A0A3Q0KP08_SCHMA Loading...

DUF4968 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KP08, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 94 aa.

						>A0A3Q0KP08_SCHMA|A0A3Q0KP08
MIFTVVIYLQLFEVNSLDKSDSDGVKQVFVPNILLFQSSELSDFVVKGQFLNGRVALFLTAEHTETFFIADNQGVKLENKDIRFKKREGDLSEK
					

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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	47.5	Very low	53.1	Low	132 Å²	132	80.1 Å²	80.1	65%	0.65	41%	0.406	S	S	*	.				0	130.9	0	-132.9	171.9	-169.4	0	0	108.1	F3 E40	M1-F3 HydrophobicContact CB-CE2 4.17Å; M1-F3 HydrophobicContact CB-CZ 3.98Å; M1-F3 HydrophobicContact CG-CE1 4.27Å; M1-F3 HydrophobicContact CG-CE2 4.44Å; M1-F3 HydrophobicContact CG-CZ 3.76Å; M1-F3 HydrophobicContact SD-CE1 4.24Å; M1-F3 HydrophobicContact SD-CE2 4.44Å; M1-F3 HydrophobicContact SD-CZ 3.54Å; M1-F3 VanDerWaalsContact SD-CZ 3.54Å; M1-E40 HydrophobicContact CE-CB 3.09Å; M1-E40 HydrophobicContact CE-CG 4.24Å; M1-E40 WeakPolarHBondContact CE-OE2 3.36Å
2	I	48.1	Very low	53.3	Low	144 Å²	144	80.4 Å²	80.4	74%	0.738	40%	0.403	S	S	*	.			trans	-117.6	131.1	178.9	-60.3	175	0	0	0	107.4
3	F	49.6	Very low	53.6	Low	81 Å²	81	84.1 Å²	84.1	36%	0.355	42%	0.418	S	S	.	.			trans	-112.5	145.4	172.5	-51.8	-74.2	0	0	0	108.8	M1 L41	M1-F3 HydrophobicContact CB-CE2 4.17Å; M1-F3 HydrophobicContact CB-CZ 3.98Å; M1-F3 HydrophobicContact CG-CE1 4.27Å; M1-F3 HydrophobicContact CG-CE2 4.44Å; M1-F3 HydrophobicContact CG-CZ 3.76Å; M1-F3 HydrophobicContact SD-CE1 4.24Å; M1-F3 HydrophobicContact SD-CE2 4.44Å; M1-F3 HydrophobicContact SD-CZ 3.54Å; M1-F3 VanDerWaalsContact SD-CZ 3.54Å; F3-L41 HydrophobicContact CD1-CD1 3.67Å; F3-L41 HydrophobicContact CD1-CG 4.38Å; F3-L41 HydrophobicContact CD2-CD1 4.19Å; F3-L41 HydrophobicContact CE1-CB 4.26Å; F3-L41 HydrophobicContact CE1-CD1 3.14Å; F3-L41 HydrophobicContact CE1-CG 3.42Å; F3-L41 VanDerWaalsContact CE1-CG 3.42Å; F3-L41 HydrophobicContact CE2-CD1 3.71Å; F3-L41 HydrophobicContact CE2-CG 4.31Å; F3-L41 HydrophobicContact CG-CD1 4.17Å; F3-L41 HydrophobicContact CZ-CD1 3.16Å; F3-L41 HydrophobicContact CZ-CD2 4.11Å; F3-L41 HydrophobicContact CZ-CG 3.37Å
4	T	50.9	Low	53.7	Low	83 Å²	83	83.2 Å²	83.2	51%	0.509	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	111	171.4	-54.6	0	0	0	0	108.3	V6 F36	T4-V6 HydrophobicContact CG2-CG2 4.02Å; T4-F36 PolarHBondContact O-N 2.86Å
5	V	52.5	Low	54	Low	46 Å²	46	86.1 Å²	86.1	28%	0.279	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	118	172	-170.7	0	0	0	0	107	I7 I33 L35 L59	V5-I7 HydrophobicContact CG1-CD1 4.15Å; V5-I7 HydrophobicContact CG1-CG1 4.07Å; V5-I33 HydrophobicContact CG1-CG2 4.03Å; V5-L35 HydrophobicContact CG1-CD2 4.12Å; V5-L35 HydrophobicContact CG1-CG 4.46Å; V5-L35 HydrophobicContact CG2-CD2 4.12Å; V5-L59 HydrophobicContact CB-CD1 4.49Å; V5-L59 HydrophobicContact CG1-CD1 4.04Å; V5-L59 HydrophobicContact CG1-CD2 4.06Å; V5-L59 HydrophobicContact CG2-CD1 4.25Å; V5-L59 HydrophobicContact CG2-CD2 3.77Å
6	V	53.8	Low	54.1	Low	59 Å²	59	82.9 Å²	82.9	36%	0.358	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	115.4	175.8	-178.6	0	0	0	0	107.7	T4 L34 F36	T4-V6 HydrophobicContact CG2-CG2 4.02Å; V6-L34 HydrophobicContact CB-CB 4.36Å; V6-L34 PolarHBondContact N-O 2.94Å; V6-L34 PolarHBondContact O-N 2.83Å; V6-L34 VanDerWaalsContact O-O 3.09Å; V6-F36 HydrophobicContact CB-CD2 4.44Å; V6-F36 HydrophobicContact CB-CE2 4.09Å; V6-F36 HydrophobicContact CG2-CD2 3.84Å; V6-F36 HydrophobicContact CG2-CE2 3.7Å
7	I	57.1	Low	54.1	Low	30 Å²	30	88.5 Å²	88.5	15%	0.154	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	122.8	176.7	-62.2	142.9	0	0	0	106.7	V5 I33 L57	V5-I7 HydrophobicContact CG1-CD1 4.15Å; V5-I7 HydrophobicContact CG1-CG1 4.07Å; I7-I33 HydrophobicContact CG1-CG2 4.24Å; I7-L57 HydrophobicContact CB-CD1 4Å; I7-L57 HydrophobicContact CD1-CD1 3.25Å; I7-L57 HydrophobicContact CG1-CD1 3.33Å; I7-L57 HydrophobicContact CG2-CD1 3.46Å; I7-L57 VanDerWaalsContact CG2-CD1 3.46Å
8	Y	56.7	Low	54.1	Low	102 Å²	102	89.7 Å²	89.7	40%	0.4	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.2	169.1	65.6	-83.8	0	0	0	110	N32 L34	Y8-N32 HydrophobicContact CD1-CB 3.88Å; Y8-N32 HydrophobicContact CD2-CB 3.8Å; Y8-N32 HydrophobicContact CE1-CB 3.37Å; Y8-N32 HydrophobicContact CE2-CB 3.3Å; Y8-N32 WeakPolarHBondContact CE2-ND2 3.24Å; Y8-N32 HydrophobicContact CG-CB 4.08Å; Y8-N32 PolarHBondContact N-O 2.81Å; Y8-N32 PolarHBondContact O-N 2.83Å; Y8-N32 VanDerWaalsContact O-O 3.07Å; Y8-N32 VanDerWaalsContact OH-CB 3.32Å; Y8-N32 WeakPolarHBondContact OH-CB 3.48Å; Y8-L34 HydrophobicContact CD1-CD1 4.12Å; Y8-L34 HydrophobicContact CD1-CG 4.5Å; Y8-L34 HydrophobicContact CE1-CD1 3.53Å; Y8-L34 HydrophobicContact CE1-CG 3.82Å
9	L	55.6	Low	54.1	Low	48 Å²	48	95.5 Å²	95.5	25%	0.251	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	115.6	172.1	-60	179.1	0	0	0	107.4	F29 P31 V55 A70	L9-F29 HydrophobicContact CB-CD1 4.26Å; L9-F29 HydrophobicContact CD1-CD1 4.49Å; L9-P31 HydrophobicContact CD2-CB 3.85Å; L9-V55 HydrophobicContact CD2-CB 4.08Å; L9-V55 HydrophobicContact CD2-CG2 3.45Å; L9-V55 VanDerWaalsContact CD2-CG2 3.45Å; L9-A70 HydrophobicContact CD1-CB 4.39Å
10	Q	54.7	Low	54.2	Low	78 Å²	78	95.3 Å²	95.3	36%	0.364	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.8	170.5	-172.4	169.7	-8.5	0	0	108.8	F12 V30 N32	Q10-F12 HydrophobicContact CB-CE2 3.94Å; Q10-F12 HydrophobicContact CG-CD2 4.13Å; Q10-F12 HydrophobicContact CG-CE1 4.46Å; Q10-F12 HydrophobicContact CG-CE2 3.51Å; Q10-F12 HydrophobicContact CG-CZ 3.73Å; Q10-V30 PolarHBondContact N-O 2.81Å; Q10-V30 PolarHBondContact O-N 2.82Å; Q10-N32 VanDerWaalsContact CB-ND2 3.31Å; Q10-N32 WeakPolarHBondContact CB-ND2 3.31Å; Q10-N32 PolarHBondContact OE1-ND2 3.43Å; Q10-N32 VanDerWaalsContact OE1-ND2 3.08Å
11	L	57.2	Low	54.1	Low	78 Å²	78	94.1 Å²	94.1	41%	0.408	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	126.4	175.9	-174.7	71.3	0	0	0	109.1	Q27 F29	L11-Q27 HydrophobicContact CD1-CB 3.77Å; L11-Q27 HydrophobicContact CD1-CG 3.95Å; L11-Q27 HydrophobicContact CG-CG 4.48Å; L11-F29 HydrophobicContact CD1-CD1 3.93Å; L11-F29 HydrophobicContact CD1-CD2 4.43Å; L11-F29 HydrophobicContact CD1-CE1 3.55Å; L11-F29 HydrophobicContact CD1-CE2 4.07Å; L11-F29 HydrophobicContact CD1-CG 4.36Å; L11-F29 HydrophobicContact CD1-CZ 3.61Å
12	F	56	Low	54.2	Low	84 Å²	84	92.6 Å²	92.6	37%	0.368	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	128.1	169.3	-68.6	-85.2	0	0	0	109.5	Q10 V14 Q27 V28 V30	Q10-F12 HydrophobicContact CB-CE2 3.94Å; Q10-F12 HydrophobicContact CG-CD2 4.13Å; Q10-F12 HydrophobicContact CG-CE1 4.46Å; Q10-F12 HydrophobicContact CG-CE2 3.51Å; Q10-F12 HydrophobicContact CG-CZ 3.73Å; F12-V14 HydrophobicContact CB-CG2 4.39Å; F12-V14 PolarHBondContact O-N 3.29Å; F12-Q27 CarbonylContact O-C 3.52Å; F12-Q27 WeakPolarHBondContact O-CA 3.46Å; F12-V28 PolarHBondContact N-O 3.1Å; F12-V28 PolarHBondContact O-N 2.82Å; F12-V30 HydrophobicContact CD2-CB 4.03Å; F12-V30 HydrophobicContact CD2-CG2 3.56Å; F12-V30 HydrophobicContact CE2-CB 3.84Å; F12-V30 HydrophobicContact CE2-CG2 3.71Å
13	E	57.6	Low	54.5	Low	128 Å²	128	93.2 Å²	93.2	60%	0.598	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	108.7	165.7	-70	-174.8	172.4	0	0	107.6	V25 Q27	E13-V25 HydrophobicContact CB-CG1 3.64Å; E13-V25 HydrophobicContact CG-CG1 3.65Å; E13-Q27 HydrophobicContact CG-CG 4.22Å
14	V	54.7	Low	54.9	Low	72 Å²	72	91 Å²	91	44%	0.436	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	113.8	174.8	-171.6	0	0	0	0	106.5	F12 S16 K26 V28	F12-V14 HydrophobicContact CB-CG2 4.39Å; F12-V14 PolarHBondContact O-N 3.29Å; V14-S16 PolarHBondContact O-N 2.71Å; V14-K26 PolarHBondContact N-O 3.06Å; V14-K26 PolarHBondContact O-N 3.04Å; V14-K26 VanDerWaalsContact O-N 3.16Å; V14-V28 HydrophobicContact CB-CG2 4.28Å; V14-V28 HydrophobicContact CG2-CB 4.04Å; V14-V28 HydrophobicContact CG2-CG2 3.6Å
15	N	58.1	Low	55	Low	127 Å²	127	90.8 Å²	90.8	68%	0.679	49%	0.491	S	S	*	.			trans	-60.4	127	166.5	-70.1	-33.4	0	0	0	107.5	L17	N15-L17 PolarHBondContact O-N 3.12Å
16	S	54.9	Low	55.1	Low	35 Å²	35	93.8 Å²	93.8	25%	0.245	50%	0.501	C	S	.	.			trans	-54.3	119.8	170.9	180	0	0	0	0	108.7	V14 D18	V14-S16 PolarHBondContact O-N 2.71Å; S16-D18 PolarHBondContact O-N 3.12Å; S16-D18 WeakPolarHBondContact OG-CA 3.1Å; S16-D18 WeakPolarHBondContact OG-CB 3.43Å; S16-D18 PolarHBondContact OG-N 3.44Å; S16-D18 VanDerWaalsContact OG-N 3.1Å; S16-D18 PolarHBondContact OG-O 2.85Å
17	L	54.7	Low	55.1	Low	178 Å²	178	95.9 Å²	95.9	93%	0.932	51%	0.507	S	S	*	.	S	Bend	trans	-65.1	-26.2	166.9	-80.4	163.4	0	0	0	110.4	N15 K19	N15-L17 PolarHBondContact O-N 3.12Å; L17-K19 PolarHBondContact O-N 3.17Å
18	D	53.1	Low	55	Low	110 Å²	110	97.6 Å²	97.6	59%	0.588	52%	0.518	S	S	*	.			trans	-79.1	107.9	174.9	-113.2	-27	0	0	0	109.6	S16 S20 D21	S16-D18 PolarHBondContact O-N 3.12Å; S16-D18 WeakPolarHBondContact OG-CA 3.1Å; S16-D18 WeakPolarHBondContact OG-CB 3.43Å; S16-D18 PolarHBondContact OG-N 3.44Å; S16-D18 VanDerWaalsContact OG-N 3.1Å; S16-D18 PolarHBondContact OG-O 2.85Å; D18-S20 PolarHBondContact O-N 3.16Å; D18-D21 PolarHBondContact O-N 3.28Å; D18-D21 VanDerWaalsContact O-N 3.12Å
19	K	54.6	Low	55	Low	200 Å²	200	95.1 Å²	95.1	87%	0.87	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-9.6	173.6	-66.1	-172.3	177.7	-177	0	113.1	L17 D21	L17-K19 PolarHBondContact O-N 3.17Å; K19-D21 VanDerWaalsContact C-N 3.34Å
20	S	57.3	Low	55.1	Low	91 Å²	91	95.4 Å²	95.4	64%	0.636	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-23	174.7	57.7	0	0	0	0	113.3	D18 S22	D18-S20 PolarHBondContact O-N 3.16Å; S20-S22 VanDerWaalsContact C-N 3.35Å; S20-S22 PolarHBondContact O-N 2.99Å
21	D	51.3	Low	55	Low	70 Å²	70	93.1 Å²	93.1	37%	0.374	51%	0.505	S	S	.	.	S	Bend	trans	-86.6	81.4	171.4	-82.5	-17.9	0	0	0	108.2	D18 K19 D23 K26	D18-D21 PolarHBondContact O-N 3.28Å; D18-D21 VanDerWaalsContact O-N 3.12Å; K19-D21 VanDerWaalsContact C-N 3.34Å; D21-D23 PolarHBondContact O-N 2.65Å; D21-D23 VanDerWaalsContact O-N 3.12Å; D21-K26 WeakPolarHBondContact OD2-CE 2.8Å; D21-K26 IonicContact OD2-NZ 2.65Å; D21-K26 PolarHBondContact OD2-NZ 2.85Å
22	S	50.1	Low	54.7	Low	100 Å²	100	91.5 Å²	91.5	70%	0.699	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-12.8	-166.9	58.8	0	0	0	0	115.9	S20	S20-S22 VanDerWaalsContact C-N 3.35Å; S20-S22 PolarHBondContact O-N 2.99Å
23	D	54.9	Low	54.7	Low	157 Å²	157	89.7 Å²	89.7	84%	0.84	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.4	10.9	-178.8	-74.3	-56.6	0	0	0	114.1	D21 V25	D21-D23 PolarHBondContact O-N 2.65Å; D21-D23 VanDerWaalsContact O-N 3.12Å; D23-V25 PolarHBondContact O-N 3.4Å
24	G	57.1	Low	54.4	Low	35 Å²	35	87.4 Å²	87.4	36%	0.361	48%	0.482	S	S	.	.			trans	-95.1	87.8	-172.5	0	0	0	0	0	112.7	K26	G24-K26 PolarHBondContact O-N 3.08Å
25	V	52.7	Low	54.3	Low	78 Å²	78	86.6 Å²	86.6	47%	0.473	48%	0.475	S	S	.	.			trans	-59.7	109.8	155.9	175.4	0	0	0	0	106.5	E13 D23 Q27	E13-V25 HydrophobicContact CB-CG1 3.64Å; E13-V25 HydrophobicContact CG-CG1 3.65Å; D23-V25 PolarHBondContact O-N 3.4Å; V25-Q27 PolarHBondContact O-N 3.35Å
26	K	55.3	Low	53.9	Low	110 Å²	110	86.6 Å²	86.6	48%	0.478	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	112.8	176.7	-74.6	-177.6	-176.6	165.8	0	107.8	V14 D21 G24 V28	V14-K26 PolarHBondContact N-O 3.06Å; V14-K26 PolarHBondContact O-N 3.04Å; V14-K26 VanDerWaalsContact O-N 3.16Å; D21-K26 WeakPolarHBondContact OD2-CE 2.8Å; D21-K26 IonicContact OD2-NZ 2.65Å; D21-K26 PolarHBondContact OD2-NZ 2.85Å; G24-K26 PolarHBondContact O-N 3.08Å; K26-V28 PolarHBondContact O-N 3.4Å
27	Q	53	Low	53.6	Low	103 Å²	103	90.6 Å²	90.6	48%	0.481	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	113.9	169.6	-76.9	-176.7	-9.4	0	0	109.2	L11 F12 E13 V25	L11-Q27 HydrophobicContact CD1-CB 3.77Å; L11-Q27 HydrophobicContact CD1-CG 3.95Å; L11-Q27 HydrophobicContact CG-CG 4.48Å; F12-Q27 CarbonylContact O-C 3.52Å; F12-Q27 WeakPolarHBondContact O-CA 3.46Å; E13-Q27 HydrophobicContact CG-CG 4.22Å; V25-Q27 PolarHBondContact O-N 3.35Å
28	V	56	Low	53.4	Low	66 Å²	66	84.8 Å²	84.8	40%	0.4	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	119.8	171.8	-179.1	0	0	0	0	107.3	F12 V14 K26 V30	F12-V28 PolarHBondContact N-O 3.1Å; F12-V28 PolarHBondContact O-N 2.82Å; V14-V28 HydrophobicContact CB-CG2 4.28Å; V14-V28 HydrophobicContact CG2-CB 4.04Å; V14-V28 HydrophobicContact CG2-CG2 3.6Å; K26-V28 PolarHBondContact O-N 3.4Å; V28-V30 HydrophobicContact CG1-CG2 4.32Å
29	F	55.9	Low	53.2	Low	50 Å²	50	84.6 Å²	84.6	22%	0.219	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	135.3	168.3	-65.3	-91.2	0	0	0	107.7	L9 L11 F50 N72	L9-F29 HydrophobicContact CB-CD1 4.26Å; L9-F29 HydrophobicContact CD1-CD1 4.49Å; L11-F29 HydrophobicContact CD1-CD1 3.93Å; L11-F29 HydrophobicContact CD1-CD2 4.43Å; L11-F29 HydrophobicContact CD1-CE1 3.55Å; L11-F29 HydrophobicContact CD1-CE2 4.07Å; L11-F29 HydrophobicContact CD1-CG 4.36Å; L11-F29 HydrophobicContact CD1-CZ 3.61Å; F29-F50 HydrophobicContact CB-CE1 3.76Å; F29-F50 HydrophobicContact CB-CZ 4.35Å; F29-F50 WeakPolarHBondContact O-CE1 3.17Å; F29-F50 WeakPolarHBondContact O-CZ 3.32Å; F29-N72 HydrophobicContact CE1-CB 4.14Å; F29-N72 HydrophobicContact CZ-CB 4.03Å
30	V	58	Low	53	Low	53 Å²	53	82 Å²	82	32%	0.321	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	124.8	170.7	177.5	0	0	0	0	107	Q10 F12 V28 N32	Q10-V30 PolarHBondContact N-O 2.81Å; Q10-V30 PolarHBondContact O-N 2.82Å; F12-V30 HydrophobicContact CD2-CB 4.03Å; F12-V30 HydrophobicContact CD2-CG2 3.56Å; F12-V30 HydrophobicContact CE2-CB 3.84Å; F12-V30 HydrophobicContact CE2-CG2 3.71Å; V28-V30 HydrophobicContact CG1-CG2 4.32Å; V30-N32 PolarHBondContact O-N 3.46Å
31	P	53.5	Low	52.7	Low	30 Å²	30	78.5 Å²	78.5	20%	0.195	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	117.3	-178	22.6	-2.5	0	0	0	107.7	L9 F50 V55	L9-P31 HydrophobicContact CD2-CB 3.85Å; P31-F50 HydrophobicContact CB-CZ 4.39Å; P31-F50 VanDerWaalsContact CD-CE2 3.4Å; P31-F50 HydrophobicContact CG-CE1 4.46Å; P31-F50 HydrophobicContact CG-CE2 3.54Å; P31-F50 HydrophobicContact CG-CZ 3.43Å; P31-F50 VanDerWaalsContact CG-CZ 3.43Å; P31-V55 HydrophobicContact CB-CB 4.5Å; P31-V55 HydrophobicContact CB-CG1 3.74Å; P31-V55 HydrophobicContact CB-CG2 4.14Å; P31-V55 HydrophobicContact CG-CG1 3.87Å; P31-V55 HydrophobicContact CG-CG2 4.2Å
32	N	50.6	Low	52.6	Low	44 Å²	44	79.5 Å²	79.5	24%	0.235	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	131	168.5	-66.9	-70.5	0	0	0	108.2	Y8 Q10 V30	Y8-N32 HydrophobicContact CD1-CB 3.88Å; Y8-N32 HydrophobicContact CD2-CB 3.8Å; Y8-N32 HydrophobicContact CE1-CB 3.37Å; Y8-N32 HydrophobicContact CE2-CB 3.3Å; Y8-N32 WeakPolarHBondContact CE2-ND2 3.24Å; Y8-N32 HydrophobicContact CG-CB 4.08Å; Y8-N32 PolarHBondContact N-O 2.81Å; Y8-N32 PolarHBondContact O-N 2.83Å; Y8-N32 VanDerWaalsContact O-O 3.07Å; Y8-N32 VanDerWaalsContact OH-CB 3.32Å; Y8-N32 WeakPolarHBondContact OH-CB 3.48Å; Q10-N32 VanDerWaalsContact CB-ND2 3.31Å; Q10-N32 WeakPolarHBondContact CB-ND2 3.31Å; Q10-N32 PolarHBondContact OE1-ND2 3.43Å; Q10-N32 VanDerWaalsContact OE1-ND2 3.08Å; V30-N32 PolarHBondContact O-N 3.46Å
33	I	55.5	Low	52.9	Low	47 Å²	47	80.8 Å²	80.8	24%	0.241	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	113.4	-174.8	-51.7	177	0	0	0	106.8	V5 I7 L35 V46 L57	V5-I33 HydrophobicContact CG1-CG2 4.03Å; I7-I33 HydrophobicContact CG1-CG2 4.24Å; I33-L35 HydrophobicContact CG2-CD1 3.99Å; I33-L35 HydrophobicContact CG2-CG 4.21Å; I33-V46 HydrophobicContact CD1-CB 4.2Å; I33-V46 HydrophobicContact CD1-CG1 3.32Å; I33-V46 HydrophobicContact CG2-CG1 4.18Å; I33-V46 HydrophobicContact CG2-CG2 4.38Å; I33-L57 HydrophobicContact CD1-CD1 3.92Å; I33-L57 HydrophobicContact CD1-CD2 3.42Å; I33-L57 VanDerWaalsContact CD1-CD2 3.42Å; I33-L57 HydrophobicContact CD1-CG 4.27Å; I33-L57 HydrophobicContact CG1-CD1 4.24Å; I33-L57 HydrophobicContact CG1-CD2 4.37Å
34	L	51.3	Low	53	Low	79 Å²	79	76.9 Å²	76.9	41%	0.414	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.5	171.6	-72.4	168	0	0	0	108.7	V6 Y8 F36	V6-L34 HydrophobicContact CB-CB 4.36Å; V6-L34 PolarHBondContact N-O 2.94Å; V6-L34 PolarHBondContact O-N 2.83Å; V6-L34 VanDerWaalsContact O-O 3.09Å; Y8-L34 HydrophobicContact CD1-CD1 4.12Å; Y8-L34 HydrophobicContact CD1-CG 4.5Å; Y8-L34 HydrophobicContact CE1-CD1 3.53Å; Y8-L34 HydrophobicContact CE1-CG 3.82Å; L34-F36 HydrophobicContact CB-CE2 4.04Å
35	L	51.5	Low	53	Low	55 Å²	55	79 Å²	79	29%	0.288	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	114.3	176.8	-66.4	120.6	0	0	0	108.1	V5 I33 Q37 F44 V46 L59	V5-L35 HydrophobicContact CG1-CD2 4.12Å; V5-L35 HydrophobicContact CG1-CG 4.46Å; V5-L35 HydrophobicContact CG2-CD2 4.12Å; I33-L35 HydrophobicContact CG2-CD1 3.99Å; I33-L35 HydrophobicContact CG2-CG 4.21Å; L35-Q37 PolarHBondContact O-N 3.42Å; L35-F44 HydrophobicContact CB-CE1 4.19Å; L35-F44 HydrophobicContact CB-CE2 4.06Å; L35-F44 HydrophobicContact CB-CZ 3.61Å; L35-F44 HydrophobicContact CD1-CD2 4.02Å; L35-F44 HydrophobicContact CD1-CE2 3.1Å; L35-F44 HydrophobicContact CD1-CZ 3.49Å; L35-F44 VanDerWaalsContact CD1-CZ 3.49Å; L35-F44 HydrophobicContact CD2-CD2 3.64Å; L35-F44 HydrophobicContact CD2-CE1 4.32Å; L35-F44 HydrophobicContact CD2-CE2 3.48Å; L35-F44 VanDerWaalsContact CD2-CE2 3.48Å; L35-F44 HydrophobicContact CD2-CG 4.21Å; L35-F44 HydrophobicContact CD2-CZ 3.82Å; L35-F44 HydrophobicContact CG-CD2 4.32Å; L35-F44 HydrophobicContact CG-CE2 3.66Å; L35-F44 HydrophobicContact CG-CZ 3.78Å; L35-V46 HydrophobicContact CD1-CG2 3.85Å; L35-V46 HydrophobicContact CD2-CG2 3.87Å; L35-V46 HydrophobicContact CG-CG2 4.39Å; L35-L59 HydrophobicContact CD2-CD2 3.75Å
36	F	50.2	Low	53.3	Low	128 Å²	128	77.1 Å²	77.1	56%	0.561	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	102.3	170.6	-66.6	-85.6	0	0	0	107.6	T4 V6 L34 S38	T4-F36 PolarHBondContact O-N 2.86Å; V6-F36 HydrophobicContact CB-CD2 4.44Å; V6-F36 HydrophobicContact CB-CE2 4.09Å; V6-F36 HydrophobicContact CG2-CD2 3.84Å; V6-F36 HydrophobicContact CG2-CE2 3.7Å; L34-F36 HydrophobicContact CB-CE2 4.04Å; F36-S38 PolarHBondContact O-N 3.22Å
37	Q	48.2	Very low	53.6	Low	118 Å²	118	78.7 Å²	78.7	55%	0.551	42%	0.419	S	S	*	.			trans	-74.5	115.1	176.2	-173	176.4	0.8	0	0	109.3	L35 L41	L35-Q37 PolarHBondContact O-N 3.42Å; Q37-L41 PolarHBondContact NE2-O 3.22Å
38	S	51.4	Low	54.1	Low	57 Å²	57	76.2 Å²	76.2	40%	0.399	42%	0.421	S	S	.	.			trans	-70.2	131	150.7	171.8	0	0	0	0	106.8	F36 E40	F36-S38 PolarHBondContact O-N 3.22Å; S38-E40 PolarHBondContact O-N 3.06Å
39	S	49.7	Very low	54.2	Low	106 Å²	106	78.4 Å²	78.4	74%	0.741	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	15.4	-153.3	50.8	0	0	0	0	120.3
40	E	49.4	Very low	54.4	Low	146 Å²	146	80.5 Å²	80.5	68%	0.682	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.4	8.7	-166.2	-81.7	-179	-173.6	0	0	116.8	M1 S38	M1-E40 HydrophobicContact CE-CB 3.09Å; M1-E40 HydrophobicContact CE-CG 4.24Å; M1-E40 WeakPolarHBondContact CE-OE2 3.36Å; S38-E40 PolarHBondContact O-N 3.06Å
41	L	50.3	Low	54.4	Low	16 Å²	16	81.9 Å²	81.9	8%	0.084	44%	0.441	C	S	.	.			trans	-90	132.6	167.4	-87.9	178.6	0	0	0	112.1	F3 Q37 A61 E62	F3-L41 HydrophobicContact CD1-CD1 3.67Å; F3-L41 HydrophobicContact CD1-CG 4.38Å; F3-L41 HydrophobicContact CD2-CD1 4.19Å; F3-L41 HydrophobicContact CE1-CB 4.26Å; F3-L41 HydrophobicContact CE1-CD1 3.14Å; F3-L41 HydrophobicContact CE1-CG 3.42Å; F3-L41 VanDerWaalsContact CE1-CG 3.42Å; F3-L41 HydrophobicContact CE2-CD1 3.71Å; F3-L41 HydrophobicContact CE2-CG 4.31Å; F3-L41 HydrophobicContact CG-CD1 4.17Å; F3-L41 HydrophobicContact CZ-CD1 3.16Å; F3-L41 HydrophobicContact CZ-CD2 4.11Å; F3-L41 HydrophobicContact CZ-CG 3.37Å; Q37-L41 PolarHBondContact NE2-O 3.22Å; L41-A61 HydrophobicContact CD1-CB 4.01Å; L41-E62 HydrophobicContact CD2-CB 4.48Å; L41-E62 HydrophobicContact CD2-CG 3.64Å; L41-E62 VanDerWaalsContact CD2-OE1 3.3Å; L41-E62 WeakPolarHBondContact CD2-OE1 3.48Å
42	S	50.3	Low	54.8	Low	91 Å²	91	88.8 Å²	88.8	64%	0.636	48%	0.476	S	S	*	.			trans	-87.5	-30.1	-179.8	58.9	0	0	0	0	114.4
43	D	56	Low	55.3	Low	127 Å²	127	89.1 Å²	89.1	68%	0.679	49%	0.49	S	S	*	.			trans	-153.4	125.2	178.4	-71.3	-59.5	0	0	0	110.8
44	F	57.4	Low	55.5	Low	76 Å²	76	93.1 Å²	93.1	33%	0.333	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	145.6	163	65.3	-98	0	0	0	109.2	L35 V46 T60 A61	L35-F44 HydrophobicContact CB-CE1 4.19Å; L35-F44 HydrophobicContact CB-CE2 4.06Å; L35-F44 HydrophobicContact CB-CZ 3.61Å; L35-F44 HydrophobicContact CD1-CD2 4.02Å; L35-F44 HydrophobicContact CD1-CE2 3.1Å; L35-F44 HydrophobicContact CD1-CZ 3.49Å; L35-F44 VanDerWaalsContact CD1-CZ 3.49Å; L35-F44 HydrophobicContact CD2-CD2 3.64Å; L35-F44 HydrophobicContact CD2-CE1 4.32Å; L35-F44 HydrophobicContact CD2-CE2 3.48Å; L35-F44 VanDerWaalsContact CD2-CE2 3.48Å; L35-F44 HydrophobicContact CD2-CG 4.21Å; L35-F44 HydrophobicContact CD2-CZ 3.82Å; L35-F44 HydrophobicContact CG-CD2 4.32Å; L35-F44 HydrophobicContact CG-CE2 3.66Å; L35-F44 HydrophobicContact CG-CZ 3.78Å; F44-V46 HydrophobicContact CD2-CG2 3.88Å; F44-V46 HydrophobicContact CE2-CG2 4.17Å; F44-T60 VanDerWaalsContact CA-O 3.26Å; F44-T60 WeakPolarHBondContact CA-O 3.44Å; F44-A61 HydrophobicContact CB-CB 4.24Å
45	V	56.9	Low	56.1	Low	80 Å²	80	89.4 Å²	89.4	49%	0.485	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.8	172.2	-178.6	0	0	0	0	107.9	K47 T60	V45-K47 HydrophobicContact CG1-CG 4.05Å; V45-T60 PolarHBondContact N-O 3.41Å; V45-T60 PolarHBondContact O-N 2.79Å
46	V	59.9	Low	56.7	Low	37 Å²	37	86.8 Å²	86.8	22%	0.224	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	120.3	168.8	-165.2	0	0	0	0	109.8	I33 L35 F44 F58 L59	I33-V46 HydrophobicContact CD1-CB 4.2Å; I33-V46 HydrophobicContact CD1-CG1 3.32Å; I33-V46 HydrophobicContact CG2-CG1 4.18Å; I33-V46 HydrophobicContact CG2-CG2 4.38Å; L35-V46 HydrophobicContact CD1-CG2 3.85Å; L35-V46 HydrophobicContact CD2-CG2 3.87Å; L35-V46 HydrophobicContact CG-CG2 4.39Å; F44-V46 HydrophobicContact CD2-CG2 3.88Å; F44-V46 HydrophobicContact CE2-CG2 4.17Å; V46-F58 CarbonylContact C-O 3.5Å; V46-F58 VanDerWaalsContact CA-O 3.3Å; V46-F58 WeakPolarHBondContact CA-O 3.23Å; V46-L59 HydrophobicContact CG1-CD2 4.42Å; V46-L59 HydrophobicContact CG1-CG 4.12Å; V46-L59 HydrophobicContact CG2-CD2 3.46Å; V46-L59 VanDerWaalsContact CG2-CD2 3.46Å; V46-L59 HydrophobicContact CG2-CG 3.99Å
47	K	60.7	Low	57.4	Low	144 Å²	144	80.8 Å²	80.8	63%	0.626	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.6	171	-63.3	-179	-178.9	174	0	108.9	V45 L57 F58	V45-K47 HydrophobicContact CG1-CG 4.05Å; K47-L57 CarbonylContact O-C 3.56Å; K47-L57 WeakPolarHBondContact O-CA 3.3Å; K47-F58 HydrophobicContact CB-CB 4.36Å; K47-F58 PolarHBondContact N-O 2.81Å; K47-F58 PolarHBondContact O-N 2.83Å
48	G	62.7	Low	58.1	Low	50 Å²	50	78 Å²	78	52%	0.515	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	140.9	174.4	0	0	0	0	0	112.1	A56 L57	G48-A56 CarbonylContact C-O 3.6Å; G48-A56 VanDerWaalsContact CA-O 3.3Å; G48-A56 WeakPolarHBondContact CA-O 3.34Å; G48-L57 VanDerWaalsContact CA-CD2 3.48Å
49	Q	58.1	Low	58.8	Low	112 Å²	112	76.1 Å²	76.1	52%	0.523	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	131.8	172.5	-171.5	175.8	7.1	0	0	110.4	L51 A56	Q49-L51 HydrophobicContact CG-CD2 4.13Å; Q49-L51 HydrophobicContact CG-CG 4.18Å; Q49-A56 PolarHBondContact N-O 3.46Å; Q49-A56 PolarHBondContact O-N 2.85Å
50	F	60.3	Low	59.3	Low	94 Å²	94	73.5 Å²	73.5	41%	0.412	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	128.3	168.3	-77.5	-81.7	0	0	0	110.8	F29 P31 R54 V55	F29-F50 HydrophobicContact CB-CE1 3.76Å; F29-F50 HydrophobicContact CB-CZ 4.35Å; F29-F50 WeakPolarHBondContact O-CE1 3.17Å; F29-F50 WeakPolarHBondContact O-CZ 3.32Å; P31-F50 HydrophobicContact CB-CZ 4.39Å; P31-F50 VanDerWaalsContact CD-CE2 3.4Å; P31-F50 HydrophobicContact CG-CE1 4.46Å; P31-F50 HydrophobicContact CG-CE2 3.54Å; P31-F50 HydrophobicContact CG-CZ 3.43Å; P31-F50 VanDerWaalsContact CG-CZ 3.43Å; F50-R54 CarbonylContact C-O 3.6Å; F50-R54 WeakPolarHBondContact CA-O 3.3Å; F50-V55 HydrophobicContact CD1-CG2 3.64Å; F50-V55 HydrophobicContact CE1-CG2 3.18Å; F50-V55 HydrophobicContact CG-CG2 4.49Å; F50-V55 HydrophobicContact CZ-CG2 3.69Å
51	L	58.3	Low	59.7	Low	82 Å²	82	67.6 Å²	67.6	43%	0.429	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	107.3	178.4	-64.1	171.4	0	0	0	108.5	Q49 G53 R54 A56	Q49-L51 HydrophobicContact CG-CD2 4.13Å; Q49-L51 HydrophobicContact CG-CG 4.18Å; L51-G53 PolarHBondContact O-N 2.85Å; L51-R54 PolarHBondContact N-O 2.76Å; L51-R54 WeakPolarHBondContact O-CA 3.32Å; L51-R54 VanDerWaalsContact O-CB 3.3Å; L51-R54 WeakPolarHBondContact O-CB 3.39Å; L51-R54 PolarHBondContact O-N 3.18Å; L51-A56 HydrophobicContact CD1-CB 3.92Å
52	N	61.4	Low	60.1	Low	175 Å²	175	72.1 Å²	72.1	94%	0.936	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	49.6	172.1	-60.2	-19.7	0	0	0	114.6	R54	N52-R54 VanDerWaalsContact C-N 3.27Å; N52-R54 PolarHBondContact O-N 2.88Å
53	G	60.9	Low	60.3	Low	52 Å²	52	76.7 Å²	76.7	54%	0.536	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	5.7	-178.8	0	0	0	0	0	114.9	L51	L51-G53 PolarHBondContact O-N 2.85Å
54	R	60.9	Low	60.2	Low	130 Å²	130	74.9 Å²	74.9	49%	0.491	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	154.6	173.7	-49.7	-164	169.1	142.7	-0.4	110.9	F50 L51 N52 I69 A70 D71	F50-R54 CarbonylContact C-O 3.6Å; F50-R54 WeakPolarHBondContact CA-O 3.3Å; L51-R54 PolarHBondContact N-O 2.76Å; L51-R54 WeakPolarHBondContact O-CA 3.32Å; L51-R54 VanDerWaalsContact O-CB 3.3Å; L51-R54 WeakPolarHBondContact O-CB 3.39Å; L51-R54 PolarHBondContact O-N 3.18Å; N52-R54 VanDerWaalsContact C-N 3.27Å; N52-R54 PolarHBondContact O-N 2.88Å; R54-I69 HydrophobicContact CB-CG2 3.9Å; R54-I69 HydrophobicContact CG-CG2 4.41Å; R54-A70 CarbonylContact C-O 3.55Å; R54-A70 VanDerWaalsContact CA-O 3.23Å; R54-A70 WeakPolarHBondContact CA-O 3.39Å; R54-A70 WeakPolarHBondContact CB-O 2.99Å; R54-D71 HydrophobicContact CB-CB 4.4Å; R54-D71 HydrophobicContact CG-CB 3.82Å; R54-D71 IonicContact NE-OD2 2.72Å
55	V	62.7	Low	60.2	Low	1 Å²	1	75.3 Å²	75.3	1%	0.006	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	115.2	169.8	-176.1	0	0	0	0	108.6	L9 P31 F50 L57 I69 A70	L9-V55 HydrophobicContact CD2-CB 4.08Å; L9-V55 HydrophobicContact CD2-CG2 3.45Å; L9-V55 VanDerWaalsContact CD2-CG2 3.45Å; P31-V55 HydrophobicContact CB-CB 4.5Å; P31-V55 HydrophobicContact CB-CG1 3.74Å; P31-V55 HydrophobicContact CB-CG2 4.14Å; P31-V55 HydrophobicContact CG-CG1 3.87Å; P31-V55 HydrophobicContact CG-CG2 4.2Å; F50-V55 HydrophobicContact CD1-CG2 3.64Å; F50-V55 HydrophobicContact CE1-CG2 3.18Å; F50-V55 HydrophobicContact CG-CG2 4.49Å; F50-V55 HydrophobicContact CZ-CG2 3.69Å; V55-L57 HydrophobicContact CG1-CD1 4.49Å; V55-L57 HydrophobicContact CG1-CD2 3.52Å; V55-L57 HydrophobicContact CG1-CG 3.8Å; V55-I69 CarbonylContact O-C 3.49Å; V55-I69 WeakPolarHBondContact O-CA 3.48Å; V55-A70 PolarHBondContact N-O 3.38Å; V55-A70 PolarHBondContact O-N 2.87Å
56	A	64.7	Low	60.2	Low	1 Å²	1	73.5 Å²	73.5	1%	0.008	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126	165.8	0	0	0	0	0	108.9	G48 Q49 L51 F58 F67 F68	G48-A56 CarbonylContact C-O 3.6Å; G48-A56 VanDerWaalsContact CA-O 3.3Å; G48-A56 WeakPolarHBondContact CA-O 3.34Å; Q49-A56 PolarHBondContact N-O 3.46Å; Q49-A56 PolarHBondContact O-N 2.85Å; L51-A56 HydrophobicContact CD1-CB 3.92Å; A56-F58 HydrophobicContact CB-CE2 4.3Å; A56-F67 HydrophobicContact CB-CE2 3.8Å; A56-F67 HydrophobicContact CB-CZ 4.14Å; A56-F68 CarbonylContact C-O 3.6Å; A56-F68 VanDerWaalsContact CA-O 3.32Å; A56-F68 WeakPolarHBondContact CA-O 3.27Å
57	L	66	Low	60.3	Low	1 Å²	1	73.1 Å²	73.1	1%	0.005	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	135.8	175	-59.6	176.5	0	0	0	110.3	I7 I33 K47 G48 V55 F67 F68	I7-L57 HydrophobicContact CB-CD1 4Å; I7-L57 HydrophobicContact CD1-CD1 3.25Å; I7-L57 HydrophobicContact CG1-CD1 3.33Å; I7-L57 HydrophobicContact CG2-CD1 3.46Å; I7-L57 VanDerWaalsContact CG2-CD1 3.46Å; I33-L57 HydrophobicContact CD1-CD1 3.92Å; I33-L57 HydrophobicContact CD1-CD2 3.42Å; I33-L57 VanDerWaalsContact CD1-CD2 3.42Å; I33-L57 HydrophobicContact CD1-CG 4.27Å; I33-L57 HydrophobicContact CG1-CD1 4.24Å; I33-L57 HydrophobicContact CG1-CD2 4.37Å; K47-L57 CarbonylContact O-C 3.56Å; K47-L57 WeakPolarHBondContact O-CA 3.3Å; G48-L57 VanDerWaalsContact CA-CD2 3.48Å; V55-L57 HydrophobicContact CG1-CD1 4.49Å; V55-L57 HydrophobicContact CG1-CD2 3.52Å; V55-L57 HydrophobicContact CG1-CG 3.8Å; L57-F67 CarbonylContact O-C 3.46Å; L57-F67 WeakPolarHBondContact O-CA 3.38Å; L57-F68 HydrophobicContact CB-CB 4.26Å; L57-F68 PolarHBondContact N-O 3Å; L57-F68 PolarHBondContact O-N 2.95Å
58	F	63.1	Low	60.4	Low	61 Å²	61	67.9 Å²	67.9	27%	0.268	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	119.7	175.1	-62.2	-93.8	0	0	0	107.9	V46 K47 A56 F67 F84	V46-F58 CarbonylContact C-O 3.5Å; V46-F58 VanDerWaalsContact CA-O 3.3Å; V46-F58 WeakPolarHBondContact CA-O 3.23Å; K47-F58 HydrophobicContact CB-CB 4.36Å; K47-F58 PolarHBondContact N-O 2.81Å; K47-F58 PolarHBondContact O-N 2.83Å; A56-F58 HydrophobicContact CB-CE2 4.3Å; F58-F67 AromaticContact CD1-CD2 3.62Å; F58-F67 HydrophobicContact CD1-CD2 3.62Å; F58-F67 HydrophobicContact CD1-CE2 4.31Å; F58-F67 HydrophobicContact CD2-CD2 4.32Å; F58-F67 HydrophobicContact CD2-CE2 4.44Å; F58-F67 AromaticContact CE1-CD2 3.25Å; F58-F67 HydrophobicContact CE1-CD2 3.25Å; F58-F67 AromaticContact CE1-CE2 3.59Å; F58-F67 HydrophobicContact CE1-CE2 3.59Å; F58-F67 HydrophobicContact CE1-CG 4.24Å; F58-F67 HydrophobicContact CE2-CD2 4.01Å; F58-F67 AromaticContact CE2-CE2 3.76Å; F58-F67 HydrophobicContact CE2-CE2 3.76Å; F58-F67 HydrophobicContact CG-CD2 4.15Å; F58-F67 AromaticContact CZ-CD2 3.48Å; F58-F67 HydrophobicContact CZ-CD2 3.48Å; F58-F67 VanDerWaalsContact CZ-CD2 3.48Å; F58-F67 AromaticContact CZ-CE2 3.29Å; F58-F67 HydrophobicContact CZ-CE2 3.29Å; F58-F67 HydrophobicContact CZ-CZ 4.43Å; F58-F84 HydrophobicContact CD1-CE2 4.4Å; F58-F84 HydrophobicContact CD1-CZ 4.39Å; F58-F84 HydrophobicContact CE1-CE2 4.29Å; F58-F84 AromaticContact CE1-CZ 3.89Å; F58-F84 HydrophobicContact CE1-CZ 3.89Å
59	L	64.3	Low	60.2	Low	16 Å²	16	67.5 Å²	67.5	8%	0.084	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	115.4	174.5	-81.1	129.7	0	0	0	108.6	V5 L35 V46 E65 T66 F68	V5-L59 HydrophobicContact CB-CD1 4.49Å; V5-L59 HydrophobicContact CG1-CD1 4.04Å; V5-L59 HydrophobicContact CG1-CD2 4.06Å; V5-L59 HydrophobicContact CG2-CD1 4.25Å; V5-L59 HydrophobicContact CG2-CD2 3.77Å; L35-L59 HydrophobicContact CD2-CD2 3.75Å; V46-L59 HydrophobicContact CG1-CD2 4.42Å; V46-L59 HydrophobicContact CG1-CG 4.12Å; V46-L59 HydrophobicContact CG2-CD2 3.46Å; V46-L59 VanDerWaalsContact CG2-CD2 3.46Å; V46-L59 HydrophobicContact CG2-CG 3.99Å; L59-E65 CarbonylContact O-C 3.59Å; L59-E65 VanDerWaalsContact O-CA 3.24Å; L59-E65 WeakPolarHBondContact O-CA 3.26Å; L59-T66 PolarHBondContact N-O 3.47Å; L59-T66 PolarHBondContact O-N 2.84Å; L59-F68 HydrophobicContact CB-CE2 4.3Å; L59-F68 HydrophobicContact CD1-CD2 3.48Å; L59-F68 VanDerWaalsContact CD1-CD2 3.48Å; L59-F68 HydrophobicContact CD1-CE2 3.1Å; L59-F68 HydrophobicContact CD1-CZ 3.93Å; L59-F68 HydrophobicContact CG-CE2 4.28Å
60	T	60.8	Low	60.3	Low	51 Å²	51	62.3 Å²	62.3	31%	0.313	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	121	172.8	-55.1	0	0	0	0	108.2	F44 V45 T64 E65	F44-T60 VanDerWaalsContact CA-O 3.26Å; F44-T60 WeakPolarHBondContact CA-O 3.44Å; V45-T60 PolarHBondContact N-O 3.41Å; V45-T60 PolarHBondContact O-N 2.79Å; T60-T64 WeakPolarHBondContact CA-O 3.3Å; T60-E65 HydrophobicContact CG2-CG 3.83Å; T60-E65 WeakPolarHBondContact CG2-OE1 3.38Å; T60-E65 PolarHBondContact OG1-OE1 3.02Å
61	A	58.3	Low	60.2	Low	22 Å²	22	59.6 Å²	59.6	18%	0.182	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	122.8	176.2	0	0	0	0	0	110.3	L41 F44 H63 T64	L41-A61 HydrophobicContact CD1-CB 4.01Å; F44-A61 HydrophobicContact CB-CB 4.24Å; A61-H63 PolarHBondContact O-N 2.87Å; A61-T64 PolarHBondContact N-O 2.99Å; A61-T64 PolarHBondContact O-N 2.91Å
62	E	58.7	Low	60	Low	112 Å²	112	60.9 Å²	60.9	52%	0.523	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	-62.4	-178.9	-71.6	179.9	177.3	0	0	115.5	L41	L41-E62 HydrophobicContact CD2-CB 4.48Å; L41-E62 HydrophobicContact CD2-CG 3.64Å; L41-E62 VanDerWaalsContact CD2-OE1 3.3Å; L41-E62 WeakPolarHBondContact CD2-OE1 3.48Å
63	H	55	Low	59.7	Low	187 Å²	187	60.4 Å²	60.4	87%	0.866	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-149	5.6	173.7	-58.8	-63.4	0	0	0	114.1	A61	A61-H63 PolarHBondContact O-N 2.87Å
64	T	52.4	Low	59.4	Low	89 Å²	89	59.6 Å²	59.6	55%	0.546	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.4	-178.4	-52.8	0	0	0	0	109.3	T60 A61	T60-T64 WeakPolarHBondContact CA-O 3.3Å; A61-T64 PolarHBondContact N-O 2.99Å; A61-T64 PolarHBondContact O-N 2.91Å
65	E	57.6	Low	59	Low	84 Å²	84	56.6 Å²	56.6	39%	0.393	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122.3	168.7	-61.6	-164.1	142.1	0	0	108.9	L59 T60 F84	L59-E65 CarbonylContact O-C 3.59Å; L59-E65 VanDerWaalsContact O-CA 3.24Å; L59-E65 WeakPolarHBondContact O-CA 3.26Å; T60-E65 HydrophobicContact CG2-CG 3.83Å; T60-E65 WeakPolarHBondContact CG2-OE1 3.38Å; T60-E65 PolarHBondContact OG1-OE1 3.02Å; E65-F84 WeakPolarHBondContact OE2-CD2 3.39Å
66	T	58.5	Low	58.4	Low	43 Å²	43	62.7 Å²	62.7	26%	0.264	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132.1	177.4	-47.6	0	0	0	0	109.8	L59 F68	L59-T66 PolarHBondContact N-O 3.47Å; L59-T66 PolarHBondContact O-N 2.84Å; T66-F68 HydrophobicContact CG2-CD2 4.22Å; T66-F68 HydrophobicContact CG2-CE1 4.23Å; T66-F68 HydrophobicContact CG2-CE2 3.3Å; T66-F68 HydrophobicContact CG2-CZ 3.31Å
67	F	60.1	Low	57.4	Low	29 Å²	29	68.3 Å²	68.3	13%	0.127	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133.8	-176.6	175.7	-107	0	0	0	110.9	A56 L57 F58 I69 I82	A56-F67 HydrophobicContact CB-CE2 3.8Å; A56-F67 HydrophobicContact CB-CZ 4.14Å; L57-F67 CarbonylContact O-C 3.46Å; L57-F67 WeakPolarHBondContact O-CA 3.38Å; F58-F67 AromaticContact CD1-CD2 3.62Å; F58-F67 HydrophobicContact CD1-CD2 3.62Å; F58-F67 HydrophobicContact CD1-CE2 4.31Å; F58-F67 HydrophobicContact CD2-CD2 4.32Å; F58-F67 HydrophobicContact CD2-CE2 4.44Å; F58-F67 AromaticContact CE1-CD2 3.25Å; F58-F67 HydrophobicContact CE1-CD2 3.25Å; F58-F67 AromaticContact CE1-CE2 3.59Å; F58-F67 HydrophobicContact CE1-CE2 3.59Å; F58-F67 HydrophobicContact CE1-CG 4.24Å; F58-F67 HydrophobicContact CE2-CD2 4.01Å; F58-F67 AromaticContact CE2-CE2 3.76Å; F58-F67 HydrophobicContact CE2-CE2 3.76Å; F58-F67 HydrophobicContact CG-CD2 4.15Å; F58-F67 AromaticContact CZ-CD2 3.48Å; F58-F67 HydrophobicContact CZ-CD2 3.48Å; F58-F67 VanDerWaalsContact CZ-CD2 3.48Å; F58-F67 AromaticContact CZ-CE2 3.29Å; F58-F67 HydrophobicContact CZ-CE2 3.29Å; F58-F67 HydrophobicContact CZ-CZ 4.43Å; F67-I69 HydrophobicContact CD1-CG1 4.32Å; F67-I69 HydrophobicContact CE1-CD1 3.49Å; F67-I69 VanDerWaalsContact CE1-CD1 3.49Å; F67-I69 HydrophobicContact CE1-CG1 3.33Å; F67-I69 HydrophobicContact CE2-CG1 4.31Å; F67-I69 HydrophobicContact CZ-CD1 3.57Å; F67-I69 HydrophobicContact CZ-CG1 3.33Å; F67-I82 HydrophobicContact CB-CD1 3.54Å; F67-I82 HydrophobicContact CB-CG1 4.46Å; F67-I82 HydrophobicContact CD1-CD1 3.73Å; F67-I82 HydrophobicContact CG-CD1 3.7Å
68	F	63	Low	56.5	Low	34 Å²	34	71 Å²	71	15%	0.149	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	136.6	-178.8	-55	-104.2	0	0	0	108.6	A56 L57 L59 T66 V75 L77	A56-F68 CarbonylContact C-O 3.6Å; A56-F68 VanDerWaalsContact CA-O 3.32Å; A56-F68 WeakPolarHBondContact CA-O 3.27Å; L57-F68 HydrophobicContact CB-CB 4.26Å; L57-F68 PolarHBondContact N-O 3Å; L57-F68 PolarHBondContact O-N 2.95Å; L59-F68 HydrophobicContact CB-CE2 4.3Å; L59-F68 HydrophobicContact CD1-CD2 3.48Å; L59-F68 VanDerWaalsContact CD1-CD2 3.48Å; L59-F68 HydrophobicContact CD1-CE2 3.1Å; L59-F68 HydrophobicContact CD1-CZ 3.93Å; L59-F68 HydrophobicContact CG-CE2 4.28Å; T66-F68 HydrophobicContact CG2-CD2 4.22Å; T66-F68 HydrophobicContact CG2-CE1 4.23Å; T66-F68 HydrophobicContact CG2-CE2 3.3Å; T66-F68 HydrophobicContact CG2-CZ 3.31Å; F68-V75 HydrophobicContact CD1-CG1 4.42Å; F68-L77 HydrophobicContact CD1-CD2 3.29Å; F68-L77 HydrophobicContact CE1-CD2 3.4Å; F68-L77 VanDerWaalsContact CE1-CD2 3.4Å
69	I	59.6	Low	55.5	Low	42 Å²	42	75 Å²	75	22%	0.215	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	119.2	164.4	-58.8	179.9	0	0	0	107.3	R54 V55 F67 K76	R54-I69 HydrophobicContact CB-CG2 3.9Å; R54-I69 HydrophobicContact CG-CG2 4.41Å; V55-I69 CarbonylContact O-C 3.49Å; V55-I69 WeakPolarHBondContact O-CA 3.48Å; F67-I69 HydrophobicContact CD1-CG1 4.32Å; F67-I69 HydrophobicContact CE1-CD1 3.49Å; F67-I69 VanDerWaalsContact CE1-CD1 3.49Å; F67-I69 HydrophobicContact CE1-CG1 3.33Å; F67-I69 HydrophobicContact CE2-CG1 4.31Å; F67-I69 HydrophobicContact CZ-CD1 3.57Å; F67-I69 HydrophobicContact CZ-CG1 3.33Å; I69-K76 PolarHBondContact O-N 2.71Å; I69-K76 VanDerWaalsContact O-O 3.07Å
70	A	59.5	Low	54.4	Low	3 Å²	3	79.7 Å²	79.7	3%	0.025	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	142.9	169.9	0	0	0	0	0	109.8	L9 R54 V55 G74 V75	L9-A70 HydrophobicContact CD1-CB 4.39Å; R54-A70 CarbonylContact C-O 3.55Å; R54-A70 VanDerWaalsContact CA-O 3.23Å; R54-A70 WeakPolarHBondContact CA-O 3.39Å; R54-A70 WeakPolarHBondContact CB-O 2.99Å; V55-A70 PolarHBondContact N-O 3.38Å; V55-A70 PolarHBondContact O-N 2.87Å; A70-G74 WeakPolarHBondContact CA-O 3.34Å; A70-V75 HydrophobicContact CB-CG2 4.08Å
71	D	58.7	Low	53.3	Low	36 Å²	36	83.6 Å²	83.6	19%	0.193	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	-173	166	66.6	23.6	0	0	0	109.8	R54 Q73 G74	R54-D71 HydrophobicContact CB-CB 4.4Å; R54-D71 HydrophobicContact CG-CB 3.82Å; R54-D71 IonicContact NE-OD2 2.72Å; D71-Q73 PolarHBondContact O-N 3.28Å; D71-Q73 WeakPolarHBondContact OD1-CA 3.24Å; D71-Q73 VanDerWaalsContact OD1-CB 3.27Å; D71-Q73 WeakPolarHBondContact OD1-CB 3.46Å; D71-Q73 PolarHBondContact OD1-N 2.95Å; D71-G74 PolarHBondContact N-O 2.9Å; D71-G74 PolarHBondContact O-N 2.86Å; D71-G74 PolarHBondContact OD1-N 2.84Å
72	N	53.7	Low	52.4	Low	109 Å²	109	85.1 Å²	85.1	58%	0.583	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-11.6	-179.7	71	-11.4	0	0	0	113.9	F29 G74	F29-N72 HydrophobicContact CE1-CB 4.14Å; F29-N72 HydrophobicContact CZ-CB 4.03Å; N72-G74 VanDerWaalsContact C-N 3.34Å
73	Q	55.3	Low	51.3	Low	165 Å²	165	89.7 Å²	89.7	77%	0.771	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-4.1	172.9	-54.8	-58.5	-55.9	0	0	112.2	D71	D71-Q73 PolarHBondContact O-N 3.28Å; D71-Q73 WeakPolarHBondContact OD1-CA 3.24Å; D71-Q73 VanDerWaalsContact OD1-CB 3.27Å; D71-Q73 WeakPolarHBondContact OD1-CB 3.46Å; D71-Q73 PolarHBondContact OD1-N 2.95Å
74	G	54.1	Low	50.5	Low	35 Å²	35	86.2 Å²	86.2	36%	0.361	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	121.1	-167.9	178.1	0	0	0	0	0	113.2	A70 D71 N72 K76	A70-G74 WeakPolarHBondContact CA-O 3.34Å; D71-G74 PolarHBondContact N-O 2.9Å; D71-G74 PolarHBondContact O-N 2.86Å; D71-G74 PolarHBondContact OD1-N 2.84Å; N72-G74 VanDerWaalsContact C-N 3.34Å; G74-K76 PolarHBondContact O-N 2.8Å
75	V	52.3	Low	49.5	Very low	67 Å²	67	91.4 Å²	91.4	41%	0.406	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	111.2	179.7	-174.1	0	0	0	0	109	F68 A70 L77	F68-V75 HydrophobicContact CD1-CG1 4.42Å; A70-V75 HydrophobicContact CB-CG2 4.08Å; V75-L77 HydrophobicContact CG1-CD2 3.89Å; V75-L77 HydrophobicContact CG1-CG 4.02Å; V75-L77 PolarHBondContact O-N 2.9Å
76	K	51.3	Low	48.4	Very low	129 Å²	129	96.4 Å²	96.4	56%	0.561	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	98.3	165.1	-161.6	-175.8	178.3	-153	0	107.6	I69 G74 E78	I69-K76 PolarHBondContact O-N 2.71Å; I69-K76 VanDerWaalsContact O-O 3.07Å; G74-K76 PolarHBondContact O-N 2.8Å; K76-E78 VanDerWaalsContact C-N 3.25Å; K76-E78 HydrophobicContact CD-CG 4.44Å; K76-E78 HydrophobicContact CG-CG 4.45Å; K76-E78 IonicContact NZ-OE1 3.82Å; K76-E78 PolarHBondContact NZ-OE1 2.72Å; K76-E78 PolarHBondContact O-N 2.71Å
77	L	43.7	Very low	47.2	Very low	119 Å²	119	105.6 Å²	105.6	62%	0.623	50%	0.495	S	S	*	.			trans	-68.1	85	172.6	-68.3	169.3	0	0	0	109.3	F68 V75 N79	F68-L77 HydrophobicContact CD1-CD2 3.29Å; F68-L77 HydrophobicContact CE1-CD2 3.4Å; F68-L77 VanDerWaalsContact CE1-CD2 3.4Å; V75-L77 HydrophobicContact CG1-CD2 3.89Å; V75-L77 HydrophobicContact CG1-CG 4.02Å; V75-L77 PolarHBondContact O-N 2.9Å; L77-N79 VanDerWaalsContact C-N 3.26Å; L77-N79 PolarHBondContact O-N 3.12Å; L77-N79 VanDerWaalsContact O-N 3.12Å
78	E	47.6	Very low	46.2	Very low	57 Å²	57	112.4 Å²	112.4	27%	0.266	53%	0.528	S	S	.	.			trans	-79.2	88.2	159.7	-66.5	-165.3	178.5	0	0	106.5	K76 K80	K76-E78 VanDerWaalsContact C-N 3.25Å; K76-E78 HydrophobicContact CD-CG 4.44Å; K76-E78 HydrophobicContact CG-CG 4.45Å; K76-E78 IonicContact NZ-OE1 3.82Å; K76-E78 PolarHBondContact NZ-OE1 2.72Å; K76-E78 PolarHBondContact O-N 2.71Å; E78-K80 HydrophobicContact CB-CD 4.48Å; E78-K80 HydrophobicContact CB-CG 4.41Å; E78-K80 PolarHBondContact O-N 3.23Å; E78-K80 WeakPolarHBondContact OE2-CE 3.3Å; E78-K80 IonicContact OE2-NZ 3.65Å; E78-K80 PolarHBondContact OE2-NZ 3.12Å
79	N	40.6	Very low	45	Very low	146 Å²	146	113.3 Å²	113.3	78%	0.781	55%	0.547	S	S	*	.			trans	-68	73.3	170.8	-158.8	5.3	0	0	0	108.2	L77	L77-N79 VanDerWaalsContact C-N 3.26Å; L77-N79 PolarHBondContact O-N 3.12Å; L77-N79 VanDerWaalsContact O-N 3.12Å
80	K	41.3	Very low	44	Very low	115 Å²	115	118.3 Å²	118.3	50%	0.5	57%	0.574	S	S	.	*			trans	-84.1	122.4	170.5	-78.2	173.4	171.6	157	0	105.2	E78 I82	E78-K80 HydrophobicContact CB-CD 4.48Å; E78-K80 HydrophobicContact CB-CG 4.41Å; E78-K80 PolarHBondContact O-N 3.23Å; E78-K80 WeakPolarHBondContact OE2-CE 3.3Å; E78-K80 IonicContact OE2-NZ 3.65Å; E78-K80 PolarHBondContact OE2-NZ 3.12Å; K80-I82 HydrophobicContact CB-CD1 4.13Å; K80-I82 HydrophobicContact CB-CG1 3.55Å; K80-I82 WeakPolarHBondContact O-CG1 3.38Å; K80-I82 PolarHBondContact O-N 2.89Å
81	D	39.1	Very low	43.2	Very low	133 Å²	133	125.8 Å²	125.8	71%	0.711	61%	0.613	S	S	*	*			trans	-67.4	74.3	167.7	-157.6	22.2	0	0	0	107.1	R83	D81-R83 PolarHBondContact O-N 2.73Å; D81-R83 IonicContact OD2-NE 2.95Å; D81-R83 IonicContact OD2-NH2 3.7Å
82	I	37.4	Very low	42.1	Very low	53 Å²	53	128.4 Å²	128.4	27%	0.272	63%	0.634	S	S	.	*			trans	-79.8	94	-175.9	-53.2	-176.1	0	0	0	107.1	F67 K80 F84	F67-I82 HydrophobicContact CB-CD1 3.54Å; F67-I82 HydrophobicContact CB-CG1 4.46Å; F67-I82 HydrophobicContact CD1-CD1 3.73Å; F67-I82 HydrophobicContact CG-CD1 3.7Å; K80-I82 HydrophobicContact CB-CD1 4.13Å; K80-I82 HydrophobicContact CB-CG1 3.55Å; K80-I82 WeakPolarHBondContact O-CG1 3.38Å; K80-I82 PolarHBondContact O-N 2.89Å; I82-F84 HydrophobicContact CB-CD2 4.37Å; I82-F84 HydrophobicContact CB-CE2 4.05Å; I82-F84 HydrophobicContact CG2-CD2 3.59Å; I82-F84 HydrophobicContact CG2-CE1 4.3Å; I82-F84 HydrophobicContact CG2-CE2 3.28Å; I82-F84 HydrophobicContact CG2-CG 4.26Å; I82-F84 HydrophobicContact CG2-CZ 3.67Å; I82-F84 PolarHBondContact O-N 3.16Å; I82-F84 VanDerWaalsContact O-N 3.12Å
83	R	37.5	Very low	41.6	Very low	209 Å²	209	131.6 Å²	131.6	79%	0.789	65%	0.645	S	S	*	*			trans	-77.7	93.8	167.5	-60.8	-175.2	-172.2	-172.6	1.3	108.3	D81 K85	D81-R83 PolarHBondContact O-N 2.73Å; D81-R83 IonicContact OD2-NE 2.95Å; D81-R83 IonicContact OD2-NH2 3.7Å; R83-K85 PolarHBondContact O-N 2.73Å
84	F	37	Very low	40.5	Very low	113 Å²	113	136.8 Å²	136.8	50%	0.496	67%	0.665	S	S	.	*			trans	-65.3	118	163.4	-72.2	-85.7	0	0	0	107.7	F58 E65 I82 K86	F58-F84 HydrophobicContact CD1-CE2 4.4Å; F58-F84 HydrophobicContact CD1-CZ 4.39Å; F58-F84 HydrophobicContact CE1-CE2 4.29Å; F58-F84 AromaticContact CE1-CZ 3.89Å; F58-F84 HydrophobicContact CE1-CZ 3.89Å; E65-F84 WeakPolarHBondContact OE2-CD2 3.39Å; I82-F84 HydrophobicContact CB-CD2 4.37Å; I82-F84 HydrophobicContact CB-CE2 4.05Å; I82-F84 HydrophobicContact CG2-CD2 3.59Å; I82-F84 HydrophobicContact CG2-CE1 4.3Å; I82-F84 HydrophobicContact CG2-CE2 3.28Å; I82-F84 HydrophobicContact CG2-CG 4.26Å; I82-F84 HydrophobicContact CG2-CZ 3.67Å; I82-F84 PolarHBondContact O-N 3.16Å; I82-F84 VanDerWaalsContact O-N 3.12Å; F84-K86 PolarHBondContact O-N 2.82Å; F84-K86 VanDerWaalsContact O-N 3.11Å
85	K	32.8	Very low	39.8	Very low	199 Å²	199	141.9 Å²	141.9	87%	0.865	68%	0.681	S	S	*	*			trans	-62.4	117	159.7	-76.6	-174.8	177.1	-177	0	105.2	R83 R87	R83-K85 PolarHBondContact O-N 2.73Å; K85-R87 VanDerWaalsContact C-N 3.33Å; K85-R87 PolarHBondContact O-N 2.64Å
86	K	33.1	Very low	39.1	Very low	189 Å²	189	145.8 Å²	145.8	82%	0.822	70%	0.695	S	S	*	*			trans	-45.9	108.5	161.7	-166.2	180	-174.4	-174.8	0	104.9	F84 E88	F84-K86 PolarHBondContact O-N 2.82Å; F84-K86 VanDerWaalsContact O-N 3.11Å; K86-E88 PolarHBondContact O-N 3.19Å
87	R	33.4	Very low	38.4	Very low	235 Å²	235	146.8 Å²	146.8	89%	0.887	70%	0.703	S	S	*	*			trans	-65.5	103.5	164.3	-81	-170.7	179.6	-178.9	0.4	102	K85 G89	K85-R87 VanDerWaalsContact C-N 3.33Å; K85-R87 PolarHBondContact O-N 2.64Å; R87-G89 PolarHBondContact O-N 3.12Å
88	E	38.4	Very low	38.1	Very low	172 Å²	172	148.4 Å²	148.4	80%	0.804	71%	0.707	S	S	*	*			trans	-58	82.5	149.7	-71	-178.4	167.2	0	0	104.1	K86 D90	K86-E88 PolarHBondContact O-N 3.19Å; E88-D90 PolarHBondContact O-N 2.79Å; E88-D90 VanDerWaalsContact O-N 3.16Å
89	G	39.6	Very low	37.5	Very low	54 Å²	54	154.1 Å²	154.1	56%	0.557	74%	0.735	S	S	*	*			trans	-60.6	115.6	157.6	0	0	0	0	0	102.9	R87 L91	R87-G89 PolarHBondContact O-N 3.12Å; G89-L91 VanDerWaalsContact C-N 3.28Å; G89-L91 PolarHBondContact O-N 3.04Å
90	D	37.9	Very low	37.3	Very low	146 Å²	146	154.7 Å²	154.7	78%	0.781	73%	0.732	S	S	*	*			trans	-37	96.7	170.7	-83.4	-45.3	0	0	0	108.8	E88 S92	E88-D90 PolarHBondContact O-N 2.79Å; E88-D90 VanDerWaalsContact O-N 3.16Å; D90-S92 PolarHBondContact O-N 2.75Å
91	L	43	Very low	37.1	Very low	161 Å²	161	157.5 Å²	157.5	84%	0.843	75%	0.748	S	S	*	*			trans	-73.9	55.1	152	-70	168.2	0	0	0	106	G89 E93	G89-L91 VanDerWaalsContact C-N 3.28Å; G89-L91 PolarHBondContact O-N 3.04Å; L91-E93 PolarHBondContact O-N 2.91Å; L91-E93 VanDerWaalsContact O-N 3.12Å
92	S	35.9	Very low	36.9	Very low	91 Å²	91	159.4 Å²	159.4	64%	0.636	75%	0.751	S	S	*	*			trans	-79.2	70.3	153.7	62.2	0	0	0	0	105.5	D90 K94	D90-S92 PolarHBondContact O-N 2.75Å; S92-K94 PolarHBondContact O-N 3.11Å
93	E	42.2	Very low	36.9	Very low	175 Å²	175	168.3 Å²	168.3	82%	0.818	79%	0.791	S	S	*	*			trans	-62.8	119	153.7	-77.5	-171.3	165.3	0	0	106.4	L91	L91-E93 PolarHBondContact O-N 2.91Å; L91-E93 VanDerWaalsContact O-N 3.12Å
94	K	31.5	Very low	36.8	Very low	275 Å²	275	164.5 Å²	164.5	100%	1.196	79%	0.791	S	S	*	*			trans	-51.8	0	155.5	-73.1	175.3	170.7	177	0	111.2	S92	S92-K94 PolarHBondContact O-N 3.11Å

Retrieved 94 of 94 residues in 142.8 ms (Link to these results)

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