G4M0M1_SCHMA Loading...

Phage protein

AlphaFold DB , UniProt , Accession G4M0M1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 85 aa.

						>G4M0M1_SCHMA|G4M0M1
MPKKIAFEFLDGSVAIKEYLNSFAMVEGVPVTIIKKTTQYWRNMKASKIKLNLVCSSPTSVSQGYFLPHKQLYKNTLKGIHGNSK
					

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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	28.1	Very low	31.7	Very low	230 Å²	230	133.3 Å²	133.3	100%	1.133	68%	0.677	S	S	*	*				0	126.4	0	-65.8	-175.7	177.9	0	0	108.8	K3	M1-K3 PolarHBondContact O-N 3.23Å
2	P	29.4	Very low	32.2	Very low	101 Å²	101	125.7 Å²	125.7	66%	0.656	66%	0.657	S	S	*	*			trans	-64.9	118.2	175.1	25.8	-30.7	0	0	0	109.2	K4	P2-K4 PolarHBondContact O-N 2.95Å
3	K	24.6	Very low	33	Very low	169 Å²	169	120.2 Å²	120.2	74%	0.735	64%	0.636	S	S	*	*			trans	-74.5	112.2	172.5	-78.8	-177.6	176.4	177.9	0	107.9	M1 I5	M1-K3 PolarHBondContact O-N 3.23Å; K3-I5 PolarHBondContact O-N 3.2Å
4	K	28	Very low	33.6	Very low	193 Å²	193	118.2 Å²	118.2	84%	0.839	63%	0.63	S	S	*	*			trans	-70.9	118.5	170.6	-70.8	-177.3	-178.7	177.9	0	107.8	P2	P2-K4 PolarHBondContact O-N 2.95Å
5	I	30.8	Very low	34.7	Very low	65 Å²	65	113.6 Å²	113.6	33%	0.333	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.6	103.9	169.5	-54.5	-179.8	0	0	0	105.5	K3 F7 Y65	K3-I5 PolarHBondContact O-N 3.2Å; I5-F7 HydrophobicContact CB-CE2 4.38Å; I5-F7 HydrophobicContact CG2-CD2 4.16Å; I5-F7 HydrophobicContact CG2-CE1 4.32Å; I5-F7 HydrophobicContact CG2-CE2 3.53Å; I5-F7 HydrophobicContact CG2-CZ 3.63Å; I5-Y65 HydrophobicContact CD1-CD1 4.33Å; I5-Y65 HydrophobicContact CD1-CE1 3.4Å; I5-Y65 VanDerWaalsContact CD1-CE1 3.4Å; I5-Y65 HydrophobicContact CG2-CE1 4.32Å
6	A	31.2	Very low	35.9	Very low	81 Å²	81	108.4 Å²	108.4	67%	0.669	59%	0.587	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-89.6	123.1	173.2	0	0	0	0	0	108
7	F	36.6	Very low	36.9	Very low	78 Å²	78	108.9 Å²	108.9	34%	0.342	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.4	116.9	167.5	-66.4	-83.9	0	0	0	107.8	I5 L53 Y65	I5-F7 HydrophobicContact CB-CE2 4.38Å; I5-F7 HydrophobicContact CG2-CD2 4.16Å; I5-F7 HydrophobicContact CG2-CE1 4.32Å; I5-F7 HydrophobicContact CG2-CE2 3.53Å; I5-F7 HydrophobicContact CG2-CZ 3.63Å; F7-L53 HydrophobicContact CD2-CD1 4.48Å; F7-L53 HydrophobicContact CE2-CD1 4.34Å; F7-Y65 HydrophobicContact CZ-CE1 4.23Å
8	E	32.3	Very low	37.9	Very low	155 Å²	155	110 Å²	110	72%	0.724	58%	0.583	S	S	*	*			trans	-84.5	113.4	163	-89.3	-172.5	151.5	0	0	108.1	L10	E8-L10 VanDerWaalsContact C-N 3.26Å; E8-L10 PolarHBondContact O-N 2.82Å
9	F	38	Very low	39.1	Very low	74 Å²	74	108.8 Å²	108.8	33%	0.325	57%	0.57	S	S	.	*			trans	-71.3	90.3	166.2	-75	-85.7	0	0	0	107.7	I16 I49 L51	F9-I16 HydrophobicContact CD1-CD1 4.22Å; F9-I16 HydrophobicContact CD1-CG1 3.86Å; F9-I16 HydrophobicContact CE1-CD1 4.09Å; F9-I16 HydrophobicContact CE1-CG1 3.43Å; F9-I16 VanDerWaalsContact CE1-CG1 3.43Å; F9-I16 HydrophobicContact CZ-CG1 4.37Å; F9-I49 WeakPolarHBondContact CD2-O 3.34Å; F9-L51 HydrophobicContact CE2-CB 4.47Å
10	L	32.6	Very low	40.2	Very low	144 Å²	144	104.5 Å²	104.5	75%	0.754	55%	0.548	S	S	*	.			trans	-65.4	137.1	164.1	-75	163.3	0	0	0	108	E8 G12	E8-L10 VanDerWaalsContact C-N 3.26Å; E8-L10 PolarHBondContact O-N 2.82Å; L10-G12 PolarHBondContact O-N 2.81Å
11	D	36.8	Very low	41	Very low	176 Å²	176	102.9 Å²	102.9	94%	0.941	54%	0.54	S	S	*	.	S	Bend	trans	-31.2	117.5	-175.9	-92	-60.9	0	0	0	113.8
12	G	37.7	Very low	42.3	Very low	42 Å²	42	95.5 Å²	95.5	43%	0.433	51%	0.511	S	S	.	.			trans	144.6	111.2	168.7	0	0	0	0	0	113.8	L10 V14 A15	L10-G12 PolarHBondContact O-N 2.81Å; G12-V14 PolarHBondContact O-N 3.07Å; G12-A15 PolarHBondContact O-N 3.23Å
13	S	42.4	Very low	43.6	Very low	55 Å²	55	91.9 Å²	91.9	39%	0.385	49%	0.485	S	S	.	.	H	α-helix	trans	-51	-8.1	168.3	60.3	0	0	0	0	115.9
14	V	42	Very low	45.1	Very low	92 Å²	92	84.3 Å²	84.3	56%	0.558	45%	0.454	S	S	*	.	H	α-helix	trans	-72.5	-44.1	177.4	-177.1	0	0	0	0	111.7	G12 I16 K17 E18	G12-V14 PolarHBondContact O-N 3.07Å; V14-I16 VanDerWaalsContact C-N 3.3Å; V14-I16 PolarHBondContact O-N 3.5Å; V14-K17 PolarHBondContact O-N 3.37Å; V14-E18 PolarHBondContact O-N 3.28Å
15	A	50	Low	46.3	Very low	49 Å²	49	83.4 Å²	83.4	41%	0.405	45%	0.454	S	S	.	.	H	α-helix	trans	-63	-35.8	-176.1	0	0	0	0	0	112.6	G12 K17 Y19	G12-A15 PolarHBondContact O-N 3.23Å; A15-K17 VanDerWaalsContact C-N 3.35Å; A15-Y19 WeakPolarHBondContact O-CB 3.18Å; A15-Y19 PolarHBondContact O-N 3.2Å
16	I	54.6	Low	47.3	Very low	30 Å²	30	84.5 Å²	84.5	15%	0.154	46%	0.464	C	S	.	.	H	α-helix	trans	-64.9	-40.5	175.2	-70	169.9	0	0	0	110.9	F9 V14 L20 T38 W41	F9-I16 HydrophobicContact CD1-CD1 4.22Å; F9-I16 HydrophobicContact CD1-CG1 3.86Å; F9-I16 HydrophobicContact CE1-CD1 4.09Å; F9-I16 HydrophobicContact CE1-CG1 3.43Å; F9-I16 VanDerWaalsContact CE1-CG1 3.43Å; F9-I16 HydrophobicContact CZ-CG1 4.37Å; V14-I16 VanDerWaalsContact C-N 3.3Å; V14-I16 PolarHBondContact O-N 3.5Å; I16-L20 HydrophobicContact CG2-CD1 3.63Å; I16-L20 HydrophobicContact CG2-CG 4.29Å; I16-L20 VanDerWaalsContact O-CB 3.26Å; I16-L20 WeakPolarHBondContact O-CB 3.26Å; I16-L20 WeakPolarHBondContact O-CG 3.21Å; I16-L20 PolarHBondContact O-N 3.22Å; I16-T38 HydrophobicContact CG2-CG2 4.35Å; I16-W41 HydrophobicContact CD1-CB 4.33Å
17	K	52.1	Low	48.4	Very low	118 Å²	118	84.3 Å²	84.3	51%	0.513	45%	0.449	S	S	.	.	H	α-helix	trans	-70.8	-41.6	-177.4	-164.8	-174.3	178.4	-166.5	0	111.2	V14 A15 N21 T38	V14-K17 PolarHBondContact O-N 3.37Å; A15-K17 VanDerWaalsContact C-N 3.35Å; K17-N21 VanDerWaalsContact O-CB 3.29Å; K17-N21 WeakPolarHBondContact O-CB 3.29Å; K17-N21 PolarHBondContact O-N 2.96Å; K17-T38 HydrophobicContact CB-CG2 4.5Å
18	E	54.8	Low	49	Very low	128 Å²	128	83.7 Å²	83.7	60%	0.598	47%	0.465	S	S	*	.	H	α-helix	trans	-66.8	-44.3	175.3	-72.7	-175.3	161.3	0	0	111.7	V14 L20 N21 S22	V14-E18 PolarHBondContact O-N 3.28Å; E18-L20 PolarHBondContact O-N 3.23Å; E18-N21 PolarHBondContact O-N 2.89Å; E18-S22 PolarHBondContact O-N 3.19Å; E18-S22 PolarHBondContact O-OG 3.29Å
19	Y	61.2	Low	49.8	Very low	87 Å²	87	77.2 Å²	77.2	34%	0.341	44%	0.436	S	S	.	.	H	α-helix	trans	-60.2	-46.9	175.7	175.5	-98.3	0	0	0	112.1	A15 S22 F23 H69	A15-Y19 WeakPolarHBondContact O-CB 3.18Å; A15-Y19 PolarHBondContact O-N 3.2Å; Y19-S22 PolarHBondContact O-N 3.14Å; Y19-F23 WeakPolarHBondContact O-CB 3.49Å; Y19-F23 PolarHBondContact O-N 2.83Å; Y19-H69 AromaticContact CZ-CE1 3.66Å; Y19-H69 PolarHBondContact OH-CE1 3.04Å; Y19-H69 PolarHBondContact OH-ND1 3.48Å; Y19-H69 PolarHBondContact OH-NE2 3.03Å
20	L	60.7	Low	50.4	Low	22 Å²	22	77.3 Å²	77.3	12%	0.115	44%	0.444	C	S	.	.	H	α-helix	trans	-65.4	-41.1	177.6	-73.1	170.8	0	0	0	111.2	I16 E18 F23 A24 I34 T37 T38	I16-L20 HydrophobicContact CG2-CD1 3.63Å; I16-L20 HydrophobicContact CG2-CG 4.29Å; I16-L20 VanDerWaalsContact O-CB 3.26Å; I16-L20 WeakPolarHBondContact O-CB 3.26Å; I16-L20 WeakPolarHBondContact O-CG 3.21Å; I16-L20 PolarHBondContact O-N 3.22Å; E18-L20 PolarHBondContact O-N 3.23Å; L20-F23 CarbonylContact O-C 3.58Å; L20-F23 WeakPolarHBondContact O-CA 3.35Å; L20-F23 WeakPolarHBondContact O-CB 3.45Å; L20-F23 PolarHBondContact O-N 3.44Å; L20-F23 VanDerWaalsContact O-N 3.17Å; L20-A24 PolarHBondContact O-N 2.91Å; L20-I34 VanDerWaalsContact C-CD1 3.46Å; L20-I34 HydrophobicContact CB-CB 4.27Å; L20-I34 HydrophobicContact CB-CD1 4.2Å; L20-I34 HydrophobicContact CB-CG1 4Å; L20-I34 HydrophobicContact CB-CG2 3.54Å; L20-I34 HydrophobicContact CD1-CG2 4.11Å; L20-I34 HydrophobicContact CG-CG2 4.44Å; L20-I34 WeakPolarHBondContact O-CD1 3.38Å; L20-T37 HydrophobicContact CD1-CG2 4.02Å; L20-T37 HydrophobicContact CD2-CG2 4.25Å; L20-T38 VanDerWaalsContact CD1-OG1 3.32Å; L20-T38 WeakPolarHBondContact CD1-OG1 3.48Å
21	N	56.4	Low	51.3	Low	71 Å²	71	74.5 Å²	74.5	38%	0.38	43%	0.432	S	S	.	.	H	α-helix	trans	-61.2	-45.3	175.9	-91.4	-3.5	0	0	0	112.3	K17 E18 F23 A24 M25	K17-N21 VanDerWaalsContact O-CB 3.29Å; K17-N21 WeakPolarHBondContact O-CB 3.29Å; K17-N21 PolarHBondContact O-N 2.96Å; E18-N21 PolarHBondContact O-N 2.89Å; N21-F23 VanDerWaalsContact C-N 3.26Å; N21-F23 PolarHBondContact O-N 3.29Å; N21-A24 PolarHBondContact O-N 3.47Å; N21-M25 PolarHBondContact O-N 3.23Å
22	S	56.7	Low	51.9	Low	75 Å²	75	70.9 Å²	70.9	52%	0.524	42%	0.417	S	S	.	.	H	α-helix	trans	-60.6	-39.1	173.9	-65.8	0	0	0	0	111.1	E18 Y19 M25 V26	E18-S22 PolarHBondContact O-N 3.19Å; E18-S22 PolarHBondContact O-OG 3.29Å; Y19-S22 PolarHBondContact O-N 3.14Å; S22-M25 PolarHBondContact O-N 3.39Å; S22-V26 WeakPolarHBondContact O-CB 3.32Å; S22-V26 WeakPolarHBondContact O-CG2 3.5Å; S22-V26 PolarHBondContact O-N 2.88Å; S22-V26 VanDerWaalsContact O-N 3.1Å
23	F	57.2	Low	52.6	Low	26 Å²	26	70.9 Å²	70.9	11%	0.114	41%	0.407	C	S	.	.	H	α-helix	trans	-64.2	-42.2	174.4	-178.2	-102.6	0	0	0	113	Y19 L20 N21 V26 E27 V29 H69 Y73	Y19-F23 WeakPolarHBondContact O-CB 3.49Å; Y19-F23 PolarHBondContact O-N 2.83Å; L20-F23 CarbonylContact O-C 3.58Å; L20-F23 WeakPolarHBondContact O-CA 3.35Å; L20-F23 WeakPolarHBondContact O-CB 3.45Å; L20-F23 PolarHBondContact O-N 3.44Å; L20-F23 VanDerWaalsContact O-N 3.17Å; N21-F23 VanDerWaalsContact C-N 3.26Å; N21-F23 PolarHBondContact O-N 3.29Å; F23-V26 PolarHBondContact O-N 3.05Å; F23-E27 HydrophobicContact CD2-CG 4.12Å; F23-E27 HydrophobicContact CE1-CB 4.49Å; F23-E27 HydrophobicContact CE2-CB 4.36Å; F23-E27 HydrophobicContact CE2-CG 3.61Å; F23-E27 HydrophobicContact CZ-CB 4.22Å; F23-E27 HydrophobicContact CZ-CG 3.86Å; F23-E27 WeakPolarHBondContact O-CB 3.47Å; F23-E27 PolarHBondContact O-N 3.44Å; F23-V29 HydrophobicContact CD1-CG2 4.12Å; F23-V29 HydrophobicContact CE1-CG2 3.64Å; F23-V29 HydrophobicContact CZ-CG2 4.37Å; F23-H69 AromaticContact CD2-ND1 3.39Å; F23-H69 WeakPolarHBondContact CD2-ND1 3.21Å; F23-H69 HydrophobicContact CE2-CB 3.72Å; F23-H69 AromaticContact CE2-CG 3.92Å; F23-H69 AromaticContact CE2-ND1 3.38Å; F23-H69 WeakPolarHBondContact CE2-ND1 3.2Å; F23-H69 HydrophobicContact CZ-CB 4.39Å; F23-Y73 HydrophobicContact CE1-CD2 4.18Å
24	A	54.5	Low	53.2	Low	10 Å²	10	68.6 Å²	68.6	8%	0.083	39%	0.39	C	S	.	.	H	α-helix	trans	-65.2	-39.1	175.1	0	0	0	0	0	113.3	L20 N21 V26 G28 V29 I34	L20-A24 PolarHBondContact O-N 2.91Å; N21-A24 PolarHBondContact O-N 3.47Å; A24-V26 PolarHBondContact O-N 3.43Å; A24-G28 CarbonylContact O-C 3.58Å; A24-G28 VanDerWaalsContact O-CA 3.24Å; A24-G28 WeakPolarHBondContact O-CA 3.38Å; A24-G28 PolarHBondContact O-N 3.01Å; A24-V29 HydrophobicContact CB-CB 4.26Å; A24-V29 WeakPolarHBondContact CB-O 3.38Å; A24-V29 PolarHBondContact O-N 3.42Å; A24-I34 HydrophobicContact CB-CD1 3.1Å; A24-I34 HydrophobicContact CB-CG1 4.25Å
25	M	53	Low	53.8	Low	173 Å²	173	71.4 Å²	71.4	85%	0.852	40%	0.395	S	S	*	.	H	α-helix	trans	-62.9	-37.2	176.7	-80.8	-171.1	160.8	0	0	111.4	N21 S22	N21-M25 PolarHBondContact O-N 3.23Å; S22-M25 PolarHBondContact O-N 3.39Å
26	V	53	Low	54.1	Low	88 Å²	88	75.7 Å²	75.7	53%	0.533	40%	0.404	S	S	.	.	H	α-helix	trans	-79.6	-40.2	-177.1	171.7	0	0	0	0	112.8	S22 F23 A24 F66	S22-V26 WeakPolarHBondContact O-CB 3.32Å; S22-V26 WeakPolarHBondContact O-CG2 3.5Å; S22-V26 PolarHBondContact O-N 2.88Å; S22-V26 VanDerWaalsContact O-N 3.1Å; F23-V26 PolarHBondContact O-N 3.05Å; A24-V26 PolarHBondContact O-N 3.43Å; V26-F66 HydrophobicContact CG1-CD2 4.3Å; V26-F66 HydrophobicContact CG1-CE2 3.16Å; V26-F66 HydrophobicContact CG1-CZ 3.38Å
27	E	52.9	Low	54.2	Low	77 Å²	77	74.6 Å²	74.6	36%	0.36	40%	0.399	S	S	.	.	H	α-helix	trans	-102.3	1.7	-175.2	-72.7	-93.5	167.7	0	0	113.6	F23 V29 F66	F23-E27 HydrophobicContact CD2-CG 4.12Å; F23-E27 HydrophobicContact CE1-CB 4.49Å; F23-E27 HydrophobicContact CE2-CB 4.36Å; F23-E27 HydrophobicContact CE2-CG 3.61Å; F23-E27 HydrophobicContact CZ-CB 4.22Å; F23-E27 HydrophobicContact CZ-CG 3.86Å; F23-E27 WeakPolarHBondContact O-CB 3.47Å; F23-E27 PolarHBondContact O-N 3.44Å; E27-V29 HydrophobicContact CB-CG2 3.64Å; E27-V29 PolarHBondContact O-N 3.23Å; E27-F66 WeakPolarHBondContact OE1-CE1 3.46Å
28	G	50.4	Low	54.4	Low	65 Å²	65	69.8 Å²	69.8	67%	0.67	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	24.1	-176.1	0	0	0	0	0	113.5	A24	A24-G28 CarbonylContact O-C 3.58Å; A24-G28 VanDerWaalsContact O-CA 3.24Å; A24-G28 WeakPolarHBondContact O-CA 3.38Å; A24-G28 PolarHBondContact O-N 3.01Å
29	V	49.9	Very low	54.6	Low	20 Å²	20	69.3 Å²	69.3	12%	0.121	38%	0.377	C	S	.	.			trans	-73	133.2	-176	-178.4	0	0	0	0	109.6	F23 A24 E27 V31 I33 Y73	F23-V29 HydrophobicContact CD1-CG2 4.12Å; F23-V29 HydrophobicContact CE1-CG2 3.64Å; F23-V29 HydrophobicContact CZ-CG2 4.37Å; A24-V29 HydrophobicContact CB-CB 4.26Å; A24-V29 WeakPolarHBondContact CB-O 3.38Å; A24-V29 PolarHBondContact O-N 3.42Å; E27-V29 HydrophobicContact CB-CG2 3.64Å; E27-V29 PolarHBondContact O-N 3.23Å; V29-V31 PolarHBondContact O-N 3.41Å; V29-I33 HydrophobicContact CG1-CB 4.19Å; V29-I33 HydrophobicContact CG1-CD1 4.34Å; V29-Y73 HydrophobicContact CG1-CE2 4.15Å
30	P	49.4	Very low	54.5	Low	75 Å²	75	67.7 Å²	67.7	49%	0.487	37%	0.371	S	S	.	.			trans	-58.4	130.4	177.9	-23.1	31.2	0	0	0	112.2	T32 I33	P30-T32 PolarHBondContact O-N 3.45Å; P30-I33 HydrophobicContact CB-CG1 4.47Å; P30-I33 HydrophobicContact CG-CD1 4.41Å; P30-I33 WeakPolarHBondContact O-CB 3.44Å; P30-I33 PolarHBondContact O-N 2.82Å
31	V	50.9	Low	54.3	Low	85 Å²	85	69.2 Å²	69.2	52%	0.515	38%	0.375	S	S	.	.	H	α-helix	trans	-54.7	-25.5	178.7	170.9	0	0	0	0	113	V29 I33 I34 K35	V29-V31 PolarHBondContact O-N 3.41Å; V31-I33 VanDerWaalsContact C-N 3.28Å; V31-I33 PolarHBondContact O-N 2.9Å; V31-I34 WeakPolarHBondContact O-CB 3.39Å; V31-I34 PolarHBondContact O-N 2.92Å; V31-K35 PolarHBondContact O-N 2.68Å
32	T	51.2	Low	54.3	Low	100 Å²	100	73.2 Å²	73.2	61%	0.613	39%	0.385	S	S	*	.	H	α-helix	trans	-60.6	-35.8	173.9	39.2	0	0	0	0	112.9	P30 K35 K36	P30-T32 PolarHBondContact O-N 3.45Å; T32-K35 PolarHBondContact O-N 3.5Å; T32-K36 PolarHBondContact O-N 2.98Å; T32-K36 VanDerWaalsContact O-N 3.16Å
33	I	51.8	Low	54.4	Low	43 Å²	43	75.7 Å²	75.7	22%	0.221	39%	0.392	C	S	.	.	H	α-helix	trans	-71.7	-41.1	178	-57.3	-175.4	0	0	0	109.6	V29 P30 V31 K35 K36 T37 Y73 L77	V29-I33 HydrophobicContact CG1-CB 4.19Å; V29-I33 HydrophobicContact CG1-CD1 4.34Å; P30-I33 HydrophobicContact CB-CG1 4.47Å; P30-I33 HydrophobicContact CG-CD1 4.41Å; P30-I33 WeakPolarHBondContact O-CB 3.44Å; P30-I33 PolarHBondContact O-N 2.82Å; V31-I33 VanDerWaalsContact C-N 3.28Å; V31-I33 PolarHBondContact O-N 2.9Å; I33-K35 VanDerWaalsContact C-N 3.33Å; I33-K35 PolarHBondContact O-N 3.47Å; I33-K36 PolarHBondContact O-N 3.24Å; I33-T37 WeakPolarHBondContact O-CB 3.24Å; I33-T37 PolarHBondContact O-N 2.92Å; I33-T37 PolarHBondContact O-OG1 3.34Å; I33-Y73 WeakPolarHBondContact CD1-OH 3.41Å; I33-Y73 HydrophobicContact CG2-CE2 3.81Å; I33-L77 HydrophobicContact CG2-CD2 4.39Å
34	I	55	Low	54.3	Low	7 Å²	7	78.8 Å²	78.8	4%	0.036	41%	0.408	C	S	.	.	H	α-helix	trans	-56.9	-46.7	173.7	-67.2	176.9	0	0	0	111.6	L20 A24 V31 K36 T37 T38	L20-I34 VanDerWaalsContact C-CD1 3.46Å; L20-I34 HydrophobicContact CB-CB 4.27Å; L20-I34 HydrophobicContact CB-CD1 4.2Å; L20-I34 HydrophobicContact CB-CG1 4Å; L20-I34 HydrophobicContact CB-CG2 3.54Å; L20-I34 HydrophobicContact CD1-CG2 4.11Å; L20-I34 HydrophobicContact CG-CG2 4.44Å; L20-I34 WeakPolarHBondContact O-CD1 3.38Å; A24-I34 HydrophobicContact CB-CD1 3.1Å; A24-I34 HydrophobicContact CB-CG1 4.25Å; V31-I34 WeakPolarHBondContact O-CB 3.39Å; V31-I34 PolarHBondContact O-N 2.92Å; I34-K36 VanDerWaalsContact C-N 3.34Å; I34-K36 PolarHBondContact O-N 2.87Å; I34-T37 PolarHBondContact O-N 3.37Å; I34-T38 WeakPolarHBondContact O-CB 3.44Å; I34-T38 PolarHBondContact O-N 3.37Å; I34-T38 PolarHBondContact O-OG1 3.07Å
35	K	53.7	Low	54	Low	150 Å²	150	87.3 Å²	87.3	65%	0.652	44%	0.443	S	S	*	.	H	α-helix	trans	-58.5	-46.9	177.6	-87.8	-176	174	178.9	0	111.3	V31 T32 I33 T38 Q39	V31-K35 PolarHBondContact O-N 2.68Å; T32-K35 PolarHBondContact O-N 3.5Å; I33-K35 VanDerWaalsContact C-N 3.33Å; I33-K35 PolarHBondContact O-N 3.47Å; K35-T38 PolarHBondContact O-N 2.92Å; K35-Q39 VanDerWaalsContact O-CB 3.25Å; K35-Q39 WeakPolarHBondContact O-CB 3.36Å; K35-Q39 PolarHBondContact O-N 3.28Å
36	K	57.4	Low	53.5	Low	139 Å²	139	81 Å²	81	60%	0.604	42%	0.419	S	S	*	.	H	α-helix	trans	-61.6	-45	177.4	-79.6	-173.7	174.9	-175.7	0	112.1	T32 I33 I34 Q39 Y40	T32-K36 PolarHBondContact O-N 2.98Å; T32-K36 VanDerWaalsContact O-N 3.16Å; I33-K36 PolarHBondContact O-N 3.24Å; I34-K36 VanDerWaalsContact C-N 3.34Å; I34-K36 PolarHBondContact O-N 2.87Å; K36-Q39 PolarHBondContact O-N 3.17Å; K36-Y40 WeakPolarHBondContact O-CB 3.25Å; K36-Y40 PolarHBondContact O-N 3.1Å
37	T	55.4	Low	52.8	Low	8 Å²	8	82.1 Å²	82.1	5%	0.049	43%	0.431	C	S	.	.	H	α-helix	trans	-64	-47.6	178.8	-55.8	0	0	0	0	111.3	L20 I33 I34 Q39 Y40 W41 T76	L20-T37 HydrophobicContact CD1-CG2 4.02Å; L20-T37 HydrophobicContact CD2-CG2 4.25Å; I33-T37 WeakPolarHBondContact O-CB 3.24Å; I33-T37 PolarHBondContact O-N 2.92Å; I33-T37 PolarHBondContact O-OG1 3.34Å; I34-T37 PolarHBondContact O-N 3.37Å; T37-Q39 VanDerWaalsContact C-N 3.29Å; T37-Q39 PolarHBondContact O-N 2.92Å; T37-Y40 WeakPolarHBondContact O-CB 3Å; T37-Y40 PolarHBondContact O-N 3.43Å; T37-W41 VanDerWaalsContact CG2-NE1 3.32Å; T37-W41 PolarHBondContact O-N 2.85Å; T37-T76 HydrophobicContact CG2-CG2 3.57Å
38	T	56.6	Low	52	Low	17 Å²	17	87.5 Å²	87.5	10%	0.104	45%	0.453	C	S	.	.	H	α-helix	trans	-60.4	-41	177.2	-47.3	0	0	0	0	111.3	I16 K17 L20 I34 K35 W41 R42	I16-T38 HydrophobicContact CG2-CG2 4.35Å; K17-T38 HydrophobicContact CB-CG2 4.5Å; L20-T38 VanDerWaalsContact CD1-OG1 3.32Å; L20-T38 WeakPolarHBondContact CD1-OG1 3.48Å; I34-T38 WeakPolarHBondContact O-CB 3.44Å; I34-T38 PolarHBondContact O-N 3.37Å; I34-T38 PolarHBondContact O-OG1 3.07Å; K35-T38 PolarHBondContact O-N 2.92Å; T38-W41 PolarHBondContact O-N 2.96Å; T38-R42 WeakPolarHBondContact O-CB 3.14Å; T38-R42 PolarHBondContact O-N 3.27Å
39	Q	58.5	Low	51.3	Low	118 Å²	118	86.2 Å²	86.2	55%	0.551	43%	0.43	S	S	*	.	H	α-helix	trans	-67.8	-40.4	177.8	-171.1	172.8	2.7	0	0	112	K35 K36 T37 R42 N43	K35-Q39 VanDerWaalsContact O-CB 3.25Å; K35-Q39 WeakPolarHBondContact O-CB 3.36Å; K35-Q39 PolarHBondContact O-N 3.28Å; K36-Q39 PolarHBondContact O-N 3.17Å; T37-Q39 VanDerWaalsContact C-N 3.29Å; T37-Q39 PolarHBondContact O-N 2.92Å; Q39-R42 PolarHBondContact O-N 3.4Å; Q39-N43 WeakPolarHBondContact O-CB 3.24Å; Q39-N43 PolarHBondContact O-N 3.42Å
40	Y	59.9	Low	50.7	Low	53 Å²	53	93 Å²	93	21%	0.208	46%	0.458	C	S	.	.	H	α-helix	trans	-59.7	-47.2	173.7	-179.2	-99.8	0	0	0	111.6	K36 T37 R42 N43 M44 G79 I80	K36-Y40 WeakPolarHBondContact O-CB 3.25Å; K36-Y40 PolarHBondContact O-N 3.1Å; T37-Y40 WeakPolarHBondContact O-CB 3Å; T37-Y40 PolarHBondContact O-N 3.43Å; Y40-R42 PolarHBondContact O-N 3.02Å; Y40-N43 PolarHBondContact O-N 2.87Å; Y40-M44 HydrophobicContact CD1-CE 4.16Å; Y40-M44 HydrophobicContact CE1-CE 3.2Å; Y40-M44 HydrophobicContact CE2-CE 4.46Å; Y40-M44 PolarHBondContact O-N 3.46Å; Y40-M44 VanDerWaalsContact O-N 3.07Å; Y40-M44 VanDerWaalsContact OH-CE 3.24Å; Y40-M44 WeakPolarHBondContact OH-CE 3.46Å; Y40-G79 PolarHBondContact OH-O 3.32Å; Y40-I80 HydrophobicContact CD1-CG1 4.36Å; Y40-I80 HydrophobicContact CD2-CG1 4.11Å; Y40-I80 HydrophobicContact CE2-CG1 4.5Å; Y40-I80 HydrophobicContact CG-CG1 4.03Å
41	W	56	Low	50	Low	53 Å²	53	90.9 Å²	90.9	20%	0.201	44%	0.442	C	S	.	.	H	α-helix	trans	-66.2	-36.4	177	-68.2	117.8	0	0	0	113	I16 T37 T38 M44 I49	I16-W41 HydrophobicContact CD1-CB 4.33Å; T37-W41 VanDerWaalsContact CG2-NE1 3.32Å; T37-W41 PolarHBondContact O-N 2.85Å; T38-W41 PolarHBondContact O-N 2.96Å; W41-M44 PolarHBondContact O-N 3.28Å; W41-I49 HydrophobicContact CD2-CD1 4.27Å; W41-I49 HydrophobicContact CE3-CD1 3.21Å; W41-I49 HydrophobicContact CE3-CG1 4.29Å; W41-I49 HydrophobicContact CH2-CD1 4.22Å; W41-I49 HydrophobicContact CH2-CG2 4.28Å; W41-I49 HydrophobicContact CZ3-CD1 3.18Å; W41-I49 HydrophobicContact CZ3-CG1 3.81Å; W41-I49 HydrophobicContact CZ3-CG2 4.16Å
42	R	56.2	Low	49	Very low	156 Å²	156	93.3 Å²	93.3	59%	0.589	45%	0.452	S	S	*	.	H	α-helix	trans	-61.9	-45.3	171.5	-87.9	-174.1	-179.5	-177.4	-2.6	112.1	T38 Q39 Y40 M44 K45	T38-R42 WeakPolarHBondContact O-CB 3.14Å; T38-R42 PolarHBondContact O-N 3.27Å; Q39-R42 PolarHBondContact O-N 3.4Å; Y40-R42 PolarHBondContact O-N 3.02Å; R42-M44 VanDerWaalsContact C-N 3.26Å; R42-M44 PolarHBondContact O-N 3.32Å; R42-K45 PolarHBondContact O-N 3.18Å
43	N	59.6	Low	48.1	Very low	126 Å²	126	89.9 Å²	89.9	67%	0.674	43%	0.43	S	S	*	.	H	α-helix	trans	-67	-29	-178.5	-79.1	1.9	0	0	0	112.6	Q39 Y40 K45	Q39-N43 WeakPolarHBondContact O-CB 3.24Å; Q39-N43 PolarHBondContact O-N 3.42Å; Y40-N43 PolarHBondContact O-N 2.87Å; N43-K45 PolarHBondContact O-N 3.16Å; N43-K45 VanDerWaalsContact O-N 3.14Å
44	M	54.8	Low	46.9	Very low	91 Å²	91	93.3 Å²	93.3	45%	0.448	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-11	176.2	-83.6	-128.4	-147.2	0	0	114.4	Y40 W41 R42 A46	Y40-M44 HydrophobicContact CD1-CE 4.16Å; Y40-M44 HydrophobicContact CE1-CE 3.2Å; Y40-M44 HydrophobicContact CE2-CE 4.46Å; Y40-M44 PolarHBondContact O-N 3.46Å; Y40-M44 VanDerWaalsContact O-N 3.07Å; Y40-M44 VanDerWaalsContact OH-CE 3.24Å; Y40-M44 WeakPolarHBondContact OH-CE 3.46Å; W41-M44 PolarHBondContact O-N 3.28Å; R42-M44 VanDerWaalsContact C-N 3.26Å; R42-M44 PolarHBondContact O-N 3.32Å; M44-A46 HydrophobicContact CB-CB 3.94Å; M44-A46 PolarHBondContact O-N 3.49Å
45	K	48.2	Very low	45.7	Very low	189 Å²	189	95.2 Å²	95.2	82%	0.822	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	43	32.4	-172	-72.8	-170.3	176.6	-178.4	0	112.2	R42 N43 S47	R42-K45 PolarHBondContact O-N 3.18Å; N43-K45 PolarHBondContact O-N 3.16Å; N43-K45 VanDerWaalsContact O-N 3.14Å; K45-S47 PolarHBondContact O-N 3.38Å
46	A	43.6	Very low	44.4	Very low	40 Å²	40	93.4 Å²	93.4	33%	0.331	47%	0.473	S	S	.	.			trans	-83.1	79.3	-167.8	0	0	0	0	0	109.3	M44 K48 I49	M44-A46 HydrophobicContact CB-CB 3.94Å; M44-A46 PolarHBondContact O-N 3.49Å; A46-K48 PolarHBondContact O-N 2.96Å; A46-K48 VanDerWaalsContact O-N 3.07Å; A46-I49 HydrophobicContact CB-CD1 3.65Å; A46-I49 HydrophobicContact CB-CG1 3.7Å
47	S	36.4	Very low	43	Very low	113 Å²	113	89.3 Å²	89.3	79%	0.79	46%	0.462	S	S	*	.	S	Bend	trans	-43.7	110	153.5	-52.3	0	0	0	0	108	K45	K45-S47 PolarHBondContact O-N 3.38Å
48	K	37.9	Very low	41.8	Very low	190 Å²	190	95.3 Å²	95.3	83%	0.826	50%	0.501	S	S	*	.			trans	63.7	84.8	176.1	-58.4	179.6	178.9	179.2	0	115.7	A46 K50	A46-K48 PolarHBondContact O-N 2.96Å; A46-K48 VanDerWaalsContact O-N 3.07Å; K48-K50 PolarHBondContact O-N 3.31Å
49	I	35.9	Very low	40.5	Very low	37 Å²	37	99.1 Å²	99.1	19%	0.19	52%	0.524	C	S	.	.			trans	-86.6	107.6	159.5	-63	140.8	0	0	0	108.2	F9 W41 A46 L51	F9-I49 WeakPolarHBondContact CD2-O 3.34Å; W41-I49 HydrophobicContact CD2-CD1 4.27Å; W41-I49 HydrophobicContact CE3-CD1 3.21Å; W41-I49 HydrophobicContact CE3-CG1 4.29Å; W41-I49 HydrophobicContact CH2-CD1 4.22Å; W41-I49 HydrophobicContact CH2-CG2 4.28Å; W41-I49 HydrophobicContact CZ3-CD1 3.18Å; W41-I49 HydrophobicContact CZ3-CG1 3.81Å; W41-I49 HydrophobicContact CZ3-CG2 4.16Å; A46-I49 HydrophobicContact CB-CD1 3.65Å; A46-I49 HydrophobicContact CB-CG1 3.7Å; I49-L51 HydrophobicContact CG2-CD1 3.97Å; I49-L51 PolarHBondContact O-N 3.44Å
50	K	35.3	Very low	39.1	Very low	163 Å²	163	98.3 Å²	98.3	71%	0.709	53%	0.531	S	S	*	.			trans	-77.3	100.2	164.9	-100	-177.3	177.4	175.9	0	108.5	K48 N52	K48-K50 PolarHBondContact O-N 3.31Å; K50-N52 PolarHBondContact O-N 2.89Å
51	L	35.1	Very low	37.6	Very low	30 Å²	30	102.8 Å²	102.8	16%	0.157	56%	0.564	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.7	94.7	177.4	-150.5	86	0	0	0	109.2	F9 I49 L53 L72	F9-L51 HydrophobicContact CE2-CB 4.47Å; I49-L51 HydrophobicContact CG2-CD1 3.97Å; I49-L51 PolarHBondContact O-N 3.44Å; L51-L53 HydrophobicContact CD2-CD1 3.71Å; L51-L53 HydrophobicContact CD2-CG 4.35Å; L51-L53 PolarHBondContact O-N 3.23Å; L51-L72 HydrophobicContact CD1-CD1 4.08Å; L51-L72 HydrophobicContact CD1-CD2 4.3Å; L51-L72 HydrophobicContact CD2-CD1 3.54Å; L51-L72 HydrophobicContact CD2-CD2 3.7Å; L51-L72 HydrophobicContact CD2-CG 4.23Å; L51-L72 HydrophobicContact CG-CD1 3.8Å; L51-L72 HydrophobicContact CG-CD2 4.48Å
52	N	30.2	Very low	36.1	Very low	136 Å²	136	104.4 Å²	104.4	73%	0.727	58%	0.584	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.3	94.4	174.3	-85.6	-30.6	0	0	0	110	K50	K50-N52 PolarHBondContact O-N 2.89Å
53	L	31.9	Very low	34.6	Very low	28 Å²	28	106.5 Å²	106.5	15%	0.147	60%	0.6	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.6	114	172.1	-86.7	145.9	0	0	0	110.1	F7 L51 P68 L72	F7-L53 HydrophobicContact CD2-CD1 4.48Å; F7-L53 HydrophobicContact CE2-CD1 4.34Å; L51-L53 HydrophobicContact CD2-CD1 3.71Å; L51-L53 HydrophobicContact CD2-CG 4.35Å; L51-L53 PolarHBondContact O-N 3.23Å; L53-P68 HydrophobicContact CD2-CB 3.67Å; L53-P68 HydrophobicContact CD2-CG 4.13Å; L53-L72 HydrophobicContact CD1-CD1 4.26Å; L53-L72 HydrophobicContact CD2-CD1 3.77Å; L53-L72 HydrophobicContact CG-CD1 3.89Å
54	V	27.8	Very low	33	Very low	115 Å²	115	103.2 Å²	103.2	70%	0.697	60%	0.596	S	S	*	*			trans	-96.3	112.2	168.2	-178.8	0	0	0	0	107.6
55	C	28.8	Very low	31.9	Very low	48 Å²	48	105.8 Å²	105.8	32%	0.324	60%	0.602	S	S	.	*			trans	-93.3	113.3	177	-154.6	0	0	0	0	109.2	P68	C55-P68 HydrophobicContact CB-CB 4.24Å; C55-P68 HydrophobicContact CB-CG 4.38Å
56	S	27	Very low	31.1	Very low	112 Å²	112	102.2 Å²	102.2	78%	0.783	59%	0.586	S	S	*	*			trans	-101.5	51.6	-176.2	-48.1	0	0	0	0	112.2
57	S	28	Very low	30.6	Very low	53 Å²	53	105.8 Å²	105.8	37%	0.371	60%	0.599	S	S	.	*			trans	-165.5	140.8	158.2	66.1	0	0	0	0	111.8	T59	S57-T59 PolarHBondContact O-N 2.9Å
58	P	29.7	Very low	31	Very low	134 Å²	134	101.7 Å²	101.7	87%	0.87	57%	0.57	S	S	*	*			trans	-93.6	80.5	172.1	35.7	-26.5	0	0	0	108.8
59	T	30.2	Very low	31.4	Very low	96 Å²	96	94 Å²	94	59%	0.589	54%	0.537	S	S	*	.			trans	-132.2	105	169.4	-6.7	0	0	0	0	109.1	S57	S57-T59 PolarHBondContact O-N 2.9Å
60	S	28	Very low	31.7	Very low	101 Å²	101	99.7 Å²	99.7	71%	0.706	56%	0.56	S	S	*	*			trans	56.6	82.8	165.9	-54.8	0	0	0	0	116.7	S62	S60-S62 PolarHBondContact O-N 3.33Å
61	V	28.6	Very low	32.3	Very low	147 Å²	147	97.5 Å²	97.5	89%	0.891	55%	0.552	S	S	*	*			trans	-76.2	73	152.1	-172.6	0	0	0	0	107.5
62	S	24.8	Very low	33	Very low	88 Å²	88	98.1 Å²	98.1	62%	0.615	56%	0.556	S	S	*	*	S	Bend	trans	-124.6	97.6	164.7	53.5	0	0	0	0	105.8	S60	S60-S62 PolarHBondContact O-N 3.33Å
63	Q	25.1	Very low	33.9	Very low	199 Å²	199	94.7 Å²	94.7	93%	0.93	53%	0.533	S	S	*	.	S	Bend	trans	53	97.1	174.4	-63.5	177.8	-55.9	0	0	115.7
64	G	25.6	Very low	34.8	Very low	57 Å²	57	99.4 Å²	99.4	59%	0.588	55%	0.553	S	S	*	*	S	Bend	trans	93.6	80.2	157.5	0	0	0	0	0	116.9	F66	G64-F66 PolarHBondContact O-N 2.92Å
65	Y	31.6	Very low	35.9	Very low	146 Å²	146	98.4 Å²	98.4	57%	0.573	54%	0.543	S	S	*	.			trans	23	92.9	141	-63.7	-96.9	0	0	0	118.3	I5 F7	I5-Y65 HydrophobicContact CD1-CD1 4.33Å; I5-Y65 HydrophobicContact CD1-CE1 3.4Å; I5-Y65 VanDerWaalsContact CD1-CE1 3.4Å; I5-Y65 HydrophobicContact CG2-CE1 4.32Å; F7-Y65 HydrophobicContact CZ-CE1 4.23Å
66	F	32.4	Very low	36.9	Very low	113 Å²	113	97 Å²	97	50%	0.496	53%	0.533	S	S	.	.			trans	-134.9	-4.2	177.5	-126.8	-86.2	0	0	0	118.9	V26 E27 G64	V26-F66 HydrophobicContact CG1-CD2 4.3Å; V26-F66 HydrophobicContact CG1-CE2 3.16Å; V26-F66 HydrophobicContact CG1-CZ 3.38Å; E27-F66 WeakPolarHBondContact OE1-CE1 3.46Å; G64-F66 PolarHBondContact O-N 2.92Å
67	L	32.8	Very low	37.9	Very low	115 Å²	115	94.3 Å²	94.3	60%	0.602	51%	0.51	S	S	*	.	S	Bend	trans	-113.8	-19.3	-172.7	-88.1	107.1	0	0	0	120
68	P	45.3	Very low	38.9	Very low	28 Å²	28	99.5 Å²	99.5	18%	0.182	53%	0.525	C	S	.	.	S	Bend	trans	-93.1	3.6	178	34.8	-32.6	0	0	0	114.6	L53 C55	L53-P68 HydrophobicContact CD2-CB 3.67Å; L53-P68 HydrophobicContact CD2-CG 4.13Å; C55-P68 HydrophobicContact CB-CB 4.24Å; C55-P68 HydrophobicContact CB-CG 4.38Å
69	H	45.1	Very low	39.9	Very low	27 Å²	27	94.3 Å²	94.3	13%	0.125	50%	0.496	C	S	.	.	H	α-helix	trans	-79.1	-31.7	-171.3	-80.4	-123.6	0	0	0	115.1	Y19 F23 Q71 L72 Y73	Y19-H69 AromaticContact CZ-CE1 3.66Å; Y19-H69 PolarHBondContact OH-CE1 3.04Å; Y19-H69 PolarHBondContact OH-ND1 3.48Å; Y19-H69 PolarHBondContact OH-NE2 3.03Å; F23-H69 AromaticContact CD2-ND1 3.39Å; F23-H69 WeakPolarHBondContact CD2-ND1 3.21Å; F23-H69 HydrophobicContact CE2-CB 3.72Å; F23-H69 AromaticContact CE2-CG 3.92Å; F23-H69 AromaticContact CE2-ND1 3.38Å; F23-H69 WeakPolarHBondContact CE2-ND1 3.2Å; F23-H69 HydrophobicContact CZ-CB 4.39Å; H69-Q71 VanDerWaalsContact C-N 3.27Å; H69-Q71 PolarHBondContact O-N 3.45Å; H69-L72 PolarHBondContact O-N 2.85Å; H69-Y73 WeakPolarHBondContact O-CB 3.45Å; H69-Y73 PolarHBondContact O-N 3.18Å
70	K	42.9	Very low	40.7	Very low	158 Å²	158	91.8 Å²	91.8	69%	0.687	48%	0.479	S	S	*	.	H	α-helix	trans	-61.4	-36.1	-179.2	-117.4	176.2	-174.4	170.5	0	112.6	K74	K70-K74 WeakPolarHBondContact O-CB 3.45Å; K70-K74 WeakPolarHBondContact O-CG 3.45Å; K70-K74 PolarHBondContact O-N 3.5Å
71	Q	46.8	Very low	41.5	Very low	116 Å²	116	94.1 Å²	94.1	54%	0.542	48%	0.478	S	S	.	.	H	α-helix	trans	-75.2	-38	-179.1	-158.7	66.2	19.9	0	0	111.6	H69 K74 N75	H69-Q71 VanDerWaalsContact C-N 3.27Å; H69-Q71 PolarHBondContact O-N 3.45Å; Q71-K74 PolarHBondContact O-N 3.38Å; Q71-N75 WeakPolarHBondContact O-CB 3.49Å; Q71-N75 VanDerWaalsContact O-CG 3.29Å; Q71-N75 PolarHBondContact O-N 3.48Å
72	L	49.7	Very low	42.2	Very low	43 Å²	43	90 Å²	90	23%	0.225	47%	0.465	C	S	.	.	H	α-helix	trans	-64.6	-45.6	175.7	-147.8	106.3	0	0	0	110.8	L51 L53 H69 K74 N75 T76	L51-L72 HydrophobicContact CD1-CD1 4.08Å; L51-L72 HydrophobicContact CD1-CD2 4.3Å; L51-L72 HydrophobicContact CD2-CD1 3.54Å; L51-L72 HydrophobicContact CD2-CD2 3.7Å; L51-L72 HydrophobicContact CD2-CG 4.23Å; L51-L72 HydrophobicContact CG-CD1 3.8Å; L51-L72 HydrophobicContact CG-CD2 4.48Å; L53-L72 HydrophobicContact CD1-CD1 4.26Å; L53-L72 HydrophobicContact CD2-CD1 3.77Å; L53-L72 HydrophobicContact CG-CD1 3.89Å; H69-L72 PolarHBondContact O-N 2.85Å; L72-K74 PolarHBondContact O-N 3.43Å; L72-N75 PolarHBondContact O-N 3Å; L72-T76 WeakPolarHBondContact O-CB 3.33Å; L72-T76 PolarHBondContact O-N 3.46Å; L72-T76 PolarHBondContact O-OG1 2.98Å
73	Y	49.9	Very low	43.1	Very low	64 Å²	64	92 Å²	92	25%	0.251	47%	0.47	S	S	.	.	H	α-helix	trans	-60.1	-43.3	174.5	-175.5	-105.2	0	0	0	112.3	F23 V29 I33 H69 N75 T76 L77	F23-Y73 HydrophobicContact CE1-CD2 4.18Å; V29-Y73 HydrophobicContact CG1-CE2 4.15Å; I33-Y73 WeakPolarHBondContact CD1-OH 3.41Å; I33-Y73 HydrophobicContact CG2-CE2 3.81Å; H69-Y73 WeakPolarHBondContact O-CB 3.45Å; H69-Y73 PolarHBondContact O-N 3.18Å; Y73-N75 PolarHBondContact O-N 2.85Å; Y73-T76 PolarHBondContact O-N 3.25Å; Y73-L77 HydrophobicContact CD1-CD1 3.7Å; Y73-L77 HydrophobicContact CD1-CG 4.43Å; Y73-L77 HydrophobicContact CE1-CD1 3.2Å; Y73-L77 HydrophobicContact CE1-CG 4.14Å; Y73-L77 HydrophobicContact CE2-CD1 4.29Å; Y73-L77 HydrophobicContact CE2-CG 4.43Å; Y73-L77 HydrophobicContact CG-CD1 4.43Å; Y73-L77 WeakPolarHBondContact O-CB 3.35Å; Y73-L77 WeakPolarHBondContact O-CG 2.98Å; Y73-L77 PolarHBondContact O-N 2.86Å
74	K	50.8	Low	43.5	Very low	128 Å²	128	87.1 Å²	87.1	56%	0.557	46%	0.457	S	S	*	.	H	α-helix	trans	-60.7	-42.1	173.2	-87.8	-177.3	175.7	-179.7	0	112.7	K70 Q71 L72 K78	K70-K74 WeakPolarHBondContact O-CB 3.45Å; K70-K74 WeakPolarHBondContact O-CG 3.45Å; K70-K74 PolarHBondContact O-N 3.5Å; Q71-K74 PolarHBondContact O-N 3.38Å; L72-K74 PolarHBondContact O-N 3.43Å; K74-K78 WeakPolarHBondContact O-CB 3.47Å; K74-K78 PolarHBondContact O-N 2.91Å
75	N	51.3	Low	44	Very low	94 Å²	94	97.5 Å²	97.5	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-70.8	-39	179.8	-73.2	-8.5	0	0	0	111.8	Q71 L72 Y73 K78 G79	Q71-N75 WeakPolarHBondContact O-CB 3.49Å; Q71-N75 VanDerWaalsContact O-CG 3.29Å; Q71-N75 PolarHBondContact O-N 3.48Å; L72-N75 PolarHBondContact O-N 3Å; Y73-N75 PolarHBondContact O-N 2.85Å; N75-K78 PolarHBondContact O-N 3.3Å; N75-G79 PolarHBondContact O-N 2.9Å
76	T	49.2	Very low	44.6	Very low	19 Å²	19	95.1 Å²	95.1	12%	0.117	48%	0.482	C	S	.	.	H	α-helix	trans	-66.9	-42.8	174.3	-53.8	0	0	0	0	111.4	T37 L72 Y73 K78 G79 I80	T37-T76 HydrophobicContact CG2-CG2 3.57Å; L72-T76 WeakPolarHBondContact O-CB 3.33Å; L72-T76 PolarHBondContact O-N 3.46Å; L72-T76 PolarHBondContact O-OG1 2.98Å; Y73-T76 PolarHBondContact O-N 3.25Å; T76-K78 PolarHBondContact O-N 3.37Å; T76-G79 PolarHBondContact O-N 3.02Å; T76-I80 HydrophobicContact CG2-CD1 3.93Å; T76-I80 WeakPolarHBondContact O-CD1 3.1Å; T76-I80 WeakPolarHBondContact O-CG1 3.47Å; T76-I80 PolarHBondContact O-N 3.29Å
77	L	48	Very low	45.3	Very low	55 Å²	55	94.1 Å²	94.1	29%	0.288	48%	0.481	S	S	.	.	H	α-helix	trans	-63.8	-39.2	173	-80	176.8	0	0	0	112.3	I33 Y73 I80 H81	I33-L77 HydrophobicContact CG2-CD2 4.39Å; Y73-L77 HydrophobicContact CD1-CD1 3.7Å; Y73-L77 HydrophobicContact CD1-CG 4.43Å; Y73-L77 HydrophobicContact CE1-CD1 3.2Å; Y73-L77 HydrophobicContact CE1-CG 4.14Å; Y73-L77 HydrophobicContact CE2-CD1 4.29Å; Y73-L77 HydrophobicContact CE2-CG 4.43Å; Y73-L77 HydrophobicContact CG-CD1 4.43Å; Y73-L77 WeakPolarHBondContact O-CB 3.35Å; Y73-L77 WeakPolarHBondContact O-CG 2.98Å; Y73-L77 PolarHBondContact O-N 2.86Å; L77-I80 PolarHBondContact O-N 2.86Å; L77-H81 WeakPolarHBondContact O-CB 3.44Å; L77-H81 PolarHBondContact O-N 3.49Å
78	K	50	Low	45.9	Very low	161 Å²	161	92.9 Å²	92.9	70%	0.7	47%	0.474	S	S	*	.	H	α-helix	trans	-62.3	-40.8	172.3	-97.6	-173.7	170.9	-173.5	0	112	K74 N75 T76 I80 H81 G82	K74-K78 WeakPolarHBondContact O-CB 3.47Å; K74-K78 PolarHBondContact O-N 2.91Å; N75-K78 PolarHBondContact O-N 3.3Å; T76-K78 PolarHBondContact O-N 3.37Å; K78-I80 VanDerWaalsContact C-N 3.35Å; K78-H81 PolarHBondContact O-N 3.42Å; K78-G82 WeakPolarHBondContact O-CA 3.36Å; K78-G82 PolarHBondContact O-N 3.32Å
79	G	50.6	Low	46	Very low	25 Å²	25	96.8 Å²	96.8	26%	0.258	49%	0.491	S	S	.	.	H	α-helix	trans	-68.2	-32.6	175.8	0	0	0	0	0	113.4	Y40 N75 T76	Y40-G79 PolarHBondContact OH-O 3.32Å; N75-G79 PolarHBondContact O-N 2.9Å; T76-G79 PolarHBondContact O-N 3.02Å
80	I	45.3	Very low	46	Very low	43 Å²	43	101.1 Å²	101.1	22%	0.221	51%	0.514	C	S	.	.	H	α-helix	trans	-74.4	-39.9	174.8	-65.3	163.9	0	0	0	111.3	Y40 T76 L77 K78	Y40-I80 HydrophobicContact CD1-CG1 4.36Å; Y40-I80 HydrophobicContact CD2-CG1 4.11Å; Y40-I80 HydrophobicContact CE2-CG1 4.5Å; Y40-I80 HydrophobicContact CG-CG1 4.03Å; T76-I80 HydrophobicContact CG2-CD1 3.93Å; T76-I80 WeakPolarHBondContact O-CD1 3.1Å; T76-I80 WeakPolarHBondContact O-CG1 3.47Å; T76-I80 PolarHBondContact O-N 3.29Å; L77-I80 PolarHBondContact O-N 2.86Å; K78-I80 VanDerWaalsContact C-N 3.35Å
81	H	45.6	Very low	46.2	Very low	150 Å²	150	97.3 Å²	97.3	69%	0.694	50%	0.503	S	S	*	.	H	α-helix	trans	-79.4	-29.4	177.2	-100.7	87.7	0	0	0	113.6	L77 K78 N83 S84	L77-H81 WeakPolarHBondContact O-CB 3.44Å; L77-H81 PolarHBondContact O-N 3.49Å; K78-H81 PolarHBondContact O-N 3.42Å; H81-N83 VanDerWaalsContact C-N 3.3Å; H81-N83 PolarHBondContact O-N 2.86Å; H81-S84 PolarHBondContact O-N 2.76Å
82	G	43.8	Very low	46.2	Very low	60 Å²	60	96 Å²	96	62%	0.619	50%	0.5	S	S	*	.	H	α-helix	trans	-75.4	-14.3	-176	0	0	0	0	0	114.6	K78 S84	K78-G82 WeakPolarHBondContact O-CA 3.36Å; K78-G82 PolarHBondContact O-N 3.32Å; G82-S84 VanDerWaalsContact C-N 3.32Å
83	N	43.2	Very low	45.9	Very low	132 Å²	132	100.1 Å²	100.1	71%	0.706	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	13.7	172.9	-99.5	-8.3	0	0	0	113.2	H81	H81-N83 VanDerWaalsContact C-N 3.3Å; H81-N83 PolarHBondContact O-N 2.86Å
84	S	33.5	Very low	45.6	Very low	96 Å²	96	103.1 Å²	103.1	67%	0.671	54%	0.544	S	S	*	.			trans	-104.6	58.7	175.6	-167.7	0	0	0	0	111.1	H81 G82	H81-S84 PolarHBondContact O-N 2.76Å; G82-S84 VanDerWaalsContact C-N 3.32Å
85	K	35.9	Very low	45.1	Very low	274 Å²	274	100.8 Å²	100.8	100%	1.191	54%	0.542	S	S	*	.			trans	-173.9	0	150.7	-110.4	179.8	-176.8	-170.9	0	110.9

Retrieved 85 of 85 residues in 15 ms (Link to these results)

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