A0A5K4FF27_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4FF27, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 95 aa.

						>A0A5K4FF27_SCHMA|A0A5K4FF27
MDYMIRFNCLILLFVLVSSINSLDSITDSDDLDDIINEEPENMVTFYRQDRSTLFPRVGRSDTKKMNRLRQILMNNPNFANDSPKRAVRIVRYGK
					

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(Predicted Aligned Error values between residue pairs)

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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	56.7	Low	53.4	Low	193 Å²	193	134.1 Å²	134.1	95%	0.951	65%	0.645	S	S	*	*				0	-17	0	-73.1	-72.1	-166.4	0	0	112
2	D	51.5	Low	53.8	Low	116 Å²	116	133.5 Å²	133.5	62%	0.62	65%	0.647	S	S	*	*	H	α-helix	trans	-74.8	-24.3	-174.3	-56.7	-91	0	0	0	116	R6	D2-R6 PolarHBondContact O-N 3.25Å
3	Y	52	Low	54	Low	199 Å²	199	131.6 Å²	131.6	78%	0.78	64%	0.641	S	S	*	*	H	α-helix	trans	-70.4	-34.1	-179	-68	-79.1	0	0	0	113.2	R6 F7	Y3-R6 PolarHBondContact O-N 2.69Å; Y3-F7 PolarHBondContact O-N 2.95Å
4	M	50.7	Low	54.1	Low	142 Å²	142	133.6 Å²	133.6	70%	0.7	65%	0.645	S	S	*	*	H	α-helix	trans	-70.7	-33.4	-178.6	-63.8	-173	79.9	0	0	112.1	N8	M4-N8 PolarHBondContact O-N 3.01Å; M4-N8 VanDerWaalsContact O-N 3.13Å
5	I	50.7	Low	54.1	Low	117 Å²	117	130.5 Å²	130.5	60%	0.6	64%	0.637	S	S	*	*	H	α-helix	trans	-70.5	-41.4	177.1	-59.8	174.8	0	0	0	110.1	F7 N8 C9	I5-F7 PolarHBondContact O-N 2.76Å; I5-N8 PolarHBondContact O-N 2.9Å; I5-C9 PolarHBondContact O-N 3.37Å; I5-C9 VanDerWaalsContact O-N 3.13Å
6	R	49.7	Very low	53.8	Low	185 Å²	185	128.8 Å²	128.8	70%	0.698	63%	0.631	S	S	*	*	H	α-helix	trans	-65.6	-36.9	176.2	-71.6	-175.6	175	-177.8	-0.9	112.7	D2 Y3 C9 L10	D2-R6 PolarHBondContact O-N 3.25Å; Y3-R6 PolarHBondContact O-N 2.69Å; R6-C9 PolarHBondContact O-N 3.45Å; R6-L10 PolarHBondContact O-N 3.13Å
7	F	55.7	Low	53.6	Low	138 Å²	138	125.5 Å²	125.5	61%	0.605	62%	0.62	S	S	*	*	H	α-helix	trans	-67.5	-40.9	177.3	-162.4	-102.3	0	0	0	112.1	Y3 I5 C9 L10 I11	Y3-F7 PolarHBondContact O-N 2.95Å; I5-F7 PolarHBondContact O-N 2.76Å; F7-C9 PolarHBondContact O-N 3.3Å; F7-L10 PolarHBondContact O-N 3.17Å; F7-I11 HydrophobicContact CD1-CD1 3.66Å; F7-I11 HydrophobicContact CE1-CD1 3.54Å; F7-I11 HydrophobicContact CE1-CG1 4.39Å; F7-I11 HydrophobicContact CZ-CD1 4.44Å; F7-I11 PolarHBondContact O-N 3.12Å
8	N	50.6	Low	53.2	Low	114 Å²	114	121.9 Å²	121.9	61%	0.61	61%	0.609	S	S	*	*	H	α-helix	trans	-64.4	-36.7	174.6	-98.2	-22.1	0	0	0	113	M4 I5 L10 I11 L12	M4-N8 PolarHBondContact O-N 3.01Å; M4-N8 VanDerWaalsContact O-N 3.13Å; I5-N8 PolarHBondContact O-N 2.9Å; N8-L10 PolarHBondContact O-N 3.49Å; N8-I11 PolarHBondContact O-N 3.05Å; N8-L12 PolarHBondContact O-N 2.94Å; N8-L12 VanDerWaalsContact O-N 3.12Å
9	C	54.3	Low	52.7	Low	78 Å²	78	119.1 Å²	119.1	53%	0.527	60%	0.602	S	S	.	*	H	α-helix	trans	-65.2	-35.7	174.9	-82.1	0	0	0	0	113.2	I5 R6 F7 L13	I5-C9 PolarHBondContact O-N 3.37Å; I5-C9 VanDerWaalsContact O-N 3.13Å; R6-C9 PolarHBondContact O-N 3.45Å; F7-C9 PolarHBondContact O-N 3.3Å; C9-L13 PolarHBondContact O-N 3.07Å
10	L	58	Low	52.2	Low	115 Å²	115	118 Å²	118	60%	0.602	60%	0.597	S	S	*	*	H	α-helix	trans	-69.7	-39.9	178.1	-75.7	166.5	0	0	0	112.2	R6 F7 N8 L13 F14	R6-L10 PolarHBondContact O-N 3.13Å; F7-L10 PolarHBondContact O-N 3.17Å; N8-L10 PolarHBondContact O-N 3.49Å; L10-L13 PolarHBondContact O-N 3.24Å; L10-F14 PolarHBondContact O-N 2.98Å
11	I	57.5	Low	51.7	Low	78 Å²	78	117.7 Å²	117.7	40%	0.4	60%	0.597	S	S	.	*	H	α-helix	trans	-64.3	-43.1	176.2	-67.3	166.9	0	0	0	110.5	F7 N8 L13 F14 V15	F7-I11 HydrophobicContact CD1-CD1 3.66Å; F7-I11 HydrophobicContact CE1-CD1 3.54Å; F7-I11 HydrophobicContact CE1-CG1 4.39Å; F7-I11 HydrophobicContact CZ-CD1 4.44Å; F7-I11 PolarHBondContact O-N 3.12Å; N8-I11 PolarHBondContact O-N 3.05Å; I11-L13 VanDerWaalsContact C-N 3.32Å; I11-L13 PolarHBondContact O-N 2.94Å; I11-F14 PolarHBondContact O-N 3.3Å; I11-F14 VanDerWaalsContact O-N 3.16Å; I11-V15 HydrophobicContact CG2-CG2 4.32Å; I11-V15 WeakPolarHBondContact O-CG2 2.93Å; I11-V15 PolarHBondContact O-N 3.24Å
12	L	57.6	Low	50.8	Low	127 Å²	127	113 Å²	113	67%	0.665	58%	0.583	S	S	*	*	H	α-helix	trans	-61.1	-42.4	179.2	-153.9	92.8	0	0	0	111.6	N8 V15 L16	N8-L12 PolarHBondContact O-N 2.94Å; N8-L12 VanDerWaalsContact O-N 3.12Å; L12-V15 PolarHBondContact O-N 3.34Å; L12-L16 WeakPolarHBondContact O-CB 3.49Å; L12-L16 PolarHBondContact O-N 2.84Å
13	L	56.7	Low	50.4	Low	109 Å²	109	113.6 Å²	113.6	57%	0.571	59%	0.586	S	S	*	*	H	α-helix	trans	-63	-41.3	174.1	-99.3	154.3	0	0	0	112.1	C9 L10 I11 L16 V17	C9-L13 PolarHBondContact O-N 3.07Å; L10-L13 PolarHBondContact O-N 3.24Å; I11-L13 VanDerWaalsContact C-N 3.32Å; I11-L13 PolarHBondContact O-N 2.94Å; L13-L16 PolarHBondContact O-N 3.46Å; L13-V17 WeakPolarHBondContact O-CB 2.99Å; L13-V17 VanDerWaalsContact O-CG2 3.26Å; L13-V17 WeakPolarHBondContact O-CG2 3.12Å; L13-V17 PolarHBondContact O-N 3.35Å
14	F	55.5	Low	49.7	Very low	159 Å²	159	111.3 Å²	111.3	70%	0.697	59%	0.587	S	S	*	*	H	α-helix	trans	-67.4	-38.3	179.6	-145.4	-90.2	0	0	0	112.4	L10 I11 S18	L10-F14 PolarHBondContact O-N 2.98Å; I11-F14 PolarHBondContact O-N 3.3Å; I11-F14 VanDerWaalsContact O-N 3.16Å; F14-S18 VanDerWaalsContact O-CB 3.31Å; F14-S18 WeakPolarHBondContact O-CB 3.11Å; F14-S18 PolarHBondContact O-N 3.1Å; F14-S18 PolarHBondContact O-OG 3.48Å
15	V	53.5	Low	49.1	Very low	88 Å²	88	109 Å²	109	53%	0.533	59%	0.585	S	S	.	*	H	α-helix	trans	-68.7	-39.1	174.6	173.8	0	0	0	0	110.9	I11 L12 S18 S19	I11-V15 HydrophobicContact CG2-CG2 4.32Å; I11-V15 WeakPolarHBondContact O-CG2 2.93Å; I11-V15 PolarHBondContact O-N 3.24Å; L12-V15 PolarHBondContact O-N 3.34Å; V15-S18 PolarHBondContact O-N 3.5Å; V15-S19 WeakPolarHBondContact O-CB 3.33Å; V15-S19 PolarHBondContact O-N 3.4Å; V15-S19 PolarHBondContact O-OG 3.06Å
16	L	50.4	Low	48.5	Very low	103 Å²	103	109.3 Å²	109.3	54%	0.539	59%	0.587	S	S	.	*	H	α-helix	trans	-66.1	-45.1	177.1	-146.7	104.5	0	0	0	111.5	L12 L13 S18 S19 I20	L12-L16 WeakPolarHBondContact O-CB 3.49Å; L12-L16 PolarHBondContact O-N 2.84Å; L13-L16 PolarHBondContact O-N 3.46Å; L16-S18 VanDerWaalsContact C-N 3.34Å; L16-S18 PolarHBondContact O-N 2.89Å; L16-S19 WeakPolarHBondContact O-CB 3.43Å; L16-S19 PolarHBondContact O-N 3.48Å; L16-I20 HydrophobicContact CD2-CD1 4.15Å; L16-I20 WeakPolarHBondContact O-CD1 3.47Å; L16-I20 VanDerWaalsContact O-CG1 3.25Å; L16-I20 WeakPolarHBondContact O-CG1 3.36Å; L16-I20 PolarHBondContact O-N 2.9Å
17	V	50.3	Low	48.2	Very low	72 Å²	72	106.1 Å²	106.1	44%	0.436	59%	0.587	S	S	.	*	H	α-helix	trans	-67	-35.4	177.2	175.1	0	0	0	0	111.3	L13 S19 I20 N21	L13-V17 WeakPolarHBondContact O-CB 2.99Å; L13-V17 VanDerWaalsContact O-CG2 3.26Å; L13-V17 WeakPolarHBondContact O-CG2 3.12Å; L13-V17 PolarHBondContact O-N 3.35Å; V17-S19 VanDerWaalsContact C-N 3.31Å; V17-S19 PolarHBondContact O-N 3.41Å; V17-I20 PolarHBondContact O-N 3.16Å; V17-N21 WeakPolarHBondContact O-CB 3.27Å; V17-N21 PolarHBondContact O-N 3.36Å
18	S	45.7	Very low	47.8	Very low	61 Å²	61	104.1 Å²	104.1	43%	0.427	58%	0.583	S	S	.	*	H	α-helix	trans	-68.1	-31.3	173.1	-58.8	0	0	0	0	112.6	F14 V15 L16 S22	F14-S18 VanDerWaalsContact O-CB 3.31Å; F14-S18 WeakPolarHBondContact O-CB 3.11Å; F14-S18 PolarHBondContact O-N 3.1Å; F14-S18 PolarHBondContact O-OG 3.48Å; V15-S18 PolarHBondContact O-N 3.5Å; L16-S18 VanDerWaalsContact C-N 3.34Å; L16-S18 PolarHBondContact O-N 2.89Å; S18-S22 WeakPolarHBondContact O-CB 3.23Å; S18-S22 PolarHBondContact O-N 3.09Å
19	S	43.8	Very low	47.6	Very low	68 Å²	68	102.3 Å²	102.3	48%	0.476	58%	0.579	S	S	.	*	H	α-helix	trans	-73.2	-32.6	175.3	-54.9	0	0	0	0	112	V15 L16 V17 L23	V15-S19 WeakPolarHBondContact O-CB 3.33Å; V15-S19 PolarHBondContact O-N 3.4Å; V15-S19 PolarHBondContact O-OG 3.06Å; L16-S19 WeakPolarHBondContact O-CB 3.43Å; L16-S19 PolarHBondContact O-N 3.48Å; V17-S19 VanDerWaalsContact C-N 3.31Å; V17-S19 PolarHBondContact O-N 3.41Å; S19-L23 PolarHBondContact O-N 3.24Å
20	I	43.9	Very low	47.4	Very low	97 Å²	97	104.1 Å²	104.1	50%	0.497	58%	0.584	S	S	.	*	H	α-helix	trans	-73.5	-41.4	175.2	-65.1	161.1	0	0	0	110.2	L16 V17 S22 L23	L16-I20 HydrophobicContact CD2-CD1 4.15Å; L16-I20 WeakPolarHBondContact O-CD1 3.47Å; L16-I20 VanDerWaalsContact O-CG1 3.25Å; L16-I20 WeakPolarHBondContact O-CG1 3.36Å; L16-I20 PolarHBondContact O-N 2.9Å; V17-I20 PolarHBondContact O-N 3.16Å; I20-S22 VanDerWaalsContact C-N 3.29Å; I20-S22 PolarHBondContact O-N 3.32Å; I20-L23 VanDerWaalsContact O-CB 3.31Å; I20-L23 WeakPolarHBondContact O-CB 3.49Å; I20-L23 PolarHBondContact O-N 3.47Å; I20-L23 VanDerWaalsContact O-N 3.1Å
21	N	40	Very low	47.1	Very low	113 Å²	113	101.9 Å²	101.9	60%	0.604	57%	0.573	S	S	*	*	H	α-helix	trans	-74.5	-16.4	177	-70.9	1.1	0	0	0	113.7	V17 L23	V17-N21 WeakPolarHBondContact O-CB 3.27Å; V17-N21 PolarHBondContact O-N 3.36Å; N21-L23 VanDerWaalsContact C-N 3.34Å
22	S	39.5	Very low	46.8	Very low	95 Å²	95	101.7 Å²	101.7	66%	0.664	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-5.7	169.5	-166.4	0	0	0	0	113	S18 I20	S18-S22 WeakPolarHBondContact O-CB 3.23Å; S18-S22 PolarHBondContact O-N 3.09Å; I20-S22 VanDerWaalsContact C-N 3.29Å; I20-S22 PolarHBondContact O-N 3.32Å
23	L	41.7	Very low	46.5	Very low	128 Å²	128	99.5 Å²	99.5	67%	0.67	56%	0.561	S	S	*	*	S	Bend	trans	-93	-12.5	179.1	-136	79.6	0	0	0	112.8	S19 I20 N21 S25	S19-L23 PolarHBondContact O-N 3.24Å; I20-L23 VanDerWaalsContact O-CB 3.31Å; I20-L23 WeakPolarHBondContact O-CB 3.49Å; I20-L23 PolarHBondContact O-N 3.47Å; I20-L23 VanDerWaalsContact O-N 3.1Å; N21-L23 VanDerWaalsContact C-N 3.34Å; L23-S25 PolarHBondContact O-N 2.79Å
24	D	37.8	Very low	46.4	Very low	150 Å²	150	99.1 Å²	99.1	80%	0.802	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	11.7	-178.6	-104.9	-15.3	0	0	0	114.2
25	S	37.8	Very low	46.3	Very low	94 Å²	94	95.1 Å²	95.1	66%	0.657	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	14.4	-178.9	-174.7	0	0	0	0	114	L23 T27	L23-S25 PolarHBondContact O-N 2.79Å; S25-T27 VanDerWaalsContact C-N 3.27Å; S25-T27 PolarHBondContact O-N 3.41Å
26	I	39	Very low	46.3	Very low	124 Å²	124	93.5 Å²	93.5	64%	0.636	53%	0.532	S	S	*	.			trans	-89.2	77.5	167.9	-67.7	178.7	0	0	0	107.6	D28	I26-D28 HydrophobicContact CG2-CB 3.88Å; I26-D28 PolarHBondContact O-N 3.22Å; I26-D28 VanDerWaalsContact O-N 3.1Å
27	T	43.4	Very low	46.5	Very low	117 Å²	117	94.4 Å²	94.4	72%	0.718	54%	0.538	S	S	*	.			trans	-75.1	31.6	166.4	-15.9	0	0	0	0	111.2	S25	S25-T27 VanDerWaalsContact C-N 3.27Å; S25-T27 PolarHBondContact O-N 3.41Å
28	D	47.6	Very low	46.9	Very low	97 Å²	97	98.5 Å²	98.5	52%	0.519	55%	0.552	S	S	.	*			trans	-114.1	12.2	-171.9	-82.2	-21	0	0	0	112.4	I26 L32	I26-D28 HydrophobicContact CG2-CB 3.88Å; I26-D28 PolarHBondContact O-N 3.22Å; I26-D28 VanDerWaalsContact O-N 3.1Å; D28-L32 PolarHBondContact O-N 3.38Å
29	S	45.9	Very low	47.1	Very low	75 Å²	75	99.9 Å²	99.9	52%	0.524	55%	0.552	S	S	.	*	H	α-helix	trans	-70.3	-37.9	173.2	-170	0	0	0	0	111.3	L32 D33	S29-L32 PolarHBondContact O-N 2.87Å; S29-D33 PolarHBondContact O-N 2.96Å; S29-D33 VanDerWaalsContact O-N 3.16Å
30	D	49.8	Very low	47.5	Very low	117 Å²	117	100.7 Å²	100.7	63%	0.626	56%	0.555	S	S	*	*	H	α-helix	trans	-68.6	-38.8	-178.7	-62.7	-23.7	0	0	0	111	L32 D33 D34	D30-L32 VanDerWaalsContact C-N 3.26Å; D30-L32 PolarHBondContact O-N 3.42Å; D30-D33 PolarHBondContact O-N 3.32Å; D30-D34 PolarHBondContact O-N 3.49Å
31	D	52.8	Low	47.4	Very low	68 Å²	68	103.8 Å²	103.8	36%	0.364	57%	0.568	S	S	.	*	H	α-helix	trans	-62.8	-30.5	174.7	-99.4	29.5	0	0	0	112.7	I35 R68	D31-I35 WeakPolarHBondContact O-CD1 3.18Å; D31-I35 VanDerWaalsContact O-CG1 3.27Å; D31-I35 WeakPolarHBondContact O-CG1 3.39Å; D31-I35 PolarHBondContact O-N 2.92Å; D31-R68 IonicContact OD2-NH2 2.95Å; D31-R68 PolarHBondContact OD2-NH2 3.13Å; D31-R68 VanDerWaalsContact OD2-NH2 3.09Å
32	L	49.7	Very low	47.6	Very low	74 Å²	74	102.1 Å²	102.1	39%	0.387	56%	0.559	S	S	.	*	H	α-helix	trans	-79.7	-38.6	-179.3	-163.2	75.6	0	0	0	111.3	D28 S29 D30 D34 I35 I36	D28-L32 PolarHBondContact O-N 3.38Å; S29-L32 PolarHBondContact O-N 2.87Å; D30-L32 VanDerWaalsContact C-N 3.26Å; D30-L32 PolarHBondContact O-N 3.42Å; L32-D34 VanDerWaalsContact C-N 3.34Å; L32-I35 PolarHBondContact O-N 3.19Å; L32-I36 HydrophobicContact CD2-CD1 4.47Å; L32-I36 HydrophobicContact CG-CD1 4.09Å; L32-I36 WeakPolarHBondContact O-CD1 3.44Å; L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.43Å; L32-I36 PolarHBondContact O-N 3.1Å; L32-I36 VanDerWaalsContact O-N 3.1Å
33	D	51.6	Low	47.6	Very low	80 Å²	80	100.6 Å²	100.6	43%	0.428	54%	0.542	S	S	.	.	H	α-helix	trans	-66.2	-37.4	174.8	-76.4	-29.4	0	0	0	111.2	S29 D30 I35 I36 N37	S29-D33 PolarHBondContact O-N 2.96Å; S29-D33 VanDerWaalsContact O-N 3.16Å; D30-D33 PolarHBondContact O-N 3.32Å; D33-I35 PolarHBondContact O-N 2.96Å; D33-I36 PolarHBondContact O-N 3.19Å; D33-N37 VanDerWaalsContact O-CB 3.23Å; D33-N37 WeakPolarHBondContact O-CB 3.28Å; D33-N37 PolarHBondContact O-N 2.88Å; D33-N37 PolarHBondContact O-ND2 3.44Å
34	D	54.6	Low	47.6	Very low	102 Å²	102	97.6 Å²	97.6	55%	0.545	53%	0.529	S	S	.	.	H	α-helix	trans	-62.4	-42.1	174.8	-78.5	-17	0	0	0	112.4	D30 L32 I36 N37 E38	D30-D34 PolarHBondContact O-N 3.49Å; L32-D34 VanDerWaalsContact C-N 3.34Å; D34-I36 PolarHBondContact O-N 3.22Å; D34-N37 PolarHBondContact O-N 2.97Å; D34-E38 WeakPolarHBondContact O-CB 3.27Å; D34-E38 WeakPolarHBondContact O-CG 3.5Å; D34-E38 PolarHBondContact O-N 3.01Å
35	I	53.1	Low	47.7	Very low	74 Å²	74	94.7 Å²	94.7	38%	0.379	52%	0.517	S	S	.	.	H	α-helix	trans	-70.6	-33	179.2	-66.6	167.7	0	0	0	112	D31 L32 D33 M43	D31-I35 WeakPolarHBondContact O-CD1 3.18Å; D31-I35 VanDerWaalsContact O-CG1 3.27Å; D31-I35 WeakPolarHBondContact O-CG1 3.39Å; D31-I35 PolarHBondContact O-N 2.92Å; L32-I35 PolarHBondContact O-N 3.19Å; D33-I35 PolarHBondContact O-N 2.96Å; I35-M43 HydrophobicContact CG2-CE 4.27Å
36	I	53.4	Low	47.8	Very low	54 Å²	54	94.2 Å²	94.2	28%	0.277	50%	0.503	S	S	.	.	H	α-helix	trans	-77.4	-35.2	178.5	-68.3	168.3	0	0	0	111	L32 D33 D34 M43 V91	L32-I36 HydrophobicContact CD2-CD1 4.47Å; L32-I36 HydrophobicContact CG-CD1 4.09Å; L32-I36 WeakPolarHBondContact O-CD1 3.44Å; L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.43Å; L32-I36 PolarHBondContact O-N 3.1Å; L32-I36 VanDerWaalsContact O-N 3.1Å; D33-I36 PolarHBondContact O-N 3.19Å; D34-I36 PolarHBondContact O-N 3.22Å; I36-M43 HydrophobicContact CG1-CE 4.03Å; I36-V91 HydrophobicContact CD1-CG1 4.13Å
37	N	55.1	Low	47.9	Very low	123 Å²	123	94.3 Å²	94.3	66%	0.658	50%	0.496	S	S	*	.	H	α-helix	trans	-77.2	-30.3	179.1	-74.1	-42.8	0	0	0	113.3	D33 D34	D33-N37 VanDerWaalsContact O-CB 3.23Å; D33-N37 WeakPolarHBondContact O-CB 3.28Å; D33-N37 PolarHBondContact O-N 2.88Å; D33-N37 PolarHBondContact O-ND2 3.44Å; D34-N37 PolarHBondContact O-N 2.97Å
38	E	58.1	Low	47.6	Very low	157 Å²	157	99.3 Å²	99.3	73%	0.734	50%	0.502	S	S	*	.	H	α-helix	trans	-68.7	-37.8	179.2	-86.1	-166.5	151.5	0	0	113.3	D34	D34-E38 WeakPolarHBondContact O-CB 3.27Å; D34-E38 WeakPolarHBondContact O-CG 3.5Å; D34-E38 PolarHBondContact O-N 3.01Å
39	E	51.2	Low	47.1	Very low	90 Å²	90	100.3 Å²	100.3	42%	0.421	50%	0.503	S	S	.	.			trans	-146.2	71.5	-172.2	-63.5	-169.5	150.3	0	0	114.7	E41 N42	E39-E41 PolarHBondContact O-N 3.36Å; E39-N42 HydrophobicContact CB-CB 4.1Å; E39-N42 PolarHBondContact O-N 3.28Å; E39-N42 PolarHBondContact OE1-ND2 2.93Å; E39-N42 PolarHBondContact OE2-ND2 3.48Å
40	P	50.7	Low	46.7	Very low	85 Å²	85	101.3 Å²	101.3	55%	0.552	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-28	175.3	24.5	-33.4	0	0	0	112.8	V44	P40-V44 WeakPolarHBondContact O-CG2 3.07Å
41	E	42.8	Very low	46.3	Very low	163 Å²	163	108.7 Å²	108.7	76%	0.762	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-31.3	-175.9	-62.6	-167.9	161.5	0	0	113.4	E39 V44	E39-E41 PolarHBondContact O-N 3.36Å; E41-V44 PolarHBondContact O-N 3.46Å
42	N	44.6	Very low	45.8	Very low	77 Å²	77	110.2 Å²	110.2	41%	0.412	54%	0.538	S	S	.	.	H	α-helix	trans	-75.3	-24.9	178.9	-77.5	-18.9	0	0	0	112.5	E39 V44 T45 F46	E39-N42 HydrophobicContact CB-CB 4.1Å; E39-N42 PolarHBondContact O-N 3.28Å; E39-N42 PolarHBondContact OE1-ND2 2.93Å; E39-N42 PolarHBondContact OE2-ND2 3.48Å; N42-V44 PolarHBondContact O-N 3Å; N42-T45 PolarHBondContact O-OG1 3.41Å; N42-T45 VanDerWaalsContact O-OG1 3.05Å; N42-F46 WeakPolarHBondContact O-CD2 3.31Å; N42-F46 WeakPolarHBondContact O-CE2 3.22Å
43	M	39.9	Very low	45.3	Very low	63 Å²	63	110.3 Å²	110.3	31%	0.31	54%	0.542	S	S	.	.	H	α-helix	trans	-70.4	-19	172.9	-71.7	-158.2	178.4	0	0	113.6	I35 I36	I35-M43 HydrophobicContact CG2-CE 4.27Å; I36-M43 HydrophobicContact CG1-CE 4.03Å
44	V	41.2	Very low	44.8	Very low	65 Å²	65	114.4 Å²	114.4	39%	0.394	56%	0.563	S	S	.	*	H	α-helix	trans	-85.8	-27.2	-174.4	178.4	0	0	0	0	112.5	P40 E41 N42 F46	P40-V44 WeakPolarHBondContact O-CG2 3.07Å; E41-V44 PolarHBondContact O-N 3.46Å; N42-V44 PolarHBondContact O-N 3Å; V44-F46 VanDerWaalsContact C-N 3.35Å
45	T	39.5	Very low	44	Very low	90 Å²	90	117.6 Å²	117.6	55%	0.552	57%	0.572	S	S	*	*	H	α-helix	trans	-74.2	-22.8	178.1	46.7	0	0	0	0	113.2	N42 Y47	N42-T45 PolarHBondContact O-OG1 3.41Å; N42-T45 VanDerWaalsContact O-OG1 3.05Å; T45-Y47 PolarHBondContact O-N 3.27Å
46	F	40.9	Very low	43.5	Very low	84 Å²	84	116.7 Å²	116.7	37%	0.368	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.2	-19.4	178.2	-72.4	-76.4	0	0	0	115	N42 V44	N42-F46 WeakPolarHBondContact O-CD2 3.31Å; N42-F46 WeakPolarHBondContact O-CE2 3.22Å; V44-F46 VanDerWaalsContact C-N 3.35Å
47	Y	39.9	Very low	43	Very low	126 Å²	126	125.1 Å²	125.1	49%	0.494	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.3	-2.8	-170.6	-80	-84.5	0	0	0	115.2	T45 V88	T45-Y47 PolarHBondContact O-N 3.27Å; Y47-V88 HydrophobicContact CD2-CG1 4.21Å; Y47-V88 HydrophobicContact CE1-CG2 4.4Å; Y47-V88 HydrophobicContact CE2-CB 4.25Å; Y47-V88 HydrophobicContact CE2-CG1 3.9Å; Y47-V88 HydrophobicContact CE2-CG2 3.64Å; Y47-V88 VanDerWaalsContact CZ-CG2 3.46Å; Y47-V88 WeakPolarHBondContact OH-CG2 3.36Å
48	R	38.1	Very low	42.6	Very low	221 Å²	221	122.1 Å²	122.1	83%	0.834	59%	0.585	S	S	*	*	S	Bend	trans	-100.4	-4.3	-175.4	-131.5	-179.5	178.7	-169.9	-1.1	114.5
49	Q	36.8	Very low	41.9	Very low	118 Å²	118	116.8 Å²	116.8	55%	0.551	57%	0.572	S	S	*	*	S	Bend	trans	-99.6	111.7	178.2	-105	170.6	-1.6	0	0	111.5
50	D	37.2	Very low	41.8	Very low	96 Å²	96	124.6 Å²	124.6	51%	0.513	60%	0.598	S	S	.	*			trans	67.5	96.8	154.1	-60.7	-29.1	0	0	0	119	S52 T53	D50-S52 PolarHBondContact O-N 3.41Å; D50-T53 WeakPolarHBondContact CB-OG1 3.47Å; D50-T53 PolarHBondContact O-N 3.46Å
51	R	41	Very low	41.8	Very low	272 Å²	272	124.8 Å²	124.8	100%	1.026	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	0	158.8	-74.2	-179.4	172.2	-178.7	-2.3	114.2
52	S	43.4	Very low	42.5	Very low	100 Å²	100	120.2 Å²	120.2	70%	0.699	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.9	-3.7	-177.3	54.4	0	0	0	0	114.7	D50	D50-S52 PolarHBondContact O-N 3.41Å
53	T	38.6	Very low	43.1	Very low	76 Å²	76	121.3 Å²	121.3	47%	0.466	59%	0.592	S	S	.	*			trans	-134.8	113.4	177.6	55.4	0	0	0	0	110.9	D50 F55	D50-T53 WeakPolarHBondContact CB-OG1 3.47Å; D50-T53 PolarHBondContact O-N 3.46Å; T53-F55 PolarHBondContact O-N 3.1Å
54	L	41.4	Very low	44.2	Very low	167 Å²	167	126.3 Å²	126.3	87%	0.874	61%	0.612	S	S	*	*	S	Bend	trans	-65.9	12.8	-176.9	-112.6	131.2	0	0	0	115.5
55	F	38	Very low	45.1	Very low	169 Å²	169	128.9 Å²	128.9	74%	0.741	62%	0.618	S	S	*	*	S	Bend	trans	-143.7	116.7	179.4	-67	-79.4	0	0	0	109.9	T53 R57	T53-F55 PolarHBondContact O-N 3.1Å; F55-R57 PolarHBondContact O-N 3.04Å
56	P	41.9	Very low	46.1	Very low	55 Å²	55	128.6 Å²	128.6	36%	0.357	61%	0.611	S	S	.	*			trans	-58.9	135.8	164.5	22.8	-27.1	0	0	0	108	V58	P56-V58 PolarHBondContact O-N 3.4Å
57	R	42.3	Very low	47.2	Very low	231 Å²	231	129 Å²	129	87%	0.872	62%	0.617	S	S	*	*			trans	-63.7	91	165.5	-79	-177.3	173.4	-178.7	-0.7	106.8	F55 G59	F55-R57 PolarHBondContact O-N 3.04Å; R57-G59 VanDerWaalsContact C-N 3.35Å; R57-G59 PolarHBondContact O-N 2.87Å
58	V	47.9	Very low	48.3	Very low	59 Å²	59	129.1 Å²	129.1	36%	0.358	62%	0.617	S	S	.	*			trans	-60.3	101.5	171	-172.1	0	0	0	0	105.9	P56 R60 M66	P56-V58 PolarHBondContact O-N 3.4Å; V58-R60 PolarHBondContact O-N 3.22Å; V58-M66 HydrophobicContact CB-SD 4.23Å; V58-M66 HydrophobicContact CG1-SD 3.54Å; V58-M66 VanDerWaalsContact CG1-SD 3.54Å; V58-M66 HydrophobicContact CG2-CE 4.26Å; V58-M66 HydrophobicContact CG2-SD 3.57Å; V58-M66 VanDerWaalsContact CG2-SD 3.57Å
59	G	43.1	Very low	49.5	Very low	45 Å²	45	123 Å²	123	46%	0.464	60%	0.6	S	S	.	*			trans	-52	140.4	162.5	0	0	0	0	0	107.3	R57 S61	R57-G59 VanDerWaalsContact C-N 3.35Å; R57-G59 PolarHBondContact O-N 2.87Å; G59-S61 PolarHBondContact O-N 2.78Å; G59-S61 PolarHBondContact O-OG 2.83Å
60	R	48.6	Very low	50.7	Low	255 Å²	255	124.7 Å²	124.7	96%	0.962	60%	0.601	S	S	*	*	S	Bend	trans	-53.8	-0	-172.7	-78.9	-179.3	167.3	167	-4.2	116	V58 D62	V58-R60 PolarHBondContact O-N 3.22Å; R60-D62 PolarHBondContact O-N 3.47Å; R60-D62 VanDerWaalsContact O-N 3.13Å
61	S	52.1	Low	52	Low	89 Å²	89	126.1 Å²	126.1	62%	0.622	61%	0.605	S	S	*	*	S	Bend	trans	-67	100.8	171	49.9	0	0	0	0	110.9	G59	G59-S61 PolarHBondContact O-N 2.78Å; G59-S61 PolarHBondContact O-OG 2.83Å
62	D	56.2	Low	53.1	Low	66 Å²	66	117 Å²	117	35%	0.353	58%	0.576	S	S	.	*			trans	68.7	65	161.1	-78	-46.3	0	0	0	118.4	R60 K64 K65 M66	R60-D62 PolarHBondContact O-N 3.47Å; R60-D62 VanDerWaalsContact O-N 3.13Å; D62-K64 PolarHBondContact O-N 3.47Å; D62-K64 VanDerWaalsContact O-N 3.12Å; D62-K65 HydrophobicContact CB-CB 3.64Å; D62-K65 HydrophobicContact CB-CD 3.7Å; D62-K65 HydrophobicContact CB-CG 3.57Å; D62-K65 PolarHBondContact O-N 3.2Å; D62-K65 VanDerWaalsContact O-N 3.07Å; D62-K65 WeakPolarHBondContact OD2-CD 3.32Å; D62-K65 WeakPolarHBondContact OD2-CE 3.35Å; D62-K65 IonicContact OD2-NZ 3.06Å; D62-K65 PolarHBondContact OD2-NZ 3.2Å; D62-M66 PolarHBondContact O-N 3.3Å
63	T	57.7	Low	53.9	Low	100 Å²	100	114.5 Å²	114.5	61%	0.613	55%	0.554	S	S	*	*	H	α-helix	trans	-49.4	-31.6	155.1	49.7	0	0	0	0	112.1	N67	T63-N67 WeakPolarHBondContact O-CB 3.32Å; T63-N67 PolarHBondContact O-N 3.29Å; T63-N67 PolarHBondContact O-ND2 3.33Å
64	K	63.4	Low	54.9	Low	169 Å²	169	116.9 Å²	116.9	74%	0.735	56%	0.561	S	S	*	*	H	α-helix	trans	-65.7	-48	175	-165.6	178.2	-179	-175.4	0	112.4	D62 N67 R68	D62-K64 PolarHBondContact O-N 3.47Å; D62-K64 VanDerWaalsContact O-N 3.12Å; K64-N67 PolarHBondContact O-N 3.4Å; K64-R68 PolarHBondContact O-N 3.08Å
65	K	59.9	Low	55.9	Low	118 Å²	118	115.3 Å²	115.3	51%	0.513	55%	0.554	S	S	.	*	H	α-helix	trans	-67.5	-38.6	177.1	-64.2	178.7	-177.8	162.3	0	111.3	D62 N67 R68 L69	D62-K65 HydrophobicContact CB-CB 3.64Å; D62-K65 HydrophobicContact CB-CD 3.7Å; D62-K65 HydrophobicContact CB-CG 3.57Å; D62-K65 PolarHBondContact O-N 3.2Å; D62-K65 VanDerWaalsContact O-N 3.07Å; D62-K65 WeakPolarHBondContact OD2-CD 3.32Å; D62-K65 WeakPolarHBondContact OD2-CE 3.35Å; D62-K65 IonicContact OD2-NZ 3.06Å; D62-K65 PolarHBondContact OD2-NZ 3.2Å; K65-N67 VanDerWaalsContact C-N 3.35Å; K65-N67 PolarHBondContact O-N 2.91Å; K65-R68 PolarHBondContact O-N 3.17Å; K65-L69 WeakPolarHBondContact O-CB 3.31Å; K65-L69 PolarHBondContact O-N 2.98Å
66	M	59.2	Low	56.6	Low	84 Å²	84	110.1 Å²	110.1	41%	0.414	53%	0.534	S	S	.	.	H	α-helix	trans	-61.6	-41.2	173.5	-105.1	-167.1	73.7	0	0	112.7	V58 D62 L69 R70	V58-M66 HydrophobicContact CB-SD 4.23Å; V58-M66 HydrophobicContact CG1-SD 3.54Å; V58-M66 VanDerWaalsContact CG1-SD 3.54Å; V58-M66 HydrophobicContact CG2-CE 4.26Å; V58-M66 HydrophobicContact CG2-SD 3.57Å; V58-M66 VanDerWaalsContact CG2-SD 3.57Å; D62-M66 PolarHBondContact O-N 3.3Å; M66-L69 PolarHBondContact O-N 3.47Å; M66-R70 VanDerWaalsContact O-CB 3.28Å; M66-R70 WeakPolarHBondContact O-CB 3.49Å; M66-R70 PolarHBondContact O-N 2.93Å
67	N	64.1	Low	57.2	Low	92 Å²	92	112.1 Å²	112.1	49%	0.492	55%	0.547	S	S	.	.	H	α-helix	trans	-67	-38.1	175.4	-77	-21.5	0	0	0	111.9	T63 K64 K65 R70 Q71	T63-N67 WeakPolarHBondContact O-CB 3.32Å; T63-N67 PolarHBondContact O-N 3.29Å; T63-N67 PolarHBondContact O-ND2 3.33Å; K64-N67 PolarHBondContact O-N 3.4Å; K65-N67 VanDerWaalsContact C-N 3.35Å; K65-N67 PolarHBondContact O-N 2.91Å; N67-R70 PolarHBondContact O-N 2.86Å; N67-Q71 WeakPolarHBondContact O-CG 3.32Å; N67-Q71 PolarHBondContact O-N 3.47Å
68	R	64.3	Low	57.7	Low	129 Å²	129	106.7 Å²	106.7	49%	0.487	54%	0.535	S	S	.	.	H	α-helix	trans	-64.1	-46.6	174.4	-166.7	174.6	-179.1	-171.6	-3.8	111	D31 K64 K65 R70 Q71 I72	D31-R68 IonicContact OD2-NH2 2.95Å; D31-R68 PolarHBondContact OD2-NH2 3.13Å; D31-R68 VanDerWaalsContact OD2-NH2 3.09Å; K64-R68 PolarHBondContact O-N 3.08Å; K65-R68 PolarHBondContact O-N 3.17Å; R68-R70 VanDerWaalsContact C-N 3.33Å; R68-R70 PolarHBondContact O-N 3.48Å; R68-Q71 WeakPolarHBondContact O-CB 3.46Å; R68-Q71 PolarHBondContact O-N 2.93Å; R68-I72 HydrophobicContact CG-CD1 4.17Å; R68-I72 VanDerWaalsContact O-CG1 3.31Å; R68-I72 WeakPolarHBondContact O-CG1 3.41Å; R68-I72 PolarHBondContact O-N 2.94Å
69	L	63	Low	57.9	Low	93 Å²	93	105.3 Å²	105.3	49%	0.487	53%	0.525	S	S	.	.	H	α-helix	trans	-60	-43.7	175.1	-164.5	105.8	0	0	0	111.1	K65 M66 Q71 I72 L73	K65-L69 WeakPolarHBondContact O-CB 3.31Å; K65-L69 PolarHBondContact O-N 2.98Å; M66-L69 PolarHBondContact O-N 3.47Å; L69-Q71 VanDerWaalsContact C-N 3.34Å; L69-Q71 PolarHBondContact O-N 2.99Å; L69-I72 PolarHBondContact O-N 3.34Å; L69-L73 HydrophobicContact CD2-CD1 3.8Å; L69-L73 HydrophobicContact CG-CD1 4.1Å; L69-L73 WeakPolarHBondContact O-CB 3.38Å; L69-L73 WeakPolarHBondContact O-CG 3.41Å; L69-L73 PolarHBondContact O-N 2.75Å
70	R	62.1	Low	58.2	Low	154 Å²	154	106.8 Å²	106.8	58%	0.581	53%	0.532	S	S	*	.	H	α-helix	trans	-61.4	-40.7	176.2	-175.2	177.6	178.2	174.9	1	112.2	M66 N67 R68 M74	M66-R70 VanDerWaalsContact O-CB 3.28Å; M66-R70 WeakPolarHBondContact O-CB 3.49Å; M66-R70 PolarHBondContact O-N 2.93Å; N67-R70 PolarHBondContact O-N 2.86Å; R68-R70 VanDerWaalsContact C-N 3.33Å; R68-R70 PolarHBondContact O-N 3.48Å; R70-M74 HydrophobicContact CG-CG 4.5Å; R70-M74 HydrophobicContact CG-SD 4.08Å; R70-M74 WeakPolarHBondContact O-CB 3.39Å; R70-M74 VanDerWaalsContact O-CG 3.32Å; R70-M74 WeakPolarHBondContact O-CG 3.14Å; R70-M74 PolarHBondContact O-N 3.17Å
71	Q	64	Low	58.3	Low	126 Å²	126	101.8 Å²	101.8	59%	0.589	53%	0.525	S	S	*	.	H	α-helix	trans	-64.3	-46.4	175.6	-78.7	176.8	-15.5	0	0	111.8	N67 R68 L69 L73 M74 N75	N67-Q71 WeakPolarHBondContact O-CG 3.32Å; N67-Q71 PolarHBondContact O-N 3.47Å; R68-Q71 WeakPolarHBondContact O-CB 3.46Å; R68-Q71 PolarHBondContact O-N 2.93Å; L69-Q71 VanDerWaalsContact C-N 3.34Å; L69-Q71 PolarHBondContact O-N 2.99Å; Q71-L73 VanDerWaalsContact C-N 3.32Å; Q71-L73 PolarHBondContact O-N 3.06Å; Q71-M74 PolarHBondContact O-N 2.62Å; Q71-N75 WeakPolarHBondContact O-CB 3.36Å; Q71-N75 PolarHBondContact O-N 3.49Å; Q71-N75 PolarHBondContact O-ND2 2.71Å
72	I	64.3	Low	58.2	Low	80 Å²	80	100.2 Å²	100.2	41%	0.41	51%	0.509	S	S	.	.	H	α-helix	trans	-59.6	-44.5	178.2	-66.5	164.1	0	0	0	110.6	R68 L69 N76	R68-I72 HydrophobicContact CG-CD1 4.17Å; R68-I72 VanDerWaalsContact O-CG1 3.31Å; R68-I72 WeakPolarHBondContact O-CG1 3.41Å; R68-I72 PolarHBondContact O-N 2.94Å; L69-I72 PolarHBondContact O-N 3.34Å; I72-N76 PolarHBondContact O-N 3.48Å
73	L	60.6	Low	58	Low	47 Å²	47	100.1 Å²	100.1	25%	0.246	51%	0.514	C	S	.	.	H	α-helix	trans	-69.7	-34.4	179.5	-65.3	174.5	0	0	0	112.9	L69 Q71 F79 A87	L69-L73 HydrophobicContact CD2-CD1 3.8Å; L69-L73 HydrophobicContact CG-CD1 4.1Å; L69-L73 WeakPolarHBondContact O-CB 3.38Å; L69-L73 WeakPolarHBondContact O-CG 3.41Å; L69-L73 PolarHBondContact O-N 2.75Å; Q71-L73 VanDerWaalsContact C-N 3.32Å; Q71-L73 PolarHBondContact O-N 3.06Å; L73-F79 HydrophobicContact CB-CD1 4.49Å; L73-F79 HydrophobicContact CD2-CD1 3.4Å; L73-F79 VanDerWaalsContact CD2-CD1 3.4Å; L73-F79 HydrophobicContact CD2-CE1 3.25Å; L73-F79 HydrophobicContact CD2-CG 4.38Å; L73-F79 HydrophobicContact CD2-CZ 4.17Å; L73-F79 WeakPolarHBondContact O-CB 3.36Å; L73-A87 HydrophobicContact CD2-CB 4.05Å
74	M	58.9	Low	57.7	Low	126 Å²	126	100.1 Å²	100.1	62%	0.621	52%	0.515	S	S	*	.	H	α-helix	trans	-78.5	-27	178	-76	-174.1	153.1	0	0	113.4	R70 Q71 N76	R70-M74 HydrophobicContact CG-CG 4.5Å; R70-M74 HydrophobicContact CG-SD 4.08Å; R70-M74 WeakPolarHBondContact O-CB 3.39Å; R70-M74 VanDerWaalsContact O-CG 3.32Å; R70-M74 WeakPolarHBondContact O-CG 3.14Å; R70-M74 PolarHBondContact O-N 3.17Å; Q71-M74 PolarHBondContact O-N 2.62Å; M74-N76 VanDerWaalsContact C-N 3.3Å
75	N	61.4	Low	57	Low	134 Å²	134	99.9 Å²	99.9	72%	0.717	51%	0.514	S	S	*	.	H	α-helix	trans	-80.8	-11.2	178.2	-72.5	-10.1	0	0	0	113.2	Q71 P77	Q71-N75 WeakPolarHBondContact O-CB 3.36Å; Q71-N75 PolarHBondContact O-N 3.49Å; Q71-N75 PolarHBondContact O-ND2 2.71Å; N75-P77 WeakPolarHBondContact O-CD 3.43Å
76	N	54.6	Low	56.4	Low	60 Å²	60	100.6 Å²	100.6	32%	0.321	51%	0.514	S	S	.	.			trans	-91.3	111.2	178.4	-159.4	-35.5	0	0	0	109.7	I72 M74 N78 F79 A80	I72-N76 PolarHBondContact O-N 3.48Å; M74-N76 VanDerWaalsContact C-N 3.3Å; N76-N78 PolarHBondContact O-N 3.43Å; N76-N78 VanDerWaalsContact O-N 3.08Å; N76-N78 PolarHBondContact OD1-N 2.94Å; N76-F79 HydrophobicContact CB-CB 4.25Å; N76-F79 HydrophobicContact CB-CD2 3.46Å; N76-F79 VanDerWaalsContact CB-CD2 3.46Å; N76-F79 HydrophobicContact CB-CE2 4.09Å; N76-F79 HydrophobicContact CB-CG 4.1Å; N76-F79 WeakPolarHBondContact ND2-CE2 3.31Å; N76-F79 WeakPolarHBondContact O-CB 3.31Å; N76-F79 PolarHBondContact O-N 2.92Å; N76-A80 PolarHBondContact O-N 3.16Å
77	P	54.1	Low	55.9	Low	97 Å²	97	96.8 Å²	96.8	63%	0.63	50%	0.496	S	S	*	.	H	α-helix	trans	-62.1	-21.6	-175.1	23.4	-32.7	0	0	0	113	N75 F79	N75-P77 WeakPolarHBondContact O-CD 3.43Å; P77-F79 VanDerWaalsContact C-N 3.27Å; P77-F79 PolarHBondContact O-N 3.34Å
78	N	51.7	Low	55.2	Low	117 Å²	117	94 Å²	94	63%	0.626	48%	0.482	S	S	*	.	H	α-helix	trans	-75.9	-13.3	173.7	-69.7	-20.7	0	0	0	113.6	N76	N76-N78 PolarHBondContact O-N 3.43Å; N76-N78 VanDerWaalsContact O-N 3.08Å; N76-N78 PolarHBondContact OD1-N 2.94Å
79	F	53.1	Low	54.4	Low	31 Å²	31	96.5 Å²	96.5	14%	0.136	49%	0.491	C	S	.	.	H	α-helix	trans	-101.1	-25	178.2	-74.1	-112.8	0	0	0	112	L73 N76 P77 N81 D82 A87 I90	L73-F79 HydrophobicContact CB-CD1 4.49Å; L73-F79 HydrophobicContact CD2-CD1 3.4Å; L73-F79 VanDerWaalsContact CD2-CD1 3.4Å; L73-F79 HydrophobicContact CD2-CE1 3.25Å; L73-F79 HydrophobicContact CD2-CG 4.38Å; L73-F79 HydrophobicContact CD2-CZ 4.17Å; L73-F79 WeakPolarHBondContact O-CB 3.36Å; N76-F79 HydrophobicContact CB-CB 4.25Å; N76-F79 HydrophobicContact CB-CD2 3.46Å; N76-F79 VanDerWaalsContact CB-CD2 3.46Å; N76-F79 HydrophobicContact CB-CE2 4.09Å; N76-F79 HydrophobicContact CB-CG 4.1Å; N76-F79 WeakPolarHBondContact ND2-CE2 3.31Å; N76-F79 WeakPolarHBondContact O-CB 3.31Å; N76-F79 PolarHBondContact O-N 2.92Å; P77-F79 VanDerWaalsContact C-N 3.27Å; P77-F79 PolarHBondContact O-N 3.34Å; F79-N81 PolarHBondContact O-N 2.97Å; F79-D82 PolarHBondContact O-N 3.12Å; F79-A87 HydrophobicContact CD1-CB 3.21Å; F79-A87 HydrophobicContact CE1-CB 3.24Å; F79-I90 HydrophobicContact CZ-CD1 4.44Å
80	A	48.6	Very low	53.9	Low	75 Å²	75	95 Å²	95	62%	0.62	48%	0.483	S	S	*	.	H	α-helix	trans	-63.5	-27.3	178.1	0	0	0	0	0	113.3	N76	N76-A80 PolarHBondContact O-N 3.16Å
81	N	51.8	Low	53.3	Low	151 Å²	151	91 Å²	91	81%	0.807	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	2.3	178.8	-75.2	-22.1	0	0	0	113.8	F79	F79-N81 PolarHBondContact O-N 2.97Å
82	D	50	Low	52.2	Low	55 Å²	55	90.4 Å²	90.4	29%	0.294	47%	0.468	S	S	.	.	S	Bend	trans	-129.4	145.2	-172.2	-93.8	-56.9	0	0	0	113	F79 R86	F79-D82 PolarHBondContact O-N 3.12Å; D82-R86 HydrophobicContact CB-CB 4.11Å; D82-R86 WeakPolarHBondContact OD1-CD 3.44Å; D82-R86 IonicContact OD1-CZ 3.88Å; D82-R86 IonicContact OD1-NE 3.75Å; D82-R86 IonicContact OD1-NH1 3.87Å; D82-R86 PolarHBondContact OD1-NH1 3.42Å; D82-R86 WeakPolarHBondContact OD2-CD 3.43Å; D82-R86 IonicContact OD2-CZ 3.45Å; D82-R86 IonicContact OD2-NE 3.09Å; D82-R86 IonicContact OD2-NH1 2.62Å; D82-R86 PolarHBondContact OD2-NH1 3.18Å
83	S	51.4	Low	51.2	Low	64 Å²	64	93.8 Å²	93.8	45%	0.448	48%	0.477	S	S	.	.			trans	-56	145.1	-179.5	72	0	0	0	0	110.7	K85 R86 A87	S83-K85 PolarHBondContact O-N 3.42Å; S83-R86 WeakPolarHBondContact O-CB 3.47Å; S83-R86 PolarHBondContact O-N 3.01Å; S83-R86 PolarHBondContact OG-N 3.49Å; S83-A87 PolarHBondContact O-N 3.49Å
84	P	50.8	Low	50.1	Low	100 Å²	100	95.1 Å²	95.1	65%	0.649	50%	0.502	S	S	*	.	H	α-helix	trans	-52.3	-14.7	170.6	-26.4	33	0	0	0	114.3	A87	P84-A87 WeakPolarHBondContact O-CB 3.06Å
85	K	49	Very low	49.1	Very low	165 Å²	165	100.2 Å²	100.2	72%	0.717	52%	0.521	S	S	*	.	H	α-helix	trans	-73.6	-36.6	171	-70.1	178.5	175.6	174.4	0	113.1	S83 A87 R89	S83-K85 PolarHBondContact O-N 3.42Å; K85-A87 VanDerWaalsContact C-N 3.34Å; K85-R89 PolarHBondContact O-N 3.2Å
86	R	47.5	Very low	48.5	Very low	132 Å²	132	98.6 Å²	98.6	50%	0.498	51%	0.511	S	S	.	.	H	α-helix	trans	-71.3	-37.7	178.2	-155.2	-176.3	178.9	-172.6	-6.3	110.2	D82 S83 V88 R89 I90	D82-R86 HydrophobicContact CB-CB 4.11Å; D82-R86 WeakPolarHBondContact OD1-CD 3.44Å; D82-R86 IonicContact OD1-CZ 3.88Å; D82-R86 IonicContact OD1-NE 3.75Å; D82-R86 IonicContact OD1-NH1 3.87Å; D82-R86 PolarHBondContact OD1-NH1 3.42Å; D82-R86 WeakPolarHBondContact OD2-CD 3.43Å; D82-R86 IonicContact OD2-CZ 3.45Å; D82-R86 IonicContact OD2-NE 3.09Å; D82-R86 IonicContact OD2-NH1 2.62Å; D82-R86 PolarHBondContact OD2-NH1 3.18Å; S83-R86 WeakPolarHBondContact O-CB 3.47Å; S83-R86 PolarHBondContact O-N 3.01Å; S83-R86 PolarHBondContact OG-N 3.49Å; R86-V88 VanDerWaalsContact C-N 3.31Å; R86-V88 PolarHBondContact O-N 3.42Å; R86-R89 WeakPolarHBondContact O-CA 3.48Å; R86-R89 WeakPolarHBondContact O-CB 3.44Å; R86-R89 PolarHBondContact O-N 3.13Å; R86-I90 HydrophobicContact CG-CD1 4.34Å; R86-I90 WeakPolarHBondContact O-CG1 3.34Å; R86-I90 PolarHBondContact O-N 3.42Å
87	A	48.9	Very low	48.2	Very low	4 Å²	4	100.6 Å²	100.6	3%	0.033	52%	0.521	C	S	.	.	H	α-helix	trans	-48.7	-51	171.6	0	0	0	0	0	113.3	L73 F79 S83 P84 K85 R89 V91	L73-A87 HydrophobicContact CD2-CB 4.05Å; F79-A87 HydrophobicContact CD1-CB 3.21Å; F79-A87 HydrophobicContact CE1-CB 3.24Å; S83-A87 PolarHBondContact O-N 3.49Å; P84-A87 WeakPolarHBondContact O-CB 3.06Å; K85-A87 VanDerWaalsContact C-N 3.34Å; A87-R89 VanDerWaalsContact C-N 3.32Å; A87-R89 PolarHBondContact O-N 3.48Å; A87-V91 WeakPolarHBondContact O-CG2 3.41Å; A87-V91 PolarHBondContact O-N 3.29Å
88	V	49.2	Very low	47.8	Very low	35 Å²	35	100.8 Å²	100.8	21%	0.212	52%	0.515	C	S	.	.	H	α-helix	trans	-73.9	-23.7	178.8	174.9	0	0	0	0	112.9	Y47 R86 R92	Y47-V88 HydrophobicContact CD2-CG1 4.21Å; Y47-V88 HydrophobicContact CE1-CG2 4.4Å; Y47-V88 HydrophobicContact CE2-CB 4.25Å; Y47-V88 HydrophobicContact CE2-CG1 3.9Å; Y47-V88 HydrophobicContact CE2-CG2 3.64Å; Y47-V88 VanDerWaalsContact CZ-CG2 3.46Å; Y47-V88 WeakPolarHBondContact OH-CG2 3.36Å; R86-V88 VanDerWaalsContact C-N 3.31Å; R86-V88 PolarHBondContact O-N 3.42Å; V88-R92 VanDerWaalsContact O-CB 3.31Å; V88-R92 WeakPolarHBondContact O-CB 3.25Å; V88-R92 WeakPolarHBondContact O-CG 3.26Å; V88-R92 PolarHBondContact O-N 3.49Å
89	R	48.5	Very low	47.6	Very low	180 Å²	180	99.8 Å²	99.8	68%	0.679	51%	0.509	S	S	*	.	H	α-helix	trans	-74.7	-39.6	176	-130.6	-179.8	-175.3	-168.1	1.2	112.4	K85 R86 A87 V91 R92 Y93	K85-R89 PolarHBondContact O-N 3.2Å; R86-R89 WeakPolarHBondContact O-CA 3.48Å; R86-R89 WeakPolarHBondContact O-CB 3.44Å; R86-R89 PolarHBondContact O-N 3.13Å; A87-R89 VanDerWaalsContact C-N 3.32Å; A87-R89 PolarHBondContact O-N 3.48Å; R89-V91 VanDerWaalsContact C-N 3.35Å; R89-R92 PolarHBondContact O-N 3.05Å; R89-Y93 HydrophobicContact CG-CD2 3.95Å; R89-Y93 HydrophobicContact CG-CE2 4.38Å; R89-Y93 PolarHBondContact O-N 3.43Å
90	I	51	Low	47.3	Very low	61 Å²	61	104.1 Å²	104.1	31%	0.313	53%	0.532	S	S	.	.	H	α-helix	trans	-63.5	-45.6	175.6	-65.5	165.4	0	0	0	109	F79 R86 R92 G94	F79-I90 HydrophobicContact CZ-CD1 4.44Å; R86-I90 HydrophobicContact CG-CD1 4.34Å; R86-I90 WeakPolarHBondContact O-CG1 3.34Å; R86-I90 PolarHBondContact O-N 3.42Å; I90-R92 PolarHBondContact O-N 3.25Å; I90-G94 PolarHBondContact O-N 3.13Å; I90-G94 VanDerWaalsContact O-N 3.17Å
91	V	51	Low	47.2	Very low	70 Å²	70	106.1 Å²	106.1	42%	0.424	53%	0.526	S	S	.	.	H	α-helix	trans	-64.1	-37	175.8	176.6	0	0	0	0	112.5	I36 A87 R89	I36-V91 HydrophobicContact CD1-CG1 4.13Å; A87-V91 WeakPolarHBondContact O-CG2 3.41Å; A87-V91 PolarHBondContact O-N 3.29Å; R89-V91 VanDerWaalsContact C-N 3.35Å
92	R	40.9	Very low	46.8	Very low	114 Å²	114	102.9 Å²	102.9	43%	0.43	51%	0.506	S	S	.	.	H	α-helix	trans	-82.7	-26	-178.4	-86.8	-171	179.3	-156.8	1.2	116.4	V88 R89 I90	V88-R92 VanDerWaalsContact O-CB 3.31Å; V88-R92 WeakPolarHBondContact O-CB 3.25Å; V88-R92 WeakPolarHBondContact O-CG 3.26Å; V88-R92 PolarHBondContact O-N 3.49Å; R89-R92 PolarHBondContact O-N 3.05Å; I90-R92 PolarHBondContact O-N 3.25Å
93	Y	43.4	Very low	46.6	Very low	151 Å²	151	106.5 Å²	106.5	59%	0.592	52%	0.523	S	S	*	.	H	α-helix	trans	-133.2	5.9	-165.1	-62.4	-73.7	0	0	0	114.5	R89 K95	R89-Y93 HydrophobicContact CG-CD2 3.95Å; R89-Y93 HydrophobicContact CG-CE2 4.38Å; R89-Y93 PolarHBondContact O-N 3.43Å; Y93-K95 PolarHBondContact O-N 3.38Å; Y93-K95 VanDerWaalsContact O-N 3.13Å
94	G	36.5	Very low	46.2	Very low	76 Å²	76	110.1 Å²	110.1	78%	0.784	53%	0.529	S	S	*	.			trans	52.8	38.8	172.7	0	0	0	0	0	113.6	I90	I90-G94 PolarHBondContact O-N 3.13Å; I90-G94 VanDerWaalsContact O-N 3.17Å
95	K	37.8	Very low	45.8	Very low	233 Å²	233	111 Å²	111	100%	1.013	52%	0.518	S	S	*	.			trans	-111.2	0	179.2	-79.8	-159.5	177.5	-172.1	0	112.2	Y93	Y93-K95 PolarHBondContact O-N 3.38Å; Y93-K95 VanDerWaalsContact O-N 3.13Å

Retrieved 95 of 95 residues in 48.3 ms (Link to these results)

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