A0A5K4FDZ4_SCHMA Loading...

NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 2, mitochondrial AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FDZ4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 96 aa.

						>A0A5K4FDZ4_SCHMA|A0A5K4FDZ4
MFLGKLRPFLKSRFIILREFSDSSSERVPFYSMKPRLFMYRDYIERDFKEERKSQLLMTLFWAWITYFCINHPEELIGHEKLPDPKTFTDNELGVL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	52	Low	58.9	Low	237 Å²	237	143.4 Å²	143.4	100%	1.167	70%	0.7	S	S	*	*				0	-0.9	0	-156.6	168.9	174.5	0	0	114.7
2	F	56	Low	59	Low	189 Å²	189	136.1 Å²	136.1	83%	0.829	68%	0.675	S	S	*	*			trans	-89.5	-20.9	-174.6	-91.3	-89.8	0	0	0	116.4	G4	F2-G4 VanDerWaalsContact C-N 3.3Å; F2-G4 PolarHBondContact O-N 2.93Å
3	L	58	Low	59.1	Low	152 Å²	152	136.8 Å²	136.8	80%	0.796	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-12.8	-173.1	-76.3	134.7	0	0	0	114.8
4	G	61.6	Low	59	Low	55 Å²	55	138.6 Å²	138.6	57%	0.567	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-30	-179.8	0	0	0	0	0	114.3	F2	F2-G4 VanDerWaalsContact C-N 3.3Å; F2-G4 PolarHBondContact O-N 2.93Å
5	K	60.3	Low	59	Low	190 Å²	190	137.1 Å²	137.1	83%	0.826	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-9.3	-178.1	-79	-167.5	171.3	173.4	0	114.4	P8	K5-P8 WeakPolarHBondContact O-CD 3.45Å
6	L	59.6	Low	59	Low	87 Å²	87	135.2 Å²	135.2	46%	0.455	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.1	-17.3	178.2	-83.7	152.1	0	0	0	113.6	F9 L10	L6-F9 WeakPolarHBondContact O-CB 3.37Å; L6-F9 PolarHBondContact O-N 3.48Å; L6-F9 VanDerWaalsContact O-N 3.15Å; L6-L10 WeakPolarHBondContact O-CG 3.49Å; L6-L10 PolarHBondContact O-N 3.42Å
7	R	60	Low	58.9	Low	194 Å²	194	133.6 Å²	133.6	73%	0.732	65%	0.651	S	S	*	*	H	α-helix	trans	-57.3	-44.6	179.1	-75	-171.1	179.7	-172.2	0.6	115	F9 L10 K11	R7-F9 VanDerWaalsContact C-N 3.31Å; R7-F9 PolarHBondContact O-N 3.32Å; R7-L10 PolarHBondContact O-N 3.5Å; R7-K11 PolarHBondContact O-N 2.91Å
8	P	61.2	Low	58.9	Low	88 Å²	88	136.6 Å²	136.6	57%	0.571	65%	0.654	S	S	*	*	H	α-helix	trans	-67.5	-32.7	175.2	24.8	-33.3	0	0	0	112.3	K5 K11 S12	K5-P8 WeakPolarHBondContact O-CD 3.45Å; P8-K11 PolarHBondContact O-N 3.07Å; P8-S12 PolarHBondContact O-N 3.46Å; P8-S12 VanDerWaalsContact O-N 3.07Å
9	F	59.4	Low	58.9	Low	128 Å²	128	136.7 Å²	136.7	56%	0.561	65%	0.654	S	S	*	*	H	α-helix	trans	-67.4	-38.4	177	-151.6	-94.2	0	0	0	111.8	L6 R7 S12 R13	L6-F9 WeakPolarHBondContact O-CB 3.37Å; L6-F9 PolarHBondContact O-N 3.48Å; L6-F9 VanDerWaalsContact O-N 3.15Å; R7-F9 VanDerWaalsContact C-N 3.31Å; R7-F9 PolarHBondContact O-N 3.32Å; F9-S12 PolarHBondContact O-N 3.08Å; F9-R13 HydrophobicContact CD1-CG 4.37Å; F9-R13 HydrophobicContact CE1-CG 4.45Å; F9-R13 WeakPolarHBondContact O-CG 3.43Å; F9-R13 PolarHBondContact O-N 3.03Å
10	L	59.7	Low	58.7	Low	92 Å²	92	136.1 Å²	136.1	48%	0.482	65%	0.648	S	S	.	*	H	α-helix	trans	-66.7	-37.7	174.6	-69.9	170.7	0	0	0	112.4	L6 R7 R13 F14	L6-L10 WeakPolarHBondContact O-CG 3.49Å; L6-L10 PolarHBondContact O-N 3.42Å; R7-L10 PolarHBondContact O-N 3.5Å; L10-R13 PolarHBondContact O-N 3.22Å; L10-F14 WeakPolarHBondContact O-CD2 3.38Å; L10-F14 PolarHBondContact O-N 3.1Å
11	K	60.3	Low	58.6	Low	165 Å²	165	134 Å²	134	72%	0.717	65%	0.648	S	S	*	*	H	α-helix	trans	-67	-38.4	174.7	-76.6	-166.1	173.9	-159.8	0	112.7	R7 P8 F14	R7-K11 PolarHBondContact O-N 2.91Å; P8-K11 PolarHBondContact O-N 3.07Å; K11-F14 PolarHBondContact O-N 3.39Å
12	S	60.5	Low	58.8	Low	56 Å²	56	128.2 Å²	128.2	39%	0.392	62%	0.622	S	S	.	*	H	α-helix	trans	-63.2	-43.2	174.2	159.3	0	0	0	0	112.1	P8 F9 F14 I15 I16	P8-S12 PolarHBondContact O-N 3.46Å; P8-S12 VanDerWaalsContact O-N 3.07Å; F9-S12 PolarHBondContact O-N 3.08Å; S12-F14 VanDerWaalsContact C-N 3.27Å; S12-F14 PolarHBondContact O-N 3.42Å; S12-I15 PolarHBondContact O-N 2.79Å; S12-I15 VanDerWaalsContact O-N 3.14Å; S12-I16 PolarHBondContact O-N 3.07Å
13	R	59.2	Low	58.7	Low	145 Å²	145	124.2 Å²	124.2	55%	0.547	62%	0.618	S	S	.	*	H	α-helix	trans	-62	-33.2	177.5	-72.1	-178.3	82.9	178	6.3	113	F9 L10 I15 L17	F9-R13 HydrophobicContact CD1-CG 4.37Å; F9-R13 HydrophobicContact CE1-CG 4.45Å; F9-R13 WeakPolarHBondContact O-CG 3.43Å; F9-R13 PolarHBondContact O-N 3.03Å; L10-R13 PolarHBondContact O-N 3.22Å; R13-I15 VanDerWaalsContact C-N 3.3Å; R13-I15 PolarHBondContact O-N 3.04Å; R13-L17 WeakPolarHBondContact O-CB 3.09Å; R13-L17 WeakPolarHBondContact O-CG 3.31Å; R13-L17 PolarHBondContact O-N 3.43Å
14	F	57.8	Low	58.5	Low	162 Å²	162	120.3 Å²	120.3	71%	0.711	60%	0.603	S	S	*	*	H	α-helix	trans	-66.7	-29.1	176.8	-99.9	-84.4	0	0	0	113.6	L10 K11 S12 R18	L10-F14 WeakPolarHBondContact O-CD2 3.38Å; L10-F14 PolarHBondContact O-N 3.1Å; K11-F14 PolarHBondContact O-N 3.39Å; S12-F14 VanDerWaalsContact C-N 3.27Å; S12-F14 PolarHBondContact O-N 3.42Å; F14-R18 WeakPolarHBondContact O-CB 3.24Å; F14-R18 PolarHBondContact O-N 3.4Å
15	I	59.4	Low	58	Low	116 Å²	116	122.4 Å²	122.4	60%	0.595	61%	0.609	S	S	*	*	H	α-helix	trans	-75.6	-45.6	177.7	-62.8	170.4	0	0	0	110.1	S12 R13 L17 R18 E19	S12-I15 PolarHBondContact O-N 2.79Å; S12-I15 VanDerWaalsContact O-N 3.14Å; R13-I15 VanDerWaalsContact C-N 3.3Å; R13-I15 PolarHBondContact O-N 3.04Å; I15-L17 PolarHBondContact O-N 2.99Å; I15-R18 PolarHBondContact O-N 3.47Å; I15-E19 PolarHBondContact O-N 3.1Å; I15-E19 VanDerWaalsContact O-N 3.1Å
16	I	59.2	Low	57.8	Low	107 Å²	107	121.4 Å²	121.4	55%	0.549	61%	0.607	S	S	.	*	H	α-helix	trans	-65.2	-39.9	179.1	-61.2	169.8	0	0	0	111.3	S12 R18 E19 F20	S12-I16 PolarHBondContact O-N 3.07Å; I16-R18 VanDerWaalsContact C-N 3.29Å; I16-R18 PolarHBondContact O-N 3.34Å; I16-E19 PolarHBondContact O-N 3.2Å; I16-F20 WeakPolarHBondContact O-CB 3.06Å; I16-F20 PolarHBondContact O-N 3.28Å
17	L	57.1	Low	57.2	Low	109 Å²	109	128.7 Å²	128.7	57%	0.571	63%	0.629	S	S	*	*	H	α-helix	trans	-67.6	-29.8	177	-71.6	172.5	0	0	0	112.7	R13 I15 S21	R13-L17 WeakPolarHBondContact O-CB 3.09Å; R13-L17 WeakPolarHBondContact O-CG 3.31Å; R13-L17 PolarHBondContact O-N 3.43Å; I15-L17 PolarHBondContact O-N 2.99Å; L17-S21 PolarHBondContact O-N 3.31Å; L17-S21 VanDerWaalsContact O-N 3.15Å
18	R	58.9	Low	57.1	Low	186 Å²	186	123.8 Å²	123.8	70%	0.702	62%	0.62	S	S	*	*	H	α-helix	trans	-71.4	-43	175.5	-175.7	171	176.6	145.2	-1.5	111.5	F14 I15 I16 F20 S21 D22	F14-R18 WeakPolarHBondContact O-CB 3.24Å; F14-R18 PolarHBondContact O-N 3.4Å; I15-R18 PolarHBondContact O-N 3.47Å; I16-R18 VanDerWaalsContact C-N 3.29Å; I16-R18 PolarHBondContact O-N 3.34Å; R18-F20 VanDerWaalsContact C-N 3.32Å; R18-F20 PolarHBondContact O-N 3.02Å; R18-S21 WeakPolarHBondContact O-CB 3.16Å; R18-S21 PolarHBondContact O-N 3.47Å; R18-S21 VanDerWaalsContact O-N 3.14Å; R18-D22 PolarHBondContact O-N 2.9Å
19	E	58.1	Low	56.7	Low	140 Å²	140	124.2 Å²	124.2	65%	0.654	62%	0.623	S	S	*	*	H	α-helix	trans	-67.4	-33.6	177.5	-157.1	161	-163.6	0	0	112.1	I15 I16 S21 D22 S23	I15-E19 PolarHBondContact O-N 3.1Å; I15-E19 VanDerWaalsContact O-N 3.1Å; I16-E19 PolarHBondContact O-N 3.2Å; E19-S21 VanDerWaalsContact C-N 3.33Å; E19-D22 PolarHBondContact O-N 2.82Å; E19-S23 WeakPolarHBondContact O-CB 3.28Å; E19-S23 PolarHBondContact O-N 3.49Å; E19-S23 VanDerWaalsContact O-N 3.12Å
20	F	56	Low	56.5	Low	124 Å²	124	127.7 Å²	127.7	54%	0.544	64%	0.638	S	S	.	*	H	α-helix	trans	-68.4	-31.3	171.7	-160.8	-98.4	0	0	0	113.1	I16 R18	I16-F20 WeakPolarHBondContact O-CB 3.06Å; I16-F20 PolarHBondContact O-N 3.28Å; R18-F20 VanDerWaalsContact C-N 3.32Å; R18-F20 PolarHBondContact O-N 3.02Å
21	S	57.4	Low	55.9	Low	91 Å²	91	132.1 Å²	132.1	64%	0.636	65%	0.65	S	S	*	*	H	α-helix	trans	-72.2	-36.1	174.8	-170	0	0	0	0	112.3	L17 R18 E19	L17-S21 PolarHBondContact O-N 3.31Å; L17-S21 VanDerWaalsContact O-N 3.15Å; R18-S21 WeakPolarHBondContact O-CB 3.16Å; R18-S21 PolarHBondContact O-N 3.47Å; R18-S21 VanDerWaalsContact O-N 3.14Å; E19-S21 VanDerWaalsContact C-N 3.33Å
22	D	55	Low	55.6	Low	117 Å²	117	129 Å²	129	63%	0.626	65%	0.648	S	S	*	*	H	α-helix	trans	-82.8	-22	-177.5	-81.2	-27.2	0	0	0	113.3	R18 E19 S24	R18-D22 PolarHBondContact O-N 2.9Å; E19-D22 PolarHBondContact O-N 2.82Å; D22-S24 PolarHBondContact O-N 3.16Å
23	S	54.7	Low	55.1	Low	105 Å²	105	135.6 Å²	135.6	73%	0.734	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-1.4	-178.4	-166.5	0	0	0	0	115.1	E19	E19-S23 WeakPolarHBondContact O-CB 3.28Å; E19-S23 PolarHBondContact O-N 3.49Å; E19-S23 VanDerWaalsContact O-N 3.12Å
24	S	53.1	Low	55.1	Low	70 Å²	70	133.6 Å²	133.6	49%	0.49	67%	0.671	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104	19.9	-173.1	-51.9	0	0	0	0	114.9	D22 R52	D22-S24 PolarHBondContact O-N 3.16Å; S24-R52 PolarHBondContact OG-NH2 3Å
25	S	50.6	Low	55.1	Low	99 Å²	99	131.2 Å²	131.2	69%	0.692	67%	0.671	S	S	*	*			trans	-105	52.3	-175.3	176.9	0	0	0	0	113.3
26	E	56.9	Low	55.2	Low	169 Å²	169	135.4 Å²	135.4	79%	0.79	68%	0.68	S	S	*	*			trans	-79.1	114.4	149.5	-102.4	-174	153.3	0	0	107.4	V28	E26-V28 VanDerWaalsContact C-N 3.27Å; E26-V28 PolarHBondContact O-N 2.95Å
27	R	46.8	Very low	55.5	Low	240 Å²	240	134.9 Å²	134.9	91%	0.906	68%	0.678	S	S	*	*			trans	-65.6	81.8	-177.8	-67.4	-162.8	-79.2	-177.4	-5.9	110.5
28	V	57.5	Low	56.1	Low	91 Å²	91	139.9 Å²	139.9	55%	0.552	70%	0.695	S	S	*	*			trans	-73.1	132.7	165.6	-72	0	0	0	0	109.3	E26 F30 F48	E26-V28 VanDerWaalsContact C-N 3.27Å; E26-V28 PolarHBondContact O-N 2.95Å; V28-F30 PolarHBondContact O-N 3.43Å; V28-F48 HydrophobicContact CG1-CE2 4.16Å; V28-F48 HydrophobicContact CG2-CE2 4.12Å
29	P	52.5	Low	56.9	Low	97 Å²	97	135 Å²	135	63%	0.63	68%	0.681	S	S	*	*			trans	-64.1	136.2	-176	26.9	-33.2	0	0	0	109.9	Y31	P29-Y31 HydrophobicContact CB-CD2 3.87Å; P29-Y31 HydrophobicContact CB-CE2 3.96Å; P29-Y31 PolarHBondContact O-N 3.19Å
30	F	55.7	Low	58.1	Low	201 Å²	201	137.6 Å²	137.6	88%	0.882	69%	0.686	S	S	*	*	S	Bend	trans	-57.9	14.2	-172.2	178.3	-104.3	0	0	0	116.3	V28	V28-F30 PolarHBondContact O-N 3.43Å
31	Y	46.8	Very low	59.6	Low	185 Å²	185	142.2 Å²	142.2	73%	0.725	70%	0.7	S	S	*	*			trans	-107	80	-179.4	-35.6	-77.4	0	0	0	110.8	P29	P29-Y31 HydrophobicContact CB-CD2 3.87Å; P29-Y31 HydrophobicContact CB-CE2 3.96Å; P29-Y31 PolarHBondContact O-N 3.19Å
32	S	53.5	Low	60.9	Low	98 Å²	98	143.4 Å²	143.4	69%	0.685	70%	0.7	S	S	*	*			trans	-137.5	68.3	165.8	-160.1	0	0	0	0	111.7	K34	S32-K34 VanDerWaalsContact C-N 3.34Å
33	M	50.8	Low	62.2	Low	195 Å²	195	147.7 Å²	147.7	96%	0.961	71%	0.708	S	S	*	*			trans	-100.8	63.5	138.2	-80.2	173.7	100.8	0	0	106.3
34	K	58.8	Low	63.6	Low	104 Å²	104	149.1 Å²	149.1	45%	0.452	71%	0.706	S	S	.	*			trans	-88	123.3	179.4	-77.8	169.4	170.8	-175	0	109	S32 R36 L37	S32-K34 VanDerWaalsContact C-N 3.34Å; K34-R36 PolarHBondContact O-N 3.44Å; K34-L37 HydrophobicContact CB-CD1 4.36Å; K34-L37 HydrophobicContact CD-CD1 3.72Å; K34-L37 HydrophobicContact CG-CD1 4.15Å
35	P	58.8	Low	64.8	Low	111 Å²	111	152.5 Å²	152.5	72%	0.721	71%	0.714	S	S	*	*			trans	-54.2	136	158.7	25.8	-32.1	0	0	0	106.9	L37	P35-L37 PolarHBondContact O-N 3.33Å
36	R	61.6	Low	66.2	Low	204 Å²	204	156.3 Å²	156.3	77%	0.77	71%	0.714	S	S	*	*			trans	-50.1	101.7	-173	-60.7	-156.5	-170.2	-136.8	-0.4	109.4	K34 F38	K34-R36 PolarHBondContact O-N 3.44Å; R36-F38 PolarHBondContact O-N 2.86Å
37	L	66	Low	67.6	Low	97 Å²	97	151.9 Å²	151.9	51%	0.508	70%	0.696	S	S	.	*			trans	-65.3	122.9	-176	-80.9	153.1	0	0	0	106.8	K34 P35 M39	K34-L37 HydrophobicContact CB-CD1 4.36Å; K34-L37 HydrophobicContact CD-CD1 3.72Å; K34-L37 HydrophobicContact CG-CD1 4.15Å; P35-L37 PolarHBondContact O-N 3.33Å; L37-M39 HydrophobicContact CB-CE 3.53Å; L37-M39 HydrophobicContact CB-SD 4.13Å; L37-M39 HydrophobicContact CD1-CE 4.16Å; L37-M39 HydrophobicContact CG-CE 4.47Å; L37-M39 PolarHBondContact O-N 3.27Å; L37-M39 VanDerWaalsContact O-N 3.13Å
38	F	69.5	Low	69.3	Low	214 Å²	214	146.3 Å²	146.3	94%	0.939	68%	0.678	S	S	*	*			trans	-61.6	113.9	169	-81	-91.2	0	0	0	108.2	R36	R36-F38 PolarHBondContact O-N 2.86Å
39	M	75	Confident	70.6	Confident	84 Å²	84	149.2 Å²	149.2	41%	0.414	68%	0.683	S	S	.	*			trans	-98.1	137.5	173.2	-55.9	-52.1	-175.5	0	0	109.4	L37 D42	L37-M39 HydrophobicContact CB-CE 3.53Å; L37-M39 HydrophobicContact CB-SD 4.13Å; L37-M39 HydrophobicContact CD1-CE 4.16Å; L37-M39 HydrophobicContact CG-CE 4.47Å; L37-M39 PolarHBondContact O-N 3.27Å; L37-M39 VanDerWaalsContact O-N 3.13Å; M39-D42 HydrophobicContact CB-CB 4.26Å
40	Y	84.2	Confident	72.2	Confident	194 Å²	194	149.5 Å²	149.5	76%	0.761	68%	0.676	S	S	*	*	S	Bend	trans	-103.8	118.2	172.9	-177.8	-104.6	0	0	0	109.8	D42	Y40-D42 PolarHBondContact O-N 2.75Å
41	R	86.8	Confident	73.8	Confident	221 Å²	221	142 Å²	142	83%	0.834	64%	0.644	S	S	*	*	S	Bend	trans	57.7	25.3	-179.9	-62.7	178.6	174.1	-109.1	0.8	115.3
42	D	84.9	Confident	75.9	Confident	116 Å²	116	139.5 Å²	139.5	62%	0.62	63%	0.633	S	S	*	*	S	Bend	trans	-125	163.8	173.3	-153.2	-8.6	0	0	0	110.8	M39 Y40	M39-D42 HydrophobicContact CB-CB 4.26Å; Y40-D42 PolarHBondContact O-N 2.75Å
43	Y	82.7	Confident	77.8	Confident	206 Å²	206	141.5 Å²	141.5	81%	0.808	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-75.7	149.8	176.2	-61.5	-83.4	0	0	0	110.9	E45	Y43-E45 PolarHBondContact O-N 3.11Å
44	I	82.2	Confident	79.8	Confident	136 Å²	136	135.4 Å²	135.4	70%	0.697	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-76.4	121.8	173.2	-59.9	171.5	0	0	0	107.9	R46	I44-R46 PolarHBondContact O-N 2.94Å
45	E	80.1	Confident	81.6	Confident	141 Å²	141	134.9 Å²	134.9	66%	0.659	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-55.8	121.5	169.6	-70.2	179.3	179.7	0	0	109.3	Y43	Y43-E45 PolarHBondContact O-N 3.11Å
46	R	79.7	Confident	83.3	Confident	178 Å²	178	134.4 Å²	134.4	67%	0.672	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-77.7	135.2	178.7	-62.7	-175.1	-59	-154	0.2	109.6	I44 F48 E51	I44-R46 PolarHBondContact O-N 2.94Å; R46-F48 PolarHBondContact O-N 3.03Å; R46-E51 IonicContact CZ-OE1 3.89Å; R46-E51 IonicContact CZ-OE2 3.99Å; R46-E51 IonicContact NE-OE1 3.11Å; R46-E51 IonicContact NE-OE2 3.34Å; R46-E51 PolarHBondContact NE-OE2 3.38Å; R46-E51 IonicContact NH1-OE1 3.79Å; R46-E51 IonicContact NH2-OE1 3.69Å; R46-E51 PolarHBondContact NH2-OE1 3.36Å; R46-E51 IonicContact NH2-OE2 3.4Å; R46-E51 PolarHBondContact NH2-OE2 3.4Å
47	D	85.3	Confident	85	Confident	77 Å²	77	130.3 Å²	130.3	41%	0.412	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-71.2	117.4	167.3	-179.2	2.2	0	0	0	108.8	K49 E50 E51	D47-K49 PolarHBondContact O-N 2.85Å; D47-K49 VanDerWaalsContact O-N 3.08Å; D47-K49 PolarHBondContact OD1-N 3.38Å; D47-E50 HydrophobicContact CB-CB 4.12Å; D47-E50 HydrophobicContact CB-CG 3.94Å; D47-E50 PolarHBondContact O-N 2.92Å; D47-E51 PolarHBondContact O-N 2.93Å
48	F	83.6	Confident	86.5	Confident	122 Å²	122	131.2 Å²	131.2	54%	0.535	59%	0.592	S	S	.	*	H	α-helix	trans	-51.7	-31.8	176.4	-69.2	-76.1	0	0	0	112.8	V28 R46 R52	V28-F48 HydrophobicContact CG1-CE2 4.16Å; V28-F48 HydrophobicContact CG2-CE2 4.12Å; R46-F48 PolarHBondContact O-N 3.03Å; F48-R52 VanDerWaalsContact O-CB 3.28Å; F48-R52 WeakPolarHBondContact O-CB 3.47Å; F48-R52 PolarHBondContact O-N 3.35Å
49	K	84.4	Confident	87.8	Confident	152 Å²	152	125.3 Å²	125.3	66%	0.661	57%	0.573	S	S	*	*	H	α-helix	trans	-71.5	-40.7	176.8	-67	178.4	-179.1	174.2	0	111.9	D47 K53	D47-K49 PolarHBondContact O-N 2.85Å; D47-K49 VanDerWaalsContact O-N 3.08Å; D47-K49 PolarHBondContact OD1-N 3.38Å; K49-K53 VanDerWaalsContact O-CG 3.24Å; K49-K53 WeakPolarHBondContact O-CG 3.48Å; K49-K53 PolarHBondContact O-N 2.86Å; K49-K53 VanDerWaalsContact O-N 3.13Å
50	E	86.8	Confident	88.9	Confident	103 Å²	103	126.1 Å²	126.1	48%	0.481	58%	0.579	S	S	.	*	H	α-helix	trans	-68.7	-43.1	176.7	-67.2	-173.1	165.2	0	0	110.9	D47 R52 K53 S54	D47-E50 HydrophobicContact CB-CB 4.12Å; D47-E50 HydrophobicContact CB-CG 3.94Å; D47-E50 PolarHBondContact O-N 2.92Å; E50-R52 PolarHBondContact O-N 3.34Å; E50-K53 PolarHBondContact O-N 3.5Å; E50-S54 PolarHBondContact O-N 3.34Å
51	E	89.2	Confident	89.5	Confident	44 Å²	44	122.8 Å²	122.8	21%	0.206	57%	0.568	C	S	.	*	H	α-helix	trans	-62.6	-42.3	177	-177.5	165.9	-165.3	0	0	111.8	R46 D47 K53 S54 Q55	R46-E51 IonicContact CZ-OE1 3.89Å; R46-E51 IonicContact CZ-OE2 3.99Å; R46-E51 IonicContact NE-OE1 3.11Å; R46-E51 IonicContact NE-OE2 3.34Å; R46-E51 PolarHBondContact NE-OE2 3.38Å; R46-E51 IonicContact NH1-OE1 3.79Å; R46-E51 IonicContact NH2-OE1 3.69Å; R46-E51 PolarHBondContact NH2-OE1 3.36Å; R46-E51 IonicContact NH2-OE2 3.4Å; R46-E51 PolarHBondContact NH2-OE2 3.4Å; D47-E51 PolarHBondContact O-N 2.93Å; E51-K53 VanDerWaalsContact C-N 3.34Å; E51-K53 PolarHBondContact O-N 2.9Å; E51-S54 PolarHBondContact O-N 3.13Å; E51-S54 PolarHBondContact O-OG 3.25Å; E51-Q55 WeakPolarHBondContact O-CB 3.39Å; E51-Q55 VanDerWaalsContact O-CG 3.28Å; E51-Q55 WeakPolarHBondContact O-CG 3.34Å; E51-Q55 PolarHBondContact O-N 2.88Å
52	R	89.4	Confident	89.9	Confident	133 Å²	133	119.3 Å²	119.3	50%	0.502	56%	0.555	S	S	.	*	H	α-helix	trans	-64.9	-38.5	175.7	-172.7	172.7	-68.3	165.7	-2	112.3	S24 F48 E50 L56	S24-R52 PolarHBondContact OG-NH2 3Å; F48-R52 VanDerWaalsContact O-CB 3.28Å; F48-R52 WeakPolarHBondContact O-CB 3.47Å; F48-R52 PolarHBondContact O-N 3.35Å; E50-R52 PolarHBondContact O-N 3.34Å; R52-L56 WeakPolarHBondContact O-CB 3.43Å; R52-L56 PolarHBondContact O-N 3.4Å
53	K	93.1	Very high	90.5	Very high	140 Å²	140	116.6 Å²	116.6	61%	0.609	55%	0.549	S	S	*	.	H	α-helix	trans	-65.6	-43.3	175.3	-74.6	171.8	-176	179.4	0	111.4	K49 E50 E51 L56 L57	K49-K53 VanDerWaalsContact O-CG 3.24Å; K49-K53 WeakPolarHBondContact O-CG 3.48Å; K49-K53 PolarHBondContact O-N 2.86Å; K49-K53 VanDerWaalsContact O-N 3.13Å; E50-K53 PolarHBondContact O-N 3.5Å; E51-K53 VanDerWaalsContact C-N 3.34Å; E51-K53 PolarHBondContact O-N 2.9Å; K53-L56 PolarHBondContact O-N 2.95Å; K53-L57 WeakPolarHBondContact O-CG 3.22Å; K53-L57 PolarHBondContact O-N 3.33Å
54	S	94	Very high	91	Very high	66 Å²	66	114.8 Å²	114.8	46%	0.462	54%	0.541	S	S	.	.	H	α-helix	trans	-65.5	-41	179.8	70.5	0	0	0	0	111.7	E50 E51 L57 M58	E50-S54 PolarHBondContact O-N 3.34Å; E51-S54 PolarHBondContact O-N 3.13Å; E51-S54 PolarHBondContact O-OG 3.25Å; S54-L57 PolarHBondContact O-N 2.88Å; S54-M58 WeakPolarHBondContact O-CB 3.05Å; S54-M58 PolarHBondContact O-N 3.23Å
55	Q	95.6	Very high	91.6	Very high	94 Å²	94	110.8 Å²	110.8	44%	0.439	52%	0.52	S	S	.	.	H	α-helix	trans	-62	-42.8	173.2	-70.7	174.2	5.5	0	0	112	E51 M58 T59	E51-Q55 WeakPolarHBondContact O-CB 3.39Å; E51-Q55 VanDerWaalsContact O-CG 3.28Å; E51-Q55 WeakPolarHBondContact O-CG 3.34Å; E51-Q55 PolarHBondContact O-N 2.88Å; Q55-M58 PolarHBondContact O-N 3.13Å; Q55-T59 WeakPolarHBondContact O-CB 3.47Å; Q55-T59 WeakPolarHBondContact O-CG2 3.29Å; Q55-T59 PolarHBondContact O-N 2.74Å; Q55-T59 PolarHBondContact O-OG1 2.89Å
56	L	96.2	Very high	92.3	Very high	100 Å²	100	107.2 Å²	107.2	52%	0.524	51%	0.508	S	S	.	.	H	α-helix	trans	-63.7	-41.3	176.6	-175.5	140	0	0	0	112	R52 K53 T59 L60	R52-L56 WeakPolarHBondContact O-CB 3.43Å; R52-L56 PolarHBondContact O-N 3.4Å; K53-L56 PolarHBondContact O-N 2.95Å; L56-T59 WeakPolarHBondContact CA-OG1 3.49Å; L56-T59 PolarHBondContact O-OG1 3.48Å; L56-L60 HydrophobicContact CD2-CD1 3.64Å; L56-L60 HydrophobicContact CD2-CG 4.4Å; L56-L60 HydrophobicContact CG-CD1 4.41Å; L56-L60 WeakPolarHBondContact O-CB 3.38Å; L56-L60 VanDerWaalsContact O-CG 3.29Å; L56-L60 WeakPolarHBondContact O-CG 3.16Å; L56-L60 PolarHBondContact O-N 3.29Å
57	L	97	Very high	93	Very high	118 Å²	118	104.7 Å²	104.7	62%	0.618	50%	0.499	S	S	*	.	H	α-helix	trans	-65.6	-43.3	175.6	-70.6	173.4	0	0	0	112	K53 S54 T59 L60 F61	K53-L57 WeakPolarHBondContact O-CG 3.22Å; K53-L57 PolarHBondContact O-N 3.33Å; S54-L57 PolarHBondContact O-N 2.88Å; L57-T59 PolarHBondContact O-N 3.45Å; L57-L60 PolarHBondContact O-N 3.03Å; L57-F61 WeakPolarHBondContact O-CB 3.36Å; L57-F61 PolarHBondContact O-N 2.94Å
58	M	97	Very high	93.4	Very high	117 Å²	117	104.9 Å²	104.9	58%	0.576	50%	0.497	S	S	*	.	H	α-helix	trans	-62.7	-42.9	177.8	-177.3	57.7	67.8	0	0	111.9	S54 Q55 F61 W62	S54-M58 WeakPolarHBondContact O-CB 3.05Å; S54-M58 PolarHBondContact O-N 3.23Å; Q55-M58 PolarHBondContact O-N 3.13Å; M58-F61 PolarHBondContact O-N 3Å; M58-F61 HydrophobicContact SD-CD1 4.45Å; M58-W62 PolarHBondContact O-N 3.24Å
59	T	97.1	Very high	93.8	Very high	89 Å²	89	101.8 Å²	101.8	55%	0.546	49%	0.49	S	S	.	.	H	α-helix	trans	-66.5	-39.8	176.9	51.1	0	0	0	0	112.3	Q55 L56 L57 A63	Q55-T59 WeakPolarHBondContact O-CB 3.47Å; Q55-T59 WeakPolarHBondContact O-CG2 3.29Å; Q55-T59 PolarHBondContact O-N 2.74Å; Q55-T59 PolarHBondContact O-OG1 2.89Å; L56-T59 WeakPolarHBondContact CA-OG1 3.49Å; L56-T59 PolarHBondContact O-OG1 3.48Å; L57-T59 PolarHBondContact O-N 3.45Å; T59-A63 VanDerWaalsContact O-CB 3.25Å; T59-A63 WeakPolarHBondContact O-CB 3.43Å; T59-A63 PolarHBondContact O-N 2.91Å
60	L	97.3	Very high	94.1	Very high	102 Å²	102	100.5 Å²	100.5	53%	0.534	49%	0.489	S	S	.	.	H	α-helix	trans	-65.2	-40.3	173.7	-74.3	177	0	0	0	112.3	L56 L57 A63 W64	L56-L60 HydrophobicContact CD2-CD1 3.64Å; L56-L60 HydrophobicContact CD2-CG 4.4Å; L56-L60 HydrophobicContact CG-CD1 4.41Å; L56-L60 WeakPolarHBondContact O-CB 3.38Å; L56-L60 VanDerWaalsContact O-CG 3.29Å; L56-L60 WeakPolarHBondContact O-CG 3.16Å; L56-L60 PolarHBondContact O-N 3.29Å; L57-L60 PolarHBondContact O-N 3.03Å; L60-A63 PolarHBondContact O-N 3.03Å; L60-W64 WeakPolarHBondContact O-CB 3.28Å; L60-W64 PolarHBondContact O-N 2.98Å
61	F	97.2	Very high	94.4	Very high	123 Å²	123	99.1 Å²	99.1	54%	0.539	49%	0.485	S	S	.	.	H	α-helix	trans	-60.4	-48.5	176.5	177.7	-106.4	0	0	0	111.6	L57 M58 W64 I65	L57-F61 WeakPolarHBondContact O-CB 3.36Å; L57-F61 PolarHBondContact O-N 2.94Å; M58-F61 PolarHBondContact O-N 3Å; M58-F61 HydrophobicContact SD-CD1 4.45Å; F61-W64 WeakPolarHBondContact O-CB 3.44Å; F61-W64 PolarHBondContact O-N 2.93Å; F61-I65 HydrophobicContact CD1-CD1 3.9Å; F61-I65 HydrophobicContact CE1-CD1 3.36Å; F61-I65 HydrophobicContact CE2-CD1 4.08Å; F61-I65 HydrophobicContact CG-CD1 4.47Å; F61-I65 HydrophobicContact CZ-CD1 3.47Å; F61-I65 VanDerWaalsContact CZ-CD1 3.47Å; F61-I65 HydrophobicContact CZ-CG1 4.42Å; F61-I65 WeakPolarHBondContact O-CG1 3.39Å; F61-I65 PolarHBondContact O-N 2.9Å
62	W	95.8	Very high	94.4	Very high	148 Å²	148	100.2 Å²	100.2	56%	0.561	49%	0.49	S	S	*	.	H	α-helix	trans	-69.4	-35.9	176.3	-118.1	133.9	0	0	0	112.4	M58 W64 I65 T66	M58-W62 PolarHBondContact O-N 3.24Å; W62-W64 PolarHBondContact O-N 3.43Å; W62-I65 HydrophobicContact CE3-CB 3.79Å; W62-I65 HydrophobicContact CE3-CG2 3.92Å; W62-I65 HydrophobicContact CH2-CG2 4.22Å; W62-I65 HydrophobicContact CZ3-CB 3.9Å; W62-I65 HydrophobicContact CZ3-CG2 3.47Å; W62-I65 VanDerWaalsContact CZ3-CG2 3.47Å; W62-I65 PolarHBondContact O-N 3.2Å; W62-T66 WeakPolarHBondContact O-CB 3.25Å; W62-T66 PolarHBondContact O-N 3.3Å; W62-T66 PolarHBondContact O-OG1 3.31Å
63	A	96	Very high	94.4	Very high	59 Å²	59	96.3 Å²	96.3	49%	0.488	48%	0.481	S	S	.	.	H	α-helix	trans	-59.4	-40.2	173.2	0	0	0	0	0	111.2	T59 L60 Y67	T59-A63 VanDerWaalsContact O-CB 3.25Å; T59-A63 WeakPolarHBondContact O-CB 3.43Å; T59-A63 PolarHBondContact O-N 2.91Å; L60-A63 PolarHBondContact O-N 3.03Å; A63-Y67 VanDerWaalsContact O-CB 3.22Å; A63-Y67 WeakPolarHBondContact O-CB 3.32Å; A63-Y67 PolarHBondContact O-N 3.43Å
64	W	94.8	Very high	94	Very high	168 Å²	168	93.1 Å²	93.1	64%	0.636	47%	0.469	S	S	*	.	H	α-helix	trans	-66	-48.6	176.5	-178.8	-98.7	0	0	0	112.9	L60 F61 W62 T66 Y67 F68	L60-W64 WeakPolarHBondContact O-CB 3.28Å; L60-W64 PolarHBondContact O-N 2.98Å; F61-W64 WeakPolarHBondContact O-CB 3.44Å; F61-W64 PolarHBondContact O-N 2.93Å; W62-W64 PolarHBondContact O-N 3.43Å; W64-T66 VanDerWaalsContact C-N 3.33Å; W64-T66 PolarHBondContact O-N 3.37Å; W64-Y67 HydrophobicContact CZ3-CD1 4.5Å; W64-Y67 WeakPolarHBondContact O-CB 3.49Å; W64-Y67 PolarHBondContact O-N 3.28Å; W64-F68 WeakPolarHBondContact O-CB 3.29Å; W64-F68 PolarHBondContact O-N 2.96Å
65	I	94.4	Very high	93.5	Very high	53 Å²	53	94.1 Å²	94.1	27%	0.272	47%	0.466	S	S	.	.	H	α-helix	trans	-59.5	-47.3	177.9	-67	172.1	0	0	0	110.4	F61 W62 Y67 F68 C69	F61-I65 HydrophobicContact CD1-CD1 3.9Å; F61-I65 HydrophobicContact CE1-CD1 3.36Å; F61-I65 HydrophobicContact CE2-CD1 4.08Å; F61-I65 HydrophobicContact CG-CD1 4.47Å; F61-I65 HydrophobicContact CZ-CD1 3.47Å; F61-I65 VanDerWaalsContact CZ-CD1 3.47Å; F61-I65 HydrophobicContact CZ-CG1 4.42Å; F61-I65 WeakPolarHBondContact O-CG1 3.39Å; F61-I65 PolarHBondContact O-N 2.9Å; W62-I65 HydrophobicContact CE3-CB 3.79Å; W62-I65 HydrophobicContact CE3-CG2 3.92Å; W62-I65 HydrophobicContact CH2-CG2 4.22Å; W62-I65 HydrophobicContact CZ3-CB 3.9Å; W62-I65 HydrophobicContact CZ3-CG2 3.47Å; W62-I65 VanDerWaalsContact CZ3-CG2 3.47Å; W62-I65 PolarHBondContact O-N 3.2Å; I65-Y67 VanDerWaalsContact C-N 3.33Å; I65-Y67 PolarHBondContact O-N 3.08Å; I65-F68 PolarHBondContact O-N 3.02Å; I65-C69 PolarHBondContact O-N 3.43Å; I65-C69 PolarHBondContact O-SG 3.5Å
66	T	94.8	Very high	92.9	Very high	65 Å²	65	96.2 Å²	96.2	40%	0.399	48%	0.48	S	S	.	.	H	α-helix	trans	-62.3	-43.1	179.7	-54	0	0	0	0	111.2	W62 W64 F68 C69 I70	W62-T66 WeakPolarHBondContact O-CB 3.25Å; W62-T66 PolarHBondContact O-N 3.3Å; W62-T66 PolarHBondContact O-OG1 3.31Å; W64-T66 VanDerWaalsContact C-N 3.33Å; W64-T66 PolarHBondContact O-N 3.37Å; T66-F68 VanDerWaalsContact C-N 3.34Å; T66-F68 PolarHBondContact O-N 2.74Å; T66-C69 PolarHBondContact O-N 3.15Å; T66-I70 HydrophobicContact CG2-CD1 3.89Å; T66-I70 VanDerWaalsContact O-CG1 3.29Å; T66-I70 WeakPolarHBondContact O-CG1 3.38Å; T66-I70 PolarHBondContact O-N 3Å; T66-I70 VanDerWaalsContact O-N 3.16Å
67	Y	94.7	Very high	92.2	Very high	125 Å²	125	98.3 Å²	98.3	49%	0.49	49%	0.49	S	S	.	.	H	α-helix	trans	-58.5	-47.1	174.6	172.7	-95.4	0	0	0	111	A63 W64 I65 I70 N71	A63-Y67 VanDerWaalsContact O-CB 3.22Å; A63-Y67 WeakPolarHBondContact O-CB 3.32Å; A63-Y67 PolarHBondContact O-N 3.43Å; W64-Y67 HydrophobicContact CZ3-CD1 4.5Å; W64-Y67 WeakPolarHBondContact O-CB 3.49Å; W64-Y67 PolarHBondContact O-N 3.28Å; I65-Y67 VanDerWaalsContact C-N 3.33Å; I65-Y67 PolarHBondContact O-N 3.08Å; Y67-I70 PolarHBondContact O-N 3.42Å; Y67-N71 WeakPolarHBondContact CD2-ND2 3.49Å; Y67-N71 WeakPolarHBondContact CE2-ND2 3.46Å; Y67-N71 PolarHBondContact O-N 3.45Å; Y67-N71 VanDerWaalsContact O-N 3.11Å; Y67-N71 PolarHBondContact O-ND2 3.07Å
68	F	93	Very high	91.6	Very high	81 Å²	81	94.7 Å²	94.7	36%	0.355	48%	0.481	S	S	.	.	H	α-helix	trans	-61.2	-51.6	179.1	-168.5	-96.3	0	0	0	111.1	W64 I65 T66 I70 N71 H72 E75	W64-F68 WeakPolarHBondContact O-CB 3.29Å; W64-F68 PolarHBondContact O-N 2.96Å; I65-F68 PolarHBondContact O-N 3.02Å; T66-F68 VanDerWaalsContact C-N 3.34Å; T66-F68 PolarHBondContact O-N 2.74Å; F68-I70 PolarHBondContact O-N 3.28Å; F68-I70 VanDerWaalsContact O-N 3.1Å; F68-N71 PolarHBondContact O-N 3.43Å; F68-H72 HydrophobicContact CD1-CB 4.31Å; F68-H72 HydrophobicContact CD2-CB 4.17Å; F68-H72 AromaticContact CD2-CD2 3.93Å; F68-H72 HydrophobicContact CE1-CB 4.08Å; F68-H72 HydrophobicContact CE2-CB 3.93Å; F68-H72 AromaticContact CE2-CD2 3.91Å; F68-H72 HydrophobicContact CG-CB 4.35Å; F68-H72 HydrophobicContact CZ-CB 3.88Å; F68-H72 WeakPolarHBondContact O-CA 3.24Å; F68-H72 VanDerWaalsContact O-CB 3.28Å; F68-H72 WeakPolarHBondContact O-CB 3.28Å; F68-H72 PolarHBondContact O-N 2.92Å; F68-E75 HydrophobicContact CE1-CB 4.07Å; F68-E75 HydrophobicContact CE1-CG 4.37Å; F68-E75 HydrophobicContact CZ-CB 4.24Å; F68-E75 HydrophobicContact CZ-CG 4.03Å
69	C	91.2	Very high	91	Very high	57 Å²	57	95.9 Å²	95.9	39%	0.385	49%	0.485	S	S	.	.	H	α-helix	trans	-58.6	-28.7	179.7	-65.1	0	0	0	0	114.4	I65 T66	I65-C69 PolarHBondContact O-N 3.43Å; I65-C69 PolarHBondContact O-SG 3.5Å; T66-C69 PolarHBondContact O-N 3.15Å
70	I	92.7	Very high	90.3	Very high	125 Å²	125	100 Å²	100	64%	0.641	50%	0.498	S	S	*	.	H	α-helix	trans	-80.2	-42.4	178.6	-68.2	167.9	0	0	0	111.9	T66 Y67 F68	T66-I70 HydrophobicContact CG2-CD1 3.89Å; T66-I70 VanDerWaalsContact O-CG1 3.29Å; T66-I70 WeakPolarHBondContact O-CG1 3.38Å; T66-I70 PolarHBondContact O-N 3Å; T66-I70 VanDerWaalsContact O-N 3.16Å; Y67-I70 PolarHBondContact O-N 3.42Å; F68-I70 PolarHBondContact O-N 3.28Å; F68-I70 VanDerWaalsContact O-N 3.1Å
71	N	92	Very high	89.6	Confident	74 Å²	74	104.8 Å²	104.8	40%	0.396	51%	0.514	S	S	.	.	H	α-helix	trans	-85.5	-25.6	-175.5	-66.5	-84.1	0	0	0	112.8	Y67 F68	Y67-N71 WeakPolarHBondContact CD2-ND2 3.49Å; Y67-N71 WeakPolarHBondContact CE2-ND2 3.46Å; Y67-N71 PolarHBondContact O-N 3.45Å; Y67-N71 VanDerWaalsContact O-N 3.11Å; Y67-N71 PolarHBondContact O-ND2 3.07Å; F68-N71 PolarHBondContact O-N 3.43Å
72	H	90.1	Very high	88.9	Confident	67 Å²	67	106.9 Å²	106.9	31%	0.31	53%	0.53	S	S	.	.			trans	-132.9	60.7	-169.9	-69.9	-57.6	0	0	0	109.7	F68 E74 E75	F68-H72 HydrophobicContact CD1-CB 4.31Å; F68-H72 HydrophobicContact CD2-CB 4.17Å; F68-H72 AromaticContact CD2-CD2 3.93Å; F68-H72 HydrophobicContact CE1-CB 4.08Å; F68-H72 HydrophobicContact CE2-CB 3.93Å; F68-H72 AromaticContact CE2-CD2 3.91Å; F68-H72 HydrophobicContact CG-CB 4.35Å; F68-H72 HydrophobicContact CZ-CB 3.88Å; F68-H72 WeakPolarHBondContact O-CA 3.24Å; F68-H72 VanDerWaalsContact O-CB 3.28Å; F68-H72 WeakPolarHBondContact O-CB 3.28Å; F68-H72 PolarHBondContact O-N 2.92Å; H72-E74 VanDerWaalsContact C-N 3.29Å; H72-E74 IonicContact ND1-OE1 3.53Å; H72-E75 WeakPolarHBondContact CA-OE2 3.35Å; H72-E75 WeakPolarHBondContact CB-OE2 3.19Å; H72-E75 IonicContact CG-OE1 2.98Å; H72-E75 IonicContact CG-OE2 3.03Å; H72-E75 IonicContact ND1-OE1 3.5Å; H72-E75 PolarHBondContact ND1-OE1 3.2Å; H72-E75 IonicContact ND1-OE2 3.31Å
73	P	88.3	Confident	88.3	Confident	51 Å²	51	104.1 Å²	104.1	33%	0.331	53%	0.532	S	S	.	.			trans	-73.1	-24.1	176.1	31.5	-36.6	0	0	0	112.2	E75 L76 I77	P73-E75 PolarHBondContact O-N 2.78Å; P73-L76 PolarHBondContact O-N 3.12Å; P73-I77 HydrophobicContact CB-CD1 4.5Å; P73-I77 PolarHBondContact O-N 3.47Å
74	E	85.2	Confident	87.9	Confident	73 Å²	73	105.6 Å²	105.6	34%	0.341	53%	0.531	S	S	.	.	H	α-helix	trans	-64.3	-27.3	-178.9	59.4	-87.6	-166.6	0	0	113.4	H72 L76 G78 H79	H72-E74 VanDerWaalsContact C-N 3.29Å; H72-E74 IonicContact ND1-OE1 3.53Å; E74-L76 VanDerWaalsContact C-N 3.28Å; E74-L76 PolarHBondContact O-N 3.02Å; E74-G78 CarbonylContact O-C 3.1Å; E74-G78 WeakPolarHBondContact O-CA 3.41Å; E74-G78 PolarHBondContact O-N 3.41Å; E74-H79 WeakPolarHBondContact CG-CE1 3.4Å; E74-H79 WeakPolarHBondContact CG-ND1 3.46Å; E74-H79 PolarHBondContact O-N 3.42Å
75	E	83.3	Confident	87.3	Confident	87 Å²	87	102.1 Å²	102.1	41%	0.407	53%	0.53	S	S	.	.	H	α-helix	trans	-72.5	-24.6	175	-67.6	84.1	164.5	0	0	112	F68 H72 P73	F68-E75 HydrophobicContact CE1-CB 4.07Å; F68-E75 HydrophobicContact CE1-CG 4.37Å; F68-E75 HydrophobicContact CZ-CB 4.24Å; F68-E75 HydrophobicContact CZ-CG 4.03Å; H72-E75 WeakPolarHBondContact CA-OE2 3.35Å; H72-E75 WeakPolarHBondContact CB-OE2 3.19Å; H72-E75 IonicContact CG-OE1 2.98Å; H72-E75 IonicContact CG-OE2 3.03Å; H72-E75 IonicContact ND1-OE1 3.5Å; H72-E75 PolarHBondContact ND1-OE1 3.2Å; H72-E75 IonicContact ND1-OE2 3.31Å; P73-E75 PolarHBondContact O-N 2.78Å
76	L	84	Confident	86.9	Confident	138 Å²	138	108.4 Å²	108.4	72%	0.723	56%	0.556	S	S	*	*	H	α-helix	trans	-89.1	-40.2	177.1	-172.5	67	0	0	0	112.1	P73 E74	P73-L76 PolarHBondContact O-N 3.12Å; E74-L76 VanDerWaalsContact C-N 3.28Å; E74-L76 PolarHBondContact O-N 3.02Å
77	I	81.5	Confident	86.3	Confident	144 Å²	144	110.4 Å²	110.4	74%	0.738	57%	0.568	S	S	*	*	H	α-helix	trans	-94.8	-21.6	-172.9	-61.1	171.7	0	0	0	111.7	P73	P73-I77 HydrophobicContact CB-CD1 4.5Å; P73-I77 PolarHBondContact O-N 3.47Å
78	G	83.4	Confident	85.9	Confident	42 Å²	42	108.5 Å²	108.5	43%	0.433	56%	0.562	S	S	.	*			trans	98.4	140	-168.7	0	0	0	0	0	111.3	E74 E80	E74-G78 CarbonylContact O-C 3.1Å; E74-G78 WeakPolarHBondContact O-CA 3.41Å; E74-G78 PolarHBondContact O-N 3.41Å; G78-E80 VanDerWaalsContact C-N 3.34Å
79	H	85.4	Confident	85.5	Confident	143 Å²	143	108.3 Å²	108.3	66%	0.662	57%	0.568	S	S	*	*	S	Bend	trans	-65.8	-35.9	179.3	-65.3	-72.7	0	0	0	112.9	E74	E74-H79 WeakPolarHBondContact CG-CE1 3.4Å; E74-H79 WeakPolarHBondContact CG-ND1 3.46Å; E74-H79 PolarHBondContact O-N 3.42Å
80	E	81.9	Confident	85.4	Confident	175 Å²	175	110.8 Å²	110.8	82%	0.818	58%	0.577	S	S	*	*	S	Bend	trans	-129.2	145.4	-176.1	-61.1	-160.2	173	0	0	111.2	G78 L82	G78-E80 VanDerWaalsContact C-N 3.34Å; E80-L82 PolarHBondContact O-N 3.1Å
81	K	82.3	Confident	85	Confident	202 Å²	202	111.9 Å²	111.9	88%	0.878	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-71.6	124.1	171.8	-66.9	-178	-178.9	177.4	0	108.3	P83	K81-P83 WeakPolarHBondContact O-CD 3.38Å
82	L	82.3	Confident	84.9	Confident	167 Å²	167	115 Å²	115	87%	0.874	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-59.8	121.5	168.9	-74.4	134.2	0	0	0	108.7	E80	E80-L82 PolarHBondContact O-N 3.1Å
83	P	83.5	Confident	84.6	Confident	90 Å²	90	116.5 Å²	116.5	58%	0.584	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-65.5	140.8	175.5	27.5	-33.3	0	0	0	109.5	K81 P85 F88	K81-P83 WeakPolarHBondContact O-CD 3.38Å; P83-P85 WeakPolarHBondContact O-CD 3.42Å; P83-F88 HydrophobicContact CB-CZ 3.87Å; P83-F88 HydrophobicContact CG-CZ 3.93Å
84	D	86.4	Confident	84.6	Confident	91 Å²	91	117.1 Å²	117.1	49%	0.487	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-72	118.4	174.6	-178.8	2.4	0	0	0	109.1	K86 T87	D84-K86 PolarHBondContact O-N 3.44Å; D84-K86 PolarHBondContact OD1-N 3.32Å; D84-T87 PolarHBondContact O-N 3.46Å
85	P	83.2	Confident	84.5	Confident	94 Å²	94	117.8 Å²	117.8	61%	0.61	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-59.8	-20.8	-176.6	24.1	-35.9	0	0	0	114	P83 T87 F88	P83-P85 WeakPolarHBondContact O-CD 3.42Å; P85-T87 VanDerWaalsContact C-N 3.28Å; P85-T87 PolarHBondContact O-N 3.2Å; P85-F88 HydrophobicContact CB-CD2 4.49Å; P85-F88 WeakPolarHBondContact O-CD2 3.39Å
86	K	85	Confident	84.2	Confident	186 Å²	186	125.2 Å²	125.2	81%	0.809	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-75.7	-15.2	178.4	-64.9	-177.1	-179.8	-178	0	114.2	D84 F88	D84-K86 PolarHBondContact O-N 3.44Å; D84-K86 PolarHBondContact OD1-N 3.32Å; K86-F88 VanDerWaalsContact C-N 3.35Å
87	T	84	Confident	84.3	Confident	106 Å²	106	124.6 Å²	124.6	65%	0.65	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-84	-16.2	-177.8	-51	0	0	0	0	111.8	D84 P85 T89	D84-T87 PolarHBondContact O-N 3.46Å; P85-T87 VanDerWaalsContact C-N 3.28Å; P85-T87 PolarHBondContact O-N 3.2Å; T87-T89 PolarHBondContact O-N 3.06Å
88	F	85.4	Confident	84.4	Confident	86 Å²	86	123.5 Å²	123.5	38%	0.377	67%	0.666	S	S	.	*	S	Bend	trans	-67	129.6	177.4	-62.8	-55.2	0	0	0	110.6	P83 P85 K86 L93	P83-F88 HydrophobicContact CB-CZ 3.87Å; P83-F88 HydrophobicContact CG-CZ 3.93Å; P85-F88 HydrophobicContact CB-CD2 4.49Å; P85-F88 WeakPolarHBondContact O-CD2 3.39Å; K86-F88 VanDerWaalsContact C-N 3.35Å; F88-L93 HydrophobicContact CB-CD1 3.92Å; F88-L93 HydrophobicContact CB-CD2 3.87Å; F88-L93 HydrophobicContact CB-CG 3.82Å; F88-L93 HydrophobicContact CD2-CD2 4.38Å; F88-L93 HydrophobicContact CG-CD2 4.27Å
89	T	85.5	Confident	84.5	Confident	76 Å²	76	128.1 Å²	128.1	47%	0.466	68%	0.679	S	S	.	*			trans	-79.4	147.5	176.5	62.7	0	0	0	0	110.4	T87 N91 E92 L93	T87-T89 PolarHBondContact O-N 3.06Å; T89-N91 PolarHBondContact O-N 3.14Å; T89-N91 VanDerWaalsContact O-N 3.07Å; T89-E92 WeakPolarHBondContact O-CB 3.4Å; T89-E92 PolarHBondContact O-N 3.15Å; T89-E92 WeakPolarHBondContact OG1-CG 3.43Å; T89-L93 PolarHBondContact O-N 3.29Å; T89-L93 VanDerWaalsContact O-N 3.1Å
90	D	87.3	Confident	84.4	Confident	109 Å²	109	127.2 Å²	127.2	58%	0.583	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-31.2	-178.7	-67.1	-27.2	0	0	0	112.8	L93 G94 V95	D90-L93 CarbonylContact O-C 3.6Å; D90-L93 PolarHBondContact O-N 3.14Å; D90-G94 PolarHBondContact O-N 3.32Å; D90-G94 VanDerWaalsContact O-N 3.08Å; D90-V95 HydrophobicContact CB-CB 4.17Å; D90-V95 PolarHBondContact O-N 3.2Å
91	N	85.8	Confident	84.6	Confident	149 Å²	149	124.2 Å²	124.2	80%	0.797	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-38.9	174.4	-172.9	31.6	0	0	0	113.2	T89 L93 G94	T89-N91 PolarHBondContact O-N 3.14Å; T89-N91 VanDerWaalsContact O-N 3.07Å; N91-L93 VanDerWaalsContact C-N 3.33Å; N91-G94 PolarHBondContact O-N 3.39Å
92	E	88.3	Confident	84.7	Confident	140 Å²	140	119 Å²	119	65%	0.654	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-31.4	174.5	-71.4	177	154.5	0	0	111.9	T89 G94	T89-E92 WeakPolarHBondContact O-CB 3.4Å; T89-E92 PolarHBondContact O-N 3.15Å; T89-E92 WeakPolarHBondContact OG1-CG 3.43Å; E92-G94 VanDerWaalsContact C-N 3.27Å; E92-G94 PolarHBondContact O-N 3.07Å
93	L	85.8	Confident	84.9	Confident	98 Å²	98	115.6 Å²	115.6	51%	0.513	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.9	-7.1	177	-65.2	174.9	0	0	0	113.3	F88 T89 D90 N91 V95	F88-L93 HydrophobicContact CB-CD1 3.92Å; F88-L93 HydrophobicContact CB-CD2 3.87Å; F88-L93 HydrophobicContact CB-CG 3.82Å; F88-L93 HydrophobicContact CD2-CD2 4.38Å; F88-L93 HydrophobicContact CG-CD2 4.27Å; T89-L93 PolarHBondContact O-N 3.29Å; T89-L93 VanDerWaalsContact O-N 3.1Å; D90-L93 CarbonylContact O-C 3.6Å; D90-L93 PolarHBondContact O-N 3.14Å; N91-L93 VanDerWaalsContact C-N 3.33Å; L93-V95 VanDerWaalsContact C-N 3.29Å; L93-V95 HydrophobicContact CB-CG2 3.97Å; L93-V95 PolarHBondContact O-N 3.34Å
94	G	86.8	Confident	85	Confident	64 Å²	64	117.5 Å²	117.5	66%	0.66	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.9	25.5	-177.3	0	0	0	0	0	113.7	D90 N91 E92	D90-G94 PolarHBondContact O-N 3.32Å; D90-G94 VanDerWaalsContact O-N 3.08Å; N91-G94 PolarHBondContact O-N 3.39Å; E92-G94 VanDerWaalsContact C-N 3.27Å; E92-G94 PolarHBondContact O-N 3.07Å
95	V	84.1	Confident	84.9	Confident	87 Å²	87	119.8 Å²	119.8	53%	0.527	66%	0.659	S	S	.	*			trans	-87.5	119.4	175.9	-176.8	0	0	0	0	108.2	D90 L93	D90-V95 HydrophobicContact CB-CB 4.17Å; D90-V95 PolarHBondContact O-N 3.2Å; L93-V95 VanDerWaalsContact C-N 3.29Å; L93-V95 HydrophobicContact CB-CG2 3.97Å; L93-V95 PolarHBondContact O-N 3.34Å
96	L	77.3	Confident	85	Confident	242 Å²	242	122.1 Å²	122.1	100%	1.267	66%	0.664	S	S	*	*			trans	-74.1	0	179.4	-69.8	170.6	0	0	0	113

Retrieved 96 of 96 residues in 94.9 ms (Link to these results)

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