPolarHBondContact CA-O 3.49Å; L155-L160 HydrophobicContact CD1-CD2 4.48Å; L155-L160 HydrophobicContact CD2-CD2 3.47Å; L155-L160 VanDerWaalsContact CD2-CD2 3.47Å; L155-L160 HydrophobicContact CD2-CG 3.71Å; L155-L160 HydrophobicContact CG-CD2 3.81Å
156	Q	54.3	Low	50.8	Low	126 Å²	126	110.6 Å²	110.6	59%	0.589	64%	0.637	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.4	123.1	170.8	-169.7	172.6	-14.4	0	0	107.9	T154 G158 Q159	T154-Q156 HydrophobicContact CG2-CB 4.45Å; T154-Q156 PolarHBondContact O-N 2.71Å; Q156-G158 VanDerWaalsContact C-N 3.26Å; Q156-G158 PolarHBondContact O-N 3.06Å; Q156-G158 VanDerWaalsContact O-N 3.16Å; Q156-Q159 PolarHBondContact N-O 3.12Å; Q156-Q159 VanDerWaalsContact N-O 3.11Å; Q156-Q159 PolarHBondContact O-N 2.71Å
157	N	62.3	Low	49.7	Very low	163 Å²	163	109.7 Å²	109.7	87%	0.872	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.4	33.2	178.4	-66.4	48.1	0	0	0	115.2	Q159	N157-Q159 PolarHBondContact O-N 2.73Å
158	G	56.8	Low	49.3	Very low	75 Å²	75	106.1 Å²	106.1	77%	0.773	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	77.5	4.8	-178.4	0	0	0	0	0	114.5	Q156	Q156-G158 VanDerWaalsContact C-N 3.26Å; Q156-G158 PolarHBondContact O-N 3.06Å; Q156-G158 VanDerWaalsContact O-N 3.16Å
159	Q	43.4	Very low	48.9	Very low	141 Å²	141	111.1 Å²	111.1	66%	0.659	65%	0.649	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.2	132.6	172.1	-138.1	-159.9	-22.9	0	0	110.3	L155 Q156 N157 T161	L155-Q159 WeakPolarHBondContact CA-O 3.49Å; Q156-Q159 PolarHBondContact N-O 3.12Å; Q156-Q159 VanDerWaalsContact N-O 3.11Å; Q156-Q159 PolarHBondContact O-N 2.71Å; N157-Q159 PolarHBondContact O-N 2.73Å; Q159-T161 PolarHBondContact O-N 2.84Å
160	L	54.5	Low	48.3	Very low	106 Å²	106	111 Å²	111	56%	0.555	65%	0.648	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.4	109.6	173	-71.6	162.6	0	0	0	108.6	A153 L155	A153-L160 HydrophobicContact CB-CD2 4.18Å; L155-L160 HydrophobicContact CD1-CD2 4.48Å; L155-L160 HydrophobicContact CD2-CD2 3.47Å; L155-L160 VanDerWaalsContact CD2-CD2 3.47Å; L155-L160 HydrophobicContact CD2-CG 3.71Å; L155-L160 HydrophobicContact CG-CD2 3.81Å
161	T	49.9	Very low	48	Very low	62 Å²	62	111.9 Å²	111.9	38%	0.38	65%	0.654	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.9	112.6	175.5	-57	0	0	0	0	109.1	T154 Q159	T154-T161 PolarHBondContact N-O 3.41Å; T154-T161 PolarHBondContact O-N 2.94Å; Q159-T161 PolarHBondContact O-N 2.84Å
162	F	55.2	Low	47.6	Very low	139 Å²	139	113.2 Å²	113.2	61%	0.61	67%	0.669	S	S	*	*			trans	-82.6	115.3	168.1	-70.2	-85.3	0	0	0	108.5	A153 S164	A153-F162 HydrophobicContact CB-CE1 4.18Å; A153-F162 HydrophobicContact CB-CZ 4.39Å; F162-S164 VanDerWaalsContact C-N 3.31Å; F162-S164 PolarHBondContact O-N 3.28Å
163	A	51.4	Low	47.1	Very low	61 Å²	61	114.6 Å²	114.6	50%	0.504	68%	0.676	S	S	.	*			trans	-71.9	89.7	172.2	0	0	0	0	0	109.3	S165	A163-S165 PolarHBondContact O-N 3.03Å
164	S	49.8	Very low	46.3	Very low	78 Å²	78	119.3 Å²	119.3	55%	0.545	69%	0.693	S	S	.	*			trans	-78.3	92	165.3	-64.3	0	0	0	0	108.1	F162 Y166	F162-S164 VanDerWaalsContact C-N 3.31Å; F162-S164 PolarHBondContact O-N 3.28Å; S164-Y166 VanDerWaalsContact C-N 3.31Å; S164-Y166 PolarHBondContact O-N 2.83Å; S164-Y166 VanDerWaalsContact O-N 3.16Å
165	S	44.1	Very low	45.4	Very low	115 Å²	115	119.9 Å²	119.9	80%	0.804	70%	0.7	S	S	*	*			trans	-82.8	80.5	169.8	60	0	0	0	0	109.3	A163	A163-S165 PolarHBondContact O-N 3.03Å
166	Y	43.4	Very low	44.4	Very low	179 Å²	179	124.6 Å²	124.6	70%	0.702	71%	0.711	S	S	*	*			trans	-133.6	102.6	150.7	39.6	-91.8	0	0	0	106.2	S164 V168	S164-Y166 VanDerWaalsContact C-N 3.31Å; S164-Y166 PolarHBondContact O-N 2.83Å; S164-Y166 VanDerWaalsContact O-N 3.16Å; Y166-V168 PolarHBondContact O-N 3.46Å; Y166-V168 VanDerWaalsContact O-N 3.12Å
167	G	35.2	Very low	43.4	Very low	82 Å²	82	122 Å²	122	85%	0.845	72%	0.718	S	S	*	*			trans	-64	110.9	169.3	0	0	0	0	0	108.3
168	V	42	Very low	42.7	Very low	130 Å²	130	125.2 Å²	125.2	79%	0.788	72%	0.718	S	S	*	*			trans	-138.6	120.3	152.3	-163.8	0	0	0	0	106.5	Y166	Y166-V168 PolarHBondContact O-N 3.46Å; Y166-V168 VanDerWaalsContact O-N 3.12Å
169	Q	37.5	Very low	42.1	Very low	178 Å²	178	127.1 Å²	127.1	83%	0.832	71%	0.711	S	S	*	*			trans	-64.9	150.3	-171	-62	-155.8	-30.1	0	0	112.3	S171	Q169-S171 PolarHBondContact O-N 2.86Å
170	H	33.3	Very low	42	Very low	192 Å²	192	132.2 Å²	132.2	89%	0.889	72%	0.724	S	S	*	*			trans	-46.9	118.8	169	-50.5	139.7	0	0	0	111.6
171	S	37.4	Very low	41.6	Very low	115 Å²	115	133.6 Å²	133.6	80%	0.804	73%	0.732	S	S	*	*			trans	-159.6	127.3	149.1	-1.6	0	0	0	0	109	Q169	Q169-S171 PolarHBondContact O-N 2.86Å
172	A	37.5	Very low	41.5	Very low	91 Å²	91	139 Å²	139	75%	0.752	75%	0.75	S	S	*	*			trans	-59.4	161	-178.7	0	0	0	0	0	113.3
173	T	39.5	Very low	40.7	Very low	124 Å²	124	141.4 Å²	141.4	76%	0.761	76%	0.763	S	S	*	*			trans	104.7	96.8	152.8	-41	0	0	0	0	116.3
174	I	34.3	Very low	40.4	Very low	150 Å²	150	144.5 Å²	144.5	77%	0.769	77%	0.77	S	S	*	*				34.8	121.6	129.9	-48.5	-177.5	0	0	0	117.1
175	S	37.3	Very low	40.2	Very low	91 Å²	91	146.9 Å²	146.9	64%	0.636	78%	0.777	S	S	*	*				165.6	120.2	129.5	-81.2	0	0	0	0	114.8
176	Y	32.6	Very low	40.7	Very low	219 Å²	219	146 Å²	146	86%	0.859	78%	0.776	S	S	*	*			trans	23.9	130.4	156	63.7	-91.4	0	0	0	121.9
177	G	34.6	Very low	41.3	Very low	72 Å²	72	144.1 Å²	144.1	74%	0.742	78%	0.779	S	S	*	*			trans	114.9	79	143.1	0	0	0	0	0	115.6
178	R	47.7	Very low	42.4	Very low	229 Å²	229	148.1 Å²	148.1	86%	0.864	78%	0.775	S	S	*	*	S	Bend	trans	-176.2	128.1	136.5	-101.8	170.4	-160.5	-177.4	5.6	109.3
179	D	43.2	Very low	43.7	Very low	116 Å²	116	145.2 Å²	145.2	62%	0.62	77%	0.765	S	S	*	*			trans	76.5	72.5	153.3	-43.1	-24.2	0	0	0	117.3	N181	D179-N181 PolarHBondContact O-N 2.73Å
180	R	41.2	Very low	45.4	Very low	247 Å²	247	142.7 Å²	142.7	93%	0.932	76%	0.764	S	S	*	*			trans	-69.9	61.1	165.2	-70.4	-171.5	-71.9	-121.1	-1.7	112.4
181	N	46.9	Very low	47.3	Very low	136 Å²	136	136.7 Å²	136.7	73%	0.727	74%	0.738	S	S	*	*			trans	-118.8	15.2	-175.2	-96.1	76	0	0	0	115.7	D179	D179-N181 PolarHBondContact O-N 2.73Å
182	F	47.8	Very low	49.3	Very low	174 Å²	174	134.4 Å²	134.4	76%	0.763	72%	0.72	S	S	*	*			trans	-158.8	34.7	175.1	39.4	-98.1	0	0	0	114.3	I184	F182-I184 PolarHBondContact O-N 2.93Å
183	E	37	Very low	51.2	Low	190 Å²	190	136.6 Å²	136.6	89%	0.888	73%	0.727	S	S	*	*			trans	-91.5	67.3	154.8	-163.1	171.9	-161.3	0	0	106.9
184	I	46.9	Very low	53.2	Low	127 Å²	127	133 Å²	133	65%	0.651	72%	0.715	S	S	*	*			trans	-105.1	116	163.7	-66.5	169.6	0	0	0	102.7	F182 A186	F182-I184 PolarHBondContact O-N 2.93Å; I184-A186 PolarHBondContact O-N 3.07Å
185	D	45.6	Very low	55.7	Low	127 Å²	127	131.6 Å²	131.6	68%	0.679	70%	0.7	S	S	*	*			trans	-41.3	116.4	172	-64.7	-61.7	0	0	0	108.8	D187 E188	D185-D187 PolarHBondContact O-N 3.05Å; D185-E188 PolarHBondContact O-N 3.08Å
186	A	53.1	Low	58	Low	97 Å²	97	134 Å²	134	80%	0.802	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	0.2	-173.7	0	0	0	0	0	113.4	I184	I184-A186 PolarHBondContact O-N 3.07Å
187	D	57.2	Low	60.4	Low	140 Å²	140	127.9 Å²	127.9	75%	0.749	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-8	-177.4	-71.6	-29.6	0	0	0	114.5	D185	D185-D187 PolarHBondContact O-N 3.05Å
188	E	57.6	Low	62.7	Low	166 Å²	166	125.2 Å²	125.2	78%	0.776	65%	0.654	S	S	*	*	S	Bend	trans	-120.2	-5.2	-170.5	-156.9	80.2	-153.5	0	0	115.2	D185 P190	D185-E188 PolarHBondContact O-N 3.08Å; E188-P190 WeakPolarHBondContact O-CD 3.27Å
189	A	68.7	Low	64.5	Low	69 Å²	69	118.8 Å²	118.8	57%	0.57	64%	0.643	S	S	*	*	S	Bend	trans	-75.1	119.5	175.2	0	0	0	0	0	109.7	L191	A189-L191 PolarHBondContact O-N 2.81Å; A189-L191 VanDerWaalsContact O-N 3.13Å
190	P	74.3	Confident	66.4	Low	125 Å²	125	115 Å²	115	81%	0.812	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-61.5	123.4	-177.8	23.6	-32	0	0	0	109.6	E188	E188-P190 WeakPolarHBondContact O-CD 3.27Å
191	L	73.6	Confident	68.5	Low	66 Å²	66	113.4 Å²	113.4	35%	0.346	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-58	145	175.1	-62.2	171.5	0	0	0	109.3	A189 W195 M197 F207	A189-L191 PolarHBondContact O-N 2.81Å; A189-L191 VanDerWaalsContact O-N 3.13Å; L191-W195 HydrophobicContact CB-CB 3.83Å; L191-W195 VanDerWaalsContact CB-O 3.29Å; L191-W195 WeakPolarHBondContact CB-O 3.33Å; L191-W195 VanDerWaalsContact CD1-O 3.31Å; L191-W195 WeakPolarHBondContact CD1-O 3.05Å; L191-M197 HydrophobicContact CD1-CB 3.7Å; L191-F207 HydrophobicContact CD2-CD1 3.7Å; L191-F207 HydrophobicContact CD2-CE1 3.57Å
192	P	79.5	Confident	70.4	Confident	66 Å²	66	112.4 Å²	112.4	43%	0.429	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-51.3	148.9	174.2	-24.9	32.7	0	0	0	111.1	G194 W195	P192-G194 PolarHBondContact O-N 2.84Å; P192-W195 HydrophobicContact CB-CB 4.45Å; P192-W195 HydrophobicContact CB-CD2 4.27Å; P192-W195 HydrophobicContact CB-CG 3.94Å; P192-W195 HydrophobicContact CG-CD2 3.98Å; P192-W195 HydrophobicContact CG-CE3 4.36Å; P192-W195 HydrophobicContact CG-CG 4.09Å; P192-W195 WeakPolarHBondContact O-CA 3.43Å; P192-W195 VanDerWaalsContact O-CB 3.23Å; P192-W195 WeakPolarHBondContact O-CB 3.13Å; P192-W195 PolarHBondContact O-N 2.84Å
193	P	77.7	Confident	72.2	Confident	138 Å²	138	106.6 Å²	106.6	90%	0.896	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.9	128.5	179	-27.7	34.5	0	0	0	112.5	W195	P193-W195 VanDerWaalsContact C-N 3.32Å
194	G	80.5	Confident	74.3	Confident	49 Å²	49	103.3 Å²	103.3	51%	0.505	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	85.8	-5.5	-174.6	0	0	0	0	0	114.6	P192 K209	P192-G194 PolarHBondContact O-N 2.84Å; G194-K209 CarbonylContact O-C 3.57Å; G194-K209 VanDerWaalsContact O-CA 3.3Å; G194-K209 WeakPolarHBondContact O-CA 3.35Å
195	W	87.5	Confident	76.2	Confident	120 Å²	120	100.5 Å²	100.5	46%	0.455	59%	0.59	S	S	.	*			trans	-88.2	119.7	174.9	-71.4	42.9	0	0	0	109.7	L191 P192 P193 F207 I208	L191-W195 HydrophobicContact CB-CB 3.83Å; L191-W195 VanDerWaalsContact CB-O 3.29Å; L191-W195 WeakPolarHBondContact CB-O 3.33Å; L191-W195 VanDerWaalsContact CD1-O 3.31Å; L191-W195 WeakPolarHBondContact CD1-O 3.05Å; P192-W195 HydrophobicContact CB-CB 4.45Å; P192-W195 HydrophobicContact CB-CD2 4.27Å; P192-W195 HydrophobicContact CB-CG 3.94Å; P192-W195 HydrophobicContact CG-CD2 3.98Å; P192-W195 HydrophobicContact CG-CE3 4.36Å; P192-W195 HydrophobicContact CG-CG 4.09Å; P192-W195 WeakPolarHBondContact O-CA 3.43Å; P192-W195 VanDerWaalsContact O-CB 3.23Å; P192-W195 WeakPolarHBondContact O-CB 3.13Å; P192-W195 PolarHBondContact O-N 2.84Å; P193-W195 VanDerWaalsContact C-N 3.32Å; W195-F207 HydrophobicContact CE3-CB 3.99Å; W195-F207 HydrophobicContact CE3-CG 4.38Å; W195-F207 HydrophobicContact CZ3-CB 4.29Å; W195-I208 CarbonylContact C-O 3.58Å; W195-I208 WeakPolarHBondContact CA-O 3.43Å
196	E	84.7	Confident	78.1	Confident	141 Å²	141	99.7 Å²	99.7	66%	0.659	58%	0.578	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.9	137.5	173.4	-65.9	-174.9	173.2	0	0	109	F207 I208	E196-F207 CarbonylContact O-C 3.51Å; E196-F207 WeakPolarHBondContact O-CA 3.28Å; E196-I208 PolarHBondContact N-O 3.47Å; E196-I208 PolarHBondContact O-N 3.13Å
197	M	82.3	Confident	79.7	Confident	90 Å²	90	100.5 Å²	100.5	44%	0.443	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.1	114.7	172.2	-178.7	173.8	71.5	0	0	108.6	L191 P205 Y206 F207	L191-M197 HydrophobicContact CD1-CB 3.7Å; M197-P205 HydrophobicContact CG-CB 3.9Å; M197-P205 HydrophobicContact SD-CB 3.77Å; M197-Y206 CarbonylContact C-O 3.56Å; M197-Y206 WeakPolarHBondContact CA-O 3.44Å; M197-F207 HydrophobicContact CB-CD1 4.18Å; M197-F207 HydrophobicContact CB-CE1 4.13Å; M197-F207 HydrophobicContact CG-CD1 4.42Å; M197-F207 HydrophobicContact CG-CE1 4.07Å; M197-F207 HydrophobicContact SD-CE1 4.1Å; M197-F207 HydrophobicContact SD-CZ 4.48Å
198	G	84.2	Confident	81	Confident	17 Å²	17	97.6 Å²	97.6	18%	0.175	55%	0.547	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	164.1	168.3	0	0	0	0	0	111.1	P205 Y206	G198-P205 CarbonylContact O-C 3.39Å; G198-P205 VanDerWaalsContact O-CA 3.29Å; G198-P205 WeakPolarHBondContact O-CA 3.45Å; G198-Y206 VanDerWaalsContact C-CD1 3.48Å; G198-Y206 VanDerWaalsContact C-CE1 3.41Å; G198-Y206 PolarHBondContact N-O 3.38Å; G198-Y206 VanDerWaalsContact O-CD1 3.28Å; G198-Y206 WeakPolarHBondContact O-CD1 3.44Å; G198-Y206 PolarHBondContact O-N 3.28Å
199	C	84.9	Confident	81.8	Confident	93 Å²	93	98.5 Å²	98.5	63%	0.628	55%	0.548	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.3	126.3	171	-64.7	0	0	0	0	109.4	Y206	C199-Y206 VanDerWaalsContact C-CE1 3.42Å
200	A	83.6	Confident	82.5	Confident	37 Å²	37	100 Å²	100	31%	0.306	55%	0.547	S	S	.	.			trans	-71.6	164.7	173.2	0	0	0	0	0	110.3	N202 G203 Q204 Y206	A200-N202 WeakPolarHBondContact CB-OD1 3.24Å; A200-N202 PolarHBondContact O-N 2.9Å; A200-G203 WeakPolarHBondContact O-CA 3.37Å; A200-G203 PolarHBondContact O-N 3.06Å; A200-Q204 PolarHBondContact N-O 3.48Å; A200-Y206 HydrophobicContact CB-CD1 4.1Å; A200-Y206 HydrophobicContact CB-CE1 4.41Å
201	E	85.1	Confident	82.9	Confident	213 Å²	213	98.6 Å²	98.6	100%	0.995	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-23	-179.9	-171.9	175.9	-179.4	0	0	113	G203	E201-G203 VanDerWaalsContact C-N 3.29Å; E201-G203 PolarHBondContact O-N 2.95Å
202	N	86.5	Confident	83.5	Confident	116 Å²	116	100.4 Å²	100.4	62%	0.62	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	6.8	173.8	65.1	0.5	0	0	0	114.1	A200 Q204	A200-N202 WeakPolarHBondContact CB-OD1 3.24Å; A200-N202 PolarHBondContact O-N 2.9Å; N202-Q204 VanDerWaalsContact C-N 3.26Å; N202-Q204 PolarHBondContact O-N 3.03Å; N202-Q204 VanDerWaalsContact OD1-CB 3.27Å; N202-Q204 WeakPolarHBondContact OD1-CB 3.44Å; N202-Q204 WeakPolarHBondContact OD1-CG 3.45Å; N202-Q204 PolarHBondContact OD1-N 3.45Å
203	G	85.9	Confident	83.7	Confident	51 Å²	51	102.5 Å²	102.5	53%	0.526	55%	0.55	S	S	.	*	S	Bend	trans	74.1	7.2	-177.6	0	0	0	0	0	115	A200 E201	A200-G203 WeakPolarHBondContact O-CA 3.37Å; A200-G203 PolarHBondContact O-N 3.06Å; E201-G203 VanDerWaalsContact C-N 3.29Å; E201-G203 PolarHBondContact O-N 2.95Å
204	Q	82	Confident	84.1	Confident	122 Å²	122	100.3 Å²	100.3	57%	0.57	53%	0.529	S	S	*	.			trans	-80.1	129.6	177.1	-64.2	-67.2	-52.3	0	0	110.2	A200 N202	A200-Q204 PolarHBondContact N-O 3.48Å; N202-Q204 VanDerWaalsContact C-N 3.26Å; N202-Q204 PolarHBondContact O-N 3.03Å; N202-Q204 VanDerWaalsContact OD1-CB 3.27Å; N202-Q204 WeakPolarHBondContact OD1-CB 3.44Å; N202-Q204 WeakPolarHBondContact OD1-CG 3.45Å; N202-Q204 PolarHBondContact OD1-N 3.45Å
205	P	84.8	Confident	84.3	Confident	68 Å²	68	103.7 Å²	103.7	44%	0.442	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	138.2	173	27.7	-32.4	0	0	0	110.1	M197 G198	M197-P205 HydrophobicContact CG-CB 3.9Å; M197-P205 HydrophobicContact SD-CB 3.77Å; G198-P205 CarbonylContact O-C 3.39Å; G198-P205 VanDerWaalsContact O-CA 3.29Å; G198-P205 WeakPolarHBondContact O-CA 3.45Å
206	Y	85.7	Confident	84.1	Confident	109 Å²	109	102.5 Å²	102.5	43%	0.427	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	149.6	172.5	70.2	-82.9	0	0	0	109.7	M197 G198 C199 A200 I208	M197-Y206 CarbonylContact C-O 3.56Å; M197-Y206 WeakPolarHBondContact CA-O 3.44Å; G198-Y206 VanDerWaalsContact C-CD1 3.48Å; G198-Y206 VanDerWaalsContact C-CE1 3.41Å; G198-Y206 PolarHBondContact N-O 3.38Å; G198-Y206 VanDerWaalsContact O-CD1 3.28Å; G198-Y206 WeakPolarHBondContact O-CD1 3.44Å; G198-Y206 PolarHBondContact O-N 3.28Å; C199-Y206 VanDerWaalsContact C-CE1 3.42Å; A200-Y206 HydrophobicContact CB-CD1 4.1Å; A200-Y206 HydrophobicContact CB-CE1 4.41Å; Y206-I208 HydrophobicContact CD2-CD1 4.22Å; Y206-I208 HydrophobicContact CD2-CG1 3.7Å; Y206-I208 HydrophobicContact CE2-CD1 3.35Å; Y206-I208 HydrophobicContact CE2-CG1 3.35Å
207	F	86.9	Confident	84	Confident	114 Å²	114	99.5 Å²	99.5	50%	0.5	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	126.5	-175.9	-54	-82.3	0	0	0	109.8	L191 W195 E196 M197	L191-F207 HydrophobicContact CD2-CD1 3.7Å; L191-F207 HydrophobicContact CD2-CE1 3.57Å; W195-F207 HydrophobicContact CE3-CB 3.99Å; W195-F207 HydrophobicContact CE3-CG 4.38Å; W195-F207 HydrophobicContact CZ3-CB 4.29Å; E196-F207 CarbonylContact O-C 3.51Å; E196-F207 WeakPolarHBondContact O-CA 3.28Å; M197-F207 HydrophobicContact CB-CD1 4.18Å; M197-F207 HydrophobicContact CB-CE1 4.13Å; M197-F207 HydrophobicContact CG-CD1 4.42Å; M197-F207 HydrophobicContact CG-CE1 4.07Å; M197-F207 HydrophobicContact SD-CE1 4.1Å; M197-F207 HydrophobicContact SD-CZ 4.48Å
208	I	84.9	Confident	84.2	Confident	79 Å²	79	100.3 Å²	100.3	41%	0.405	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	151.1	174.2	-45.6	175.8	0	0	0	107.9	W195 E196 Y206	W195-I208 CarbonylContact C-O 3.58Å; W195-I208 WeakPolarHBondContact CA-O 3.43Å; E196-I208 PolarHBondContact N-O 3.47Å; E196-I208 PolarHBondContact O-N 3.13Å; Y206-I208 HydrophobicContact CD2-CD1 4.22Å; Y206-I208 HydrophobicContact CD2-CG1 3.7Å; Y206-I208 HydrophobicContact CE2-CD1 3.35Å; Y206-I208 HydrophobicContact CE2-CG1 3.35Å
209	K	75.4	Confident	84.2	Confident	185 Å²	185	107.9 Å²	107.9	80%	0.804	57%	0.566	S	S	*	*			trans	-110.8	0	174.7	173.9	177.9	176.4	175.8	0	110.8	G194	G194-K209 CarbonylContact O-C 3.57Å; G194-K209 VanDerWaalsContact O-CA 3.3Å; G194-K209 WeakPolarHBondContact O-CA 3.35Å

Retrieved 209 of 209 residues in 218.7 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).