A0A5K4F6X7_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4F6X7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 73 aa.

						>A0A5K4F6X7_SCHMA|A0A5K4F6X7
MNIITIIIIDTFVVFNNDFTEQISFASLCSQNVLVKPSFLNNQNHIIVIIIINCTKSILFFHHKFHAHYSNDA
					

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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)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51	Low	48	Very low	221 Å²	221	93.7 Å²	93.7	100%	1.089	49%	0.49	S	S	*	.				0	116.2	0	-172.3	171.6	156.3	0	106.4
2	N	48.3	Very low	48	Very low	106 Å²	106	89.5 Å²	89.5	57%	0.567	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-77.1	130.9	-176.6	-65.4	-19.4	0	0	109
3	I	46.5	Very low	47.4	Very low	90 Å²	90	89.2 Å²	89.2	46%	0.462	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	119.8	174	-63	171.3	0	0	106.6	N44 H45 I46	I3-N44 PolarHBondContact N-O 2.91Å; I3-H45 WeakPolarHBondContact O-CA 3.36Å; I3-I46 PolarHBondContact O-N 3.33Å; I3-I46 VanDerWaalsContact O-N 3.11Å
4	I	52.5	Low	46.9	Very low	106 Å²	106	85.1 Å²	85.1	54%	0.544	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	117.3	173.9	-57	175.8	0	0	107.1	I6 I46 V48	I4-I6 HydrophobicContact CG2-CG1 4.15Å; I4-I46 WeakPolarHBondContact CA-O 3.36Å; I4-I46 HydrophobicContact CG1-CB 4.45Å; I4-V48 HydrophobicContact CG2-CG2 4.08Å
5	T	40	Very low	46.3	Very low	50 Å²	50	90.5 Å²	90.5	31%	0.307	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	116.2	175.5	-54.4	0	0	0	108.4	I7 I46 I47 V48	T5-I7 HydrophobicContact CG2-CG1 4.13Å; T5-I46 PolarHBondContact N-O 3.28Å; T5-I47 HydrophobicContact CG2-CD1 4.23Å; T5-I47 CarbonylContact O-C 3.6Å; T5-I47 VanDerWaalsContact O-CA 3.25Å; T5-I47 WeakPolarHBondContact O-CA 3.4Å; T5-V48 PolarHBondContact O-N 2.93Å
6	I	47.4	Very low	45.5	Very low	102 Å²	102	91.4 Å²	91.4	52%	0.523	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	120.1	176.4	-54.3	176.3	0	0	107.6	I4 I8 V48 I50	I4-I6 HydrophobicContact CG2-CG1 4.15Å; I6-I8 HydrophobicContact CG2-CG1 4.17Å; I6-V48 CarbonylContact C-O 3.58Å; I6-V48 WeakPolarHBondContact CA-O 3.25Å; I6-V48 HydrophobicContact CG1-CB 4.16Å; I6-V48 HydrophobicContact CG1-CG2 4.47Å; I6-V48 HydrophobicContact CG2-CB 4.43Å; I6-V48 HydrophobicContact CG2-CG1 4.33Å; I6-I50 HydrophobicContact CG2-CD1 4Å; I6-I50 HydrophobicContact CG2-CG1 4.46Å
7	I	50	Low	45.3	Very low	70 Å²	70	95.8 Å²	95.8	36%	0.359	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	115	175.8	-56	178.4	0	0	107	T5 I9 I47 V48 I49 I50	T5-I7 HydrophobicContact CG2-CG1 4.13Å; I7-I9 HydrophobicContact CG2-CD1 4.19Å; I7-I9 HydrophobicContact CG2-CG1 3.83Å; I7-I47 HydrophobicContact CD1-CG2 3.85Å; I7-I47 HydrophobicContact CG1-CG2 4.11Å; I7-V48 PolarHBondContact N-O 3.43Å; I7-I49 WeakPolarHBondContact O-CA 3.36Å; I7-I50 PolarHBondContact O-N 2.91Å
8	I	48.7	Very low	45	Very low	107 Å²	107	95.3 Å²	95.3	55%	0.549	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	121.2	175.5	-59.3	177.5	0	0	107.6	I6 I50 I52	I6-I8 HydrophobicContact CG2-CG1 4.17Å; I8-I50 CarbonylContact C-O 3.6Å; I8-I50 WeakPolarHBondContact CA-O 3.15Å; I8-I50 HydrophobicContact CG1-CB 4.42Å; I8-I52 HydrophobicContact CG2-CD1 3.35Å; I8-I52 HydrophobicContact CG2-CG1 3.82Å
9	I	52.9	Low	44.7	Very low	43 Å²	43	96.1 Å²	96.1	22%	0.221	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	112.5	179.4	-55.7	-178.8	0	0	107.6	I7 T11 I49 I50 I51 I52	I7-I9 HydrophobicContact CG2-CD1 4.19Å; I7-I9 HydrophobicContact CG2-CG1 3.83Å; I9-T11 WeakPolarHBondContact CG2-O 3.34Å; I9-I49 HydrophobicContact CD1-CG2 3.83Å; I9-I49 HydrophobicContact CG1-CG2 4.27Å; I9-I50 PolarHBondContact N-O 3.23Å; I9-I51 CarbonylContact O-C 3.58Å; I9-I51 VanDerWaalsContact O-CA 3.23Å; I9-I51 WeakPolarHBondContact O-CA 3.15Å; I9-I52 PolarHBondContact O-N 3.26Å
10	D	46.6	Very low	44.5	Very low	82 Å²	82	96.8 Å²	96.8	44%	0.439	51%	0.505	S	S	.	.	S	Bend	trans	-71	-42.1	175.4	-177.2	68	0	0	110.5	N53	D10-N53 CarbonylContact O-C 3.53Å; D10-N53 VanDerWaalsContact O-CA 3.31Å; D10-N53 WeakPolarHBondContact O-CA 3.47Å; D10-N53 WeakPolarHBondContact O-CB 3.11Å; D10-N53 PolarHBondContact O-N 3.22Å; D10-N53 VanDerWaalsContact OD1-CB 3.25Å; D10-N53 WeakPolarHBondContact OD1-CB 3.5Å; D10-N53 PolarHBondContact OD1-ND2 3.5Å
11	T	44.5	Very low	44.3	Very low	54 Å²	54	97.4 Å²	97.4	33%	0.331	51%	0.505	S	S	.	.			trans	-130.4	127.6	-176.9	-57.7	0	0	0	111.1	I9 V13	I9-T11 WeakPolarHBondContact CG2-O 3.34Å; T11-V13 HydrophobicContact CG2-CG2 4.16Å
12	F	47.5	Very low	43.8	Very low	43 Å²	43	88 Å²	88	19%	0.189	46%	0.459	C	S	.	.			trans	-92.6	108.1	173	-154.1	-85.2	0	0	109.3	V14 F25 I51 S57	F12-V14 HydrophobicContact CD1-CB 4.21Å; F12-V14 HydrophobicContact CD1-CG2 3.4Å; F12-V14 VanDerWaalsContact CD1-CG2 3.4Å; F12-V14 HydrophobicContact CE1-CB 4.01Å; F12-V14 HydrophobicContact CE1-CG1 4.07Å; F12-V14 HydrophobicContact CE1-CG2 3.48Å; F12-V14 VanDerWaalsContact CE1-CG2 3.48Å; F12-F25 HydrophobicContact CD1-CB 4.24Å; F12-F25 HydrophobicContact CD1-CG 4.49Å; F12-F25 HydrophobicContact CD2-CD1 4.31Å; F12-F25 HydrophobicContact CD2-CG 4.49Å; F12-F25 HydrophobicContact CE1-CB 3.97Å; F12-F25 HydrophobicContact CE1-CD1 4.38Å; F12-F25 AromaticContact CE1-CD2 3.8Å; F12-F25 HydrophobicContact CE1-CD2 3.8Å; F12-F25 HydrophobicContact CE1-CE2 4.43Å; F12-F25 AromaticContact CE1-CG 3.79Å; F12-F25 HydrophobicContact CE1-CG 3.79Å; F12-F25 HydrophobicContact CE2-CB 4.3Å; F12-F25 AromaticContact CE2-CD1 3.51Å; F12-F25 HydrophobicContact CE2-CD1 3.51Å; F12-F25 HydrophobicContact CE2-CD2 4.29Å; F12-F25 AromaticContact CE2-CE1 3.84Å; F12-F25 HydrophobicContact CE2-CE1 3.84Å; F12-F25 AromaticContact CE2-CG 3.77Å; F12-F25 HydrophobicContact CE2-CG 3.77Å; F12-F25 HydrophobicContact CE2-CZ 4.37Å; F12-F25 HydrophobicContact CZ-CB 3.99Å; F12-F25 AromaticContact CZ-CD1 3.55Å; F12-F25 HydrophobicContact CZ-CD1 3.55Å; F12-F25 AromaticContact CZ-CD2 3.46Å; F12-F25 HydrophobicContact CZ-CD2 3.46Å; F12-F25 VanDerWaalsContact CZ-CD2 3.46Å; F12-F25 AromaticContact CZ-CE1 3.84Å; F12-F25 HydrophobicContact CZ-CE1 3.84Å; F12-F25 AromaticContact CZ-CE2 3.77Å; F12-F25 HydrophobicContact CZ-CE2 3.77Å; F12-F25 AromaticContact CZ-CG 3.37Å; F12-F25 HydrophobicContact CZ-CG 3.37Å; F12-F25 AromaticContact CZ-CZ 3.95Å; F12-F25 HydrophobicContact CZ-CZ 3.95Å; F12-I51 HydrophobicContact CD2-CD1 4.39Å; F12-S57 PolarHBondContact N-OG 3.4Å
13	V	40.8	Very low	43.5	Very low	86 Å²	86	88.5 Å²	88.5	52%	0.521	46%	0.46	S	S	.	.			trans	-99.1	100.5	167.7	-174.5	0	0	0	106.8	T11 F15	T11-V13 HydrophobicContact CG2-CG2 4.16Å; V13-F15 HydrophobicContact CB-CD2 4.35Å; V13-F15 HydrophobicContact CB-CE2 3.89Å; V13-F15 HydrophobicContact CG1-CD2 3.87Å; V13-F15 HydrophobicContact CG1-CE1 4.34Å; V13-F15 HydrophobicContact CG1-CE2 3.34Å; V13-F15 HydrophobicContact CG1-CZ 3.61Å; V13-F15 WeakPolarHBondContact O-CD2 3.37Å; V13-F15 PolarHBondContact O-N 3.11Å
14	V	40.1	Very low	43.5	Very low	32 Å²	32	87 Å²	87	19%	0.194	46%	0.457	C	S	.	.			trans	-73.8	112.9	177	-157.6	0	0	0	108	F12 Q22 F61	F12-V14 HydrophobicContact CD1-CB 4.21Å; F12-V14 HydrophobicContact CD1-CG2 3.4Å; F12-V14 VanDerWaalsContact CD1-CG2 3.4Å; F12-V14 HydrophobicContact CE1-CB 4.01Å; F12-V14 HydrophobicContact CE1-CG1 4.07Å; F12-V14 HydrophobicContact CE1-CG2 3.48Å; F12-V14 VanDerWaalsContact CE1-CG2 3.48Å; V14-Q22 HydrophobicContact CB-CG 4.21Å; V14-Q22 HydrophobicContact CG1-CG 3.76Å; V14-Q22 HydrophobicContact CG2-CB 4.48Å; V14-Q22 HydrophobicContact CG2-CG 4.2Å; V14-F61 HydrophobicContact CB-CZ 3.73Å; V14-F61 HydrophobicContact CG2-CE1 4.49Å; V14-F61 HydrophobicContact CG2-CE2 3.81Å; V14-F61 HydrophobicContact CG2-CZ 3.4Å
15	F	37.2	Very low	43.2	Very low	166 Å²	166	84.2 Å²	84.2	73%	0.728	44%	0.441	S	S	*	.			trans	-100.7	76.1	166.7	-69	-85.7	0	0	108.3	V13	V13-F15 HydrophobicContact CB-CD2 4.35Å; V13-F15 HydrophobicContact CB-CE2 3.89Å; V13-F15 HydrophobicContact CG1-CD2 3.87Å; V13-F15 HydrophobicContact CG1-CE1 4.34Å; V13-F15 HydrophobicContact CG1-CE2 3.34Å; V13-F15 HydrophobicContact CG1-CZ 3.61Å; V13-F15 WeakPolarHBondContact O-CD2 3.37Å; V13-F15 PolarHBondContact O-N 3.11Å
16	N	34.7	Very low	43.6	Very low	104 Å²	104	84 Å²	84	56%	0.556	45%	0.445	S	S	*	.			trans	-165.4	142.2	162.9	-118	-10.1	0	0	113	D18 Q22	N16-D18 PolarHBondContact O-N 3Å; N16-D18 VanDerWaalsContact O-N 3.09Å; N16-Q22 PolarHBondContact O-NE2 3.39Å
17	N	40.9	Very low	43.5	Very low	167 Å²	167	81.2 Å²	81.2	89%	0.893	43%	0.434	S	S	*	.	S	Bend	trans	-67.8	-2.4	-179.9	-75.6	-10.2	0	0	114.2	F19	N17-F19 PolarHBondContact O-N 2.8Å
18	D	39.8	Very low	43.4	Very low	87 Å²	87	78.8 Å²	78.8	47%	0.465	42%	0.422	S	S	.	.			trans	-92.8	92.2	-177.9	-147.4	-34.2	0	0	110.7	N16 T20 E21	N16-D18 PolarHBondContact O-N 3Å; N16-D18 VanDerWaalsContact O-N 3.09Å; D18-T20 PolarHBondContact O-N 3.22Å; D18-T20 VanDerWaalsContact O-N 3.08Å; D18-T20 PolarHBondContact OD1-OG1 2.85Å; D18-E21 PolarHBondContact O-N 2.92Å
19	F	40.2	Very low	43.4	Very low	109 Å²	109	74.7 Å²	74.7	48%	0.478	40%	0.402	S	S	.	.	H	α-helix	trans	-53.3	-26.3	-179.9	-104.4	-90	0	0	113.9	N17 E21 Q22 I23 F65	N17-F19 PolarHBondContact O-N 2.8Å; F19-E21 PolarHBondContact O-N 2.86Å; F19-Q22 WeakPolarHBondContact O-CB 3.49Å; F19-Q22 PolarHBondContact O-N 2.79Å; F19-I23 PolarHBondContact O-N 3.46Å; F19-F65 HydrophobicContact CE2-CE2 4.07Å; F19-F65 HydrophobicContact CE2-CZ 4.07Å; F19-F65 AromaticContact CZ-CE2 3.55Å; F19-F65 HydrophobicContact CZ-CE2 3.55Å; F19-F65 AromaticContact CZ-CZ 3.58Å; F19-F65 HydrophobicContact CZ-CZ 3.58Å
20	T	40	Very low	43.2	Very low	111 Å²	111	77.3 Å²	77.3	68%	0.681	43%	0.425	S	S	*	.	H	α-helix	trans	-66.1	-39.7	-175.5	-20	0	0	0	111.9	D18	D18-T20 PolarHBondContact O-N 3.22Å; D18-T20 VanDerWaalsContact O-N 3.08Å; D18-T20 PolarHBondContact OD1-OG1 2.85Å
21	E	40.4	Very low	43.2	Very low	109 Å²	109	79.8 Å²	79.8	51%	0.509	43%	0.434	S	S	.	.	H	α-helix	trans	-73.5	-32.1	174.2	-66.1	-169.7	162.9	0	111.4	D18 F19 I23 S24 F25	D18-E21 PolarHBondContact O-N 2.92Å; F19-E21 PolarHBondContact O-N 2.86Å; E21-I23 PolarHBondContact O-N 3.16Å; E21-S24 WeakPolarHBondContact O-CB 3.47Å; E21-S24 PolarHBondContact O-N 3.16Å; E21-F25 HydrophobicContact CB-CE2 4.49Å; E21-F25 WeakPolarHBondContact O-CD2 3.25Å; E21-F25 PolarHBondContact O-N 3.17Å
22	Q	39.9	Very low	43.2	Very low	25 Å²	25	84.7 Å²	84.7	12%	0.117	46%	0.458	C	S	.	.	H	α-helix	trans	-61.3	-46.1	-179.1	-60.1	173.3	13.7	0	112.6	V14 N16 F19 S24 F25 A26	V14-Q22 HydrophobicContact CB-CG 4.21Å; V14-Q22 HydrophobicContact CG1-CG 3.76Å; V14-Q22 HydrophobicContact CG2-CB 4.48Å; V14-Q22 HydrophobicContact CG2-CG 4.2Å; N16-Q22 PolarHBondContact O-NE2 3.39Å; F19-Q22 WeakPolarHBondContact O-CB 3.49Å; F19-Q22 PolarHBondContact O-N 2.79Å; Q22-S24 VanDerWaalsContact C-N 3.27Å; Q22-S24 PolarHBondContact O-N 3.22Å; Q22-F25 PolarHBondContact O-N 3.02Å; Q22-A26 PolarHBondContact O-N 3.35Å
23	I	44	Very low	43	Very low	116 Å²	116	84.9 Å²	84.9	60%	0.595	46%	0.462	S	S	*	.	H	α-helix	trans	-64.9	-37	-180	-64.2	171.6	0	0	110.4	F19 E21 A26 S27	F19-I23 PolarHBondContact O-N 3.46Å; E21-I23 PolarHBondContact O-N 3.16Å; I23-A26 PolarHBondContact O-N 3.19Å; I23-S27 WeakPolarHBondContact O-CB 2.95Å; I23-S27 PolarHBondContact O-N 3.1Å; I23-S27 PolarHBondContact O-OG 3.09Å
24	S	45.3	Very low	43	Very low	58 Å²	58	85.9 Å²	85.9	41%	0.406	46%	0.464	S	S	.	.	H	α-helix	trans	-55.8	-55.7	174.2	-167.4	0	0	0	109.3	E21 Q22 A26 S27 L28	E21-S24 WeakPolarHBondContact O-CB 3.47Å; E21-S24 PolarHBondContact O-N 3.16Å; Q22-S24 VanDerWaalsContact C-N 3.27Å; Q22-S24 PolarHBondContact O-N 3.22Å; S24-A26 PolarHBondContact O-N 3.49Å; S24-S27 WeakPolarHBondContact O-CB 3.31Å; S24-S27 PolarHBondContact O-N 3.13Å; S24-S27 PolarHBondContact O-OG 3.05Å; S24-L28 WeakPolarHBondContact O-CG 3.14Å; S24-L28 PolarHBondContact O-N 3.28Å
25	F	47.1	Very low	43.4	Very low	47 Å²	47	85.6 Å²	85.6	21%	0.206	46%	0.462	C	S	.	.	H	α-helix	trans	-62.6	-39.8	-179.1	-68.5	-71.3	0	0	115.1	F12 E21 Q22 S27 L28 C29 V35	F12-F25 HydrophobicContact CD1-CB 4.24Å; F12-F25 HydrophobicContact CD1-CG 4.49Å; F12-F25 HydrophobicContact CD2-CD1 4.31Å; F12-F25 HydrophobicContact CD2-CG 4.49Å; F12-F25 HydrophobicContact CE1-CB 3.97Å; F12-F25 HydrophobicContact CE1-CD1 4.38Å; F12-F25 AromaticContact CE1-CD2 3.8Å; F12-F25 HydrophobicContact CE1-CD2 3.8Å; F12-F25 HydrophobicContact CE1-CE2 4.43Å; F12-F25 AromaticContact CE1-CG 3.79Å; F12-F25 HydrophobicContact CE1-CG 3.79Å; F12-F25 HydrophobicContact CE2-CB 4.3Å; F12-F25 AromaticContact CE2-CD1 3.51Å; F12-F25 HydrophobicContact CE2-CD1 3.51Å; F12-F25 HydrophobicContact CE2-CD2 4.29Å; F12-F25 AromaticContact CE2-CE1 3.84Å; F12-F25 HydrophobicContact CE2-CE1 3.84Å; F12-F25 AromaticContact CE2-CG 3.77Å; F12-F25 HydrophobicContact CE2-CG 3.77Å; F12-F25 HydrophobicContact CE2-CZ 4.37Å; F12-F25 HydrophobicContact CZ-CB 3.99Å; F12-F25 AromaticContact CZ-CD1 3.55Å; F12-F25 HydrophobicContact CZ-CD1 3.55Å; F12-F25 AromaticContact CZ-CD2 3.46Å; F12-F25 HydrophobicContact CZ-CD2 3.46Å; F12-F25 VanDerWaalsContact CZ-CD2 3.46Å; F12-F25 AromaticContact CZ-CE1 3.84Å; F12-F25 HydrophobicContact CZ-CE1 3.84Å; F12-F25 AromaticContact CZ-CE2 3.77Å; F12-F25 HydrophobicContact CZ-CE2 3.77Å; F12-F25 AromaticContact CZ-CG 3.37Å; F12-F25 HydrophobicContact CZ-CG 3.37Å; F12-F25 AromaticContact CZ-CZ 3.95Å; F12-F25 HydrophobicContact CZ-CZ 3.95Å; E21-F25 HydrophobicContact CB-CE2 4.49Å; E21-F25 WeakPolarHBondContact O-CD2 3.25Å; E21-F25 PolarHBondContact O-N 3.17Å; Q22-F25 PolarHBondContact O-N 3.02Å; F25-S27 VanDerWaalsContact C-N 3.29Å; F25-S27 PolarHBondContact O-N 3.16Å; F25-L28 HydrophobicContact CB-CD1 4.4Å; F25-L28 HydrophobicContact CD1-CD1 3.48Å; F25-L28 VanDerWaalsContact CD1-CD1 3.48Å; F25-L28 HydrophobicContact CE1-CD1 3.95Å; F25-L28 HydrophobicContact CG-CD1 4.1Å; F25-L28 WeakPolarHBondContact O-CB 3.23Å; F25-L28 PolarHBondContact O-N 3.26Å; F25-C29 PolarHBondContact O-N 2.97Å; F25-V35 HydrophobicContact CE1-CG2 4.5Å
26	A	46.8	Very low	43.7	Very low	46 Å²	46	84 Å²	84	38%	0.38	46%	0.455	S	S	.	.	H	α-helix	trans	-63.6	-36.3	174.3	0	0	0	0	112.1	Q22 I23 S24 C29	Q22-A26 PolarHBondContact O-N 3.35Å; I23-A26 PolarHBondContact O-N 3.19Å; S24-A26 PolarHBondContact O-N 3.49Å; A26-C29 WeakPolarHBondContact O-CB 3.44Å; A26-C29 PolarHBondContact O-N 3.23Å
27	S	46.8	Very low	44.3	Very low	43 Å²	43	80 Å²	80	30%	0.301	44%	0.435	S	S	.	.	H	α-helix	trans	-70.8	-33.8	174.2	77.8	0	0	0	112.8	I23 S24 F25 C29 S30 Q31	I23-S27 WeakPolarHBondContact O-CB 2.95Å; I23-S27 PolarHBondContact O-N 3.1Å; I23-S27 PolarHBondContact O-OG 3.09Å; S24-S27 WeakPolarHBondContact O-CB 3.31Å; S24-S27 PolarHBondContact O-N 3.13Å; S24-S27 PolarHBondContact O-OG 3.05Å; F25-S27 VanDerWaalsContact C-N 3.29Å; F25-S27 PolarHBondContact O-N 3.16Å; S27-C29 PolarHBondContact O-N 3.44Å; S27-S30 PolarHBondContact O-N 3.23Å; S27-S30 VanDerWaalsContact O-N 3.1Å; S27-S30 PolarHBondContact O-OG 2.02Å; S27-Q31 PolarHBondContact O-N 3.19Å
28	L	48.1	Very low	44.4	Very low	19 Å²	19	77.1 Å²	77.1	10%	0.099	43%	0.428	C	S	.	.	H	α-helix	trans	-62.4	-30.3	175.8	-61.4	160.5	0	0	110.8	S24 F25 Q31 N32 V33 V35	S24-L28 WeakPolarHBondContact O-CG 3.14Å; S24-L28 PolarHBondContact O-N 3.28Å; F25-L28 HydrophobicContact CB-CD1 4.4Å; F25-L28 HydrophobicContact CD1-CD1 3.48Å; F25-L28 VanDerWaalsContact CD1-CD1 3.48Å; F25-L28 HydrophobicContact CE1-CD1 3.95Å; F25-L28 HydrophobicContact CG-CD1 4.1Å; F25-L28 WeakPolarHBondContact O-CB 3.23Å; F25-L28 PolarHBondContact O-N 3.26Å; L28-Q31 PolarHBondContact O-N 3.37Å; L28-N32 PolarHBondContact O-N 3.22Å; L28-N32 VanDerWaalsContact O-N 3.13Å; L28-V33 HydrophobicContact CB-CB 4Å; L28-V33 HydrophobicContact CB-CG2 4.37Å; L28-V33 HydrophobicContact CD2-CB 3.2Å; L28-V33 HydrophobicContact CD2-CG1 3.18Å; L28-V33 HydrophobicContact CD2-CG2 3.75Å; L28-V33 HydrophobicContact CG-CB 4.15Å; L28-V33 PolarHBondContact O-N 3.43Å; L28-V35 HydrophobicContact CB-CG2 4.47Å; L28-V35 HydrophobicContact CD1-CG2 3.21Å; L28-V35 HydrophobicContact CD2-CG2 3.72Å; L28-V35 HydrophobicContact CG-CG2 3.94Å
29	C	48.4	Very low	44.9	Very low	21 Å²	21	81 Å²	81	14%	0.142	44%	0.441	C	S	.	.	H	α-helix	trans	-67.4	-33	175.5	-109.3	0	0	0	114.6	F25 A26 S27 Q31 I51 C54	F25-C29 PolarHBondContact O-N 2.97Å; A26-C29 WeakPolarHBondContact O-CB 3.44Å; A26-C29 PolarHBondContact O-N 3.23Å; S27-C29 PolarHBondContact O-N 3.44Å; C29-Q31 VanDerWaalsContact C-N 3.34Å; C29-I51 VanDerWaalsContact SG-CG2 3.53Å; C29-C54 WeakPolarHBondContact CA-SG 3.3Å; C29-C54 HydrophobicContact CB-CB 3.47Å; C29-C54 VanDerWaalsContact CB-CB 3.47Å; C29-C54 WeakPolarHBondContact CB-SG 3.34Å; C29-C54 PolarHBondContact O-SG 3.24Å; C29-C54 WeakPolarHBondContact SG-CA 3.35Å; C29-C54 WeakPolarHBondContact SG-CB 3.5Å; C29-C54 CovalentContact SG-SG 2.02Å; C29-C54 PolarHBondContact SG-SG 3.49Å
30	S	48.6	Very low	45.3	Very low	98 Å²	98	77.8 Å²	77.8	69%	0.685	43%	0.428	S	S	*	.	H	α-helix	trans	-84.4	-12.2	173.6	61	0	0	0	113	S27	S27-S30 PolarHBondContact O-N 3.23Å; S27-S30 VanDerWaalsContact O-N 3.1Å; S27-S30 PolarHBondContact O-OG 2.02Å
31	Q	45.4	Very low	45.6	Very low	135 Å²	135	78.3 Å²	78.3	63%	0.631	43%	0.427	S	S	*	.	H	α-helix	trans	-118.7	7.9	-169.5	-70.6	-177.8	11.4	0	114.5	S27 L28 C29 V33	S27-Q31 PolarHBondContact O-N 3.19Å; L28-Q31 PolarHBondContact O-N 3.37Å; C29-Q31 VanDerWaalsContact C-N 3.34Å; Q31-V33 HydrophobicContact CB-CG2 3.15Å; Q31-V33 HydrophobicContact CG-CG2 4.39Å; Q31-V33 WeakPolarHBondContact O-CG2 2.85Å; Q31-V33 PolarHBondContact O-N 3.06Å; Q31-V33 VanDerWaalsContact O-N 3.16Å
32	N	44.2	Very low	45.8	Very low	156 Å²	156	79.2 Å²	79.2	83%	0.834	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	42	-176.6	-75.1	-30.8	0	0	111.8	L28 L34	L28-N32 PolarHBondContact O-N 3.22Å; L28-N32 VanDerWaalsContact O-N 3.13Å; N32-L34 PolarHBondContact O-N 2.9Å
33	V	44.4	Very low	46.5	Very low	47 Å²	47	87 Å²	87	29%	0.285	47%	0.471	S	S	.	.			trans	-85.1	129.3	-163.9	-175.6	0	0	0	110.9	L28 Q31 V35	L28-V33 HydrophobicContact CB-CB 4Å; L28-V33 HydrophobicContact CB-CG2 4.37Å; L28-V33 HydrophobicContact CD2-CB 3.2Å; L28-V33 HydrophobicContact CD2-CG1 3.18Å; L28-V33 HydrophobicContact CD2-CG2 3.75Å; L28-V33 HydrophobicContact CG-CB 4.15Å; L28-V33 PolarHBondContact O-N 3.43Å; Q31-V33 HydrophobicContact CB-CG2 3.15Å; Q31-V33 HydrophobicContact CG-CG2 4.39Å; Q31-V33 WeakPolarHBondContact O-CG2 2.85Å; Q31-V33 PolarHBondContact O-N 3.06Å; Q31-V33 VanDerWaalsContact O-N 3.16Å; V33-V35 PolarHBondContact O-N 3.36Å; V33-V35 VanDerWaalsContact O-N 3.16Å
34	L	41.7	Very low	46.8	Very low	107 Å²	107	86.1 Å²	86.1	56%	0.56	47%	0.468	S	S	*	.			trans	-71.3	100.4	168	-169	74.3	0	0	110.1	N32 V48	N32-L34 PolarHBondContact O-N 2.9Å; L34-V48 HydrophobicContact CD1-CB 3.6Å; L34-V48 HydrophobicContact CD1-CG1 3.11Å; L34-V48 HydrophobicContact CD1-CG2 3.79Å
35	V	47	Very low	46.6	Very low	26 Å²	26	86.4 Å²	86.4	16%	0.158	46%	0.463	C	S	.	.	B	Isolated β-bridge	trans	-82.3	125.7	172.2	-169	0	0	0	109.1	F25 L28 V33 P37 I49	F25-V35 HydrophobicContact CE1-CG2 4.5Å; L28-V35 HydrophobicContact CB-CG2 4.47Å; L28-V35 HydrophobicContact CD1-CG2 3.21Å; L28-V35 HydrophobicContact CD2-CG2 3.72Å; L28-V35 HydrophobicContact CG-CG2 3.94Å; V33-V35 PolarHBondContact O-N 3.36Å; V33-V35 VanDerWaalsContact O-N 3.16Å; V35-P37 HydrophobicContact CG1-CG 4.36Å; V35-P37 WeakPolarHBondContact O-CD 3.24Å; V35-I49 HydrophobicContact CB-CD1 4.41Å
36	K	44.7	Very low	46.7	Very low	134 Å²	134	87.9 Å²	87.9	58%	0.583	47%	0.472	S	S	*	.			trans	-98.9	99	160.3	-176.1	-177.7	179	-176.4	107.5	S38	K36-S38 PolarHBondContact O-N 2.67Å
37	P	46	Very low	46.6	Very low	18 Å²	18	86.4 Å²	86.4	12%	0.117	46%	0.458	C	S	.	.			trans	-63.4	133	-179.5	-15.4	27.9	0	0	109.9	V35 F39 L40 I49	V35-P37 HydrophobicContact CG1-CG 4.36Å; V35-P37 WeakPolarHBondContact O-CD 3.24Å; P37-F39 HydrophobicContact CB-CD1 3.52Å; P37-F39 HydrophobicContact CB-CE1 3.15Å; P37-F39 HydrophobicContact CB-CE2 4.47Å; P37-F39 HydrophobicContact CB-CG 4.33Å; P37-F39 HydrophobicContact CB-CZ 3.68Å; P37-F39 HydrophobicContact CG-CE1 3.98Å; P37-F39 HydrophobicContact CG-CZ 4.11Å; P37-F39 PolarHBondContact O-N 3Å; P37-L40 HydrophobicContact CB-CD1 3.93Å; P37-L40 HydrophobicContact CG-CD1 3.68Å; P37-L40 PolarHBondContact O-N 3.22Å; P37-L40 VanDerWaalsContact O-N 3.09Å; P37-I49 HydrophobicContact CG-CD1 3.65Å
38	S	44.5	Very low	46.7	Very low	107 Å²	107	85.5 Å²	85.5	75%	0.748	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-59.4	-29.4	-176.4	52	0	0	0	113.1	K36 L40 N41	K36-S38 PolarHBondContact O-N 2.67Å; S38-L40 PolarHBondContact O-N 3.48Å; S38-L40 VanDerWaalsContact O-N 3.16Å; S38-N41 WeakPolarHBondContact O-CB 2.92Å; S38-N41 PolarHBondContact O-N 3.47Å
39	F	49.5	Very low	46.8	Very low	169 Å²	169	85.6 Å²	85.6	74%	0.741	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-66.9	-12.7	178.6	66.5	-97	0	0	113.9	P37 N41	P37-F39 HydrophobicContact CB-CD1 3.52Å; P37-F39 HydrophobicContact CB-CE1 3.15Å; P37-F39 HydrophobicContact CB-CE2 4.47Å; P37-F39 HydrophobicContact CB-CG 4.33Å; P37-F39 HydrophobicContact CB-CZ 3.68Å; P37-F39 HydrophobicContact CG-CE1 3.98Å; P37-F39 HydrophobicContact CG-CZ 4.11Å; P37-F39 PolarHBondContact O-N 3Å; F39-N41 VanDerWaalsContact C-N 3.31Å; F39-N41 PolarHBondContact O-N 3.43Å
40	L	47.5	Very low	46.8	Very low	42 Å²	42	88.1 Å²	88.1	22%	0.22	46%	0.462	C	S	.	.	G	3₁₀ helix	trans	-97.1	28.1	179.9	-67.6	153.3	0	0	112.4	P37 S38 N42 I47	P37-L40 HydrophobicContact CB-CD1 3.93Å; P37-L40 HydrophobicContact CG-CD1 3.68Å; P37-L40 PolarHBondContact O-N 3.22Å; P37-L40 VanDerWaalsContact O-N 3.09Å; S38-L40 PolarHBondContact O-N 3.48Å; S38-L40 VanDerWaalsContact O-N 3.16Å; L40-N42 PolarHBondContact O-N 3.44Å; L40-I47 HydrophobicContact CD1-CB 3.81Å; L40-I47 HydrophobicContact CD1-CD1 3.37Å; L40-I47 HydrophobicContact CD1-CG1 3.61Å; L40-I47 HydrophobicContact CD1-CG2 4.22Å; L40-I47 HydrophobicContact CD2-CD1 3.58Å; L40-I47 HydrophobicContact CD2-CG1 4.32Å; L40-I47 HydrophobicContact CG-CD1 3.98Å; L40-I47 HydrophobicContact CG-CG1 4.32Å
41	N	47.3	Very low	47.1	Very low	122 Å²	122	84.5 Å²	84.5	65%	0.652	44%	0.435	S	S	*	.			trans	-65.2	13.2	-176.5	-137.9	9.6	0	0	115.2	S38 F39 Q43	S38-N41 WeakPolarHBondContact O-CB 2.92Å; S38-N41 PolarHBondContact O-N 3.47Å; F39-N41 VanDerWaalsContact C-N 3.31Å; F39-N41 PolarHBondContact O-N 3.43Å; N41-Q43 PolarHBondContact O-N 2.93Å
42	N	45.5	Very low	47.3	Very low	128 Å²	128	83.1 Å²	83.1	68%	0.684	43%	0.431	S	S	*	.			trans	-71	112.2	166.1	-92	-18.8	0	0	108.8	L40 N44 H45	L40-N42 PolarHBondContact O-N 3.44Å; N42-N44 PolarHBondContact O-N 3.46Å; N42-H45 PolarHBondContact O-N 3.05Å
43	Q	54.7	Low	47.5	Very low	187 Å²	187	78 Å²	78	87%	0.874	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-9.3	-167.4	-65.6	-171.9	-18.6	0	116	N41	N41-Q43 PolarHBondContact O-N 2.93Å
44	N	49.1	Very low	47.7	Very low	98 Å²	98	77.1 Å²	77.1	52%	0.524	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-1	179.6	-68.2	-16	0	0	114.6	I3 N42	I3-N44 PolarHBondContact N-O 2.91Å; N42-N44 PolarHBondContact O-N 3.46Å
45	H	42.2	Very low	48	Very low	64 Å²	64	76.7 Å²	76.7	30%	0.296	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	118.9	-179.6	-70.9	-87.2	0	0	111.9	I3 N42	I3-H45 WeakPolarHBondContact O-CA 3.36Å; N42-H45 PolarHBondContact O-N 3.05Å
46	I	48.2	Very low	47.7	Very low	79 Å²	79	81.7 Å²	81.7	41%	0.405	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	115.5	164.5	-61.2	173.7	0	0	105.8	I3 I4 T5 V48	I3-I46 PolarHBondContact O-N 3.33Å; I3-I46 VanDerWaalsContact O-N 3.11Å; I4-I46 WeakPolarHBondContact CA-O 3.36Å; I4-I46 HydrophobicContact CG1-CB 4.45Å; T5-I46 PolarHBondContact N-O 3.28Å; I46-V48 HydrophobicContact CG2-CG2 4.19Å
47	I	45.9	Very low	47.5	Very low	15 Å²	15	75.7 Å²	75.7	8%	0.077	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	127.6	172.8	-54.2	-146	0	0	108.9	T5 I7 L40 I49	T5-I47 HydrophobicContact CG2-CD1 4.23Å; T5-I47 CarbonylContact O-C 3.6Å; T5-I47 VanDerWaalsContact O-CA 3.25Å; T5-I47 WeakPolarHBondContact O-CA 3.4Å; I7-I47 HydrophobicContact CD1-CG2 3.85Å; I7-I47 HydrophobicContact CG1-CG2 4.11Å; L40-I47 HydrophobicContact CD1-CB 3.81Å; L40-I47 HydrophobicContact CD1-CD1 3.37Å; L40-I47 HydrophobicContact CD1-CG1 3.61Å; L40-I47 HydrophobicContact CD1-CG2 4.22Å; L40-I47 HydrophobicContact CD2-CD1 3.58Å; L40-I47 HydrophobicContact CD2-CG1 4.32Å; L40-I47 HydrophobicContact CG-CD1 3.98Å; L40-I47 HydrophobicContact CG-CG1 4.32Å; I47-I49 HydrophobicContact CG2-CG1 4.13Å
48	V	47.2	Very low	47.1	Very low	24 Å²	24	78.8 Å²	78.8	15%	0.145	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	108.5	179.8	175.1	0	0	0	106.2	I4 T5 I6 I7 L34 I46 I50	I4-V48 HydrophobicContact CG2-CG2 4.08Å; T5-V48 PolarHBondContact O-N 2.93Å; I6-V48 CarbonylContact C-O 3.58Å; I6-V48 WeakPolarHBondContact CA-O 3.25Å; I6-V48 HydrophobicContact CG1-CB 4.16Å; I6-V48 HydrophobicContact CG1-CG2 4.47Å; I6-V48 HydrophobicContact CG2-CB 4.43Å; I6-V48 HydrophobicContact CG2-CG1 4.33Å; I7-V48 PolarHBondContact N-O 3.43Å; L34-V48 HydrophobicContact CD1-CB 3.6Å; L34-V48 HydrophobicContact CD1-CG1 3.11Å; L34-V48 HydrophobicContact CD1-CG2 3.79Å; I46-V48 HydrophobicContact CG2-CG2 4.19Å; V48-I50 HydrophobicContact CG1-CD1 4.17Å; V48-I50 HydrophobicContact CG1-CG1 3.9Å
49	I	50.2	Low	46.6	Very low	21 Å²	21	78.8 Å²	78.8	11%	0.108	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	119.3	175	-55.7	-179.7	0	0	108.2	I7 I9 V35 P37 I47 I51	I7-I49 WeakPolarHBondContact O-CA 3.36Å; I9-I49 HydrophobicContact CD1-CG2 3.83Å; I9-I49 HydrophobicContact CG1-CG2 4.27Å; V35-I49 HydrophobicContact CB-CD1 4.41Å; P37-I49 HydrophobicContact CG-CD1 3.65Å; I47-I49 HydrophobicContact CG2-CG1 4.13Å; I49-I51 HydrophobicContact CG2-CG1 4.33Å
50	I	49.6	Very low	45.8	Very low	73 Å²	73	77.7 Å²	77.7	37%	0.374	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	123	176.4	-57.2	177.1	0	0	107.7	I6 I7 I8 I9 V48 I52	I6-I50 HydrophobicContact CG2-CD1 4Å; I6-I50 HydrophobicContact CG2-CG1 4.46Å; I7-I50 PolarHBondContact O-N 2.91Å; I8-I50 CarbonylContact C-O 3.6Å; I8-I50 WeakPolarHBondContact CA-O 3.15Å; I8-I50 HydrophobicContact CG1-CB 4.42Å; I9-I50 PolarHBondContact N-O 3.23Å; V48-I50 HydrophobicContact CG1-CD1 4.17Å; V48-I50 HydrophobicContact CG1-CG1 3.9Å; I50-I52 HydrophobicContact CG2-CD1 4.17Å; I50-I52 HydrophobicContact CG2-CG1 3.79Å
51	I	54.9	Low	45.1	Very low	22 Å²	22	79 Å²	79	11%	0.113	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	117.8	178.8	-51.3	173.4	0	0	108.6	I9 F12 C29 I49	I9-I51 CarbonylContact O-C 3.58Å; I9-I51 VanDerWaalsContact O-CA 3.23Å; I9-I51 WeakPolarHBondContact O-CA 3.15Å; F12-I51 HydrophobicContact CD2-CD1 4.39Å; C29-I51 VanDerWaalsContact SG-CG2 3.53Å; I49-I51 HydrophobicContact CG2-CG1 4.33Å
52	I	49.8	Very low	44.3	Very low	106 Å²	106	79 Å²	79	54%	0.544	40%	0.396	S	S	.	.			trans	-102.3	-10.6	-169.7	-59.8	-173.3	0	0	113.5	I8 I9 I50	I8-I52 HydrophobicContact CG2-CD1 3.35Å; I8-I52 HydrophobicContact CG2-CG1 3.82Å; I9-I52 PolarHBondContact O-N 3.26Å; I50-I52 HydrophobicContact CG2-CD1 4.17Å; I50-I52 HydrophobicContact CG2-CG1 3.79Å
53	N	48.5	Very low	43.8	Very low	50 Å²	50	79.4 Å²	79.4	27%	0.267	39%	0.394	S	S	.	.			trans	-142.4	66.3	-176.5	-130.1	-24.3	0	0	113.7	D10 T55 S57	D10-N53 CarbonylContact O-C 3.53Å; D10-N53 VanDerWaalsContact O-CA 3.31Å; D10-N53 WeakPolarHBondContact O-CA 3.47Å; D10-N53 WeakPolarHBondContact O-CB 3.11Å; D10-N53 PolarHBondContact O-N 3.22Å; D10-N53 VanDerWaalsContact OD1-CB 3.25Å; D10-N53 WeakPolarHBondContact OD1-CB 3.5Å; D10-N53 PolarHBondContact OD1-ND2 3.5Å; N53-T55 VanDerWaalsContact C-N 3.25Å; N53-T55 PolarHBondContact O-N 3.3Å; N53-S57 PolarHBondContact O-OG 3.2Å
54	C	48.5	Very low	42.7	Very low	28 Å²	28	76.4 Å²	76.4	19%	0.189	38%	0.378	C	S	.	.	H	α-helix	trans	-62.5	-28	-176.8	-65.4	0	0	0	114.7	C29 S57 I58	C29-C54 WeakPolarHBondContact CA-SG 3.3Å; C29-C54 HydrophobicContact CB-CB 3.47Å; C29-C54 VanDerWaalsContact CB-CB 3.47Å; C29-C54 WeakPolarHBondContact CB-SG 3.34Å; C29-C54 PolarHBondContact O-SG 3.24Å; C29-C54 WeakPolarHBondContact SG-CA 3.35Å; C29-C54 WeakPolarHBondContact SG-CB 3.5Å; C29-C54 CovalentContact SG-SG 2.02Å; C29-C54 PolarHBondContact SG-SG 3.49Å; C54-S57 PolarHBondContact O-N 3.18Å; C54-I58 PolarHBondContact O-N 3.25Å
55	T	46.6	Very low	41.9	Very low	97 Å²	97	75.9 Å²	75.9	60%	0.595	37%	0.371	S	S	*	.	H	α-helix	trans	-67	-39.4	-175.4	40.5	0	0	0	113.3	N53 L59	N53-T55 VanDerWaalsContact C-N 3.25Å; N53-T55 PolarHBondContact O-N 3.3Å; T55-L59 PolarHBondContact O-N 2.8Å
56	K	41.3	Very low	41.4	Very low	132 Å²	132	79.1 Å²	79.1	57%	0.574	39%	0.386	S	S	*	.	H	α-helix	trans	-77.9	-28.5	178.7	-72.7	-176.2	179.8	176.5	113.1	L59 F60	K56-L59 PolarHBondContact O-N 3.3Å; K56-F60 PolarHBondContact O-N 3.4Å
57	S	40.1	Very low	40.7	Very low	8 Å²	8	78 Å²	78	6%	0.056	39%	0.388	C	S	.	.	H	α-helix	trans	-63.8	-43.7	179.7	-51	0	0	0	111	F12 N53 C54 F61	F12-S57 PolarHBondContact N-OG 3.4Å; N53-S57 PolarHBondContact O-OG 3.2Å; C54-S57 PolarHBondContact O-N 3.18Å; S57-F61 VanDerWaalsContact O-CD2 3.3Å; S57-F61 WeakPolarHBondContact O-CD2 3.2Å
58	I	37.5	Very low	39.9	Very low	83 Å²	83	83.1 Å²	83.1	43%	0.426	41%	0.412	S	S	.	.	H	α-helix	trans	-74	-36.7	179.6	-61.4	169.5	0	0	111.6	C54 F60 F61 H62	C54-I58 PolarHBondContact O-N 3.25Å; I58-F60 VanDerWaalsContact C-N 3.27Å; I58-F60 PolarHBondContact O-N 2.95Å; I58-F61 WeakPolarHBondContact O-CA 3.33Å; I58-F61 WeakPolarHBondContact O-CB 3.49Å; I58-F61 PolarHBondContact O-N 3.34Å; I58-H62 PolarHBondContact O-N 3.09Å
59	L	33.7	Very low	39.1	Very low	106 Å²	106	89.5 Å²	89.5	56%	0.555	43%	0.434	S	S	*	.	H	α-helix	trans	-64.9	-31	179.7	-113.4	144	0	0	112.8	T55 K56 F61 H62 H63	T55-L59 PolarHBondContact O-N 2.8Å; K56-L59 PolarHBondContact O-N 3.3Å; L59-F61 PolarHBondContact O-N 3.26Å; L59-H62 PolarHBondContact O-N 3.36Å; L59-H63 PolarHBondContact O-N 3.38Å
60	F	34	Very low	38.4	Very low	147 Å²	147	92.2 Å²	92.2	65%	0.645	46%	0.455	S	S	*	.	H	α-helix	trans	-64.5	-27.8	171.1	-107.9	-82.7	0	0	112.8	K56 I58 K64	K56-F60 PolarHBondContact O-N 3.4Å; I58-F60 VanDerWaalsContact C-N 3.27Å; I58-F60 PolarHBondContact O-N 2.95Å; F60-K64 VanDerWaalsContact O-CB 3.31Å; F60-K64 WeakPolarHBondContact O-CB 3.31Å; F60-K64 PolarHBondContact O-N 3Å
61	F	31.3	Very low	37.8	Very low	70 Å²	70	94.9 Å²	94.9	31%	0.307	47%	0.47	S	S	.	.	H	α-helix	trans	-67.9	-52	173.5	-80.9	-84.8	0	0	111.1	V14 S57 I58 L59 H63 K64 F65	V14-F61 HydrophobicContact CB-CZ 3.73Å; V14-F61 HydrophobicContact CG2-CE1 4.49Å; V14-F61 HydrophobicContact CG2-CE2 3.81Å; V14-F61 HydrophobicContact CG2-CZ 3.4Å; S57-F61 VanDerWaalsContact O-CD2 3.3Å; S57-F61 WeakPolarHBondContact O-CD2 3.2Å; I58-F61 WeakPolarHBondContact O-CA 3.33Å; I58-F61 WeakPolarHBondContact O-CB 3.49Å; I58-F61 PolarHBondContact O-N 3.34Å; L59-F61 PolarHBondContact O-N 3.26Å; F61-H63 VanDerWaalsContact C-N 3.29Å; F61-H63 PolarHBondContact O-N 2.75Å; F61-K64 PolarHBondContact O-N 3.08Å; F61-F65 WeakPolarHBondContact O-CB 3.34Å; F61-F65 PolarHBondContact O-N 2.82Å
62	H	31.5	Very low	36.9	Very low	120 Å²	120	101 Å²	101	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-58.1	-42.1	-179.3	-88.5	-75.6	0	0	112.6	I58 L59 H66	I58-H62 PolarHBondContact O-N 3.09Å; L59-H62 PolarHBondContact O-N 3.36Å; H62-H66 WeakPolarHBondContact O-CB 3.44Å; H62-H66 PolarHBondContact O-CD2 3.01Å; H62-H66 PolarHBondContact O-N 2.95Å
63	H	33.9	Very low	36.4	Very low	137 Å²	137	103 Å²	103	63%	0.634	54%	0.535	S	S	*	.	H	α-helix	trans	-73.1	-39.8	-179.9	-88.3	-74.8	0	0	113.9	L59 F61 A67	L59-H63 PolarHBondContact O-N 3.38Å; F61-H63 VanDerWaalsContact C-N 3.29Å; F61-H63 PolarHBondContact O-N 2.75Å; H63-A67 WeakPolarHBondContact O-CB 3.25Å; H63-A67 PolarHBondContact O-N 3.2Å
64	K	32.2	Very low	35.8	Very low	124 Å²	124	105.6 Å²	105.6	54%	0.539	55%	0.549	S	S	.	.	H	α-helix	trans	-76.7	-29	178.6	-152	175.2	-176.2	-177.3	112.1	F60 F61 A67 H68	F60-K64 VanDerWaalsContact O-CB 3.31Å; F60-K64 WeakPolarHBondContact O-CB 3.31Å; F60-K64 PolarHBondContact O-N 3Å; F61-K64 PolarHBondContact O-N 3.08Å; K64-A67 PolarHBondContact O-N 2.92Å; K64-H68 WeakPolarHBondContact O-CB 3.35Å; K64-H68 PolarHBondContact O-N 3.46Å
65	F	32.5	Very low	35.1	Very low	87 Å²	87	109.7 Å²	109.7	38%	0.382	57%	0.567	S	S	.	*	H	α-helix	trans	-65.8	-45.5	170.5	-129	-102.8	0	0	110.9	F19 F61 A67 H68 Y69	F19-F65 HydrophobicContact CE2-CE2 4.07Å; F19-F65 HydrophobicContact CE2-CZ 4.07Å; F19-F65 AromaticContact CZ-CE2 3.55Å; F19-F65 HydrophobicContact CZ-CE2 3.55Å; F19-F65 AromaticContact CZ-CZ 3.58Å; F19-F65 HydrophobicContact CZ-CZ 3.58Å; F61-F65 WeakPolarHBondContact O-CB 3.34Å; F61-F65 PolarHBondContact O-N 2.82Å; F65-A67 VanDerWaalsContact C-N 3.34Å; F65-A67 PolarHBondContact O-N 3.35Å; F65-H68 PolarHBondContact O-N 3.46Å; F65-Y69 AromaticContact CD1-CD2 3.44Å; F65-Y69 HydrophobicContact CD1-CD2 3.44Å; F65-Y69 VanDerWaalsContact CD1-CD2 3.44Å; F65-Y69 AromaticContact CD1-CE2 3.5Å; F65-Y69 HydrophobicContact CD1-CE2 3.5Å; F65-Y69 HydrophobicContact CD1-CG 4.48Å; F65-Y69 AromaticContact CE1-CD2 3.54Å; F65-Y69 HydrophobicContact CE1-CD2 3.54Å; F65-Y69 AromaticContact CE1-CE2 3.04Å; F65-Y69 HydrophobicContact CE1-CE2 3.04Å; F65-Y69 AromaticContact CE1-CZ 3.83Å; F65-Y69 HydrophobicContact CE2-CE2 4.3Å; F65-Y69 HydrophobicContact CG-CD2 4.16Å; F65-Y69 HydrophobicContact CG-CE2 4.3Å; F65-Y69 HydrophobicContact CZ-CD2 4.28Å; F65-Y69 AromaticContact CZ-CE2 3.5Å; F65-Y69 HydrophobicContact CZ-CE2 3.5Å; F65-Y69 VanDerWaalsContact CZ-CE2 3.5Å; F65-Y69 WeakPolarHBondContact O-CB 3.38Å; F65-Y69 WeakPolarHBondContact O-CD2 3.46Å; F65-Y69 PolarHBondContact O-N 3.18Å
66	H	30.8	Very low	34.5	Very low	132 Å²	132	110.4 Å²	110.4	61%	0.611	57%	0.566	S	S	*	*	H	α-helix	trans	-65.5	-36.9	175.4	-85.4	-71.5	0	0	112.5	H62 S70	H62-H66 WeakPolarHBondContact O-CB 3.44Å; H62-H66 PolarHBondContact O-CD2 3.01Å; H62-H66 PolarHBondContact O-N 2.95Å; H66-S70 VanDerWaalsContact O-CB 3.25Å; H66-S70 WeakPolarHBondContact O-CB 3.45Å; H66-S70 PolarHBondContact O-N 2.98Å; H66-S70 PolarHBondContact O-OG 2.86Å
67	A	34	Very low	34.1	Very low	55 Å²	55	109.1 Å²	109.1	46%	0.455	57%	0.565	S	S	.	*	H	α-helix	trans	-70.4	-31.8	176.9	0	0	0	0	113.3	H63 K64 F65	H63-A67 WeakPolarHBondContact O-CB 3.25Å; H63-A67 PolarHBondContact O-N 3.2Å; K64-A67 PolarHBondContact O-N 2.92Å; F65-A67 VanDerWaalsContact C-N 3.34Å; F65-A67 PolarHBondContact O-N 3.35Å
68	H	30.3	Very low	33.7	Very low	124 Å²	124	115.4 Å²	115.4	57%	0.574	60%	0.597	S	S	*	*	H	α-helix	trans	-82.2	-34.8	175.4	-103.7	-69.2	0	0	113.2	K64 F65	K64-H68 WeakPolarHBondContact O-CB 3.35Å; K64-H68 PolarHBondContact O-N 3.46Å; F65-H68 PolarHBondContact O-N 3.46Å
69	Y	30.5	Very low	33.5	Very low	158 Å²	158	117.6 Å²	117.6	62%	0.62	61%	0.609	S	S	*	*	H	α-helix	trans	-80.9	-17.1	177.5	-86.7	-90	0	0	114	F65 N71	F65-Y69 AromaticContact CD1-CD2 3.44Å; F65-Y69 HydrophobicContact CD1-CD2 3.44Å; F65-Y69 VanDerWaalsContact CD1-CD2 3.44Å; F65-Y69 AromaticContact CD1-CE2 3.5Å; F65-Y69 HydrophobicContact CD1-CE2 3.5Å; F65-Y69 HydrophobicContact CD1-CG 4.48Å; F65-Y69 AromaticContact CE1-CD2 3.54Å; F65-Y69 HydrophobicContact CE1-CD2 3.54Å; F65-Y69 AromaticContact CE1-CE2 3.04Å; F65-Y69 HydrophobicContact CE1-CE2 3.04Å; F65-Y69 AromaticContact CE1-CZ 3.83Å; F65-Y69 HydrophobicContact CE2-CE2 4.3Å; F65-Y69 HydrophobicContact CG-CD2 4.16Å; F65-Y69 HydrophobicContact CG-CE2 4.3Å; F65-Y69 HydrophobicContact CZ-CD2 4.28Å; F65-Y69 AromaticContact CZ-CE2 3.5Å; F65-Y69 HydrophobicContact CZ-CE2 3.5Å; F65-Y69 VanDerWaalsContact CZ-CE2 3.5Å; F65-Y69 WeakPolarHBondContact O-CB 3.38Å; F65-Y69 WeakPolarHBondContact O-CD2 3.46Å; F65-Y69 PolarHBondContact O-N 3.18Å; Y69-N71 VanDerWaalsContact C-N 3.29Å
70	S	33.8	Very low	33.5	Very low	78 Å²	78	118.4 Å²	118.4	55%	0.545	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.9	-8.9	173.4	72.9	0	0	0	114	H66	H66-S70 VanDerWaalsContact O-CB 3.25Å; H66-S70 WeakPolarHBondContact O-CB 3.45Å; H66-S70 PolarHBondContact O-N 2.98Å; H66-S70 PolarHBondContact O-OG 2.86Å
71	N	38.9	Very low	33.4	Very low	129 Å²	129	116.2 Å²	116.2	69%	0.69	61%	0.61	S	S	*	*	S	Bend	trans	-100.7	-8.4	179	-85.1	2.5	0	0	114	Y69	Y69-N71 VanDerWaalsContact C-N 3.29Å
72	D	35	Very low	33.6	Very low	149 Å²	149	120.1 Å²	120.1	80%	0.797	64%	0.635	S	S	*	*			trans	-106.5	13.4	177	-75.1	-21.8	0	0	113.1
73	A	39.7	Very low	33.8	Very low	148 Å²	148	120.1 Å²	120.1	100%	1.223	64%	0.643	S	S	*	*			trans	-102.5	0	168.2	0	0	0	0	110.4

Retrieved 73 of 73 residues in 107.4 ms (Link to these results)

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