A0A077ZEW9_TRITR Loading...

RAB3GAP2 N domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZEW9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 169 aa.

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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	34.9	Very low	34.4	Very low	230 Å²	230	159.5 Å²	159.5	100%	1.133	85%	0.847	S	S	*	*				0	126.3	0	-90.1	168.3	169.1	0	0	107
2	D	32.2	Very low	33.8	Very low	151 Å²	151	160 Å²	160	81%	0.807	85%	0.849	S	S	*	*			trans	61	100.6	153.4	-49.1	-22.6	0	0	0	119
3	S	35.3	Very low	33.5	Very low	113 Å²	113	163.3 Å²	163.3	79%	0.79	84%	0.842	S	S	*	*				-179.9	95	102.2	68	0	0	0	0	109.9	D5	S3-D5 PolarHBondContact O-N 3.34Å
4	L	34.6	Very low	33.1	Very low	178 Å²	178	165.4 Å²	165.4	93%	0.932	84%	0.842	S	S	*	*			trans	-76.3	96.6	158.2	-85.8	150.2	0	0	0	106.6
5	D	33.4	Very low	33.1	Very low	151 Å²	151	159.7 Å²	159.7	81%	0.807	81%	0.814	S	S	*	*			trans	-158	89.6	170.1	-102.8	-28.6	0	0	0	110.3	S3	S3-D5 PolarHBondContact O-N 3.34Å
6	A	37.6	Very low	33.2	Very low	95 Å²	95	154.3 Å²	154.3	79%	0.785	80%	0.801	S	S	*	*			trans	-153.1	102.8	151.3	0	0	0	0	0	107.4	E8	A6-E8 PolarHBondContact O-N 3.1Å; A6-E8 VanDerWaalsContact O-N 3.1Å
7	K	35	Very low	33.8	Very low	195 Å²	195	159 Å²	159	85%	0.848	81%	0.806	S	S	*	*			trans	-52.7	107.8	171.9	-68.4	167.4	173.5	173.6	0	109.6	E9	K7-E9 PolarHBondContact O-N 3.24Å
8	E	35	Very low	34.5	Very low	191 Å²	191	151.8 Å²	151.8	89%	0.893	77%	0.771	S	S	*	*			trans	-73.5	102.6	154.9	-77.1	-177.2	160.2	0	0	106.8	A6	A6-E8 PolarHBondContact O-N 3.1Å; A6-E8 VanDerWaalsContact O-N 3.1Å
9	E	33.9	Very low	35.5	Very low	172 Å²	172	150.7 Å²	150.7	80%	0.804	77%	0.767	S	S	*	*			trans	-57.7	131.5	163.4	-72.6	-175.3	154.9	0	0	107.9	K7 E11	K7-E9 PolarHBondContact O-N 3.24Å; E9-E11 PolarHBondContact O-N 2.71Å
10	P	37.7	Very low	36.3	Very low	118 Å²	118	144.3 Å²	144.3	77%	0.766	74%	0.737	S	S	*	*			trans	-63.6	119.3	174.9	26.7	-29.5	0	0	0	106.5	L12	P10-L12 PolarHBondContact O-N 2.82Å
11	E	29.4	Very low	37.5	Very low	160 Å²	160	142.3 Å²	142.3	75%	0.748	73%	0.734	S	S	*	*			trans	-43.3	105.7	168.7	-72.7	-176.3	149.2	0	0	108	E9 R13	E9-E11 PolarHBondContact O-N 2.71Å; E11-R13 HydrophobicContact CB-CG 4.39Å; E11-R13 PolarHBondContact O-N 3.06Å
12	L	26.6	Very low	38.4	Very low	166 Å²	166	132.1 Å²	132.1	87%	0.869	69%	0.686	S	S	*	*			trans	-59.5	83.8	155.8	-91.2	153.5	0	0	0	104.5	P10 F14	P10-L12 PolarHBondContact O-N 2.82Å; L12-F14 VanDerWaalsContact C-N 3.32Å; L12-F14 PolarHBondContact O-N 2.8Å
13	R	29.9	Very low	39.6	Very low	203 Å²	203	126.2 Å²	126.2	77%	0.766	65%	0.652	S	S	*	*			trans	-54.7	107.2	172.7	-76.4	-176.1	177.7	174.4	0.7	104.9	E11 L15	E11-R13 HydrophobicContact CB-CG 4.39Å; E11-R13 PolarHBondContact O-N 3.06Å; R13-L15 PolarHBondContact O-N 2.74Å
14	F	28.6	Very low	41	Very low	192 Å²	192	124.8 Å²	124.8	84%	0.842	63%	0.633	S	S	*	*			trans	-35.3	112.3	172.1	-93.6	-113.6	0	0	0	107.9	L12 A16	L12-F14 VanDerWaalsContact C-N 3.32Å; L12-F14 PolarHBondContact O-N 2.8Å; F14-A16 VanDerWaalsContact C-N 3.25Å; F14-A16 PolarHBondContact O-N 2.98Å
15	L	32.5	Very low	42.4	Very low	80 Å²	80	122.2 Å²	122.2	42%	0.419	62%	0.616	S	S	.	*			trans	-47.6	107.1	153.2	-81.1	157.9	0	0	0	104.2	R13 R17 S46 I48	R13-L15 PolarHBondContact O-N 2.74Å; L15-R17 PolarHBondContact O-N 3.23Å; L15-S46 VanDerWaalsContact CD1-O 3.25Å; L15-S46 WeakPolarHBondContact CD1-O 3.35Å; L15-I48 HydrophobicContact CD2-CB 4.06Å; L15-I48 HydrophobicContact CD2-CG1 4.36Å
16	A	35.1	Very low	43.6	Very low	73 Å²	73	115.5 Å²	115.5	60%	0.603	58%	0.581	S	S	*	*			trans	-46.5	122.2	177.7	0	0	0	0	0	105.6	F14 V18	F14-A16 VanDerWaalsContact C-N 3.25Å; F14-A16 PolarHBondContact O-N 2.98Å; A16-V18 WeakPolarHBondContact O-CG2 3.09Å; A16-V18 PolarHBondContact O-N 2.81Å
17	R	43	Very low	44.9	Very low	235 Å²	235	113 Å²	113	89%	0.887	55%	0.552	S	S	*	*			trans	-58.7	95.5	164.4	-78	-179	175.9	179.8	-1	103.9	L15 D19	L15-R17 PolarHBondContact O-N 3.23Å; R17-D19 PolarHBondContact O-N 2.97Å
18	V	46.9	Very low	46.3	Very low	29 Å²	29	111 Å²	111	18%	0.176	54%	0.544	C	S	.	.			trans	-67.9	82.2	177.5	177.6	0	0	0	0	105	A16 S20 W23 V50	A16-V18 WeakPolarHBondContact O-CG2 3.09Å; A16-V18 PolarHBondContact O-N 2.81Å; V18-S20 PolarHBondContact O-N 2.72Å; V18-W23 HydrophobicContact CB-CB 4.32Å; V18-W23 HydrophobicContact CB-CG 4.24Å; V18-W23 HydrophobicContact CG1-CB 3.88Å; V18-W23 HydrophobicContact CG1-CG 4.32Å; V18-W23 VanDerWaalsContact O-CB 3.26Å; V18-W23 WeakPolarHBondContact O-CB 3.49Å; V18-V50 HydrophobicContact CG2-CG2 4.43Å
19	D	52.9	Low	47.7	Very low	132 Å²	132	105 Å²	105	71%	0.706	52%	0.515	S	S	*	.			trans	-81.7	67.4	177.1	-167.6	3.6	0	0	0	108.6	R17 H24	R17-D19 PolarHBondContact O-N 2.97Å; D19-H24 IonicContact OD1-CE1 2.98Å; D19-H24 PolarHBondContact OD1-CE1 3.11Å; D19-H24 IonicContact OD1-ND1 3.84Å; D19-H24 IonicContact OD1-NE2 3.81Å
20	S	51.2	Low	48.8	Very low	22 Å²	22	97.1 Å²	97.1	15%	0.154	48%	0.478	C	S	.	.			trans	-114	145.8	176.9	85.3	0	0	0	0	110.5	V18 A22 W23 H24	V18-S20 PolarHBondContact O-N 2.72Å; S20-A22 PolarHBondContact O-N 2.8Å; S20-A22 VanDerWaalsContact O-N 3.15Å; S20-W23 WeakPolarHBondContact O-CB 3.41Å; S20-W23 PolarHBondContact O-N 2.85Å; S20-W23 PolarHBondContact OG-N 2.86Å; S20-H24 PolarHBondContact O-N 2.98Å; S20-H24 PolarHBondContact O-ND1 3.05Å
21	P	61.5	Low	50	Low	103 Å²	103	95.1 Å²	95.1	67%	0.669	46%	0.456	S	S	*	.	H	α-helix	trans	-55.4	-31.6	172.9	-26.4	34.5	0	0	0	112.9	Q25	P21-Q25 WeakPolarHBondContact O-CG 2.99Å; P21-Q25 PolarHBondContact O-N 3.44Å
22	A	54.9	Low	51.5	Low	16 Å²	16	91.7 Å²	91.7	13%	0.132	45%	0.45	C	S	.	.	H	α-helix	trans	-66	-44.6	175	0	0	0	0	0	111.2	S20 H24 Q25 V26 F57	S20-A22 PolarHBondContact O-N 2.8Å; S20-A22 VanDerWaalsContact O-N 3.15Å; A22-H24 PolarHBondContact O-N 3.18Å; A22-Q25 WeakPolarHBondContact O-CB 3.47Å; A22-Q25 PolarHBondContact O-N 3.09Å; A22-Q25 VanDerWaalsContact O-N 3.17Å; A22-V26 WeakPolarHBondContact O-CG2 3.38Å; A22-V26 PolarHBondContact O-N 3.03Å; A22-F57 HydrophobicContact CB-CE2 4.28Å; A22-F57 HydrophobicContact CB-CZ 3.83Å
23	W	57.2	Low	52.8	Low	27 Å²	27	87.5 Å²	87.5	10%	0.102	43%	0.431	C	S	.	.	H	α-helix	trans	-61	-45.3	175.7	175.9	-121.5	0	0	0	112.1	V18 S20 Q25 V26 Q27 M43 I48 F59	V18-W23 HydrophobicContact CB-CB 4.32Å; V18-W23 HydrophobicContact CB-CG 4.24Å; V18-W23 HydrophobicContact CG1-CB 3.88Å; V18-W23 HydrophobicContact CG1-CG 4.32Å; V18-W23 VanDerWaalsContact O-CB 3.26Å; V18-W23 WeakPolarHBondContact O-CB 3.49Å; S20-W23 WeakPolarHBondContact O-CB 3.41Å; S20-W23 PolarHBondContact O-N 2.85Å; S20-W23 PolarHBondContact OG-N 2.86Å; W23-Q25 VanDerWaalsContact C-N 3.27Å; W23-Q25 PolarHBondContact O-N 2.65Å; W23-V26 HydrophobicContact CE3-CB 4.2Å; W23-V26 HydrophobicContact CE3-CG1 4.23Å; W23-V26 HydrophobicContact CZ3-CB 4.45Å; W23-V26 HydrophobicContact CZ3-CG1 4.01Å; W23-V26 PolarHBondContact O-N 3.29Å; W23-V26 VanDerWaalsContact O-N 3.13Å; W23-Q27 HydrophobicContact CD2-CG 3.8Å; W23-Q27 HydrophobicContact CE3-CG 4.05Å; W23-Q27 HydrophobicContact CG-CG 4.38Å; W23-Q27 HydrophobicContact CH2-CG 3.83Å; W23-Q27 HydrophobicContact CZ2-CG 3.62Å; W23-Q27 HydrophobicContact CZ3-CG 3.98Å; W23-Q27 VanDerWaalsContact NE1-NE2 3.18Å; W23-Q27 WeakPolarHBondContact O-CB 3.27Å; W23-Q27 WeakPolarHBondContact O-CG 3.07Å; W23-Q27 PolarHBondContact O-N 3.32Å; W23-M43 HydrophobicContact CH2-SD 4.33Å; W23-I48 HydrophobicContact CH2-CD1 4.02Å; W23-I48 HydrophobicContact CZ2-CD1 3.99Å; W23-F59 HydrophobicContact CE3-CE1 4.16Å; W23-F59 HydrophobicContact CE3-CZ 4.04Å; W23-F59 HydrophobicContact CH2-CD1 4.26Å; W23-F59 AromaticContact CH2-CE1 3.38Å; W23-F59 HydrophobicContact CH2-CE1 3.38Å; W23-F59 AromaticContact CH2-CZ 3.98Å; W23-F59 HydrophobicContact CH2-CZ 3.98Å; W23-F59 HydrophobicContact CZ3-CD1 4.31Å; W23-F59 AromaticContact CZ3-CE1 3.13Å; W23-F59 HydrophobicContact CZ3-CE1 3.13Å; W23-F59 HydrophobicContact CZ3-CE2 4.45Å; W23-F59 AromaticContact CZ3-CZ 3.23Å; W23-F59 HydrophobicContact CZ3-CZ 3.23Å
24	H	64	Low	53.8	Low	83 Å²	83	79.4 Å²	79.4	38%	0.384	40%	0.404	S	S	.	.	H	α-helix	trans	-59.5	-36.8	175	-72	127	0	0	0	113.2	D19 S20 A22 K28	D19-H24 IonicContact OD1-CE1 2.98Å; D19-H24 PolarHBondContact OD1-CE1 3.11Å; D19-H24 IonicContact OD1-ND1 3.84Å; D19-H24 IonicContact OD1-NE2 3.81Å; S20-H24 PolarHBondContact O-N 2.98Å; S20-H24 PolarHBondContact O-ND1 3.05Å; A22-H24 PolarHBondContact O-N 3.18Å; H24-K28 WeakPolarHBondContact O-CB 3.41Å; H24-K28 VanDerWaalsContact O-CG 3.26Å; H24-K28 WeakPolarHBondContact O-CG 3.49Å; H24-K28 PolarHBondContact O-N 3.12Å
25	Q	63.3	Low	54.9	Low	123 Å²	123	78.4 Å²	78.4	58%	0.575	41%	0.408	S	S	*	.	H	α-helix	trans	-67.4	-43.7	174.2	-76.4	179.5	2.9	0	0	111.8	P21 A22 W23 K28 F29	P21-Q25 WeakPolarHBondContact O-CG 2.99Å; P21-Q25 PolarHBondContact O-N 3.44Å; A22-Q25 WeakPolarHBondContact O-CB 3.47Å; A22-Q25 PolarHBondContact O-N 3.09Å; A22-Q25 VanDerWaalsContact O-N 3.17Å; W23-Q25 VanDerWaalsContact C-N 3.27Å; W23-Q25 PolarHBondContact O-N 2.65Å; Q25-K28 PolarHBondContact O-N 2.89Å; Q25-F29 WeakPolarHBondContact O-CB 3.46Å; Q25-F29 PolarHBondContact O-N 2.92Å
26	V	60.1	Low	56	Low	11 Å²	11	76.6 Å²	76.6	7%	0.067	40%	0.402	C	S	.	.	H	α-helix	trans	-62.5	-45.5	176.6	172.7	0	0	0	0	110.8	A22 W23 F29 L30 F57 F59 V68	A22-V26 WeakPolarHBondContact O-CG2 3.38Å; A22-V26 PolarHBondContact O-N 3.03Å; W23-V26 HydrophobicContact CE3-CB 4.2Å; W23-V26 HydrophobicContact CE3-CG1 4.23Å; W23-V26 HydrophobicContact CZ3-CB 4.45Å; W23-V26 HydrophobicContact CZ3-CG1 4.01Å; W23-V26 PolarHBondContact O-N 3.29Å; W23-V26 VanDerWaalsContact O-N 3.13Å; V26-F29 PolarHBondContact O-N 3.05Å; V26-L30 HydrophobicContact CG1-CD1 3.58Å; V26-L30 HydrophobicContact CG1-CG 4.25Å; V26-L30 WeakPolarHBondContact O-CB 3.21Å; V26-L30 VanDerWaalsContact O-CG 3.31Å; V26-L30 WeakPolarHBondContact O-CG 3.44Å; V26-L30 PolarHBondContact O-N 3.48Å; V26-F57 HydrophobicContact CG2-CD2 4.05Å; V26-F57 HydrophobicContact CG2-CE2 4.25Å; V26-F59 HydrophobicContact CG1-CE2 4.03Å; V26-F59 HydrophobicContact CG1-CZ 3.94Å; V26-V68 HydrophobicContact CG1-CB 4.27Å; V26-V68 HydrophobicContact CG1-CG1 4.07Å; V26-V68 HydrophobicContact CG1-CG2 4.02Å; V26-V68 HydrophobicContact CG2-CG1 3.85Å
27	Q	63.5	Low	57	Low	41 Å²	41	80.4 Å²	80.4	19%	0.192	41%	0.405	C	S	.	.	H	α-helix	trans	-59.1	-49.9	174.4	-73.8	-175	-44.9	0	0	111.6	W23 F29 L30 Y31	W23-Q27 HydrophobicContact CD2-CG 3.8Å; W23-Q27 HydrophobicContact CE3-CG 4.05Å; W23-Q27 HydrophobicContact CG-CG 4.38Å; W23-Q27 HydrophobicContact CH2-CG 3.83Å; W23-Q27 HydrophobicContact CZ2-CG 3.62Å; W23-Q27 HydrophobicContact CZ3-CG 3.98Å; W23-Q27 VanDerWaalsContact NE1-NE2 3.18Å; W23-Q27 WeakPolarHBondContact O-CB 3.27Å; W23-Q27 WeakPolarHBondContact O-CG 3.07Å; W23-Q27 PolarHBondContact O-N 3.32Å; Q27-F29 VanDerWaalsContact C-N 3.29Å; Q27-F29 PolarHBondContact O-N 2.99Å; Q27-L30 PolarHBondContact O-N 3.22Å; Q27-Y31 HydrophobicContact CB-CD2 4.21Å; Q27-Y31 HydrophobicContact CB-CE2 3.91Å; Q27-Y31 HydrophobicContact CG-CE2 4.48Å; Q27-Y31 VanDerWaalsContact O-CB 3.3Å; Q27-Y31 WeakPolarHBondContact O-CB 3.23Å; Q27-Y31 WeakPolarHBondContact O-CD2 3.25Å; Q27-Y31 PolarHBondContact O-N 2.74Å
28	K	65.9	Low	57.6	Low	155 Å²	155	72.7 Å²	72.7	67%	0.674	39%	0.387	S	S	*	.	H	α-helix	trans	-57.2	-43.9	176.8	-79.6	177.5	-179.4	-179	0	111.6	H24 Q25 S32	H24-K28 WeakPolarHBondContact O-CB 3.41Å; H24-K28 VanDerWaalsContact O-CG 3.26Å; H24-K28 WeakPolarHBondContact O-CG 3.49Å; H24-K28 PolarHBondContact O-N 3.12Å; Q25-K28 PolarHBondContact O-N 2.89Å; K28-S32 VanDerWaalsContact O-CB 3.29Å; K28-S32 WeakPolarHBondContact O-CB 3.35Å; K28-S32 PolarHBondContact O-N 2.7Å; K28-S32 PolarHBondContact O-OG 3.45Å
29	F	63.8	Low	57.8	Low	63 Å²	63	73.5 Å²	73.5	28%	0.276	39%	0.392	S	S	.	.	H	α-helix	trans	-64.4	-52.3	178.7	-172.5	-97.1	0	0	0	111.1	Q25 V26 Q27 Y31 S32 T33 P78	Q25-F29 WeakPolarHBondContact O-CB 3.46Å; Q25-F29 PolarHBondContact O-N 2.92Å; V26-F29 PolarHBondContact O-N 3.05Å; Q27-F29 VanDerWaalsContact C-N 3.29Å; Q27-F29 PolarHBondContact O-N 2.99Å; F29-Y31 VanDerWaalsContact C-N 3.34Å; F29-Y31 PolarHBondContact O-N 3.18Å; F29-S32 WeakPolarHBondContact CA-OG 3.26Å; F29-S32 WeakPolarHBondContact O-CA 3.44Å; F29-S32 PolarHBondContact O-N 3.43Å; F29-S32 PolarHBondContact O-OG 2.53Å; F29-T33 HydrophobicContact CD1-CG2 4.15Å; F29-T33 HydrophobicContact CD2-CG2 4.32Å; F29-T33 HydrophobicContact CE1-CG2 3.75Å; F29-T33 HydrophobicContact CE2-CG2 3.94Å; F29-T33 HydrophobicContact CG-CG2 4.42Å; F29-T33 HydrophobicContact CZ-CG2 3.65Å; F29-T33 PolarHBondContact O-N 2.88Å; F29-T33 PolarHBondContact O-OG1 2.94Å; F29-P78 HydrophobicContact CB-CG 4.45Å; F29-P78 HydrophobicContact CD1-CG 3.8Å; F29-P78 HydrophobicContact CD2-CG 4.12Å; F29-P78 HydrophobicContact CE1-CG 4Å; F29-P78 HydrophobicContact CE2-CG 4.31Å; F29-P78 HydrophobicContact CG-CG 3.85Å; F29-P78 HydrophobicContact CZ-CG 4.24Å
30	L	56.7	Low	57.9	Low	8 Å²	8	73.2 Å²	73.2	4%	0.042	38%	0.381	C	S	.	.	H	α-helix	trans	-58.6	-45.2	178.9	-72.3	169.7	0	0	0	111.4	V26 Q27 S32 T33 T34 M43 F59 V68 F80	V26-L30 HydrophobicContact CG1-CD1 3.58Å; V26-L30 HydrophobicContact CG1-CG 4.25Å; V26-L30 WeakPolarHBondContact O-CB 3.21Å; V26-L30 VanDerWaalsContact O-CG 3.31Å; V26-L30 WeakPolarHBondContact O-CG 3.44Å; V26-L30 PolarHBondContact O-N 3.48Å; Q27-L30 PolarHBondContact O-N 3.22Å; L30-S32 VanDerWaalsContact C-N 3.26Å; L30-S32 PolarHBondContact O-N 3Å; L30-T33 PolarHBondContact O-N 2.98Å; L30-T33 PolarHBondContact O-OG1 3.31Å; L30-T34 PolarHBondContact O-N 2.93Å; L30-T34 PolarHBondContact O-OG1 3.15Å; L30-M43 HydrophobicContact CB-CE 3.51Å; L30-M43 HydrophobicContact CD1-CE 3.22Å; L30-M43 HydrophobicContact CG-CE 3.93Å; L30-F59 HydrophobicContact CD1-CE2 4.36Å; L30-V68 HydrophobicContact CD1-CG2 4.44Å; L30-F80 HydrophobicContact CD2-CD2 4Å; L30-F80 HydrophobicContact CD2-CE2 3.61Å
31	Y	63.5	Low	58.2	Low	76 Å²	76	78 Å²	78	30%	0.298	40%	0.4	S	S	.	.	H	α-helix	trans	-64.4	-29.1	175.5	-65.3	-34.9	0	0	0	113.3	Q27 F29 R40 M43	Q27-Y31 HydrophobicContact CB-CD2 4.21Å; Q27-Y31 HydrophobicContact CB-CE2 3.91Å; Q27-Y31 HydrophobicContact CG-CE2 4.48Å; Q27-Y31 VanDerWaalsContact O-CB 3.3Å; Q27-Y31 WeakPolarHBondContact O-CB 3.23Å; Q27-Y31 WeakPolarHBondContact O-CD2 3.25Å; Q27-Y31 PolarHBondContact O-N 2.74Å; F29-Y31 VanDerWaalsContact C-N 3.34Å; F29-Y31 PolarHBondContact O-N 3.18Å; Y31-R40 HydrophobicContact CD1-CB 4.22Å; Y31-R40 HydrophobicContact CD1-CG 3.64Å; Y31-R40 HydrophobicContact CE1-CB 3.98Å; Y31-R40 HydrophobicContact CE1-CG 3.93Å; Y31-R40 PolarHBondContact O-NH2 2.93Å; Y31-M43 HydrophobicContact CE1-CE 4.39Å; Y31-M43 HydrophobicContact CE1-CG 4.46Å; Y31-M43 HydrophobicContact CE1-SD 3.76Å
32	S	60.8	Low	57.8	Low	88 Å²	88	73.5 Å²	73.5	62%	0.615	37%	0.372	S	S	*	.	H	α-helix	trans	-81.9	-27.5	177.2	71.7	0	0	0	0	114.2	K28 F29 L30	K28-S32 VanDerWaalsContact O-CB 3.29Å; K28-S32 WeakPolarHBondContact O-CB 3.35Å; K28-S32 PolarHBondContact O-N 2.7Å; K28-S32 PolarHBondContact O-OG 3.45Å; F29-S32 WeakPolarHBondContact CA-OG 3.26Å; F29-S32 WeakPolarHBondContact O-CA 3.44Å; F29-S32 PolarHBondContact O-N 3.43Å; F29-S32 PolarHBondContact O-OG 2.53Å; L30-S32 VanDerWaalsContact C-N 3.26Å; L30-S32 PolarHBondContact O-N 3Å
33	T	54.7	Low	57.9	Low	77 Å²	77	73.5 Å²	73.5	47%	0.472	37%	0.369	S	S	.	.	H	α-helix	trans	-99.2	-16.5	-175.4	54.8	0	0	0	0	113.9	F29 L30	F29-T33 HydrophobicContact CD1-CG2 4.15Å; F29-T33 HydrophobicContact CD2-CG2 4.32Å; F29-T33 HydrophobicContact CE1-CG2 3.75Å; F29-T33 HydrophobicContact CE2-CG2 3.94Å; F29-T33 HydrophobicContact CG-CG2 4.42Å; F29-T33 HydrophobicContact CZ-CG2 3.65Å; F29-T33 PolarHBondContact O-N 2.88Å; F29-T33 PolarHBondContact O-OG1 2.94Å; L30-T33 PolarHBondContact O-N 2.98Å; L30-T33 PolarHBondContact O-OG1 3.31Å
34	T	49.2	Very low	57.9	Low	33 Å²	33	77.3 Å²	77.3	20%	0.202	40%	0.397	C	S	.	.			trans	-103.2	108	174.6	46.2	0	0	0	0	111.3	L30 S36 V39	L30-T34 PolarHBondContact O-N 2.93Å; L30-T34 PolarHBondContact O-OG1 3.15Å; T34-S36 PolarHBondContact O-N 3.08Å; T34-V39 HydrophobicContact CG2-CB 4.33Å; T34-V39 HydrophobicContact CG2-CG1 4.2Å; T34-V39 HydrophobicContact CG2-CG2 4.14Å
35	D	52.4	Low	57.9	Low	172 Å²	172	78 Å²	78	92%	0.92	41%	0.408	S	S	*	.			trans	-65.8	-8	165.3	-82.9	-26.3	0	0	0	112.4	K37	D35-K37 PolarHBondContact O-N 3.27Å
36	S	55.1	Low	58.2	Low	42 Å²	42	72.5 Å²	72.5	29%	0.294	38%	0.383	S	S	.	.			trans	-83.7	106.7	-178.3	132.9	0	0	0	0	110.2	T34 S38 V39	T34-S36 PolarHBondContact O-N 3.08Å; S36-S38 PolarHBondContact O-N 3.18Å; S36-S38 VanDerWaalsContact O-N 3.11Å; S36-S38 PolarHBondContact OG-OG 2.91Å; S36-V39 PolarHBondContact O-N 3.03Å; S36-V39 WeakPolarHBondContact OG-CG2 3.42Å; S36-V39 PolarHBondContact OG-N 3.25Å; S36-V39 VanDerWaalsContact OG-N 3.09Å
37	K	56.5	Low	59.2	Low	152 Å²	152	74.4 Å²	74.4	66%	0.661	39%	0.392	S	S	*	.	H	α-helix	trans	-47.9	-33.6	166.5	-168	-177.3	-177	-162.5	0	111.8	D35 V39 R40 E41	D35-K37 PolarHBondContact O-N 3.27Å; K37-V39 PolarHBondContact O-N 3.48Å; K37-R40 PolarHBondContact O-N 3.16Å; K37-E41 WeakPolarHBondContact CE-OE1 3.39Å; K37-E41 HydrophobicContact CG-CG 4.43Å; K37-E41 WeakPolarHBondContact CG-OE1 3.38Å; K37-E41 IonicContact NZ-OE1 3.67Å; K37-E41 WeakPolarHBondContact O-CG 3.16Å; K37-E41 PolarHBondContact O-N 3.38Å
38	S	56.1	Low	60.2	Low	73 Å²	73	74.4 Å²	74.4	51%	0.51	39%	0.393	S	S	.	.	H	α-helix	trans	-64.1	-33.1	178.1	53	0	0	0	0	114.5	S36 R40 S42	S36-S38 PolarHBondContact O-N 3.18Å; S36-S38 VanDerWaalsContact O-N 3.11Å; S36-S38 PolarHBondContact OG-OG 2.91Å; S38-R40 VanDerWaalsContact C-N 3.35Å; S38-S42 VanDerWaalsContact O-CB 3.27Å; S38-S42 WeakPolarHBondContact O-CB 3.26Å; S38-S42 PolarHBondContact O-N 2.76Å; S38-S42 PolarHBondContact O-OG 3.42Å
39	V	51	Low	61.1	Low	46 Å²	46	67.4 Å²	67.4	28%	0.279	36%	0.364	S	S	.	.	H	α-helix	trans	-70.4	-34.5	174.2	170.6	0	0	0	0	111.1	T34 S36 K37 S42 M43	T34-V39 HydrophobicContact CG2-CB 4.33Å; T34-V39 HydrophobicContact CG2-CG1 4.2Å; T34-V39 HydrophobicContact CG2-CG2 4.14Å; S36-V39 PolarHBondContact O-N 3.03Å; S36-V39 WeakPolarHBondContact OG-CG2 3.42Å; S36-V39 PolarHBondContact OG-N 3.25Å; S36-V39 VanDerWaalsContact OG-N 3.09Å; K37-V39 PolarHBondContact O-N 3.48Å; V39-S42 WeakPolarHBondContact CA-OG 3.48Å; V39-S42 PolarHBondContact O-OG 2.73Å; V39-M43 WeakPolarHBondContact O-CG 3.03Å; V39-M43 PolarHBondContact O-N 3Å
40	R	54.7	Low	62	Low	127 Å²	127	66 Å²	66	48%	0.479	36%	0.361	S	S	.	.	H	α-helix	trans	-70.8	-41.8	176.7	-51	-158.6	-178.8	155.3	-2	111.9	Y31 K37 S38 S42	Y31-R40 HydrophobicContact CD1-CB 4.22Å; Y31-R40 HydrophobicContact CD1-CG 3.64Å; Y31-R40 HydrophobicContact CE1-CB 3.98Å; Y31-R40 HydrophobicContact CE1-CG 3.93Å; Y31-R40 PolarHBondContact O-NH2 2.93Å; K37-R40 PolarHBondContact O-N 3.16Å; S38-R40 VanDerWaalsContact C-N 3.35Å; R40-S42 VanDerWaalsContact C-N 3.28Å; R40-S42 PolarHBondContact O-N 2.6Å
41	E	57.2	Low	63	Low	121 Å²	121	65.7 Å²	65.7	57%	0.565	36%	0.359	S	S	*	.	H	α-helix	trans	-68.4	-28.2	178.1	-72.5	172.6	175.3	0	0	112.2	K37 P44	K37-E41 WeakPolarHBondContact CE-OE1 3.39Å; K37-E41 HydrophobicContact CG-CG 4.43Å; K37-E41 WeakPolarHBondContact CG-OE1 3.38Å; K37-E41 IonicContact NZ-OE1 3.67Å; K37-E41 WeakPolarHBondContact O-CG 3.16Å; K37-E41 PolarHBondContact O-N 3.38Å; E41-P44 WeakPolarHBondContact O-CD 3.14Å
42	S	54.3	Low	63.3	Low	10 Å²	10	66.4 Å²	66.4	7%	0.07	37%	0.373	C	S	.	.	H	α-helix	trans	-83.9	-25.7	-178.8	61.8	0	0	0	0	114.9	S38 V39 R40 P44 T45 S46	S38-S42 VanDerWaalsContact O-CB 3.27Å; S38-S42 WeakPolarHBondContact O-CB 3.26Å; S38-S42 PolarHBondContact O-N 2.76Å; S38-S42 PolarHBondContact O-OG 3.42Å; V39-S42 WeakPolarHBondContact CA-OG 3.48Å; V39-S42 PolarHBondContact O-OG 2.73Å; R40-S42 VanDerWaalsContact C-N 3.28Å; R40-S42 PolarHBondContact O-N 2.6Å; S42-P44 VanDerWaalsContact C-CD 3.42Å; S42-T45 CarbonylContact O-C 3.53Å; S42-T45 WeakPolarHBondContact O-CA 2.88Å; S42-T45 PolarHBondContact O-N 2.77Å; S42-T45 PolarHBondContact O-OG1 3.34Å; S42-S46 PolarHBondContact O-N 2.86Å; S42-S46 VanDerWaalsContact O-N 3.12Å; S42-S46 PolarHBondContact O-OG 3.22Å
43	M	56	Low	63.7	Low	16 Å²	16	67.2 Å²	67.2	8%	0.079	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-50.6	-42.2	-176.3	-87	-151.1	176.7	0	0	115.8	W23 L30 Y31 V39 T45 S46	W23-M43 HydrophobicContact CH2-SD 4.33Å; L30-M43 HydrophobicContact CB-CE 3.51Å; L30-M43 HydrophobicContact CD1-CE 3.22Å; L30-M43 HydrophobicContact CG-CE 3.93Å; Y31-M43 HydrophobicContact CE1-CE 4.39Å; Y31-M43 HydrophobicContact CE1-CG 4.46Å; Y31-M43 HydrophobicContact CE1-SD 3.76Å; V39-M43 WeakPolarHBondContact O-CG 3.03Å; V39-M43 PolarHBondContact O-N 3Å; M43-T45 PolarHBondContact O-N 2.97Å; M43-S46 WeakPolarHBondContact CA-OG 3.11Å; M43-S46 WeakPolarHBondContact O-CB 3.3Å; M43-S46 PolarHBondContact O-N 2.61Å
44	P	57.6	Low	64.5	Low	106 Å²	106	68.5 Å²	68.5	69%	0.688	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-63.4	-22.9	177.6	-22.4	34.2	0	0	0	113.8	E41 S42	E41-P44 WeakPolarHBondContact O-CD 3.14Å; S42-P44 VanDerWaalsContact C-CD 3.42Å
45	T	64.1	Low	65.7	Low	98 Å²	98	68.7 Å²	68.7	60%	0.601	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-101.7	-0.9	179.6	61.1	0	0	0	0	113	S42 M43	S42-T45 CarbonylContact O-C 3.53Å; S42-T45 WeakPolarHBondContact O-CA 2.88Å; S42-T45 PolarHBondContact O-N 2.77Å; S42-T45 PolarHBondContact O-OG1 3.34Å; M43-T45 PolarHBondContact O-N 2.97Å
46	S	68.5	Low	67	Low	7 Å²	7	60.8 Å²	60.8	5%	0.049	33%	0.328	C	S	.	.			trans	-72.4	137.7	179.8	-64.2	0	0	0	0	110.6	L15 S42 M43 G60	L15-S46 VanDerWaalsContact CD1-O 3.25Å; L15-S46 WeakPolarHBondContact CD1-O 3.35Å; S42-S46 PolarHBondContact O-N 2.86Å; S42-S46 VanDerWaalsContact O-N 3.12Å; S42-S46 PolarHBondContact O-OG 3.22Å; M43-S46 WeakPolarHBondContact CA-OG 3.11Å; M43-S46 WeakPolarHBondContact O-CB 3.3Å; M43-S46 PolarHBondContact O-N 2.61Å; S46-G60 WeakPolarHBondContact CA-O 3.32Å
47	L	82.3	Confident	68.3	Low	52 Å²	52	59 Å²	59	27%	0.272	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	136.4	164.2	-66.3	167.7	0	0	0	108.4	F59 G60 I89 S90 L92	L47-F59 CarbonylContact O-C 3.58Å; L47-F59 WeakPolarHBondContact O-CA 3.35Å; L47-G60 PolarHBondContact N-O 3.03Å; L47-G60 PolarHBondContact O-N 3.17Å; L47-I89 HydrophobicContact CD1-CB 4.39Å; L47-I89 HydrophobicContact CD1-CG2 3.76Å; L47-S90 VanDerWaalsContact CD1-C 3.49Å; L47-S90 WeakPolarHBondContact CD1-O 3.26Å; L47-L92 HydrophobicContact CB-CD2 3.29Å; L47-L92 HydrophobicContact CB-CG 4.24Å; L47-L92 HydrophobicContact CD1-CD2 4.15Å; L47-L92 HydrophobicContact CG-CD2 4.37Å
48	I	84.6	Confident	69.8	Low	41 Å²	41	51.7 Å²	51.7	21%	0.21	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	128.7	-178.4	-54.7	175.6	0	0	0	108.4	L15 W23 V50 A58 F59	L15-I48 HydrophobicContact CD2-CB 4.06Å; L15-I48 HydrophobicContact CD2-CG1 4.36Å; W23-I48 HydrophobicContact CH2-CD1 4.02Å; W23-I48 HydrophobicContact CZ2-CD1 3.99Å; I48-V50 HydrophobicContact CG2-CG2 3.99Å; I48-A58 WeakPolarHBondContact CA-O 3.48Å; I48-F59 HydrophobicContact CD1-CD1 4.49Å; I48-F59 HydrophobicContact CD1-CE1 4.22Å; I48-F59 HydrophobicContact CG1-CD1 3.94Å; I48-F59 HydrophobicContact CG1-CE1 4.01Å; I48-F59 HydrophobicContact CG2-CD1 4.46Å; I48-F59 HydrophobicContact CG2-CE1 3.97Å
49	A	85	Confident	71.2	Confident	7 Å²	7	48.8 Å²	48.8	6%	0.058	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	148.5	162.2	0	0	0	0	0	109.1	A58 L92 F94	A49-A58 HydrophobicContact CB-CB 4.37Å; A49-A58 PolarHBondContact N-O 2.77Å; A49-A58 PolarHBondContact O-N 3.48Å; A49-L92 HydrophobicContact CB-CD1 3.38Å; A49-L92 HydrophobicContact CB-CG 4.27Å; A49-F94 HydrophobicContact CB-CD2 3.93Å; A49-F94 HydrophobicContact CB-CE2 4.03Å
50	V	81.5	Confident	72.9	Confident	34 Å²	34	46.7 Å²	46.7	21%	0.206	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	134.6	-179.7	-169.6	0	0	0	0	107.3	V18 I48 F54 F57 F94	V18-V50 HydrophobicContact CG2-CG2 4.43Å; I48-V50 HydrophobicContact CG2-CG2 3.99Å; V50-F54 HydrophobicContact CG1-CB 4.28Å; V50-F54 HydrophobicContact CG1-CD1 3.57Å; V50-F54 HydrophobicContact CG1-CE1 4.16Å; V50-F54 HydrophobicContact CG1-CG 4.13Å; V50-F57 HydrophobicContact CB-CD1 4.34Å; V50-F57 HydrophobicContact CB-CE1 4.48Å; V50-F57 HydrophobicContact CG1-CD1 3.8Å; V50-F57 HydrophobicContact CG1-CE1 3.6Å; V50-F57 HydrophobicContact CG1-CG 4.5Å; V50-F57 HydrophobicContact CG1-CZ 4.16Å; V50-F57 HydrophobicContact CG2-CD1 3.7Å; V50-F57 HydrophobicContact CG2-CE1 4Å; V50-F94 VanDerWaalsContact C-CD2 3.43Å
51	D	78.4	Confident	74.3	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.011	25%	0.246	C	C	.	.			trans	-66.1	158	174.1	82.5	-63.9	0	0	0	110.1	M53 F54 S55 V56 F94 L111	D51-M53 PolarHBondContact O-N 3.34Å; D51-M53 WeakPolarHBondContact OD2-CB 3.36Å; D51-M53 PolarHBondContact OD2-N 2.83Å; D51-F54 PolarHBondContact O-N 2.96Å; D51-F54 WeakPolarHBondContact OD1-CA 3.38Å; D51-F54 PolarHBondContact OD1-N 3.35Å; D51-F54 VanDerWaalsContact OD1-N 3.14Å; D51-S55 PolarHBondContact OD1-N 3.36Å; D51-V56 HydrophobicContact CB-CB 4.29Å; D51-V56 PolarHBondContact N-O 2.89Å; D51-V56 PolarHBondContact OD1-N 3.28Å; D51-F94 HydrophobicContact CB-CD2 4.22Å; D51-F94 HydrophobicContact CB-CE2 4.39Å; D51-F94 HydrophobicContact CB-CG 4.44Å; D51-L111 HydrophobicContact CB-CD1 3.97Å
52	P	70	Confident	75.5	Confident	91 Å²	91	40.7 Å²	40.7	59%	0.591	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-22.8	-178.5	-28.8	36.4	0	0	0	115.4
53	M	69.1	Low	77.2	Confident	105 Å²	105	45.1 Å²	45.1	52%	0.517	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	5.9	177.8	-62.2	-62.1	115.9	0	0	114.6	D51 S55 Y108	D51-M53 PolarHBondContact O-N 3.34Å; D51-M53 WeakPolarHBondContact OD2-CB 3.36Å; D51-M53 PolarHBondContact OD2-N 2.83Å; M53-S55 PolarHBondContact O-N 2.83Å; M53-S55 VanDerWaalsContact O-N 3.1Å; M53-S55 PolarHBondContact O-OG 3.37Å; M53-Y108 HydrophobicContact CB-CE2 4.27Å; M53-Y108 HydrophobicContact CG-CE1 4.38Å; M53-Y108 HydrophobicContact CG-CE2 3.67Å; M53-Y108 WeakPolarHBondContact CG-OH 3.31Å
54	F	70.5	Confident	78.7	Confident	103 Å²	103	48.1 Å²	48.1	45%	0.452	27%	0.265	S	S	.	.	S	Bend	trans	54.6	31.5	-179.2	-55.3	-93.8	0	0	0	113.1	V50 D51 F57	V50-F54 HydrophobicContact CG1-CB 4.28Å; V50-F54 HydrophobicContact CG1-CD1 3.57Å; V50-F54 HydrophobicContact CG1-CE1 4.16Å; V50-F54 HydrophobicContact CG1-CG 4.13Å; D51-F54 PolarHBondContact O-N 2.96Å; D51-F54 WeakPolarHBondContact OD1-CA 3.38Å; D51-F54 PolarHBondContact OD1-N 3.35Å; D51-F54 VanDerWaalsContact OD1-N 3.14Å; F54-F57 HydrophobicContact CB-CZ 4.23Å; F54-F57 WeakPolarHBondContact O-CE2 3.39Å
55	S	74.6	Confident	80.1	Confident	38 Å²	38	43.1 Å²	43.1	27%	0.266	23%	0.232	S	C	.	.	S	Bend	trans	-100.2	-21.8	179.5	-65.1	0	0	0	0	112.3	D51 M53 R70	D51-S55 PolarHBondContact OD1-N 3.36Å; M53-S55 PolarHBondContact O-N 2.83Å; M53-S55 VanDerWaalsContact O-N 3.1Å; M53-S55 PolarHBondContact O-OG 3.37Å; S55-R70 WeakPolarHBondContact O-CB 3.2Å; S55-R70 PolarHBondContact O-N 2.87Å
56	V	79.5	Confident	81.2	Confident	6 Å²	6	39.8 Å²	39.8	4%	0.036	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	129.8	177.6	-170	0	0	0	0	108.9	D51 I67 V68 R69 F94 L111 V127	D51-V56 HydrophobicContact CB-CB 4.29Å; D51-V56 PolarHBondContact N-O 2.89Å; D51-V56 PolarHBondContact OD1-N 3.28Å; V56-I67 HydrophobicContact CG1-CG2 3.59Å; V56-V68 WeakPolarHBondContact CA-O 3.31Å; V56-R69 HydrophobicContact CG2-CG 4.3Å; V56-F94 HydrophobicContact CB-CE1 4.42Å; V56-F94 HydrophobicContact CB-CZ 4.04Å; V56-F94 HydrophobicContact CG1-CE1 3.92Å; V56-F94 HydrophobicContact CG1-CZ 3.59Å; V56-L111 HydrophobicContact CG2-CD1 4.07Å; V56-V127 HydrophobicContact CG1-CG1 3.66Å; V56-V127 HydrophobicContact CG2-CG1 4.26Å
57	F	83.4	Confident	81.9	Confident	3 Å²	3	39.5 Å²	39.5	1%	0.013	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	138.3	175.1	-58.1	-99.4	0	0	0	109	A22 V26 V50 F54 F59 I67 V68	A22-F57 HydrophobicContact CB-CE2 4.28Å; A22-F57 HydrophobicContact CB-CZ 3.83Å; V26-F57 HydrophobicContact CG2-CD2 4.05Å; V26-F57 HydrophobicContact CG2-CE2 4.25Å; V50-F57 HydrophobicContact CB-CD1 4.34Å; V50-F57 HydrophobicContact CB-CE1 4.48Å; V50-F57 HydrophobicContact CG1-CD1 3.8Å; V50-F57 HydrophobicContact CG1-CE1 3.6Å; V50-F57 HydrophobicContact CG1-CG 4.5Å; V50-F57 HydrophobicContact CG1-CZ 4.16Å; V50-F57 HydrophobicContact CG2-CD1 3.7Å; V50-F57 HydrophobicContact CG2-CE1 4Å; F54-F57 HydrophobicContact CB-CZ 4.23Å; F54-F57 WeakPolarHBondContact O-CE2 3.39Å; F57-F59 HydrophobicContact CB-CE2 3.57Å; F57-F59 HydrophobicContact CB-CZ 3.55Å; F57-F59 HydrophobicContact CG-CZ 4.37Å; F57-I67 CarbonylContact O-C 3.49Å; F57-I67 WeakPolarHBondContact O-CA 3.42Å; F57-V68 HydrophobicContact CB-CB 4.35Å; F57-V68 PolarHBondContact N-O 3.15Å; F57-V68 PolarHBondContact O-N 2.78Å
58	A	87.3	Confident	81.9	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	137.1	175.4	0	0	0	0	0	110.7	I48 A49 C66 I67 L92 F94 I113	I48-A58 WeakPolarHBondContact CA-O 3.48Å; A49-A58 HydrophobicContact CB-CB 4.37Å; A49-A58 PolarHBondContact N-O 2.77Å; A49-A58 PolarHBondContact O-N 3.48Å; A58-C66 CarbonylContact C-O 3.49Å; A58-C66 WeakPolarHBondContact CA-O 3.33Å; A58-I67 HydrophobicContact CB-CD1 3.31Å; A58-L92 HydrophobicContact CB-CD1 3.6Å; A58-F94 HydrophobicContact CB-CE2 4.07Å; A58-F94 HydrophobicContact CB-CZ 3.81Å; A58-I113 HydrophobicContact CB-CD1 3.15Å
59	F	86.5	Confident	81.6	Confident	12 Å²	12	39.7 Å²	39.7	5%	0.053	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	123.9	-179	-55.5	-79.1	0	0	0	109.1	W23 V26 L30 L47 I48 F57 M65 C66 V68	W23-F59 HydrophobicContact CE3-CE1 4.16Å; W23-F59 HydrophobicContact CE3-CZ 4.04Å; W23-F59 HydrophobicContact CH2-CD1 4.26Å; W23-F59 AromaticContact CH2-CE1 3.38Å; W23-F59 HydrophobicContact CH2-CE1 3.38Å; W23-F59 AromaticContact CH2-CZ 3.98Å; W23-F59 HydrophobicContact CH2-CZ 3.98Å; W23-F59 HydrophobicContact CZ3-CD1 4.31Å; W23-F59 AromaticContact CZ3-CE1 3.13Å; W23-F59 HydrophobicContact CZ3-CE1 3.13Å; W23-F59 HydrophobicContact CZ3-CE2 4.45Å; W23-F59 AromaticContact CZ3-CZ 3.23Å; W23-F59 HydrophobicContact CZ3-CZ 3.23Å; V26-F59 HydrophobicContact CG1-CE2 4.03Å; V26-F59 HydrophobicContact CG1-CZ 3.94Å; L30-F59 HydrophobicContact CD1-CE2 4.36Å; L47-F59 CarbonylContact O-C 3.58Å; L47-F59 WeakPolarHBondContact O-CA 3.35Å; I48-F59 HydrophobicContact CD1-CD1 4.49Å; I48-F59 HydrophobicContact CD1-CE1 4.22Å; I48-F59 HydrophobicContact CG1-CD1 3.94Å; I48-F59 HydrophobicContact CG1-CE1 4.01Å; I48-F59 HydrophobicContact CG2-CD1 4.46Å; I48-F59 HydrophobicContact CG2-CE1 3.97Å; F57-F59 HydrophobicContact CB-CE2 3.57Å; F57-F59 HydrophobicContact CB-CZ 3.55Å; F57-F59 HydrophobicContact CG-CZ 4.37Å; F59-M65 CarbonylContact O-C 3.55Å; F59-M65 VanDerWaalsContact O-CA 3.29Å; F59-M65 WeakPolarHBondContact O-CA 3.22Å; F59-C66 HydrophobicContact CB-CB 4.29Å; F59-C66 PolarHBondContact N-O 2.86Å; F59-C66 PolarHBondContact O-N 3.06Å; F59-V68 HydrophobicContact CD2-CG2 4.12Å; F59-V68 HydrophobicContact CE2-CB 4.21Å; F59-V68 HydrophobicContact CE2-CG2 3.67Å
60	G	86	Confident	80.8	Confident	2 Å²	2	45 Å²	45	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.2	170.5	0	0	0	0	0	110.7	S46 L47	S46-G60 WeakPolarHBondContact CA-O 3.32Å; L47-G60 PolarHBondContact N-O 3.03Å; L47-G60 PolarHBondContact O-N 3.17Å
61	F	83.3	Confident	79.9	Confident	95 Å²	95	47.2 Å²	47.2	42%	0.417	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	118.5	172.2	175.2	-107.7	0	0	0	111.2	K63 Q64	F61-K63 PolarHBondContact O-N 3.3Å; F61-K63 VanDerWaalsContact O-N 3.15Å; F61-Q64 PolarHBondContact N-O 2.81Å; F61-Q64 PolarHBondContact O-N 3.05Å
62	G	83.6	Confident	78.7	Confident	27 Å²	27	52.1 Å²	52.1	28%	0.278	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	-122.7	-174.4	0	0	0	0	0	110	N88 I89	G62-N88 CarbonylContact O-C 3.49Å; G62-N88 VanDerWaalsContact O-CA 3.26Å; G62-N88 WeakPolarHBondContact O-CA 3.36Å; G62-I89 PolarHBondContact O-N 2.82Å
63	K	89	Confident	77.8	Confident	103 Å²	103	53.8 Å²	53.8	45%	0.448	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	11.9	177.6	-52.8	-164	178.7	-166.2	0	114.4	F61 L85 E86 N88	F61-K63 PolarHBondContact O-N 3.3Å; F61-K63 VanDerWaalsContact O-N 3.15Å; K63-L85 PolarHBondContact O-N 3.48Å; K63-E86 PolarHBondContact NZ-O 3Å; K63-N88 VanDerWaalsContact CG-OD1 3.23Å; K63-N88 WeakPolarHBondContact CG-OD1 3.3Å
64	Q	86.9	Confident	76.6	Confident	79 Å²	79	56.6 Å²	56.6	37%	0.369	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.8	-176.6	-67.1	-64.5	-29.8	0	0	110.5	F61 S84 I89	F61-Q64 PolarHBondContact N-O 2.81Å; F61-Q64 PolarHBondContact O-N 3.05Å; Q64-S84 PolarHBondContact NE2-OG 3.24Å; Q64-S84 VanDerWaalsContact NE2-OG 3.15Å; Q64-I89 WeakPolarHBondContact O-CD1 3.29Å
65	M	88.1	Confident	75.7	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.2	167.7	-176.9	180	69.8	0	0	109.1	F59 I67 S82 Q83 L85 I89 I113 V115 Y125 L131	F59-M65 CarbonylContact O-C 3.55Å; F59-M65 VanDerWaalsContact O-CA 3.29Å; F59-M65 WeakPolarHBondContact O-CA 3.22Å; M65-I67 HydrophobicContact CG-CD1 4.35Å; M65-I67 HydrophobicContact SD-CD1 4.36Å; M65-S82 CarbonylContact O-C 3.53Å; M65-S82 VanDerWaalsContact O-CA 3.29Å; M65-S82 WeakPolarHBondContact O-CA 3.47Å; M65-Q83 HydrophobicContact CE-CB 4.21Å; M65-Q83 PolarHBondContact N-O 2.96Å; M65-Q83 PolarHBondContact O-N 2.83Å; M65-L85 HydrophobicContact CB-CD1 4.17Å; M65-I89 HydrophobicContact CB-CD1 3.99Å; M65-I113 HydrophobicContact CE-CG2 4.11Å; M65-I113 HydrophobicContact SD-CD1 3.99Å; M65-I113 HydrophobicContact SD-CG2 4Å; M65-V115 HydrophobicContact SD-CG2 3.49Å; M65-V115 WeakPolarHBondContact SD-CG2 3.12Å; M65-Y125 HydrophobicContact CE-CD2 3.79Å; M65-Y125 HydrophobicContact CE-CE2 4.27Å; M65-Y125 HydrophobicContact CE-CG 4.16Å; M65-L131 HydrophobicContact CE-CD1 4.04Å
66	C	86.4	Confident	74.9	Confident	28 Å²	28	63.4 Å²	63.4	19%	0.189	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	133.9	175.6	-58.5	0	0	0	0	110	A58 F59 F80 Y81	A58-C66 CarbonylContact C-O 3.49Å; A58-C66 WeakPolarHBondContact CA-O 3.33Å; F59-C66 HydrophobicContact CB-CB 4.29Å; F59-C66 PolarHBondContact N-O 2.86Å; F59-C66 PolarHBondContact O-N 3.06Å; C66-F80 HydrophobicContact CB-CE2 3.7Å; C66-F80 HydrophobicContact CB-CZ 3.71Å; C66-F80 VanDerWaalsContact SG-CZ 3.59Å; C66-Y81 CarbonylContact C-O 3.58Å; C66-Y81 VanDerWaalsContact CA-O 3.3Å; C66-Y81 WeakPolarHBondContact CA-O 3.46Å
67	I	84.7	Confident	74.3	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128.9	175	-57.4	-57.6	0	0	0	108.9	V56 F57 A58 M65 F80 Y81 I113 V127 L131	V56-I67 HydrophobicContact CG1-CG2 3.59Å; F57-I67 CarbonylContact O-C 3.49Å; F57-I67 WeakPolarHBondContact O-CA 3.42Å; A58-I67 HydrophobicContact CB-CD1 3.31Å; M65-I67 HydrophobicContact CG-CD1 4.35Å; M65-I67 HydrophobicContact SD-CD1 4.36Å; I67-F80 WeakPolarHBondContact O-CA 3.38Å; I67-Y81 PolarHBondContact N-O 3.13Å; I67-Y81 PolarHBondContact O-N 2.87Å; I67-I113 HydrophobicContact CD1-CD1 3.71Å; I67-I113 HydrophobicContact CD1-CG2 4.44Å; I67-V127 HydrophobicContact CG2-CG1 4.09Å; I67-L131 HydrophobicContact CB-CD2 4.3Å; I67-L131 HydrophobicContact CG1-CD1 4.12Å; I67-L131 HydrophobicContact CG1-CD2 3.67Å
68	V	81.5	Confident	73.7	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.012	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	112.8	175	-175.6	0	0	0	0	108.1	V26 L30 V56 F57 F59 P78 S79 F80	V26-V68 HydrophobicContact CG1-CB 4.27Å; V26-V68 HydrophobicContact CG1-CG1 4.07Å; V26-V68 HydrophobicContact CG1-CG2 4.02Å; V26-V68 HydrophobicContact CG2-CG1 3.85Å; L30-V68 HydrophobicContact CD1-CG2 4.44Å; V56-V68 WeakPolarHBondContact CA-O 3.31Å; F57-V68 HydrophobicContact CB-CB 4.35Å; F57-V68 PolarHBondContact N-O 3.15Å; F57-V68 PolarHBondContact O-N 2.78Å; F59-V68 HydrophobicContact CD2-CG2 4.12Å; F59-V68 HydrophobicContact CE2-CB 4.21Å; F59-V68 HydrophobicContact CE2-CG2 3.67Å; V68-P78 HydrophobicContact CG1-CB 3.7Å; V68-P78 HydrophobicContact CG1-CG 4.32Å; V68-S79 WeakPolarHBondContact CA-O 3.38Å; V68-F80 HydrophobicContact CG2-CD2 3.92Å; V68-F80 HydrophobicContact CG2-CE2 4.33Å
69	R	77.8	Confident	73.1	Confident	95 Å²	95	69.1 Å²	69.1	36%	0.358	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	123.5	175.5	-177.1	174.3	-178.4	175.2	2.2	109.6	V56 Q71 P78 S79	V56-R69 HydrophobicContact CG2-CG 4.3Å; R69-Q71 PolarHBondContact O-N 2.87Å; R69-P78 CarbonylContact O-C 3.55Å; R69-P78 VanDerWaalsContact O-CA 3.26Å; R69-P78 WeakPolarHBondContact O-CA 3.47Å; R69-P78 WeakPolarHBondContact O-CB 3.29Å; R69-S79 PolarHBondContact N-O 3.02Å; R69-S79 PolarHBondContact O-N 3Å
70	R	68.4	Low	72.7	Confident	118 Å²	118	72.7 Å²	72.7	45%	0.445	36%	0.364	S	S	.	.			trans	-67.3	103.8	164.2	-171.4	176.8	179.9	-166.8	-0.6	107.3	S55	S55-R70 WeakPolarHBondContact O-CB 3.2Å; S55-R70 PolarHBondContact O-N 2.87Å
71	Q	62.4	Low	72.5	Confident	82 Å²	82	74.9 Å²	74.9	38%	0.383	37%	0.373	S	S	.	.			trans	-63.3	149	162.6	-68	-170.1	-17.4	0	0	107.8	R69 S75 T77 S79	R69-Q71 PolarHBondContact O-N 2.87Å; Q71-S75 VanDerWaalsContact CB-CB 3.45Å; Q71-S75 WeakPolarHBondContact CB-OG 3.45Å; Q71-S75 PolarHBondContact OE1-OG 3.19Å; Q71-T77 PolarHBondContact OE1-O 3.15Å; Q71-S79 VanDerWaalsContact CD-OG 3.32Å; Q71-S79 WeakPolarHBondContact CG-OG 3.42Å; Q71-S79 PolarHBondContact NE2-OG 2.84Å
72	C	54.6	Low	72.6	Confident	104 Å²	104	73.8 Å²	73.8	70%	0.703	38%	0.376	S	S	*	.			trans	-24.8	155.3	-174.1	-69.3	0	0	0	0	116.2	L74 S75	C72-L74 CarbonylContact O-C 3.59Å; C72-L74 PolarHBondContact O-N 2.79Å; C72-S75 PolarHBondContact O-N 2.83Å
73	V	49.7	Very low	72.7	Confident	127 Å²	127	75.5 Å²	75.5	77%	0.77	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.2	-28	178.9	-177.8	0	0	0	0	114.6
74	L	43.9	Very low	72.8	Confident	164 Å²	164	73.9 Å²	73.9	86%	0.859	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-20.6	178.4	-59.7	174.4	0	0	0	115.9	C72	C72-L74 CarbonylContact O-C 3.59Å; C72-L74 PolarHBondContact O-N 2.79Å
75	S	52.8	Low	72.9	Confident	41 Å²	41	70.8 Å²	70.8	29%	0.287	37%	0.365	S	S	.	.			trans	-84.6	124.1	177	-176.6	0	0	0	0	110.1	Q71 C72 T77	Q71-S75 VanDerWaalsContact CB-CB 3.45Å; Q71-S75 WeakPolarHBondContact CB-OG 3.45Å; Q71-S75 PolarHBondContact OE1-OG 3.19Å; C72-S75 PolarHBondContact O-N 2.83Å; S75-T77 VanDerWaalsContact C-N 3.33Å; S75-T77 PolarHBondContact OG-O 3.01Å
76	R	57.2	Low	73.1	Confident	243 Å²	243	75 Å²	75	92%	0.917	38%	0.384	S	S	*	.			trans	-84.5	-9.3	178.8	-67.3	-174.3	178.4	-175.5	-0	113.2
77	T	66.3	Low	73.3	Confident	84 Å²	84	74 Å²	74	52%	0.515	38%	0.378	S	S	.	.	S	Bend	trans	-113.6	112.5	-174.4	48.6	0	0	0	0	109.7	Q71 S75	Q71-T77 PolarHBondContact OE1-O 3.15Å; S75-T77 VanDerWaalsContact C-N 3.33Å; S75-T77 PolarHBondContact OG-O 3.01Å
78	P	71.3	Confident	73.5	Confident	31 Å²	31	77.7 Å²	77.7	20%	0.201	40%	0.398	C	S	.	.			trans	-63.7	148.5	171.9	28.6	-33.3	0	0	0	110	F29 V68 R69	F29-P78 HydrophobicContact CB-CG 4.45Å; F29-P78 HydrophobicContact CD1-CG 3.8Å; F29-P78 HydrophobicContact CD2-CG 4.12Å; F29-P78 HydrophobicContact CE1-CG 4Å; F29-P78 HydrophobicContact CE2-CG 4.31Å; F29-P78 HydrophobicContact CG-CG 3.85Å; F29-P78 HydrophobicContact CZ-CG 4.24Å; V68-P78 HydrophobicContact CG1-CB 3.7Å; V68-P78 HydrophobicContact CG1-CG 4.32Å; R69-P78 CarbonylContact O-C 3.55Å; R69-P78 VanDerWaalsContact O-CA 3.26Å; R69-P78 WeakPolarHBondContact O-CA 3.47Å; R69-P78 WeakPolarHBondContact O-CB 3.29Å
79	S	74.1	Confident	73.9	Confident	14 Å²	14	78.3 Å²	78.3	10%	0.098	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	134.9	166.3	-54.4	0	0	0	0	109.4	V68 R69 Q71 Y81	V68-S79 WeakPolarHBondContact CA-O 3.38Å; R69-S79 PolarHBondContact N-O 3.02Å; R69-S79 PolarHBondContact O-N 3Å; Q71-S79 VanDerWaalsContact CD-OG 3.32Å; Q71-S79 WeakPolarHBondContact CG-OG 3.42Å; Q71-S79 PolarHBondContact NE2-OG 2.84Å; S79-Y81 WeakPolarHBondContact CB-OH 3.5Å
80	F	78.1	Confident	74.5	Confident	86 Å²	86	75.2 Å²	75.2	38%	0.377	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	129.2	177.7	-177.4	-92.2	0	0	0	109.8	L30 C66 I67 V68	L30-F80 HydrophobicContact CD2-CD2 4Å; L30-F80 HydrophobicContact CD2-CE2 3.61Å; C66-F80 HydrophobicContact CB-CE2 3.7Å; C66-F80 HydrophobicContact CB-CZ 3.71Å; C66-F80 VanDerWaalsContact SG-CZ 3.59Å; I67-F80 WeakPolarHBondContact O-CA 3.38Å; V68-F80 HydrophobicContact CG2-CD2 3.92Å; V68-F80 HydrophobicContact CG2-CE2 4.33Å
81	Y	82.5	Confident	75.5	Confident	49 Å²	49	70.1 Å²	70.1	19%	0.192	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140.6	173.1	-52.9	-78.9	0	0	0	108.8	C66 I67 S79 L129	C66-Y81 CarbonylContact C-O 3.58Å; C66-Y81 VanDerWaalsContact CA-O 3.3Å; C66-Y81 WeakPolarHBondContact CA-O 3.46Å; I67-Y81 PolarHBondContact N-O 3.13Å; I67-Y81 PolarHBondContact O-N 2.87Å; S79-Y81 WeakPolarHBondContact CB-OH 3.5Å; Y81-L129 HydrophobicContact CE1-CD2 4.14Å; Y81-L129 WeakPolarHBondContact OH-CD2 3.39Å
82	S	84.8	Confident	76.9	Confident	71 Å²	71	67.1 Å²	67.1	50%	0.497	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	141.5	176.6	58.8	0	0	0	0	110.6	M65	M65-S82 CarbonylContact O-C 3.53Å; M65-S82 VanDerWaalsContact O-CA 3.29Å; M65-S82 WeakPolarHBondContact O-CA 3.47Å
83	Q	86.9	Confident	78.6	Confident	64 Å²	64	65 Å²	65	30%	0.299	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	126.5	177.3	-178.5	59.6	39.2	0	0	109.7	M65 L85 Y125 L131	M65-Q83 HydrophobicContact CE-CB 4.21Å; M65-Q83 PolarHBondContact N-O 2.96Å; M65-Q83 PolarHBondContact O-N 2.83Å; Q83-L85 HydrophobicContact CG-CD2 4.02Å; Q83-Y125 HydrophobicContact CG-CE1 4.28Å; Q83-L131 HydrophobicContact CB-CD1 3.96Å
84	S	89.6	Confident	80.4	Confident	69 Å²	69	59.6 Å²	59.6	48%	0.483	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	136.8	168.3	-167.1	0	0	0	0	109.7	Q64	Q64-S84 PolarHBondContact NE2-OG 3.24Å; Q64-S84 VanDerWaalsContact NE2-OG 3.15Å
85	L	90.9	Very high	82.1	Confident	13 Å²	13	52.8 Å²	52.8	7%	0.068	28%	0.275	C	S	.	.			trans	-113.2	163	-178.8	-56.5	171.4	0	0	0	109.9	K63 M65 Q83 I89 V115 L117 L123 Y125	K63-L85 PolarHBondContact O-N 3.48Å; M65-L85 HydrophobicContact CB-CD1 4.17Å; Q83-L85 HydrophobicContact CG-CD2 4.02Å; L85-I89 HydrophobicContact CD1-CD1 3.62Å; L85-I89 HydrophobicContact CD1-CG1 3.41Å; L85-I89 VanDerWaalsContact CD1-CG1 3.41Å; L85-V115 HydrophobicContact CD1-CG1 4Å; L85-L117 HydrophobicContact CB-CD2 4.5Å; L85-L117 HydrophobicContact CD1-CD2 3.96Å; L85-L123 HydrophobicContact CD2-CD1 3.95Å; L85-Y125 HydrophobicContact CD2-CE2 3.88Å; L85-Y125 VanDerWaalsContact CD2-OH 3.25Å; L85-Y125 WeakPolarHBondContact CD2-OH 3.37Å
86	E	90.9	Very high	82.9	Confident	89 Å²	89	54.1 Å²	54.1	42%	0.416	28%	0.283	S	S	.	.	S	Bend	trans	-77.1	-24.4	-178	64.1	-131.9	177.2	0	0	113.8	K63 L117 R121	K63-E86 PolarHBondContact NZ-O 3Å; E86-L117 HydrophobicContact CG-CD1 3.97Å; E86-R121 WeakPolarHBondContact OE1-CD 3.41Å; E86-R121 IonicContact OE1-CZ 3.07Å; E86-R121 IonicContact OE1-NE 3.12Å; E86-R121 PolarHBondContact OE1-NE 2.81Å; E86-R121 VanDerWaalsContact OE1-NE 3.12Å; E86-R121 IonicContact OE1-NH1 2.75Å; E86-R121 PolarHBondContact OE1-NH1 2.79Å; E86-R121 IonicContact OE2-CZ 3.69Å; E86-R121 IonicContact OE2-NH1 2.73Å; E86-R121 PolarHBondContact OE2-NH1 2.79Å
87	A	90.1	Very high	83.2	Confident	8 Å²	8	46.1 Å²	46.1	7%	0.066	26%	0.258	C	S	.	.	S	Bend	trans	-139.6	169.4	-177.8	0	0	0	0	0	111	L117 V118 N119	A87-L117 HydrophobicContact CB-CB 4.22Å; A87-L117 HydrophobicContact CB-CD1 4.14Å; A87-V118 HydrophobicContact CB-CG2 4.16Å; A87-N119 HydrophobicContact CB-CB 3.94Å; A87-N119 VanDerWaalsContact CB-CG 3.48Å
88	N	88.8	Confident	82.5	Confident	77 Å²	77	48.4 Å²	48.4	41%	0.412	26%	0.264	S	S	.	.			trans	-67.7	140	179.5	-66.8	-16	0	0	0	110.4	G62 K63 L117 V118	G62-N88 CarbonylContact O-C 3.49Å; G62-N88 VanDerWaalsContact O-CA 3.26Å; G62-N88 WeakPolarHBondContact O-CA 3.36Å; K63-N88 VanDerWaalsContact CG-OD1 3.23Å; K63-N88 WeakPolarHBondContact CG-OD1 3.3Å; N88-L117 WeakPolarHBondContact O-CA 3.38Å; N88-V118 HydrophobicContact CB-CG1 4.08Å; N88-V118 HydrophobicContact CB-CG2 3.87Å; N88-V118 PolarHBondContact O-N 2.79Å
89	I	90.5	Very high	81.3	Confident	15 Å²	15	50.7 Å²	50.7	8%	0.077	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	131.4	173.2	-55.8	163.7	0	0	0	108.2	L47 G62 Q64 M65 L85 L92 V115 L117	L47-I89 HydrophobicContact CD1-CB 4.39Å; L47-I89 HydrophobicContact CD1-CG2 3.76Å; G62-I89 PolarHBondContact O-N 2.82Å; Q64-I89 WeakPolarHBondContact O-CD1 3.29Å; M65-I89 HydrophobicContact CB-CD1 3.99Å; L85-I89 HydrophobicContact CD1-CD1 3.62Å; L85-I89 HydrophobicContact CD1-CG1 3.41Å; L85-I89 VanDerWaalsContact CD1-CG1 3.41Å; I89-L92 HydrophobicContact CG2-CD2 3.95Å; I89-V115 HydrophobicContact CG1-CG1 4.07Å; I89-V115 HydrophobicContact CG2-CG1 3.88Å; I89-L117 HydrophobicContact CG1-CD2 4.13Å
90	S	90.2	Very high	79.9	Confident	31 Å²	31	58 Å²	58	22%	0.217	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-30.4	176.3	43	0	0	0	0	112.7	L47 G116 L117 I144	L47-S90 VanDerWaalsContact CD1-C 3.49Å; L47-S90 WeakPolarHBondContact CD1-O 3.26Å; S90-G116 PolarHBondContact N-O 2.92Å; S90-G116 PolarHBondContact OG-O 2.7Å; S90-L117 VanDerWaalsContact OG-C 3.24Å; S90-L117 PolarHBondContact OG-N 3.23Å; S90-I144 WeakPolarHBondContact CB-O 3.25Å; S90-I144 PolarHBondContact OG-O 3.39Å
91	C	90.3	Very high	78.1	Confident	10 Å²	10	63.6 Å²	63.6	7%	0.068	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	156.2	174	59.5	0	0	0	0	110.5	G116	C91-G116 PolarHBondContact N-O 3.01Å; C91-G116 PolarHBondContact O-N 2.68Å
92	L	91.5	Very high	75.9	Confident	19 Å²	19	73.1 Å²	73.1	10%	0.099	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	144.8	171.8	61.9	121.3	0	0	0	110.8	L47 A49 A58 I89 I113 C114	L47-L92 HydrophobicContact CB-CD2 3.29Å; L47-L92 HydrophobicContact CB-CG 4.24Å; L47-L92 HydrophobicContact CD1-CD2 4.15Å; L47-L92 HydrophobicContact CG-CD2 4.37Å; A49-L92 HydrophobicContact CB-CD1 3.38Å; A49-L92 HydrophobicContact CB-CG 4.27Å; A58-L92 HydrophobicContact CB-CD1 3.6Å; I89-L92 HydrophobicContact CG2-CD2 3.95Å; L92-I113 HydrophobicContact CB-CD1 4.48Å; L92-I113 HydrophobicContact CD1-CD1 3.92Å; L92-C114 CarbonylContact C-O 3.56Å; L92-C114 WeakPolarHBondContact CA-O 3.02Å
93	D	90	Very high	73.3	Confident	61 Å²	61	74.6 Å²	74.6	33%	0.326	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	155.4	177.5	-159.5	3.7	0	0	0	111.1	C114 I149	D93-C114 PolarHBondContact N-O 2.87Å; D93-C114 WeakPolarHBondContact O-CB 3.34Å; D93-C114 PolarHBondContact O-N 2.85Å; D93-I149 HydrophobicContact CB-CD1 4.08Å
94	F	87.1	Confident	70.9	Confident	12 Å²	12	78.4 Å²	78.4	5%	0.053	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	128	176.7	-78.3	-72.8	0	0	0	111.1	A49 V50 D51 V56 A58 P96 I113 V127 I149	A49-F94 HydrophobicContact CB-CD2 3.93Å; A49-F94 HydrophobicContact CB-CE2 4.03Å; V50-F94 VanDerWaalsContact C-CD2 3.43Å; D51-F94 HydrophobicContact CB-CD2 4.22Å; D51-F94 HydrophobicContact CB-CE2 4.39Å; D51-F94 HydrophobicContact CB-CG 4.44Å; V56-F94 HydrophobicContact CB-CE1 4.42Å; V56-F94 HydrophobicContact CB-CZ 4.04Å; V56-F94 HydrophobicContact CG1-CE1 3.92Å; V56-F94 HydrophobicContact CG1-CZ 3.59Å; A58-F94 HydrophobicContact CB-CE2 4.07Å; A58-F94 HydrophobicContact CB-CZ 3.81Å; F94-P96 WeakPolarHBondContact O-CD 3.49Å; F94-I113 HydrophobicContact CD1-CB 4.2Å; F94-I113 HydrophobicContact CE1-CB 4.16Å; F94-I113 HydrophobicContact CE1-CD1 4.33Å; F94-I113 HydrophobicContact CZ-CD1 4.42Å; F94-V127 HydrophobicContact CD1-CG2 4.24Å; F94-V127 HydrophobicContact CE1-CG2 3.73Å; F94-I149 WeakPolarHBondContact O-CD1 3.5Å
95	L	81	Confident	68.5	Low	22 Å²	22	84 Å²	84	12%	0.115	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	116.8	170.8	-172.9	67.3	0	0	0	109.1	I97 A112 V124 I149 L154 L168	L95-I97 PolarHBondContact O-N 2.91Å; L95-A112 HydrophobicContact CB-CB 4.14Å; L95-A112 HydrophobicContact CD2-CB 4.31Å; L95-A112 PolarHBondContact N-O 3.06Å; L95-V124 HydrophobicContact CD2-CG1 4.49Å; L95-I149 HydrophobicContact CB-CD1 4.47Å; L95-I149 HydrophobicContact CD1-CD1 4.2Å; L95-I149 HydrophobicContact CD1-CG2 3.74Å; L95-L154 HydrophobicContact CD1-CD1 4.17Å; L95-L168 HydrophobicContact CD1-CD1 3.98Å; L95-L168 HydrophobicContact CD2-CD1 4.04Å; L95-L168 HydrophobicContact CD2-CD2 4.33Å
96	P	68.2	Low	66	Low	69 Å²	69	90.8 Å²	90.8	45%	0.448	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-70.3	116.7	173	28.9	-27	0	0	0	107.9	F94 M98 I149	F94-P96 WeakPolarHBondContact O-CD 3.49Å; P96-M98 PolarHBondContact O-N 3.15Å; P96-I149 VanDerWaalsContact CD-CG2 3.45Å; P96-I149 HydrophobicContact CG-CG2 4.07Å
97	I	63.3	Low	63.6	Low	75 Å²	75	90.8 Å²	90.8	39%	0.385	47%	0.469	S	S	.	.			trans	-81.9	101.3	169.6	-60.9	-166.3	0	0	0	106.4	L95 S99 W110 A112	L95-I97 PolarHBondContact O-N 2.91Å; I97-S99 VanDerWaalsContact C-N 3.25Å; I97-S99 PolarHBondContact O-N 2.78Å; I97-W110 WeakPolarHBondContact CB-O 3.41Å; I97-W110 HydrophobicContact CD1-CB 3.33Å; I97-W110 WeakPolarHBondContact CD1-O 3.46Å; I97-W110 HydrophobicContact CG1-CB 4.39Å; I97-W110 WeakPolarHBondContact CG1-O 3.44Å; I97-W110 HydrophobicContact CG2-CB 4.48Å; I97-A112 HydrophobicContact CD1-CB 4.24Å
98	M	51.9	Low	61.6	Low	132 Å²	132	95.9 Å²	95.9	65%	0.65	49%	0.488	S	S	*	.			trans	-69.9	90.3	166.7	-62.4	-158.3	-52.7	0	0	107.2	P96 D100 S151	P96-M98 PolarHBondContact O-N 3.15Å; M98-D100 PolarHBondContact O-N 2.93Å; M98-S151 WeakPolarHBondContact CE-O 3.35Å
99	S	47.2	Very low	59.9	Low	78 Å²	78	96.7 Å²	96.7	55%	0.545	49%	0.492	S	S	.	.			trans	-68.2	119.6	166.9	72.2	0	0	0	0	107.1	I97 R101	I97-S99 VanDerWaalsContact C-N 3.25Å; I97-S99 PolarHBondContact O-N 2.78Å; S99-R101 PolarHBondContact O-N 2.77Å
100	D	44.7	Very low	58.2	Low	168 Å²	168	102.9 Å²	102.9	90%	0.898	51%	0.514	S	S	*	.			trans	-69.7	17.6	176.8	-142.9	-0.4	0	0	0	112.1	M98	M98-D100 PolarHBondContact O-N 2.93Å
101	R	39.9	Very low	57.4	Low	203 Å²	203	102 Å²	102	77%	0.766	51%	0.507	S	S	*	.			trans	-100.6	97.7	-176.5	-70.9	-169.8	176.8	-175	0.7	109.7	S99 C103	S99-R101 PolarHBondContact O-N 2.77Å; R101-C103 PolarHBondContact O-N 2.73Å
102	R	36.8	Very low	57.2	Low	249 Å²	249	101.6 Å²	101.6	94%	0.94	51%	0.505	S	S	*	.			trans	-58.7	22.6	166	-73.7	-173	174.7	-174.8	-0.8	115.5
103	C	30.4	Very low	57.1	Low	103 Å²	103	100.7 Å²	100.7	70%	0.696	50%	0.5	S	S	*	.	S	Bend	trans	-139.9	113.1	-173.4	-64.7	0	0	0	0	110.7	R101	R101-C103 PolarHBondContact O-N 2.73Å
104	N	35.3	Very low	57.2	Low	143 Å²	143	97.8 Å²	97.8	77%	0.765	48%	0.484	S	S	*	.			trans	78.9	106.5	174.6	-63.1	-12.3	0	0	0	116.9	E106	N104-E106 PolarHBondContact O-N 2.75Å
105	L	39.2	Very low	57.5	Low	187 Å²	187	97.2 Å²	97.2	98%	0.979	48%	0.482	S	S	*	.			trans	-64.1	11.6	169.6	-110.8	105.3	0	0	0	114.4
106	E	37.9	Very low	58.1	Low	155 Å²	155	96.2 Å²	96.2	72%	0.724	48%	0.476	S	S	*	.			trans	-105.8	108.1	-170.3	-64.2	-170.8	167.3	0	0	108.9	N104	N104-E106 PolarHBondContact O-N 2.75Å
107	S	40.5	Very low	59.3	Low	89 Å²	89	92.9 Å²	92.9	62%	0.622	46%	0.455	S	S	*	.			trans	92	113.5	-178.6	-33.7	0	0	0	0	113.3	D109	S107-D109 WeakPolarHBondContact CB-OD1 3.47Å; S107-D109 PolarHBondContact O-N 3.12Å
108	Y	50	Low	60.6	Low	116 Å²	116	92.5 Å²	92.5	46%	0.455	46%	0.456	S	S	.	.			trans	-56.8	90.2	155.9	-82.2	-88.2	0	0	0	107.1	M53 W110 L111	M53-Y108 HydrophobicContact CB-CE2 4.27Å; M53-Y108 HydrophobicContact CG-CE1 4.38Å; M53-Y108 HydrophobicContact CG-CE2 3.67Å; M53-Y108 WeakPolarHBondContact CG-OH 3.31Å; Y108-W110 PolarHBondContact O-N 2.85Å; Y108-W110 VanDerWaalsContact O-N 3.15Å; Y108-L111 HydrophobicContact CD1-CD1 3.71Å; Y108-L111 HydrophobicContact CD1-CD2 4.1Å; Y108-L111 HydrophobicContact CD1-CG 3.84Å; Y108-L111 HydrophobicContact CE1-CD1 4.49Å; Y108-L111 HydrophobicContact CG-CD1 3.96Å; Y108-L111 HydrophobicContact CG-CG 4.35Å
109	D	51.5	Low	62.4	Low	93 Å²	93	89.5 Å²	89.5	50%	0.497	44%	0.443	S	S	.	.			trans	-66.9	-27.3	-161.8	-110.9	-5.5	0	0	0	111	S107	S107-D109 WeakPolarHBondContact CB-OD1 3.47Å; S107-D109 PolarHBondContact O-N 3.12Å
110	W	54.8	Low	64.4	Low	145 Å²	145	85.8 Å²	85.8	55%	0.549	42%	0.417	S	S	.	.			trans	-153.5	114.7	170.3	-51.3	81.3	0	0	0	106.6	I97 Y108 D128	I97-W110 WeakPolarHBondContact CB-O 3.41Å; I97-W110 HydrophobicContact CD1-CB 3.33Å; I97-W110 WeakPolarHBondContact CD1-O 3.46Å; I97-W110 HydrophobicContact CG1-CB 4.39Å; I97-W110 WeakPolarHBondContact CG1-O 3.44Å; I97-W110 HydrophobicContact CG2-CB 4.48Å; Y108-W110 PolarHBondContact O-N 2.85Å; Y108-W110 VanDerWaalsContact O-N 3.15Å; W110-D128 WeakPolarHBondContact CZ3-OD2 3.43Å
111	L	74.9	Confident	66.7	Low	14 Å²	14	80.5 Å²	80.5	7%	0.073	38%	0.384	C	S	.	.			trans	-99.5	133.3	161.2	-82	163.9	0	0	0	105.5	D51 V56 Y108 V127	D51-L111 HydrophobicContact CB-CD1 3.97Å; V56-L111 HydrophobicContact CG2-CD1 4.07Å; Y108-L111 HydrophobicContact CD1-CD1 3.71Å; Y108-L111 HydrophobicContact CD1-CD2 4.1Å; Y108-L111 HydrophobicContact CD1-CG 3.84Å; Y108-L111 HydrophobicContact CE1-CD1 4.49Å; Y108-L111 HydrophobicContact CG-CD1 3.96Å; Y108-L111 HydrophobicContact CG-CG 4.35Å; L111-V127 HydrophobicContact CB-CB 4.19Å; L111-V127 HydrophobicContact CB-CG2 4.13Å; L111-V127 WeakPolarHBondContact O-CB 3.09Å; L111-V127 WeakPolarHBondContact O-CG2 3.06Å; L111-V127 PolarHBondContact O-N 2.81Å
112	A	85.6	Confident	69.2	Low	1 Å²	1	70.8 Å²	70.8	1%	0.008	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	150.5	172.6	0	0	0	0	0	109.2	L95 I97 V124 Y125 L134	L95-A112 HydrophobicContact CB-CB 4.14Å; L95-A112 HydrophobicContact CD2-CB 4.31Å; L95-A112 PolarHBondContact N-O 3.06Å; I97-A112 HydrophobicContact CD1-CB 4.24Å; A112-V124 HydrophobicContact CB-CG1 3.79Å; A112-Y125 CarbonylContact C-O 3.54Å; A112-Y125 WeakPolarHBondContact CA-O 3.37Å; A112-Y125 WeakPolarHBondContact CB-O 3.42Å; A112-L134 HydrophobicContact CB-CD1 4.14Å
113	I	89.5	Confident	71.9	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	127.5	174.5	-172.4	166.8	0	0	0	110	A58 M65 I67 L92 F94 V115 V124 Y125 V127	A58-I113 HydrophobicContact CB-CD1 3.15Å; M65-I113 HydrophobicContact CE-CG2 4.11Å; M65-I113 HydrophobicContact SD-CD1 3.99Å; M65-I113 HydrophobicContact SD-CG2 4Å; I67-I113 HydrophobicContact CD1-CD1 3.71Å; I67-I113 HydrophobicContact CD1-CG2 4.44Å; L92-I113 HydrophobicContact CB-CD1 4.48Å; L92-I113 HydrophobicContact CD1-CD1 3.92Å; F94-I113 HydrophobicContact CD1-CB 4.2Å; F94-I113 HydrophobicContact CE1-CB 4.16Å; F94-I113 HydrophobicContact CE1-CD1 4.33Å; F94-I113 HydrophobicContact CZ-CD1 4.42Å; I113-V115 HydrophobicContact CG1-CG2 4.36Å; I113-V124 CarbonylContact O-C 3.59Å; I113-V124 WeakPolarHBondContact O-CA 3.43Å; I113-Y125 PolarHBondContact N-O 2.72Å; I113-Y125 PolarHBondContact O-N 2.79Å; I113-V127 HydrophobicContact CB-CG2 4.29Å; I113-V127 HydrophobicContact CG2-CG2 4.35Å
114	C	91.6	Very high	74.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	134	173.4	-65.3	0	0	0	0	109.2	L92 D93 F122 L123 I147	L92-C114 CarbonylContact C-O 3.56Å; L92-C114 WeakPolarHBondContact CA-O 3.02Å; D93-C114 PolarHBondContact N-O 2.87Å; D93-C114 WeakPolarHBondContact O-CB 3.34Å; D93-C114 PolarHBondContact O-N 2.85Å; C114-F122 HydrophobicContact CB-CE2 3.76Å; C114-F122 HydrophobicContact CB-CZ 3.89Å; C114-L123 CarbonylContact C-O 3.59Å; C114-L123 WeakPolarHBondContact CA-O 3.49Å; C114-I147 HydrophobicContact CB-CD1 3.85Å; C114-I147 HydrophobicContact CB-CG2 4.26Å
115	V	93.8	Very high	77.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	120.7	-177.4	-171.1	0	0	0	0	108.7	M65 L85 I89 I113 L117 F122 L123 Y125	M65-V115 HydrophobicContact SD-CG2 3.49Å; M65-V115 WeakPolarHBondContact SD-CG2 3.12Å; L85-V115 HydrophobicContact CD1-CG1 4Å; I89-V115 HydrophobicContact CG1-CG1 4.07Å; I89-V115 HydrophobicContact CG2-CG1 3.88Å; I113-V115 HydrophobicContact CG1-CG2 4.36Å; V115-L117 HydrophobicContact CG1-CD2 3.91Å; V115-F122 WeakPolarHBondContact O-CA 3.32Å; V115-L123 HydrophobicContact CB-CB 4.35Å; V115-L123 PolarHBondContact N-O 3.21Å; V115-L123 PolarHBondContact O-N 2.83Å; V115-Y125 HydrophobicContact CG2-CD2 4.14Å; V115-Y125 HydrophobicContact CG2-CE2 4.46Å
116	G	93.2	Very high	79.6	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	137.2	169.8	0	0	0	0	0	110.6	S90 C91	S90-G116 PolarHBondContact N-O 2.92Å; S90-G116 PolarHBondContact OG-O 2.7Å; C91-G116 PolarHBondContact N-O 3.01Å; C91-G116 PolarHBondContact O-N 2.68Å
117	L	93.5	Very high	81.6	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	152.9	177.9	-56.6	-169.5	0	0	0	111.9	L85 E86 A87 N88 I89 S90 V115 N119 G120 R121 L123 I144	L85-L117 HydrophobicContact CB-CD2 4.5Å; L85-L117 HydrophobicContact CD1-CD2 3.96Å; E86-L117 HydrophobicContact CG-CD1 3.97Å; A87-L117 HydrophobicContact CB-CB 4.22Å; A87-L117 HydrophobicContact CB-CD1 4.14Å; N88-L117 WeakPolarHBondContact O-CA 3.38Å; I89-L117 HydrophobicContact CG1-CD2 4.13Å; S90-L117 VanDerWaalsContact OG-C 3.24Å; S90-L117 PolarHBondContact OG-N 3.23Å; V115-L117 HydrophobicContact CG1-CD2 3.91Å; L117-N119 WeakPolarHBondContact CB-OD1 3.39Å; L117-N119 PolarHBondContact O-N 3.1Å; L117-G120 PolarHBondContact O-N 2.69Å; L117-G120 VanDerWaalsContact O-N 3.08Å; L117-R121 HydrophobicContact CB-CB 4.35Å; L117-R121 WeakPolarHBondContact CB-O 3.44Å; L117-R121 HydrophobicContact CD1-CB 4.09Å; L117-R121 HydrophobicContact CG-CB 4.4Å; L117-R121 PolarHBondContact N-O 2.98Å; L117-L123 HydrophobicContact CD1-CD1 3.86Å; L117-L123 HydrophobicContact CG-CD1 4.34Å; L117-I144 PolarHBondContact O-N 3.14Å; L117-I144 VanDerWaalsContact O-N 3.15Å
118	V	90.5	Very high	83.3	Confident	67 Å²	67	30.1 Å²	30.1	41%	0.406	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.2	178.8	-63.7	0	0	0	0	114.1	A87 N88 G120 P143	A87-V118 HydrophobicContact CB-CG2 4.16Å; N88-V118 HydrophobicContact CB-CG1 4.08Å; N88-V118 HydrophobicContact CB-CG2 3.87Å; N88-V118 PolarHBondContact O-N 2.79Å; V118-G120 VanDerWaalsContact C-N 3.3Å; V118-P143 HydrophobicContact CB-CB 4.5Å; V118-P143 WeakPolarHBondContact O-CA 3.06Å
119	N	90	Very high	84.2	Confident	69 Å²	69	30.5 Å²	30.5	37%	0.369	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	6.4	177.6	69.4	-16.2	0	0	0	113.1	A87 L117 R121	A87-N119 HydrophobicContact CB-CB 3.94Å; A87-N119 VanDerWaalsContact CB-CG 3.48Å; L117-N119 WeakPolarHBondContact CB-OD1 3.39Å; L117-N119 PolarHBondContact O-N 3.1Å; N119-R121 PolarHBondContact OD1-N 2.96Å
120	G	89.5	Confident	85.2	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	85	13.2	179.3	0	0	0	0	0	114.3	L117 V118 F139 G142	L117-G120 PolarHBondContact O-N 2.69Å; L117-G120 VanDerWaalsContact O-N 3.08Å; V118-G120 VanDerWaalsContact C-N 3.3Å; G120-F139 VanDerWaalsContact O-CD2 3.31Å; G120-F139 WeakPolarHBondContact O-CD2 3.43Å; G120-F139 PolarHBondContact O-N 3.33Å; G120-G142 WeakPolarHBondContact CA-O 3.4Å; G120-G142 PolarHBondContact N-O 3.04Å
121	R	92.6	Very high	86.6	Confident	56 Å²	56	28.2 Å²	28.2	21%	0.211	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	136.2	169.9	-72.8	-161.6	55.1	-166.5	5.7	111.8	E86 L117 N119 S136 V137	E86-R121 WeakPolarHBondContact OE1-CD 3.41Å; E86-R121 IonicContact OE1-CZ 3.07Å; E86-R121 IonicContact OE1-NE 3.12Å; E86-R121 PolarHBondContact OE1-NE 2.81Å; E86-R121 VanDerWaalsContact OE1-NE 3.12Å; E86-R121 IonicContact OE1-NH1 2.75Å; E86-R121 PolarHBondContact OE1-NH1 2.79Å; E86-R121 IonicContact OE2-CZ 3.69Å; E86-R121 IonicContact OE2-NH1 2.73Å; E86-R121 PolarHBondContact OE2-NH1 2.79Å; L117-R121 HydrophobicContact CB-CB 4.35Å; L117-R121 WeakPolarHBondContact CB-O 3.44Å; L117-R121 HydrophobicContact CD1-CB 4.09Å; L117-R121 HydrophobicContact CG-CB 4.4Å; L117-R121 PolarHBondContact N-O 2.98Å; N119-R121 PolarHBondContact OD1-N 2.96Å; R121-S136 PolarHBondContact NH2-OG 2.84Å; R121-V137 WeakPolarHBondContact CA-O 3.47Å
122	F	92	Very high	87.1	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.6	172.5	174.1	-107.6	0	0	0	108.5	C114 V115 V124 L135 S136 V137 F139 I144 I147 L154 L156 I165	C114-F122 HydrophobicContact CB-CE2 3.76Å; C114-F122 HydrophobicContact CB-CZ 3.89Å; V115-F122 WeakPolarHBondContact O-CA 3.32Å; F122-V124 HydrophobicContact CD1-CG2 4.46Å; F122-V124 HydrophobicContact CE1-CG2 3.52Å; F122-V124 HydrophobicContact CZ-CG2 3.61Å; F122-L135 HydrophobicContact CE1-CD2 4.14Å; F122-S136 CarbonylContact O-C 3.57Å; F122-S136 WeakPolarHBondContact O-CA 3.39Å; F122-V137 HydrophobicContact CB-CB 4.36Å; F122-V137 HydrophobicContact CD1-CB 4.46Å; F122-V137 HydrophobicContact CD1-CG2 4.39Å; F122-V137 PolarHBondContact N-O 3.23Å; F122-V137 PolarHBondContact O-N 2.9Å; F122-F139 HydrophobicContact CB-CE2 4.37Å; F122-I144 HydrophobicContact CB-CD1 4.39Å; F122-I144 HydrophobicContact CB-CG1 4.31Å; F122-I147 HydrophobicContact CD2-CD1 4.4Å; F122-I147 HydrophobicContact CD2-CG1 4.5Å; F122-I147 HydrophobicContact CE2-CD1 3.92Å; F122-I147 HydrophobicContact CE2-CG1 4.07Å; F122-L154 HydrophobicContact CE1-CD1 4.13Å; F122-L154 HydrophobicContact CE1-CD2 4.19Å; F122-L154 HydrophobicContact CE2-CD1 4.49Å; F122-L154 HydrophobicContact CE2-CD2 4.34Å; F122-L154 HydrophobicContact CZ-CD1 3.55Å; F122-L154 HydrophobicContact CZ-CD2 3.83Å; F122-L154 HydrophobicContact CZ-CG 4.34Å; F122-L156 HydrophobicContact CB-CD1 3.86Å; F122-L156 HydrophobicContact CD1-CD1 4.14Å; F122-L156 HydrophobicContact CD2-CD1 4Å; F122-L156 HydrophobicContact CD2-CD2 3.6Å; F122-L156 HydrophobicContact CD2-CG 4.46Å; F122-L156 HydrophobicContact CE2-CD2 3.63Å; F122-L156 HydrophobicContact CG-CD1 3.72Å; F122-L156 HydrophobicContact CG-CD2 4.16Å; F122-L156 HydrophobicContact CZ-CD2 4.23Å; F122-I165 HydrophobicContact CD1-CD1 3.53Å; F122-I165 HydrophobicContact CE1-CD1 3.6Å; F122-I165 HydrophobicContact CG-CD1 4.42Å
123	L	93.4	Very high	87.3	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	143.5	-174.6	-54.3	174.2	0	0	0	109.3	L85 C114 V115 L117 Y125 L133 L135	L85-L123 HydrophobicContact CD2-CD1 3.95Å; C114-L123 CarbonylContact C-O 3.59Å; C114-L123 WeakPolarHBondContact CA-O 3.49Å; V115-L123 HydrophobicContact CB-CB 4.35Å; V115-L123 PolarHBondContact N-O 3.21Å; V115-L123 PolarHBondContact O-N 2.83Å; L117-L123 HydrophobicContact CD1-CD1 3.86Å; L117-L123 HydrophobicContact CG-CD1 4.34Å; L123-Y125 HydrophobicContact CB-CD2 4.33Å; L123-Y125 HydrophobicContact CB-CE2 3.8Å; L123-Y125 HydrophobicContact CD1-CE2 3.96Å; L123-L133 HydrophobicContact CB-CD1 4Å; L123-L133 HydrophobicContact CD2-CD1 4.07Å; L123-L135 CarbonylContact C-O 3.58Å; L123-L135 WeakPolarHBondContact CA-O 3.29Å
124	V	90.6	Very high	87.2	Confident	4 Å²	4	39.3 Å²	39.3	2%	0.024	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	123.4	169.8	-173.5	0	0	0	0	108.2	L95 A112 I113 F122 L134 L135	L95-V124 HydrophobicContact CD2-CG1 4.49Å; A112-V124 HydrophobicContact CB-CG1 3.79Å; I113-V124 CarbonylContact O-C 3.59Å; I113-V124 WeakPolarHBondContact O-CA 3.43Å; F122-V124 HydrophobicContact CD1-CG2 4.46Å; F122-V124 HydrophobicContact CE1-CG2 3.52Å; F122-V124 HydrophobicContact CZ-CG2 3.61Å; V124-L134 HydrophobicContact CG1-CB 4.49Å; V124-L134 HydrophobicContact CG1-CD1 4.4Å; V124-L134 WeakPolarHBondContact O-CB 3.26Å; V124-L134 PolarHBondContact O-N 3.05Å; V124-L135 HydrophobicContact CB-CB 3.89Å; V124-L135 HydrophobicContact CG2-CB 3.91Å; V124-L135 HydrophobicContact CG2-CD2 4.05Å; V124-L135 HydrophobicContact CG2-CG 4.45Å; V124-L135 PolarHBondContact N-O 2.75Å; V124-L135 PolarHBondContact O-N 3.32Å
125	Y	90.1	Very high	87	Confident	17 Å²	17	42 Å²	42	7%	0.067	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142.7	176.3	-68.7	-82.2	0	0	0	110	M65 Q83 L85 A112 I113 V115 L123 L131 P132 L133	M65-Y125 HydrophobicContact CE-CD2 3.79Å; M65-Y125 HydrophobicContact CE-CE2 4.27Å; M65-Y125 HydrophobicContact CE-CG 4.16Å; Q83-Y125 HydrophobicContact CG-CE1 4.28Å; L85-Y125 HydrophobicContact CD2-CE2 3.88Å; L85-Y125 VanDerWaalsContact CD2-OH 3.25Å; L85-Y125 WeakPolarHBondContact CD2-OH 3.37Å; A112-Y125 CarbonylContact C-O 3.54Å; A112-Y125 WeakPolarHBondContact CA-O 3.37Å; A112-Y125 WeakPolarHBondContact CB-O 3.42Å; I113-Y125 PolarHBondContact N-O 2.72Å; I113-Y125 PolarHBondContact O-N 2.79Å; V115-Y125 HydrophobicContact CG2-CD2 4.14Å; V115-Y125 HydrophobicContact CG2-CE2 4.46Å; L123-Y125 HydrophobicContact CB-CD2 4.33Å; L123-Y125 HydrophobicContact CB-CE2 3.8Å; L123-Y125 HydrophobicContact CD1-CE2 3.96Å; Y125-L131 HydrophobicContact CD1-CB 4.45Å; Y125-L131 WeakPolarHBondContact CD1-O 3.37Å; Y125-P132 CarbonylContact C-O 3.59Å; Y125-P132 WeakPolarHBondContact CA-O 3.45Å; Y125-L133 HydrophobicContact CD1-CB 3.99Å; Y125-L133 HydrophobicContact CD1-CD1 3.97Å; Y125-L133 HydrophobicContact CD2-CD1 4.41Å; Y125-L133 HydrophobicContact CE1-CB 3.73Å; Y125-L133 HydrophobicContact CE1-CD1 3.61Å; Y125-L133 HydrophobicContact CE1-CG 4.25Å; Y125-L133 HydrophobicContact CE2-CD1 4.06Å; Y125-L133 HydrophobicContact CG-CD1 4.38Å
126	S	85.9	Confident	86.9	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.014	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	144.8	162.6	-167.9	0	0	0	0	109.2	D128 L131 P132	S126-D128 PolarHBondContact O-N 2.88Å; S126-D128 VanDerWaalsContact OG-CG 3.29Å; S126-D128 PolarHBondContact OG-N 2.89Å; S126-D128 PolarHBondContact OG-OD2 3.07Å; S126-L131 WeakPolarHBondContact O-CA 3.21Å; S126-L131 WeakPolarHBondContact O-CD2 3.48Å; S126-P132 PolarHBondContact N-O 2.92Å
127	V	81.1	Confident	86.8	Confident	6 Å²	6	46.3 Å²	46.3	4%	0.036	24%	0.243	C	C	.	.	S	Bend	trans	-82.8	2.5	173.9	176.6	0	0	0	0	111.5	V56 I67 F94 L111 I113	V56-V127 HydrophobicContact CG1-CG1 3.66Å; V56-V127 HydrophobicContact CG2-CG1 4.26Å; I67-V127 HydrophobicContact CG2-CG1 4.09Å; F94-V127 HydrophobicContact CD1-CG2 4.24Å; F94-V127 HydrophobicContact CE1-CG2 3.73Å; L111-V127 HydrophobicContact CB-CB 4.19Å; L111-V127 HydrophobicContact CB-CG2 4.13Å; L111-V127 WeakPolarHBondContact O-CB 3.09Å; L111-V127 WeakPolarHBondContact O-CG2 3.06Å; L111-V127 PolarHBondContact O-N 2.81Å; I113-V127 HydrophobicContact CB-CG2 4.29Å; I113-V127 HydrophobicContact CG2-CG2 4.35Å
128	D	75.4	Confident	86.7	Confident	40 Å²	40	49.9 Å²	49.9	21%	0.214	27%	0.268	C	S	.	.	S	Bend	trans	-66.3	174.2	172.5	-60.6	-47.9	0	0	0	113.2	W110 S126 K130 L131	W110-D128 WeakPolarHBondContact CZ3-OD2 3.43Å; S126-D128 PolarHBondContact O-N 2.88Å; S126-D128 VanDerWaalsContact OG-CG 3.29Å; S126-D128 PolarHBondContact OG-N 2.89Å; S126-D128 PolarHBondContact OG-OD2 3.07Å; D128-K130 PolarHBondContact O-N 2.78Å; D128-K130 VanDerWaalsContact O-N 3.13Å; D128-L131 PolarHBondContact O-N 2.71Å; D128-L131 VanDerWaalsContact O-N 3.07Å
129	L	67.7	Low	86.5	Confident	125 Å²	125	48.6 Å²	48.6	65%	0.654	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.1	121.8	176.9	-64.4	170.3	0	0	0	110.6	Y81	Y81-L129 HydrophobicContact CE1-CD2 4.14Å; Y81-L129 WeakPolarHBondContact OH-CD2 3.39Å
130	K	74	Confident	86	Confident	183 Å²	183	52.9 Å²	52.9	80%	0.796	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	9	177.4	-49.7	179.2	178.9	179	0	117.3	D128	D128-K130 PolarHBondContact O-N 2.78Å; D128-K130 VanDerWaalsContact O-N 3.13Å
131	L	83	Confident	85.1	Confident	6 Å²	6	57.7 Å²	57.7	3%	0.031	31%	0.309	C	S	.	.			trans	49.7	58	175.7	-57.7	172.4	0	0	0	113	M65 I67 Q83 Y125 S126 D128 L133	M65-L131 HydrophobicContact CE-CD1 4.04Å; I67-L131 HydrophobicContact CB-CD2 4.3Å; I67-L131 HydrophobicContact CG1-CD1 4.12Å; I67-L131 HydrophobicContact CG1-CD2 3.67Å; Q83-L131 HydrophobicContact CB-CD1 3.96Å; Y125-L131 HydrophobicContact CD1-CB 4.45Å; Y125-L131 WeakPolarHBondContact CD1-O 3.37Å; S126-L131 WeakPolarHBondContact O-CA 3.21Å; S126-L131 WeakPolarHBondContact O-CD2 3.48Å; D128-L131 PolarHBondContact O-N 2.71Å; D128-L131 VanDerWaalsContact O-N 3.07Å; L131-L133 PolarHBondContact O-N 2.83Å
132	P	86.2	Confident	84.5	Confident	59 Å²	59	56.4 Å²	56.4	38%	0.383	31%	0.313	S	S	.	.			trans	-64.8	135.2	179.3	28.4	-34.2	0	0	0	110.4	Y125 S126 L134	Y125-P132 CarbonylContact C-O 3.59Å; Y125-P132 WeakPolarHBondContact CA-O 3.45Å; S126-P132 PolarHBondContact N-O 2.92Å; P132-L134 PolarHBondContact O-N 2.9Å
133	L	89.5	Confident	84.3	Confident	86 Å²	86	58.3 Å²	58.3	45%	0.45	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	121	175.1	-176.4	70.3	0	0	0	109.4	L123 Y125 L131 L135	L123-L133 HydrophobicContact CB-CD1 4Å; L123-L133 HydrophobicContact CD2-CD1 4.07Å; Y125-L133 HydrophobicContact CD1-CB 3.99Å; Y125-L133 HydrophobicContact CD1-CD1 3.97Å; Y125-L133 HydrophobicContact CD2-CD1 4.41Å; Y125-L133 HydrophobicContact CE1-CB 3.73Å; Y125-L133 HydrophobicContact CE1-CD1 3.61Å; Y125-L133 HydrophobicContact CE1-CG 4.25Å; Y125-L133 HydrophobicContact CE2-CD1 4.06Å; Y125-L133 HydrophobicContact CG-CD1 4.38Å; L131-L133 PolarHBondContact O-N 2.83Å; L133-L135 WeakPolarHBondContact CD1-O 3.38Å
134	L	87.1	Confident	84.1	Confident	103 Å²	103	58.2 Å²	58.2	54%	0.539	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-43.6	-179.7	-58.9	178.4	0	0	0	112	A112 V124 P132	A112-L134 HydrophobicContact CB-CD1 4.14Å; V124-L134 HydrophobicContact CG1-CB 4.49Å; V124-L134 HydrophobicContact CG1-CD1 4.4Å; V124-L134 WeakPolarHBondContact O-CB 3.26Å; V124-L134 PolarHBondContact O-N 3.05Å; P132-L134 PolarHBondContact O-N 2.9Å
135	L	88.1	Confident	84	Confident	56 Å²	56	62.5 Å²	62.5	29%	0.293	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	144.1	-177.1	-179.3	68.1	0	0	0	110.2	F122 L123 V124 L133 V137	F122-L135 HydrophobicContact CE1-CD2 4.14Å; L123-L135 CarbonylContact C-O 3.58Å; L123-L135 WeakPolarHBondContact CA-O 3.29Å; V124-L135 HydrophobicContact CB-CB 3.89Å; V124-L135 HydrophobicContact CG2-CB 3.91Å; V124-L135 HydrophobicContact CG2-CD2 4.05Å; V124-L135 HydrophobicContact CG2-CG 4.45Å; V124-L135 PolarHBondContact N-O 2.75Å; V124-L135 PolarHBondContact O-N 3.32Å; L133-L135 WeakPolarHBondContact CD1-O 3.38Å; L135-V137 HydrophobicContact CD1-CG2 4.3Å; L135-V137 HydrophobicContact CD2-CG2 4.34Å; L135-V137 HydrophobicContact CG-CG2 4.21Å
136	S	92.5	Very high	83.9	Confident	52 Å²	52	65.5 Å²	65.5	36%	0.364	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	123.4	171.2	157.2	0	0	0	0	109.7	R121 F122	R121-S136 PolarHBondContact NH2-OG 2.84Å; F122-S136 CarbonylContact O-C 3.57Å; F122-S136 WeakPolarHBondContact O-CA 3.39Å
137	V	90.1	Very high	84	Confident	40 Å²	40	65.7 Å²	65.7	24%	0.242	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	139.7	172	-175.3	0	0	0	0	108.2	R121 F122 L135 F139 I165	R121-V137 WeakPolarHBondContact CA-O 3.47Å; F122-V137 HydrophobicContact CB-CB 4.36Å; F122-V137 HydrophobicContact CD1-CB 4.46Å; F122-V137 HydrophobicContact CD1-CG2 4.39Å; F122-V137 PolarHBondContact N-O 3.23Å; F122-V137 PolarHBondContact O-N 2.9Å; L135-V137 HydrophobicContact CD1-CG2 4.3Å; L135-V137 HydrophobicContact CD2-CG2 4.34Å; L135-V137 HydrophobicContact CG-CG2 4.21Å; V137-F139 HydrophobicContact CB-CE2 4.31Å; V137-F139 HydrophobicContact CG1-CD2 4.3Å; V137-F139 HydrophobicContact CG1-CE1 4.05Å; V137-F139 HydrophobicContact CG1-CE2 3.68Å; V137-F139 HydrophobicContact CG1-CZ 3.54Å; V137-I165 HydrophobicContact CG2-CD1 4.3Å
138	S	90.9	Very high	84.2	Confident	74 Å²	74	68.6 Å²	68.6	52%	0.517	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	134.5	176.5	-167.6	0	0	0	0	109.1
139	F	87.5	Confident	84.4	Confident	40 Å²	40	68.4 Å²	68.4	18%	0.175	38%	0.38	C	S	.	.			trans	-119.8	143.7	175.3	-56.5	-84.2	0	0	0	109.6	G120 F122 V137 I144 L156 Y158 V163	G120-F139 VanDerWaalsContact O-CD2 3.31Å; G120-F139 WeakPolarHBondContact O-CD2 3.43Å; G120-F139 PolarHBondContact O-N 3.33Å; F122-F139 HydrophobicContact CB-CE2 4.37Å; V137-F139 HydrophobicContact CB-CE2 4.31Å; V137-F139 HydrophobicContact CG1-CD2 4.3Å; V137-F139 HydrophobicContact CG1-CE1 4.05Å; V137-F139 HydrophobicContact CG1-CE2 3.68Å; V137-F139 HydrophobicContact CG1-CZ 3.54Å; F139-I144 HydrophobicContact CD2-CD1 3.55Å; F139-I144 HydrophobicContact CE2-CD1 3.77Å; F139-L156 HydrophobicContact CE2-CD1 3.6Å; F139-L156 HydrophobicContact CZ-CD1 3.91Å; F139-Y158 HydrophobicContact CB-CD1 4.33Å; F139-Y158 HydrophobicContact CB-CD2 4.07Å; F139-Y158 HydrophobicContact CB-CE1 3.72Å; F139-Y158 HydrophobicContact CB-CE2 3.39Å; F139-Y158 HydrophobicContact CB-CG 4.45Å; F139-Y158 WeakPolarHBondContact CB-OH 3.33Å; F139-Y158 HydrophobicContact CD2-CD2 4.22Å; F139-Y158 HydrophobicContact CD2-CE2 4.27Å; F139-Y158 HydrophobicContact CG-CD1 4.49Å; F139-Y158 HydrophobicContact CG-CD2 4.26Å; F139-Y158 HydrophobicContact CG-CE1 4.34Å; F139-Y158 HydrophobicContact CG-CE2 4.06Å; F139-Y158 HydrophobicContact CG-CG 4.41Å; F139-Y158 PolarHBondContact O-OH 3.24Å; F139-V163 HydrophobicContact CE1-CG1 3.89Å; F139-V163 HydrophobicContact CE1-CG2 4.43Å; F139-V163 HydrophobicContact CZ-CG1 3.98Å
140	D	79.2	Confident	84.6	Confident	160 Å²	160	65.3 Å²	65.3	86%	0.856	37%	0.367	S	S	*	.	S	Bend	trans	-81	-21.2	-164.3	-62.2	-37.1	0	0	0	116	Y158	D140-Y158 PolarHBondContact N-OH 3.32Å
141	T	69.6	Low	84.3	Confident	101 Å²	101	60.9 Å²	60.9	62%	0.62	36%	0.359	S	S	*	.	S	Bend	trans	-129.8	70.6	-166.2	51.3	0	0	0	0	115.2	Y158 S159	T141-Y158 WeakPolarHBondContact CA-OH 3.17Å; T141-Y158 PolarHBondContact N-OH 2.87Å; T141-Y158 VanDerWaalsContact O-CZ 3.23Å; T141-Y158 PolarHBondContact O-OH 2.9Å; T141-Y158 PolarHBondContact OG1-OH 3.4Å; T141-S159 WeakPolarHBondContact O-CB 2.98Å
142	G	80.2	Confident	83.6	Confident	28 Å²	28	65.6 Å²	65.6	29%	0.289	38%	0.384	S	S	.	.	S	Bend	trans	113.9	-173.3	161.6	0	0	0	0	0	116.2	G120 Y158	G120-G142 WeakPolarHBondContact CA-O 3.4Å; G120-G142 PolarHBondContact N-O 3.04Å; G142-Y158 PolarHBondContact N-OH 2.86Å; G142-Y158 WeakPolarHBondContact O-CE2 2.77Å
143	P	88.6	Confident	82.9	Confident	40 Å²	40	68.9 Å²	68.9	26%	0.26	39%	0.389	S	S	.	.			trans	-80.5	150.4	-173.9	32.3	-36.1	0	0	0	112.9	V118 K145 S159	V118-P143 HydrophobicContact CB-CB 4.5Å; V118-P143 WeakPolarHBondContact O-CA 3.06Å; P143-K145 HydrophobicContact CG-CG 4.06Å; P143-K145 PolarHBondContact O-N 3.22Å; P143-S159 PolarHBondContact O-N 2.82Å
144	I	88.4	Confident	82.6	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	113.2	157.6	-51.1	-60.1	0	0	0	107	S90 L117 F122 F139 I147 L156 Y158	S90-I144 WeakPolarHBondContact CB-O 3.25Å; S90-I144 PolarHBondContact OG-O 3.39Å; L117-I144 PolarHBondContact O-N 3.14Å; L117-I144 VanDerWaalsContact O-N 3.15Å; F122-I144 HydrophobicContact CB-CD1 4.39Å; F122-I144 HydrophobicContact CB-CG1 4.31Å; F139-I144 HydrophobicContact CD2-CD1 3.55Å; F139-I144 HydrophobicContact CE2-CD1 3.77Å; I144-I147 HydrophobicContact CG2-CG1 4.4Å; I144-L156 HydrophobicContact CD1-CD1 4.13Å; I144-L156 HydrophobicContact CG2-CD2 4.19Å; I144-Y158 HydrophobicContact CD1-CD2 3.49Å; I144-Y158 VanDerWaalsContact CD1-CD2 3.49Å; I144-Y158 HydrophobicContact CD1-CE2 4.15Å; I144-Y158 HydrophobicContact CD1-CG 4.33Å
145	K	87.8	Confident	82.5	Confident	95 Å²	95	61.6 Å²	61.6	41%	0.413	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-33.1	-174.8	-64.2	-177.4	-179.1	168.2	0	113.1	P143 L157 S159 N160	P143-K145 HydrophobicContact CG-CG 4.06Å; P143-K145 PolarHBondContact O-N 3.22Å; K145-L157 HydrophobicContact CB-CD2 4.04Å; K145-L157 HydrophobicContact CB-CG 4.1Å; K145-L157 PolarHBondContact N-O 2.72Å; K145-S159 WeakPolarHBondContact CD-O 3.07Å; K145-S159 WeakPolarHBondContact CE-O 3.07Å; K145-S159 PolarHBondContact NZ-O 3.15Å; K145-N160 PolarHBondContact NZ-OD1 3.19Å
146	D	88.3	Confident	82.5	Confident	80 Å²	80	59 Å²	59	43%	0.428	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	157.8	-177.5	-157.2	5.5	0	0	0	111.1	L157	D146-L157 HydrophobicContact CB-CB 3.9Å; D146-L157 HydrophobicContact CB-CD2 4.27Å; D146-L157 PolarHBondContact O-N 3.43Å
147	I	89.2	Confident	82.4	Confident	6 Å²	6	58.7 Å²	58.7	3%	0.031	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	123.3	176.9	-59.4	154.6	0	0	0	106.9	C114 F122 I144 I149 L154 L156	C114-I147 HydrophobicContact CB-CD1 3.85Å; C114-I147 HydrophobicContact CB-CG2 4.26Å; F122-I147 HydrophobicContact CD2-CD1 4.4Å; F122-I147 HydrophobicContact CD2-CG1 4.5Å; F122-I147 HydrophobicContact CE2-CD1 3.92Å; F122-I147 HydrophobicContact CE2-CG1 4.07Å; I144-I147 HydrophobicContact CG2-CG1 4.4Å; I147-I149 HydrophobicContact CG2-CD1 4.01Å; I147-I149 HydrophobicContact CG2-CG1 3.72Å; I147-L154 HydrophobicContact CG2-CD2 4.36Å; I147-L154 HydrophobicContact CG2-CG 4.31Å; I147-L156 HydrophobicContact CB-CD2 4.35Å; I147-L156 HydrophobicContact CG1-CD2 3.74Å; I147-L156 HydrophobicContact CG2-CD2 4.21Å
148	S	85.7	Confident	82.1	Confident	66 Å²	66	57.5 Å²	57.5	46%	0.462	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.2	172.8	-179.6	0	0	0	0	109.1	V155	S148-V155 PolarHBondContact N-O 3.13Å; S148-V155 PolarHBondContact O-N 3.07Å
149	I	79.3	Confident	81.5	Confident	36 Å²	36	55.8 Å²	55.8	19%	0.185	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	119.4	-173.8	-53.9	-179.8	0	0	0	108.5	D93 F94 L95 P96 I147	D93-I149 HydrophobicContact CB-CD1 4.08Å; F94-I149 WeakPolarHBondContact O-CD1 3.5Å; L95-I149 HydrophobicContact CB-CD1 4.47Å; L95-I149 HydrophobicContact CD1-CD1 4.2Å; L95-I149 HydrophobicContact CD1-CG2 3.74Å; P96-I149 VanDerWaalsContact CD-CG2 3.45Å; P96-I149 HydrophobicContact CG-CG2 4.07Å; I147-I149 HydrophobicContact CG2-CD1 4.01Å; I147-I149 HydrophobicContact CG2-CG1 3.72Å
150	T	71.3	Confident	81.4	Confident	61 Å²	61	60.1 Å²	60.1	37%	0.374	34%	0.337	S	S	.	.			trans	-109	176.2	170.8	68.4	0	0	0	0	109.8	D152 R153	T150-D152 PolarHBondContact O-N 3.38Å; T150-D152 PolarHBondContact OG1-OD1 3.44Å; T150-R153 PolarHBondContact N-O 2.75Å; T150-R153 WeakPolarHBondContact OG1-CB 3.44Å; T150-R153 PolarHBondContact OG1-N 2.96Å; T150-R153 PolarHBondContact OG1-O 2.77Å
151	S	67.6	Low	81.7	Confident	90 Å²	90	55.8 Å²	55.8	63%	0.629	32%	0.319	S	S	*	.	S	Bend	trans	-61.8	-22.9	176.3	51	0	0	0	0	113.9	M98	M98-S151 WeakPolarHBondContact CE-O 3.35Å
152	D	68.4	Low	82.4	Confident	105 Å²	105	58.7 Å²	58.7	56%	0.561	32%	0.323	S	S	*	.	S	Bend	trans	-123	-13.9	-171.9	67.8	-41.8	0	0	0	113.9	T150	T150-D152 PolarHBondContact O-N 3.38Å; T150-D152 PolarHBondContact OG1-OD1 3.44Å
153	R	72.2	Confident	82.6	Confident	128 Å²	128	59.4 Å²	59.4	48%	0.483	32%	0.322	S	S	.	.			trans	-143.5	149.1	-171.4	-63.1	169.2	-162.6	-141.9	-5.6	111.3	T150 V155	T150-R153 PolarHBondContact N-O 2.75Å; T150-R153 WeakPolarHBondContact OG1-CB 3.44Å; T150-R153 PolarHBondContact OG1-N 2.96Å; T150-R153 PolarHBondContact OG1-O 2.77Å; R153-V155 HydrophobicContact CB-CG2 4.32Å
154	L	83.3	Confident	82.4	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121.3	162.1	-173	157.9	0	0	0	107.6	L95 F122 I147 L156 A164 I165 L168	L95-L154 HydrophobicContact CD1-CD1 4.17Å; F122-L154 HydrophobicContact CE1-CD1 4.13Å; F122-L154 HydrophobicContact CE1-CD2 4.19Å; F122-L154 HydrophobicContact CE2-CD1 4.49Å; F122-L154 HydrophobicContact CE2-CD2 4.34Å; F122-L154 HydrophobicContact CZ-CD1 3.55Å; F122-L154 HydrophobicContact CZ-CD2 3.83Å; F122-L154 HydrophobicContact CZ-CG 4.34Å; I147-L154 HydrophobicContact CG2-CD2 4.36Å; I147-L154 HydrophobicContact CG2-CG 4.31Å; L154-L156 HydrophobicContact CD2-CD2 3.44Å; L154-L156 VanDerWaalsContact CD2-CD2 3.44Å; L154-L156 HydrophobicContact CD2-CG 3.77Å; L154-A164 CarbonylContact O-C 3.52Å; L154-A164 WeakPolarHBondContact O-CA 3.47Å; L154-I165 HydrophobicContact CB-CB 4.44Å; L154-I165 HydrophobicContact CD2-CB 4.28Å; L154-I165 HydrophobicContact CD2-CD1 3.9Å; L154-I165 HydrophobicContact CD2-CG1 4.06Å; L154-I165 PolarHBondContact O-N 3.24Å; L154-L168 HydrophobicContact CB-CD1 3.8Å; L154-L168 HydrophobicContact CD1-CD1 3.81Å; L154-L168 HydrophobicContact CG-CD1 4.48Å
155	V	85.1	Confident	81.8	Confident	35 Å²	35	60.8 Å²	60.8	21%	0.212	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.4	-179.7	-176.7	0	0	0	0	109.1	S148 R153 F162 V163 A164	S148-V155 PolarHBondContact N-O 3.13Å; S148-V155 PolarHBondContact O-N 3.07Å; R153-V155 HydrophobicContact CB-CG2 4.32Å; V155-F162 HydrophobicContact CG1-CB 4.12Å; V155-F162 HydrophobicContact CG1-CD1 4.04Å; V155-V163 CarbonylContact C-O 3.58Å; V155-V163 WeakPolarHBondContact CA-O 3.08Å; V155-A164 HydrophobicContact CG2-CB 4.49Å
156	L	88	Confident	80.7	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	132.9	175.8	-58.6	-177	0	0	0	110.1	F122 F139 I144 I147 L154 Y158 F162 V163 I165	F122-L156 HydrophobicContact CB-CD1 3.86Å; F122-L156 HydrophobicContact CD1-CD1 4.14Å; F122-L156 HydrophobicContact CD2-CD1 4Å; F122-L156 HydrophobicContact CD2-CD2 3.6Å; F122-L156 HydrophobicContact CD2-CG 4.46Å; F122-L156 HydrophobicContact CE2-CD2 3.63Å; F122-L156 HydrophobicContact CG-CD1 3.72Å; F122-L156 HydrophobicContact CG-CD2 4.16Å; F122-L156 HydrophobicContact CZ-CD2 4.23Å; F139-L156 HydrophobicContact CE2-CD1 3.6Å; F139-L156 HydrophobicContact CZ-CD1 3.91Å; I144-L156 HydrophobicContact CD1-CD1 4.13Å; I144-L156 HydrophobicContact CG2-CD2 4.19Å; I147-L156 HydrophobicContact CB-CD2 4.35Å; I147-L156 HydrophobicContact CG1-CD2 3.74Å; I147-L156 HydrophobicContact CG2-CD2 4.21Å; L154-L156 HydrophobicContact CD2-CD2 3.44Å; L154-L156 VanDerWaalsContact CD2-CD2 3.44Å; L154-L156 HydrophobicContact CD2-CG 3.77Å; L156-Y158 PolarHBondContact O-N 2.6Å; L156-F162 CarbonylContact O-C 3.52Å; L156-F162 VanDerWaalsContact O-CA 3.32Å; L156-F162 WeakPolarHBondContact O-CA 3.15Å; L156-V163 HydrophobicContact CB-CB 4.47Å; L156-V163 PolarHBondContact N-O 2.94Å; L156-V163 PolarHBondContact O-N 3.43Å; L156-I165 HydrophobicContact CD1-CD1 3.71Å; L156-I165 HydrophobicContact CD1-CG1 4.29Å; L156-I165 HydrophobicContact CG-CD1 4.19Å; L156-I165 HydrophobicContact CG-CG1 4.46Å
157	L	89	Confident	79	Confident	46 Å²	46	67.4 Å²	67.4	24%	0.241	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	99.9	159.5	178.3	60.8	0	0	0	107.8	K145 D146 F162	K145-L157 HydrophobicContact CB-CD2 4.04Å; K145-L157 HydrophobicContact CB-CG 4.1Å; K145-L157 PolarHBondContact N-O 2.72Å; D146-L157 HydrophobicContact CB-CB 3.9Å; D146-L157 HydrophobicContact CB-CD2 4.27Å; D146-L157 PolarHBondContact O-N 3.43Å; L157-F162 HydrophobicContact CB-CD1 4.37Å; L157-F162 HydrophobicContact CB-CE1 4.16Å; L157-F162 HydrophobicContact CD1-CD1 4.14Å; L157-F162 HydrophobicContact CD1-CE1 3.8Å; L157-F162 HydrophobicContact CD1-CE2 4.42Å; L157-F162 HydrophobicContact CD1-CZ 3.96Å; L157-F162 HydrophobicContact CG-CE1 4.44Å
158	Y	84.8	Confident	77	Confident	15 Å²	15	71.1 Å²	71.1	6%	0.059	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	118.5	-178.5	174.5	-114.6	0	0	0	110.9	F139 D140 T141 G142 I144 L156 N160 S161	F139-Y158 HydrophobicContact CB-CD1 4.33Å; F139-Y158 HydrophobicContact CB-CD2 4.07Å; F139-Y158 HydrophobicContact CB-CE1 3.72Å; F139-Y158 HydrophobicContact CB-CE2 3.39Å; F139-Y158 HydrophobicContact CB-CG 4.45Å; F139-Y158 WeakPolarHBondContact CB-OH 3.33Å; F139-Y158 HydrophobicContact CD2-CD2 4.22Å; F139-Y158 HydrophobicContact CD2-CE2 4.27Å; F139-Y158 HydrophobicContact CG-CD1 4.49Å; F139-Y158 HydrophobicContact CG-CD2 4.26Å; F139-Y158 HydrophobicContact CG-CE1 4.34Å; F139-Y158 HydrophobicContact CG-CE2 4.06Å; F139-Y158 HydrophobicContact CG-CG 4.41Å; F139-Y158 PolarHBondContact O-OH 3.24Å; D140-Y158 PolarHBondContact N-OH 3.32Å; T141-Y158 WeakPolarHBondContact CA-OH 3.17Å; T141-Y158 PolarHBondContact N-OH 2.87Å; T141-Y158 VanDerWaalsContact O-CZ 3.23Å; T141-Y158 PolarHBondContact O-OH 2.9Å; T141-Y158 PolarHBondContact OG1-OH 3.4Å; G142-Y158 PolarHBondContact N-OH 2.86Å; G142-Y158 WeakPolarHBondContact O-CE2 2.77Å; I144-Y158 HydrophobicContact CD1-CD2 3.49Å; I144-Y158 VanDerWaalsContact CD1-CD2 3.49Å; I144-Y158 HydrophobicContact CD1-CE2 4.15Å; I144-Y158 HydrophobicContact CD1-CG 4.33Å; L156-Y158 PolarHBondContact O-N 2.6Å; Y158-N160 PolarHBondContact O-N 2.78Å; Y158-S161 PolarHBondContact N-O 3.42Å; Y158-S161 PolarHBondContact O-N 2.85Å; Y158-S161 VanDerWaalsContact O-O 3.08Å
159	S	79	Confident	74.7	Confident	38 Å²	38	81.1 Å²	81.1	27%	0.266	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	-103.9	-173.3	-171.9	0	0	0	0	110.5	T141 P143 K145	T141-S159 WeakPolarHBondContact O-CB 2.98Å; P143-S159 PolarHBondContact O-N 2.82Å; K145-S159 WeakPolarHBondContact CD-O 3.07Å; K145-S159 WeakPolarHBondContact CE-O 3.07Å; K145-S159 PolarHBondContact NZ-O 3.15Å
160	N	84.4	Confident	74.4	Confident	132 Å²	132	83.4 Å²	83.4	71%	0.706	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.2	23.4	174.9	-61.1	-25.4	0	0	0	112.7	K145 Y158	K145-N160 PolarHBondContact NZ-OD1 3.19Å; Y158-N160 PolarHBondContact O-N 2.78Å
161	S	84.8	Confident	74.6	Confident	69 Å²	69	84.6 Å²	84.6	48%	0.483	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.9	-175	-59	0	0	0	0	111.2	Y158	Y158-S161 PolarHBondContact N-O 3.42Å; Y158-S161 PolarHBondContact O-N 2.85Å; Y158-S161 VanDerWaalsContact O-O 3.08Å
162	F	85.2	Confident	75	Confident	161 Å²	161	84.3 Å²	84.3	71%	0.706	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	129.8	171.4	-65.9	-78.8	0	0	0	110	V155 L156 L157	V155-F162 HydrophobicContact CG1-CB 4.12Å; V155-F162 HydrophobicContact CG1-CD1 4.04Å; L156-F162 CarbonylContact O-C 3.52Å; L156-F162 VanDerWaalsContact O-CA 3.32Å; L156-F162 WeakPolarHBondContact O-CA 3.15Å; L157-F162 HydrophobicContact CB-CD1 4.37Å; L157-F162 HydrophobicContact CB-CE1 4.16Å; L157-F162 HydrophobicContact CD1-CD1 4.14Å; L157-F162 HydrophobicContact CD1-CE1 3.8Å; L157-F162 HydrophobicContact CD1-CE2 4.42Å; L157-F162 HydrophobicContact CD1-CZ 3.96Å; L157-F162 HydrophobicContact CG-CE1 4.44Å
163	V	85.3	Confident	75.4	Confident	43 Å²	43	83.1 Å²	83.1	26%	0.261	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	118.4	178.2	-178.3	0	0	0	0	108.6	F139 V155 L156	F139-V163 HydrophobicContact CE1-CG1 3.89Å; F139-V163 HydrophobicContact CE1-CG2 4.43Å; F139-V163 HydrophobicContact CZ-CG1 3.98Å; V155-V163 CarbonylContact C-O 3.58Å; V155-V163 WeakPolarHBondContact CA-O 3.08Å; L156-V163 HydrophobicContact CB-CB 4.47Å; L156-V163 PolarHBondContact N-O 2.94Å; L156-V163 PolarHBondContact O-N 3.43Å
164	A	82.9	Confident	75.6	Confident	46 Å²	46	80.3 Å²	80.3	38%	0.38	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	133.9	171.3	0	0	0	0	0	110.2	L154 V155 E166	L154-A164 CarbonylContact O-C 3.52Å; L154-A164 WeakPolarHBondContact O-CA 3.47Å; V155-A164 HydrophobicContact CG2-CB 4.49Å; A164-E166 HydrophobicContact CB-CG 4.25Å
165	I	76.6	Confident	75.1	Confident	23 Å²	23	85.5 Å²	85.5	12%	0.118	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	100.3	169.8	-56.3	-168.9	0	0	0	107.4	F122 V137 L154 L156 H167	F122-I165 HydrophobicContact CD1-CD1 3.53Å; F122-I165 HydrophobicContact CE1-CD1 3.6Å; F122-I165 HydrophobicContact CG-CD1 4.42Å; V137-I165 HydrophobicContact CG2-CD1 4.3Å; L154-I165 HydrophobicContact CB-CB 4.44Å; L154-I165 HydrophobicContact CD2-CB 4.28Å; L154-I165 HydrophobicContact CD2-CD1 3.9Å; L154-I165 HydrophobicContact CD2-CG1 4.06Å; L154-I165 PolarHBondContact O-N 3.24Å; L156-I165 HydrophobicContact CD1-CD1 3.71Å; L156-I165 HydrophobicContact CD1-CG1 4.29Å; L156-I165 HydrophobicContact CG-CD1 4.19Å; L156-I165 HydrophobicContact CG-CG1 4.46Å; I165-H167 VanDerWaalsContact C-N 3.31Å; I165-H167 PolarHBondContact O-N 2.97Å
166	E	63.9	Low	74.3	Confident	142 Å²	142	89.1 Å²	89.1	66%	0.664	45%	0.452	S	S	*	.			trans	-87.4	17.5	-170.7	-62.5	-169.9	156	0	0	114.8	A164	A164-E166 HydrophobicContact CB-CG 4.25Å
167	H	52.3	Low	73.3	Confident	172 Å²	172	96 Å²	96	80%	0.796	49%	0.486	S	S	*	.			trans	-121.3	29.1	-170.3	-71.8	-47.5	0	0	0	115.9	I165 K169	I165-H167 VanDerWaalsContact C-N 3.31Å; I165-H167 PolarHBondContact O-N 2.97Å; H167-K169 PolarHBondContact O-N 2.82Å
168	L	48.4	Very low	72	Confident	84 Å²	84	100.2 Å²	100.2	44%	0.44	51%	0.507	S	S	.	.			trans	-97	72.7	169.4	-63.5	169.7	0	0	0	109.7	L95 L154	L95-L168 HydrophobicContact CD1-CD1 3.98Å; L95-L168 HydrophobicContact CD2-CD1 4.04Å; L95-L168 HydrophobicContact CD2-CD2 4.33Å; L154-L168 HydrophobicContact CB-CD1 3.8Å; L154-L168 HydrophobicContact CD1-CD1 3.81Å; L154-L168 HydrophobicContact CG-CD1 4.48Å
169	K	36.4	Very low	70.8	Confident	277 Å²	277	107.9 Å²	107.9	100%	1.204	55%	0.548	S	S	*	.			trans	-122.8	0	165.9	-82	-168.6	179.3	-178.8	0	109.9	H167	H167-K169 PolarHBondContact O-N 2.82Å

Retrieved 169 of 169 residues in 55 ms (Link to these results)

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