G4VTQ0_SCHMA Loading...

SmKK7

AlphaFold DB , UniProt , Accession G4VTQ0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 79 aa.

						>G4VTQ0_SCHMA|G4VTQ0
MKLYFIFFLLVIYCGFYSEAKPGRVKCSAQCWETGIKCKNDCRNNACKRNCQDGVRDCIREVCKVSEHVDTYDEHKLHD
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47	Very low	51.4	Low	219 Å²	219	146.3 Å²	146.3	100%	1.079	70%	0.695	S	S	*	*				0	36.8	0	-61.4	180	178	0	0	113.2
2	K	49.8	Very low	51.3	Low	192 Å²	192	143 Å²	143	84%	0.835	68%	0.683	S	S	*	*			trans	-100.7	-21	-177.9	-101.2	168.7	167.7	168.9	0	114
3	L	52.6	Low	50.6	Low	131 Å²	131	145.5 Å²	145.5	69%	0.686	68%	0.684	S	S	*	*	H	α-helix	trans	-75	-35.7	-179.7	-91.7	103.3	0	0	0	113.9	F5 I6 F7	L3-F5 PolarHBondContact O-N 3.19Å; L3-I6 PolarHBondContact O-N 3.29Å; L3-F7 WeakPolarHBondContact O-CD2 3.47Å
4	Y	53.5	Low	50.4	Low	184 Å²	184	140.6 Å²	140.6	72%	0.722	67%	0.671	S	S	*	*	H	α-helix	trans	-64.8	-27.6	-178.5	-65.9	-74.2	0	0	0	113.6	I6 F7 F8	Y4-I6 VanDerWaalsContact C-N 3.33Å; Y4-I6 PolarHBondContact O-N 3.47Å; Y4-F7 PolarHBondContact O-N 3.26Å; Y4-F8 PolarHBondContact O-N 3.3Å
5	F	51.4	Low	50	Low	155 Å²	155	135.5 Å²	135.5	68%	0.68	67%	0.671	S	S	*	*	H	α-helix	trans	-68	-33.1	-179.5	-120.6	-88.3	0	0	0	112.6	L3 L9	L3-F5 PolarHBondContact O-N 3.19Å; F5-L9 WeakPolarHBondContact O-CG 3.48Å; F5-L9 PolarHBondContact O-N 3.41Å
6	I	55	Low	49.7	Very low	113 Å²	113	138.3 Å²	138.3	58%	0.579	68%	0.678	S	S	*	*	H	α-helix	trans	-73	-37.6	179.7	-58.2	169.2	0	0	0	110.3	L3 Y4 L9 L10	L3-I6 PolarHBondContact O-N 3.29Å; Y4-I6 VanDerWaalsContact C-N 3.33Å; Y4-I6 PolarHBondContact O-N 3.47Å; I6-L9 PolarHBondContact O-N 3.3Å; I6-L10 PolarHBondContact O-N 3.45Å
7	F	53.7	Low	49.1	Very low	140 Å²	140	140.9 Å²	140.9	61%	0.614	68%	0.68	S	S	*	*	H	α-helix	trans	-64.9	-40.1	175.3	-80.6	-80.9	0	0	0	112.3	L3 Y4 L9 L10 V11	L3-F7 WeakPolarHBondContact O-CD2 3.47Å; Y4-F7 PolarHBondContact O-N 3.26Å; F7-L9 PolarHBondContact O-N 3.29Å; F7-L10 PolarHBondContact O-N 3.36Å; F7-V11 WeakPolarHBondContact O-CG2 3.46Å; F7-V11 PolarHBondContact O-N 3.22Å
8	F	52.8	Low	48.8	Very low	147 Å²	147	136.1 Å²	136.1	65%	0.645	66%	0.664	S	S	*	*	H	α-helix	trans	-65.4	-38.1	178.4	-105.7	-89.2	0	0	0	113.1	Y4 V11 I12	Y4-F8 PolarHBondContact O-N 3.3Å; F8-V11 PolarHBondContact O-N 3.39Å; F8-I12 WeakPolarHBondContact O-CG1 3.43Å; F8-I12 PolarHBondContact O-N 3.34Å
9	L	50.4	Low	48.4	Very low	109 Å²	109	138.7 Å²	138.7	57%	0.571	68%	0.675	S	S	*	*	H	α-helix	trans	-68.8	-34.4	178.9	-70.7	171.8	0	0	0	112.5	F5 I6 F7 V11 I12 Y13	F5-L9 WeakPolarHBondContact O-CG 3.48Å; F5-L9 PolarHBondContact O-N 3.41Å; I6-L9 PolarHBondContact O-N 3.3Å; F7-L9 PolarHBondContact O-N 3.29Å; L9-V11 VanDerWaalsContact C-N 3.33Å; L9-I12 PolarHBondContact O-N 3.4Å; L9-Y13 WeakPolarHBondContact O-CB 3.42Å; L9-Y13 PolarHBondContact O-N 3Å
10	L	46.6	Very low	48.4	Very low	109 Å²	109	133.4 Å²	133.4	57%	0.571	65%	0.654	S	S	*	*	H	α-helix	trans	-64.4	-37.3	174.5	-111.7	152.3	0	0	0	112.2	I6 F7 C14	I6-L10 PolarHBondContact O-N 3.45Å; F7-L10 PolarHBondContact O-N 3.36Å; L10-C14 PolarHBondContact O-N 3.49Å
11	V	53.1	Low	48.6	Very low	110 Å²	110	133.4 Å²	133.4	67%	0.667	65%	0.651	S	S	*	*	H	α-helix	trans	-68	-38	176.8	175.4	0	0	0	0	111.5	F7 F8 L9	F7-V11 WeakPolarHBondContact O-CG2 3.46Å; F7-V11 PolarHBondContact O-N 3.22Å; F8-V11 PolarHBondContact O-N 3.39Å; L9-V11 VanDerWaalsContact C-N 3.33Å
12	I	49.9	Very low	48.8	Very low	107 Å²	107	129.4 Å²	129.4	55%	0.549	64%	0.641	S	S	.	*	H	α-helix	trans	-77.5	-39.5	-177.8	-62.9	171.5	0	0	0	111.6	F8 L9 C14 G15	F8-I12 WeakPolarHBondContact O-CG1 3.43Å; F8-I12 PolarHBondContact O-N 3.34Å; L9-I12 PolarHBondContact O-N 3.4Å; I12-C14 VanDerWaalsContact C-N 3.31Å; I12-C14 PolarHBondContact O-N 3.12Å; I12-G15 PolarHBondContact O-N 2.8Å; I12-G15 VanDerWaalsContact O-N 3.12Å
13	Y	42.2	Very low	49.2	Very low	176 Å²	176	124.5 Å²	124.5	69%	0.69	65%	0.645	S	S	*	*	H	α-helix	trans	-68.7	-29.5	-177.5	-163.9	-100	0	0	0	112.9	L9 G15	L9-Y13 WeakPolarHBondContact O-CB 3.42Å; L9-Y13 PolarHBondContact O-N 3Å; Y13-G15 VanDerWaalsContact C-N 3.29Å; Y13-G15 PolarHBondContact O-N 3.45Å
14	C	48.4	Very low	49.6	Very low	76 Å²	76	121.8 Å²	121.8	51%	0.514	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.5	-15.1	173.3	-75	0	0	0	0	114.2	L10 I12 F16	L10-C14 PolarHBondContact O-N 3.49Å; I12-C14 VanDerWaalsContact C-N 3.31Å; I12-C14 PolarHBondContact O-N 3.12Å; C14-F16 VanDerWaalsContact C-N 3.32Å; C14-F16 PolarHBondContact O-N 3.43Å
15	G	44.4	Very low	50.2	Low	64 Å²	64	116.9 Å²	116.9	66%	0.66	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-19.1	-173.5	0	0	0	0	0	115.5	I12 Y13	I12-G15 PolarHBondContact O-N 2.8Å; I12-G15 VanDerWaalsContact O-N 3.12Å; Y13-G15 VanDerWaalsContact C-N 3.29Å; Y13-G15 PolarHBondContact O-N 3.45Å
16	F	44.5	Very low	51.3	Low	181 Å²	181	117.4 Å²	117.4	79%	0.794	62%	0.617	S	S	*	*	S	Bend	trans	-109.9	-22	-167.6	-87.4	-88.2	0	0	0	116	C14	C14-F16 VanDerWaalsContact C-N 3.32Å; C14-F16 PolarHBondContact O-N 3.43Å
17	Y	39.2	Very low	52.4	Low	182 Å²	182	114.6 Å²	114.6	71%	0.714	61%	0.606	S	S	*	*	S	Bend	trans	-100.4	-5.7	-164.3	-96.5	-80.5	0	0	0	117	E19	Y17-E19 PolarHBondContact O-N 3.35Å; Y17-E19 VanDerWaalsContact O-N 3.16Å
18	S	44.2	Very low	53.7	Low	55 Å²	55	108 Å²	108	39%	0.385	58%	0.577	S	S	.	*			trans	-91.1	83.1	177.1	-52.8	0	0	0	0	109.2	A20	S18-A20 VanDerWaalsContact C-N 3.34Å; S18-A20 PolarHBondContact O-N 3.15Å
19	E	41	Very low	55.2	Low	186 Å²	186	101.9 Å²	101.9	87%	0.869	55%	0.554	S	S	*	*			trans	-46.8	106.7	154.8	-78.7	179.5	92.7	0	0	107.1	Y17 K21	Y17-E19 PolarHBondContact O-N 3.35Å; Y17-E19 VanDerWaalsContact O-N 3.16Å; E19-K21 PolarHBondContact O-N 2.83Å
20	A	48.4	Very low	56.7	Low	32 Å²	32	102.7 Å²	102.7	26%	0.264	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-62	128.2	-178.3	0	0	0	0	0	107.3	S18 R24 K26	S18-A20 VanDerWaalsContact C-N 3.34Å; S18-A20 PolarHBondContact O-N 3.15Å; A20-R24 HydrophobicContact CB-CB 4.34Å; A20-R24 WeakPolarHBondContact CB-O 3.1Å; A20-K26 HydrophobicContact CB-CG 3.98Å
21	K	52.2	Low	58.6	Low	134 Å²	134	97.7 Å²	97.7	58%	0.583	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-48.7	143.3	170.6	-76.2	-173.1	172.7	-174.6	0	108.8	E19 G23 R24	E19-K21 PolarHBondContact O-N 2.83Å; K21-G23 PolarHBondContact O-N 3.46Å; K21-R24 WeakPolarHBondContact O-CB 3.22Å; K21-R24 PolarHBondContact O-N 2.82Å
22	P	52.5	Low	60.1	Low	134 Å²	134	94 Å²	94	87%	0.87	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	133.1	177.8	18.6	-30.4	0	0	0	110.2
23	G	56.8	Low	61.8	Low	89 Å²	89	93.5 Å²	93.5	92%	0.918	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	87	-0.4	-174.4	0	0	0	0	0	115.9	K21	K21-G23 PolarHBondContact O-N 3.46Å
24	R	62	Low	63.8	Low	75 Å²	75	89.6 Å²	89.6	28%	0.283	49%	0.493	S	S	.	.			trans	-112.7	133.2	176.1	-60.9	-177.5	-179.7	-177.4	-4.9	111.2	A20 K21 W32	A20-R24 HydrophobicContact CB-CB 4.34Å; A20-R24 WeakPolarHBondContact CB-O 3.1Å; K21-R24 WeakPolarHBondContact O-CB 3.22Å; K21-R24 PolarHBondContact O-N 2.82Å; R24-W32 VanDerWaalsContact CD-CD1 3.49Å
25	V	66.4	Low	65.7	Low	80 Å²	80	86.4 Å²	86.4	49%	0.485	47%	0.473	S	S	.	.			trans	-73.9	138.7	171.2	-70.5	0	0	0	0	109.7	C27 S28	V25-C27 WeakPolarHBondContact CG2-SG 3.3Å; V25-C27 PolarHBondContact O-N 3.43Å; V25-C27 VanDerWaalsContact O-N 3.15Å; V25-S28 PolarHBondContact N-OG 3.11Å; V25-S28 WeakPolarHBondContact O-CB 3.44Å; V25-S28 PolarHBondContact O-N 2.99Å; V25-S28 PolarHBondContact O-OG 3.19Å
26	K	74.4	Confident	67.7	Low	167 Å²	167	86.6 Å²	86.6	73%	0.726	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-53.9	-38.9	-174.9	-75.2	-177.4	176.7	-177.2	0	113.5	A20 S28 A29	A20-K26 HydrophobicContact CB-CG 3.98Å; K26-S28 PolarHBondContact O-N 2.02Å; K26-A29 WeakPolarHBondContact O-CB 3.26Å; K26-A29 PolarHBondContact O-N 2.9Å
27	C	77.5	Confident	69.7	Low	54 Å²	54	84.4 Å²	84.4	37%	0.365	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-60.7	-23.2	176.2	57.2	0	0	0	0	113.5	V25 V62 C63	V25-C27 WeakPolarHBondContact CG2-SG 3.3Å; V25-C27 PolarHBondContact O-N 3.43Å; V25-C27 VanDerWaalsContact O-N 3.15Å; C27-V62 VanDerWaalsContact O-CG1 3.26Å; C27-V62 WeakPolarHBondContact O-CG1 3.42Å; C27-C63 HydrophobicContact CB-CB 3.93Å; C27-C63 WeakPolarHBondContact CB-SG 3.33Å; C27-C63 WeakPolarHBondContact SG-CB 3.31Å; C27-C63 CovalentContact SG-SG 2.02Å; C27-C63 PolarHBondContact SG-SG 3.29Å
28	S	81	Confident	71.9	Confident	1 Å²	1	78.3 Å²	78.3	1%	0.007	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-85.7	-6.7	-179.2	68.6	0	0	0	0	114.5	V25 K26 Q30 C31 W32 C63	V25-S28 PolarHBondContact N-OG 3.11Å; V25-S28 WeakPolarHBondContact O-CB 3.44Å; V25-S28 PolarHBondContact O-N 2.99Å; V25-S28 PolarHBondContact O-OG 3.19Å; K26-S28 PolarHBondContact O-N 2.02Å; S28-Q30 VanDerWaalsContact C-N 3.34Å; S28-Q30 PolarHBondContact O-N 2.87Å; S28-C31 WeakPolarHBondContact O-CB 3.02Å; S28-C31 PolarHBondContact O-N 3.02Å; S28-W32 PolarHBondContact O-N 3.32Å; S28-W32 VanDerWaalsContact OG-CD1 3.27Å; S28-W32 PolarHBondContact OG-NE1 3.16Å; S28-C63 PolarHBondContact N-SG 3.48Å; S28-C63 VanDerWaalsContact N-SG 3.43Å
29	A	83.2	Confident	74	Confident	19 Å²	19	80 Å²	80	16%	0.157	43%	0.432	C	S	.	.	H	α-helix	trans	-54.2	-48.1	-169.1	0	0	0	0	0	112.7	K26 C31 W32 E33	K26-A29 WeakPolarHBondContact O-CB 3.26Å; K26-A29 PolarHBondContact O-N 2.9Å; A29-C31 PolarHBondContact O-N 3.25Å; A29-W32 PolarHBondContact O-N 3.22Å; A29-E33 WeakPolarHBondContact O-CG 3.13Å; A29-E33 PolarHBondContact O-N 2.05Å
30	Q	83.9	Confident	76.2	Confident	126 Å²	126	77 Å²	77	59%	0.589	42%	0.422	S	S	*	.	H	α-helix	trans	-65.8	-35.4	178.5	-67.6	-176.5	-37.9	0	0	113.1	S28 W32 E33 T34	S28-Q30 VanDerWaalsContact C-N 3.34Å; S28-Q30 PolarHBondContact O-N 2.87Å; Q30-W32 VanDerWaalsContact C-N 3.35Å; Q30-E33 PolarHBondContact O-N 3.03Å; Q30-T34 WeakPolarHBondContact O-CB 3.32Å; Q30-T34 PolarHBondContact O-N 3.44Å; Q30-T34 PolarHBondContact O-OG1 3.45Å
31	C	84.8	Confident	78.3	Confident	3 Å²	3	81.9 Å²	81.9	2%	0.02	44%	0.444	C	S	.	.	H	α-helix	trans	-61.5	-47	175.7	-59.3	0	0	0	0	110.2	S28 A29 T34 G35 V55 C58 I59	S28-C31 WeakPolarHBondContact O-CB 3.02Å; S28-C31 PolarHBondContact O-N 3.02Å; A29-C31 PolarHBondContact O-N 3.25Å; C31-T34 PolarHBondContact O-N 3.05Å; C31-G35 PolarHBondContact O-N 3.49Å; C31-V55 HydrophobicContact CB-CG1 4.32Å; C31-C58 WeakPolarHBondContact CA-SG 3.41Å; C31-C58 HydrophobicContact CB-CB 3.64Å; C31-C58 WeakPolarHBondContact CB-SG 3.46Å; C31-C58 WeakPolarHBondContact SG-CB 3.37Å; C31-C58 PolarHBondContact SG-O 3.24Å; C31-C58 CovalentContact SG-SG 2.05Å; C31-C58 PolarHBondContact SG-SG 3.18Å; C31-I59 HydrophobicContact CB-CG1 3.83Å
32	W	84.8	Confident	80	Confident	32 Å²	32	76 Å²	76	12%	0.121	42%	0.419	C	S	.	.	H	α-helix	trans	-65.8	-40.9	177.6	-73.6	108	0	0	0	113.6	R24 S28 A29 Q30 T34 G35 I36 Q52 V55 I59	R24-W32 VanDerWaalsContact CD-CD1 3.49Å; S28-W32 PolarHBondContact O-N 3.32Å; S28-W32 VanDerWaalsContact OG-CD1 3.27Å; S28-W32 PolarHBondContact OG-NE1 3.16Å; A29-W32 PolarHBondContact O-N 3.22Å; Q30-W32 VanDerWaalsContact C-N 3.35Å; W32-T34 VanDerWaalsContact C-N 3.31Å; W32-T34 PolarHBondContact O-N 2.6Å; W32-G35 PolarHBondContact O-N 3.22Å; W32-I36 WeakPolarHBondContact O-CD1 2.93Å; W32-I36 VanDerWaalsContact O-CG1 3.23Å; W32-I36 WeakPolarHBondContact O-CG1 3.49Å; W32-I36 PolarHBondContact O-N 3.18Å; W32-Q52 VanDerWaalsContact CH2-NE2 3.27Å; W32-V55 HydrophobicContact CD2-CG1 3.74Å; W32-V55 HydrophobicContact CE3-CG1 3.76Å; W32-V55 HydrophobicContact CG-CG1 4.3Å; W32-V55 HydrophobicContact CH2-CG1 4.24Å; W32-V55 HydrophobicContact CZ2-CG1 4.21Å; W32-V55 HydrophobicContact CZ3-CG1 4.02Å; W32-I59 HydrophobicContact CZ2-CD1 4.17Å
33	E	85.7	Confident	81.9	Confident	98 Å²	98	81.5 Å²	81.5	46%	0.458	42%	0.423	S	S	.	.	H	α-helix	trans	-59.7	-44.2	176	-75.2	177	-164.3	0	0	111.6	A29 Q30 I36 K37	A29-E33 WeakPolarHBondContact O-CG 3.13Å; A29-E33 PolarHBondContact O-N 2.05Å; Q30-E33 PolarHBondContact O-N 3.03Å; E33-I36 PolarHBondContact O-N 3.3Å; E33-K37 WeakPolarHBondContact O-CG 3.03Å; E33-K37 PolarHBondContact O-N 3.45Å; E33-K37 VanDerWaalsContact O-N 3.13Å
34	T	85.6	Confident	83.5	Confident	94 Å²	94	81.5 Å²	81.5	58%	0.577	40%	0.402	S	S	*	.	H	α-helix	trans	-64.3	-43.7	176.1	-55.3	0	0	0	0	111.1	Q30 C31 W32 I36 K37 C38	Q30-T34 WeakPolarHBondContact O-CB 3.32Å; Q30-T34 PolarHBondContact O-N 3.44Å; Q30-T34 PolarHBondContact O-OG1 3.45Å; C31-T34 PolarHBondContact O-N 3.05Å; W32-T34 VanDerWaalsContact C-N 3.31Å; W32-T34 PolarHBondContact O-N 2.6Å; T34-I36 PolarHBondContact O-N 3.28Å; T34-K37 PolarHBondContact O-N 3.29Å; T34-C38 WeakPolarHBondContact O-CB 3.44Å; T34-C38 PolarHBondContact O-N 2.98Å
35	G	87.6	Confident	84.7	Confident	9 Å²	9	83.4 Å²	83.4	9%	0.093	42%	0.418	C	S	.	.	H	α-helix	trans	-61	-41	176.2	0	0	0	0	0	113.9	C31 W32 C38 K39 V55	C31-G35 PolarHBondContact O-N 3.49Å; W32-G35 PolarHBondContact O-N 3.22Å; G35-C38 PolarHBondContact O-N 3.22Å; G35-K39 WeakPolarHBondContact O-CB 3.44Å; G35-K39 PolarHBondContact O-N 3.38Å; G35-V55 VanDerWaalsContact CA-CG2 3.4Å
36	I	85.1	Confident	85.8	Confident	67 Å²	67	82.1 Å²	82.1	34%	0.344	42%	0.415	S	S	.	.	H	α-helix	trans	-63.9	-45.3	176.6	-70.1	162.7	0	0	0	110.4	W32 E33 T34 K39 N40	W32-I36 WeakPolarHBondContact O-CD1 2.93Å; W32-I36 VanDerWaalsContact O-CG1 3.23Å; W32-I36 WeakPolarHBondContact O-CG1 3.49Å; W32-I36 PolarHBondContact O-N 3.18Å; E33-I36 PolarHBondContact O-N 3.3Å; T34-I36 PolarHBondContact O-N 3.28Å; I36-K39 PolarHBondContact O-N 2.84Å; I36-N40 PolarHBondContact O-N 2.97Å; I36-N40 PolarHBondContact O-ND2 3.33Å
37	K	87.1	Confident	86.4	Confident	136 Å²	136	76.3 Å²	76.3	59%	0.591	40%	0.395	S	S	*	.	H	α-helix	trans	-58.9	-50.5	175.8	-71.4	174.5	-177.7	174.8	0	111	E33 T34 K39 N40 D41	E33-K37 WeakPolarHBondContact O-CG 3.03Å; E33-K37 PolarHBondContact O-N 3.45Å; E33-K37 VanDerWaalsContact O-N 3.13Å; T34-K37 PolarHBondContact O-N 3.29Å; K37-K39 VanDerWaalsContact C-N 3.31Å; K37-K39 PolarHBondContact O-N 3.4Å; K37-N40 WeakPolarHBondContact O-CB 3.07Å; K37-N40 PolarHBondContact O-N 2.95Å; K37-N40 VanDerWaalsContact O-N 3.11Å; K37-D41 PolarHBondContact O-N 3.4Å; K37-D41 VanDerWaalsContact O-N 3.15Å
38	C	86.4	Confident	86.8	Confident	53 Å²	53	77.2 Å²	77.2	36%	0.358	39%	0.393	S	S	.	.	H	α-helix	trans	-54	-47.5	175.7	-177	0	0	0	0	111.7	T34 G35 N40 D41 C42 C51	T34-C38 WeakPolarHBondContact O-CB 3.44Å; T34-C38 PolarHBondContact O-N 2.98Å; G35-C38 PolarHBondContact O-N 3.22Å; C38-N40 VanDerWaalsContact C-N 3.32Å; C38-N40 PolarHBondContact O-N 3.47Å; C38-D41 PolarHBondContact O-N 3.13Å; C38-C42 PolarHBondContact O-N 3.01Å; C38-C42 PolarHBondContact O-SG 3.29Å; C38-C51 HydrophobicContact CB-CB 3.66Å; C38-C51 WeakPolarHBondContact CB-SG 3.49Å; C38-C51 PolarHBondContact O-SG 2.84Å; C38-C51 VanDerWaalsContact SG-CA 3.59Å; C38-C51 WeakPolarHBondContact SG-CB 3.47Å; C38-C51 CovalentContact SG-SG 2.03Å; C38-C51 PolarHBondContact SG-SG 2.87Å
39	K	86.8	Confident	87	Confident	90 Å²	90	82.4 Å²	82.4	39%	0.391	41%	0.412	S	S	.	.	H	α-helix	trans	-64	-34.9	-180	-170.4	-178.9	179.4	178.9	0	112.9	G35 I36 K37 D41 C42 K48	G35-K39 WeakPolarHBondContact O-CB 3.44Å; G35-K39 PolarHBondContact O-N 3.38Å; I36-K39 PolarHBondContact O-N 2.84Å; K37-K39 VanDerWaalsContact C-N 3.31Å; K37-K39 PolarHBondContact O-N 3.4Å; K39-D41 VanDerWaalsContact C-N 3.34Å; K39-C42 PolarHBondContact O-N 2.88Å; K39-K48 HydrophobicContact CG-CB 4.28Å; K39-K48 HydrophobicContact CG-CD 4.26Å; K39-K48 HydrophobicContact CG-CG 3.92Å
40	N	88.3	Confident	87.2	Confident	124 Å²	124	86.8 Å²	86.8	66%	0.663	43%	0.433	S	S	*	.	H	α-helix	trans	-69.1	-33	177.5	-71.1	-17.4	0	0	0	112	I36 K37 C38 C42	I36-N40 PolarHBondContact O-N 2.97Å; I36-N40 PolarHBondContact O-ND2 3.33Å; K37-N40 WeakPolarHBondContact O-CB 3.07Å; K37-N40 PolarHBondContact O-N 2.95Å; K37-N40 VanDerWaalsContact O-N 3.11Å; C38-N40 VanDerWaalsContact C-N 3.32Å; C38-N40 PolarHBondContact O-N 3.47Å; N40-C42 VanDerWaalsContact C-N 3.3Å
41	D	91.7	Very high	87.3	Confident	134 Å²	134	81.2 Å²	81.2	72%	0.717	41%	0.408	S	S	*	.	H	α-helix	trans	-80.2	-14	177.6	-63.4	-29.5	0	0	0	112.8	K37 C38 K39 R43	K37-D41 PolarHBondContact O-N 3.4Å; K37-D41 VanDerWaalsContact O-N 3.15Å; C38-D41 PolarHBondContact O-N 3.13Å; K39-D41 VanDerWaalsContact C-N 3.34Å; D41-R43 PolarHBondContact O-N 3.43Å
42	C	88.9	Confident	87.3	Confident	10 Å²	10	82.3 Å²	82.3	7%	0.068	41%	0.413	C	S	.	.			trans	-77.1	120.8	-178.2	-74.3	0	0	0	0	114	C38 K39 N40 C47 K48 C51	C38-C42 PolarHBondContact O-N 3.01Å; C38-C42 PolarHBondContact O-SG 3.29Å; K39-C42 PolarHBondContact O-N 2.88Å; N40-C42 VanDerWaalsContact C-N 3.3Å; C42-C47 WeakPolarHBondContact CA-SG 3.21Å; C42-C47 HydrophobicContact CB-CB 3.58Å; C42-C47 WeakPolarHBondContact CB-SG 3.33Å; C42-C47 WeakPolarHBondContact SG-CB 3.22Å; C42-C47 PolarHBondContact SG-O 3.29Å; C42-C47 CovalentContact SG-SG 2.03Å; C42-C47 PolarHBondContact SG-SG 3.18Å; C42-K48 HydrophobicContact CB-CG 3.57Å; C42-K48 PolarHBondContact SG-N 2.93Å; C42-C51 PolarHBondContact SG-SG 3.36Å
43	R	91.4	Very high	87.3	Confident	250 Å²	250	83.2 Å²	83.2	94%	0.943	42%	0.42	S	S	*	.	S	Bend	trans	-82.1	-14.7	173.5	-63.2	-173.5	179.2	-172.1	-0.3	115	D41	D41-R43 PolarHBondContact O-N 3.43Å
44	N	90.9	Very high	87.4	Confident	90 Å²	90	80.4 Å²	80.4	48%	0.481	42%	0.417	S	S	.	.	S	Bend	trans	-137.5	162.7	-176.1	67.5	42.7	0	0	0	112.4	A46 C47 K48	N44-A46 VanDerWaalsContact C-N 3.33Å; N44-A46 PolarHBondContact O-N 3.28Å; N44-A46 PolarHBondContact OD1-N 2.89Å; N44-C47 PolarHBondContact O-N 3.39Å; N44-C47 WeakPolarHBondContact OD1-CB 3.08Å; N44-C47 PolarHBondContact OD1-N 2.94Å; N44-K48 WeakPolarHBondContact O-CG 3.38Å; N44-K48 PolarHBondContact O-N 3Å
45	N	88.3	Confident	87.4	Confident	115 Å²	115	76.1 Å²	76.1	62%	0.615	39%	0.391	S	S	*	.	H	α-helix	trans	-69.2	-28.8	-176.5	-69	-18.5	0	0	0	113.2	K48 R49	N45-K48 PolarHBondContact O-N 3.34Å; N45-R49 PolarHBondContact O-N 2.71Å
46	A	88.5	Confident	87.3	Confident	52 Å²	52	78 Å²	78	43%	0.43	40%	0.395	S	S	.	.	H	α-helix	trans	-63.3	-47.2	175.9	0	0	0	0	0	111.1	N44 K48 R49 N50	N44-A46 VanDerWaalsContact C-N 3.33Å; N44-A46 PolarHBondContact O-N 3.28Å; N44-A46 PolarHBondContact OD1-N 2.89Å; A46-K48 PolarHBondContact O-N 3.41Å; A46-R49 PolarHBondContact O-N 3.05Å; A46-N50 PolarHBondContact O-N 2.86Å; A46-N50 PolarHBondContact O-OD1 3.11Å
47	C	86.1	Confident	87.3	Confident	45 Å²	45	78.2 Å²	78.2	30%	0.304	40%	0.397	S	S	.	.	H	α-helix	trans	-58.8	-46.6	174	-179.9	0	0	0	0	111.2	C42 N44 R49 N50 C51	C42-C47 WeakPolarHBondContact CA-SG 3.21Å; C42-C47 HydrophobicContact CB-CB 3.58Å; C42-C47 WeakPolarHBondContact CB-SG 3.33Å; C42-C47 WeakPolarHBondContact SG-CB 3.22Å; C42-C47 PolarHBondContact SG-O 3.29Å; C42-C47 CovalentContact SG-SG 2.03Å; C42-C47 PolarHBondContact SG-SG 3.18Å; N44-C47 PolarHBondContact O-N 3.39Å; N44-C47 WeakPolarHBondContact OD1-CB 3.08Å; N44-C47 PolarHBondContact OD1-N 2.94Å; C47-R49 VanDerWaalsContact C-N 3.29Å; C47-R49 PolarHBondContact O-N 3.44Å; C47-N50 PolarHBondContact O-N 3.36Å; C47-C51 PolarHBondContact O-N 2.69Å; C47-C51 PolarHBondContact O-SG 2.94Å
48	K	87.1	Confident	87.2	Confident	74 Å²	74	73.5 Å²	73.5	32%	0.322	38%	0.381	S	S	.	.	H	α-helix	trans	-60.1	-37.7	179	-67.5	-179.8	179.5	175.3	0	112.8	K39 C42 N44 N45 A46 Q52	K39-K48 HydrophobicContact CG-CB 4.28Å; K39-K48 HydrophobicContact CG-CD 4.26Å; K39-K48 HydrophobicContact CG-CG 3.92Å; C42-K48 HydrophobicContact CB-CG 3.57Å; C42-K48 PolarHBondContact SG-N 2.93Å; N44-K48 WeakPolarHBondContact O-CG 3.38Å; N44-K48 PolarHBondContact O-N 3Å; N45-K48 PolarHBondContact O-N 3.34Å; A46-K48 PolarHBondContact O-N 3.41Å; K48-Q52 PolarHBondContact O-N 3.44Å
49	R	85.2	Confident	87.1	Confident	109 Å²	109	71.3 Å²	71.3	41%	0.411	37%	0.366	S	S	.	.	H	α-helix	trans	-65.5	-48.6	174.2	-79.9	-172.2	-79.1	-144.4	2.7	111.7	N45 A46 C47 C51 Q52 D53 Y72	N45-R49 PolarHBondContact O-N 2.71Å; A46-R49 PolarHBondContact O-N 3.05Å; C47-R49 VanDerWaalsContact C-N 3.29Å; C47-R49 PolarHBondContact O-N 3.44Å; R49-C51 PolarHBondContact O-N 3.3Å; R49-Q52 WeakPolarHBondContact O-CA 3.23Å; R49-Q52 WeakPolarHBondContact O-CB 3.47Å; R49-Q52 PolarHBondContact O-N 3.11Å; R49-D53 PolarHBondContact O-N 3.15Å; R49-Y72 HydrophobicContact CG-CD1 3.78Å; R49-Y72 HydrophobicContact CG-CE1 4.4Å; R49-Y72 HydrophobicContact CG-CG 4.28Å
50	N	86.9	Confident	86.9	Confident	112 Å²	112	71.7 Å²	71.7	60%	0.599	37%	0.365	S	S	*	.	H	α-helix	trans	-58.6	-36.9	177	-67.8	-1	0	0	0	112.5	A46 C47 Q52 D53 G54	A46-N50 PolarHBondContact O-N 2.86Å; A46-N50 PolarHBondContact O-OD1 3.11Å; C47-N50 PolarHBondContact O-N 3.36Å; N50-Q52 VanDerWaalsContact C-N 3.31Å; N50-Q52 PolarHBondContact O-N 3.32Å; N50-D53 PolarHBondContact O-N 3.31Å; N50-G54 PolarHBondContact O-N 2.97Å
51	C	86.8	Confident	86.8	Confident	8 Å²	8	72.1 Å²	72.1	5%	0.054	36%	0.363	C	S	.	.	H	α-helix	trans	-60.7	-41.1	173.6	-63.7	0	0	0	0	112.1	C38 C42 C47 R49 G54 V55	C38-C51 HydrophobicContact CB-CB 3.66Å; C38-C51 WeakPolarHBondContact CB-SG 3.49Å; C38-C51 PolarHBondContact O-SG 2.84Å; C38-C51 VanDerWaalsContact SG-CA 3.59Å; C38-C51 WeakPolarHBondContact SG-CB 3.47Å; C38-C51 CovalentContact SG-SG 2.03Å; C38-C51 PolarHBondContact SG-SG 2.87Å; C42-C51 PolarHBondContact SG-SG 3.36Å; C47-C51 PolarHBondContact O-N 2.69Å; C47-C51 PolarHBondContact O-SG 2.94Å; R49-C51 PolarHBondContact O-N 3.3Å; C51-G54 PolarHBondContact O-N 3.29Å; C51-V55 WeakPolarHBondContact O-CG2 3.34Å; C51-V55 PolarHBondContact O-N 2.03Å
52	Q	84.4	Confident	86.4	Confident	27 Å²	27	69.3 Å²	69.3	13%	0.126	35%	0.35	C	S	.	.	H	α-helix	trans	-70.5	-38.8	178.8	-172.9	63.9	30.1	0	0	111.9	W32 K48 R49 N50 G54 V55 R56 Y72	W32-Q52 VanDerWaalsContact CH2-NE2 3.27Å; K48-Q52 PolarHBondContact O-N 3.44Å; R49-Q52 WeakPolarHBondContact O-CA 3.23Å; R49-Q52 WeakPolarHBondContact O-CB 3.47Å; R49-Q52 PolarHBondContact O-N 3.11Å; N50-Q52 VanDerWaalsContact C-N 3.31Å; N50-Q52 PolarHBondContact O-N 3.32Å; Q52-G54 VanDerWaalsContact C-N 3.28Å; Q52-G54 PolarHBondContact O-N 3.46Å; Q52-V55 WeakPolarHBondContact O-CB 3.39Å; Q52-V55 PolarHBondContact O-N 3.27Å; Q52-V55 VanDerWaalsContact O-N 3.11Å; Q52-R56 PolarHBondContact O-N 3.24Å; Q52-Y72 HydrophobicContact CG-CD2 4.38Å; Q52-Y72 HydrophobicContact CG-CG 4.5Å
53	D	85.6	Confident	86	Confident	50 Å²	50	69.9 Å²	69.9	27%	0.267	35%	0.354	S	S	.	.	H	α-helix	trans	-62.4	-38.8	173	-68.8	-33.3	0	0	0	111.2	R49 N50 V55 R56 D57	R49-D53 PolarHBondContact O-N 3.15Å; N50-D53 PolarHBondContact O-N 3.31Å; D53-V55 VanDerWaalsContact C-N 3.31Å; D53-V55 PolarHBondContact O-N 3.46Å; D53-R56 WeakPolarHBondContact O-CB 3.42Å; D53-R56 PolarHBondContact O-N 3.41Å; D53-R56 IonicContact OD1-NH1 3.99Å; D53-D57 PolarHBondContact O-N 2.88Å
54	G	86.3	Confident	85.5	Confident	40 Å²	40	65.6 Å²	65.6	41%	0.412	34%	0.342	S	S	.	.	H	α-helix	trans	-61.5	-36.2	171.9	0	0	0	0	0	113.3	N50 C51 Q52 C58	N50-G54 PolarHBondContact O-N 2.97Å; C51-G54 PolarHBondContact O-N 3.29Å; Q52-G54 VanDerWaalsContact C-N 3.28Å; Q52-G54 PolarHBondContact O-N 3.46Å; G54-C58 VanDerWaalsContact O-CB 3.22Å; G54-C58 WeakPolarHBondContact O-CB 3.37Å; G54-C58 PolarHBondContact O-N 2.94Å
55	V	86.7	Confident	84.8	Confident	3 Å²	3	63.6 Å²	63.6	2%	0.018	33%	0.333	C	S	.	.	H	α-helix	trans	-63	-48.8	172.1	174.2	0	0	0	0	110.2	C31 W32 G35 C51 Q52 D53 D57 C58 I59	C31-V55 HydrophobicContact CB-CG1 4.32Å; W32-V55 HydrophobicContact CD2-CG1 3.74Å; W32-V55 HydrophobicContact CE3-CG1 3.76Å; W32-V55 HydrophobicContact CG-CG1 4.3Å; W32-V55 HydrophobicContact CH2-CG1 4.24Å; W32-V55 HydrophobicContact CZ2-CG1 4.21Å; W32-V55 HydrophobicContact CZ3-CG1 4.02Å; G35-V55 VanDerWaalsContact CA-CG2 3.4Å; C51-V55 WeakPolarHBondContact O-CG2 3.34Å; C51-V55 PolarHBondContact O-N 2.03Å; Q52-V55 WeakPolarHBondContact O-CB 3.39Å; Q52-V55 PolarHBondContact O-N 3.27Å; Q52-V55 VanDerWaalsContact O-N 3.11Å; D53-V55 VanDerWaalsContact C-N 3.31Å; D53-V55 PolarHBondContact O-N 3.46Å; V55-D57 VanDerWaalsContact C-N 3.32Å; V55-D57 PolarHBondContact O-N 3.4Å; V55-C58 PolarHBondContact O-N 3.31Å; V55-I59 HydrophobicContact CG1-CD1 3.67Å; V55-I59 HydrophobicContact CG1-CG1 4.26Å; V55-I59 WeakPolarHBondContact O-CG1 3.44Å; V55-I59 PolarHBondContact O-N 3.04Å
56	R	84.2	Confident	84	Confident	48 Å²	48	64.2 Å²	64.2	18%	0.181	35%	0.346	C	S	.	.	H	α-helix	trans	-55.4	-48.6	178.9	-177.9	-159	67.4	-152.8	-8.2	111.4	Q52 D53 I59 R60 V69	Q52-R56 PolarHBondContact O-N 3.24Å; D53-R56 WeakPolarHBondContact O-CB 3.42Å; D53-R56 PolarHBondContact O-N 3.41Å; D53-R56 IonicContact OD1-NH1 3.99Å; R56-I59 PolarHBondContact O-N 3.35Å; R56-R60 PolarHBondContact O-N 3.44Å; R56-V69 HydrophobicContact CB-CG1 4.33Å; R56-V69 HydrophobicContact CG-CB 3.82Å; R56-V69 HydrophobicContact CG-CG1 3.94Å; R56-V69 WeakPolarHBondContact CG-O 3.4Å
57	D	85.9	Confident	82.9	Confident	72 Å²	72	68.7 Å²	68.7	39%	0.385	36%	0.359	S	S	.	.	H	α-helix	trans	-68.6	-40.8	-177.2	-65.2	-17.1	0	0	0	111.4	D53 V55 I59 R60 E61	D53-D57 PolarHBondContact O-N 2.88Å; V55-D57 VanDerWaalsContact C-N 3.32Å; V55-D57 PolarHBondContact O-N 3.4Å; D57-I59 VanDerWaalsContact C-N 3.31Å; D57-I59 PolarHBondContact O-N 2.97Å; D57-R60 PolarHBondContact O-N 3.45Å; D57-R60 IonicContact OD1-NH1 2.86Å; D57-E61 PolarHBondContact O-N 2.97Å
58	C	84.7	Confident	82.4	Confident	38 Å²	38	71.4 Å²	71.4	26%	0.257	37%	0.367	S	S	.	.	H	α-helix	trans	-58	-42.7	170.8	177.4	0	0	0	0	111.7	C31 G54 V55 E61 V62	C31-C58 WeakPolarHBondContact CA-SG 3.41Å; C31-C58 HydrophobicContact CB-CB 3.64Å; C31-C58 WeakPolarHBondContact CB-SG 3.46Å; C31-C58 WeakPolarHBondContact SG-CB 3.37Å; C31-C58 PolarHBondContact SG-O 3.24Å; C31-C58 CovalentContact SG-SG 2.05Å; C31-C58 PolarHBondContact SG-SG 3.18Å; G54-C58 VanDerWaalsContact O-CB 3.22Å; G54-C58 WeakPolarHBondContact O-CB 3.37Å; G54-C58 PolarHBondContact O-N 2.94Å; V55-C58 PolarHBondContact O-N 3.31Å; C58-E61 PolarHBondContact O-N 2.95Å; C58-V62 VanDerWaalsContact O-CB 3.32Å; C58-V62 WeakPolarHBondContact O-CB 3.49Å; C58-V62 VanDerWaalsContact O-CG2 3.31Å; C58-V62 WeakPolarHBondContact O-CG2 3.06Å; C58-V62 PolarHBondContact O-N 3.03Å
59	I	84.7	Confident	81.6	Confident	7 Å²	7	69 Å²	69	4%	0.036	36%	0.358	C	S	.	.	H	α-helix	trans	-64	-46.5	178.5	-69.3	172.9	0	0	0	110.6	C31 W32 V55 R56 D57 E61 V62 C63 V65 V69	C31-I59 HydrophobicContact CB-CG1 3.83Å; W32-I59 HydrophobicContact CZ2-CD1 4.17Å; V55-I59 HydrophobicContact CG1-CD1 3.67Å; V55-I59 HydrophobicContact CG1-CG1 4.26Å; V55-I59 WeakPolarHBondContact O-CG1 3.44Å; V55-I59 PolarHBondContact O-N 3.04Å; R56-I59 PolarHBondContact O-N 3.35Å; D57-I59 VanDerWaalsContact C-N 3.31Å; D57-I59 PolarHBondContact O-N 2.97Å; I59-E61 PolarHBondContact O-N 3.4Å; I59-V62 PolarHBondContact O-N 3.27Å; I59-C63 HydrophobicContact CG2-CB 4.26Å; I59-C63 WeakPolarHBondContact O-CA 3.05Å; I59-C63 WeakPolarHBondContact O-CB 3.32Å; I59-C63 PolarHBondContact O-N 3.34Å; I59-V65 HydrophobicContact CG2-CG2 4.03Å; I59-V69 HydrophobicContact CB-CG1 4.38Å; I59-V69 HydrophobicContact CD1-CG1 4.08Å; I59-V69 HydrophobicContact CG2-CG1 4.23Å; I59-V69 HydrophobicContact CG2-CG2 3.8Å
60	R	83.4	Confident	80.8	Confident	97 Å²	97	66.7 Å²	66.7	37%	0.366	35%	0.354	S	S	.	.	H	α-helix	trans	-56.6	-42.4	176.3	-74.3	178.1	172	162.7	-1.9	111.4	R56 D57 K64 V65 V69	R56-R60 PolarHBondContact O-N 3.44Å; D57-R60 PolarHBondContact O-N 3.45Å; D57-R60 IonicContact OD1-NH1 2.86Å; R60-K64 VanDerWaalsContact O-CA 3.3Å; R60-K64 WeakPolarHBondContact O-CA 3.47Å; R60-K64 PolarHBondContact O-N 3.45Å; R60-V65 HydrophobicContact CG-CG2 4.5Å; R60-V69 HydrophobicContact CG-CG2 4.41Å
61	E	85.3	Confident	79.8	Confident	133 Å²	133	62.6 Å²	62.6	62%	0.621	33%	0.333	S	S	*	.	H	α-helix	trans	-72.6	-47.7	-179.2	-171.5	179	174.2	0	0	113.3	D57 C58 I59 K64	D57-E61 PolarHBondContact O-N 2.97Å; C58-E61 PolarHBondContact O-N 2.95Å; I59-E61 PolarHBondContact O-N 3.4Å; E61-K64 VanDerWaalsContact O-CD 3.22Å; E61-K64 WeakPolarHBondContact O-CD 3.42Å; E61-K64 WeakPolarHBondContact O-CE 3.34Å; E61-K64 PolarHBondContact O-NZ 3.21Å
62	V	84	Confident	78.8	Confident	75 Å²	75	66.1 Å²	66.1	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-79.7	-43.8	-173.1	174.5	0	0	0	0	111.5	C27 C58 I59 K64	C27-V62 VanDerWaalsContact O-CG1 3.26Å; C27-V62 WeakPolarHBondContact O-CG1 3.42Å; C58-V62 VanDerWaalsContact O-CB 3.32Å; C58-V62 WeakPolarHBondContact O-CB 3.49Å; C58-V62 VanDerWaalsContact O-CG2 3.31Å; C58-V62 WeakPolarHBondContact O-CG2 3.06Å; C58-V62 PolarHBondContact O-N 3.03Å; I59-V62 PolarHBondContact O-N 3.27Å; V62-K64 VanDerWaalsContact C-N 3.32Å
63	C	80.5	Confident	77.8	Confident	23 Å²	23	69 Å²	69	16%	0.155	36%	0.362	C	S	.	.	H	α-helix	trans	-82.3	-11.2	179.3	-63.2	0	0	0	0	113.2	C27 S28 I59 V65	C27-C63 HydrophobicContact CB-CB 3.93Å; C27-C63 WeakPolarHBondContact CB-SG 3.33Å; C27-C63 WeakPolarHBondContact SG-CB 3.31Å; C27-C63 CovalentContact SG-SG 2.02Å; C27-C63 PolarHBondContact SG-SG 3.29Å; S28-C63 PolarHBondContact N-SG 3.48Å; S28-C63 VanDerWaalsContact N-SG 3.43Å; I59-C63 HydrophobicContact CG2-CB 4.26Å; I59-C63 WeakPolarHBondContact O-CA 3.05Å; I59-C63 WeakPolarHBondContact O-CB 3.32Å; I59-C63 PolarHBondContact O-N 3.34Å; C63-V65 HydrophobicContact CB-CG1 3.77Å; C63-V65 HydrophobicContact CB-CG2 4.23Å; C63-V65 PolarHBondContact O-N 3.37Å; C63-V65 VanDerWaalsContact O-N 3.11Å
64	K	80.7	Confident	77	Confident	160 Å²	160	69.5 Å²	69.5	70%	0.696	36%	0.363	S	S	*	.			trans	50.8	33.2	-174.2	-57.1	-62.5	-179.4	-153.8	0	112.5	R60 E61 V62	R60-K64 VanDerWaalsContact O-CA 3.3Å; R60-K64 WeakPolarHBondContact O-CA 3.47Å; R60-K64 PolarHBondContact O-N 3.45Å; E61-K64 VanDerWaalsContact O-CD 3.22Å; E61-K64 WeakPolarHBondContact O-CD 3.42Å; E61-K64 WeakPolarHBondContact O-CE 3.34Å; E61-K64 PolarHBondContact O-NZ 3.21Å; V62-K64 VanDerWaalsContact C-N 3.32Å
65	V	75.8	Confident	76.1	Confident	48 Å²	48	71.6 Å²	71.6	29%	0.291	36%	0.361	S	S	.	.			trans	-76	127.5	177.7	-70.5	0	0	0	0	109.2	I59 R60 C63 E67 V69	I59-V65 HydrophobicContact CG2-CG2 4.03Å; R60-V65 HydrophobicContact CG-CG2 4.5Å; C63-V65 HydrophobicContact CB-CG1 3.77Å; C63-V65 HydrophobicContact CB-CG2 4.23Å; C63-V65 PolarHBondContact O-N 3.37Å; C63-V65 VanDerWaalsContact O-N 3.11Å; V65-E67 VanDerWaalsContact C-N 3.31Å; V65-V69 HydrophobicContact CG2-CG2 3.79Å
66	S	70.7	Confident	75.2	Confident	127 Å²	127	77.8 Å²	77.8	89%	0.888	39%	0.388	S	S	*	.			trans	-82.2	-16.9	167.8	55.1	0	0	0	0	112.2
67	E	66.8	Low	74.4	Confident	147 Å²	147	82.3 Å²	82.3	69%	0.687	42%	0.415	S	S	*	.	S	Bend	trans	-72.6	158.3	-178.8	-62.8	-176.1	157	0	0	111.5	V65	V65-E67 VanDerWaalsContact C-N 3.31Å
68	H	73.9	Confident	73	Confident	102 Å²	102	85.9 Å²	85.9	47%	0.472	43%	0.429	S	S	.	.			trans	-63.1	138.7	175	-173.7	62.3	0	0	0	110.3	D70 E74	H68-D70 IonicContact CD2-OD1 2.84Å; H68-D70 PolarHBondContact CD2-OD1 2.03Å; H68-D70 VanDerWaalsContact CD2-OD1 3.3Å; H68-D70 IonicContact NE2-OD1 3.3Å; H68-E74 IonicContact CD2-OE1 3.97Å; H68-E74 IonicContact CE1-OE1 3.93Å; H68-E74 PolarHBondContact CE1-OE1 3.27Å; H68-E74 IonicContact CE1-OE2 3.63Å; H68-E74 PolarHBondContact CE1-OE2 3.02Å; H68-E74 IonicContact NE2-OE1 3.36Å; H68-E74 PolarHBondContact NE2-OE1 3.46Å; H68-E74 IonicContact NE2-OE2 3.36Å; H68-E74 PolarHBondContact NE2-OE2 3.38Å
69	V	70.5	Confident	71.4	Confident	24 Å²	24	93.1 Å²	93.1	15%	0.145	47%	0.465	C	S	.	.			trans	-118.6	117.1	172.8	176.9	0	0	0	0	104.9	R56 I59 R60 V65 T71	R56-V69 HydrophobicContact CB-CG1 4.33Å; R56-V69 HydrophobicContact CG-CB 3.82Å; R56-V69 HydrophobicContact CG-CG1 3.94Å; R56-V69 WeakPolarHBondContact CG-O 3.4Å; I59-V69 HydrophobicContact CB-CG1 4.38Å; I59-V69 HydrophobicContact CD1-CG1 4.08Å; I59-V69 HydrophobicContact CG2-CG1 4.23Å; I59-V69 HydrophobicContact CG2-CG2 3.8Å; R60-V69 HydrophobicContact CG-CG2 4.41Å; V65-V69 HydrophobicContact CG2-CG2 3.79Å; V69-T71 PolarHBondContact O-N 3.15Å
70	D	69.2	Low	70.8	Confident	60 Å²	60	97.4 Å²	97.4	32%	0.321	49%	0.487	S	S	.	.			trans	-55.8	130.8	-174.7	-63.5	-23.2	0	0	0	111.4	H68 E74 H75	H68-D70 IonicContact CD2-OD1 2.84Å; H68-D70 PolarHBondContact CD2-OD1 2.03Å; H68-D70 VanDerWaalsContact CD2-OD1 3.3Å; H68-D70 IonicContact NE2-OD1 3.3Å; D70-E74 WeakPolarHBondContact CA-OE2 3.46Å; D70-E74 HydrophobicContact CB-CB 3.89Å; D70-H75 IonicContact OD2-ND1 3.65Å
71	T	66.6	Low	70.1	Confident	26 Å²	26	97.4 Å²	97.4	16%	0.16	49%	0.493	C	S	.	.			trans	-68.5	171.1	167.4	60.4	0	0	0	0	110.7	V69 D73 E74 H75	V69-T71 PolarHBondContact O-N 3.15Å; T71-D73 VanDerWaalsContact C-N 3.27Å; T71-D73 PolarHBondContact O-N 3.2Å; T71-E74 WeakPolarHBondContact CB-OE2 3.21Å; T71-E74 WeakPolarHBondContact CG2-OE2 3.05Å; T71-E74 PolarHBondContact N-OE2 3.43Å; T71-E74 PolarHBondContact O-N 3.39Å; T71-E74 VanDerWaalsContact OG1-CD 3.27Å; T71-E74 WeakPolarHBondContact OG1-CG 3.49Å; T71-E74 PolarHBondContact OG1-N 3.45Å; T71-E74 PolarHBondContact OG1-OE2 3.21Å; T71-H75 PolarHBondContact O-N 3.26Å
72	Y	65	Low	69.2	Low	81 Å²	81	95.4 Å²	95.4	32%	0.318	49%	0.486	S	S	.	.	H	α-helix	trans	-53.7	-46.9	175	-180	-106.5	0	0	0	112.7	R49 Q52 E74 H75 K76	R49-Y72 HydrophobicContact CG-CD1 3.78Å; R49-Y72 HydrophobicContact CG-CE1 4.4Å; R49-Y72 HydrophobicContact CG-CG 4.28Å; Q52-Y72 HydrophobicContact CG-CD2 4.38Å; Q52-Y72 HydrophobicContact CG-CG 4.5Å; Y72-E74 VanDerWaalsContact C-N 3.31Å; Y72-E74 PolarHBondContact O-N 3.32Å; Y72-H75 PolarHBondContact O-N 3.13Å; Y72-K76 PolarHBondContact O-N 3.31Å; Y72-K76 VanDerWaalsContact O-N 3.13Å
73	D	62.8	Low	68.4	Low	87 Å²	87	96.6 Å²	96.6	47%	0.465	49%	0.488	S	S	.	.	H	α-helix	trans	-69.7	-33.3	-174.5	-66.1	-44.7	0	0	0	110.8	T71	T71-D73 VanDerWaalsContact C-N 3.27Å; T71-D73 PolarHBondContact O-N 3.2Å
74	E	69	Low	67.6	Low	62 Å²	62	101.3 Å²	101.3	29%	0.29	51%	0.509	S	S	.	.	H	α-helix	trans	-69.9	-43.5	174.4	-71	164.2	139.7	0	0	112	H68 D70 T71 Y72 K76 L77 H78	H68-E74 IonicContact CD2-OE1 3.97Å; H68-E74 IonicContact CE1-OE1 3.93Å; H68-E74 PolarHBondContact CE1-OE1 3.27Å; H68-E74 IonicContact CE1-OE2 3.63Å; H68-E74 PolarHBondContact CE1-OE2 3.02Å; H68-E74 IonicContact NE2-OE1 3.36Å; H68-E74 PolarHBondContact NE2-OE1 3.46Å; H68-E74 IonicContact NE2-OE2 3.36Å; H68-E74 PolarHBondContact NE2-OE2 3.38Å; D70-E74 WeakPolarHBondContact CA-OE2 3.46Å; D70-E74 HydrophobicContact CB-CB 3.89Å; T71-E74 WeakPolarHBondContact CB-OE2 3.21Å; T71-E74 WeakPolarHBondContact CG2-OE2 3.05Å; T71-E74 PolarHBondContact N-OE2 3.43Å; T71-E74 PolarHBondContact O-N 3.39Å; T71-E74 VanDerWaalsContact OG1-CD 3.27Å; T71-E74 WeakPolarHBondContact OG1-CG 3.49Å; T71-E74 PolarHBondContact OG1-N 3.45Å; T71-E74 PolarHBondContact OG1-OE2 3.21Å; Y72-E74 VanDerWaalsContact C-N 3.31Å; Y72-E74 PolarHBondContact O-N 3.32Å; E74-K76 PolarHBondContact O-N 2.81Å; E74-L77 WeakPolarHBondContact O-CB 3.05Å; E74-L77 PolarHBondContact O-N 3.44Å; E74-H78 PolarHBondContact O-CD2 3.43Å
75	H	68.3	Low	66.7	Low	83 Å²	83	97.3 Å²	97.3	38%	0.384	50%	0.496	S	S	.	.	H	α-helix	trans	-60.6	-35.7	176.8	-132.1	70.4	0	0	0	111.9	D70 T71 Y72 L77 H78	D70-H75 IonicContact OD2-ND1 3.65Å; T71-H75 PolarHBondContact O-N 3.26Å; Y72-H75 PolarHBondContact O-N 3.13Å; H75-L77 PolarHBondContact O-N 3.45Å; H75-H78 PolarHBondContact O-N 3.13Å; H75-H78 VanDerWaalsContact O-N 3.13Å
76	K	67.1	Low	66.1	Low	134 Å²	134	100.9 Å²	100.9	58%	0.583	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-18.6	177.7	-164.1	-176.4	173	-168.8	0	113.4	Y72 E74 H78	Y72-K76 PolarHBondContact O-N 3.31Å; Y72-K76 VanDerWaalsContact O-N 3.13Å; E74-K76 PolarHBondContact O-N 2.81Å; K76-H78 VanDerWaalsContact C-N 3.27Å
77	L	67.4	Low	65.7	Low	143 Å²	143	98.8 Å²	98.8	75%	0.749	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-16.8	175.1	-63.9	171.2	0	0	0	112.6	E74 H75	E74-L77 WeakPolarHBondContact O-CB 3.05Å; E74-L77 PolarHBondContact O-N 3.44Å; H75-L77 PolarHBondContact O-N 3.45Å
78	H	57.2	Low	65.7	Low	147 Å²	147	94.8 Å²	94.8	68%	0.681	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-10.2	-174.5	-67.2	-68.4	0	0	0	114.5	E74 H75 K76	E74-H78 PolarHBondContact O-CD2 3.43Å; H75-H78 PolarHBondContact O-N 3.13Å; H75-H78 VanDerWaalsContact O-N 3.13Å; K76-H78 VanDerWaalsContact C-N 3.27Å
79	D	50.7	Low	64.9	Low	189 Å²	189	94.2 Å²	94.2	100%	1.011	46%	0.464	S	S	*	.			trans	-100	0	174.6	-77.1	-20.6	0	0	0	111.5

Retrieved 79 of 79 residues in 31 ms (Link to these results)

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