Q4JHT3_SCHMA Loading...

Small nuclear ribonucleoprotein Sm D3

AlphaFold DB , UniProt , Accession Q4JHT3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 130 aa.

						>Q4JHT3_SCHMA|Q4JHT3
MSVGIPIKVLHDAEGHVVTLETVSGEVFRGKLVEAEDNMNVHMCDLIMTSRDGRTSNLQQVYIRGSKIRFLILPDMLKNSPMLKRPQGAKGLGTGRGKNAMLRAGVRGRGTFVRGRVATVRGTGRTTGRF
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	56.9	Low	90.3	Very high	246 Å²	246	75.3 Å²	75.3	100%	1.212	43%	0.431	S	S	*	.				0	131.9	0	-68.4	172.8	-166	0	0	107.5
2	S	85.6	Confident	90.7	Very high	120 Å²	120	74.8 Å²	74.8	84%	0.839	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-91.1	118.8	178.7	57.8	0	0	0	0	110.2
3	V	88.2	Confident	91.2	Very high	45 Å²	45	69 Å²	69	27%	0.273	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-71.1	150.5	172.9	-70	0	0	0	0	111.9	I7 K8 D37	V3-I7 HydrophobicContact CB-CB 4.2Å; V3-I7 HydrophobicContact CB-CG2 4.05Å; V3-I7 HydrophobicContact CG1-CG2 4.22Å; V3-I7 HydrophobicContact CG2-CG2 4.47Å; V3-K8 HydrophobicContact CG2-CD 4.46Å; V3-K8 HydrophobicContact CG2-CG 3.68Å; V3-K8 WeakPolarHBondContact O-CE 3.42Å; V3-D37 HydrophobicContact CG1-CB 4.29Å; V3-D37 VanDerWaalsContact CG1-CG 3.49Å; V3-D37 WeakPolarHBondContact CG1-OD1 3.48Å; V3-D37 WeakPolarHBondContact CG1-OD2 3.26Å
4	G	93	Very high	91.7	Very high	42 Å²	42	68.9 Å²	68.9	43%	0.433	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-65	155.1	177.4	0	0	0	0	0	112.5	P6 I7 K8	G4-P6 VanDerWaalsContact C-CD 3.44Å; G4-P6 VanDerWaalsContact C-N 3.31Å; G4-I7 PolarHBondContact O-N 2.89Å; G4-I7 VanDerWaalsContact O-N 3.1Å; G4-K8 PolarHBondContact O-N 2.87Å
5	I	93.3	Very high	92.1	Very high	93 Å²	93	67.1 Å²	67.1	48%	0.477	39%	0.391	S	S	.	.	H	α-helix	trans	-51.1	-43.3	178.6	-65.4	170.1	0	0	0	112.6	I7 K8 V9 M82 L83	I5-I7 VanDerWaalsContact C-N 3.34Å; I5-I7 PolarHBondContact O-N 2.91Å; I5-K8 WeakPolarHBondContact O-CB 3.23Å; I5-K8 PolarHBondContact O-N 2.94Å; I5-V9 HydrophobicContact CG2-CG2 4.46Å; I5-V9 WeakPolarHBondContact O-CG2 3.49Å; I5-V9 PolarHBondContact O-N 2.88Å; I5-M82 HydrophobicContact CG2-CB 4.19Å; I5-M82 VanDerWaalsContact CG2-O 3.29Å; I5-M82 WeakPolarHBondContact CG2-O 3.29Å; I5-L83 HydrophobicContact CG2-CD2 4.5Å
6	P	95.2	Very high	92.5	Very high	99 Å²	99	67.2 Å²	67.2	64%	0.643	39%	0.386	S	S	*	.	H	α-helix	trans	-61.4	-37.7	178.8	-25.6	36.3	0	0	0	114.1	G4 V9 L10	G4-P6 VanDerWaalsContact C-CD 3.44Å; G4-P6 VanDerWaalsContact C-N 3.31Å; P6-V9 PolarHBondContact O-N 2.96Å; P6-L10 PolarHBondContact O-N 2.78Å
7	I	96.3	Very high	92.8	Very high	28 Å²	28	68.2 Å²	68.2	14%	0.144	39%	0.393	C	S	.	.	H	α-helix	trans	-68.2	-39.4	177.8	-59.2	-58	0	0	0	110.4	V3 G4 I5 V9 L10 H11 M39	V3-I7 HydrophobicContact CB-CB 4.2Å; V3-I7 HydrophobicContact CB-CG2 4.05Å; V3-I7 HydrophobicContact CG1-CG2 4.22Å; V3-I7 HydrophobicContact CG2-CG2 4.47Å; G4-I7 PolarHBondContact O-N 2.89Å; G4-I7 VanDerWaalsContact O-N 3.1Å; I5-I7 VanDerWaalsContact C-N 3.34Å; I5-I7 PolarHBondContact O-N 2.91Å; I7-V9 VanDerWaalsContact C-N 3.31Å; I7-V9 PolarHBondContact O-N 2.96Å; I7-L10 WeakPolarHBondContact O-CB 3.22Å; I7-L10 PolarHBondContact O-N 3.34Å; I7-L10 VanDerWaalsContact O-N 3.11Å; I7-H11 PolarHBondContact O-CD2 3.44Å; I7-H11 PolarHBondContact O-N 3.13Å; I7-M39 HydrophobicContact CD1-CG 3.72Å; I7-M39 HydrophobicContact CD1-SD 4.27Å
8	K	94.7	Very high	93.1	Very high	80 Å²	80	64.4 Å²	64.4	35%	0.348	37%	0.372	S	S	.	.	H	α-helix	trans	-59.2	-43	172.8	-62.2	-176.5	179.5	-177.2	0	112.1	V3 G4 I5 L10 H11 D12 M82	V3-K8 HydrophobicContact CG2-CD 4.46Å; V3-K8 HydrophobicContact CG2-CG 3.68Å; V3-K8 WeakPolarHBondContact O-CE 3.42Å; G4-K8 PolarHBondContact O-N 2.87Å; I5-K8 WeakPolarHBondContact O-CB 3.23Å; I5-K8 PolarHBondContact O-N 2.94Å; K8-L10 VanDerWaalsContact C-N 3.29Å; K8-L10 PolarHBondContact O-N 2.87Å; K8-H11 PolarHBondContact O-N 2.83Å; K8-D12 PolarHBondContact O-N 2.96Å; K8-M82 HydrophobicContact CB-CG 4.11Å; K8-M82 HydrophobicContact CB-SD 4.49Å; K8-M82 HydrophobicContact CD-CG 4.5Å; K8-M82 HydrophobicContact CD-SD 3.83Å
9	V	96.1	Very high	93.4	Very high	12 Å²	12	62.6 Å²	62.6	7%	0.073	36%	0.362	C	S	.	.	H	α-helix	trans	-68.4	-30.5	177	177.1	0	0	0	0	111.6	I5 P6 I7 D12 A13 L73 L77 M82 L83	I5-V9 HydrophobicContact CG2-CG2 4.46Å; I5-V9 WeakPolarHBondContact O-CG2 3.49Å; I5-V9 PolarHBondContact O-N 2.88Å; P6-V9 PolarHBondContact O-N 2.96Å; I7-V9 VanDerWaalsContact C-N 3.31Å; I7-V9 PolarHBondContact O-N 2.96Å; V9-D12 WeakPolarHBondContact O-CB 3.39Å; V9-D12 PolarHBondContact O-N 2.83Å; V9-A13 PolarHBondContact O-N 3.11Å; V9-L73 HydrophobicContact CG1-CD1 3.97Å; V9-L77 HydrophobicContact CG1-CB 4.46Å; V9-L77 HydrophobicContact CG1-CD1 4.42Å; V9-M82 HydrophobicContact CG2-CB 3.9Å; V9-L83 HydrophobicContact CG2-CD2 3.96Å; V9-L83 HydrophobicContact CG2-CG 4.05Å
10	L	97.1	Very high	93.6	Very high	9 Å²	9	59.5 Å²	59.5	5%	0.047	34%	0.344	C	S	.	.	H	α-helix	trans	-65.8	-42.5	172.7	179.7	62	0	0	0	111.4	P6 I7 K8 D12 A13 L32 A35 M39 L71 L73	P6-L10 PolarHBondContact O-N 2.78Å; I7-L10 WeakPolarHBondContact O-CB 3.22Å; I7-L10 PolarHBondContact O-N 3.34Å; I7-L10 VanDerWaalsContact O-N 3.11Å; K8-L10 VanDerWaalsContact C-N 3.29Å; K8-L10 PolarHBondContact O-N 2.87Å; L10-D12 VanDerWaalsContact C-N 3.34Å; L10-D12 PolarHBondContact O-N 2.75Å; L10-A13 VanDerWaalsContact O-CB 3.24Å; L10-A13 WeakPolarHBondContact O-CB 3.45Å; L10-A13 PolarHBondContact O-N 3.32Å; L10-L32 HydrophobicContact CD1-CD2 4.2Å; L10-A35 HydrophobicContact CD1-CB 4.44Å; L10-A35 HydrophobicContact CD2-CB 4.01Å; L10-A35 HydrophobicContact CG-CB 3.78Å; L10-M39 HydrophobicContact CD2-CG 4.32Å; L10-L71 HydrophobicContact CD1-CD1 4.42Å; L10-L71 HydrophobicContact CD1-CD2 3.9Å; L10-L73 HydrophobicContact CD1-CD2 4.24Å
11	H	96.6	Very high	93.9	Very high	54 Å²	54	58.4 Å²	58.4	25%	0.25	34%	0.335	C	S	.	.	H	α-helix	trans	-63.1	-38.3	172.3	-68.2	-65.8	0	0	0	112.4	I7 K8 A13 E14 A35 D37	I7-H11 PolarHBondContact O-CD2 3.44Å; I7-H11 PolarHBondContact O-N 3.13Å; K8-H11 PolarHBondContact O-N 2.83Å; H11-A13 PolarHBondContact O-N 2.87Å; H11-A13 VanDerWaalsContact O-N 3.08Å; H11-E14 IonicContact CE1-OE1 3.97Å; H11-E14 IonicContact CG-OE1 3.88Å; H11-E14 IonicContact ND1-OE1 2.97Å; H11-E14 PolarHBondContact ND1-OE1 3.26Å; H11-E14 WeakPolarHBondContact O-CB 3.36Å; H11-E14 WeakPolarHBondContact O-CG 3.32Å; H11-E14 PolarHBondContact O-N 2.9Å; H11-A35 PolarHBondContact CE1-O 2.94Å; H11-A35 PolarHBondContact ND1-O 3.11Å; H11-D37 IonicContact NE2-OD1 3.36Å; H11-D37 PolarHBondContact NE2-OD1 2.99Å
12	D	95.7	Very high	95.8	Very high	69 Å²	69	46.9 Å²	46.9	37%	0.369	28%	0.279	S	S	.	.	H	α-helix	trans	-59.3	-21.6	173.3	-70.5	-10.3	0	0	0	112.3	K8 V9 L10 L77 S80	K8-D12 PolarHBondContact O-N 2.96Å; V9-D12 WeakPolarHBondContact O-CB 3.39Å; V9-D12 PolarHBondContact O-N 2.83Å; L10-D12 VanDerWaalsContact C-N 3.34Å; L10-D12 PolarHBondContact O-N 2.75Å; D12-L77 HydrophobicContact CB-CD2 3.87Å; D12-S80 PolarHBondContact OD2-OG 3.39Å
13	A	97.3	Very high	96.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-10	178.3	0	0	0	0	0	114	V9 L10 H11 H16 V18 L32 L73 L77	V9-A13 PolarHBondContact O-N 3.11Å; L10-A13 VanDerWaalsContact O-CB 3.24Å; L10-A13 WeakPolarHBondContact O-CB 3.45Å; L10-A13 PolarHBondContact O-N 3.32Å; H11-A13 PolarHBondContact O-N 2.87Å; H11-A13 VanDerWaalsContact O-N 3.08Å; A13-H16 WeakPolarHBondContact O-CB 3.29Å; A13-H16 PolarHBondContact O-N 2.94Å; A13-H16 VanDerWaalsContact O-N 3.13Å; A13-H16 PolarHBondContact O-ND1 3.4Å; A13-V18 HydrophobicContact CB-CG1 4.27Å; A13-L32 HydrophobicContact CB-CD2 4.11Å; A13-L73 HydrophobicContact CB-CD1 4.32Å; A13-L73 HydrophobicContact CB-CD2 3.84Å; A13-L73 HydrophobicContact CB-CG 4.48Å; A13-L77 HydrophobicContact CB-CD1 3.52Å
14	E	97.9	Very high	96.8	Very high	67 Å²	67	46.3 Å²	46.3	31%	0.313	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	142.8	176.1	-69.4	172.6	-172.2	0	0	110.7	H11 H16 L32 A35	H11-E14 IonicContact CE1-OE1 3.97Å; H11-E14 IonicContact CG-OE1 3.88Å; H11-E14 IonicContact ND1-OE1 2.97Å; H11-E14 PolarHBondContact ND1-OE1 3.26Å; H11-E14 WeakPolarHBondContact O-CB 3.36Å; H11-E14 WeakPolarHBondContact O-CG 3.32Å; H11-E14 PolarHBondContact O-N 2.9Å; E14-H16 VanDerWaalsContact C-N 3.25Å; E14-H16 PolarHBondContact O-N 2.82Å; E14-H16 PolarHBondContact O-ND1 3.32Å; E14-L32 HydrophobicContact CG-CD2 4.27Å; E14-L32 HydrophobicContact CG-CG 4.41Å; E14-A35 HydrophobicContact CG-CB 4.41Å; E14-A35 PolarHBondContact OE1-N 3.48Å
15	G	97.6	Very high	97.1	Very high	43 Å²	43	45 Å²	45	44%	0.443	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	-7.5	-174.6	0	0	0	0	0	115.4	K31 L32	G15-K31 VanDerWaalsContact O-CE 3.26Å; G15-K31 WeakPolarHBondContact O-CE 3.08Å; G15-L32 WeakPolarHBondContact CA-O 3.44Å; G15-L32 PolarHBondContact N-O 2.88Å
16	H	98.1	Very high	97.3	Very high	68 Å²	68	43.6 Å²	43.6	32%	0.315	25%	0.252	S	S	.	.	S	Bend	trans	-105	162.7	-179	-59	79.1	0	0	0	112.9	A13 E14 V18 K31 L32 P74	A13-H16 WeakPolarHBondContact O-CB 3.29Å; A13-H16 PolarHBondContact O-N 2.94Å; A13-H16 VanDerWaalsContact O-N 3.13Å; A13-H16 PolarHBondContact O-ND1 3.4Å; E14-H16 VanDerWaalsContact C-N 3.25Å; E14-H16 PolarHBondContact O-N 2.82Å; E14-H16 PolarHBondContact O-ND1 3.32Å; H16-V18 PolarHBondContact O-N 3.39Å; H16-K31 WeakPolarHBondContact O-CA 3.17Å; H16-L32 PolarHBondContact O-N 2.86Å; H16-P74 HydrophobicContact CB-CG 3.44Å; H16-P74 VanDerWaalsContact CB-CG 3.44Å
17	V	98.2	Very high	97.4	Very high	84 Å²	84	41 Å²	41	51%	0.509	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	122.4	171.4	178.8	0	0	0	0	109.4	R29 G30	V17-R29 HydrophobicContact CG1-CG 4.19Å; V17-G30 CarbonylContact C-O 3.53Å; V17-G30 WeakPolarHBondContact CA-O 3.44Å
18	V	98.5	Very high	97.5	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	157.4	175.4	-57.9	0	0	0	0	109.5	A13 H16 R29 G30 L32 M43 L73	A13-V18 HydrophobicContact CB-CG1 4.27Å; H16-V18 PolarHBondContact O-N 3.39Å; V18-R29 WeakPolarHBondContact O-CA 3.5Å; V18-G30 PolarHBondContact N-O 3.21Å; V18-G30 PolarHBondContact O-N 2.97Å; V18-G30 VanDerWaalsContact O-N 3.11Å; V18-L32 HydrophobicContact CG1-CB 4.11Å; V18-L32 HydrophobicContact CG1-CD2 4.35Å; V18-L32 HydrophobicContact CG2-CB 3.87Å; V18-M43 HydrophobicContact CG2-CE 3.48Å; V18-M43 VanDerWaalsContact CG2-CE 3.48Å; V18-M43 HydrophobicContact CG2-SD 4.27Å; V18-L73 HydrophobicContact CG1-CD2 3.95Å
19	T	98.5	Very high	97.7	Very high	29 Å²	29	44.2 Å²	44.2	18%	0.178	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	133.6	167.4	-54.4	0	0	0	0	108	V27 F28 R29 L71 I72	T19-V27 HydrophobicContact CG2-CG1 3.49Å; T19-V27 VanDerWaalsContact CG2-CG1 3.49Å; T19-F28 CarbonylContact C-O 3.53Å; T19-F28 VanDerWaalsContact CA-O 3.31Å; T19-F28 WeakPolarHBondContact CA-O 3.47Å; T19-R29 HydrophobicContact CG2-CB 4.42Å; T19-L71 CarbonylContact O-C 3.53Å; T19-L71 WeakPolarHBondContact O-CA 3.33Å; T19-I72 HydrophobicContact CG2-CD1 4.45Å; T19-I72 PolarHBondContact N-O 3.33Å; T19-I72 VanDerWaalsContact N-O 3.09Å; T19-I72 PolarHBondContact O-N 3.08Å
20	L	98.1	Very high	97.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	147.3	172.6	68	94.4	0	0	0	110.5	T22 V27 F28 V41 M43 I63 I68 F70 L71	L20-T22 HydrophobicContact CD1-CG2 4.17Å; L20-V27 CarbonylContact O-C 3.58Å; L20-V27 WeakPolarHBondContact O-CA 3.16Å; L20-F28 HydrophobicContact CD1-CB 4.17Å; L20-F28 HydrophobicContact CD1-CD2 3.92Å; L20-F28 HydrophobicContact CD1-CG 4.4Å; L20-F28 HydrophobicContact CG-CB 4.06Å; L20-F28 PolarHBondContact N-O 3.05Å; L20-F28 PolarHBondContact O-N 3.16Å; L20-V41 HydrophobicContact CD2-CG2 3.93Å; L20-M43 HydrophobicContact CD2-CE 4.33Å; L20-M43 HydrophobicContact CD2-SD 3.24Å; L20-M43 WeakPolarHBondContact CD2-SD 3.29Å; L20-M43 HydrophobicContact CG-SD 4.34Å; L20-I63 HydrophobicContact CD1-CD1 3.69Å; L20-I63 HydrophobicContact CD2-CD1 4.16Å; L20-I63 HydrophobicContact CG-CD1 4.45Å; L20-I68 HydrophobicContact CB-CG2 4.41Å; L20-F70 WeakPolarHBondContact CA-O 3.49Å; L20-L71 HydrophobicContact CB-CD2 4.08Å; L20-L71 HydrophobicContact CB-CG 3.93Å; L20-L71 HydrophobicContact CD2-CD2 4.36Å
21	E	98.4	Very high	97.9	Very high	37 Å²	37	47.9 Å²	47.9	17%	0.173	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	132	172.8	-170.3	-179.9	150	0	0	109.1	E26 V27 R69 F70	E21-E26 WeakPolarHBondContact CA-O 3.35Å; E21-V27 HydrophobicContact CB-CG2 4.35Å; E21-V27 HydrophobicContact CG-CG2 4.02Å; E21-R69 WeakPolarHBondContact O-CB 3.22Å; E21-R69 PolarHBondContact O-N 2.91Å; E21-R69 IonicContact OE1-CZ 3.28Å; E21-R69 VanDerWaalsContact OE1-CZ 3.28Å; E21-R69 IonicContact OE1-NH1 2.6Å; E21-R69 PolarHBondContact OE1-NH1 3.43Å; E21-R69 IonicContact OE1-NH2 3.79Å; E21-F70 HydrophobicContact CB-CD1 4.26Å; E21-F70 HydrophobicContact CB-CE1 3.72Å; E21-F70 HydrophobicContact CB-CE2 4.17Å; E21-F70 HydrophobicContact CB-CZ 3.66Å; E21-F70 HydrophobicContact CG-CE1 4.33Å; E21-F70 HydrophobicContact CG-CZ 4.46Å; E21-F70 PolarHBondContact N-O 2.92Å; E21-F70 VanDerWaalsContact N-O 3.11Å; E21-F70 WeakPolarHBondContact OE2-CE1 3.41Å; E21-F70 WeakPolarHBondContact OE2-CZ 3.45Å
22	T	98.2	Very high	98	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.031	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	164.6	175	60.5	0	0	0	0	111.6	L20 S24 G25 E26 F28 I63 K67	L20-T22 HydrophobicContact CD1-CG2 4.17Å; T22-S24 PolarHBondContact O-N 3.01Å; T22-S24 PolarHBondContact OG1-OG 3.08Å; T22-G25 PolarHBondContact O-N 3.03Å; T22-E26 PolarHBondContact N-O 2.91Å; T22-E26 WeakPolarHBondContact OG1-CB 2.95Å; T22-E26 PolarHBondContact OG1-N 3.29Å; T22-E26 VanDerWaalsContact OG1-N 3.1Å; T22-E26 PolarHBondContact OG1-O 3.45Å; T22-E26 PolarHBondContact OG1-OE2 3.04Å; T22-F28 HydrophobicContact CG2-CD2 3.95Å; T22-F28 HydrophobicContact CG2-CE2 3.56Å; T22-I63 HydrophobicContact CG2-CG2 4.43Å; T22-K67 CarbonylContact C-O 3.44Å; T22-K67 WeakPolarHBondContact CA-O 3.49Å; T22-K67 WeakPolarHBondContact CB-O 3.4Å
23	V	98.2	Very high	98.1	Very high	83 Å²	83	45 Å²	45	50%	0.503	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-28.8	175.6	-174.5	0	0	0	0	111.5	G25 K67 R69	V23-G25 PolarHBondContact O-N 2.84Å; V23-K67 WeakPolarHBondContact CG2-O 2.97Å; V23-K67 PolarHBondContact N-O 2.85Å; V23-R69 PolarHBondContact O-NH2 3.49Å
24	S	96.7	Very high	98.1	Very high	69 Å²	69	50.3 Å²	50.3	48%	0.483	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-12.6	173	31.7	0	0	0	0	114.2	T22 E26	T22-S24 PolarHBondContact O-N 3.01Å; T22-S24 PolarHBondContact OG1-OG 3.08Å; S24-E26 PolarHBondContact OG-OE2 2.88Å
25	G	97.5	Very high	98.2	Very high	16 Å²	16	47.3 Å²	47.3	17%	0.165	26%	0.258	C	S	.	.	S	Bend	trans	86.2	17.3	-178.1	0	0	0	0	0	114.2	T22 V23	T22-G25 PolarHBondContact O-N 3.03Å; V23-G25 PolarHBondContact O-N 2.84Å
26	E	97.4	Very high	98.2	Very high	63 Å²	63	48.1 Å²	48.1	29%	0.294	25%	0.251	S	S	.	.			trans	-83.8	138.1	170.1	-57.8	151.1	134.5	0	0	108.6	E21 T22 S24 F28 M48 T49	E21-E26 WeakPolarHBondContact CA-O 3.35Å; T22-E26 PolarHBondContact N-O 2.91Å; T22-E26 WeakPolarHBondContact OG1-CB 2.95Å; T22-E26 PolarHBondContact OG1-N 3.29Å; T22-E26 VanDerWaalsContact OG1-N 3.1Å; T22-E26 PolarHBondContact OG1-O 3.45Å; T22-E26 PolarHBondContact OG1-OE2 3.04Å; S24-E26 PolarHBondContact OG-OE2 2.88Å; E26-F28 HydrophobicContact CB-CE2 3.76Å; E26-F28 HydrophobicContact CB-CZ 4.36Å; E26-M48 HydrophobicContact CB-CE 3.94Å; E26-M48 HydrophobicContact CG-CE 3.68Å; E26-T49 WeakPolarHBondContact CA-O 3.39Å
27	V	98.5	Very high	98.1	Very high	44 Å²	44	49.9 Å²	49.9	27%	0.267	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	126	-179.1	179.9	0	0	0	0	109.1	T19 L20 E21 M48 T49	T19-V27 HydrophobicContact CG2-CG1 3.49Å; T19-V27 VanDerWaalsContact CG2-CG1 3.49Å; L20-V27 CarbonylContact O-C 3.58Å; L20-V27 WeakPolarHBondContact O-CA 3.16Å; E21-V27 HydrophobicContact CB-CG2 4.35Å; E21-V27 HydrophobicContact CG-CG2 4.02Å; V27-M48 CarbonylContact O-C 3.55Å; V27-M48 WeakPolarHBondContact O-CA 3.33Å; V27-T49 PolarHBondContact N-O 2.99Å; V27-T49 PolarHBondContact O-N 3.11Å
28	F	98.5	Very high	98.1	Very high	19 Å²	19	50 Å²	50	8%	0.083	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	127.5	175.6	-62.6	-99.7	0	0	0	108.8	T19 L20 T22 E26 L46 M48 L58 V61 I63	T19-F28 CarbonylContact C-O 3.53Å; T19-F28 VanDerWaalsContact CA-O 3.31Å; T19-F28 WeakPolarHBondContact CA-O 3.47Å; L20-F28 HydrophobicContact CD1-CB 4.17Å; L20-F28 HydrophobicContact CD1-CD2 3.92Å; L20-F28 HydrophobicContact CD1-CG 4.4Å; L20-F28 HydrophobicContact CG-CB 4.06Å; L20-F28 PolarHBondContact N-O 3.05Å; L20-F28 PolarHBondContact O-N 3.16Å; T22-F28 HydrophobicContact CG2-CD2 3.95Å; T22-F28 HydrophobicContact CG2-CE2 3.56Å; E26-F28 HydrophobicContact CB-CE2 3.76Å; E26-F28 HydrophobicContact CB-CZ 4.36Å; F28-L46 HydrophobicContact CB-CD2 4Å; F28-L46 HydrophobicContact CD1-CD2 4.32Å; F28-M48 HydrophobicContact CD1-CB 3.93Å; F28-M48 HydrophobicContact CD1-CG 4Å; F28-M48 HydrophobicContact CE1-CB 3.89Å; F28-M48 HydrophobicContact CE1-CG 3.6Å; F28-M48 HydrophobicContact CE2-CG 4.42Å; F28-M48 HydrophobicContact CZ-CG 3.83Å; F28-L58 HydrophobicContact CD1-CD1 4.35Å; F28-L58 HydrophobicContact CE1-CD1 3.92Å; F28-V61 HydrophobicContact CD1-CG2 4.49Å; F28-V61 HydrophobicContact CE1-CG1 4.43Å; F28-I63 HydrophobicContact CB-CD1 4.34Å; F28-I63 HydrophobicContact CD1-CD1 4.08Å; F28-I63 HydrophobicContact CD2-CD1 3.79Å; F28-I63 HydrophobicContact CE1-CD1 4.32Å; F28-I63 HydrophobicContact CE2-CD1 4.06Å; F28-I63 HydrophobicContact CG-CD1 3.81Å; F28-I63 HydrophobicContact CZ-CD1 4.31Å
29	R	98.5	Very high	98.1	Very high	157 Å²	157	53.4 Å²	53.4	59%	0.592	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	120.9	173.8	-178.6	178.2	178.9	-177.1	-0.1	109.5	V17 V18 T19 L46 I47	V17-R29 HydrophobicContact CG1-CG 4.19Å; V18-R29 WeakPolarHBondContact O-CA 3.5Å; T19-R29 HydrophobicContact CG2-CB 4.42Å; R29-L46 CarbonylContact O-C 3.5Å; R29-L46 VanDerWaalsContact O-CA 3.23Å; R29-L46 WeakPolarHBondContact O-CA 3.26Å; R29-I47 PolarHBondContact N-O 3.21Å; R29-I47 PolarHBondContact O-N 2.6Å
30	G	98.4	Very high	98.1	Very high	4 Å²	4	52.7 Å²	52.7	4%	0.041	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.5	-170.4	179.8	0	0	0	0	0	112.1	V17 V18 M43	V17-G30 CarbonylContact C-O 3.53Å; V17-G30 WeakPolarHBondContact CA-O 3.44Å; V18-G30 PolarHBondContact N-O 3.21Å; V18-G30 PolarHBondContact O-N 2.97Å; V18-G30 VanDerWaalsContact O-N 3.11Å; G30-M43 VanDerWaalsContact O-CE 3.29Å; G30-M43 WeakPolarHBondContact O-CE 3.44Å
31	K	98.4	Very high	98.1	Very high	94 Å²	94	52.7 Å²	52.7	41%	0.409	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	125.4	-177.4	-175.7	177.4	178.6	-178	0	110.6	G15 H16 V33 M43 C44	G15-K31 VanDerWaalsContact O-CE 3.26Å; G15-K31 WeakPolarHBondContact O-CE 3.08Å; H16-K31 WeakPolarHBondContact O-CA 3.17Å; K31-V33 PolarHBondContact O-N 2.96Å; K31-M43 CarbonylContact O-C 3.59Å; K31-M43 WeakPolarHBondContact O-CA 3.37Å; K31-M43 WeakPolarHBondContact O-CB 3.36Å; K31-C44 PolarHBondContact N-O 2.93Å; K31-C44 PolarHBondContact O-N 3.48Å
32	L	98.6	Very high	98.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	117.6	169	-176.3	61.4	0	0	0	108.8	L10 A13 E14 G15 H16 V18 E34 A35 V41 M43	L10-L32 HydrophobicContact CD1-CD2 4.2Å; A13-L32 HydrophobicContact CB-CD2 4.11Å; E14-L32 HydrophobicContact CG-CD2 4.27Å; E14-L32 HydrophobicContact CG-CG 4.41Å; G15-L32 WeakPolarHBondContact CA-O 3.44Å; G15-L32 PolarHBondContact N-O 2.88Å; H16-L32 PolarHBondContact O-N 2.86Å; V18-L32 HydrophobicContact CG1-CB 4.11Å; V18-L32 HydrophobicContact CG1-CD2 4.35Å; V18-L32 HydrophobicContact CG2-CB 3.87Å; L32-E34 WeakPolarHBondContact CD1-O 3.37Å; L32-A35 HydrophobicContact CD2-CB 4.31Å; L32-V41 HydrophobicContact CD1-CB 3.76Å; L32-V41 HydrophobicContact CD1-CG1 3.86Å; L32-M43 HydrophobicContact CD1-CG 4.12Å
33	V	98.4	Very high	98.1	Very high	62 Å²	62	52.9 Å²	52.9	38%	0.376	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-46.3	178.9	178.2	0	0	0	0	109.9	K31 H42 C44	K31-V33 PolarHBondContact O-N 2.96Å; V33-H42 HydrophobicContact CB-CB 4.42Å; V33-H42 WeakPolarHBondContact CB-ND1 3.33Å; V33-H42 WeakPolarHBondContact CB-O 3.36Å; V33-H42 WeakPolarHBondContact CG1-ND1 3.24Å; V33-H42 PolarHBondContact N-O 3.03Å; V33-C44 HydrophobicContact CG2-CB 3.87Å
34	E	98.4	Very high	98.1	Very high	111 Å²	111	49.9 Å²	49.9	52%	0.519	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	141.5	-176.6	-175.1	175.6	-170.4	0	0	109.6	L32 V41 H42	L32-E34 WeakPolarHBondContact CD1-O 3.37Å; E34-V41 WeakPolarHBondContact O-CA 3.31Å; E34-H42 HydrophobicContact CB-CB 4.24Å; E34-H42 PolarHBondContact N-O 2.89Å; E34-H42 PolarHBondContact O-N 3.09Å
35	A	98.3	Very high	98.1	Very high	4 Å²	4	52.6 Å²	52.6	3%	0.033	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136	169.5	0	0	0	0	0	110.4	L10 H11 E14 L32 V41	L10-A35 HydrophobicContact CD1-CB 4.44Å; L10-A35 HydrophobicContact CD2-CB 4.01Å; L10-A35 HydrophobicContact CG-CB 3.78Å; H11-A35 PolarHBondContact CE1-O 2.94Å; H11-A35 PolarHBondContact ND1-O 3.11Å; E14-A35 HydrophobicContact CG-CB 4.41Å; E14-A35 PolarHBondContact OE1-N 3.48Å; L32-A35 HydrophobicContact CD2-CB 4.31Å; A35-V41 HydrophobicContact CB-CG1 4.29Å
36	E	98	Very high	98.1	Very high	61 Å²	61	52 Å²	52	29%	0.285	26%	0.256	S	S	.	.			trans	-95.9	160.9	174.6	-67.3	174.3	-138.4	0	0	111.7	N38 M39 N40 Y62	E36-N38 VanDerWaalsContact CB-OD1 3.25Å; E36-N38 WeakPolarHBondContact CB-OD1 3.4Å; E36-N38 PolarHBondContact O-N 2.64Å; E36-N38 VanDerWaalsContact O-N 3.09Å; E36-N38 PolarHBondContact OE2-ND2 3.24Å; E36-N38 PolarHBondContact OE2-OD1 2.94Å; E36-M39 WeakPolarHBondContact O-CA 3.46Å; E36-M39 PolarHBondContact O-N 2.69Å; E36-N40 HydrophobicContact CB-CB 4.12Å; E36-N40 HydrophobicContact CG-CB 4.17Å; E36-N40 PolarHBondContact N-O 3.49Å; E36-N40 WeakPolarHBondContact OE1-CB 3.43Å; E36-N40 PolarHBondContact OE2-ND2 2.95Å; E36-Y62 PolarHBondContact OE1-OH 3.09Å
37	D	97.4	Very high	98.2	Very high	104 Å²	104	52.9 Å²	52.9	56%	0.556	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-27.3	176.9	-72.8	-6.1	0	0	0	113.9	V3 H11 M39	V3-D37 HydrophobicContact CG1-CB 4.29Å; V3-D37 VanDerWaalsContact CG1-CG 3.49Å; V3-D37 WeakPolarHBondContact CG1-OD1 3.48Å; V3-D37 WeakPolarHBondContact CG1-OD2 3.26Å; H11-D37 IonicContact NE2-OD1 3.36Å; H11-D37 PolarHBondContact NE2-OD1 2.99Å; D37-M39 VanDerWaalsContact C-N 3.26Å
38	N	97.1	Very high	98.1	Very high	86 Å²	86	51.8 Å²	51.8	46%	0.46	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	8.4	177.8	62.6	22.2	0	0	0	112.9	E36 N40	E36-N38 VanDerWaalsContact CB-OD1 3.25Å; E36-N38 WeakPolarHBondContact CB-OD1 3.4Å; E36-N38 PolarHBondContact O-N 2.64Å; E36-N38 VanDerWaalsContact O-N 3.09Å; E36-N38 PolarHBondContact OE2-ND2 3.24Å; E36-N38 PolarHBondContact OE2-OD1 2.94Å; N38-N40 VanDerWaalsContact C-N 3.26Å; N38-N40 PolarHBondContact ND2-ND2 3.3Å; N38-N40 PolarHBondContact O-N 3.12Å; N38-N40 VanDerWaalsContact OD1-CB 3.26Å; N38-N40 WeakPolarHBondContact OD1-CB 3.41Å; N38-N40 PolarHBondContact OD1-N 3.08Å; N38-N40 PolarHBondContact OD1-ND2 3.24Å; N38-N40 VanDerWaalsContact OD1-ND2 3.12Å; N38-N40 PolarHBondContact OD1-OD1 3.21Å
39	M	97.9	Very high	98.1	Very high	74 Å²	74	53.1 Å²	53.1	37%	0.365	26%	0.264	S	S	.	.			trans	65.3	14.5	-175.2	-52.1	-173.5	-60.6	0	0	115.4	I7 L10 E36 D37 V41 G65 I68	I7-M39 HydrophobicContact CD1-CG 3.72Å; I7-M39 HydrophobicContact CD1-SD 4.27Å; L10-M39 HydrophobicContact CD2-CG 4.32Å; E36-M39 WeakPolarHBondContact O-CA 3.46Å; E36-M39 PolarHBondContact O-N 2.69Å; D37-M39 VanDerWaalsContact C-N 3.26Å; M39-V41 PolarHBondContact O-N 2.99Å; M39-G65 WeakPolarHBondContact O-CA 3.49Å; M39-I68 VanDerWaalsContact O-CD1 3.28Å; M39-I68 WeakPolarHBondContact O-CD1 3.4Å
40	N	98.3	Very high	98.1	Very high	13 Å²	13	47.3 Å²	47.3	7%	0.07	25%	0.248	C	C	.	.			trans	-61.1	139.2	163.5	-62.3	-23.3	0	0	0	108.5	E36 N38 Y62 I63 R64 G65	E36-N40 HydrophobicContact CB-CB 4.12Å; E36-N40 HydrophobicContact CG-CB 4.17Å; E36-N40 PolarHBondContact N-O 3.49Å; E36-N40 WeakPolarHBondContact OE1-CB 3.43Å; E36-N40 PolarHBondContact OE2-ND2 2.95Å; N38-N40 VanDerWaalsContact C-N 3.26Å; N38-N40 PolarHBondContact ND2-ND2 3.3Å; N38-N40 PolarHBondContact O-N 3.12Å; N38-N40 VanDerWaalsContact OD1-CB 3.26Å; N38-N40 WeakPolarHBondContact OD1-CB 3.41Å; N38-N40 PolarHBondContact OD1-N 3.08Å; N38-N40 PolarHBondContact OD1-ND2 3.24Å; N38-N40 VanDerWaalsContact OD1-ND2 3.12Å; N38-N40 PolarHBondContact OD1-OD1 3.21Å; N40-Y62 HydrophobicContact CB-CE1 4.48Å; N40-Y62 HydrophobicContact CB-CE2 4.21Å; N40-Y62 VanDerWaalsContact CB-OH 3.29Å; N40-Y62 WeakPolarHBondContact CB-OH 3.16Å; N40-Y62 PolarHBondContact ND2-OH 2.86Å; N40-I63 WeakPolarHBondContact CA-O 3.24Å; N40-R64 WeakPolarHBondContact OD1-CA 3.38Å; N40-G65 PolarHBondContact OD1-N 2.85Å
41	V	98.4	Very high	97.9	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	137.4	-177.8	-63.6	0	0	0	0	110.6	L20 L32 E34 A35 M39 M43 Y62 I63 I68	L20-V41 HydrophobicContact CD2-CG2 3.93Å; L32-V41 HydrophobicContact CD1-CB 3.76Å; L32-V41 HydrophobicContact CD1-CG1 3.86Å; E34-V41 WeakPolarHBondContact O-CA 3.31Å; A35-V41 HydrophobicContact CB-CG1 4.29Å; M39-V41 PolarHBondContact O-N 2.99Å; V41-M43 HydrophobicContact CG2-CG 4.44Å; V41-M43 HydrophobicContact CG2-SD 4.5Å; V41-Y62 WeakPolarHBondContact O-CA 3.43Å; V41-I63 HydrophobicContact CG2-CB 3.86Å; V41-I63 PolarHBondContact N-O 3.26Å; V41-I63 PolarHBondContact O-N 3.01Å; V41-I68 HydrophobicContact CG1-CD1 4.17Å; V41-I68 HydrophobicContact CG2-CD1 3.82Å
42	H	98.5	Very high	97.8	Very high	46 Å²	46	57.5 Å²	57.5	21%	0.213	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.2	166	-174.9	-122.6	0	0	0	108.9	V33 E34 V61 Y62	V33-H42 HydrophobicContact CB-CB 4.42Å; V33-H42 WeakPolarHBondContact CB-ND1 3.33Å; V33-H42 WeakPolarHBondContact CB-O 3.36Å; V33-H42 WeakPolarHBondContact CG1-ND1 3.24Å; V33-H42 PolarHBondContact N-O 3.03Å; E34-H42 HydrophobicContact CB-CB 4.24Å; E34-H42 PolarHBondContact N-O 2.89Å; E34-H42 PolarHBondContact O-N 3.09Å; H42-V61 PolarHBondContact CD2-O 3.49Å; H42-V61 VanDerWaalsContact CD2-O 3.32Å; H42-Y62 HydrophobicContact CB-CD2 4.23Å
43	M	98.4	Very high	97.7	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	155	-178	-62	-178	70.4	0	0	111.3	V18 L20 G30 K31 L32 V41 L46 Q60 V61	V18-M43 HydrophobicContact CG2-CE 3.48Å; V18-M43 VanDerWaalsContact CG2-CE 3.48Å; V18-M43 HydrophobicContact CG2-SD 4.27Å; L20-M43 HydrophobicContact CD2-CE 4.33Å; L20-M43 HydrophobicContact CD2-SD 3.24Å; L20-M43 WeakPolarHBondContact CD2-SD 3.29Å; L20-M43 HydrophobicContact CG-SD 4.34Å; G30-M43 VanDerWaalsContact O-CE 3.29Å; G30-M43 WeakPolarHBondContact O-CE 3.44Å; K31-M43 CarbonylContact O-C 3.59Å; K31-M43 WeakPolarHBondContact O-CA 3.37Å; K31-M43 WeakPolarHBondContact O-CB 3.36Å; L32-M43 HydrophobicContact CD1-CG 4.12Å; V41-M43 HydrophobicContact CG2-CG 4.44Å; V41-M43 HydrophobicContact CG2-SD 4.5Å; M43-L46 HydrophobicContact CB-CD1 4.02Å; M43-L46 HydrophobicContact CB-CD2 3.62Å; M43-L46 HydrophobicContact CB-CG 4.1Å; M43-L46 HydrophobicContact CE-CD2 3.57Å; M43-L46 HydrophobicContact CE-CG 4.45Å; M43-L46 HydrophobicContact CG-CD2 4.31Å; M43-L46 HydrophobicContact SD-CD2 3.73Å; M43-Q60 WeakPolarHBondContact O-CA 3.28Å; M43-V61 HydrophobicContact CB-CG2 3.88Å; M43-V61 PolarHBondContact N-O 3.37Å; M43-V61 PolarHBondContact O-N 3.31Å
44	C	98.2	Very high	97.7	Very high	19 Å²	19	65.9 Å²	65.9	13%	0.128	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	163.6	175	73.4	0	0	0	0	112.5	K31 V33 L46 Q59 Q60	K31-C44 PolarHBondContact N-O 2.93Å; K31-C44 PolarHBondContact O-N 3.48Å; V33-C44 HydrophobicContact CG2-CB 3.87Å; C44-L46 VanDerWaalsContact C-CD1 3.44Å; C44-Q59 CarbonylContact C-O 3.56Å; C44-Q59 WeakPolarHBondContact CA-O 3.47Å; C44-Q60 HydrophobicContact CB-CG 4.32Å
45	D	97.8	Very high	97.6	Very high	126 Å²	126	65.2 Å²	65.2	67%	0.674	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51.2	61.5	176.1	-54.3	-53	0	0	0	112.4	Q59	D45-Q59 PolarHBondContact N-O 3.11Å
46	L	97.1	Very high	97.6	Very high	3 Å²	3	67.2 Å²	67.2	2%	0.016	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	151.2	-170.7	-51.8	96.2	0	0	0	113.5	F28 R29 M43 C44 N57 L58 V61	F28-L46 HydrophobicContact CB-CD2 4Å; F28-L46 HydrophobicContact CD1-CD2 4.32Å; R29-L46 CarbonylContact O-C 3.5Å; R29-L46 VanDerWaalsContact O-CA 3.23Å; R29-L46 WeakPolarHBondContact O-CA 3.26Å; M43-L46 HydrophobicContact CB-CD1 4.02Å; M43-L46 HydrophobicContact CB-CD2 3.62Å; M43-L46 HydrophobicContact CB-CG 4.1Å; M43-L46 HydrophobicContact CE-CD2 3.57Å; M43-L46 HydrophobicContact CE-CG 4.45Å; M43-L46 HydrophobicContact CG-CD2 4.31Å; M43-L46 HydrophobicContact SD-CD2 3.73Å; C44-L46 VanDerWaalsContact C-CD1 3.44Å; L46-N57 WeakPolarHBondContact O-CA 3.37Å; L46-L58 HydrophobicContact CB-CB 4.49Å; L46-L58 PolarHBondContact N-O 2.73Å; L46-L58 PolarHBondContact O-N 3.11Å; L46-V61 HydrophobicContact CD1-CB 4.44Å; L46-V61 HydrophobicContact CD1-CG1 4.21Å; L46-V61 HydrophobicContact CD1-CG2 3.7Å; L46-V61 HydrophobicContact CD2-CG2 3.53Å; L46-V61 HydrophobicContact CG-CG2 4.26Å
47	I	98.2	Very high	97.6	Very high	82 Å²	82	70.9 Å²	70.9	42%	0.421	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	118.1	158.7	-54.9	174.9	0	0	0	107.1	R29 T55 S56	R29-I47 PolarHBondContact N-O 3.21Å; R29-I47 PolarHBondContact O-N 2.6Å; I47-T55 HydrophobicContact CG2-CG2 4.32Å; I47-S56 WeakPolarHBondContact CA-O 3.4Å
48	M	98.1	Very high	97.6	Very high	21 Å²	21	68.7 Å²	68.7	10%	0.103	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	133.8	168.3	177.9	-138.1	163	0	0	108.8	E26 V27 F28 S50 T55 S56 L58	E26-M48 HydrophobicContact CB-CE 3.94Å; E26-M48 HydrophobicContact CG-CE 3.68Å; V27-M48 CarbonylContact O-C 3.55Å; V27-M48 WeakPolarHBondContact O-CA 3.33Å; F28-M48 HydrophobicContact CD1-CB 3.93Å; F28-M48 HydrophobicContact CD1-CG 4Å; F28-M48 HydrophobicContact CE1-CB 3.89Å; F28-M48 HydrophobicContact CE1-CG 3.6Å; F28-M48 HydrophobicContact CE2-CG 4.42Å; F28-M48 HydrophobicContact CZ-CG 3.83Å; M48-S50 WeakPolarHBondContact CE-OG 3.19Å; M48-T55 CarbonylContact O-C 3.59Å; M48-T55 WeakPolarHBondContact O-CA 3.06Å; M48-S56 PolarHBondContact N-O 3.36Å; M48-S56 PolarHBondContact O-N 3.41Å; M48-L58 HydrophobicContact CB-CD1 3.73Å; M48-L58 HydrophobicContact CB-CG 4.35Å; M48-L58 HydrophobicContact CG-CD1 4.43Å
49	T	98.3	Very high	97.6	Very high	47 Å²	47	72.6 Å²	72.6	29%	0.288	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	113.8	169.3	-50.8	0	0	0	0	108.6	E26 V27 R54 T55	E26-T49 WeakPolarHBondContact CA-O 3.39Å; V27-T49 PolarHBondContact N-O 2.99Å; V27-T49 PolarHBondContact O-N 3.11Å; T49-R54 CarbonylContact C-O 3.52Å; T49-R54 WeakPolarHBondContact CA-O 3.06Å; T49-T55 HydrophobicContact CG2-CG2 4.21Å
50	S	97	Very high	97.6	Very high	36 Å²	36	75.5 Å²	75.5	25%	0.252	39%	0.386	S	S	.	.			trans	-66.2	161.1	173.5	-69.7	0	0	0	0	111.1	M48 D52 G53 R54	M48-S50 WeakPolarHBondContact CE-OG 3.19Å; S50-D52 WeakPolarHBondContact CB-OD1 3.49Å; S50-D52 PolarHBondContact O-N 2.87Å; S50-D52 VanDerWaalsContact O-N 3.16Å; S50-G53 WeakPolarHBondContact O-CA 3.48Å; S50-G53 PolarHBondContact O-N 3.23Å; S50-R54 PolarHBondContact N-O 2.84Å
51	R	95.8	Very high	97.6	Very high	216 Å²	216	76 Å²	76	82%	0.815	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-26.1	178.1	-172.5	177.1	178.2	-169.1	-0.5	113.6	G53	R51-G53 PolarHBondContact O-N 3.1Å
52	D	96	Very high	97.6	Very high	96 Å²	96	82.4 Å²	82.4	51%	0.513	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	1.9	174.8	66.6	-9.1	0	0	0	113.4	S50 R54	S50-D52 WeakPolarHBondContact CB-OD1 3.49Å; S50-D52 PolarHBondContact O-N 2.87Å; S50-D52 VanDerWaalsContact O-N 3.16Å; D52-R54 VanDerWaalsContact C-N 3.32Å; D52-R54 WeakPolarHBondContact OD1-CB 3.4Å; D52-R54 PolarHBondContact OD1-N 3.23Å; D52-R54 VanDerWaalsContact OD1-N 3.11Å; D52-R54 WeakPolarHBondContact OD2-CD 3.08Å; D52-R54 WeakPolarHBondContact OD2-CG 3.39Å; D52-R54 IonicContact OD2-CZ 3.48Å; D52-R54 IonicContact OD2-NE 3.32Å; D52-R54 PolarHBondContact OD2-NE 2.95Å; D52-R54 IonicContact OD2-NH1 3.4Å; D52-R54 PolarHBondContact OD2-NH1 2.79Å
53	G	96.2	Very high	97.5	Very high	52 Å²	52	81 Å²	81	54%	0.536	41%	0.408	S	S	.	.	S	Bend	trans	84.1	-1.1	-179.7	0	0	0	0	0	114.5	S50 R51	S50-G53 WeakPolarHBondContact O-CA 3.48Å; S50-G53 PolarHBondContact O-N 3.23Å; R51-G53 PolarHBondContact O-N 3.1Å
54	R	97.5	Very high	97.5	Very high	185 Å²	185	88.3 Å²	88.3	70%	0.698	44%	0.436	S	S	*	.			trans	-70.4	140.1	175.6	-66.2	-179.1	-176.6	156	-2.6	110.4	T49 S50 D52	T49-R54 CarbonylContact C-O 3.52Å; T49-R54 WeakPolarHBondContact CA-O 3.06Å; S50-R54 PolarHBondContact N-O 2.84Å; D52-R54 VanDerWaalsContact C-N 3.32Å; D52-R54 WeakPolarHBondContact OD1-CB 3.4Å; D52-R54 PolarHBondContact OD1-N 3.23Å; D52-R54 VanDerWaalsContact OD1-N 3.11Å; D52-R54 WeakPolarHBondContact OD2-CD 3.08Å; D52-R54 WeakPolarHBondContact OD2-CG 3.39Å; D52-R54 IonicContact OD2-CZ 3.48Å; D52-R54 IonicContact OD2-NE 3.32Å; D52-R54 PolarHBondContact OD2-NE 2.95Å; D52-R54 IonicContact OD2-NH1 3.4Å; D52-R54 PolarHBondContact OD2-NH1 2.79Å
55	T	97.8	Very high	97.5	Very high	98 Å²	98	87.4 Å²	87.4	60%	0.601	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	144.2	178.4	54.4	0	0	0	0	111.2	I47 M48 T49	I47-T55 HydrophobicContact CG2-CG2 4.32Å; M48-T55 CarbonylContact O-C 3.59Å; M48-T55 WeakPolarHBondContact O-CA 3.06Å; T49-T55 HydrophobicContact CG2-CG2 4.21Å
56	S	97.4	Very high	97.5	Very high	46 Å²	46	85 Å²	85	32%	0.322	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	142.2	173.9	59.1	0	0	0	0	110.1	I47 M48	I47-S56 WeakPolarHBondContact CA-O 3.4Å; M48-S56 PolarHBondContact N-O 3.36Å; M48-S56 PolarHBondContact O-N 3.41Å
57	N	97.8	Very high	97.6	Very high	137 Å²	137	90.9 Å²	90.9	73%	0.733	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	131.2	175	-65.3	-35.4	0	0	0	109.1	L46	L46-N57 WeakPolarHBondContact O-CA 3.37Å
58	L	97.2	Very high	97.6	Very high	58 Å²	58	87.9 Å²	87.9	30%	0.304	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.4	179.8	-57.9	176	0	0	0	109	F28 L46 M48 V61	F28-L58 HydrophobicContact CD1-CD1 4.35Å; F28-L58 HydrophobicContact CE1-CD1 3.92Å; L46-L58 HydrophobicContact CB-CB 4.49Å; L46-L58 PolarHBondContact N-O 2.73Å; L46-L58 PolarHBondContact O-N 3.11Å; M48-L58 HydrophobicContact CB-CD1 3.73Å; M48-L58 HydrophobicContact CB-CG 4.35Å; M48-L58 HydrophobicContact CG-CD1 4.43Å; L58-V61 HydrophobicContact CB-CG1 4.03Å; L58-V61 HydrophobicContact CD1-CG1 3.63Å; L58-V61 HydrophobicContact CG-CG1 4.46Å
59	Q	97.7	Very high	97.6	Very high	169 Å²	169	93.2 Å²	93.2	79%	0.79	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	-45.6	-179.1	-69.3	-178.9	-4.3	0	0	111.9	C44 D45	C44-Q59 CarbonylContact C-O 3.56Å; C44-Q59 WeakPolarHBondContact CA-O 3.47Å; D45-Q59 PolarHBondContact N-O 3.11Å
60	Q	97.7	Very high	97.6	Very high	135 Å²	135	95 Å²	95	63%	0.631	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.5	144	-179.9	-70.2	-177.4	-38.1	0	0	109.9	M43 C44	M43-Q60 WeakPolarHBondContact O-CA 3.28Å; C44-Q60 HydrophobicContact CB-CG 4.32Å
61	V	97.8	Very high	97.6	Very high	24 Å²	24	95.3 Å²	95.3	15%	0.145	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	148.1	172	-60.7	0	0	0	0	110.5	F28 H42 M43 L46 L58 I63	F28-V61 HydrophobicContact CD1-CG2 4.49Å; F28-V61 HydrophobicContact CE1-CG1 4.43Å; H42-V61 PolarHBondContact CD2-O 3.49Å; H42-V61 VanDerWaalsContact CD2-O 3.32Å; M43-V61 HydrophobicContact CB-CG2 3.88Å; M43-V61 PolarHBondContact N-O 3.37Å; M43-V61 PolarHBondContact O-N 3.31Å; L46-V61 HydrophobicContact CD1-CB 4.44Å; L46-V61 HydrophobicContact CD1-CG1 4.21Å; L46-V61 HydrophobicContact CD1-CG2 3.7Å; L46-V61 HydrophobicContact CD2-CG2 3.53Å; L46-V61 HydrophobicContact CG-CG2 4.26Å; L58-V61 HydrophobicContact CB-CG1 4.03Å; L58-V61 HydrophobicContact CD1-CG1 3.63Å; L58-V61 HydrophobicContact CG-CG1 4.46Å; V61-I63 HydrophobicContact CB-CG1 4.48Å; V61-I63 HydrophobicContact CG2-CD1 4.09Å; V61-I63 HydrophobicContact CG2-CG1 4.16Å
62	Y	98.2	Very high	97.8	Very high	134 Å²	134	89.6 Å²	89.6	53%	0.525	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	121.3	167	-177	-96.4	0	0	0	108.7	E36 N40 V41 H42	E36-Y62 PolarHBondContact OE1-OH 3.09Å; N40-Y62 HydrophobicContact CB-CE1 4.48Å; N40-Y62 HydrophobicContact CB-CE2 4.21Å; N40-Y62 VanDerWaalsContact CB-OH 3.29Å; N40-Y62 WeakPolarHBondContact CB-OH 3.16Å; N40-Y62 PolarHBondContact ND2-OH 2.86Å; V41-Y62 WeakPolarHBondContact O-CA 3.43Å; H42-Y62 HydrophobicContact CB-CD2 4.23Å
63	I	97.8	Very high	97.8	Very high	16 Å²	16	87.2 Å²	87.2	8%	0.082	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	124.8	-175.3	-57.5	177.7	0	0	0	108.7	L20 T22 F28 N40 V41 V61 G65 I68	L20-I63 HydrophobicContact CD1-CD1 3.69Å; L20-I63 HydrophobicContact CD2-CD1 4.16Å; L20-I63 HydrophobicContact CG-CD1 4.45Å; T22-I63 HydrophobicContact CG2-CG2 4.43Å; F28-I63 HydrophobicContact CB-CD1 4.34Å; F28-I63 HydrophobicContact CD1-CD1 4.08Å; F28-I63 HydrophobicContact CD2-CD1 3.79Å; F28-I63 HydrophobicContact CE1-CD1 4.32Å; F28-I63 HydrophobicContact CE2-CD1 4.06Å; F28-I63 HydrophobicContact CG-CD1 3.81Å; F28-I63 HydrophobicContact CZ-CD1 4.31Å; N40-I63 WeakPolarHBondContact CA-O 3.24Å; V41-I63 HydrophobicContact CG2-CB 3.86Å; V41-I63 PolarHBondContact N-O 3.26Å; V41-I63 PolarHBondContact O-N 3.01Å; V61-I63 HydrophobicContact CB-CG1 4.48Å; V61-I63 HydrophobicContact CG2-CD1 4.09Å; V61-I63 HydrophobicContact CG2-CG1 4.16Å; I63-G65 PolarHBondContact O-N 3.38Å; I63-I68 HydrophobicContact CG2-CD1 4.38Å; I63-I68 HydrophobicContact CG2-CG1 3.9Å
64	R	98.3	Very high	97.9	Very high	154 Å²	154	86.2 Å²	86.2	58%	0.581	41%	0.411	S	S	*	.			trans	-66.5	131.2	175.9	-177.4	179.3	174.4	86.1	0.2	110.5	N40 S66 K67	N40-R64 WeakPolarHBondContact OD1-CA 3.38Å; R64-S66 VanDerWaalsContact C-N 3.27Å; R64-S66 WeakPolarHBondContact CD-OG 3.25Å; R64-S66 PolarHBondContact NE-OG 3.06Å; R64-S66 PolarHBondContact O-N 3.06Å; R64-K67 HydrophobicContact CB-CG 4.37Å; R64-K67 WeakPolarHBondContact O-CA 3.45Å; R64-K67 WeakPolarHBondContact O-CB 3.38Å; R64-K67 PolarHBondContact O-N 2.87Å
65	G	98.1	Very high	97.8	Very high	1 Å²	1	83.5 Å²	83.5	1%	0.01	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-58.6	-34.6	-176.5	0	0	0	0	0	114.5	M39 N40 I63 K67 I68	M39-G65 WeakPolarHBondContact O-CA 3.49Å; N40-G65 PolarHBondContact OD1-N 2.85Å; I63-G65 PolarHBondContact O-N 3.38Å; G65-K67 PolarHBondContact O-N 3.18Å; G65-I68 PolarHBondContact O-N 2.81Å
66	S	98.2	Very high	97.6	Very high	76 Å²	76	85.2 Å²	85.2	53%	0.531	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-67.1	-6.4	175.2	75.5	0	0	0	0	114.3	R64	R64-S66 VanDerWaalsContact C-N 3.27Å; R64-S66 WeakPolarHBondContact CD-OG 3.25Å; R64-S66 PolarHBondContact NE-OG 3.06Å; R64-S66 PolarHBondContact O-N 3.06Å
67	K	98.2	Very high	97.5	Very high	126 Å²	126	84 Å²	84	55%	0.548	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-106.7	1.9	175.9	-61	-61.8	-173	177.8	0	112.4	T22 V23 R64 G65	T22-K67 CarbonylContact C-O 3.44Å; T22-K67 WeakPolarHBondContact CA-O 3.49Å; T22-K67 WeakPolarHBondContact CB-O 3.4Å; V23-K67 WeakPolarHBondContact CG2-O 2.97Å; V23-K67 PolarHBondContact N-O 2.85Å; R64-K67 HydrophobicContact CB-CG 4.37Å; R64-K67 WeakPolarHBondContact O-CA 3.45Å; R64-K67 WeakPolarHBondContact O-CB 3.38Å; R64-K67 PolarHBondContact O-N 2.87Å; G65-K67 PolarHBondContact O-N 3.18Å
68	I	98.3	Very high	97.2	Very high	19 Å²	19	84.4 Å²	84.4	10%	0.097	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	131	175.7	-55.8	178.3	0	0	0	109.2	L20 M39 V41 I63 G65 L71	L20-I68 HydrophobicContact CB-CG2 4.41Å; M39-I68 VanDerWaalsContact O-CD1 3.28Å; M39-I68 WeakPolarHBondContact O-CD1 3.4Å; V41-I68 HydrophobicContact CG1-CD1 4.17Å; V41-I68 HydrophobicContact CG2-CD1 3.82Å; I63-I68 HydrophobicContact CG2-CD1 4.38Å; I63-I68 HydrophobicContact CG2-CG1 3.9Å; G65-I68 PolarHBondContact O-N 2.81Å; I68-L71 HydrophobicContact CG2-CD1 3.78Å; I68-L71 HydrophobicContact CG2-CG 4.07Å
69	R	98.1	Very high	96.8	Very high	132 Å²	132	86.6 Å²	86.6	50%	0.498	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-50.8	173.9	-171	-175.9	-65.3	163.5	9.7	111	E21 V23	E21-R69 WeakPolarHBondContact O-CB 3.22Å; E21-R69 PolarHBondContact O-N 2.91Å; E21-R69 IonicContact OE1-CZ 3.28Å; E21-R69 VanDerWaalsContact OE1-CZ 3.28Å; E21-R69 IonicContact OE1-NH1 2.6Å; E21-R69 PolarHBondContact OE1-NH1 3.43Å; E21-R69 IonicContact OE1-NH2 3.79Å; V23-R69 PolarHBondContact O-NH2 3.49Å
70	F	98.3	Very high	96.3	Very high	85 Å²	85	78.9 Å²	78.9	37%	0.373	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	163.7	173.6	63.4	-95.9	0	0	0	110.9	L20 E21 I72	L20-F70 WeakPolarHBondContact CA-O 3.49Å; E21-F70 HydrophobicContact CB-CD1 4.26Å; E21-F70 HydrophobicContact CB-CE1 3.72Å; E21-F70 HydrophobicContact CB-CE2 4.17Å; E21-F70 HydrophobicContact CB-CZ 3.66Å; E21-F70 HydrophobicContact CG-CE1 4.33Å; E21-F70 HydrophobicContact CG-CZ 4.46Å; E21-F70 PolarHBondContact N-O 2.92Å; E21-F70 VanDerWaalsContact N-O 3.11Å; E21-F70 WeakPolarHBondContact OE2-CE1 3.41Å; E21-F70 WeakPolarHBondContact OE2-CZ 3.45Å; F70-I72 HydrophobicContact CD2-CG1 4.14Å; F70-I72 HydrophobicContact CE2-CD1 4.05Å; F70-I72 HydrophobicContact CE2-CG1 3.94Å
71	L	98.1	Very high	95.7	Very high	43 Å²	43	76.6 Å²	76.6	23%	0.225	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	144.7	169	-59.9	101.2	0	0	0	110.2	L10 T19 L20 I68 L73	L10-L71 HydrophobicContact CD1-CD1 4.42Å; L10-L71 HydrophobicContact CD1-CD2 3.9Å; T19-L71 CarbonylContact O-C 3.53Å; T19-L71 WeakPolarHBondContact O-CA 3.33Å; L20-L71 HydrophobicContact CB-CD2 4.08Å; L20-L71 HydrophobicContact CB-CG 3.93Å; L20-L71 HydrophobicContact CD2-CD2 4.36Å; I68-L71 HydrophobicContact CG2-CD1 3.78Å; I68-L71 HydrophobicContact CG2-CG 4.07Å; L71-L73 HydrophobicContact CB-CD2 3.99Å
72	I	98.3	Very high	95.1	Very high	95 Å²	95	78.9 Å²	78.9	49%	0.487	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	116.8	167	-56.6	172	0	0	0	106.3	T19 F70	T19-I72 HydrophobicContact CG2-CD1 4.45Å; T19-I72 PolarHBondContact N-O 3.33Å; T19-I72 VanDerWaalsContact N-O 3.09Å; T19-I72 PolarHBondContact O-N 3.08Å; F70-I72 HydrophobicContact CD2-CG1 4.14Å; F70-I72 HydrophobicContact CE2-CD1 4.05Å; F70-I72 HydrophobicContact CE2-CG1 3.94Å
73	L	97.5	Very high	94.4	Very high	47 Å²	47	77 Å²	77	25%	0.246	38%	0.38	C	S	.	.			trans	-99.9	161.4	-178.3	-51.6	-177	0	0	0	110.8	V9 L10 A13 V18 L71 L77	V9-L73 HydrophobicContact CG1-CD1 3.97Å; L10-L73 HydrophobicContact CD1-CD2 4.24Å; A13-L73 HydrophobicContact CB-CD1 4.32Å; A13-L73 HydrophobicContact CB-CD2 3.84Å; A13-L73 HydrophobicContact CB-CG 4.48Å; V18-L73 HydrophobicContact CG1-CD2 3.95Å; L71-L73 HydrophobicContact CB-CD2 3.99Å; L73-L77 HydrophobicContact CB-CD1 3.92Å; L73-L77 HydrophobicContact CD1-CD1 4.02Å
74	P	97.3	Very high	93.7	Very high	30 Å²	30	83 Å²	83	20%	0.195	41%	0.405	C	S	.	.			trans	-58.5	140	175.6	-21.5	29.3	0	0	0	113	H16 M76 L77	H16-P74 HydrophobicContact CB-CG 3.44Å; H16-P74 VanDerWaalsContact CB-CG 3.44Å; P74-M76 PolarHBondContact O-N 3.26Å; P74-L77 WeakPolarHBondContact O-CB 3.47Å; P74-L77 PolarHBondContact O-N 2.74Å
75	D	95.7	Very high	92.5	Very high	129 Å²	129	86.2 Å²	86.2	69%	0.69	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-56.7	-23	179.3	-76.3	1	0	0	0	114.1	L77 K78	D75-L77 PolarHBondContact O-N 3.07Å; D75-K78 WeakPolarHBondContact O-CB 3.24Å; D75-K78 WeakPolarHBondContact O-CD 3.43Å; D75-K78 WeakPolarHBondContact O-CG 3.35Å; D75-K78 PolarHBondContact O-N 2.93Å
76	M	94.3	Very high	91.1	Very high	134 Å²	134	90.9 Å²	90.9	66%	0.66	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-61	-29.5	177.4	-54.7	-150.2	-39.5	0	0	112.3	P74 K78 N79	P74-M76 PolarHBondContact O-N 3.26Å; M76-K78 PolarHBondContact O-N 3.45Å; M76-N79 PolarHBondContact O-N 3.04Å
77	L	93.7	Very high	89.1	Confident	21 Å²	21	96.4 Å²	96.4	11%	0.11	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-72	-10.7	-178.8	-59.5	-174.9	0	0	0	113.5	V9 D12 A13 L73 P74 D75 N79 S80 L83	V9-L77 HydrophobicContact CG1-CB 4.46Å; V9-L77 HydrophobicContact CG1-CD1 4.42Å; D12-L77 HydrophobicContact CB-CD2 3.87Å; A13-L77 HydrophobicContact CB-CD1 3.52Å; L73-L77 HydrophobicContact CB-CD1 3.92Å; L73-L77 HydrophobicContact CD1-CD1 4.02Å; P74-L77 WeakPolarHBondContact O-CB 3.47Å; P74-L77 PolarHBondContact O-N 2.74Å; D75-L77 PolarHBondContact O-N 3.07Å; L77-N79 PolarHBondContact O-N 3.06Å; L77-N79 VanDerWaalsContact O-N 3.08Å; L77-S80 VanDerWaalsContact O-CB 3.24Å; L77-S80 WeakPolarHBondContact O-CB 3.47Å; L77-S80 PolarHBondContact O-N 3.3Å; L77-L83 WeakPolarHBondContact O-CD1 3.35Å
78	K	91.7	Very high	87.3	Confident	145 Å²	145	93.6 Å²	93.6	63%	0.63	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-57.8	-23.9	171.4	78	-166.1	170.3	-173.3	0	112.9	D75 M76	D75-K78 WeakPolarHBondContact O-CB 3.24Å; D75-K78 WeakPolarHBondContact O-CD 3.43Å; D75-K78 WeakPolarHBondContact O-CG 3.35Å; D75-K78 PolarHBondContact O-N 2.93Å; M76-K78 PolarHBondContact O-N 3.45Å
79	N	88.7	Confident	85.3	Confident	104 Å²	104	95.8 Å²	95.8	56%	0.556	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-96.3	1.9	178.8	-65	-40.5	0	0	0	113.3	M76 L77	M76-N79 PolarHBondContact O-N 3.04Å; L77-N79 PolarHBondContact O-N 3.06Å; L77-N79 VanDerWaalsContact O-N 3.08Å
80	S	87.3	Confident	83.1	Confident	7 Å²	7	97.4 Å²	97.4	5%	0.049	50%	0.503	C	S	.	.			trans	-51.7	133.3	-179.7	171.3	0	0	0	0	109.6	D12 L77 M82 L83	D12-S80 PolarHBondContact OD2-OG 3.39Å; L77-S80 VanDerWaalsContact O-CB 3.24Å; L77-S80 WeakPolarHBondContact O-CB 3.47Å; L77-S80 PolarHBondContact O-N 3.3Å; S80-M82 PolarHBondContact O-N 3.18Å; S80-M82 PolarHBondContact OG-N 3.1Å; S80-L83 PolarHBondContact O-N 2.84Å
81	P	85.9	Confident	80.8	Confident	87 Å²	87	96.6 Å²	96.6	57%	0.565	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-57.5	-24.7	178.5	24.7	-34	0	0	0	111.9	L83 K84	P81-L83 VanDerWaalsContact C-N 3.31Å; P81-L83 PolarHBondContact O-N 3.23Å; P81-K84 PolarHBondContact O-N 3.38Å
82	M	84.4	Confident	78.7	Confident	71 Å²	71	102.9 Å²	102.9	35%	0.35	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-68.3	-28.3	179	-60.2	-57.9	110.3	0	0	113.1	I5 K8 V9 S80	I5-M82 HydrophobicContact CG2-CB 4.19Å; I5-M82 VanDerWaalsContact CG2-O 3.29Å; I5-M82 WeakPolarHBondContact CG2-O 3.29Å; K8-M82 HydrophobicContact CB-CG 4.11Å; K8-M82 HydrophobicContact CB-SD 4.49Å; K8-M82 HydrophobicContact CD-CG 4.5Å; K8-M82 HydrophobicContact CD-SD 3.83Å; V9-M82 HydrophobicContact CG2-CB 3.9Å; S80-M82 PolarHBondContact O-N 3.18Å; S80-M82 PolarHBondContact OG-N 3.1Å
83	L	84.7	Confident	76.3	Confident	95 Å²	95	101.5 Å²	101.5	50%	0.497	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-82.7	-15.7	176.8	-65	179.8	0	0	0	112.8	I5 V9 L77 S80 P81	I5-L83 HydrophobicContact CG2-CD2 4.5Å; V9-L83 HydrophobicContact CG2-CD2 3.96Å; V9-L83 HydrophobicContact CG2-CG 4.05Å; L77-L83 WeakPolarHBondContact O-CD1 3.35Å; S80-L83 PolarHBondContact O-N 2.84Å; P81-L83 VanDerWaalsContact C-N 3.31Å; P81-L83 PolarHBondContact O-N 3.23Å
84	K	83	Confident	74	Confident	141 Å²	141	106.3 Å²	106.3	61%	0.613	59%	0.592	S	S	*	*	S	Bend	trans	-77.2	128.2	177.3	-65.8	179.2	-176.7	170.9	0	108.9	P81	P81-K84 PolarHBondContact O-N 3.38Å
85	R	72.6	Confident	71.9	Confident	222 Å²	222	108.4 Å²	108.4	84%	0.838	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-58.9	132.7	169.5	-67	-178.8	-174	177.1	2.3	108.4	Q87	R85-Q87 PolarHBondContact O-N 3.23Å
86	P	68.4	Low	70	Confident	99 Å²	99	112.2 Å²	112.2	64%	0.643	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-54.3	130.5	178.2	19.5	-29.9	0	0	0	109.3	G88 A89	P86-G88 PolarHBondContact O-N 3.06Å; P86-A89 HydrophobicContact CG-CB 4.15Å; P86-A89 PolarHBondContact O-N 2.78Å
87	Q	57.9	Low	67.9	Low	193 Å²	193	108.2 Å²	108.2	90%	0.902	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	88.2	174.9	-71	-175.5	-5.2	0	0	107.9	R85	R85-Q87 PolarHBondContact O-N 3.23Å
88	G	58.8	Low	66	Low	66 Å²	66	115.3 Å²	115.3	68%	0.68	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	159.6	-27.4	-170.7	0	0	0	0	0	112.4	P86 K90	P86-G88 PolarHBondContact O-N 3.06Å; G88-K90 PolarHBondContact O-N 2.95Å; G88-K90 VanDerWaalsContact O-N 3.13Å
89	A	57.7	Low	64.2	Low	65 Å²	65	114.1 Å²	114.1	54%	0.537	65%	0.648	S	S	.	*			trans	-78.1	13.3	172	0	0	0	0	0	113.8	P86 G91	P86-A89 HydrophobicContact CG-CB 4.15Å; P86-A89 PolarHBondContact O-N 2.78Å; A89-G91 PolarHBondContact O-N 3.13Å
90	K	50.6	Low	62.7	Low	167 Å²	167	112.3 Å²	112.3	73%	0.726	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	68.9	173.3	-66.9	-178.5	-179.6	173.2	0	109.3	G88	G88-K90 PolarHBondContact O-N 2.95Å; G88-K90 VanDerWaalsContact O-N 3.13Å
91	G	51.3	Low	61.2	Low	68 Å²	68	119.2 Å²	119.2	70%	0.701	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-164.8	-14.5	-177.7	0	0	0	0	0	117.9	A89	A89-G91 PolarHBondContact O-N 3.13Å
92	L	52.4	Low	59.8	Low	175 Å²	175	120.7 Å²	120.7	92%	0.916	68%	0.684	S	S	*	*	S	Bend	trans	-128.7	97.8	-175.5	-124.5	70.9	0	0	0	109.5
93	G	49.5	Very low	58.4	Low	66 Å²	66	127.5 Å²	127.5	68%	0.68	71%	0.705	S	S	*	*	S	Bend	trans	111	119.8	174.8	0	0	0	0	0	113.8
94	T	49.3	Very low	57.1	Low	147 Å²	147	126.7 Å²	126.7	90%	0.902	71%	0.712	S	S	*	*	S	Bend	trans	65.2	86.1	161.1	68	0	0	0	0	117.5
95	G	53.1	Low	55.7	Low	75 Å²	75	123 Å²	123	77%	0.773	71%	0.714	S	S	*	*	S	Bend	trans	108.7	-3.3	135.8	0	0	0	0	0	119.2
96	R	54.8	Low	54.8	Low	209 Å²	209	118.3 Å²	118.3	79%	0.789	71%	0.71	S	S	*	*			trans	-99.4	-3.2	-176.2	-117.9	-180	176	111	0	117
97	G	49.4	Very low	53.7	Low	49 Å²	49	124.4 Å²	124.4	51%	0.505	72%	0.72	S	S	.	*	S	Bend	trans	-77.7	-21	179.2	0	0	0	0	0	115.6
98	K	55	Low	53.1	Low	170 Å²	170	119.1 Å²	119.1	74%	0.739	72%	0.718	S	S	*	*	H	α-helix	trans	-76.7	-35.9	-175.3	-75.1	-179.9	174.2	-179.5	0	113.2	L102	K98-L102 VanDerWaalsContact O-CD1 3.28Å; K98-L102 WeakPolarHBondContact O-CD1 3.28Å; K98-L102 WeakPolarHBondContact O-CG 3.39Å; K98-L102 PolarHBondContact O-N 2.98Å
99	N	54.7	Low	52.2	Low	120 Å²	120	127.6 Å²	127.6	64%	0.642	73%	0.729	S	S	*	*	H	α-helix	trans	-83.5	-17.2	-173.6	-71	-4.8	0	0	0	114.7	R103	N99-R103 PolarHBondContact O-N 3.44Å
100	A	57.1	Low	51.3	Low	67 Å²	67	127.3 Å²	127.3	55%	0.554	73%	0.732	S	S	*	*	H	α-helix	trans	-80.3	-36.3	174.2	0	0	0	0	0	112	R103 A104	A100-R103 PolarHBondContact O-N 3.48Å; A100-A104 WeakPolarHBondContact O-CB 3.38Å; A100-A104 PolarHBondContact O-N 3.36Å
101	M	54.8	Low	50.8	Low	151 Å²	151	126.3 Å²	126.3	74%	0.744	74%	0.741	S	S	*	*	H	α-helix	trans	-72.1	-34.8	176.2	-65.8	-177.8	-171.5	0	0	112.1	R103 A104 G105	M101-R103 VanDerWaalsContact C-N 3.28Å; M101-R103 PolarHBondContact O-N 3.39Å; M101-A104 PolarHBondContact O-N 3.11Å; M101-G105 PolarHBondContact O-N 3.37Å; M101-G105 VanDerWaalsContact O-N 3.08Å
102	L	57.1	Low	50.2	Low	119 Å²	119	132.5 Å²	132.5	62%	0.623	75%	0.749	S	S	*	*	H	α-helix	trans	-68.5	-23.1	173.7	-74.5	159.4	0	0	0	113.5	K98 V106	K98-L102 VanDerWaalsContact O-CD1 3.28Å; K98-L102 WeakPolarHBondContact O-CD1 3.28Å; K98-L102 WeakPolarHBondContact O-CG 3.39Å; K98-L102 PolarHBondContact O-N 2.98Å; L102-V106 WeakPolarHBondContact O-CG2 3.4Å
103	R	54.7	Low	49.8	Very low	213 Å²	213	130.2 Å²	130.2	80%	0.804	74%	0.742	S	S	*	*	H	α-helix	trans	-95.2	-22.4	174.8	-71.9	-157.1	171.5	-173.2	-1.6	114.1	N99 A100 M101	N99-R103 PolarHBondContact O-N 3.44Å; A100-R103 PolarHBondContact O-N 3.48Å; M101-R103 VanDerWaalsContact C-N 3.28Å; M101-R103 PolarHBondContact O-N 3.39Å
104	A	57.2	Low	49.2	Very low	78 Å²	78	138.4 Å²	138.4	65%	0.645	75%	0.752	S	S	*	*	H	α-helix	trans	-77.8	-28.1	171.9	0	0	0	0	0	112.6	A100 M101 V106	A100-A104 WeakPolarHBondContact O-CB 3.38Å; A100-A104 PolarHBondContact O-N 3.36Å; M101-A104 PolarHBondContact O-N 3.11Å; A104-V106 VanDerWaalsContact C-N 3.32Å; A104-V106 PolarHBondContact O-N 3.08Å
105	G	53.7	Low	48.9	Very low	64 Å²	64	135 Å²	135	66%	0.66	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-4.2	-179.6	0	0	0	0	0	116.6	M101	M101-G105 PolarHBondContact O-N 3.37Å; M101-G105 VanDerWaalsContact O-N 3.08Å
106	V	54.3	Low	48.2	Very low	124 Å²	124	142.9 Å²	142.9	75%	0.752	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	15.1	-171	-170.9	0	0	0	0	112.5	L102 A104	L102-V106 WeakPolarHBondContact O-CG2 3.4Å; A104-V106 VanDerWaalsContact C-N 3.32Å; A104-V106 PolarHBondContact O-N 3.08Å
107	R	44.9	Very low	47.5	Very low	227 Å²	227	139.5 Å²	139.5	86%	0.857	76%	0.755	S	S	*	*			trans	-113.7	5.2	178.7	-89.3	-176.2	150.2	141.4	-4.3	115.8	R109	R107-R109 VanDerWaalsContact C-N 3.28Å; R107-R109 PolarHBondContact O-N 3.34Å; R107-R109 VanDerWaalsContact O-N 3.11Å
108	G	45	Very low	47.3	Very low	82 Å²	82	141.8 Å²	141.8	85%	0.845	77%	0.769	S	S	*	*			trans	-85.1	62.7	171	0	0	0	0	0	112.9	G110	G108-G110 PolarHBondContact O-N 3.3Å
109	R	40.4	Very low	47	Very low	243 Å²	243	139 Å²	139	92%	0.917	77%	0.766	S	S	*	*			trans	-71.9	108.4	176.8	177.7	167.9	171.2	154.9	-6.3	109.9	R107	R107-R109 VanDerWaalsContact C-N 3.28Å; R107-R109 PolarHBondContact O-N 3.34Å; R107-R109 VanDerWaalsContact O-N 3.11Å
110	G	37.3	Very low	46.5	Very low	59 Å²	59	139.2 Å²	139.2	61%	0.608	77%	0.771	S	S	*	*			trans	46	112.7	142.6	0	0	0	0	0	119.5	G108	G108-G110 PolarHBondContact O-N 3.3Å
111	T	42	Very low	45.7	Very low	147 Å²	147	147.6 Å²	147.6	90%	0.902	79%	0.789	S	S	*	*			trans	-165.6	102.2	132.4	3.3	0	0	0	0	109.9
112	F	36.8	Very low	45.1	Very low	198 Å²	198	143 Å²	143	87%	0.868	78%	0.78	S	S	*	*			trans	-65.6	141.7	150	-70.3	-98.3	0	0	0	107.4
113	V	44.5	Very low	44.9	Very low	126 Å²	126	144.5 Å²	144.5	76%	0.764	79%	0.794	S	S	*	*			trans	161.5	127.1	142.4	160.3	0	0	0	0	110.1
114	R	38.1	Very low	44.6	Very low	239 Å²	239	138 Å²	138	90%	0.902	79%	0.794	S	S	*	*			trans	58	116.3	160.2	-88	168.2	154.1	155.2	-5.2	117.2
115	G	41.5	Very low	44.2	Very low	76 Å²	76	146.3 Å²	146.3	78%	0.784	81%	0.808	S	S	*	*			cis	88	112.7	43.2	0	0	0	0	0	109.8
116	R	39.5	Very low	44.1	Very low	240 Å²	240	149 Å²	149	91%	0.906	81%	0.812	S	S	*	*			trans	126.3	90.7	159.2	-165.3	175	-173	161.5	1.5	114
117	V	40.5	Very low	44.1	Very low	138 Å²	138	149.9 Å²	149.9	84%	0.836	82%	0.818	S	S	*	*			trans	-133.1	102.5	148	-179.5	0	0	0	0	106.3
118	A	44.6	Very low	44.5	Very low	96 Å²	96	142.3 Å²	142.3	79%	0.793	81%	0.811	S	S	*	*			trans	-121.7	112.9	168.3	0	0	0	0	0	106.4
119	T	47.7	Very low	44.8	Very low	111 Å²	111	150.1 Å²	150.1	68%	0.681	82%	0.815	S	S	*	*			trans	-119.3	116.9	-179.4	-66.1	0	0	0	0	107.3
120	V	44.9	Very low	45.3	Very low	125 Å²	125	151.9 Å²	151.9	76%	0.758	83%	0.829	S	S	*	*			trans	76.2	114	145.8	178.1	0	0	0	0	117.4
121	R	39.9	Very low	45.7	Very low	244 Å²	244	156.5 Å²	156.5	92%	0.921	84%	0.84	S	S	*	*				146.6	136.6	107.1	-154.1	164	170.4	177.9	-5.1	112.9
122	G	43.7	Very low	45.9	Very low	54 Å²	54	157 Å²	157	56%	0.557	84%	0.837	S	S	*	*			trans	100.5	98.2	151.8	0	0	0	0	0	115.1
123	T	51.6	Low	46.4	Very low	151 Å²	151	154.7 Å²	154.7	93%	0.926	84%	0.835	S	S	*	*				80.6	114.4	94.9	54.9	0	0	0	0	113.7
124	G	48.7	Very low	46.5	Very low	76 Å²	76	156.4 Å²	156.4	78%	0.784	84%	0.839	S	S	*	*			trans	158.2	81.5	162	0	0	0	0	0	115.9
125	R	48.8	Very low	47	Very low	252 Å²	252	151.3 Å²	151.3	95%	0.951	84%	0.836	S	S	*	*			trans	34.3	124.5	141.4	-91.8	173.6	175.4	156.6	-1.4	121
126	T	52.5	Low	47.4	Very low	121 Å²	121	156.3 Å²	156.3	74%	0.742	84%	0.839	S	S	*	*			trans	-66.8	162.2	163.7	48.1	0	0	0	0	115
127	T	53.1	Low	48	Very low	143 Å²	143	150.3 Å²	150.3	88%	0.877	83%	0.834	S	S	*	*			trans	92.3	112.3	150	69.9	0	0	0	0	120.7
128	G	53.4	Low	48.5	Very low	68 Å²	68	151.2 Å²	151.2	70%	0.701	83%	0.834	S	S	*	*			trans	-175.1	93.9	155.2	0	0	0	0	0	109.2
129	R	52.5	Low	48.9	Very low	246 Å²	246	155.8 Å²	155.8	93%	0.928	84%	0.837	S	S	*	*				85.6	114.9	104.9	-78.9	-169.3	-152.4	-174.9	5.9	114.8
130	F	49.7	Very low	49	Very low	279 Å²	279	159.9 Å²	159.9	100%	1.224	85%	0.852	S	S	*	*				-78.1	0	123.2	-73.2	-86.5	0	0	0	108.6

Retrieved 130 of 130 residues in 188.5 ms (Link to these results)

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