G4VGZ9_SCHMA Loading...

Putative guanine nucleotide-binding protein beta 5 (G protein beta5)

AlphaFold DB , UniProt , Accession G4VGZ9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 351 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	54.8	Low	62.6	Low	223 Å²	223	95.3 Å²	95.3	100%	1.099	59%	0.589	S	S	*	*				0	-10	0	-72.6	-149.1	-80.9	0	0	114.8
2	A	54.3	Low	64.7	Low	85 Å²	85	95.4 Å²	95.4	70%	0.702	58%	0.583	S	S	*	*			trans	-92.5	-8	173.5	0	0	0	0	0	114.7	S5	A2-S5 PolarHBondContact O-OG 3.38Å
3	G	54.9	Low	66.5	Low	53 Å²	53	92.4 Å²	92.4	55%	0.546	57%	0.574	S	S	.	*	S	Bend	trans	-80.1	-38.1	-179.4	0	0	0	0	0	113.7	S5 A6 D7	G3-S5 VanDerWaalsContact C-N 3.35Å; G3-S5 PolarHBondContact O-N 3.39Å; G3-A6 PolarHBondContact O-N 3.14Å; G3-D7 PolarHBondContact O-N 3Å
4	D	56.9	Low	68.4	Low	112 Å²	112	94.9 Å²	94.9	60%	0.599	58%	0.576	S	S	*	*	H	α-helix	trans	-67.7	-32.2	-174.9	-63.3	-34	0	0	0	113	Q8	D4-Q8 WeakPolarHBondContact O-CB 3.25Å; D4-Q8 VanDerWaalsContact O-CG 3.25Å; D4-Q8 WeakPolarHBondContact O-CG 3.36Å; D4-Q8 PolarHBondContact O-N 3.43Å
5	S	58.7	Low	70.1	Confident	77 Å²	77	95.3 Å²	95.3	54%	0.538	57%	0.573	S	S	.	*	H	α-helix	trans	-72.1	-30.1	-179.3	57.2	0	0	0	0	113.5	A2 G3 G9	A2-S5 PolarHBondContact O-OG 3.38Å; G3-S5 VanDerWaalsContact C-N 3.35Å; G3-S5 PolarHBondContact O-N 3.39Å; S5-G9 PolarHBondContact O-N 3.43Å; S5-G9 VanDerWaalsContact O-N 3.14Å
6	A	61	Low	71.6	Confident	61 Å²	61	95.6 Å²	95.6	50%	0.504	57%	0.569	S	S	.	*	H	α-helix	trans	-76.4	-37.4	178.3	0	0	0	0	0	111.4	G3 G9 Q10	G3-A6 PolarHBondContact O-N 3.14Å; A6-G9 PolarHBondContact O-N 3.16Å; A6-Q10 PolarHBondContact O-N 3.48Å; A6-Q10 VanDerWaalsContact O-N 3.16Å
7	D	63.1	Low	72.9	Confident	117 Å²	117	97.8 Å²	97.8	63%	0.626	57%	0.572	S	S	*	*	H	α-helix	trans	-70.7	-40.4	176.9	-154.4	25.6	0	0	0	111	G3 G9 Q10 G11	G3-D7 PolarHBondContact O-N 3Å; D7-G9 PolarHBondContact O-N 2.98Å; D7-Q10 PolarHBondContact O-N 3.36Å; D7-G11 PolarHBondContact O-N 3.49Å
8	Q	64.1	Low	74.2	Confident	132 Å²	132	98.8 Å²	98.8	62%	0.617	57%	0.57	S	S	*	*	H	α-helix	trans	-59.3	-45.7	171	-77.5	175.7	-4.9	0	0	112.2	D4 Q10 G11 D12	D4-Q8 WeakPolarHBondContact O-CB 3.25Å; D4-Q8 VanDerWaalsContact O-CG 3.25Å; D4-Q8 WeakPolarHBondContact O-CG 3.36Å; D4-Q8 PolarHBondContact O-N 3.43Å; Q8-Q10 VanDerWaalsContact C-N 3.31Å; Q8-Q10 PolarHBondContact O-N 3.31Å; Q8-G11 PolarHBondContact O-N 2.89Å; Q8-D12 PolarHBondContact O-N 3.21Å
9	G	69.8	Low	75.2	Confident	39 Å²	39	97.5 Å²	97.5	40%	0.402	56%	0.564	S	S	.	*	H	α-helix	trans	-64.1	-32.4	178.7	0	0	0	0	0	114	S5 A6 D7 A13	S5-G9 PolarHBondContact O-N 3.43Å; S5-G9 VanDerWaalsContact O-N 3.14Å; A6-G9 PolarHBondContact O-N 3.16Å; D7-G9 PolarHBondContact O-N 2.98Å; G9-A13 WeakPolarHBondContact O-CB 3.35Å; G9-A13 PolarHBondContact O-N 3.32Å
10	Q	68.1	Low	76.2	Confident	122 Å²	122	97.6 Å²	97.6	57%	0.57	56%	0.559	S	S	*	*	H	α-helix	trans	-72.7	-40.6	173.5	-73.9	-175.4	2.3	0	0	112	A6 D7 Q8 A13 Q14	A6-Q10 PolarHBondContact O-N 3.48Å; A6-Q10 VanDerWaalsContact O-N 3.16Å; D7-Q10 PolarHBondContact O-N 3.36Å; Q8-Q10 VanDerWaalsContact C-N 3.31Å; Q8-Q10 PolarHBondContact O-N 3.31Å; Q10-A13 PolarHBondContact O-N 3.46Å; Q10-Q14 WeakPolarHBondContact O-CG 3.45Å; Q10-Q14 PolarHBondContact O-N 3.24Å; Q10-Q14 VanDerWaalsContact O-N 3.12Å
11	G	83.3	Confident	77.1	Confident	27 Å²	27	96.4 Å²	96.4	28%	0.278	56%	0.556	S	S	.	*	H	α-helix	trans	-59.6	-47.1	173.7	0	0	0	0	0	112.2	D7 Q8 A13 Q14 L15	D7-G11 PolarHBondContact O-N 3.49Å; Q8-G11 PolarHBondContact O-N 2.89Å; G11-A13 PolarHBondContact O-N 3.12Å; G11-Q14 PolarHBondContact O-N 3.07Å; G11-L15 WeakPolarHBondContact O-CG 3.49Å; G11-L15 PolarHBondContact O-N 3.22Å
12	D	86.7	Confident	79.1	Confident	97 Å²	97	90.7 Å²	90.7	52%	0.519	53%	0.529	S	S	.	.	H	α-helix	trans	-61.8	-42.4	179.2	-71	-12	0	0	0	111.9	Q8 Q14 L15 I16	Q8-D12 PolarHBondContact O-N 3.21Å; D12-Q14 PolarHBondContact O-N 3.42Å; D12-L15 PolarHBondContact O-N 3.45Å; D12-I16 VanDerWaalsContact O-CG1 3.26Å; D12-I16 WeakPolarHBondContact O-CG1 3.26Å; D12-I16 PolarHBondContact O-N 2.93Å
13	A	89.2	Confident	81	Confident	56 Å²	56	91.8 Å²	91.8	46%	0.463	52%	0.518	S	S	.	.	H	α-helix	trans	-63.8	-39.4	177.6	0	0	0	0	0	112.5	G9 Q10 G11 Q17	G9-A13 WeakPolarHBondContact O-CB 3.35Å; G9-A13 PolarHBondContact O-N 3.32Å; Q10-A13 PolarHBondContact O-N 3.46Å; G11-A13 PolarHBondContact O-N 3.12Å; A13-Q17 WeakPolarHBondContact O-CB 3.45Å; A13-Q17 PolarHBondContact O-N 3.31Å
14	Q	92.4	Very high	82.8	Confident	128 Å²	128	95.8 Å²	95.8	60%	0.598	52%	0.517	S	S	*	.	H	α-helix	trans	-64.9	-43.3	175.7	-72	174.4	15.7	0	0	111.5	Q10 G11 D12 Q17 E18	Q10-Q14 WeakPolarHBondContact O-CG 3.45Å; Q10-Q14 PolarHBondContact O-N 3.24Å; Q10-Q14 VanDerWaalsContact O-N 3.12Å; G11-Q14 PolarHBondContact O-N 3.07Å; D12-Q14 PolarHBondContact O-N 3.42Å; Q14-Q17 PolarHBondContact O-N 3.01Å; Q14-E18 WeakPolarHBondContact O-CB 3.41Å; Q14-E18 PolarHBondContact O-N 2.92Å
15	L	94.3	Very high	84.7	Confident	101 Å²	101	96.8 Å²	96.8	53%	0.529	52%	0.516	S	S	.	.	H	α-helix	trans	-64.5	-42.1	177.6	-68.8	173.5	0	0	0	112.1	G11 D12 Q17 E18 V19	G11-L15 WeakPolarHBondContact O-CG 3.49Å; G11-L15 PolarHBondContact O-N 3.22Å; D12-L15 PolarHBondContact O-N 3.45Å; L15-Q17 VanDerWaalsContact C-N 3.32Å; L15-Q17 PolarHBondContact O-N 3.33Å; L15-E18 PolarHBondContact O-N 3.16Å; L15-V19 VanDerWaalsContact O-CG2 3.3Å; L15-V19 WeakPolarHBondContact O-CG2 3.35Å; L15-V19 PolarHBondContact O-N 2.91Å
16	I	93.5	Very high	86.3	Confident	99 Å²	99	97 Å²	97	51%	0.508	51%	0.511	S	S	.	.	H	α-helix	trans	-59.9	-46	175.3	-69.1	164.9	0	0	0	110.1	D12 E18 V19 E20	D12-I16 VanDerWaalsContact O-CG1 3.26Å; D12-I16 WeakPolarHBondContact O-CG1 3.26Å; D12-I16 PolarHBondContact O-N 2.93Å; I16-E18 VanDerWaalsContact C-N 3.34Å; I16-E18 PolarHBondContact O-N 3.44Å; I16-V19 PolarHBondContact O-N 2.96Å; I16-E20 WeakPolarHBondContact O-CG 3.36Å; I16-E20 PolarHBondContact O-N 3.46Å
17	Q	94.2	Very high	87.7	Confident	134 Å²	134	99 Å²	99	63%	0.626	51%	0.509	S	S	*	.	H	α-helix	trans	-63.1	-40.6	178.6	-173.2	177.9	11	0	0	112.2	A13 Q14 L15 E20 C21	A13-Q17 WeakPolarHBondContact O-CB 3.45Å; A13-Q17 PolarHBondContact O-N 3.31Å; Q14-Q17 PolarHBondContact O-N 3.01Å; L15-Q17 VanDerWaalsContact C-N 3.32Å; L15-Q17 PolarHBondContact O-N 3.33Å; Q17-E20 PolarHBondContact O-N 2.99Å; Q17-C21 WeakPolarHBondContact O-CB 3.48Å; Q17-C21 PolarHBondContact O-N 3.14Å
18	E	96	Very high	89.2	Confident	115 Å²	115	98 Å²	98	54%	0.537	50%	0.504	S	S	.	.	H	α-helix	trans	-63.1	-46.8	175.8	-174.4	175.9	-175.3	0	0	111.3	Q14 L15 I16 E20 C21 L22	Q14-E18 WeakPolarHBondContact O-CB 3.41Å; Q14-E18 PolarHBondContact O-N 2.92Å; L15-E18 PolarHBondContact O-N 3.16Å; I16-E18 VanDerWaalsContact C-N 3.34Å; I16-E18 PolarHBondContact O-N 3.44Å; E18-E20 PolarHBondContact O-N 2.91Å; E18-C21 WeakPolarHBondContact O-CB 3.3Å; E18-C21 PolarHBondContact O-N 3.46Å; E18-C21 VanDerWaalsContact O-N 3.16Å; E18-L22 HydrophobicContact CG-CD1 4.17Å; E18-L22 WeakPolarHBondContact O-CG 3.46Å; E18-L22 PolarHBondContact O-N 3.3Å
19	V	93.6	Very high	90.6	Very high	75 Å²	75	96.1 Å²	96.1	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-59.2	-45.9	177	168.9	0	0	0	0	111.2	L15 I16 C21 L22 K23	L15-V19 VanDerWaalsContact O-CG2 3.3Å; L15-V19 WeakPolarHBondContact O-CG2 3.35Å; L15-V19 PolarHBondContact O-N 2.91Å; I16-V19 PolarHBondContact O-N 2.96Å; V19-C21 VanDerWaalsContact C-N 3.31Å; V19-C21 PolarHBondContact O-N 3.49Å; V19-L22 PolarHBondContact O-N 3.44Å; V19-K23 HydrophobicContact CG1-CD 4.28Å; V19-K23 WeakPolarHBondContact O-CB 3.39Å; V19-K23 WeakPolarHBondContact O-CG 3.42Å; V19-K23 PolarHBondContact O-N 3.35Å
20	E	94.8	Very high	91.6	Very high	98 Å²	98	97.2 Å²	97.2	46%	0.458	49%	0.487	S	S	.	.	H	α-helix	trans	-63.9	-35.6	177	-73.7	-178.5	-180	0	0	113	I16 Q17 E18 R24	I16-E20 WeakPolarHBondContact O-CG 3.36Å; I16-E20 PolarHBondContact O-N 3.46Å; Q17-E20 PolarHBondContact O-N 2.99Å; E18-E20 PolarHBondContact O-N 2.91Å; E20-R24 WeakPolarHBondContact O-CG 3.44Å; E20-R24 PolarHBondContact O-N 3.44Å; E20-R24 VanDerWaalsContact O-N 3.14Å; E20-R24 PolarHBondContact O-NE 3.18Å; E20-R24 IonicContact OE2-NH2 3.53Å
21	C	96.3	Very high	92.7	Very high	74 Å²	74	96.4 Å²	96.4	50%	0.5	49%	0.487	S	S	.	.	H	α-helix	trans	-66.9	-44.9	176	-176.9	0	0	0	0	111.1	Q17 E18 V19 R24 K25	Q17-C21 WeakPolarHBondContact O-CB 3.48Å; Q17-C21 PolarHBondContact O-N 3.14Å; E18-C21 WeakPolarHBondContact O-CB 3.3Å; E18-C21 PolarHBondContact O-N 3.46Å; E18-C21 VanDerWaalsContact O-N 3.16Å; V19-C21 VanDerWaalsContact C-N 3.31Å; V19-C21 PolarHBondContact O-N 3.49Å; C21-R24 PolarHBondContact O-N 3.35Å; C21-K25 WeakPolarHBondContact O-CB 3.37Å; C21-K25 PolarHBondContact O-N 2.97Å
22	L	96.1	Very high	93.2	Very high	102 Å²	102	102 Å²	102	53%	0.534	50%	0.503	S	S	.	.	H	α-helix	trans	-64.3	-41.9	177.4	-69.9	173.3	0	0	0	112	E18 V19 K25 L26	E18-L22 HydrophobicContact CG-CD1 4.17Å; E18-L22 WeakPolarHBondContact O-CG 3.46Å; E18-L22 PolarHBondContact O-N 3.3Å; V19-L22 PolarHBondContact O-N 3.44Å; L22-K25 PolarHBondContact O-N 2.92Å; L22-L26 WeakPolarHBondContact O-CB 3.5Å; L22-L26 PolarHBondContact O-N 2.94Å
23	K	93.1	Very high	93.5	Very high	108 Å²	108	104.2 Å²	104.2	47%	0.47	51%	0.514	S	S	.	.	H	α-helix	trans	-58.3	-50.7	174.9	-77.5	-178.2	177.4	-173.9	0	111.8	V19 K25 L26 E27	V19-K23 HydrophobicContact CG1-CD 4.28Å; V19-K23 WeakPolarHBondContact O-CB 3.39Å; V19-K23 WeakPolarHBondContact O-CG 3.42Å; V19-K23 PolarHBondContact O-N 3.35Å; K23-K25 VanDerWaalsContact C-N 3.34Å; K23-K25 PolarHBondContact O-N 3.45Å; K23-L26 PolarHBondContact O-N 2.93Å; K23-E27 WeakPolarHBondContact O-CG 3.46Å; K23-E27 PolarHBondContact O-N 3.18Å
24	R	93.8	Very high	93.5	Very high	138 Å²	138	103.7 Å²	103.7	52%	0.521	51%	0.508	S	S	.	.	H	α-helix	trans	-58.9	-44.5	177.2	-79.3	179.9	-92.8	168.9	-15.5	112.2	E20 C21 L26 E27 D28	E20-R24 WeakPolarHBondContact O-CG 3.44Å; E20-R24 PolarHBondContact O-N 3.44Å; E20-R24 VanDerWaalsContact O-N 3.14Å; E20-R24 PolarHBondContact O-NE 3.18Å; E20-R24 IonicContact OE2-NH2 3.53Å; C21-R24 PolarHBondContact O-N 3.35Å; R24-L26 VanDerWaalsContact C-N 3.32Å; R24-L26 PolarHBondContact O-N 3.45Å; R24-E27 PolarHBondContact O-N 2.88Å; R24-D28 VanDerWaalsContact O-CG 3.31Å; R24-D28 PolarHBondContact O-N 3.41Å
25	K	96	Very high	93.5	Very high	132 Å²	132	105.1 Å²	105.1	57%	0.574	52%	0.519	S	S	*	.	H	α-helix	trans	-61.2	-41.5	177.2	-173.1	178.5	179.5	-177.7	0	112	C21 L22 K23 D28 E29	C21-K25 WeakPolarHBondContact O-CB 3.37Å; C21-K25 PolarHBondContact O-N 2.97Å; L22-K25 PolarHBondContact O-N 2.92Å; K23-K25 VanDerWaalsContact C-N 3.34Å; K23-K25 PolarHBondContact O-N 3.45Å; K25-D28 PolarHBondContact O-N 3.29Å; K25-E29 WeakPolarHBondContact O-CG 3.43Å; K25-E29 PolarHBondContact O-N 3.42Å
26	L	92.5	Very high	93.3	Very high	83 Å²	83	105.4 Å²	105.4	44%	0.435	52%	0.518	S	S	.	.	H	α-helix	trans	-65.4	-44.1	177	-179.3	63.1	0	0	0	111.6	L22 K23 R24 D28 E29 R30	L22-L26 WeakPolarHBondContact O-CB 3.5Å; L22-L26 PolarHBondContact O-N 2.94Å; K23-L26 PolarHBondContact O-N 2.93Å; R24-L26 VanDerWaalsContact C-N 3.32Å; R24-L26 PolarHBondContact O-N 3.45Å; L26-D28 VanDerWaalsContact C-N 3.34Å; L26-D28 PolarHBondContact O-N 3.07Å; L26-E29 PolarHBondContact O-N 2.9Å; L26-R30 WeakPolarHBondContact O-CG 3.29Å; L26-R30 PolarHBondContact O-N 2.67Å
27	E	91.9	Very high	93.3	Very high	103 Å²	103	104.5 Å²	104.5	48%	0.481	51%	0.514	S	S	.	.	H	α-helix	trans	-59.2	-44	174.8	-73.3	170.2	-172.7	0	0	111.7	K23 R24 E29 R30 N31	K23-E27 WeakPolarHBondContact O-CG 3.46Å; K23-E27 PolarHBondContact O-N 3.18Å; R24-E27 PolarHBondContact O-N 2.88Å; E27-E29 PolarHBondContact O-N 3.44Å; E27-R30 PolarHBondContact O-N 3.33Å; E27-N31 WeakPolarHBondContact O-CB 3.34Å; E27-N31 PolarHBondContact O-N 2.83Å; E27-N31 PolarHBondContact O-ND2 3.16Å; E27-N31 VanDerWaalsContact O-ND2 3.16Å
28	D	93.6	Very high	93.2	Very high	96 Å²	96	100.2 Å²	100.2	51%	0.513	50%	0.495	S	S	.	.	H	α-helix	trans	-61.8	-43.1	176.7	-72.6	-22.1	0	0	0	112.1	R24 K25 L26 N31 K32	R24-D28 VanDerWaalsContact O-CG 3.31Å; R24-D28 PolarHBondContact O-N 3.41Å; K25-D28 PolarHBondContact O-N 3.29Å; L26-D28 VanDerWaalsContact C-N 3.34Å; L26-D28 PolarHBondContact O-N 3.07Å; D28-N31 PolarHBondContact O-N 3.14Å; D28-K32 WeakPolarHBondContact O-CG 3.47Å; D28-K32 PolarHBondContact O-N 3.49Å; D28-K32 VanDerWaalsContact O-N 3.14Å
29	E	93.6	Very high	93.1	Very high	91 Å²	91	97.4 Å²	97.4	43%	0.425	49%	0.486	S	S	.	.	H	α-helix	trans	-66.6	-40.2	176.5	-67.4	-51.6	138.8	0	0	112.4	K25 L26 E27 K32	K25-E29 WeakPolarHBondContact O-CG 3.43Å; K25-E29 PolarHBondContact O-N 3.42Å; L26-E29 PolarHBondContact O-N 2.9Å; E27-E29 PolarHBondContact O-N 3.44Å; E29-K32 VanDerWaalsContact CD-NZ 3.33Å; E29-K32 PolarHBondContact O-N 3.14Å; E29-K32 IonicContact OE1-NZ 3.3Å; E29-K32 PolarHBondContact OE1-NZ 3.04Å; E29-K32 IonicContact OE2-NZ 2.71Å; E29-K32 PolarHBondContact OE2-NZ 2.73Å
30	R	91.7	Very high	93.1	Very high	63 Å²	63	96.5 Å²	96.5	24%	0.238	48%	0.48	C	S	.	.	H	α-helix	trans	-62.7	-43.2	174.3	-73.3	173.4	176.5	178.9	-8.2	111.5	L26 E27 K32 L33 S34 D269	L26-R30 WeakPolarHBondContact O-CG 3.29Å; L26-R30 PolarHBondContact O-N 2.67Å; E27-R30 PolarHBondContact O-N 3.33Å; R30-K32 VanDerWaalsContact C-N 3.3Å; R30-K32 PolarHBondContact O-N 3.3Å; R30-L33 PolarHBondContact O-N 2.89Å; R30-L33 VanDerWaalsContact O-N 3.12Å; R30-S34 PolarHBondContact O-N 3.38Å; R30-D269 WeakPolarHBondContact CD-O 3.34Å; R30-D269 IonicContact CZ-OD1 3.97Å; R30-D269 IonicContact CZ-OD2 3.36Å; R30-D269 VanDerWaalsContact NE-CG 3.34Å; R30-D269 PolarHBondContact NE-O 3.2Å; R30-D269 IonicContact NE-OD1 2.83Å; R30-D269 IonicContact NE-OD2 3.62Å; R30-D269 PolarHBondContact NE-OD2 2.88Å; R30-D269 IonicContact NH2-OD1 3.5Å; R30-D269 PolarHBondContact NH2-OD1 3.35Å; R30-D269 IonicContact NH2-OD2 3.83Å; R30-D269 PolarHBondContact NH2-OD2 2.93Å
31	N	91.2	Very high	93	Very high	105 Å²	105	93.7 Å²	93.7	56%	0.561	47%	0.474	S	S	*	.	H	α-helix	trans	-65.8	-30.5	-179.8	-73.8	-27.5	0	0	0	112.9	E27 D28 L33 S34	E27-N31 WeakPolarHBondContact O-CB 3.34Å; E27-N31 PolarHBondContact O-N 2.83Å; E27-N31 PolarHBondContact O-ND2 3.16Å; E27-N31 VanDerWaalsContact O-ND2 3.16Å; D28-N31 PolarHBondContact O-N 3.14Å; N31-L33 PolarHBondContact O-N 3.4Å; N31-S34 WeakPolarHBondContact O-CB 3.32Å; N31-S34 PolarHBondContact O-N 2.87Å
32	K	93.2	Very high	92.9	Very high	144 Å²	144	90.4 Å²	90.4	63%	0.626	45%	0.452	S	S	*	.	H	α-helix	trans	-64	-28.5	173.5	-71.9	169.5	-167.7	173.1	0	113.2	D28 E29 R30	D28-K32 WeakPolarHBondContact O-CG 3.47Å; D28-K32 PolarHBondContact O-N 3.49Å; D28-K32 VanDerWaalsContact O-N 3.14Å; E29-K32 VanDerWaalsContact CD-NZ 3.33Å; E29-K32 PolarHBondContact O-N 3.14Å; E29-K32 IonicContact OE1-NZ 3.3Å; E29-K32 PolarHBondContact OE1-NZ 3.04Å; E29-K32 IonicContact OE2-NZ 2.71Å; E29-K32 PolarHBondContact OE2-NZ 2.73Å; R30-K32 VanDerWaalsContact C-N 3.3Å; R30-K32 PolarHBondContact O-N 3.3Å
33	L	92	Very high	92.7	Very high	143 Å²	143	92 Å²	92	75%	0.749	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	2.2	179.3	-60.1	172	0	0	0	112.5	R30 N31 D35	R30-L33 PolarHBondContact O-N 2.89Å; R30-L33 VanDerWaalsContact O-N 3.12Å; N31-L33 PolarHBondContact O-N 3.4Å; L33-D35 PolarHBondContact O-N 3.14Å
34	S	90.1	Very high	92.8	Very high	46 Å²	46	94 Å²	94	32%	0.322	47%	0.468	S	S	.	.			trans	-85.5	78.6	177.3	172	0	0	0	0	111.4	R30 N31 R270	R30-S34 PolarHBondContact O-N 3.38Å; N31-S34 WeakPolarHBondContact O-CB 3.32Å; N31-S34 PolarHBondContact O-N 2.87Å; S34-R270 VanDerWaalsContact CA-NH1 3.29Å; S34-R270 PolarHBondContact OG-NH1 2.81Å; S34-R270 PolarHBondContact OG-NH2 3.06Å
35	D	91.3	Very high	92.8	Very high	157 Å²	157	90.2 Å²	90.2	84%	0.84	46%	0.457	S	S	*	.			trans	-85.2	-41	-178.4	57.3	-11.1	0	0	0	114.2	L33	L33-D35 PolarHBondContact O-N 3.14Å
36	E	91.3	Very high	92.7	Very high	107 Å²	107	90.7 Å²	90.7	50%	0.5	47%	0.466	S	S	.	.			trans	-141.4	155	-176.6	-162.5	174.4	-175.5	0	0	112.7	T40 A41	E36-T40 HydrophobicContact CG-CG2 4.4Å; E36-A41 HydrophobicContact CG-CB 4.34Å; E36-A41 WeakPolarHBondContact OE1-CA 3.39Å; E36-A41 PolarHBondContact OE1-N 3.13Å
37	D	92.4	Very high	92.7	Very high	80 Å²	80	89.7 Å²	89.7	43%	0.428	47%	0.47	S	S	.	.			trans	-94.4	149.6	171.8	76.6	84.2	0	0	0	112.2	V39 T40 A41	D37-V39 VanDerWaalsContact C-N 3.26Å; D37-V39 PolarHBondContact O-N 2.95Å; D37-V39 WeakPolarHBondContact OD1-CA 3.19Å; D37-V39 WeakPolarHBondContact OD1-CB 3.17Å; D37-V39 PolarHBondContact OD1-N 2.91Å; D37-T40 PolarHBondContact O-N 3.25Å; D37-T40 PolarHBondContact OD1-N 3.23Å; D37-T40 PolarHBondContact OD1-OG1 3.32Å; D37-T40 WeakPolarHBondContact OD2-CB 3.41Å; D37-T40 PolarHBondContact OD2-OG1 2.98Å; D37-A41 WeakPolarHBondContact O-CB 3.06Å; D37-A41 PolarHBondContact O-N 2.92Å
38	L	93.9	Very high	92.8	Very high	44 Å²	44	86.2 Å²	86.2	23%	0.23	46%	0.456	C	S	.	.	H	α-helix	trans	-59.4	-35.3	-175.8	-179	65.2	0	0	0	113.3	S42 L263 V272 C273 V310 L311	L38-S42 VanDerWaalsContact O-CB 3.29Å; L38-S42 WeakPolarHBondContact O-CB 3.37Å; L38-S42 PolarHBondContact O-N 2.67Å; L38-S42 PolarHBondContact O-OG 3Å; L38-L263 HydrophobicContact CD2-CD2 3.88Å; L38-V272 HydrophobicContact CD2-CG2 4.34Å; L38-C273 HydrophobicContact CD2-CB 4.01Å; L38-V310 WeakPolarHBondContact CD2-O 3.35Å; L38-L311 HydrophobicContact CD1-CD2 4.24Å
39	V	92.6	Very high	92.8	Very high	57 Å²	57	85.9 Å²	85.9	35%	0.345	46%	0.459	S	S	.	.	H	α-helix	trans	-73.6	-38.6	-176	-178.6	0	0	0	0	110.1	D37 S42 Q43	D37-V39 VanDerWaalsContact C-N 3.26Å; D37-V39 PolarHBondContact O-N 2.95Å; D37-V39 WeakPolarHBondContact OD1-CA 3.19Å; D37-V39 WeakPolarHBondContact OD1-CB 3.17Å; D37-V39 PolarHBondContact OD1-N 2.91Å; V39-S42 PolarHBondContact O-N 3.48Å; V39-S42 PolarHBondContact O-OG 3.31Å; V39-S42 VanDerWaalsContact O-OG 3.11Å; V39-Q43 WeakPolarHBondContact O-CG 3.16Å; V39-Q43 PolarHBondContact O-N 3.36Å
40	T	93.5	Very high	92.5	Very high	55 Å²	55	87.5 Å²	87.5	34%	0.337	48%	0.477	S	S	.	.	H	α-helix	trans	-66.6	-47.4	173.1	-61.5	0	0	0	0	111.1	E36 D37 S42 Q43	E36-T40 HydrophobicContact CG-CG2 4.4Å; D37-T40 PolarHBondContact O-N 3.25Å; D37-T40 PolarHBondContact OD1-N 3.23Å; D37-T40 PolarHBondContact OD1-OG1 3.32Å; D37-T40 WeakPolarHBondContact OD2-CB 3.41Å; D37-T40 PolarHBondContact OD2-OG1 2.98Å; T40-S42 PolarHBondContact O-N 3.08Å; T40-S42 VanDerWaalsContact O-N 3.17Å; T40-Q43 WeakPolarHBondContact O-CB 3.24Å; T40-Q43 VanDerWaalsContact O-CG 3.29Å; T40-Q43 WeakPolarHBondContact O-CG 3.33Å; T40-Q43 PolarHBondContact O-N 2.75Å; T40-Q43 VanDerWaalsContact O-N 3.17Å
41	A	94	Very high	92.5	Very high	39 Å²	39	86.5 Å²	86.5	32%	0.322	48%	0.476	S	S	.	.	H	α-helix	trans	-59.4	-31.5	177.5	0	0	0	0	0	112.5	E36 D37 H44	E36-A41 HydrophobicContact CG-CB 4.34Å; E36-A41 WeakPolarHBondContact OE1-CA 3.39Å; E36-A41 PolarHBondContact OE1-N 3.13Å; D37-A41 WeakPolarHBondContact O-CB 3.06Å; D37-A41 PolarHBondContact O-N 2.92Å; A41-H44 PolarHBondContact O-CE1 3.22Å; A41-H44 PolarHBondContact O-ND1 3.31Å
42	S	93.9	Very high	92.5	Very high	6 Å²	6	86.9 Å²	86.9	4%	0.042	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	3.3	-177.8	70.2	0	0	0	0	115.4	L38 V39 T40 H44 L45 L311	L38-S42 VanDerWaalsContact O-CB 3.29Å; L38-S42 WeakPolarHBondContact O-CB 3.37Å; L38-S42 PolarHBondContact O-N 2.67Å; L38-S42 PolarHBondContact O-OG 3Å; V39-S42 PolarHBondContact O-N 3.48Å; V39-S42 PolarHBondContact O-OG 3.31Å; V39-S42 VanDerWaalsContact O-OG 3.11Å; T40-S42 PolarHBondContact O-N 3.08Å; T40-S42 VanDerWaalsContact O-N 3.17Å; S42-H44 PolarHBondContact O-N 3.2Å; S42-L45 WeakPolarHBondContact O-CB 3.39Å; S42-L45 PolarHBondContact O-N 3.39Å; S42-L311 PolarHBondContact OG-O 3.29Å
43	Q	91.8	Very high	92.6	Very high	135 Å²	135	81.4 Å²	81.4	63%	0.631	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.1	-176.4	-74.3	178.3	11.3	0	0	113.6	V39 T40 L45	V39-Q43 WeakPolarHBondContact O-CG 3.16Å; V39-Q43 PolarHBondContact O-N 3.36Å; T40-Q43 WeakPolarHBondContact O-CB 3.24Å; T40-Q43 VanDerWaalsContact O-CG 3.29Å; T40-Q43 WeakPolarHBondContact O-CG 3.33Å; T40-Q43 PolarHBondContact O-N 2.75Å; T40-Q43 VanDerWaalsContact O-N 3.17Å; Q43-L45 PolarHBondContact O-N 2.72Å
44	H	94.1	Very high	92.8	Very high	151 Å²	151	81.3 Å²	81.3	70%	0.699	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-13.1	179.8	67.8	-85.2	0	0	0	113.8	A41 S42	A41-H44 PolarHBondContact O-CE1 3.22Å; A41-H44 PolarHBondContact O-ND1 3.31Å; S42-H44 PolarHBondContact O-N 3.2Å
45	L	94.3	Very high	93.1	Very high	57 Å²	57	82.2 Å²	82.2	30%	0.298	45%	0.445	S	S	.	.	S	Bend	trans	-84.4	146.4	-179.8	-60	176.4	0	0	0	111.1	S42 Q43 L311 K312	S42-L45 WeakPolarHBondContact O-CB 3.39Å; S42-L45 PolarHBondContact O-N 3.39Å; Q43-L45 PolarHBondContact O-N 2.72Å; L45-L311 HydrophobicContact CD1-CB 4.5Å; L45-L311 HydrophobicContact CD1-CD1 3.42Å; L45-L311 VanDerWaalsContact CD1-CD1 3.42Å; L45-K312 WeakPolarHBondContact O-CE 3.45Å; L45-K312 PolarHBondContact O-NZ 3.29Å
46	D	94.1	Very high	93.3	Very high	142 Å²	142	80.8 Å²	80.8	76%	0.759	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-64.1	145.7	173.7	-68	-40.3	0	0	0	111.6	R294	D46-R294 PolarHBondContact O-NH2 2.83Å
47	A	93	Very high	93.6	Very high	63 Å²	63	81.2 Å²	81.2	52%	0.521	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-68.5	142.8	172.7	0	0	0	0	0	110.4
48	V	93.8	Very high	93.8	Very high	30 Å²	30	80 Å²	80	18%	0.182	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-65.7	128.1	172.7	-178.2	0	0	0	0	109	L51 R294 L295 D309 I316	V48-L51 HydrophobicContact CG1-CD2 4.36Å; V48-L51 HydrophobicContact CG1-CG 4.5Å; V48-R294 HydrophobicContact CG2-CG 3.9Å; V48-R294 VanDerWaalsContact CG2-CZ 3.48Å; V48-L295 HydrophobicContact CG1-CD2 4.08Å; V48-L295 HydrophobicContact CG2-CD2 4.36Å; V48-D309 WeakPolarHBondContact CG2-OD2 3.27Å; V48-I316 HydrophobicContact CB-CD1 3.74Å; V48-I316 HydrophobicContact CB-CG1 4.4Å; V48-I316 HydrophobicContact CG1-CD1 3.89Å; V48-I316 HydrophobicContact CG2-CD1 4.06Å
49	P	92.2	Very high	94	Very high	89 Å²	89	78 Å²	78	58%	0.578	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-64.8	157.5	176.5	27.5	-35.1	0	0	0	111.5	L51	P49-L51 PolarHBondContact O-N 3.07Å
50	P	88.3	Confident	94.2	Very high	124 Å²	124	82.3 Å²	82.3	81%	0.805	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-54.6	129.5	175.6	-25.1	33.9	0	0	0	112.2
51	L	91.6	Very high	94.3	Very high	42 Å²	42	80.7 Å²	80.7	22%	0.22	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-93.8	125.6	-177.3	-60.2	171.6	0	0	0	110.7	V48 P49 I53 L295 I307 I316 N317	V48-L51 HydrophobicContact CG1-CD2 4.36Å; V48-L51 HydrophobicContact CG1-CG 4.5Å; P49-L51 PolarHBondContact O-N 3.07Å; L51-I53 HydrophobicContact CB-CD1 4.08Å; L51-I53 HydrophobicContact CB-CG1 4.16Å; L51-I53 HydrophobicContact CD1-CD1 4.16Å; L51-I53 PolarHBondContact O-N 3.45Å; L51-L295 HydrophobicContact CD1-CD1 3.53Å; L51-L295 HydrophobicContact CD1-CD2 3.97Å; L51-L295 HydrophobicContact CD1-CG 4.42Å; L51-I307 HydrophobicContact CD1-CG2 4.21Å; L51-I316 HydrophobicContact CD1-CG2 4.34Å; L51-I316 HydrophobicContact CG-CG2 4.29Å; L51-N317 PolarHBondContact O-ND2 3.41Å
52	N	91.9	Very high	94.5	Very high	113 Å²	113	79 Å²	79	60%	0.604	40%	0.404	S	S	*	.			trans	-97.8	63.7	176	-175.8	12.4	0	0	0	111	R54	N52-R54 PolarHBondContact ND2-NH2 3.47Å; N52-R54 PolarHBondContact OD1-NE 3.29Å
53	I	95.2	Very high	94.6	Very high	29 Å²	29	85.8 Å²	85.8	15%	0.149	44%	0.435	C	S	.	.			trans	-79.3	131.4	179.2	-64.5	165.8	0	0	0	109.1	L51 F297 I307 L319 W350	L51-I53 HydrophobicContact CB-CD1 4.08Å; L51-I53 HydrophobicContact CB-CG1 4.16Å; L51-I53 HydrophobicContact CD1-CD1 4.16Å; L51-I53 PolarHBondContact O-N 3.45Å; I53-F297 HydrophobicContact CD1-CE1 4.39Å; I53-I307 HydrophobicContact CD1-CD1 3.63Å; I53-L319 HydrophobicContact CB-CD1 4.41Å; I53-L319 HydrophobicContact CB-CD2 4.16Å; I53-L319 HydrophobicContact CG2-CD1 4.01Å; I53-W350 HydrophobicContact CG2-CB 3.67Å; I53-W350 HydrophobicContact CG2-CE3 4.1Å
54	R	95.5	Very high	94.8	Very high	142 Å²	142	79.9 Å²	79.9	54%	0.536	41%	0.41	S	S	.	.			trans	-128.8	156.4	-178.1	-62.5	-175.8	-178.6	-165	-3	111.8	N52 R56 W350 A351	N52-R54 PolarHBondContact ND2-NH2 3.47Å; N52-R54 PolarHBondContact OD1-NE 3.29Å; R54-R56 PolarHBondContact O-N 3.34Å; R54-W350 WeakPolarHBondContact O-CA 3.2Å; R54-A351 PolarHBondContact N-O 2.87Å; R54-A351 VanDerWaalsContact N-O 3.15Å; R54-A351 PolarHBondContact O-N 2.79Å; R54-A351 VanDerWaalsContact O-N 3.1Å
55	I	96.3	Very high	95	Very high	64 Å²	64	75.2 Å²	75.2	33%	0.328	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	123.2	170.3	-56.3	169.6	0	0	0	108.4	R57 V58 C321 R348 W350	I55-R57 WeakPolarHBondContact CG2-O 3.28Å; I55-V58 HydrophobicContact CG2-CG2 3.7Å; I55-C321 HydrophobicContact CD1-CB 4.43Å; I55-R348 VanDerWaalsContact CD1-NH1 3.34Å; I55-R348 HydrophobicContact CG2-CB 4.49Å; I55-W350 HydrophobicContact CB-CH2 4.46Å; I55-W350 HydrophobicContact CB-CZ3 4.4Å; I55-W350 HydrophobicContact CD1-CH2 3.56Å; I55-W350 HydrophobicContact CD1-CZ2 4.07Å; I55-W350 HydrophobicContact CD1-CZ3 4.17Å; I55-W350 HydrophobicContact CG1-CD2 4.27Å; I55-W350 HydrophobicContact CG1-CE3 3.85Å; I55-W350 HydrophobicContact CG1-CH2 3.07Å; I55-W350 HydrophobicContact CG1-CZ2 3.59Å; I55-W350 HydrophobicContact CG1-CZ3 3.29Å
56	R	96.9	Very high	95.2	Very high	127 Å²	127	72.5 Å²	72.5	48%	0.479	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-32.5	173.7	-56.3	-52.4	176.3	162	1.4	112.3	R54 I349 A351	R54-R56 PolarHBondContact O-N 3.34Å; R56-I349 PolarHBondContact N-O 2.61Å; R56-A351 HydrophobicContact CG-CB 3.89Å; R56-A351 VanDerWaalsContact CZ-O 3.27Å; R56-A351 PolarHBondContact NE-O 3.3Å; R56-A351 PolarHBondContact NH2-O 3.11Å
57	R	96.8	Very high	95.4	Very high	116 Å²	116	66.8 Å²	66.8	44%	0.438	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	148.6	-179.8	-57.3	-67.2	-173.8	-96.5	0.6	110.8	I55 F93 T95 R348 I349	I55-R57 WeakPolarHBondContact CG2-O 3.28Å; R57-F93 PolarHBondContact NE-O 3.2Å; R57-F93 PolarHBondContact NH2-O 2.87Å; R57-T95 HydrophobicContact CB-CG2 3.97Å; R57-T95 HydrophobicContact CG-CG2 4.08Å; R57-R348 WeakPolarHBondContact O-CA 3.49Å; R57-I349 HydrophobicContact CB-CB 4.09Å; R57-I349 HydrophobicContact CB-CD1 4.16Å; R57-I349 HydrophobicContact CB-CG1 4.32Å; R57-I349 HydrophobicContact CG-CD1 4.47Å; R57-I349 PolarHBondContact N-O 2.63Å; R57-I349 PolarHBondContact O-N 2.59Å
58	V	97.2	Very high	95.7	Very high	55 Å²	55	64.4 Å²	64.4	33%	0.333	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	114	171.6	-175.2	0	0	0	0	107.4	I55 K60 T346 L347 R348	I55-V58 HydrophobicContact CG2-CG2 3.7Å; V58-K60 HydrophobicContact CG1-CG 3.99Å; V58-T346 HydrophobicContact CG1-CG2 4.41Å; V58-L347 CarbonylContact C-O 3.49Å; V58-L347 WeakPolarHBondContact CA-O 3.46Å; V58-R348 HydrophobicContact CG1-CG 4.35Å; V58-R348 HydrophobicContact CG2-CG 4.33Å
59	L	97.7	Very high	95.9	Very high	1 Å²	1	63 Å²	63	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	113.6	179.2	-49.8	-178.7	0	0	0	108.6	I78 W90 T95 L347 I349	L59-I78 HydrophobicContact CD1-CD1 4.1Å; L59-W90 HydrophobicContact CB-CD2 4.21Å; L59-W90 HydrophobicContact CB-CE3 3.96Å; L59-W90 HydrophobicContact CB-CH2 4.17Å; L59-W90 HydrophobicContact CB-CZ2 4.42Å; L59-W90 HydrophobicContact CB-CZ3 3.94Å; L59-W90 HydrophobicContact CD1-CB 4.11Å; L59-W90 HydrophobicContact CD1-CD2 4.06Å; L59-W90 HydrophobicContact CD1-CE3 4.41Å; L59-W90 HydrophobicContact CD1-CG 3.93Å; L59-W90 HydrophobicContact CD2-CE3 4.38Å; L59-W90 HydrophobicContact CG-CE3 4.48Å; L59-T95 HydrophobicContact CD2-CG2 3.69Å; L59-L347 HydrophobicContact CB-CB 4.08Å; L59-L347 HydrophobicContact CB-CD1 4.47Å; L59-L347 HydrophobicContact CD1-CB 4.14Å; L59-L347 HydrophobicContact CG-CB 4.35Å; L59-L347 PolarHBondContact N-O 3.38Å; L59-L347 PolarHBondContact O-N 2.88Å; L59-L347 VanDerWaalsContact O-N 3.11Å; L59-I349 HydrophobicContact CD1-CD1 4.41Å
60	K	96.9	Very high	96.1	Very high	149 Å²	149	59.8 Å²	59.8	65%	0.648	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	130.7	180	-60.9	-172.3	178	-174.1	0	110.4	V58 K97 T346	V58-K60 HydrophobicContact CG1-CG 3.99Å; K60-K97 WeakPolarHBondContact O-CE 3.21Å; K60-K97 PolarHBondContact O-NZ 2.89Å; K60-T346 HydrophobicContact CG-CG2 4.21Å
61	G	95.4	Very high	96.6	Very high	21 Å²	21	54.8 Å²	54.8	22%	0.216	26%	0.259	C	S	.	.			trans	172.3	-35.8	178.2	0	0	0	0	0	115.7	Q63 K97	G61-Q63 PolarHBondContact O-NE2 3.25Å; G61-Q63 VanDerWaalsContact O-NE2 3.13Å; G61-K97 VanDerWaalsContact CA-CE 3.46Å
62	H	97.5	Very high	96.8	Very high	3 Å²	3	52.9 Å²	52.9	1%	0.014	25%	0.249	C	C	.	.			trans	-60.5	142.2	171.7	-75.2	-56.9	0	0	0	110.3	V66 S80 S82 K86	H62-V66 HydrophobicContact CB-CG2 4.37Å; H62-S80 PolarHBondContact NE2-O 3.14Å; H62-S80 PolarHBondContact NE2-OG 3.36Å; H62-S82 WeakPolarHBondContact ND1-CB 3.06Å; H62-K86 PolarHBondContact CE1-O 2.89Å
63	Q	96.2	Very high	97	Very high	149 Å²	149	52.6 Å²	52.6	70%	0.696	25%	0.247	S	C	*	.	S	Bend	trans	-104.1	-13.2	176.7	-56.8	-60.5	-53.8	0	0	111.5	G61 D84	G61-Q63 PolarHBondContact O-NE2 3.25Å; G61-Q63 VanDerWaalsContact O-NE2 3.13Å; Q63-D84 WeakPolarHBondContact CB-OD2 3.24Å; Q63-D84 PolarHBondContact N-OD2 2.71Å
64	G	96.9	Very high	97	Very high	10 Å²	10	54.8 Å²	54.8	10%	0.103	26%	0.259	C	S	.	.	S	Bend	trans	-109.4	-179.1	169.1	0	0	0	0	0	112.6	V66 D84 T345	G64-V66 PolarHBondContact O-N 3.32Å; G64-D84 PolarHBondContact N-OD2 2.85Å; G64-T345 VanDerWaalsContact O-CB 3.3Å; G64-T345 WeakPolarHBondContact O-CB 3.44Å; G64-T345 VanDerWaalsContact O-CG2 3.28Å; G64-T345 WeakPolarHBondContact O-CG2 3.39Å
65	K	98.2	Very high	97.1	Very high	53 Å²	53	52.8 Å²	52.8	23%	0.23	25%	0.254	C	S	.	.			trans	-60.6	133.3	174.8	-59.8	172.3	-177.6	-176	0	109.9	L67 S82 Q83 W343	K65-L67 HydrophobicContact CB-CD2 4.25Å; K65-S82 CarbonylContact O-C 3.59Å; K65-S82 WeakPolarHBondContact O-CA 3.17Å; K65-S82 PolarHBondContact O-OG 3.46Å; K65-Q83 HydrophobicContact CB-CB 4.07Å; K65-Q83 VanDerWaalsContact CG-OE1 3.25Å; K65-Q83 PolarHBondContact O-N 2.83Å; K65-W343 HydrophobicContact CB-CB 4.15Å; K65-W343 HydrophobicContact CB-CG 3.91Å; K65-W343 HydrophobicContact CD-CB 4.16Å; K65-W343 HydrophobicContact CD-CD2 3.52Å; K65-W343 HydrophobicContact CD-CE3 3.8Å; K65-W343 HydrophobicContact CD-CG 3.7Å; K65-W343 HydrophobicContact CD-CZ2 4.39Å; K65-W343 HydrophobicContact CD-CZ3 4.35Å; K65-W343 HydrophobicContact CG-CB 3.89Å; K65-W343 HydrophobicContact CG-CD2 4.22Å; K65-W343 HydrophobicContact CG-CG 3.86Å; K65-W343 VanDerWaalsContact NZ-CZ3 3.29Å
66	V	98.4	Very high	97	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	132.5	168	-175.6	0	0	0	0	107.7	H62 G64 S81 S327 S342 L347	H62-V66 HydrophobicContact CB-CG2 4.37Å; G64-V66 PolarHBondContact O-N 3.32Å; V66-S81 WeakPolarHBondContact CA-O 3.46Å; V66-S327 WeakPolarHBondContact O-CB 3.07Å; V66-S327 PolarHBondContact O-OG 3.38Å; V66-S342 WeakPolarHBondContact CB-O 3.28Å; V66-S342 PolarHBondContact N-O 3.39Å; V66-L347 HydrophobicContact CG1-CD1 4.19Å; V66-L347 HydrophobicContact CG1-CD2 4.22Å; V66-L347 HydrophobicContact CG1-CG 4.09Å; V66-L347 HydrophobicContact CG2-CD1 3.84Å; V66-L347 HydrophobicContact CG2-CG 4.27Å
67	L	98.3	Very high	97.1	Very high	22 Å²	22	49.5 Å²	49.5	12%	0.115	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-41.7	-175.7	-61.7	179.6	0	0	0	112.2	K65 S81 Q83 W107 V108 M109	K65-L67 HydrophobicContact CB-CD2 4.25Å; L67-S81 PolarHBondContact N-O 3.08Å; L67-Q83 HydrophobicContact CD1-CB 4.3Å; L67-W107 HydrophobicContact CD1-CB 4.36Å; L67-W107 HydrophobicContact CD1-CD2 4.46Å; L67-W107 HydrophobicContact CD1-CE3 3.75Å; L67-W107 HydrophobicContact CD1-CZ3 4.48Å; L67-W107 HydrophobicContact CD2-CE3 4.14Å; L67-W107 HydrophobicContact CD2-CZ3 4.06Å; L67-V108 WeakPolarHBondContact CD1-O 3.11Å; L67-M109 HydrophobicContact CD1-CG 4.14Å
68	S	97.8	Very high	97.1	Very high	13 Å²	13	44 Å²	44	9%	0.091	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	160	177.7	-178	0	0	0	0	111.9	S80 S81 M109 C111	S68-S80 WeakPolarHBondContact O-CA 2.93Å; S68-S81 WeakPolarHBondContact CB-OG 3.45Å; S68-S81 PolarHBondContact N-OG 3.37Å; S68-S81 PolarHBondContact O-N 3.43Å; S68-S81 PolarHBondContact O-OG 3.36Å; S68-M109 WeakPolarHBondContact CB-O 3.34Å; S68-C111 PolarHBondContact O-SG 3.27Å
69	L	97.8	Very high	97.2	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	150.8	175.8	71.3	92.1	0	0	0	110.8	I78 V79 A328 R330 C339 G341 L347	L69-I78 HydrophobicContact CB-CG2 4.49Å; L69-V79 CarbonylContact C-O 3.46Å; L69-V79 VanDerWaalsContact CA-O 3.23Å; L69-V79 WeakPolarHBondContact CA-O 3.45Å; L69-A328 HydrophobicContact CD2-CB 3.76Å; L69-A328 HydrophobicContact CG-CB 3.86Å; L69-R330 HydrophobicContact CD1-CB 3.6Å; L69-R330 HydrophobicContact CD1-CG 3.48Å; L69-R330 VanDerWaalsContact CD1-CG 3.48Å; L69-R330 HydrophobicContact CG-CG 4.33Å; L69-C339 HydrophobicContact CD1-CB 4.04Å; L69-C339 HydrophobicContact CD2-CB 4.47Å; L69-G341 VanDerWaalsContact CD2-N 3.32Å; L69-L347 HydrophobicContact CB-CD2 3.95Å; L69-L347 HydrophobicContact CD2-CD2 3.99Å
70	S	97.8	Very high	97.2	Very high	22 Å²	22	41.3 Å²	41.3	15%	0.154	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	137.5	172.1	-174.3	0	0	0	0	110.1	I78 V79 Y113	S70-I78 WeakPolarHBondContact O-CA 3.31Å; S70-V79 PolarHBondContact N-O 3.18Å; S70-V79 PolarHBondContact O-N 3.19Å; S70-Y113 PolarHBondContact OG-N 3.09Å
71	W	97.9	Very high	97.3	Very high	18 Å²	18	34.2 Å²	34.2	7%	0.068	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	148.8	169.2	-72	98.2	0	0	0	110.7	I78 Y113 R330 V331 P333 C339 I349	W71-I78 HydrophobicContact CD2-CD1 4.29Å; W71-I78 HydrophobicContact CD2-CG1 3.74Å; W71-I78 HydrophobicContact CE3-CD1 3.97Å; W71-I78 HydrophobicContact CE3-CG1 3.38Å; W71-I78 HydrophobicContact CH2-CD1 3.61Å; W71-I78 HydrophobicContact CH2-CG1 4.01Å; W71-I78 HydrophobicContact CZ2-CD1 3.93Å; W71-I78 HydrophobicContact CZ2-CG1 4.31Å; W71-I78 HydrophobicContact CZ3-CD1 3.62Å; W71-I78 HydrophobicContact CZ3-CG1 3.53Å; W71-Y113 WeakPolarHBondContact O-CB 3.5Å; W71-R330 PolarHBondContact NE1-O 3.11Å; W71-V331 VanDerWaalsContact CD1-O 3.31Å; W71-P333 HydrophobicContact CB-CG 4.15Å; W71-C339 HydrophobicContact CZ2-CB 3.58Å; W71-I349 HydrophobicContact CH2-CD1 4.21Å; W71-I349 HydrophobicContact CH2-CG2 4.29Å
72	S	97.1	Very high	97.4	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.014	16%	0.161	C	C	.	.			trans	-78.1	150.6	160.1	176.4	0	0	0	0	109.9	D74 K75 H77 P333	S72-D74 WeakPolarHBondContact CB-OD1 3.19Å; S72-D74 WeakPolarHBondContact CB-OD2 3.41Å; S72-D74 PolarHBondContact O-N 3.23Å; S72-D74 VanDerWaalsContact O-N 3.17Å; S72-D74 PolarHBondContact OG-N 2.7Å; S72-D74 PolarHBondContact OG-OD1 3.37Å; S72-D74 PolarHBondContact OG-OD2 3.12Å; S72-K75 PolarHBondContact O-N 2.82Å; S72-K75 VanDerWaalsContact O-N 3.15Å; S72-H77 WeakPolarHBondContact CB-O 3.35Å; S72-H77 PolarHBondContact N-O 2.68Å; S72-P333 VanDerWaalsContact O-CG 3.31Å; S72-P333 WeakPolarHBondContact O-CG 3.41Å
73	L	95.8	Very high	97.4	Very high	107 Å²	107	35.6 Å²	35.6	56%	0.56	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-10.5	176.9	-65.4	-171.5	0	0	0	113.8	K75 P115 P333	L73-K75 PolarHBondContact O-N 2.99Å; L73-P115 HydrophobicContact CD1-CB 4.09Å; L73-P115 WeakPolarHBondContact CD1-O 3.35Å; L73-P333 HydrophobicContact CD2-CB 4.25Å; L73-P333 HydrophobicContact CD2-CG 4.18Å
74	D	95.6	Very high	97.4	Very high	75 Å²	75	30.9 Å²	30.9	40%	0.401	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-2.8	170.7	63.8	34.7	0	0	0	114.5	S72 R76 H77	S72-D74 WeakPolarHBondContact CB-OD1 3.19Å; S72-D74 WeakPolarHBondContact CB-OD2 3.41Å; S72-D74 PolarHBondContact O-N 3.23Å; S72-D74 VanDerWaalsContact O-N 3.17Å; S72-D74 PolarHBondContact OG-N 2.7Å; S72-D74 PolarHBondContact OG-OD1 3.37Å; S72-D74 PolarHBondContact OG-OD2 3.12Å; D74-R76 PolarHBondContact O-N 3.04Å; D74-R76 WeakPolarHBondContact OD1-CA 3.18Å; D74-R76 PolarHBondContact OD1-N 3.22Å; D74-H77 VanDerWaalsContact CG-ND1 3.3Å; D74-H77 PolarHBondContact OD1-N 2.76Å; D74-H77 IonicContact OD1-ND1 2.77Å; D74-H77 PolarHBondContact OD1-ND1 3.32Å; D74-H77 IonicContact OD2-CE1 2.79Å; D74-H77 IonicContact OD2-CG 3.88Å; D74-H77 IonicContact OD2-ND1 3.57Å; D74-H77 PolarHBondContact OD2-ND1 2.59Å
75	K	95.9	Very high	97.4	Very high	100 Å²	100	30.5 Å²	30.5	44%	0.435	15%	0.147	S	C	.	.	S	Bend	trans	70	6.4	176.2	-47.2	151.5	-176.6	-174.3	0	114.5	S72 L73 P333 D334	S72-K75 PolarHBondContact O-N 2.82Å; S72-K75 VanDerWaalsContact O-N 3.15Å; L73-K75 PolarHBondContact O-N 2.99Å; K75-P333 HydrophobicContact CG-CB 4.3Å; K75-D334 HydrophobicContact CD-CB 3.82Å; K75-D334 HydrophobicContact CG-CB 3.99Å
76	R	95.7	Very high	97.3	Very high	96 Å²	96	31.3 Å²	31.3	36%	0.362	15%	0.151	S	C	.	.	S	Bend	trans	-124.4	-47.4	-172.3	178.8	175.4	179.3	-175.8	-6.3	112	D74 D91 G92 F93	D74-R76 PolarHBondContact O-N 3.04Å; D74-R76 WeakPolarHBondContact OD1-CA 3.18Å; D74-R76 PolarHBondContact OD1-N 3.22Å; R76-D91 WeakPolarHBondContact CG-OD1 3.5Å; R76-D91 IonicContact CZ-OD1 3.59Å; R76-D91 IonicContact CZ-OD2 2.63Å; R76-D91 VanDerWaalsContact CZ-OD2 3.25Å; R76-D91 IonicContact NE-OD1 3.18Å; R76-D91 PolarHBondContact NE-OD1 3.31Å; R76-D91 IonicContact NE-OD2 2.76Å; R76-D91 PolarHBondContact NE-OD2 3.17Å; R76-D91 VanDerWaalsContact NE-OD2 3.13Å; R76-D91 IonicContact NH2-OD1 3.38Å; R76-D91 IonicContact NH2-OD2 3.13Å; R76-D91 PolarHBondContact NH2-OD2 3.32Å; R76-G92 WeakPolarHBondContact O-CA 3.49Å; R76-G92 PolarHBondContact O-N 2.89Å; R76-F93 HydrophobicContact CB-CD1 4.37Å; R76-F93 HydrophobicContact CB-CE1 4.38Å; R76-F93 HydrophobicContact CG-CB 4.25Å; R76-F93 HydrophobicContact CG-CD1 3.97Å; R76-F93 HydrophobicContact CG-CD2 4.46Å; R76-F93 HydrophobicContact CG-CE1 4.46Å; R76-F93 HydrophobicContact CG-CG 3.98Å
77	H	97.5	Very high	97.2	Very high	27 Å²	27	31.3 Å²	31.3	13%	0.125	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	146.1	-175.1	-59.5	93.8	0	0	0	111.6	S72 D74 W90 E98 Y113	S72-H77 WeakPolarHBondContact CB-O 3.35Å; S72-H77 PolarHBondContact N-O 2.68Å; D74-H77 VanDerWaalsContact CG-ND1 3.3Å; D74-H77 PolarHBondContact OD1-N 2.76Å; D74-H77 IonicContact OD1-ND1 2.77Å; D74-H77 PolarHBondContact OD1-ND1 3.32Å; D74-H77 IonicContact OD2-CE1 2.79Å; D74-H77 IonicContact OD2-CG 3.88Å; D74-H77 IonicContact OD2-ND1 3.57Å; D74-H77 PolarHBondContact OD2-ND1 2.59Å; H77-W90 CarbonylContact C-O 3.56Å; H77-W90 WeakPolarHBondContact CA-O 3.38Å; H77-E98 IonicContact CD2-OE1 3.99Å; H77-E98 IonicContact CD2-OE2 3.75Å; H77-E98 PolarHBondContact CD2-OE2 3.15Å; H77-E98 VanDerWaalsContact CD2-OE2 3.24Å; H77-E98 IonicContact NE2-OE1 3.25Å; H77-E98 PolarHBondContact NE2-OE1 3.25Å; H77-E98 IonicContact NE2-OE2 2.71Å; H77-E98 PolarHBondContact NE2-OE2 2.95Å; H77-Y113 HydrophobicContact CB-CE2 4.16Å
78	I	98.1	Very high	97.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	135.1	179.2	-59.6	162.8	0	0	0	107.1	L59 L69 S70 W71 V89 W90 C339 I349	L59-I78 HydrophobicContact CD1-CD1 4.1Å; L69-I78 HydrophobicContact CB-CG2 4.49Å; S70-I78 WeakPolarHBondContact O-CA 3.31Å; W71-I78 HydrophobicContact CD2-CD1 4.29Å; W71-I78 HydrophobicContact CD2-CG1 3.74Å; W71-I78 HydrophobicContact CE3-CD1 3.97Å; W71-I78 HydrophobicContact CE3-CG1 3.38Å; W71-I78 HydrophobicContact CH2-CD1 3.61Å; W71-I78 HydrophobicContact CH2-CG1 4.01Å; W71-I78 HydrophobicContact CZ2-CD1 3.93Å; W71-I78 HydrophobicContact CZ2-CG1 4.31Å; W71-I78 HydrophobicContact CZ3-CD1 3.62Å; W71-I78 HydrophobicContact CZ3-CG1 3.53Å; I78-V89 CarbonylContact O-C 3.57Å; I78-V89 WeakPolarHBondContact O-CA 3.34Å; I78-W90 PolarHBondContact N-O 3.08Å; I78-W90 VanDerWaalsContact O-CD1 3.3Å; I78-W90 PolarHBondContact O-N 3.43Å; I78-C339 HydrophobicContact CD1-CB 4.37Å; I78-I349 HydrophobicContact CD1-CD1 3.7Å; I78-I349 HydrophobicContact CD1-CG1 4.17Å
79	V	98.1	Very high	97.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	139.2	163	64.8	0	0	0	0	108.8	L69 S70 I87 L88 V89 C111 Y113 I120	L69-V79 CarbonylContact C-O 3.46Å; L69-V79 VanDerWaalsContact CA-O 3.23Å; L69-V79 WeakPolarHBondContact CA-O 3.45Å; S70-V79 PolarHBondContact N-O 3.18Å; S70-V79 PolarHBondContact O-N 3.19Å; V79-I87 HydrophobicContact CG2-CG2 3.52Å; V79-L88 WeakPolarHBondContact CA-O 3.42Å; V79-V89 HydrophobicContact CB-CG2 4.48Å; V79-V89 HydrophobicContact CG2-CG2 4.22Å; V79-C111 HydrophobicContact CG1-CB 4.34Å; V79-C111 HydrophobicContact CG2-CB 4.21Å; V79-Y113 HydrophobicContact CB-CD2 3.91Å; V79-Y113 HydrophobicContact CB-CE2 4.26Å; V79-Y113 HydrophobicContact CG1-CD2 3.79Å; V79-Y113 HydrophobicContact CG1-CG 4.46Å; V79-I120 HydrophobicContact CB-CG2 4.27Å; V79-I120 HydrophobicContact CG2-CB 4.47Å; V79-I120 HydrophobicContact CG2-CD1 4.25Å; V79-I120 HydrophobicContact CG2-CG2 4.15Å
80	S	98.5	Very high	97.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	145.3	171.5	66	0	0	0	0	112.6	H62 S68 I87 L88 W90 L347	H62-S80 PolarHBondContact NE2-O 3.14Å; H62-S80 PolarHBondContact NE2-OG 3.36Å; S68-S80 WeakPolarHBondContact O-CA 2.93Å; S80-I87 WeakPolarHBondContact O-CA 3.48Å; S80-L88 PolarHBondContact N-O 3.16Å; S80-L88 PolarHBondContact O-N 2.53Å; S80-W90 PolarHBondContact OG-NE1 2.88Å; S80-L347 WeakPolarHBondContact OG-CD1 3.4Å
81	S	98.2	Very high	97.1	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	153.8	-178.1	50.8	0	0	0	0	111.2	V66 L67 S68 V108 C111	V66-S81 WeakPolarHBondContact CA-O 3.46Å; L67-S81 PolarHBondContact N-O 3.08Å; S68-S81 WeakPolarHBondContact CB-OG 3.45Å; S68-S81 PolarHBondContact N-OG 3.37Å; S68-S81 PolarHBondContact O-N 3.43Å; S68-S81 PolarHBondContact O-OG 3.36Å; S81-V108 VanDerWaalsContact CB-O 3.31Å; S81-V108 WeakPolarHBondContact CB-O 3.34Å; S81-V108 PolarHBondContact OG-O 2.83Å; S81-C111 PolarHBondContact OG-SG 3.46Å
82	S	98.2	Very high	96.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	158.2	-170.5	162.2	0	0	0	0	112.9	H62 K65 D84 G85 K86 V108	H62-S82 WeakPolarHBondContact ND1-CB 3.06Å; K65-S82 CarbonylContact O-C 3.59Å; K65-S82 WeakPolarHBondContact O-CA 3.17Å; K65-S82 PolarHBondContact O-OG 3.46Å; S82-D84 WeakPolarHBondContact CB-OD1 3.48Å; S82-D84 PolarHBondContact O-N 3.38Å; S82-D84 PolarHBondContact OG-N 3.24Å; S82-D84 PolarHBondContact OG-OD1 3.33Å; S82-G85 PolarHBondContact O-N 2.84Å; S82-K86 PolarHBondContact N-O 3.41Å; S82-V108 PolarHBondContact O-N 3.39Å
83	Q	97.9	Very high	96.8	Very high	52 Å²	52	33.6 Å²	33.6	24%	0.243	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-32.1	173.9	-174.2	-172.2	-2.7	0	0	112.9	K65 L67 G85 T106 W107	K65-Q83 HydrophobicContact CB-CB 4.07Å; K65-Q83 VanDerWaalsContact CG-OE1 3.25Å; K65-Q83 PolarHBondContact O-N 2.83Å; L67-Q83 HydrophobicContact CD1-CB 4.3Å; Q83-G85 PolarHBondContact O-N 2.85Å; Q83-T106 CarbonylContact O-C 3.55Å; Q83-T106 WeakPolarHBondContact O-CA 3.31Å; Q83-T106 VanDerWaalsContact O-CB 3.29Å; Q83-T106 WeakPolarHBondContact O-CB 3.27Å; Q83-W107 HydrophobicContact CG-CD2 3.76Å; Q83-W107 HydrophobicContact CG-CE3 4.27Å; Q83-W107 HydrophobicContact CG-CG 4.07Å; Q83-W107 HydrophobicContact CG-CZ2 4.07Å; Q83-W107 VanDerWaalsContact NE2-CZ2 3.3Å; Q83-W107 PolarHBondContact O-N 3.26Å
84	D	95.8	Very high	96.8	Very high	50 Å²	50	32.1 Å²	32.1	27%	0.267	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	3.8	-178.5	65.7	-3.1	0	0	0	114.2	Q63 G64 S82 K86	Q63-D84 WeakPolarHBondContact CB-OD2 3.24Å; Q63-D84 PolarHBondContact N-OD2 2.71Å; G64-D84 PolarHBondContact N-OD2 2.85Å; S82-D84 WeakPolarHBondContact CB-OD1 3.48Å; S82-D84 PolarHBondContact O-N 3.38Å; S82-D84 PolarHBondContact OG-N 3.24Å; S82-D84 PolarHBondContact OG-OD1 3.33Å; D84-K86 VanDerWaalsContact C-N 3.33Å; D84-K86 WeakPolarHBondContact OD1-CB 3.38Å; D84-K86 PolarHBondContact OD1-N 2.71Å
85	G	96.1	Very high	96.8	Very high	2 Å²	2	31.2 Å²	31.2	2%	0.021	15%	0.149	C	C	.	.	S	Bend	trans	85.9	2.9	-178.7	0	0	0	0	0	114	S82 Q83 M103 T105	S82-G85 PolarHBondContact O-N 2.84Å; Q83-G85 PolarHBondContact O-N 2.85Å; G85-M103 WeakPolarHBondContact O-CB 3.26Å; G85-M103 PolarHBondContact O-N 2.86Å; G85-T105 WeakPolarHBondContact CA-O 3.37Å
86	K	96.7	Very high	96.8	Very high	70 Å²	70	28.8 Å²	28.8	30%	0.304	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	143.7	-179.6	-64.4	-175.5	178.1	179	0	112.4	H62 S82 D84 I101	H62-K86 PolarHBondContact CE1-O 2.89Å; S82-K86 PolarHBondContact N-O 3.41Å; D84-K86 VanDerWaalsContact C-N 3.33Å; D84-K86 WeakPolarHBondContact OD1-CB 3.38Å; D84-K86 PolarHBondContact OD1-N 2.71Å; K86-I101 WeakPolarHBondContact CA-O 3.42Å
87	I	96.9	Very high	96.8	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	129.6	168.3	-58.6	150.2	0	0	0	107	V79 S80 I101 M103 V108 I120 C122	V79-I87 HydrophobicContact CG2-CG2 3.52Å; S80-I87 WeakPolarHBondContact O-CA 3.48Å; I87-I101 HydrophobicContact CB-CB 4.35Å; I87-I101 HydrophobicContact CD1-CG2 4.38Å; I87-I101 PolarHBondContact N-O 3.46Å; I87-I101 PolarHBondContact O-N 2.97Å; I87-M103 HydrophobicContact CD1-CG 3.76Å; I87-M103 HydrophobicContact CD1-SD 3.75Å; I87-V108 HydrophobicContact CD1-CG1 4.33Å; I87-V108 HydrophobicContact CG1-CG1 4.15Å; I87-I120 HydrophobicContact CG2-CD1 3.98Å; I87-C122 HydrophobicContact CD1-CB 3.57Å; I87-C122 WeakPolarHBondContact CD1-SG 3.5Å; I87-C122 HydrophobicContact CG1-CB 4.31Å
88	L	97.2	Very high	96.5	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.7	179.3	-64.3	-179.7	0	0	0	108.7	V79 S80 W90 K97 Y99 S100	V79-L88 WeakPolarHBondContact CA-O 3.42Å; S80-L88 PolarHBondContact N-O 3.16Å; S80-L88 PolarHBondContact O-N 2.53Å; L88-W90 HydrophobicContact CB-CD2 4.33Å; L88-W90 VanDerWaalsContact CB-CE2 3.47Å; L88-W90 HydrophobicContact CB-CZ2 3.61Å; L88-W90 VanDerWaalsContact CB-NE1 3.35Å; L88-W90 HydrophobicContact CD1-CH2 3.58Å; L88-W90 HydrophobicContact CD1-CZ2 3.24Å; L88-W90 HydrophobicContact CG-CZ2 4.04Å; L88-W90 VanDerWaalsContact O-CD1 3.32Å; L88-W90 PolarHBondContact O-NE1 2.82Å; L88-K97 HydrophobicContact CD1-CD 4.48Å; L88-Y99 WeakPolarHBondContact CA-O 3.41Å; L88-S100 VanDerWaalsContact CD2-OG 3.24Å; L88-S100 WeakPolarHBondContact CD2-OG 3.49Å
89	V	97.1	Very high	96.3	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.006	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	126	167.6	-178.1	0	0	0	0	107.2	I78 V79 E98 Y99 Y113 I120 L134	I78-V89 CarbonylContact O-C 3.57Å; I78-V89 WeakPolarHBondContact O-CA 3.34Å; V79-V89 HydrophobicContact CB-CG2 4.48Å; V79-V89 HydrophobicContact CG2-CG2 4.22Å; V89-E98 PolarHBondContact O-N 2.99Å; V89-Y99 HydrophobicContact CB-CD2 3.94Å; V89-Y99 HydrophobicContact CB-CG 4.45Å; V89-Y99 HydrophobicContact CG1-CD2 4.14Å; V89-Y99 HydrophobicContact CG2-CD2 4.27Å; V89-Y99 PolarHBondContact N-O 2.91Å; V89-Y99 PolarHBondContact O-N 3.34Å; V89-Y113 HydrophobicContact CG1-CE2 4.2Å; V89-I120 HydrophobicContact CG2-CD1 4.18Å; V89-L134 HydrophobicContact CG1-CD1 4.43Å; V89-L134 HydrophobicContact CG2-CD1 4.24Å; V89-L134 HydrophobicContact CG2-CD2 4.32Å
90	W	97.6	Very high	96.1	Very high	1 Å²	1	39.1 Å²	39.1	0%	0.004	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	145	-173.1	-47.4	82	0	0	0	109.6	L59 H77 I78 S80 L88 S96 K97 L347	L59-W90 HydrophobicContact CB-CD2 4.21Å; L59-W90 HydrophobicContact CB-CE3 3.96Å; L59-W90 HydrophobicContact CB-CH2 4.17Å; L59-W90 HydrophobicContact CB-CZ2 4.42Å; L59-W90 HydrophobicContact CB-CZ3 3.94Å; L59-W90 HydrophobicContact CD1-CB 4.11Å; L59-W90 HydrophobicContact CD1-CD2 4.06Å; L59-W90 HydrophobicContact CD1-CE3 4.41Å; L59-W90 HydrophobicContact CD1-CG 3.93Å; L59-W90 HydrophobicContact CD2-CE3 4.38Å; L59-W90 HydrophobicContact CG-CE3 4.48Å; H77-W90 CarbonylContact C-O 3.56Å; H77-W90 WeakPolarHBondContact CA-O 3.38Å; I78-W90 PolarHBondContact N-O 3.08Å; I78-W90 VanDerWaalsContact O-CD1 3.3Å; I78-W90 PolarHBondContact O-N 3.43Å; S80-W90 PolarHBondContact OG-NE1 2.88Å; L88-W90 HydrophobicContact CB-CD2 4.33Å; L88-W90 VanDerWaalsContact CB-CE2 3.47Å; L88-W90 HydrophobicContact CB-CZ2 3.61Å; L88-W90 VanDerWaalsContact CB-NE1 3.35Å; L88-W90 HydrophobicContact CD1-CH2 3.58Å; L88-W90 HydrophobicContact CD1-CZ2 3.24Å; L88-W90 HydrophobicContact CG-CZ2 4.04Å; L88-W90 VanDerWaalsContact O-CD1 3.32Å; L88-W90 PolarHBondContact O-NE1 2.82Å; W90-S96 WeakPolarHBondContact CA-O 3.32Å; W90-K97 HydrophobicContact CE3-CG 3.73Å; W90-K97 HydrophobicContact CH2-CD 4.47Å; W90-K97 HydrophobicContact CH2-CG 4.27Å; W90-K97 HydrophobicContact CZ3-CD 4.15Å; W90-K97 HydrophobicContact CZ3-CG 3.56Å; W90-L347 HydrophobicContact CZ2-CD1 4.17Å
91	D	96.7	Very high	95.9	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.016	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	107.6	152.5	172.1	-1.6	0	0	0	108.2	R76 F93 T94 T95 S96 E98	R76-D91 WeakPolarHBondContact CG-OD1 3.5Å; R76-D91 IonicContact CZ-OD1 3.59Å; R76-D91 IonicContact CZ-OD2 2.63Å; R76-D91 VanDerWaalsContact CZ-OD2 3.25Å; R76-D91 IonicContact NE-OD1 3.18Å; R76-D91 PolarHBondContact NE-OD1 3.31Å; R76-D91 IonicContact NE-OD2 2.76Å; R76-D91 PolarHBondContact NE-OD2 3.17Å; R76-D91 VanDerWaalsContact NE-OD2 3.13Å; R76-D91 IonicContact NH2-OD1 3.38Å; R76-D91 IonicContact NH2-OD2 3.13Å; R76-D91 PolarHBondContact NH2-OD2 3.32Å; D91-F93 PolarHBondContact O-N 3.35Å; D91-F93 WeakPolarHBondContact OD1-CB 3.2Å; D91-F93 PolarHBondContact OD1-N 3.04Å; D91-T94 PolarHBondContact OD1-N 2.93Å; D91-T94 WeakPolarHBondContact OD2-CB 3.41Å; D91-T94 WeakPolarHBondContact OD2-CG2 3.12Å; D91-T94 PolarHBondContact OD2-OG1 2.96Å; D91-T95 WeakPolarHBondContact O-CA 3.19Å; D91-T95 PolarHBondContact O-N 3.06Å; D91-S96 WeakPolarHBondContact CB-OG 3.06Å; D91-S96 PolarHBondContact N-O 2.88Å; D91-E98 HydrophobicContact CB-CG 4.45Å
92	G	94.5	Very high	95.7	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.01	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.1	-177.9	0	0	0	0	0	113.9	R76 I349	R76-G92 WeakPolarHBondContact O-CA 3.49Å; R76-G92 PolarHBondContact O-N 2.89Å; G92-I349 WeakPolarHBondContact O-CD1 3.09Å
93	F	94.7	Very high	95.5	Very high	116 Å²	116	43.4 Å²	43.4	51%	0.509	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-44.4	-175.8	-77.9	26.2	0	0	0	111.3	R57 R76 D91	R57-F93 PolarHBondContact NE-O 3.2Å; R57-F93 PolarHBondContact NH2-O 2.87Å; R76-F93 HydrophobicContact CB-CD1 4.37Å; R76-F93 HydrophobicContact CB-CE1 4.38Å; R76-F93 HydrophobicContact CG-CB 4.25Å; R76-F93 HydrophobicContact CG-CD1 3.97Å; R76-F93 HydrophobicContact CG-CD2 4.46Å; R76-F93 HydrophobicContact CG-CE1 4.46Å; R76-F93 HydrophobicContact CG-CG 3.98Å; D91-F93 PolarHBondContact O-N 3.35Å; D91-F93 WeakPolarHBondContact OD1-CB 3.2Å; D91-F93 PolarHBondContact OD1-N 3.04Å
94	T	95.8	Very high	95.1	Very high	76 Å²	76	46.4 Å²	46.4	47%	0.466	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-12.9	-179.4	69.6	0	0	0	0	113.4	D91 S96	D91-T94 PolarHBondContact OD1-N 2.93Å; D91-T94 WeakPolarHBondContact OD2-CB 3.41Å; D91-T94 WeakPolarHBondContact OD2-CG2 3.12Å; D91-T94 PolarHBondContact OD2-OG1 2.96Å; T94-S96 PolarHBondContact O-N 2.89Å; T94-S96 PolarHBondContact OG1-N 2.94Å; T94-S96 PolarHBondContact OG1-OG 3.43Å; T94-S96 VanDerWaalsContact OG1-OG 3.1Å
95	T	95.5	Very high	95	Very high	56 Å²	56	45.3 Å²	45.3	34%	0.344	25%	0.248	S	C	.	.			trans	65.4	13	-174.2	72.2	0	0	0	0	114.9	R57 L59 D91	R57-T95 HydrophobicContact CB-CG2 3.97Å; R57-T95 HydrophobicContact CG-CG2 4.08Å; L59-T95 HydrophobicContact CD2-CG2 3.69Å; D91-T95 WeakPolarHBondContact O-CA 3.19Å; D91-T95 PolarHBondContact O-N 3.06Å
96	S	96.1	Very high	95.1	Very high	49 Å²	49	48.8 Å²	48.8	34%	0.343	27%	0.269	S	S	.	.			trans	-70.1	149.9	175.2	67.9	0	0	0	0	110.9	W90 D91 T94	W90-S96 WeakPolarHBondContact CA-O 3.32Å; D91-S96 WeakPolarHBondContact CB-OG 3.06Å; D91-S96 PolarHBondContact N-O 2.88Å; T94-S96 PolarHBondContact O-N 2.89Å; T94-S96 PolarHBondContact OG1-N 2.94Å; T94-S96 PolarHBondContact OG1-OG 3.43Å; T94-S96 VanDerWaalsContact OG1-OG 3.1Å
97	K	95.4	Very high	95.1	Very high	107 Å²	107	49.2 Å²	49.2	47%	0.465	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	113.9	169.8	-60	176.4	-175.5	73.7	0	106.6	K60 G61 L88 W90	K60-K97 WeakPolarHBondContact O-CE 3.21Å; K60-K97 PolarHBondContact O-NZ 2.89Å; G61-K97 VanDerWaalsContact CA-CE 3.46Å; L88-K97 HydrophobicContact CD1-CD 4.48Å; W90-K97 HydrophobicContact CE3-CG 3.73Å; W90-K97 HydrophobicContact CH2-CD 4.47Å; W90-K97 HydrophobicContact CH2-CG 4.27Å; W90-K97 HydrophobicContact CZ3-CD 4.15Å; W90-K97 HydrophobicContact CZ3-CG 3.56Å
98	E	92.7	Very high	95.1	Very high	87 Å²	87	49.2 Å²	49.2	41%	0.407	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	-43	178.7	-60.2	-161	149.2	0	0	110.8	H77 V89 D91	H77-E98 IonicContact CD2-OE1 3.99Å; H77-E98 IonicContact CD2-OE2 3.75Å; H77-E98 PolarHBondContact CD2-OE2 3.15Å; H77-E98 VanDerWaalsContact CD2-OE2 3.24Å; H77-E98 IonicContact NE2-OE1 3.25Å; H77-E98 PolarHBondContact NE2-OE1 3.25Å; H77-E98 IonicContact NE2-OE2 2.71Å; H77-E98 PolarHBondContact NE2-OE2 2.95Å; V89-E98 PolarHBondContact O-N 2.99Å; D91-E98 HydrophobicContact CB-CG 4.45Å
99	Y	92.8	Very high	95.1	Very high	77 Å²	77	51 Å²	51	30%	0.302	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.6	178	-59.4	-82.7	0	0	0	111.6	L88 V89 L134 P140	L88-Y99 WeakPolarHBondContact CA-O 3.41Å; V89-Y99 HydrophobicContact CB-CD2 3.94Å; V89-Y99 HydrophobicContact CB-CG 4.45Å; V89-Y99 HydrophobicContact CG1-CD2 4.14Å; V89-Y99 HydrophobicContact CG2-CD2 4.27Å; V89-Y99 PolarHBondContact N-O 2.91Å; V89-Y99 PolarHBondContact O-N 3.34Å; Y99-L134 HydrophobicContact CD2-CD2 3.92Å; Y99-L134 HydrophobicContact CE2-CB 4.4Å; Y99-L134 HydrophobicContact CE2-CD2 4.17Å; Y99-L134 HydrophobicContact CG-CD2 4.14Å; Y99-L134 PolarHBondContact OH-O 3.18Å; Y99-P140 HydrophobicContact CD1-CG 3.88Å; Y99-P140 HydrophobicContact CE1-CG 3.99Å
100	S	94.3	Very high	95.1	Very high	69 Å²	69	51.3 Å²	51.3	48%	0.483	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	108.5	169.4	-173.8	0	0	0	0	109.6	L88	L88-S100 VanDerWaalsContact CD2-OG 3.24Å; L88-S100 WeakPolarHBondContact CD2-OG 3.49Å
101	I	94.5	Very high	95.1	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.015	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.6	-177.3	-65.9	159.5	0	0	0	107.7	K86 I87 I120 Y132 P140 I141	K86-I101 WeakPolarHBondContact CA-O 3.42Å; I87-I101 HydrophobicContact CB-CB 4.35Å; I87-I101 HydrophobicContact CD1-CG2 4.38Å; I87-I101 PolarHBondContact N-O 3.46Å; I87-I101 PolarHBondContact O-N 2.97Å; I101-I120 HydrophobicContact CD1-CD1 3.62Å; I101-Y132 HydrophobicContact CD1-CD1 4.16Å; I101-Y132 HydrophobicContact CD1-CG 4.19Å; I101-Y132 HydrophobicContact CG2-CD1 3.96Å; I101-Y132 HydrophobicContact CG2-CE1 3.52Å; I101-Y132 HydrophobicContact CG2-CE2 4.39Å; I101-P140 HydrophobicContact CD1-CB 4.06Å; I101-I141 HydrophobicContact CG1-CG1 4.38Å; I101-I141 HydrophobicContact CG2-CG1 4.26Å
102	S	94.3	Very high	95.2	Very high	71 Å²	71	51.4 Å²	51.4	50%	0.497	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	120.9	175.6	-61.3	0	0	0	0	109.8
103	M	92.6	Very high	95.3	Very high	16 Å²	16	52.3 Å²	52.3	8%	0.079	28%	0.284	C	S	.	.			trans	-83.2	152.2	172.3	-69.6	-165.5	72.3	0	0	110.7	G85 I87 T105 V108 C122 D126	G85-M103 WeakPolarHBondContact O-CB 3.26Å; G85-M103 PolarHBondContact O-N 2.86Å; I87-M103 HydrophobicContact CD1-CG 3.76Å; I87-M103 HydrophobicContact CD1-SD 3.75Å; M103-T105 HydrophobicContact CB-CG2 4.28Å; M103-T105 HydrophobicContact CE-CG2 4.3Å; M103-T105 PolarHBondContact O-N 3.27Å; M103-T105 VanDerWaalsContact O-N 3.14Å; M103-V108 HydrophobicContact CB-CG2 4.15Å; M103-V108 HydrophobicContact CG-CG2 4.17Å; M103-V108 HydrophobicContact SD-CB 4.4Å; M103-V108 HydrophobicContact SD-CG1 3.87Å; M103-V108 HydrophobicContact SD-CG2 3.56Å; M103-V108 VanDerWaalsContact SD-CG2 3.56Å; M103-C122 HydrophobicContact SD-CB 4.32Å; M103-D126 VanDerWaalsContact CE-OD2 3.25Å; M103-D126 WeakPolarHBondContact CE-OD2 3.13Å
104	P	90.9	Very high	95.4	Very high	115 Å²	115	46.9 Å²	46.9	75%	0.747	26%	0.26	S	S	*	.	S	Bend	trans	-73.2	2.7	176.2	32.5	-36.8	0	0	0	113.5
105	T	93.6	Very high	95.3	Very high	27 Å²	27	45.1 Å²	45.1	17%	0.166	25%	0.25	C	C	.	.	S	Bend	trans	-123.2	156.7	-179.1	-167.1	0	0	0	0	110.7	G85 M103 V108 D126	G85-T105 WeakPolarHBondContact CA-O 3.37Å; M103-T105 HydrophobicContact CB-CG2 4.28Å; M103-T105 HydrophobicContact CE-CG2 4.3Å; M103-T105 PolarHBondContact O-N 3.27Å; M103-T105 VanDerWaalsContact O-N 3.14Å; T105-V108 HydrophobicContact CG2-CG2 4.49Å; T105-D126 HydrophobicContact CG2-CB 3.75Å
106	T	96.7	Very high	95.2	Very high	74 Å²	74	45.9 Å²	45.9	45%	0.454	26%	0.258	S	S	.	.	S	Bend	trans	-89.5	171.1	167.3	56.6	0	0	0	0	110.6	Q83	Q83-T106 CarbonylContact O-C 3.55Å; Q83-T106 WeakPolarHBondContact O-CA 3.31Å; Q83-T106 VanDerWaalsContact O-CB 3.29Å; Q83-T106 WeakPolarHBondContact O-CB 3.27Å
107	W	97	Very high	95.1	Very high	80 Å²	80	44.1 Å²	44.1	30%	0.303	25%	0.247	S	C	.	.			trans	55.6	60.1	177.2	-66.1	92	0	0	0	112.1	L67 Q83 M109 G124 L125	L67-W107 HydrophobicContact CD1-CB 4.36Å; L67-W107 HydrophobicContact CD1-CD2 4.46Å; L67-W107 HydrophobicContact CD1-CE3 3.75Å; L67-W107 HydrophobicContact CD1-CZ3 4.48Å; L67-W107 HydrophobicContact CD2-CE3 4.14Å; L67-W107 HydrophobicContact CD2-CZ3 4.06Å; Q83-W107 HydrophobicContact CG-CD2 3.76Å; Q83-W107 HydrophobicContact CG-CE3 4.27Å; Q83-W107 HydrophobicContact CG-CG 4.07Å; Q83-W107 HydrophobicContact CG-CZ2 4.07Å; Q83-W107 VanDerWaalsContact NE2-CZ2 3.3Å; Q83-W107 PolarHBondContact O-N 3.26Å; W107-M109 VanDerWaalsContact C-N 3.3Å; W107-M109 HydrophobicContact CB-CG 4.5Å; W107-M109 PolarHBondContact O-N 3.14Å; W107-G124 WeakPolarHBondContact O-CA 3.29Å; W107-L125 HydrophobicContact CB-CB 4.46Å; W107-L125 HydrophobicContact CB-CD1 3.5Å; W107-L125 HydrophobicContact CB-CG 3.63Å; W107-L125 VanDerWaalsContact CD1-CD1 3.47Å; W107-L125 HydrophobicContact CG-CD1 3.64Å; W107-L125 HydrophobicContact CG-CG 4.26Å; W107-L125 PolarHBondContact O-N 2.92Å
108	V	97.5	Very high	95	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.226	C	C	.	.			trans	-73.7	92.3	168.2	-175.4	0	0	0	0	106.7	L67 S81 S82 I87 M103 T105 C122 G123	L67-V108 WeakPolarHBondContact CD1-O 3.11Å; S81-V108 VanDerWaalsContact CB-O 3.31Å; S81-V108 WeakPolarHBondContact CB-O 3.34Å; S81-V108 PolarHBondContact OG-O 2.83Å; S82-V108 PolarHBondContact O-N 3.39Å; I87-V108 HydrophobicContact CD1-CG1 4.33Å; I87-V108 HydrophobicContact CG1-CG1 4.15Å; M103-V108 HydrophobicContact CB-CG2 4.15Å; M103-V108 HydrophobicContact CG-CG2 4.17Å; M103-V108 HydrophobicContact SD-CB 4.4Å; M103-V108 HydrophobicContact SD-CG1 3.87Å; M103-V108 HydrophobicContact SD-CG2 3.56Å; M103-V108 VanDerWaalsContact SD-CG2 3.56Å; T105-V108 HydrophobicContact CG2-CG2 4.49Å; V108-C122 HydrophobicContact CG1-CB 3.99Å; V108-G123 CarbonylContact C-O 3.53Å
109	M	97.2	Very high	95.1	Very high	43 Å²	43	38.4 Å²	38.4	21%	0.212	22%	0.222	C	C	.	.			trans	-78.7	-23.8	-170.2	-74.3	-180	-72.4	0	0	112.8	L67 S68 W107 G123 L125 Y153 L154	L67-M109 HydrophobicContact CD1-CG 4.14Å; S68-M109 WeakPolarHBondContact CB-O 3.34Å; W107-M109 VanDerWaalsContact C-N 3.3Å; W107-M109 HydrophobicContact CB-CG 4.5Å; W107-M109 PolarHBondContact O-N 3.14Å; M109-G123 PolarHBondContact N-O 3.19Å; M109-L125 HydrophobicContact CE-CD2 3.98Å; M109-L125 HydrophobicContact CE-CG 4.24Å; M109-Y153 HydrophobicContact CE-CD2 3.28Å; M109-Y153 HydrophobicContact CE-CE2 4.17Å; M109-Y153 HydrophobicContact CE-CG 3.71Å; M109-Y153 HydrophobicContact SD-CD2 4.05Å; M109-Y153 HydrophobicContact SD-CE2 4.4Å; M109-L154 WeakPolarHBondContact CE-O 3.3Å
110	S	97.4	Very high	95.3	Very high	7 Å²	7	34.8 Å²	34.8	5%	0.049	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	145	178.8	-150.6	0	0	0	0	113.4	C122 G123 S155 C156 C157	S110-C122 WeakPolarHBondContact O-CA 3.05Å; S110-C122 WeakPolarHBondContact O-CB 3.47Å; S110-G123 PolarHBondContact N-O 3.2Å; S110-G123 PolarHBondContact O-N 3.34Å; S110-G123 VanDerWaalsContact O-N 3.09Å; S110-S155 WeakPolarHBondContact CB-O 3.14Å; S110-C156 VanDerWaalsContact OG-CA 3.28Å; S110-C156 WeakPolarHBondContact OG-CA 3.45Å; S110-C157 PolarHBondContact OG-N 2.89Å; S110-C157 PolarHBondContact OG-SG 2.79Å
111	C	97.7	Very high	95.5	Very high	4 Å²	4	31.5 Å²	31.5	3%	0.027	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	145.6	166.2	59	0	0	0	0	110.4	S68 V79 S81 A121 C122	S68-C111 PolarHBondContact O-SG 3.27Å; V79-C111 HydrophobicContact CG1-CB 4.34Å; V79-C111 HydrophobicContact CG2-CB 4.21Å; S81-C111 PolarHBondContact OG-SG 3.46Å; C111-A121 CarbonylContact C-O 3.6Å; C111-A121 WeakPolarHBondContact CA-O 3.49Å; C111-C122 HydrophobicContact CB-CB 4.27Å
112	A	97.9	Very high	95.6	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.008	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	141.7	177.1	0	0	0	0	0	110.9	I120 A121 F159	A112-I120 CarbonylContact O-C 3.57Å; A112-I120 VanDerWaalsContact O-CA 3.27Å; A112-I120 WeakPolarHBondContact O-CA 3.38Å; A112-A121 PolarHBondContact N-O 3.38Å; A112-A121 PolarHBondContact O-N 3.17Å; A112-F159 HydrophobicContact CB-CD2 4.14Å
113	Y	96.8	Very high	95.8	Very high	21 Å²	21	28 Å²	28	8%	0.082	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	139.6	168.6	-131.9	-68.2	0	0	0	108.9	S70 W71 H77 V79 V89 G117 I120 L134	S70-Y113 PolarHBondContact OG-N 3.09Å; W71-Y113 WeakPolarHBondContact O-CB 3.5Å; H77-Y113 HydrophobicContact CB-CE2 4.16Å; V79-Y113 HydrophobicContact CB-CD2 3.91Å; V79-Y113 HydrophobicContact CB-CE2 4.26Å; V79-Y113 HydrophobicContact CG1-CD2 3.79Å; V79-Y113 HydrophobicContact CG1-CG 4.46Å; V89-Y113 HydrophobicContact CG1-CE2 4.2Å; Y113-G117 WeakPolarHBondContact CE1-O 3.12Å; Y113-I120 HydrophobicContact CD1-CG2 4.49Å; Y113-I120 HydrophobicContact CD2-CG2 4.31Å; Y113-I120 HydrophobicContact CE2-CG2 4.36Å; Y113-I120 HydrophobicContact CG-CG2 4.39Å; Y113-L134 HydrophobicContact CE1-CD1 4Å; Y113-L134 HydrophobicContact CE2-CD1 4.48Å; Y113-L134 VanDerWaalsContact OH-CD1 3.29Å; Y113-L134 WeakPolarHBondContact OH-CD1 3.1Å
114	S	96.4	Very high	96	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.014	16%	0.156	C	C	.	.			trans	-75.5	151.8	173.7	86.4	0	0	0	0	111.2	S116 G117 G118 F119 F159 D163	S114-S116 PolarHBondContact O-N 3.04Å; S114-S116 PolarHBondContact OG-OG 2.96Å; S114-G117 PolarHBondContact O-N 3.27Å; S114-G118 PolarHBondContact OG-N 3.27Å; S114-F119 WeakPolarHBondContact CB-O 3.49Å; S114-F119 PolarHBondContact N-O 3.23Å; S114-F119 PolarHBondContact OG-N 3.47Å; S114-F119 PolarHBondContact OG-O 3.17Å; S114-F159 VanDerWaalsContact CA-CD2 3.43Å; S114-D163 WeakPolarHBondContact CB-OD1 3.04Å; S114-D163 PolarHBondContact OG-OD1 3.04Å
115	P	93.7	Very high	96.3	Very high	39 Å²	39	25.6 Å²	25.6	25%	0.253	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-35.3	-179.9	-26.6	32.8	0	0	0	114	L73 G117 F159 N160 D163	L73-P115 HydrophobicContact CD1-CB 4.09Å; L73-P115 WeakPolarHBondContact CD1-O 3.35Å; P115-G117 PolarHBondContact O-N 3.1Å; P115-F159 HydrophobicContact CG-CB 4.42Å; P115-N160 WeakPolarHBondContact CG-O 3.49Å; P115-D163 WeakPolarHBondContact CD-OD1 3.23Å
116	S	94.3	Very high	96.4	Very high	72 Å²	72	25.9 Å²	25.9	50%	0.503	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-15.5	177.5	69.3	0	0	0	0	114.3	S114 G118 D163	S114-S116 PolarHBondContact O-N 3.04Å; S114-S116 PolarHBondContact OG-OG 2.96Å; S116-G118 PolarHBondContact O-N 3.45Å; S116-G118 WeakPolarHBondContact OG-CA 3.28Å; S116-G118 PolarHBondContact OG-N 3.11Å; S116-D163 WeakPolarHBondContact CB-OD2 3.45Å; S116-D163 PolarHBondContact N-OD1 3.22Å; S116-D163 VanDerWaalsContact N-OD1 3.15Å; S116-D163 PolarHBondContact OG-OD1 3.34Å; S116-D163 VanDerWaalsContact OG-OD1 3.11Å; S116-D163 PolarHBondContact OG-OD2 3.09Å
117	G	93.6	Very high	96.4	Very high	12 Å²	12	24.8 Å²	24.8	12%	0.124	13%	0.133	C	C	.	.	S	Bend	trans	76.3	3.4	-166.1	0	0	0	0	0	113.9	Y113 S114 P115	Y113-G117 WeakPolarHBondContact CE1-O 3.12Å; S114-G117 PolarHBondContact O-N 3.27Å; P115-G117 PolarHBondContact O-N 3.1Å
118	G	93.4	Very high	96.4	Very high	3 Å²	3	25 Å²	25	3%	0.031	14%	0.136	C	C	.	.	S	Bend	trans	-87.8	-19.4	-173.1	0	0	0	0	0	115.3	S114 S116 L134	S114-G118 PolarHBondContact OG-N 3.27Å; S116-G118 PolarHBondContact O-N 3.45Å; S116-G118 WeakPolarHBondContact OG-CA 3.28Å; S116-G118 PolarHBondContact OG-N 3.11Å; G118-L134 PolarHBondContact O-N 3.45Å
119	F	95.5	Very high	96.4	Very high	71 Å²	71	25 Å²	25	31%	0.311	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	156.5	-176.1	-54.4	-92.4	0	0	0	111.7	S114 V131 Y132 P133 F159 D163	S114-F119 WeakPolarHBondContact CB-O 3.49Å; S114-F119 PolarHBondContact N-O 3.23Å; S114-F119 PolarHBondContact OG-N 3.47Å; S114-F119 PolarHBondContact OG-O 3.17Å; F119-V131 HydrophobicContact CB-CG1 3.9Å; F119-V131 HydrophobicContact CD1-CG1 3.9Å; F119-V131 HydrophobicContact CG-CG1 4.24Å; F119-Y132 CarbonylContact C-O 3.51Å; F119-Y132 VanDerWaalsContact CA-O 3.32Å; F119-Y132 WeakPolarHBondContact CA-O 3.38Å; F119-P133 HydrophobicContact CD1-CB 3.89Å; F119-P133 HydrophobicContact CE1-CB 3.83Å; F119-F159 HydrophobicContact CB-CZ 4.01Å; F119-D163 HydrophobicContact CD2-CB 3.91Å; F119-D163 WeakPolarHBondContact CD2-OD2 3.29Å; F119-D163 HydrophobicContact CE2-CB 4.09Å; F119-D163 WeakPolarHBondContact CE2-OD2 3.49Å
120	I	97	Very high	96.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.3	164.4	60.6	172.1	0	0	0	109.4	V79 I87 V89 I101 A112 Y113 V131 Y132 L134	V79-I120 HydrophobicContact CB-CG2 4.27Å; V79-I120 HydrophobicContact CG2-CB 4.47Å; V79-I120 HydrophobicContact CG2-CD1 4.25Å; V79-I120 HydrophobicContact CG2-CG2 4.15Å; I87-I120 HydrophobicContact CG2-CD1 3.98Å; V89-I120 HydrophobicContact CG2-CD1 4.18Å; I101-I120 HydrophobicContact CD1-CD1 3.62Å; A112-I120 CarbonylContact O-C 3.57Å; A112-I120 VanDerWaalsContact O-CA 3.27Å; A112-I120 WeakPolarHBondContact O-CA 3.38Å; Y113-I120 HydrophobicContact CD1-CG2 4.49Å; Y113-I120 HydrophobicContact CD2-CG2 4.31Å; Y113-I120 HydrophobicContact CE2-CG2 4.36Å; Y113-I120 HydrophobicContact CG-CG2 4.39Å; I120-V131 CarbonylContact O-C 3.59Å; I120-V131 VanDerWaalsContact O-CA 3.25Å; I120-V131 WeakPolarHBondContact O-CA 3.22Å; I120-Y132 HydrophobicContact CG1-CD2 4.45Å; I120-Y132 HydrophobicContact CG1-CG 4.49Å; I120-Y132 PolarHBondContact N-O 2.9Å; I120-Y132 PolarHBondContact O-N 3.13Å; I120-L134 HydrophobicContact CD1-CD2 4.29Å; I120-L134 HydrophobicContact CG1-CD2 4.34Å; I120-L134 HydrophobicContact CG2-CD1 3.66Å; I120-L134 HydrophobicContact CG2-CG 4.21Å
121	A	97.7	Very high	96.4	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	146.1	170.8	0	0	0	0	0	108.9	C111 A112 T130 V131 F159 L166	C111-A121 CarbonylContact C-O 3.6Å; C111-A121 WeakPolarHBondContact CA-O 3.49Å; A112-A121 PolarHBondContact N-O 3.38Å; A112-A121 PolarHBondContact O-N 3.17Å; A121-T130 WeakPolarHBondContact CA-O 3.41Å; A121-V131 HydrophobicContact CB-CG2 4.06Å; A121-F159 HydrophobicContact CB-CD2 4.33Å; A121-F159 HydrophobicContact CB-CE2 3.51Å; A121-F159 HydrophobicContact CB-CZ 3.75Å; A121-L166 HydrophobicContact CB-CD1 3.59Å; A121-L166 HydrophobicContact CB-CD2 4.32Å
122	C	97.5	Very high	96.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	157.9	177.5	58.7	0	0	0	0	112.2	I87 M103 V108 S110 C111 C129 T130 Y132	I87-C122 HydrophobicContact CD1-CB 3.57Å; I87-C122 WeakPolarHBondContact CD1-SG 3.5Å; I87-C122 HydrophobicContact CG1-CB 4.31Å; M103-C122 HydrophobicContact SD-CB 4.32Å; V108-C122 HydrophobicContact CG1-CB 3.99Å; S110-C122 WeakPolarHBondContact O-CA 3.05Å; S110-C122 WeakPolarHBondContact O-CB 3.47Å; C111-C122 HydrophobicContact CB-CB 4.27Å; C122-C129 WeakPolarHBondContact O-CA 3.18Å; C122-C129 PolarHBondContact O-SG 2.84Å; C122-T130 PolarHBondContact N-O 3.42Å; C122-T130 PolarHBondContact O-N 3.43Å; C122-Y132 WeakPolarHBondContact SG-CE2 3.47Å
123	G	96.9	Very high	96.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	176.9	174.8	0	0	0	0	0	113.1	V108 M109 S110 K128 L154	V108-G123 CarbonylContact C-O 3.53Å; M109-G123 PolarHBondContact N-O 3.19Å; S110-G123 PolarHBondContact N-O 3.2Å; S110-G123 PolarHBondContact O-N 3.34Å; S110-G123 VanDerWaalsContact O-N 3.09Å; G123-K128 WeakPolarHBondContact CA-O 3.43Å; G123-L154 VanDerWaalsContact CA-CD2 3.49Å
124	G	97.1	Very high	95.8	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-175.2	-124.1	-178.3	0	0	0	0	0	113.3	W107 D126 N127 Y153 L154	W107-G124 WeakPolarHBondContact O-CA 3.29Å; G124-D126 PolarHBondContact N-OD1 3.43Å; G124-D126 VanDerWaalsContact N-OD1 3.13Å; G124-D126 PolarHBondContact O-N 3.44Å; G124-D126 VanDerWaalsContact O-N 3.13Å; G124-N127 PolarHBondContact O-N 3.32Å; G124-N127 VanDerWaalsContact O-N 3.12Å; G124-Y153 WeakPolarHBondContact O-CA 3.33Å; G124-L154 WeakPolarHBondContact CA-O 3.44Å; G124-L154 PolarHBondContact O-N 3.12Å
125	L	96.9	Very high	95.1	Very high	81 Å²	81	30 Å²	30	42%	0.424	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-7.1	-178.6	-71.5	-176.1	0	0	0	115	W107 M109 N127 Y153	W107-L125 HydrophobicContact CB-CB 4.46Å; W107-L125 HydrophobicContact CB-CD1 3.5Å; W107-L125 HydrophobicContact CB-CG 3.63Å; W107-L125 VanDerWaalsContact CD1-CD1 3.47Å; W107-L125 HydrophobicContact CG-CD1 3.64Å; W107-L125 HydrophobicContact CG-CG 4.26Å; W107-L125 PolarHBondContact O-N 2.92Å; M109-L125 HydrophobicContact CE-CD2 3.98Å; M109-L125 HydrophobicContact CE-CG 4.24Å; L125-N127 PolarHBondContact O-N 3.18Å; L125-N127 PolarHBondContact O-OD1 3.02Å; L125-Y153 HydrophobicContact CD2-CG 4.47Å
126	D	96.1	Very high	94.1	Very high	34 Å²	34	29.8 Å²	29.8	18%	0.182	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	1	171.2	60.9	-14.6	0	0	0	113.5	M103 T105 G124 K128	M103-D126 VanDerWaalsContact CE-OD2 3.25Å; M103-D126 WeakPolarHBondContact CE-OD2 3.13Å; T105-D126 HydrophobicContact CG2-CB 3.75Å; G124-D126 PolarHBondContact N-OD1 3.43Å; G124-D126 VanDerWaalsContact N-OD1 3.13Å; G124-D126 PolarHBondContact O-N 3.44Å; G124-D126 VanDerWaalsContact O-N 3.13Å; D126-K128 VanDerWaalsContact O-CG 3.29Å; D126-K128 WeakPolarHBondContact O-CG 3.39Å; D126-K128 PolarHBondContact O-N 2.59Å; D126-K128 PolarHBondContact OD1-N 3.16Å
127	N	97.5	Very high	93.1	Very high	50 Å²	50	36.4 Å²	36.4	27%	0.267	19%	0.187	S	C	.	.	S	Bend	trans	60	20.6	-179	-54.2	-6	0	0	0	112.9	G124 L125 T149 H150 T151 S152 Y153	G124-N127 PolarHBondContact O-N 3.32Å; G124-N127 VanDerWaalsContact O-N 3.12Å; L125-N127 PolarHBondContact O-N 3.18Å; L125-N127 PolarHBondContact O-OD1 3.02Å; N127-T149 CarbonylContact O-C 3.56Å; N127-T149 WeakPolarHBondContact O-CA 3.4Å; N127-H150 WeakPolarHBondContact CB-O 3.34Å; N127-H150 PolarHBondContact O-N 2.95Å; N127-T151 PolarHBondContact ND2-O 3.06Å; N127-S152 WeakPolarHBondContact CA-O 3.46Å; N127-S152 WeakPolarHBondContact CB-O 3.39Å; N127-S152 PolarHBondContact OD1-O 3.46Å; N127-Y153 WeakPolarHBondContact OD1-CA 3.33Å; N127-Y153 PolarHBondContact OD1-N 3.15Å
128	K	97.1	Very high	92.3	Very high	86 Å²	86	40.7 Å²	40.7	37%	0.374	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	152.6	-170.2	-73.2	169.9	-171.7	-178.2	0	110.3	G123 D126 L146 A148 T149	G123-K128 WeakPolarHBondContact CA-O 3.43Å; D126-K128 VanDerWaalsContact O-CG 3.29Å; D126-K128 WeakPolarHBondContact O-CG 3.39Å; D126-K128 PolarHBondContact O-N 2.59Å; D126-K128 PolarHBondContact OD1-N 3.16Å; K128-L146 HydrophobicContact CB-CD1 3.6Å; K128-L146 HydrophobicContact CD-CD1 3.82Å; K128-L146 HydrophobicContact CD-CD2 4.19Å; K128-L146 HydrophobicContact CG-CD1 3.72Å; K128-A148 CarbonylContact C-O 3.58Å; K128-A148 VanDerWaalsContact CA-O 3.3Å; K128-A148 WeakPolarHBondContact CA-O 3.32Å; K128-T149 HydrophobicContact CG-CG2 4.38Å
129	C	97.2	Very high	91.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.1	163.3	-158.1	0	0	0	0	109.8	C122 V147 A148 L154 L166 T168	C122-C129 WeakPolarHBondContact O-CA 3.18Å; C122-C129 PolarHBondContact O-SG 2.84Å; C129-V147 PolarHBondContact O-N 3.26Å; C129-A148 HydrophobicContact CB-CB 3.6Å; C129-A148 PolarHBondContact N-O 2.83Å; C129-A148 PolarHBondContact O-N 2.76Å; C129-A148 VanDerWaalsContact O-N 3.17Å; C129-L154 HydrophobicContact CB-CD1 4.43Å; C129-L154 HydrophobicContact CB-CD2 3.81Å; C129-L166 HydrophobicContact CB-CD2 4.05Å; C129-T168 HydrophobicContact CB-CG2 4.11Å
130	T	97.2	Very high	91	Very high	12 Å²	12	41.5 Å²	41.5	7%	0.074	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.9	-179.7	-55.5	0	0	0	0	109.3	A121 C122 Y132 K144 K145	A121-T130 WeakPolarHBondContact CA-O 3.41Å; C122-T130 PolarHBondContact N-O 3.42Å; C122-T130 PolarHBondContact O-N 3.43Å; T130-Y132 HydrophobicContact CG2-CD2 4.13Å; T130-Y132 HydrophobicContact CG2-CE2 3.47Å; T130-Y132 VanDerWaalsContact CG2-CE2 3.47Å; T130-K144 HydrophobicContact CG2-CB 3.89Å; T130-K144 HydrophobicContact CG2-CD 4.35Å; T130-K144 HydrophobicContact CG2-CG 4.28Å; T130-K145 CarbonylContact C-O 3.57Å; T130-K145 WeakPolarHBondContact CA-O 3.27Å; T130-K145 WeakPolarHBondContact CG2-O 3.46Å
131	V	96.7	Very high	90.2	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.018	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	134.3	176.1	177.2	0	0	0	0	109.7	F119 I120 A121 K144 K145 V147 F159 L166 V180	F119-V131 HydrophobicContact CB-CG1 3.9Å; F119-V131 HydrophobicContact CD1-CG1 3.9Å; F119-V131 HydrophobicContact CG-CG1 4.24Å; I120-V131 CarbonylContact O-C 3.59Å; I120-V131 VanDerWaalsContact O-CA 3.25Å; I120-V131 WeakPolarHBondContact O-CA 3.22Å; A121-V131 HydrophobicContact CB-CG2 4.06Å; V131-K144 CarbonylContact O-C 3.59Å; V131-K144 WeakPolarHBondContact O-CA 3.26Å; V131-K145 PolarHBondContact N-O 2.88Å; V131-K145 PolarHBondContact O-N 2.91Å; V131-V147 HydrophobicContact CB-CG2 4.08Å; V131-V147 HydrophobicContact CG2-CB 4.28Å; V131-V147 HydrophobicContact CG2-CG2 3.58Å; V131-F159 HydrophobicContact CG1-CZ 4.16Å; V131-F159 HydrophobicContact CG2-CZ 4.23Å; V131-L166 HydrophobicContact CG2-CD2 4.42Å; V131-V180 HydrophobicContact CG1-CG1 4.43Å; V131-V180 HydrophobicContact CG2-CG1 4.34Å
132	Y	95.4	Very high	89.5	Confident	3 Å²	3	50.7 Å²	50.7	1%	0.012	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126.3	178.5	-62.9	-101.7	0	0	0	109.5	I101 F119 I120 C122 T130 P140 K144	I101-Y132 HydrophobicContact CD1-CD1 4.16Å; I101-Y132 HydrophobicContact CD1-CG 4.19Å; I101-Y132 HydrophobicContact CG2-CD1 3.96Å; I101-Y132 HydrophobicContact CG2-CE1 3.52Å; I101-Y132 HydrophobicContact CG2-CE2 4.39Å; F119-Y132 CarbonylContact C-O 3.51Å; F119-Y132 VanDerWaalsContact CA-O 3.32Å; F119-Y132 WeakPolarHBondContact CA-O 3.38Å; I120-Y132 HydrophobicContact CG1-CD2 4.45Å; I120-Y132 HydrophobicContact CG1-CG 4.49Å; I120-Y132 PolarHBondContact N-O 2.9Å; I120-Y132 PolarHBondContact O-N 3.13Å; C122-Y132 WeakPolarHBondContact SG-CE2 3.47Å; T130-Y132 HydrophobicContact CG2-CD2 4.13Å; T130-Y132 HydrophobicContact CG2-CE2 3.47Å; T130-Y132 VanDerWaalsContact CG2-CE2 3.47Å; Y132-P140 HydrophobicContact CD1-CB 4.46Å; Y132-K144 HydrophobicContact CD1-CB 3.62Å; Y132-K144 HydrophobicContact CE1-CB 3.45Å; Y132-K144 VanDerWaalsContact CE1-CB 3.45Å; Y132-K144 HydrophobicContact CE1-CD 4.01Å; Y132-K144 HydrophobicContact CE1-CG 4.37Å; Y132-K144 HydrophobicContact CG-CB 4.32Å
133	P	93.9	Very high	89	Confident	19 Å²	19	54.9 Å²	54.9	12%	0.123	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	136.6	172.9	30.4	-31.8	0	0	0	110.9	F119 P140 K143	F119-P133 HydrophobicContact CD1-CB 3.89Å; F119-P133 HydrophobicContact CE1-CB 3.83Å; P133-P140 VanDerWaalsContact O-CB 3.27Å; P133-P140 WeakPolarHBondContact O-CB 3.29Å; P133-P140 WeakPolarHBondContact O-CG 3.34Å; P133-K143 WeakPolarHBondContact CD-O 3.5Å; P133-K143 HydrophobicContact CG-CB 3.53Å
134	L	90.5	Very high	88.7	Confident	5 Å²	5	60 Å²	60	3%	0.026	30%	0.299	C	S	.	.	S	Bend	trans	-102.8	-21.7	178.5	-63.2	-174.4	0	0	0	113.8	V89 Y99 Y113 G118 I120 P140	V89-L134 HydrophobicContact CG1-CD1 4.43Å; V89-L134 HydrophobicContact CG2-CD1 4.24Å; V89-L134 HydrophobicContact CG2-CD2 4.32Å; Y99-L134 HydrophobicContact CD2-CD2 3.92Å; Y99-L134 HydrophobicContact CE2-CB 4.4Å; Y99-L134 HydrophobicContact CE2-CD2 4.17Å; Y99-L134 HydrophobicContact CG-CD2 4.14Å; Y99-L134 PolarHBondContact OH-O 3.18Å; Y113-L134 HydrophobicContact CE1-CD1 4Å; Y113-L134 HydrophobicContact CE2-CD1 4.48Å; Y113-L134 VanDerWaalsContact OH-CD1 3.29Å; Y113-L134 WeakPolarHBondContact OH-CD1 3.1Å; G118-L134 PolarHBondContact O-N 3.45Å; I120-L134 HydrophobicContact CD1-CD2 4.29Å; I120-L134 HydrophobicContact CG1-CD2 4.34Å; I120-L134 HydrophobicContact CG2-CD1 3.66Å; I120-L134 HydrophobicContact CG2-CG 4.21Å; L134-P140 HydrophobicContact CD2-CG 4.36Å
135	L	82.3	Confident	88.5	Confident	141 Å²	141	63.5 Å²	63.5	74%	0.738	32%	0.315	S	S	*	.	S	Bend	trans	-91.7	1.2	-175.9	-65.2	171.6	0	0	0	114.1
136	S	72.9	Confident	88.5	Confident	33 Å²	33	63.4 Å²	63.4	23%	0.231	31%	0.314	C	S	.	.	S	Bend	trans	-77.6	143.4	177	-174.9	0	0	0	0	110	E138 K143	S136-E138 PolarHBondContact O-N 3.03Å; S136-E138 VanDerWaalsContact O-N 3.11Å; S136-E138 PolarHBondContact OG-N 3.3Å; S136-K143 WeakPolarHBondContact OG-CD 3.11Å; S136-K143 PolarHBondContact OG-NZ 2.99Å
137	E	73.1	Confident	88.5	Confident	211 Å²	211	62 Å²	62	99%	0.986	31%	0.306	S	S	*	.	S	Bend	trans	-65.3	-9.5	170.2	-63	-172.3	168.1	0	0	113.5
138	E	77.2	Confident	88.4	Confident	102 Å²	102	59.6 Å²	59.6	48%	0.477	29%	0.294	S	S	.	.	S	Bend	trans	-100.5	152.5	-178.3	-69.4	175	-128	0	0	109.7	S136 K143	S136-E138 PolarHBondContact O-N 3.03Å; S136-E138 VanDerWaalsContact O-N 3.11Å; S136-E138 PolarHBondContact OG-N 3.3Å; E138-K143 WeakPolarHBondContact OE1-CE 3.2Å; E138-K143 IonicContact OE1-NZ 3.78Å; E138-K143 PolarHBondContact OE1-NZ 2.88Å; E138-K143 WeakPolarHBondContact OE2-CE 3.45Å; E138-K143 IonicContact OE2-NZ 3.72Å
139	D	81.9	Confident	88.5	Confident	84 Å²	84	59 Å²	59	45%	0.449	30%	0.298	S	S	.	.			trans	-52.2	123	177	-175.8	-16.2	0	0	0	110.5	I141 L142	D139-I141 PolarHBondContact O-N 3.07Å; D139-I141 WeakPolarHBondContact OD1-CB 3.43Å; D139-I141 WeakPolarHBondContact OD1-CG1 3.29Å; D139-I141 PolarHBondContact OD1-N 3.32Å; D139-L142 HydrophobicContact CB-CD1 4.04Å; D139-L142 HydrophobicContact CB-CG 4.15Å; D139-L142 WeakPolarHBondContact O-CB 3.47Å; D139-L142 PolarHBondContact O-N 2.76Å
140	P	78.4	Confident	88.5	Confident	7 Å²	7	59.6 Å²	59.6	5%	0.045	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-30.9	178.3	-30.3	34.5	0	0	0	113.9	Y99 I101 Y132 P133 L134 L142 K143 K144	Y99-P140 HydrophobicContact CD1-CG 3.88Å; Y99-P140 HydrophobicContact CE1-CG 3.99Å; I101-P140 HydrophobicContact CD1-CB 4.06Å; Y132-P140 HydrophobicContact CD1-CB 4.46Å; P133-P140 VanDerWaalsContact O-CB 3.27Å; P133-P140 WeakPolarHBondContact O-CB 3.29Å; P133-P140 WeakPolarHBondContact O-CG 3.34Å; L134-P140 HydrophobicContact CD2-CG 4.36Å; P140-L142 VanDerWaalsContact C-N 3.29Å; P140-L142 PolarHBondContact O-N 3.46Å; P140-K143 PolarHBondContact O-N 2.82Å; P140-K144 PolarHBondContact O-N 2.51Å
141	I	81.2	Confident	88.5	Confident	63 Å²	63	64.9 Å²	64.9	32%	0.323	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-34.3	-179.9	-62.1	170.5	0	0	0	111.7	I101 D139 K143	I101-I141 HydrophobicContact CG1-CG1 4.38Å; I101-I141 HydrophobicContact CG2-CG1 4.26Å; D139-I141 PolarHBondContact O-N 3.07Å; D139-I141 WeakPolarHBondContact OD1-CB 3.43Å; D139-I141 WeakPolarHBondContact OD1-CG1 3.29Å; D139-I141 PolarHBondContact OD1-N 3.32Å; I141-K143 VanDerWaalsContact C-N 3.35Å
142	L	81.7	Confident	88.5	Confident	131 Å²	131	66.4 Å²	66.4	69%	0.686	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-28.9	-179.3	-64.4	173.3	0	0	0	112.3	D139 P140	D139-L142 HydrophobicContact CB-CD1 4.04Å; D139-L142 HydrophobicContact CB-CG 4.15Å; D139-L142 WeakPolarHBondContact O-CB 3.47Å; D139-L142 PolarHBondContact O-N 2.76Å; P140-L142 VanDerWaalsContact C-N 3.29Å; P140-L142 PolarHBondContact O-N 3.46Å
143	K	86.9	Confident	88.6	Confident	87 Å²	87	68.6 Å²	68.6	38%	0.378	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	17.7	-179.4	-69.3	-170.5	177	165.1	0	113.9	P133 S136 E138 P140 I141	P133-K143 WeakPolarHBondContact CD-O 3.5Å; P133-K143 HydrophobicContact CG-CB 3.53Å; S136-K143 WeakPolarHBondContact OG-CD 3.11Å; S136-K143 PolarHBondContact OG-NZ 2.99Å; E138-K143 WeakPolarHBondContact OE1-CE 3.2Å; E138-K143 IonicContact OE1-NZ 3.78Å; E138-K143 PolarHBondContact OE1-NZ 2.88Å; E138-K143 WeakPolarHBondContact OE2-CE 3.45Å; E138-K143 IonicContact OE2-NZ 3.72Å; P140-K143 PolarHBondContact O-N 2.82Å; I141-K143 VanDerWaalsContact C-N 3.35Å
144	K	91.9	Very high	88.8	Confident	107 Å²	107	67.7 Å²	67.7	47%	0.465	35%	0.346	S	S	.	.			trans	-61.2	143.1	177.1	77	-177.4	179.6	179.8	0	110.9	T130 V131 Y132 P140	T130-K144 HydrophobicContact CG2-CB 3.89Å; T130-K144 HydrophobicContact CG2-CD 4.35Å; T130-K144 HydrophobicContact CG2-CG 4.28Å; V131-K144 CarbonylContact O-C 3.59Å; V131-K144 WeakPolarHBondContact O-CA 3.26Å; Y132-K144 HydrophobicContact CD1-CB 3.62Å; Y132-K144 HydrophobicContact CE1-CB 3.45Å; Y132-K144 VanDerWaalsContact CE1-CB 3.45Å; Y132-K144 HydrophobicContact CE1-CD 4.01Å; Y132-K144 HydrophobicContact CE1-CG 4.37Å; Y132-K144 HydrophobicContact CG-CB 4.32Å; P140-K144 PolarHBondContact O-N 2.51Å
145	K	93.5	Very high	89.2	Confident	75 Å²	75	68.1 Å²	68.1	33%	0.326	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.6	179.3	-171.8	176.3	-170	172.9	0	110.6	T130 V131 V147 V180 E181	T130-K145 CarbonylContact C-O 3.57Å; T130-K145 WeakPolarHBondContact CA-O 3.27Å; T130-K145 WeakPolarHBondContact CG2-O 3.46Å; V131-K145 PolarHBondContact N-O 2.88Å; V131-K145 PolarHBondContact O-N 2.91Å; K145-V147 HydrophobicContact CD-CG2 4.35Å; K145-V147 HydrophobicContact CG-CG2 4.18Å; K145-V147 PolarHBondContact O-N 3.08Å; K145-V180 WeakPolarHBondContact CD-O 3.19Å; K145-V180 WeakPolarHBondContact CE-O 3.46Å; K145-V180 PolarHBondContact NZ-O 2.87Å; K145-E181 VanDerWaalsContact NZ-CA 3.29Å; K145-E181 PolarHBondContact NZ-O 3.18Å
146	L	96.3	Very high	89.9	Confident	78 Å²	78	61.9 Å²	61.9	41%	0.408	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	119.7	169.6	177.8	60.8	0	0	0	108.6	K128 A148	K128-L146 HydrophobicContact CB-CD1 3.6Å; K128-L146 HydrophobicContact CD-CD1 3.82Å; K128-L146 HydrophobicContact CD-CD2 4.19Å; K128-L146 HydrophobicContact CG-CD1 3.72Å; L146-A148 WeakPolarHBondContact CD1-O 3.41Å
147	V	96.2	Very high	91.1	Very high	4 Å²	4	60.7 Å²	60.7	2%	0.024	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	-47.4	-175.9	174.7	0	0	0	0	111.9	C129 V131 K145 L166 W178 V180	C129-V147 PolarHBondContact O-N 3.26Å; V131-V147 HydrophobicContact CB-CG2 4.08Å; V131-V147 HydrophobicContact CG2-CB 4.28Å; V131-V147 HydrophobicContact CG2-CG2 3.58Å; K145-V147 HydrophobicContact CD-CG2 4.35Å; K145-V147 HydrophobicContact CG-CG2 4.18Å; K145-V147 PolarHBondContact O-N 3.08Å; V147-L166 HydrophobicContact CB-CD2 4.41Å; V147-L166 HydrophobicContact CG1-CD2 4.11Å; V147-W178 HydrophobicContact CG1-CB 3.78Å; V147-W178 HydrophobicContact CG1-CG 4.42Å; V147-V180 HydrophobicContact CG1-CG2 4.24Å; V147-V180 HydrophobicContact CG2-CG1 4.16Å
148	A	96	Very high	92.2	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	146.3	-177	0	0	0	0	0	111.3	K128 C129 L146 T168 W178	K128-A148 CarbonylContact C-O 3.58Å; K128-A148 VanDerWaalsContact CA-O 3.3Å; K128-A148 WeakPolarHBondContact CA-O 3.32Å; C129-A148 HydrophobicContact CB-CB 3.6Å; C129-A148 PolarHBondContact N-O 2.83Å; C129-A148 PolarHBondContact O-N 2.76Å; C129-A148 VanDerWaalsContact O-N 3.17Å; L146-A148 WeakPolarHBondContact CD1-O 3.41Å; A148-T168 HydrophobicContact CB-CG2 3.98Å; A148-W178 HydrophobicContact CB-CD2 3.66Å; A148-W178 HydrophobicContact CB-CE3 4.25Å; A148-W178 HydrophobicContact CB-CG 4Å; A148-W178 HydrophobicContact CB-CH2 4.29Å; A148-W178 HydrophobicContact CB-CZ2 3.68Å
149	T	97.3	Very high	93.1	Very high	75 Å²	75	48 Å²	48	46%	0.46	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	127.2	167.9	-59.9	0	0	0	0	108.8	N127 K128 W178	N127-T149 CarbonylContact O-C 3.56Å; N127-T149 WeakPolarHBondContact O-CA 3.4Å; K128-T149 HydrophobicContact CG-CG2 4.38Å; T149-W178 WeakPolarHBondContact O-CH2 3.36Å
150	H	97.6	Very high	93.5	Very high	12 Å²	12	45.2 Å²	45.2	6%	0.056	24%	0.236	C	C	.	.			trans	-109.9	169.6	176.9	-80.3	-85.3	0	0	0	110.5	N127 S152 T168 S170 D172 S174 W178	N127-H150 WeakPolarHBondContact CB-O 3.34Å; N127-H150 PolarHBondContact O-N 2.95Å; H150-S152 WeakPolarHBondContact CB-O 3.47Å; H150-T168 WeakPolarHBondContact NE2-CB 3.39Å; H150-T168 PolarHBondContact NE2-OG1 3.47Å; H150-S170 WeakPolarHBondContact CB-OG 3.32Å; H150-S170 VanDerWaalsContact CG-CB 3.45Å; H150-S170 WeakPolarHBondContact ND1-CB 3.38Å; H150-D172 WeakPolarHBondContact CB-OD2 3.28Å; H150-D172 IonicContact CG-OD2 2.79Å; H150-D172 IonicContact ND1-OD1 3.64Å; H150-D172 PolarHBondContact ND1-OD1 2.9Å; H150-D172 IonicContact ND1-OD2 3.57Å; H150-D172 PolarHBondContact ND1-OD2 2.9Å; H150-S174 PolarHBondContact ND1-OG 2.85Å; H150-W178 AromaticContact NE2-CZ2 3.99Å
151	T	97.4	Very high	93.9	Very high	123 Å²	123	50.4 Å²	50.4	76%	0.755	26%	0.262	S	S	*	.	S	Bend	trans	-86.7	-15.6	176.4	59.1	0	0	0	0	112.9	N127 D172	N127-T151 PolarHBondContact ND2-O 3.06Å; T151-D172 PolarHBondContact N-OD2 3.42Å; T151-D172 WeakPolarHBondContact OG1-CB 3.4Å; T151-D172 PolarHBondContact OG1-OD2 2.89Å; T151-D172 VanDerWaalsContact OG1-OD2 3.08Å
152	S	97.6	Very high	94.4	Very high	34 Å²	34	49.6 Å²	49.6	24%	0.238	26%	0.262	C	S	.	.	S	Bend	trans	-132.8	-173.8	174.1	-166.8	0	0	0	0	109.9	N127 H150 G171	N127-S152 WeakPolarHBondContact CA-O 3.46Å; N127-S152 WeakPolarHBondContact CB-O 3.39Å; N127-S152 PolarHBondContact OD1-O 3.46Å; H150-S152 WeakPolarHBondContact CB-O 3.47Å; S152-G171 WeakPolarHBondContact CB-O 3.3Å; S152-G171 PolarHBondContact OG-O 2.98Å
153	Y	97.8	Very high	95	Very high	50 Å²	50	44.6 Å²	44.6	20%	0.196	24%	0.236	C	C	.	.			trans	-65.2	145.8	-173.1	66.1	-95.4	0	0	0	112.8	M109 G124 L125 N127 S155 S170 G171 D195	M109-Y153 HydrophobicContact CE-CD2 3.28Å; M109-Y153 HydrophobicContact CE-CE2 4.17Å; M109-Y153 HydrophobicContact CE-CG 3.71Å; M109-Y153 HydrophobicContact SD-CD2 4.05Å; M109-Y153 HydrophobicContact SD-CE2 4.4Å; G124-Y153 WeakPolarHBondContact O-CA 3.33Å; L125-Y153 HydrophobicContact CD2-CG 4.47Å; N127-Y153 WeakPolarHBondContact OD1-CA 3.33Å; N127-Y153 PolarHBondContact OD1-N 3.15Å; Y153-S155 PolarHBondContact O-N 2.76Å; Y153-S170 CarbonylContact O-C 3.53Å; Y153-S170 VanDerWaalsContact O-CA 3.29Å; Y153-S170 WeakPolarHBondContact O-CA 3.4Å; Y153-S170 PolarHBondContact O-OG 2.8Å; Y153-G171 PolarHBondContact O-N 3.01Å; Y153-D195 WeakPolarHBondContact CE1-OD2 3.47Å; Y153-D195 VanDerWaalsContact CZ-OD2 3.31Å; Y153-D195 WeakPolarHBondContact OH-CB 3.43Å; Y153-D195 PolarHBondContact OH-OD2 2.82Å
154	L	98.2	Very high	95.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	113.9	173.6	-175.1	84.3	0	0	0	109.8	M109 G123 G124 C129 C157 T168	M109-L154 WeakPolarHBondContact CE-O 3.3Å; G123-L154 VanDerWaalsContact CA-CD2 3.49Å; G124-L154 WeakPolarHBondContact CA-O 3.44Å; G124-L154 PolarHBondContact O-N 3.12Å; C129-L154 HydrophobicContact CB-CD1 4.43Å; C129-L154 HydrophobicContact CB-CD2 3.81Å; L154-C157 HydrophobicContact CD2-CB 4.23Å; L154-T168 HydrophobicContact CD1-CG2 3.67Å
155	S	97.9	Very high	95.5	Very high	14 Å²	14	43.3 Å²	43.3	10%	0.098	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-39.9	178.4	59.6	0	0	0	0	112.4	S110 Y153 G169 V196	S110-S155 WeakPolarHBondContact CB-O 3.14Å; Y153-S155 PolarHBondContact O-N 2.76Å; S155-G169 PolarHBondContact N-O 3.46Å; S155-G169 VanDerWaalsContact OG-C 3.32Å; S155-G169 PolarHBondContact OG-O 3.38Å; S155-V196 WeakPolarHBondContact CB-O 3.22Å; S155-V196 PolarHBondContact OG-O 2.94Å
156	C	97.6	Very high	95.6	Very high	10 Å²	10	39.8 Å²	39.8	7%	0.068	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	144	-172.8	57.1	0	0	0	0	112.2	S110 T168 G169 I199	S110-C156 VanDerWaalsContact OG-CA 3.28Å; S110-C156 WeakPolarHBondContact OG-CA 3.45Å; C156-T168 CarbonylContact O-C 3.47Å; C156-T168 WeakPolarHBondContact O-CA 3.41Å; C156-G169 PolarHBondContact N-O 3.05Å; C156-G169 PolarHBondContact O-N 3.08Å; C156-G169 VanDerWaalsContact SG-CA 3.58Å; C156-I199 HydrophobicContact CB-CG1 4.06Å
157	C	97.6	Very high	95.7	Very high	7 Å²	7	36 Å²	36	5%	0.047	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	150	171.7	64.2	0	0	0	0	110.7	S110 L154 L166 L167 T168	S110-C157 PolarHBondContact OG-N 2.89Å; S110-C157 PolarHBondContact OG-SG 2.79Å; L154-C157 HydrophobicContact CD2-CB 4.23Å; C157-L166 HydrophobicContact CB-CD1 4.47Å; C157-L167 CarbonylContact C-O 3.5Å; C157-L167 VanDerWaalsContact CA-O 3.26Å; C157-L167 WeakPolarHBondContact CA-O 3.43Å; C157-T168 HydrophobicContact CB-CG2 4.22Å
158	L	96.7	Very high	95.8	Very high	40 Å²	40	35.9 Å²	35.9	21%	0.209	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	139	174.5	-160.3	99.3	0	0	0	109.4	L167 I199 L201	L158-L167 PolarHBondContact N-O 3.44Å; L158-L167 PolarHBondContact O-N 2.84Å; L158-I199 HydrophobicContact CB-CD1 4.14Å; L158-L201 HydrophobicContact CD2-CB 3.97Å; L158-L201 HydrophobicContact CD2-CD1 3.39Å; L158-L201 HydrophobicContact CD2-CG 3.43Å; L158-L201 VanDerWaalsContact CD2-CG 3.43Å
159	F	95.4	Very high	95.9	Very high	8 Å²	8	35.9 Å²	35.9	4%	0.035	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	150.9	166	-74.1	-86.9	0	0	0	110.1	A112 S114 P115 F119 A121 V131 Q165 L166 V180 L201	A112-F159 HydrophobicContact CB-CD2 4.14Å; S114-F159 VanDerWaalsContact CA-CD2 3.43Å; P115-F159 HydrophobicContact CG-CB 4.42Å; F119-F159 HydrophobicContact CB-CZ 4.01Å; A121-F159 HydrophobicContact CB-CD2 4.33Å; A121-F159 HydrophobicContact CB-CE2 3.51Å; A121-F159 HydrophobicContact CB-CZ 3.75Å; V131-F159 HydrophobicContact CG1-CZ 4.16Å; V131-F159 HydrophobicContact CG2-CZ 4.23Å; F159-Q165 WeakPolarHBondContact CA-O 3.25Å; F159-L166 HydrophobicContact CD1-CD1 4.19Å; F159-L166 HydrophobicContact CD2-CD1 4.27Å; F159-L166 HydrophobicContact CE1-CD1 4.29Å; F159-L166 HydrophobicContact CE2-CD1 4.38Å; F159-L166 HydrophobicContact CG-CD1 4.19Å; F159-L166 HydrophobicContact CZ-CD1 4.39Å; F159-V180 HydrophobicContact CE1-CG2 4.33Å; F159-L201 VanDerWaalsContact O-CD1 3.27Å; F159-L201 WeakPolarHBondContact O-CD1 3.22Å
160	N	91	Very high	95.9	Very high	24 Å²	24	32.3 Å²	32.3	13%	0.128	17%	0.174	C	C	.	.			trans	-75.1	-164.7	168.8	-158.6	-0.9	0	0	0	110.9	P115 S162 Q165 L201	P115-N160 WeakPolarHBondContact CG-O 3.49Å; N160-S162 PolarHBondContact O-N 2.91Å; N160-Q165 HydrophobicContact CB-CB 3.69Å; N160-Q165 PolarHBondContact N-O 2.92Å; N160-Q165 PolarHBondContact ND2-OE1 2.99Å; N160-L201 HydrophobicContact CB-CD1 4.3Å
161	I	87	Confident	95.9	Very high	117 Å²	117	32.1 Å²	32.1	60%	0.6	18%	0.176	S	C	*	.	S	Bend	trans	-56.5	-20.3	174.3	-60.3	166.7	0	0	0	112.1
162	S	90.9	Very high	95.9	Very high	45 Å²	45	27.8 Å²	27.8	32%	0.315	15%	0.148	S	C	.	.	S	Bend	trans	-125.8	160.8	175.5	73.8	0	0	0	0	112.6	N160 H164	N160-S162 PolarHBondContact O-N 2.91Å; S162-H164 PolarHBondContact O-N 2.96Å; S162-H164 PolarHBondContact OG-N 3.24Å
163	D	93.9	Very high	95.9	Very high	27 Å²	27	28.2 Å²	28.2	14%	0.144	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-13.3	175.6	-59.2	-18.6	0	0	0	113.6	S114 P115 S116 F119 V180	S114-D163 WeakPolarHBondContact CB-OD1 3.04Å; S114-D163 PolarHBondContact OG-OD1 3.04Å; P115-D163 WeakPolarHBondContact CD-OD1 3.23Å; S116-D163 WeakPolarHBondContact CB-OD2 3.45Å; S116-D163 PolarHBondContact N-OD1 3.22Å; S116-D163 VanDerWaalsContact N-OD1 3.15Å; S116-D163 PolarHBondContact OG-OD1 3.34Å; S116-D163 VanDerWaalsContact OG-OD1 3.11Å; S116-D163 PolarHBondContact OG-OD2 3.09Å; F119-D163 HydrophobicContact CD2-CB 3.91Å; F119-D163 WeakPolarHBondContact CD2-OD2 3.29Å; F119-D163 HydrophobicContact CE2-CB 4.09Å; F119-D163 WeakPolarHBondContact CE2-OD2 3.49Å; D163-V180 WeakPolarHBondContact O-CG2 3.44Å
164	H	94.3	Very high	95.9	Very high	106 Å²	106	26.2 Å²	26.2	49%	0.491	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-12	-173.8	-60.1	-74	0	0	0	113.5	S162 V180	S162-H164 PolarHBondContact O-N 2.96Å; S162-H164 PolarHBondContact OG-N 3.24Å; H164-V180 WeakPolarHBondContact O-CB 3.49Å; H164-V180 PolarHBondContact O-N 3.02Å
165	Q	95.1	Very high	95.9	Very high	61 Å²	61	26.2 Å²	26.2	29%	0.285	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	132.4	-176.6	-70.6	-177.2	-3.1	0	0	110.8	F159 N160 L177 W178 I186	F159-Q165 WeakPolarHBondContact CA-O 3.25Å; N160-Q165 HydrophobicContact CB-CB 3.69Å; N160-Q165 PolarHBondContact N-O 2.92Å; N160-Q165 PolarHBondContact ND2-OE1 2.99Å; Q165-L177 HydrophobicContact CB-CD1 4.16Å; Q165-W178 WeakPolarHBondContact CA-O 3.45Å; Q165-I186 HydrophobicContact CG-CD1 3.89Å
166	L	96.6	Very high	95.9	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.9	-179.9	-175.6	75.3	0	0	0	109.1	A121 C129 V131 V147 C157 F159 T168 L177 W178 V180	A121-L166 HydrophobicContact CB-CD1 3.59Å; A121-L166 HydrophobicContact CB-CD2 4.32Å; C129-L166 HydrophobicContact CB-CD2 4.05Å; V131-L166 HydrophobicContact CG2-CD2 4.42Å; V147-L166 HydrophobicContact CB-CD2 4.41Å; V147-L166 HydrophobicContact CG1-CD2 4.11Å; C157-L166 HydrophobicContact CB-CD1 4.47Å; F159-L166 HydrophobicContact CD1-CD1 4.19Å; F159-L166 HydrophobicContact CD2-CD1 4.27Å; F159-L166 HydrophobicContact CE1-CD1 4.29Å; F159-L166 HydrophobicContact CE2-CD1 4.38Å; F159-L166 HydrophobicContact CG-CD1 4.19Å; F159-L166 HydrophobicContact CZ-CD1 4.39Å; L166-T168 HydrophobicContact CD2-CG2 4.19Å; L166-T168 HydrophobicContact CG-CG2 4.32Å; L166-L177 WeakPolarHBondContact O-CA 3.34Å; L166-W178 HydrophobicContact CB-CB 4.5Å; L166-W178 PolarHBondContact N-O 3.28Å; L166-W178 PolarHBondContact O-N 2.83Å; L166-V180 HydrophobicContact CB-CG2 3.8Å
167	L	97.4	Very high	95.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	134.6	172.2	-174.9	67.1	0	0	0	109.1	C157 L158 V176 L177 F189 I199 L201 F210	C157-L167 CarbonylContact C-O 3.5Å; C157-L167 VanDerWaalsContact CA-O 3.26Å; C157-L167 WeakPolarHBondContact CA-O 3.43Å; L158-L167 PolarHBondContact N-O 3.44Å; L158-L167 PolarHBondContact O-N 2.84Å; L167-V176 WeakPolarHBondContact CA-O 3.31Å; L167-L177 HydrophobicContact CB-CD1 4.47Å; L167-L177 HydrophobicContact CD1-CB 4.31Å; L167-F189 HydrophobicContact CD1-CD2 4.34Å; L167-F189 HydrophobicContact CD1-CE2 3.91Å; L167-I199 HydrophobicContact CB-CD1 4.14Å; L167-I199 HydrophobicContact CD2-CB 4.48Å; L167-I199 HydrophobicContact CD2-CD1 3.94Å; L167-I199 HydrophobicContact CG-CD1 3.8Å; L167-I199 WeakPolarHBondContact O-CD1 3.34Å; L167-L201 HydrophobicContact CD2-CD2 3.71Å; L167-F210 HydrophobicContact CD1-CD1 4.42Å; L167-F210 HydrophobicContact CD1-CE1 4.04Å; L167-F210 HydrophobicContact CD1-CE2 4.46Å; L167-F210 HydrophobicContact CD1-CZ 4.07Å; L167-F210 HydrophobicContact CD2-CB 3.94Å; L167-F210 HydrophobicContact CD2-CD1 3.84Å; L167-F210 HydrophobicContact CD2-CD2 3.6Å; L167-F210 HydrophobicContact CD2-CE1 4.19Å; L167-F210 HydrophobicContact CD2-CE2 3.97Å; L167-F210 HydrophobicContact CD2-CG 3.52Å; L167-F210 HydrophobicContact CD2-CZ 4.25Å
168	T	98.3	Very high	95.9	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	150.6	177.6	58.4	0	0	0	0	111.4	C129 A148 H150 L154 C156 C157 L166 C175 V176 W178	C129-T168 HydrophobicContact CB-CG2 4.11Å; A148-T168 HydrophobicContact CB-CG2 3.98Å; H150-T168 WeakPolarHBondContact NE2-CB 3.39Å; H150-T168 PolarHBondContact NE2-OG1 3.47Å; L154-T168 HydrophobicContact CD1-CG2 3.67Å; C156-T168 CarbonylContact O-C 3.47Å; C156-T168 WeakPolarHBondContact O-CA 3.41Å; C157-T168 HydrophobicContact CB-CG2 4.22Å; L166-T168 HydrophobicContact CD2-CG2 4.19Å; L166-T168 HydrophobicContact CG-CG2 4.32Å; T168-C175 CarbonylContact O-C 3.54Å; T168-C175 WeakPolarHBondContact O-CA 3.32Å; T168-C175 WeakPolarHBondContact O-CB 3.29Å; T168-V176 PolarHBondContact N-O 2.8Å; T168-V176 PolarHBondContact O-N 3.44Å; T168-V176 PolarHBondContact OG1-O 3.37Å; T168-W178 PolarHBondContact OG1-NE1 2.8Å
169	G	98.1	Very high	95.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	149.6	165.1	0	0	0	0	0	110.1	S155 C156	S155-G169 PolarHBondContact N-O 3.46Å; S155-G169 VanDerWaalsContact OG-C 3.32Å; S155-G169 PolarHBondContact OG-O 3.38Å; C156-G169 PolarHBondContact N-O 3.05Å; C156-G169 PolarHBondContact O-N 3.08Å; C156-G169 VanDerWaalsContact SG-CA 3.58Å
170	S	98.5	Very high	96	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	158.5	-167	169.9	0	0	0	0	112.5	H150 Y153 D172 S173 S174 V196	H150-S170 WeakPolarHBondContact CB-OG 3.32Å; H150-S170 VanDerWaalsContact CG-CB 3.45Å; H150-S170 WeakPolarHBondContact ND1-CB 3.38Å; Y153-S170 CarbonylContact O-C 3.53Å; Y153-S170 VanDerWaalsContact O-CA 3.29Å; Y153-S170 WeakPolarHBondContact O-CA 3.4Å; Y153-S170 PolarHBondContact O-OG 2.8Å; S170-D172 WeakPolarHBondContact CB-OD1 3.43Å; S170-D172 PolarHBondContact O-N 3.07Å; S170-D172 VanDerWaalsContact O-N 3.14Å; S170-D172 PolarHBondContact OG-N 3.04Å; S170-D172 VanDerWaalsContact OG-N 3.16Å; S170-D172 PolarHBondContact OG-OD1 2.86Å; S170-D172 PolarHBondContact OG-OD2 2.97Å; S170-S173 PolarHBondContact O-N 3.35Å; S170-S174 PolarHBondContact N-O 2.92Å; S170-V196 PolarHBondContact O-N 2.91Å; S170-V196 VanDerWaalsContact O-N 3.08Å
171	G	97.9	Very high	96.1	Very high	9 Å²	9	30.1 Å²	30.1	9%	0.093	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	8	168.5	0	0	0	0	0	114.1	S152 Y153 S173	S152-G171 WeakPolarHBondContact CB-O 3.3Å; S152-G171 PolarHBondContact OG-O 2.98Å; Y153-G171 PolarHBondContact O-N 3.01Å; G171-S173 VanDerWaalsContact C-N 3.34Å
172	D	97.5	Very high	96.5	Very high	32 Å²	32	31.3 Å²	31.3	17%	0.171	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	18.9	170.4	65.1	13.3	0	0	0	112.7	H150 T151 S170 S174	H150-D172 WeakPolarHBondContact CB-OD2 3.28Å; H150-D172 IonicContact CG-OD2 2.79Å; H150-D172 IonicContact ND1-OD1 3.64Å; H150-D172 PolarHBondContact ND1-OD1 2.9Å; H150-D172 IonicContact ND1-OD2 3.57Å; H150-D172 PolarHBondContact ND1-OD2 2.9Å; T151-D172 PolarHBondContact N-OD2 3.42Å; T151-D172 WeakPolarHBondContact OG1-CB 3.4Å; T151-D172 PolarHBondContact OG1-OD2 2.89Å; T151-D172 VanDerWaalsContact OG1-OD2 3.08Å; S170-D172 WeakPolarHBondContact CB-OD1 3.43Å; S170-D172 PolarHBondContact O-N 3.07Å; S170-D172 VanDerWaalsContact O-N 3.14Å; S170-D172 PolarHBondContact OG-N 3.04Å; S170-D172 VanDerWaalsContact OG-N 3.16Å; S170-D172 PolarHBondContact OG-OD1 2.86Å; S170-D172 PolarHBondContact OG-OD2 2.97Å; D172-S174 PolarHBondContact O-N 3.09Å; D172-S174 WeakPolarHBondContact OD1-CB 3.26Å; D172-S174 PolarHBondContact OD1-N 2.99Å; D172-S174 PolarHBondContact OD1-OG 2.83Å
173	S	97.5	Very high	96.7	Very high	42 Å²	42	31.1 Å²	31.1	29%	0.294	16%	0.159	S	C	.	.	S	Bend	trans	63.9	10.5	-179.2	69.9	0	0	0	0	115.8	S170 G171 A194	S170-S173 PolarHBondContact O-N 3.35Å; G171-S173 VanDerWaalsContact C-N 3.34Å; S173-A194 WeakPolarHBondContact CA-O 3.29Å; S173-A194 VanDerWaalsContact CB-O 3.24Å; S173-A194 WeakPolarHBondContact CB-O 3.46Å
174	S	97.5	Very high	96.9	Very high	8 Å²	8	35.7 Å²	35.7	6%	0.056	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	149.3	179.8	76.4	0	0	0	0	112.9	H150 S170 D172	H150-S174 PolarHBondContact ND1-OG 2.85Å; S170-S174 PolarHBondContact N-O 2.92Å; D172-S174 PolarHBondContact O-N 3.09Å; D172-S174 WeakPolarHBondContact OD1-CB 3.26Å; D172-S174 PolarHBondContact OD1-N 2.99Å; D172-S174 PolarHBondContact OD1-OG 2.83Å
175	C	98.2	Very high	97	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.007	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	148.2	157.2	-58.5	0	0	0	0	109	T168 F189 F210	T168-C175 CarbonylContact O-C 3.54Å; T168-C175 WeakPolarHBondContact O-CA 3.32Å; T168-C175 WeakPolarHBondContact O-CB 3.29Å; C175-F189 HydrophobicContact CB-CB 4.03Å; C175-F189 HydrophobicContact CB-CD2 4Å; C175-F189 HydrophobicContact CB-CG 4.41Å; C175-F189 PolarHBondContact N-O 2.79Å; C175-F189 VanDerWaalsContact N-O 3.16Å; C175-F189 WeakPolarHBondContact O-CD2 3.43Å; C175-F189 PolarHBondContact O-N 2.93Å; C175-F210 HydrophobicContact CB-CE2 4.08Å; C175-F210 HydrophobicContact CB-CZ 3.88Å
176	V	98.1	Very high	97.1	Very high	5 Å²	5	35.8 Å²	35.8	3%	0.03	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	135.1	180	-175.6	0	0	0	0	110.6	L167 T168 W178 I185 Q187	L167-V176 WeakPolarHBondContact CA-O 3.31Å; T168-V176 PolarHBondContact N-O 2.8Å; T168-V176 PolarHBondContact O-N 3.44Å; T168-V176 PolarHBondContact OG1-O 3.37Å; V176-W178 HydrophobicContact CB-CZ2 3.66Å; V176-W178 HydrophobicContact CG1-CD2 3.84Å; V176-W178 HydrophobicContact CG1-CE3 4.43Å; V176-W178 HydrophobicContact CG1-CG 4.33Å; V176-W178 HydrophobicContact CG1-CH2 4.08Å; V176-W178 HydrophobicContact CG1-CZ2 3.44Å; V176-W178 VanDerWaalsContact CG1-CZ2 3.44Å; V176-W178 HydrophobicContact CG2-CZ2 4.13Å; V176-W178 VanDerWaalsContact O-CD1 3.24Å; V176-W178 PolarHBondContact O-NE1 3.36Å; V176-I185 HydrophobicContact CG1-CB 4.35Å; V176-I185 HydrophobicContact CG1-CD1 4.45Å; V176-I185 HydrophobicContact CG1-CG1 3.99Å; V176-I185 HydrophobicContact CG1-CG2 3.77Å; V176-Q187 WeakPolarHBondContact CA-O 3.36Å; V176-Q187 WeakPolarHBondContact CG1-O 3.44Å
177	L	97.4	Very high	97.1	Very high	6 Å²	6	38.5 Å²	38.5	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	126.3	170.3	-178.2	66.2	0	0	0	109	Q165 L166 L167 I186 Q187 F189 M224	Q165-L177 HydrophobicContact CB-CD1 4.16Å; L166-L177 WeakPolarHBondContact O-CA 3.34Å; L167-L177 HydrophobicContact CB-CD1 4.47Å; L167-L177 HydrophobicContact CD1-CB 4.31Å; L177-I186 HydrophobicContact CB-CB 4.43Å; L177-I186 HydrophobicContact CD2-CB 4.15Å; L177-I186 HydrophobicContact CD2-CD1 4.46Å; L177-I186 HydrophobicContact CD2-CG2 3.89Å; L177-I186 HydrophobicContact CG-CB 4.09Å; L177-I186 HydrophobicContact CG-CD1 4.24Å; L177-I186 HydrophobicContact CG-CG2 4.39Å; L177-I186 WeakPolarHBondContact O-CB 3.38Å; L177-I186 PolarHBondContact O-N 3.17Å; L177-Q187 HydrophobicContact CB-CB 4.27Å; L177-Q187 PolarHBondContact N-O 3.42Å; L177-Q187 PolarHBondContact O-N 2.94Å; L177-F189 HydrophobicContact CB-CE2 3.94Å; L177-F189 HydrophobicContact CB-CZ 4.4Å; L177-M224 HydrophobicContact CD1-CE 3.72Å; L177-M224 HydrophobicContact CD2-CE 3.82Å; L177-M224 HydrophobicContact CG-CE 4.37Å
178	W	97.7	Very high	97	Very high	16 Å²	16	39.5 Å²	39.5	6%	0.061	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	144.8	-174.6	-52.2	84.5	0	0	0	111.2	V147 A148 T149 H150 Q165 L166 T168 V176 Q184 I185	V147-W178 HydrophobicContact CG1-CB 3.78Å; V147-W178 HydrophobicContact CG1-CG 4.42Å; A148-W178 HydrophobicContact CB-CD2 3.66Å; A148-W178 HydrophobicContact CB-CE3 4.25Å; A148-W178 HydrophobicContact CB-CG 4Å; A148-W178 HydrophobicContact CB-CH2 4.29Å; A148-W178 HydrophobicContact CB-CZ2 3.68Å; T149-W178 WeakPolarHBondContact O-CH2 3.36Å; H150-W178 AromaticContact NE2-CZ2 3.99Å; Q165-W178 WeakPolarHBondContact CA-O 3.45Å; L166-W178 HydrophobicContact CB-CB 4.5Å; L166-W178 PolarHBondContact N-O 3.28Å; L166-W178 PolarHBondContact O-N 2.83Å; T168-W178 PolarHBondContact OG1-NE1 2.8Å; V176-W178 HydrophobicContact CB-CZ2 3.66Å; V176-W178 HydrophobicContact CG1-CD2 3.84Å; V176-W178 HydrophobicContact CG1-CE3 4.43Å; V176-W178 HydrophobicContact CG1-CG 4.33Å; V176-W178 HydrophobicContact CG1-CH2 4.08Å; V176-W178 HydrophobicContact CG1-CZ2 3.44Å; V176-W178 VanDerWaalsContact CG1-CZ2 3.44Å; V176-W178 HydrophobicContact CG2-CZ2 4.13Å; V176-W178 VanDerWaalsContact O-CD1 3.24Å; V176-W178 PolarHBondContact O-NE1 3.36Å; W178-Q184 CarbonylContact C-O 3.53Å; W178-Q184 WeakPolarHBondContact CA-O 3.48Å; W178-I185 HydrophobicContact CD2-CG1 4.44Å; W178-I185 HydrophobicContact CE3-CG1 3.68Å; W178-I185 HydrophobicContact CH2-CD1 3.94Å; W178-I185 HydrophobicContact CH2-CG1 3.66Å; W178-I185 HydrophobicContact CZ2-CG1 4.43Å; W178-I185 HydrophobicContact CZ3-CD1 3.95Å; W178-I185 HydrophobicContact CZ3-CG1 3.24Å
179	D	96.7	Very high	97	Very high	37 Å²	37	39.6 Å²	39.6	20%	0.198	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	119	163.5	-170.9	-63	0	0	0	109.2	E181 Y182 A183 Q184 I186	D179-E181 VanDerWaalsContact C-N 3.35Å; D179-E181 WeakPolarHBondContact OD1-CA 3.46Å; D179-E181 WeakPolarHBondContact OD1-CB 3.24Å; D179-E181 PolarHBondContact OD1-N 2.79Å; D179-Y182 WeakPolarHBondContact OD1-CD2 3.48Å; D179-Y182 PolarHBondContact OD1-N 2.97Å; D179-A183 WeakPolarHBondContact O-CA 3.42Å; D179-A183 PolarHBondContact O-N 2.84Å; D179-Q184 PolarHBondContact N-O 3.26Å; D179-Q184 PolarHBondContact O-N 2.71Å; D179-I186 HydrophobicContact CB-CD1 3.88Å; D179-I186 HydrophobicContact CB-CG1 3.91Å
180	V	96	Very high	97	Very high	13 Å²	13	47.3 Å²	47.3	8%	0.079	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-29.2	-177.5	175.3	0	0	0	0	111.6	V131 K145 V147 F159 D163 H164 L166	V131-V180 HydrophobicContact CG1-CG1 4.43Å; V131-V180 HydrophobicContact CG2-CG1 4.34Å; K145-V180 WeakPolarHBondContact CD-O 3.19Å; K145-V180 WeakPolarHBondContact CE-O 3.46Å; K145-V180 PolarHBondContact NZ-O 2.87Å; V147-V180 HydrophobicContact CG1-CG2 4.24Å; V147-V180 HydrophobicContact CG2-CG1 4.16Å; F159-V180 HydrophobicContact CE1-CG2 4.33Å; D163-V180 WeakPolarHBondContact O-CG2 3.44Å; H164-V180 WeakPolarHBondContact O-CB 3.49Å; H164-V180 PolarHBondContact O-N 3.02Å; L166-V180 HydrophobicContact CB-CG2 3.8Å
181	E	94.1	Very high	96.8	Very high	107 Å²	107	49.8 Å²	49.8	50%	0.5	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-37.2	-178.5	-172.9	170.3	-171.9	0	0	112.4	K145 D179	K145-E181 VanDerWaalsContact NZ-CA 3.29Å; K145-E181 PolarHBondContact NZ-O 3.18Å; D179-E181 VanDerWaalsContact C-N 3.35Å; D179-E181 WeakPolarHBondContact OD1-CA 3.46Å; D179-E181 WeakPolarHBondContact OD1-CB 3.24Å; D179-E181 PolarHBondContact OD1-N 2.79Å
182	Y	95.2	Very high	96.7	Very high	142 Å²	142	49.9 Å²	49.9	56%	0.557	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-6.6	-178.7	-58.1	-73.4	0	0	0	113.8	D179 Q184	D179-Y182 WeakPolarHBondContact OD1-CD2 3.48Å; D179-Y182 PolarHBondContact OD1-N 2.97Å; Y182-Q184 PolarHBondContact O-N 3.34Å
183	A	95.5	Very high	96.7	Very high	41 Å²	41	53.4 Å²	53.4	34%	0.339	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	42.4	-173.2	0	0	0	0	0	111.8	D179	D179-A183 WeakPolarHBondContact O-CA 3.42Å; D179-A183 PolarHBondContact O-N 2.84Å
184	Q	96.7	Very high	96.7	Very high	124 Å²	124	52.7 Å²	52.7	58%	0.579	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	149.3	-177.8	-72.2	-178.4	-4.4	0	0	110.9	W178 D179 Y182 I186	W178-Q184 CarbonylContact C-O 3.53Å; W178-Q184 WeakPolarHBondContact CA-O 3.48Å; D179-Q184 PolarHBondContact N-O 3.26Å; D179-Q184 PolarHBondContact O-N 2.71Å; Y182-Q184 PolarHBondContact O-N 3.34Å; Q184-I186 PolarHBondContact O-N 2.79Å
185	I	97.3	Very high	96.7	Very high	96 Å²	96	54.8 Å²	54.8	49%	0.492	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	122.5	171.1	-63	174.7	0	0	0	108.1	V176 W178	V176-I185 HydrophobicContact CG1-CB 4.35Å; V176-I185 HydrophobicContact CG1-CD1 4.45Å; V176-I185 HydrophobicContact CG1-CG1 3.99Å; V176-I185 HydrophobicContact CG1-CG2 3.77Å; W178-I185 HydrophobicContact CD2-CG1 4.44Å; W178-I185 HydrophobicContact CE3-CG1 3.68Å; W178-I185 HydrophobicContact CH2-CD1 3.94Å; W178-I185 HydrophobicContact CH2-CG1 3.66Å; W178-I185 HydrophobicContact CZ2-CG1 4.43Å; W178-I185 HydrophobicContact CZ3-CD1 3.95Å; W178-I185 HydrophobicContact CZ3-CG1 3.24Å
186	I	96.1	Very high	96.8	Very high	72 Å²	72	54.7 Å²	54.7	37%	0.369	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-48.7	169.2	-62.6	173.3	0	0	0	109.3	Q165 L177 D179 Q184	Q165-I186 HydrophobicContact CG-CD1 3.89Å; L177-I186 HydrophobicContact CB-CB 4.43Å; L177-I186 HydrophobicContact CD2-CB 4.15Å; L177-I186 HydrophobicContact CD2-CD1 4.46Å; L177-I186 HydrophobicContact CD2-CG2 3.89Å; L177-I186 HydrophobicContact CG-CB 4.09Å; L177-I186 HydrophobicContact CG-CD1 4.24Å; L177-I186 HydrophobicContact CG-CG2 4.39Å; L177-I186 WeakPolarHBondContact O-CB 3.38Å; L177-I186 PolarHBondContact O-N 3.17Å; D179-I186 HydrophobicContact CB-CD1 3.88Å; D179-I186 HydrophobicContact CB-CG1 3.91Å; Q184-I186 PolarHBondContact O-N 2.79Å
187	Q	96.5	Very high	96.8	Very high	57 Å²	57	56.3 Å²	56.3	27%	0.266	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	141.4	-177.1	-172	58	46.5	0	0	110.9	V176 L177 F189	V176-Q187 WeakPolarHBondContact CA-O 3.36Å; V176-Q187 WeakPolarHBondContact CG1-O 3.44Å; L177-Q187 HydrophobicContact CB-CB 4.27Å; L177-Q187 PolarHBondContact N-O 3.42Å; L177-Q187 PolarHBondContact O-N 2.94Å; Q187-F189 HydrophobicContact CB-CE2 4.27Å; Q187-F189 HydrophobicContact CB-CZ 3.93Å; Q187-F189 HydrophobicContact CG-CD1 4.46Å; Q187-F189 HydrophobicContact CG-CE1 3.77Å; Q187-F189 HydrophobicContact CG-CE2 4.2Å; Q187-F189 HydrophobicContact CG-CZ 3.6Å
188	S	97.1	Very high	96.8	Very high	22 Å²	22	56.4 Å²	56.4	15%	0.154	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	145.5	171.1	-56.1	0	0	0	0	110.4	Y190	S188-Y190 VanDerWaalsContact CB-CE2 3.43Å
189	F	98.1	Very high	96.8	Very high	1 Å²	1	55.9 Å²	55.9	0%	0.004	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	112.9	-178.6	-52.6	-82.9	0	0	0	108.9	L167 C175 L177 Q187 F210 W222 M224	L167-F189 HydrophobicContact CD1-CD2 4.34Å; L167-F189 HydrophobicContact CD1-CE2 3.91Å; C175-F189 HydrophobicContact CB-CB 4.03Å; C175-F189 HydrophobicContact CB-CD2 4Å; C175-F189 HydrophobicContact CB-CG 4.41Å; C175-F189 PolarHBondContact N-O 2.79Å; C175-F189 VanDerWaalsContact N-O 3.16Å; C175-F189 WeakPolarHBondContact O-CD2 3.43Å; C175-F189 PolarHBondContact O-N 2.93Å; L177-F189 HydrophobicContact CB-CE2 3.94Å; L177-F189 HydrophobicContact CB-CZ 4.4Å; Q187-F189 HydrophobicContact CB-CE2 4.27Å; Q187-F189 HydrophobicContact CB-CZ 3.93Å; Q187-F189 HydrophobicContact CG-CD1 4.46Å; Q187-F189 HydrophobicContact CG-CE1 3.77Å; Q187-F189 HydrophobicContact CG-CE2 4.2Å; Q187-F189 HydrophobicContact CG-CZ 3.6Å; F189-F210 HydrophobicContact CB-CZ 4.24Å; F189-F210 AromaticContact CD1-CE1 3.82Å; F189-F210 HydrophobicContact CD1-CE1 3.82Å; F189-F210 HydrophobicContact CD1-CZ 4.07Å; F189-F210 AromaticContact CD2-CE1 3.75Å; F189-F210 HydrophobicContact CD2-CE1 3.75Å; F189-F210 AromaticContact CD2-CZ 3.65Å; F189-F210 HydrophobicContact CD2-CZ 3.65Å; F189-F210 AromaticContact CE1-CE1 3.71Å; F189-F210 HydrophobicContact CE1-CE1 3.71Å; F189-F210 HydrophobicContact CE1-CZ 4.4Å; F189-F210 AromaticContact CE2-CE1 3.64Å; F189-F210 HydrophobicContact CE2-CE1 3.64Å; F189-F210 HydrophobicContact CE2-CZ 4.01Å; F189-F210 AromaticContact CG-CE1 3.86Å; F189-F210 HydrophobicContact CG-CE1 3.86Å; F189-F210 AromaticContact CG-CZ 3.71Å; F189-F210 HydrophobicContact CG-CZ 3.71Å; F189-F210 AromaticContact CZ-CE1 3.64Å; F189-F210 HydrophobicContact CZ-CE1 3.64Å; F189-F210 HydrophobicContact CZ-CZ 4.39Å; F189-W222 HydrophobicContact CB-CD2 4.03Å; F189-W222 HydrophobicContact CB-CE3 3.74Å; F189-W222 HydrophobicContact CB-CH2 4.4Å; F189-W222 HydrophobicContact CB-CZ3 3.94Å; F189-W222 HydrophobicContact CD1-CB 4.03Å; F189-W222 HydrophobicContact CD1-CD2 4.29Å; F189-W222 AromaticContact CD1-CE3 3.99Å; F189-W222 HydrophobicContact CD1-CE3 3.99Å; F189-W222 HydrophobicContact CD1-CG 4.33Å; F189-W222 HydrophobicContact CE1-CB 4.36Å; F189-W222 HydrophobicContact CG-CD2 4.45Å; F189-W222 HydrophobicContact CG-CE3 4.3Å; F189-M224 HydrophobicContact CZ-CB 4.37Å; F189-M224 HydrophobicContact CZ-CG 4.38Å
190	Y	97	Very high	96.8	Very high	163 Å²	163	54.3 Å²	54.3	64%	0.639	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	135.3	-179.3	-59	-77.1	0	0	0	109.5	S188 W222	S188-Y190 VanDerWaalsContact CB-CE2 3.43Å; Y190-W222 WeakPolarHBondContact O-CH2 3.39Å; Y190-W222 WeakPolarHBondContact O-CZ3 3.06Å
191	G	94.2	Very high	96.8	Very high	52 Å²	52	55.3 Å²	55.3	54%	0.536	30%	0.296	S	S	.	.			trans	160.4	-18.4	176.4	0	0	0	0	0	114.9
192	H	97.3	Very high	96.7	Very high	11 Å²	11	50.9 Å²	50.9	5%	0.051	28%	0.277	C	S	.	.			trans	-68.4	144.6	163.6	-81.1	-70.1	0	0	0	110.1	V196 S212 D216 N220 W222	H192-V196 HydrophobicContact CB-CG2 4.08Å; H192-S212 PolarHBondContact CD2-OG 3.27Å; H192-S212 PolarHBondContact NE2-OG 2.72Å; H192-D216 WeakPolarHBondContact CA-OD2 3.36Å; H192-D216 WeakPolarHBondContact CB-OD2 3.24Å; H192-D216 IonicContact CE1-OD1 3.69Å; H192-D216 IonicContact CE1-OD2 3.89Å; H192-D216 IonicContact CG-OD2 3.55Å; H192-D216 IonicContact ND1-OD1 3.06Å; H192-D216 PolarHBondContact ND1-OD1 3.25Å; H192-D216 IonicContact ND1-OD2 2.68Å; H192-D216 PolarHBondContact ND1-OD2 3.31Å; H192-N220 PolarHBondContact CE1-ND2 3.4Å; H192-N220 PolarHBondContact NE2-ND2 2.9Å; H192-W222 AromaticContact CD2-CZ2 3.95Å
193	S	96.6	Very high	96.2	Very high	105 Å²	105	47.6 Å²	47.6	73%	0.734	27%	0.273	S	S	*	.	S	Bend	trans	-99.6	-1.5	178.3	59.8	0	0	0	0	113.6	D216	S193-D216 PolarHBondContact N-OD2 2.86Å; S193-D216 WeakPolarHBondContact OG-CB 3.39Å
194	A	97.8	Very high	95.4	Very high	27 Å²	27	47.9 Å²	47.9	22%	0.223	27%	0.273	C	S	.	.	S	Bend	trans	-149.1	-173.8	177.7	0	0	0	0	0	109.9	S173 V196 C215 D216	S173-A194 WeakPolarHBondContact CA-O 3.29Å; S173-A194 VanDerWaalsContact CB-O 3.24Å; S173-A194 WeakPolarHBondContact CB-O 3.46Å; A194-V196 PolarHBondContact O-N 3.25Å; A194-C215 HydrophobicContact CB-CB 3.78Å; A194-D216 HydrophobicContact CB-CB 4.15Å
195	D	98.1	Very high	93.7	Very high	52 Å²	52	50 Å²	50	28%	0.278	28%	0.283	S	S	.	.			trans	-54.6	131.1	-176.3	-56.8	16.7	0	0	0	111.8	Y153 L197 G214 C215	Y153-D195 WeakPolarHBondContact CE1-OD2 3.47Å; Y153-D195 VanDerWaalsContact CZ-OD2 3.31Å; Y153-D195 WeakPolarHBondContact OH-CB 3.43Å; Y153-D195 PolarHBondContact OH-OD2 2.82Å; D195-L197 HydrophobicContact CB-CD2 4.47Å; D195-G214 CarbonylContact O-C 3.52Å; D195-G214 WeakPolarHBondContact O-CA 3.3Å; D195-C215 HydrophobicContact CB-CB 4.42Å; D195-C215 PolarHBondContact O-N 3.42Å
196	V	98.5	Very high	92	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	130.5	170.2	-178.1	0	0	0	0	107.5	S155 S170 H192 A194 I199	S155-V196 WeakPolarHBondContact CB-O 3.22Å; S155-V196 PolarHBondContact OG-O 2.94Å; S170-V196 PolarHBondContact O-N 2.91Å; S170-V196 VanDerWaalsContact O-N 3.08Å; H192-V196 HydrophobicContact CB-CG2 4.08Å; A194-V196 PolarHBondContact O-N 3.25Å; V196-I199 HydrophobicContact CG1-CG2 4.48Å
197	L	98.3	Very high	90.3	Very high	38 Å²	38	51.8 Å²	51.8	20%	0.199	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-32.6	-176.7	-61.6	-177.9	0	0	0	113.3	D195 G213 D239 N241	D195-L197 HydrophobicContact CB-CD2 4.47Å; L197-G213 PolarHBondContact N-O 2.86Å; L197-D239 HydrophobicContact CD1-CB 4.22Å; L197-N241 WeakPolarHBondContact CD1-OD1 3.28Å
198	S	97.8	Very high	89.6	Confident	8 Å²	8	56.4 Å²	56.4	6%	0.056	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	151.4	-175.8	177.5	0	0	0	0	112.6	S212 G213 N241 V243	S198-S212 CarbonylContact O-C 3.54Å; S198-S212 WeakPolarHBondContact O-CA 3.47Å; S198-G213 PolarHBondContact N-O 3.06Å; S198-G213 PolarHBondContact O-N 3.02Å; S198-N241 VanDerWaalsContact CB-O 3.32Å; S198-N241 WeakPolarHBondContact CB-O 3.36Å; S198-V243 WeakPolarHBondContact OG-CG2 3.34Å; S198-V243 PolarHBondContact OG-N 2.65Å; S198-V243 VanDerWaalsContact OG-N 3.08Å
199	I	97.8	Very high	89.4	Confident	5 Å²	5	57.3 Å²	57.3	3%	0.026	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	153	172.7	58	178.6	0	0	0	111.7	C156 L158 L167 V196 F210 V211 R244	C156-I199 HydrophobicContact CB-CG1 4.06Å; L158-I199 HydrophobicContact CB-CD1 4.14Å; L167-I199 HydrophobicContact CB-CD1 4.14Å; L167-I199 HydrophobicContact CD2-CB 4.48Å; L167-I199 HydrophobicContact CD2-CD1 3.94Å; L167-I199 HydrophobicContact CG-CD1 3.8Å; L167-I199 WeakPolarHBondContact O-CD1 3.34Å; V196-I199 HydrophobicContact CG1-CG2 4.48Å; I199-F210 HydrophobicContact CG2-CD2 4.35Å; I199-F210 HydrophobicContact CG2-CE2 4.27Å; I199-V211 CarbonylContact C-O 3.51Å; I199-V211 VanDerWaalsContact CA-O 3.27Å; I199-V211 WeakPolarHBondContact CA-O 3.35Å; I199-R244 PolarHBondContact O-NH1 2.81Å
200	A	97.1	Very high	89.4	Confident	5 Å²	5	57.3 Å²	57.3	4%	0.041	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	132.7	172.7	0	0	0	0	0	110.5	F210 V211 V243 I245	A200-F210 CarbonylContact O-C 3.53Å; A200-F210 VanDerWaalsContact O-CA 3.25Å; A200-F210 WeakPolarHBondContact O-CA 3.31Å; A200-F210 VanDerWaalsContact O-CB 3.3Å; A200-F210 WeakPolarHBondContact O-CB 3.24Å; A200-V211 PolarHBondContact N-O 3.27Å; A200-V211 PolarHBondContact O-N 3.17Å; A200-V243 HydrophobicContact CB-CG2 4.04Å; A200-I245 HydrophobicContact CB-CD1 4.07Å; A200-I245 HydrophobicContact CB-CG1 4.06Å; A200-I245 VanDerWaalsContact O-CD1 3.29Å; A200-I245 WeakPolarHBondContact O-CD1 3.46Å
201	L	94.7	Very high	89.4	Confident	33 Å²	33	49.6 Å²	49.6	17%	0.173	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	145	175.7	-70.1	-178.2	0	0	0	111.8	L158 F159 N160 L167 F210 M224 I245	L158-L201 HydrophobicContact CD2-CB 3.97Å; L158-L201 HydrophobicContact CD2-CD1 3.39Å; L158-L201 HydrophobicContact CD2-CG 3.43Å; L158-L201 VanDerWaalsContact CD2-CG 3.43Å; F159-L201 VanDerWaalsContact O-CD1 3.27Å; F159-L201 WeakPolarHBondContact O-CD1 3.22Å; N160-L201 HydrophobicContact CB-CD1 4.3Å; L167-L201 HydrophobicContact CD2-CD2 3.71Å; L201-F210 HydrophobicContact CD2-CB 3.61Å; L201-M224 HydrophobicContact CD2-CE 4.36Å; L201-M224 HydrophobicContact CD2-SD 4.03Å; L201-I245 WeakPolarHBondContact O-CD1 3.07Å
202	S	92.4	Very high	89.6	Confident	14 Å²	14	47.1 Å²	47.1	10%	0.098	26%	0.255	C	S	.	.			trans	-63.8	137	172.3	-174.8	0	0	0	0	110.7	S204 T209	S202-S204 PolarHBondContact O-N 3.26Å; S202-S204 PolarHBondContact OG-N 3.18Å; S202-T209 WeakPolarHBondContact CB-O 3.48Å; S202-T209 PolarHBondContact N-O 2.84Å
203	P	85.5	Confident	89.7	Confident	74 Å²	74	46.6 Å²	46.6	48%	0.481	25%	0.252	S	S	.	.			trans	-74.9	-10.5	176.5	31.2	-35.5	0	0	0	113.1	E205 I245 P247	P203-E205 PolarHBondContact O-N 3Å; P203-I245 HydrophobicContact CG-CG2 4.39Å; P203-P247 WeakPolarHBondContact CG-O 3.49Å
204	S	78	Confident	89.7	Confident	47 Å²	47	41.6 Å²	41.6	33%	0.329	22%	0.217	S	C	.	.			trans	-68.7	127.8	-178.6	174.1	0	0	0	0	110.9	S202 F206 G207	S202-S204 PolarHBondContact O-N 3.26Å; S202-S204 PolarHBondContact OG-N 3.18Å; S204-F206 PolarHBondContact O-N 2.87Å; S204-F206 VanDerWaalsContact O-N 3.11Å; S204-F206 PolarHBondContact OG-N 3.14Å; S204-G207 WeakPolarHBondContact O-CA 3.49Å; S204-G207 PolarHBondContact O-N 3.13Å; S204-G207 PolarHBondContact OG-N 2.87Å
205	E	62.4	Low	89.7	Confident	169 Å²	169	41.7 Å²	41.7	79%	0.79	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-23.4	175.2	-63.4	-176.6	173.2	0	0	112.7	P203	P203-E205 PolarHBondContact O-N 3Å
206	F	60.8	Low	89.7	Confident	183 Å²	183	40.5 Å²	40.5	80%	0.803	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-14.6	174.4	-52.9	-72.2	0	0	0	112.7	S204 R208	S204-F206 PolarHBondContact O-N 2.87Å; S204-F206 VanDerWaalsContact O-N 3.11Å; S204-F206 PolarHBondContact OG-N 3.14Å; F206-R208 PolarHBondContact O-N 2.76Å
207	G	60.4	Low	89.7	Confident	21 Å²	21	47 Å²	47	22%	0.216	23%	0.234	C	C	.	.			trans	-75.8	91	-172.9	0	0	0	0	0	111.7	S204 T209	S204-G207 WeakPolarHBondContact O-CA 3.49Å; S204-G207 PolarHBondContact O-N 3.13Å; S204-G207 PolarHBondContact OG-N 2.87Å; G207-T209 PolarHBondContact O-N 3.26Å
208	R	81.7	Confident	89.7	Confident	155 Å²	155	45.7 Å²	45.7	59%	0.585	23%	0.228	S	C	*	.			trans	-77.2	36	170.7	-62.3	-179.4	-179	174.6	-0.8	111.7	F206 M224	F206-R208 PolarHBondContact O-N 2.76Å; R208-M224 HydrophobicContact CB-CB 4.36Å; R208-M224 WeakPolarHBondContact O-CB 3.3Å; R208-M224 VanDerWaalsContact O-CG 3.24Å; R208-M224 WeakPolarHBondContact O-CG 3.25Å; R208-M224 PolarHBondContact O-N 3.06Å
209	T	94	Very high	89.7	Confident	41 Å²	41	45.4 Å²	45.4	25%	0.252	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	151.8	-176.5	63	0	0	0	0	112.1	S202 G207 W222	S202-T209 WeakPolarHBondContact CB-O 3.48Å; S202-T209 PolarHBondContact N-O 2.84Å; G207-T209 PolarHBondContact O-N 3.26Å; T209-W222 WeakPolarHBondContact CA-O 3.39Å; T209-W222 VanDerWaalsContact CB-O 3.25Å; T209-W222 WeakPolarHBondContact CB-O 3.07Å; T209-W222 WeakPolarHBondContact CG2-O 3.28Å
210	F	96.5	Very high	89.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	160	171	77.5	-89.6	0	0	0	109.8	L167 C175 F189 I199 A200 L201 V221 W222 M224	L167-F210 HydrophobicContact CD1-CD1 4.42Å; L167-F210 HydrophobicContact CD1-CE1 4.04Å; L167-F210 HydrophobicContact CD1-CE2 4.46Å; L167-F210 HydrophobicContact CD1-CZ 4.07Å; L167-F210 HydrophobicContact CD2-CB 3.94Å; L167-F210 HydrophobicContact CD2-CD1 3.84Å; L167-F210 HydrophobicContact CD2-CD2 3.6Å; L167-F210 HydrophobicContact CD2-CE1 4.19Å; L167-F210 HydrophobicContact CD2-CE2 3.97Å; L167-F210 HydrophobicContact CD2-CG 3.52Å; L167-F210 HydrophobicContact CD2-CZ 4.25Å; C175-F210 HydrophobicContact CB-CE2 4.08Å; C175-F210 HydrophobicContact CB-CZ 3.88Å; F189-F210 HydrophobicContact CB-CZ 4.24Å; F189-F210 AromaticContact CD1-CE1 3.82Å; F189-F210 HydrophobicContact CD1-CE1 3.82Å; F189-F210 HydrophobicContact CD1-CZ 4.07Å; F189-F210 AromaticContact CD2-CE1 3.75Å; F189-F210 HydrophobicContact CD2-CE1 3.75Å; F189-F210 AromaticContact CD2-CZ 3.65Å; F189-F210 HydrophobicContact CD2-CZ 3.65Å; F189-F210 AromaticContact CE1-CE1 3.71Å; F189-F210 HydrophobicContact CE1-CE1 3.71Å; F189-F210 HydrophobicContact CE1-CZ 4.4Å; F189-F210 AromaticContact CE2-CE1 3.64Å; F189-F210 HydrophobicContact CE2-CE1 3.64Å; F189-F210 HydrophobicContact CE2-CZ 4.01Å; F189-F210 AromaticContact CG-CE1 3.86Å; F189-F210 HydrophobicContact CG-CE1 3.86Å; F189-F210 AromaticContact CG-CZ 3.71Å; F189-F210 HydrophobicContact CG-CZ 3.71Å; F189-F210 AromaticContact CZ-CE1 3.64Å; F189-F210 HydrophobicContact CZ-CE1 3.64Å; F189-F210 HydrophobicContact CZ-CZ 4.39Å; I199-F210 HydrophobicContact CG2-CD2 4.35Å; I199-F210 HydrophobicContact CG2-CE2 4.27Å; A200-F210 CarbonylContact O-C 3.53Å; A200-F210 VanDerWaalsContact O-CA 3.25Å; A200-F210 WeakPolarHBondContact O-CA 3.31Å; A200-F210 VanDerWaalsContact O-CB 3.3Å; A200-F210 WeakPolarHBondContact O-CB 3.24Å; L201-F210 HydrophobicContact CD2-CB 3.61Å; F210-V221 WeakPolarHBondContact O-CA 3.25Å; F210-W222 HydrophobicContact CD1-CB 3.71Å; F210-W222 HydrophobicContact CD1-CG 4.31Å; F210-W222 AromaticContact CD2-CD1 3.69Å; F210-W222 HydrophobicContact CD2-CG 4.41Å; F210-W222 HydrophobicContact CE1-CB 3.33Å; F210-W222 AromaticContact CE1-CD1 3.92Å; F210-W222 AromaticContact CE1-CG 3.71Å; F210-W222 HydrophobicContact CE1-CG 3.71Å; F210-W222 HydrophobicContact CE2-CB 4.27Å; F210-W222 AromaticContact CE2-CD1 3.2Å; F210-W222 AromaticContact CE2-CG 3.82Å; F210-W222 HydrophobicContact CE2-CG 3.82Å; F210-W222 AromaticContact CE2-NE1 3.76Å; F210-W222 HydrophobicContact CG-CB 4.33Å; F210-W222 HydrophobicContact CZ-CB 3.64Å; F210-W222 AromaticContact CZ-CD1 3.33Å; F210-W222 HydrophobicContact CZ-CD2 4.2Å; F210-W222 AromaticContact CZ-CG 3.43Å; F210-W222 HydrophobicContact CZ-CG 3.43Å; F210-W222 VanDerWaalsContact CZ-CG 3.43Å; F210-W222 AromaticContact CZ-NE1 3.99Å; F210-W222 PolarHBondContact N-O 3.48Å; F210-W222 PolarHBondContact O-N 2.96Å; F210-M224 HydrophobicContact CD1-CG 3.65Å; F210-M224 HydrophobicContact CD1-SD 4.36Å; F210-M224 HydrophobicContact CE1-CG 4.21Å
211	V	97.8	Very high	89.7	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138.3	175.6	-177.2	0	0	0	0	108.7	I199 A200 A219 N220 V221 V243 I245 F252	I199-V211 CarbonylContact C-O 3.51Å; I199-V211 VanDerWaalsContact CA-O 3.27Å; I199-V211 WeakPolarHBondContact CA-O 3.35Å; A200-V211 PolarHBondContact N-O 3.27Å; A200-V211 PolarHBondContact O-N 3.17Å; V211-A219 HydrophobicContact CG1-CB 4.36Å; V211-N220 CarbonylContact C-O 3.5Å; V211-N220 VanDerWaalsContact CA-O 3.26Å; V211-N220 WeakPolarHBondContact CA-O 3.25Å; V211-V221 HydrophobicContact CG2-CG1 4.46Å; V211-V221 HydrophobicContact CG2-CG2 4.11Å; V211-V243 HydrophobicContact CG1-CB 4.3Å; V211-V243 HydrophobicContact CG1-CG1 4.3Å; V211-I245 HydrophobicContact CB-CD1 4.42Å; V211-I245 HydrophobicContact CB-CG1 4.47Å; V211-I245 HydrophobicContact CG2-CD1 3.92Å; V211-I245 HydrophobicContact CG2-CG1 3.98Å; V211-F252 HydrophobicContact CG1-CD2 3.92Å; V211-F252 HydrophobicContact CG1-CE2 3.95Å; V211-F252 HydrophobicContact CG1-CG 4.28Å; V211-F252 HydrophobicContact CG1-CZ 4.33Å; V211-F252 HydrophobicContact CG2-CD1 4.26Å; V211-F252 HydrophobicContact CG2-CG 4.28Å
212	S	98.4	Very high	89.8	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	150.6	168.9	61.1	0	0	0	0	111.3	H192 S198 A219 N220 W222	H192-S212 PolarHBondContact CD2-OG 3.27Å; H192-S212 PolarHBondContact NE2-OG 2.72Å; S198-S212 CarbonylContact O-C 3.54Å; S198-S212 WeakPolarHBondContact O-CA 3.47Å; S212-A219 CarbonylContact O-C 3.59Å; S212-A219 WeakPolarHBondContact O-CA 3.48Å; S212-N220 PolarHBondContact N-O 3.42Å; S212-N220 PolarHBondContact O-N 3.31Å; S212-W222 PolarHBondContact OG-NE1 2.58Å
213	G	98.3	Very high	90	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	146.9	170.8	0	0	0	0	0	110.6	L197 S198 C218 V240	L197-G213 PolarHBondContact N-O 2.86Å; S198-G213 PolarHBondContact N-O 3.06Å; S198-G213 PolarHBondContact O-N 3.02Å; G213-C218 WeakPolarHBondContact CA-O 3.2Å; G213-V240 CarbonylContact C-O 3.59Å
214	G	97.7	Very high	90.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	-177.7	-175.8	0	0	0	0	0	115.4	D195 D216 R217 C218 V240	D195-G214 CarbonylContact O-C 3.52Å; D195-G214 WeakPolarHBondContact O-CA 3.3Å; G214-D216 PolarHBondContact O-N 3.06Å; G214-R217 PolarHBondContact O-N 2.57Å; G214-C218 PolarHBondContact N-O 2.98Å; G214-V240 PolarHBondContact O-N 3.33Å
215	C	98.3	Very high	91.1	Very high	29 Å²	29	47 Å²	47	20%	0.196	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-5.7	177.9	-65.3	0	0	0	0	113.7	A194 D195 R217 D239	A194-C215 HydrophobicContact CB-CB 3.78Å; D195-C215 HydrophobicContact CB-CB 4.42Å; D195-C215 PolarHBondContact O-N 3.42Å; C215-R217 PolarHBondContact O-N 2.91Å; C215-D239 PolarHBondContact SG-OD2 2.85Å
216	D	97.5	Very high	92.6	Very high	26 Å²	26	41 Å²	41	14%	0.139	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	10.1	170	62.8	-0.8	0	0	0	112.7	H192 S193 A194 G214 C218	H192-D216 WeakPolarHBondContact CA-OD2 3.36Å; H192-D216 WeakPolarHBondContact CB-OD2 3.24Å; H192-D216 IonicContact CE1-OD1 3.69Å; H192-D216 IonicContact CE1-OD2 3.89Å; H192-D216 IonicContact CG-OD2 3.55Å; H192-D216 IonicContact ND1-OD1 3.06Å; H192-D216 PolarHBondContact ND1-OD1 3.25Å; H192-D216 IonicContact ND1-OD2 2.68Å; H192-D216 PolarHBondContact ND1-OD2 3.31Å; S193-D216 PolarHBondContact N-OD2 2.86Å; S193-D216 WeakPolarHBondContact OG-CB 3.39Å; A194-D216 HydrophobicContact CB-CB 4.15Å; G214-D216 PolarHBondContact O-N 3.06Å; D216-C218 PolarHBondContact O-N 3.41Å; D216-C218 VanDerWaalsContact O-N 3.14Å; D216-C218 PolarHBondContact O-SG 2.98Å; D216-C218 PolarHBondContact OD1-N 3.21Å
217	R	98.1	Very high	94.2	Very high	137 Å²	137	32.6 Å²	32.6	52%	0.517	15%	0.153	S	C	.	.	S	Bend	trans	63.8	16.3	175.8	-39.9	176.2	-155.1	168.8	8.5	113.1	G214 C215	G214-R217 PolarHBondContact O-N 2.57Å; C215-R217 PolarHBondContact O-N 2.91Å
218	C	97.7	Very high	95.9	Very high	10 Å²	10	37.6 Å²	37.6	7%	0.068	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	149.2	-178.4	-62.3	0	0	0	0	110.5	G213 G214 D216 V232 F233 Q234	G213-C218 WeakPolarHBondContact CA-O 3.2Å; G214-C218 PolarHBondContact N-O 2.98Å; D216-C218 PolarHBondContact O-N 3.41Å; D216-C218 VanDerWaalsContact O-N 3.14Å; D216-C218 PolarHBondContact O-SG 2.98Å; D216-C218 PolarHBondContact OD1-N 3.21Å; C218-V232 HydrophobicContact CB-CG1 4.39Å; C218-F233 WeakPolarHBondContact CA-O 3.21Å; C218-Q234 PolarHBondContact SG-NE2 2.89Å; C218-Q234 VanDerWaalsContact SG-NE2 3.45Å
219	A	98.3	Very high	96.6	Very high	2 Å²	2	32.2 Å²	32.2	2%	0.017	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.5	160.7	0	0	0	0	0	109.3	V211 S212 F233 F252 T254	V211-A219 HydrophobicContact CG1-CB 4.36Å; S212-A219 CarbonylContact O-C 3.59Å; S212-A219 WeakPolarHBondContact O-CA 3.48Å; A219-F233 HydrophobicContact CB-CB 4.32Å; A219-F233 PolarHBondContact N-O 2.8Å; A219-F233 PolarHBondContact O-N 3.06Å; A219-F252 HydrophobicContact CB-CE2 3.61Å; A219-F252 HydrophobicContact CB-CZ 4.01Å; A219-T254 HydrophobicContact CB-CG2 3.84Å
220	N	98.1	Very high	96.7	Very high	5 Å²	5	34 Å²	34	3%	0.027	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	134.7	-174.8	-69.2	-6.7	0	0	0	110.1	H192 V211 S212 W222	H192-N220 PolarHBondContact CE1-ND2 3.4Å; H192-N220 PolarHBondContact NE2-ND2 2.9Å; V211-N220 CarbonylContact C-O 3.5Å; V211-N220 VanDerWaalsContact CA-O 3.26Å; V211-N220 WeakPolarHBondContact CA-O 3.25Å; S212-N220 PolarHBondContact N-O 3.42Å; S212-N220 PolarHBondContact O-N 3.31Å; N220-W222 HydrophobicContact CB-CZ2 3.6Å; N220-W222 PolarHBondContact O-NE1 3.18Å
221	V	97.6	Very high	96.7	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.018	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	133	172.5	-169.8	0	0	0	0	108.5	F210 V211 C229 V230 Q231 F233 F252 L266	F210-V221 WeakPolarHBondContact O-CA 3.25Å; V211-V221 HydrophobicContact CG2-CG1 4.46Å; V211-V221 HydrophobicContact CG2-CG2 4.11Å; V221-C229 CarbonylContact O-C 3.57Å; V221-C229 WeakPolarHBondContact O-CA 3.21Å; V221-C229 PolarHBondContact O-SG 3.28Å; V221-V230 HydrophobicContact CB-CG2 3.88Å; V221-V230 HydrophobicContact CG1-CG2 3.7Å; V221-V230 WeakPolarHBondContact O-CG2 3.12Å; V221-V230 PolarHBondContact O-N 3.22Å; V221-Q231 HydrophobicContact CB-CB 4.03Å; V221-Q231 HydrophobicContact CG2-CB 3.88Å; V221-Q231 PolarHBondContact N-O 2.84Å; V221-F233 HydrophobicContact CG2-CD2 4.05Å; V221-F233 HydrophobicContact CG2-CE2 3.62Å; V221-F252 HydrophobicContact CG2-CE1 4.41Å; V221-L266 HydrophobicContact CG2-CD2 3.66Å
222	W	97.4	Very high	96.6	Very high	1 Å²	1	38.6 Å²	38.6	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	141.5	-173.4	-54.6	90.9	0	0	0	111.2	F189 Y190 H192 T209 F210 S212 N220 Q228 C229	F189-W222 HydrophobicContact CB-CD2 4.03Å; F189-W222 HydrophobicContact CB-CE3 3.74Å; F189-W222 HydrophobicContact CB-CH2 4.4Å; F189-W222 HydrophobicContact CB-CZ3 3.94Å; F189-W222 HydrophobicContact CD1-CB 4.03Å; F189-W222 HydrophobicContact CD1-CD2 4.29Å; F189-W222 AromaticContact CD1-CE3 3.99Å; F189-W222 HydrophobicContact CD1-CE3 3.99Å; F189-W222 HydrophobicContact CD1-CG 4.33Å; F189-W222 HydrophobicContact CE1-CB 4.36Å; F189-W222 HydrophobicContact CG-CD2 4.45Å; F189-W222 HydrophobicContact CG-CE3 4.3Å; Y190-W222 WeakPolarHBondContact O-CH2 3.39Å; Y190-W222 WeakPolarHBondContact O-CZ3 3.06Å; H192-W222 AromaticContact CD2-CZ2 3.95Å; T209-W222 WeakPolarHBondContact CA-O 3.39Å; T209-W222 VanDerWaalsContact CB-O 3.25Å; T209-W222 WeakPolarHBondContact CB-O 3.07Å; T209-W222 WeakPolarHBondContact CG2-O 3.28Å; F210-W222 HydrophobicContact CD1-CB 3.71Å; F210-W222 HydrophobicContact CD1-CG 4.31Å; F210-W222 AromaticContact CD2-CD1 3.69Å; F210-W222 HydrophobicContact CD2-CG 4.41Å; F210-W222 HydrophobicContact CE1-CB 3.33Å; F210-W222 AromaticContact CE1-CD1 3.92Å; F210-W222 AromaticContact CE1-CG 3.71Å; F210-W222 HydrophobicContact CE1-CG 3.71Å; F210-W222 HydrophobicContact CE2-CB 4.27Å; F210-W222 AromaticContact CE2-CD1 3.2Å; F210-W222 AromaticContact CE2-CG 3.82Å; F210-W222 HydrophobicContact CE2-CG 3.82Å; F210-W222 AromaticContact CE2-NE1 3.76Å; F210-W222 HydrophobicContact CG-CB 4.33Å; F210-W222 HydrophobicContact CZ-CB 3.64Å; F210-W222 AromaticContact CZ-CD1 3.33Å; F210-W222 HydrophobicContact CZ-CD2 4.2Å; F210-W222 AromaticContact CZ-CG 3.43Å; F210-W222 HydrophobicContact CZ-CG 3.43Å; F210-W222 VanDerWaalsContact CZ-CG 3.43Å; F210-W222 AromaticContact CZ-NE1 3.99Å; F210-W222 PolarHBondContact N-O 3.48Å; F210-W222 PolarHBondContact O-N 2.96Å; S212-W222 PolarHBondContact OG-NE1 2.58Å; N220-W222 HydrophobicContact CB-CZ2 3.6Å; N220-W222 PolarHBondContact O-NE1 3.18Å; W222-Q228 WeakPolarHBondContact CA-O 3.17Å; W222-C229 HydrophobicContact CD2-CB 4.37Å; W222-C229 HydrophobicContact CE3-CB 3.72Å; W222-C229 HydrophobicContact CH2-CB 4.01Å; W222-C229 HydrophobicContact CZ3-CB 3.53Å
223	D	95	Very high	96.6	Very high	28 Å²	28	38.9 Å²	38.9	15%	0.15	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	112	164.6	173.1	2.1	0	0	0	109.4	R225 T226 G227 Q228 V230	D223-R225 PolarHBondContact O-N 3.33Å; D223-R225 WeakPolarHBondContact OD1-CB 3.29Å; D223-R225 PolarHBondContact OD1-N 2.78Å; D223-R225 IonicContact OD2-NH2 3.36Å; D223-T226 VanDerWaalsContact CB-OG1 3.31Å; D223-T226 WeakPolarHBondContact CB-OG1 3.14Å; D223-T226 VanDerWaalsContact CG-OG1 3.23Å; D223-T226 PolarHBondContact O-N 2.83Å; D223-T226 VanDerWaalsContact OD2-CG2 3.24Å; D223-T226 WeakPolarHBondContact OD2-CG2 3.34Å; D223-T226 PolarHBondContact OD2-OG1 2.85Å; D223-G227 PolarHBondContact O-N 3.23Å; D223-Q228 PolarHBondContact N-O 3.2Å; D223-V230 HydrophobicContact CB-CG1 3.83Å
224	M	94.2	Very high	96.4	Very high	18 Å²	18	44.9 Å²	44.9	9%	0.089	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-23.6	-178.4	-64.6	176.8	73	0	0	113.5	L177 F189 L201 R208 F210	L177-M224 HydrophobicContact CD1-CE 3.72Å; L177-M224 HydrophobicContact CD2-CE 3.82Å; L177-M224 HydrophobicContact CG-CE 4.37Å; F189-M224 HydrophobicContact CZ-CB 4.37Å; F189-M224 HydrophobicContact CZ-CG 4.38Å; L201-M224 HydrophobicContact CD2-CE 4.36Å; L201-M224 HydrophobicContact CD2-SD 4.03Å; R208-M224 HydrophobicContact CB-CB 4.36Å; R208-M224 WeakPolarHBondContact O-CB 3.3Å; R208-M224 VanDerWaalsContact O-CG 3.24Å; R208-M224 WeakPolarHBondContact O-CG 3.25Å; R208-M224 PolarHBondContact O-N 3.06Å; F210-M224 HydrophobicContact CD1-CG 3.65Å; F210-M224 HydrophobicContact CD1-SD 4.36Å; F210-M224 HydrophobicContact CE1-CG 4.21Å
225	R	92.8	Very high	96.2	Very high	156 Å²	156	46.3 Å²	46.3	59%	0.589	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-39.9	178.7	-179.3	-170.5	59	87.2	1.6	111.9	D223	D223-R225 PolarHBondContact O-N 3.33Å; D223-R225 WeakPolarHBondContact OD1-CB 3.29Å; D223-R225 PolarHBondContact OD1-N 2.78Å; D223-R225 IonicContact OD2-NH2 3.36Å
226	T	94.1	Very high	96.2	Very high	44 Å²	44	45.5 Å²	45.5	27%	0.27	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-19.1	-174.6	57.3	0	0	0	0	113.1	D223 Q228	D223-T226 VanDerWaalsContact CB-OG1 3.31Å; D223-T226 WeakPolarHBondContact CB-OG1 3.14Å; D223-T226 VanDerWaalsContact CG-OG1 3.23Å; D223-T226 PolarHBondContact O-N 2.83Å; D223-T226 VanDerWaalsContact OD2-CG2 3.24Å; D223-T226 WeakPolarHBondContact OD2-CG2 3.34Å; D223-T226 PolarHBondContact OD2-OG1 2.85Å; T226-Q228 PolarHBondContact O-N 3.02Å; T226-Q228 PolarHBondContact OG1-N 2.95Å
227	G	94.8	Very high	96.1	Very high	7 Å²	7	50.1 Å²	50.1	7%	0.072	26%	0.255	C	S	.	.			trans	76.9	1.7	-172.9	0	0	0	0	0	114.2	D223	D223-G227 PolarHBondContact O-N 3.23Å
228	Q	96.2	Very high	96.1	Very high	125 Å²	125	45.3 Å²	45.3	58%	0.584	24%	0.242	S	C	*	.			trans	-89.9	145	-172.7	-60.6	-60.2	-42.8	0	0	111.4	W222 D223 T226 V230	W222-Q228 WeakPolarHBondContact CA-O 3.17Å; D223-Q228 PolarHBondContact N-O 3.2Å; T226-Q228 PolarHBondContact O-N 3.02Å; T226-Q228 PolarHBondContact OG1-N 2.95Å; Q228-V230 PolarHBondContact O-N 3.16Å
229	C	96.7	Very high	96.2	Very high	42 Å²	42	47 Å²	47	28%	0.284	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	117.8	165	-172.7	0	0	0	0	108.5	V221 W222 Q231 V232	V221-C229 CarbonylContact O-C 3.57Å; V221-C229 WeakPolarHBondContact O-CA 3.21Å; V221-C229 PolarHBondContact O-SG 3.28Å; W222-C229 HydrophobicContact CD2-CB 4.37Å; W222-C229 HydrophobicContact CE3-CB 3.72Å; W222-C229 HydrophobicContact CH2-CB 4.01Å; W222-C229 HydrophobicContact CZ3-CB 3.53Å; C229-Q231 PolarHBondContact SG-O 2.62Å; C229-Q231 VanDerWaalsContact SG-O 3.33Å; C229-V232 VanDerWaalsContact SG-CG2 3.54Å
230	V	95.5	Very high	96.2	Very high	78 Å²	78	47 Å²	47	47%	0.473	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-29.3	-176.4	-64	0	0	0	0	112.7	V221 D223 Q228	V221-V230 HydrophobicContact CB-CG2 3.88Å; V221-V230 HydrophobicContact CG1-CG2 3.7Å; V221-V230 WeakPolarHBondContact O-CG2 3.12Å; V221-V230 PolarHBondContact O-N 3.22Å; D223-V230 HydrophobicContact CB-CG1 3.83Å; Q228-V230 PolarHBondContact O-N 3.16Å
231	Q	95.8	Very high	96.2	Very high	40 Å²	40	48.1 Å²	48.1	19%	0.187	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	143.9	176.7	-65.1	175	-70.3	0	0	110	V221 C229 F233 L266 D269	V221-Q231 HydrophobicContact CB-CB 4.03Å; V221-Q231 HydrophobicContact CG2-CB 3.88Å; V221-Q231 PolarHBondContact N-O 2.84Å; C229-Q231 PolarHBondContact SG-O 2.62Å; C229-Q231 VanDerWaalsContact SG-O 3.33Å; Q231-F233 HydrophobicContact CB-CD2 4.34Å; Q231-F233 HydrophobicContact CB-CE2 3.64Å; Q231-F233 HydrophobicContact CB-CZ 4.24Å; Q231-F233 HydrophobicContact CG-CE2 4.49Å; Q231-L266 PolarHBondContact NE2-O 2.86Å; Q231-D269 PolarHBondContact NE2-OD1 3.34Å
232	V	97	Very high	96.2	Very high	59 Å²	59	48.1 Å²	48.1	36%	0.358	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124.4	175.4	177.6	0	0	0	0	108.2	C218 C229 Q234	C218-V232 HydrophobicContact CB-CG1 4.39Å; C229-V232 VanDerWaalsContact SG-CG2 3.54Å; V232-Q234 HydrophobicContact CG1-CG 4.18Å
233	F	97.3	Very high	96.3	Very high	7 Å²	7	48.1 Å²	48.1	3%	0.031	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	119.8	178.1	-66.3	-88.4	0	0	0	109.7	C218 A219 V221 Q231 F252 F264 L266	C218-F233 WeakPolarHBondContact CA-O 3.21Å; A219-F233 HydrophobicContact CB-CB 4.32Å; A219-F233 PolarHBondContact N-O 2.8Å; A219-F233 PolarHBondContact O-N 3.06Å; V221-F233 HydrophobicContact CG2-CD2 4.05Å; V221-F233 HydrophobicContact CG2-CE2 3.62Å; Q231-F233 HydrophobicContact CB-CD2 4.34Å; Q231-F233 HydrophobicContact CB-CE2 3.64Å; Q231-F233 HydrophobicContact CB-CZ 4.24Å; Q231-F233 HydrophobicContact CG-CE2 4.49Å; F233-F252 HydrophobicContact CB-CZ 4.05Å; F233-F252 HydrophobicContact CD1-CZ 4.36Å; F233-F252 AromaticContact CD2-CE1 3.63Å; F233-F252 HydrophobicContact CD2-CE1 3.63Å; F233-F252 AromaticContact CD2-CZ 3.39Å; F233-F252 HydrophobicContact CD2-CZ 3.39Å; F233-F252 AromaticContact CE2-CE1 3.57Å; F233-F252 HydrophobicContact CE2-CE1 3.57Å; F233-F252 AromaticContact CE2-CZ 3.87Å; F233-F252 HydrophobicContact CE2-CZ 3.87Å; F233-F252 HydrophobicContact CG-CE1 4.16Å; F233-F252 AromaticContact CG-CZ 3.67Å; F233-F252 HydrophobicContact CG-CZ 3.67Å; F233-F252 HydrophobicContact CZ-CE1 4.04Å; F233-F264 HydrophobicContact CB-CD1 3.93Å; F233-F264 HydrophobicContact CB-CE1 3.92Å; F233-F264 HydrophobicContact CB-CG 4.26Å; F233-F264 HydrophobicContact CB-CZ 4.24Å; F233-F264 HydrophobicContact CD1-CB 3.94Å; F233-F264 AromaticContact CD1-CD1 3.34Å; F233-F264 HydrophobicContact CD1-CD1 3.34Å; F233-F264 HydrophobicContact CD1-CE1 4.03Å; F233-F264 AromaticContact CD1-CG 3.83Å; F233-F264 HydrophobicContact CD1-CG 3.83Å; F233-F264 HydrophobicContact CE1-CB 4.06Å; F233-F264 HydrophobicContact CE1-CD1 4.12Å; F233-F264 HydrophobicContact CE1-CG 4.43Å; F233-F264 HydrophobicContact CG-CB 4.39Å; F233-F264 AromaticContact CG-CD1 3.92Å; F233-F264 HydrophobicContact CG-CD1 3.92Å; F233-F264 HydrophobicContact CG-CE1 4.39Å; F233-F264 HydrophobicContact CG-CG 4.14Å; F233-L266 HydrophobicContact CE2-CD2 3.86Å; F233-L266 HydrophobicContact CZ-CD2 4.01Å
234	Q	94.7	Very high	96.4	Very high	125 Å²	125	48.1 Å²	48.1	58%	0.584	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.8	149.2	175.4	-62.8	-173.8	-29.8	0	0	108.6	C218 V232	C218-Q234 PolarHBondContact SG-NE2 2.89Å; C218-Q234 VanDerWaalsContact SG-NE2 3.45Å; V232-Q234 HydrophobicContact CG1-CG 4.18Å
235	G	92.7	Very high	96.6	Very high	30 Å²	30	48.3 Å²	48.3	31%	0.309	26%	0.255	S	S	.	.			trans	168.8	-39.3	175.7	0	0	0	0	0	112.4	R262	G235-R262 PolarHBondContact O-NH1 3.47Å; G235-R262 PolarHBondContact O-NH2 3.49Å
236	H	97.8	Very high	96.8	Very high	13 Å²	13	43 Å²	43	6%	0.06	24%	0.236	C	C	.	.			trans	-61.6	144.4	179.1	-81.5	-64.1	0	0	0	112.7	V240 T254 S256 D258 T260 R262	H236-V240 HydrophobicContact CB-CG2 4.27Å; H236-T254 WeakPolarHBondContact NE2-CB 3.42Å; H236-T254 PolarHBondContact NE2-OG1 2.95Å; H236-S256 WeakPolarHBondContact CE1-CB 3.41Å; H236-S256 WeakPolarHBondContact ND1-CB 3.45Å; H236-D258 WeakPolarHBondContact CA-OD2 3.49Å; H236-D258 IonicContact CE1-OD1 3.51Å; H236-D258 IonicContact CE1-OD2 3.18Å; H236-D258 IonicContact CG-OD2 3.46Å; H236-D258 IonicContact ND1-OD1 2.8Å; H236-D258 PolarHBondContact ND1-OD1 2.82Å; H236-D258 IonicContact ND1-OD2 3.64Å; H236-D258 PolarHBondContact ND1-OD2 2.86Å; H236-T260 PolarHBondContact CE1-OG1 2.89Å; H236-T260 VanDerWaalsContact CE1-OG1 3.25Å; H236-T260 PolarHBondContact ND1-OG1 3.45Å; H236-R262 VanDerWaalsContact CE1-CD 3.41Å; H236-R262 WeakPolarHBondContact CE1-CD 3.31Å; H236-R262 PolarHBondContact ND1-NE 2.78Å
237	D	97.5	Very high	96.8	Very high	123 Å²	123	43.4 Å²	43.4	66%	0.658	24%	0.24	S	C	*	.	S	Bend	trans	-88.1	-9.6	179.6	-66.4	-48.3	0	0	0	112.5	D258	D237-D258 HydrophobicContact CB-CB 4.05Å; D237-D258 PolarHBondContact N-OD2 3.32Å
238	S	98.1	Very high	96.7	Very high	35 Å²	35	46.1 Å²	46.1	25%	0.245	26%	0.258	C	S	.	.	S	Bend	trans	-147	-176.6	-179.5	-156.8	0	0	0	0	111.4	S256 D257	S238-S256 PolarHBondContact O-OG 2.98Å; S238-S256 VanDerWaalsContact O-OG 3.13Å; S238-D257 VanDerWaalsContact OG-CB 3.29Å; S238-D257 WeakPolarHBondContact OG-CB 3.43Å
239	D	98.3	Very high	96.6	Very high	46 Å²	46	40.7 Å²	40.7	25%	0.246	24%	0.235	C	C	.	.			trans	-51.4	140.7	-176.7	-60.5	6.7	0	0	0	113.3	L197 C215 S256 D257	L197-D239 HydrophobicContact CD1-CB 4.22Å; C215-D239 PolarHBondContact SG-OD2 2.85Å; D239-S256 WeakPolarHBondContact O-CA 3.49Å; D239-S256 VanDerWaalsContact O-CB 3.24Å; D239-S256 WeakPolarHBondContact O-CB 3.18Å; D239-S256 PolarHBondContact O-OG 3.5Å; D239-D257 PolarHBondContact O-N 3.33Å; D239-D257 VanDerWaalsContact O-N 3.08Å
240	V	98.6	Very high	96.5	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	96	176.1	-178	0	0	0	0	109.2	G213 G214 H236 V243 T254	G213-V240 CarbonylContact C-O 3.59Å; G214-V240 PolarHBondContact O-N 3.33Å; H236-V240 HydrophobicContact CB-CG2 4.27Å; V240-V243 HydrophobicContact CG1-CG1 3.93Å; V240-T254 HydrophobicContact CG1-CG2 3.92Å
241	N	98.4	Very high	96.6	Very high	30 Å²	30	38.3 Å²	38.3	16%	0.16	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	-33	-174.5	-64.1	-43.7	0	0	0	113.9	L197 S198 G255 D257 C284	L197-N241 WeakPolarHBondContact CD1-OD1 3.28Å; S198-N241 VanDerWaalsContact CB-O 3.32Å; S198-N241 WeakPolarHBondContact CB-O 3.36Å; N241-G255 PolarHBondContact N-O 3.34Å; N241-D257 PolarHBondContact ND2-N 3.45Å; N241-D257 PolarHBondContact ND2-OD1 2.89Å; N241-C284 PolarHBondContact ND2-O 2.96Å
242	S	98.3	Very high	96.7	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.021	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	138.7	-173.3	-178.5	0	0	0	0	111.3	T254 G255 N285 V287	S242-T254 CarbonylContact O-C 3.58Å; S242-T254 VanDerWaalsContact O-CA 3.26Å; S242-T254 WeakPolarHBondContact O-CA 3.11Å; S242-G255 PolarHBondContact N-O 3.3Å; S242-G255 PolarHBondContact O-N 3.44Å; S242-N285 WeakPolarHBondContact CB-O 3.5Å; S242-V287 WeakPolarHBondContact OG-CG2 3.41Å; S242-V287 PolarHBondContact OG-N 2.96Å
243	V	98.3	Very high	96.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	139.6	171.9	-63.9	0	0	0	0	110.4	S198 A200 V211 V240 A253 T254	S198-V243 WeakPolarHBondContact OG-CG2 3.34Å; S198-V243 PolarHBondContact OG-N 2.65Å; S198-V243 VanDerWaalsContact OG-N 3.08Å; A200-V243 HydrophobicContact CB-CG2 4.04Å; V211-V243 HydrophobicContact CG1-CB 4.3Å; V211-V243 HydrophobicContact CG1-CG1 4.3Å; V240-V243 HydrophobicContact CG1-CG1 3.93Å; V243-A253 CarbonylContact C-O 3.51Å; V243-A253 WeakPolarHBondContact CA-O 3.3Å; V243-T254 HydrophobicContact CG1-CG2 3.9Å
244	R	98	Very high	96.8	Very high	29 Å²	29	33.2 Å²	33.2	11%	0.109	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	132.2	172	-79.5	-66	168	-113	30.7	111.5	I199 F252 A253 V287 D288 F289	I199-R244 PolarHBondContact O-NH1 2.81Å; R244-F252 CarbonylContact O-C 3.6Å; R244-F252 VanDerWaalsContact O-CA 3.22Å; R244-F252 WeakPolarHBondContact O-CA 3.33Å; R244-F252 VanDerWaalsContact O-CB 3.32Å; R244-F252 WeakPolarHBondContact O-CB 3.48Å; R244-A253 PolarHBondContact N-O 2.83Å; R244-A253 PolarHBondContact O-N 2.8Å; R244-V287 HydrophobicContact CB-CG2 4.21Å; R244-V287 HydrophobicContact CG-CG2 4.24Å; R244-V287 WeakPolarHBondContact CG-O 3.42Å; R244-D288 HydrophobicContact CG-CB 4.48Å; R244-F289 HydrophobicContact CB-CD2 4.35Å; R244-F289 HydrophobicContact CB-CE2 4.47Å
245	I	96.9	Very high	97	Very high	22 Å²	22	27.3 Å²	27.3	11%	0.113	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	138.9	177.5	-69.1	163.1	0	0	0	108.9	A200 L201 P203 V211 F252	A200-I245 HydrophobicContact CB-CD1 4.07Å; A200-I245 HydrophobicContact CB-CG1 4.06Å; A200-I245 VanDerWaalsContact O-CD1 3.29Å; A200-I245 WeakPolarHBondContact O-CD1 3.46Å; L201-I245 WeakPolarHBondContact O-CD1 3.07Å; P203-I245 HydrophobicContact CG-CG2 4.39Å; V211-I245 HydrophobicContact CB-CD1 4.42Å; V211-I245 HydrophobicContact CB-CG1 4.47Å; V211-I245 HydrophobicContact CG2-CD1 3.92Å; V211-I245 HydrophobicContact CG2-CG1 3.98Å; I245-F252 HydrophobicContact CG1-CB 4.03Å
246	F	96.9	Very high	97.3	Very high	43 Å²	43	25.9 Å²	25.9	19%	0.189	15%	0.148	C	C	.	.			trans	-64.6	147.4	175.6	-173.2	-97.6	0	0	0	110	S248 G249 A251 F289 G293 V310	F246-S248 WeakPolarHBondContact CD1-OG 3.48Å; F246-S248 PolarHBondContact O-N 2.74Å; F246-G249 PolarHBondContact O-N 3.36Å; F246-A251 HydrophobicContact CB-CB 3.81Å; F246-A251 WeakPolarHBondContact CB-O 3.37Å; F246-A251 HydrophobicContact CG-CB 4.3Å; F246-A251 PolarHBondContact N-O 3.39Å; F246-F289 HydrophobicContact CB-CE2 4.21Å; F246-F289 HydrophobicContact CB-CZ 4.38Å; F246-F289 HydrophobicContact CD2-CD1 4.02Å; F246-F289 AromaticContact CD2-CE1 3.73Å; F246-F289 HydrophobicContact CD2-CE1 3.73Å; F246-F289 HydrophobicContact CD2-CE2 4.3Å; F246-F289 HydrophobicContact CD2-CG 4.41Å; F246-F289 AromaticContact CD2-CZ 3.87Å; F246-F289 HydrophobicContact CD2-CZ 3.87Å; F246-F289 HydrophobicContact CE2-CD1 4.41Å; F246-F289 HydrophobicContact CE2-CE1 4.3Å; F246-G293 VanDerWaalsContact CE2-CA 3.43Å; F246-G293 WeakPolarHBondContact CE2-O 3.22Å; F246-V310 HydrophobicContact CE2-CG1 4.27Å
247	P	94.6	Very high	97.3	Very high	54 Å²	54	28.2 Å²	28.2	35%	0.351	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-28.5	-173.5	-30.5	37.3	0	0	0	116.2	P203 G249 F289	P203-P247 WeakPolarHBondContact CG-O 3.49Å; P247-G249 VanDerWaalsContact C-N 3.29Å; P247-G249 PolarHBondContact O-N 3.28Å; P247-F289 HydrophobicContact CG-CB 4.4Å
248	S	93.5	Very high	97.3	Very high	64 Å²	64	24 Å²	24	45%	0.448	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-20.9	175.4	80.2	0	0	0	0	113.8	F246 D250	F246-S248 WeakPolarHBondContact CD1-OG 3.48Å; F246-S248 PolarHBondContact O-N 2.74Å; S248-D250 VanDerWaalsContact C-N 3.35Å; S248-D250 WeakPolarHBondContact CB-OD2 3.49Å; S248-D250 PolarHBondContact OG-N 3.38Å; S248-D250 PolarHBondContact OG-OD2 3.46Å
249	G	93.8	Very high	97.3	Very high	10 Å²	10	22.6 Å²	22.6	10%	0.103	13%	0.13	C	C	.	.	S	Bend	trans	86.1	-3.2	-173.2	0	0	0	0	0	115.1	F246 P247 L266	F246-G249 PolarHBondContact O-N 3.36Å; P247-G249 VanDerWaalsContact C-N 3.29Å; P247-G249 PolarHBondContact O-N 3.28Å; G249-L266 WeakPolarHBondContact O-CD1 3.46Å
250	D	94.4	Very high	97.3	Very high	60 Å²	60	21.1 Å²	21.1	32%	0.321	12%	0.122	S	C	.	.	S	Bend	trans	-94.6	-4.9	-175.3	-55.6	-61.7	0	0	0	114.3	S248 L266 R267	S248-D250 VanDerWaalsContact C-N 3.35Å; S248-D250 WeakPolarHBondContact CB-OD2 3.49Å; S248-D250 PolarHBondContact OG-N 3.38Å; S248-D250 PolarHBondContact OG-OD2 3.46Å; D250-L266 VanDerWaalsContact O-CB 3.28Å; D250-L266 WeakPolarHBondContact O-CB 3.27Å; D250-L266 PolarHBondContact O-N 2.79Å; D250-R267 HydrophobicContact CB-CG 4.37Å
251	A	96.6	Very high	97.3	Very high	10 Å²	10	21.1 Å²	21.1	8%	0.083	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	166.9	-177.6	0	0	0	0	0	110	F246 L263 F264	F246-A251 HydrophobicContact CB-CB 3.81Å; F246-A251 WeakPolarHBondContact CB-O 3.37Å; F246-A251 HydrophobicContact CG-CB 4.3Å; F246-A251 PolarHBondContact N-O 3.39Å; A251-L263 HydrophobicContact CB-CD1 4.32Å; A251-F264 CarbonylContact C-O 3.52Å; A251-F264 WeakPolarHBondContact CA-O 3.45Å; A251-F264 WeakPolarHBondContact CB-O 3.19Å
252	F	98	Very high	97.3	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	150.7	172.9	68.3	-85.4	0	0	0	111.6	V211 A219 V221 F233 R244 I245 T254 F264 L266	V211-F252 HydrophobicContact CG1-CD2 3.92Å; V211-F252 HydrophobicContact CG1-CE2 3.95Å; V211-F252 HydrophobicContact CG1-CG 4.28Å; V211-F252 HydrophobicContact CG1-CZ 4.33Å; V211-F252 HydrophobicContact CG2-CD1 4.26Å; V211-F252 HydrophobicContact CG2-CG 4.28Å; A219-F252 HydrophobicContact CB-CE2 3.61Å; A219-F252 HydrophobicContact CB-CZ 4.01Å; V221-F252 HydrophobicContact CG2-CE1 4.41Å; F233-F252 HydrophobicContact CB-CZ 4.05Å; F233-F252 HydrophobicContact CD1-CZ 4.36Å; F233-F252 AromaticContact CD2-CE1 3.63Å; F233-F252 HydrophobicContact CD2-CE1 3.63Å; F233-F252 AromaticContact CD2-CZ 3.39Å; F233-F252 HydrophobicContact CD2-CZ 3.39Å; F233-F252 AromaticContact CE2-CE1 3.57Å; F233-F252 HydrophobicContact CE2-CE1 3.57Å; F233-F252 AromaticContact CE2-CZ 3.87Å; F233-F252 HydrophobicContact CE2-CZ 3.87Å; F233-F252 HydrophobicContact CG-CE1 4.16Å; F233-F252 AromaticContact CG-CZ 3.67Å; F233-F252 HydrophobicContact CG-CZ 3.67Å; F233-F252 HydrophobicContact CZ-CE1 4.04Å; R244-F252 CarbonylContact O-C 3.6Å; R244-F252 VanDerWaalsContact O-CA 3.22Å; R244-F252 WeakPolarHBondContact O-CA 3.33Å; R244-F252 VanDerWaalsContact O-CB 3.32Å; R244-F252 WeakPolarHBondContact O-CB 3.48Å; I245-F252 HydrophobicContact CG1-CB 4.03Å; F252-T254 HydrophobicContact CD2-CG2 3.94Å; F252-T254 HydrophobicContact CE2-CG2 3.65Å; F252-F264 HydrophobicContact CD1-CB 4.01Å; F252-F264 HydrophobicContact CD2-CB 4.48Å; F252-F264 HydrophobicContact CD2-CD2 4.18Å; F252-F264 HydrophobicContact CE1-CB 3.48Å; F252-F264 VanDerWaalsContact CE1-CB 3.48Å; F252-F264 HydrophobicContact CE1-CD2 4.48Å; F252-F264 HydrophobicContact CE1-CG 4.24Å; F252-F264 HydrophobicContact CE2-CB 4.01Å; F252-F264 AromaticContact CE2-CD2 3.46Å; F252-F264 HydrophobicContact CE2-CD2 3.46Å; F252-F264 VanDerWaalsContact CE2-CD2 3.46Å; F252-F264 HydrophobicContact CE2-CE2 4.27Å; F252-F264 HydrophobicContact CE2-CG 4.02Å; F252-F264 HydrophobicContact CG-CB 4.48Å; F252-F264 HydrophobicContact CZ-CB 3.48Å; F252-F264 VanDerWaalsContact CZ-CB 3.48Å; F252-F264 AromaticContact CZ-CD2 3.65Å; F252-F264 HydrophobicContact CZ-CD2 3.65Å; F252-F264 AromaticContact CZ-CG 3.71Å; F252-F264 HydrophobicContact CZ-CG 3.71Å; F252-F264 PolarHBondContact N-O 2.83Å; F252-F264 PolarHBondContact O-N 2.86Å; F252-L266 HydrophobicContact CD1-CD2 3.62Å; F252-L266 HydrophobicContact CD1-CG 4.08Å; F252-L266 HydrophobicContact CE1-CD2 3.55Å; F252-L266 HydrophobicContact CE1-CG 4.4Å
253	A	98.5	Very high	97.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	150.9	172.5	0	0	0	0	0	111.6	V243 R244 I261 R262 L263 F289 L296	V243-A253 CarbonylContact C-O 3.51Å; V243-A253 WeakPolarHBondContact CA-O 3.3Å; R244-A253 PolarHBondContact N-O 2.83Å; R244-A253 PolarHBondContact O-N 2.8Å; A253-I261 HydrophobicContact CB-CG2 4.28Å; A253-R262 CarbonylContact C-O 3.47Å; A253-R262 WeakPolarHBondContact CA-O 3.41Å; A253-L263 HydrophobicContact CB-CD1 4.48Å; A253-F289 HydrophobicContact CB-CE1 4.35Å; A253-F289 HydrophobicContact CB-CE2 3.67Å; A253-F289 HydrophobicContact CB-CZ 3.41Å; A253-F289 VanDerWaalsContact CB-CZ 3.41Å; A253-L296 HydrophobicContact CB-CD1 3.94Å; A253-L296 HydrophobicContact CB-CD2 4.1Å
254	T	98.7	Very high	97.3	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137.8	179.1	45.1	0	0	0	0	109.1	A219 H236 V240 S242 V243 F252 I261 R262 F264	A219-T254 HydrophobicContact CB-CG2 3.84Å; H236-T254 WeakPolarHBondContact NE2-CB 3.42Å; H236-T254 PolarHBondContact NE2-OG1 2.95Å; V240-T254 HydrophobicContact CG1-CG2 3.92Å; S242-T254 CarbonylContact O-C 3.58Å; S242-T254 VanDerWaalsContact O-CA 3.26Å; S242-T254 WeakPolarHBondContact O-CA 3.11Å; V243-T254 HydrophobicContact CG1-CG2 3.9Å; F252-T254 HydrophobicContact CD2-CG2 3.94Å; F252-T254 HydrophobicContact CE2-CG2 3.65Å; T254-I261 CarbonylContact O-C 3.51Å; T254-I261 WeakPolarHBondContact O-CA 3.35Å; T254-I261 WeakPolarHBondContact O-CG2 3.46Å; T254-R262 PolarHBondContact N-O 2.91Å; T254-R262 PolarHBondContact O-N 3.17Å; T254-R262 WeakPolarHBondContact OG1-CB 3.48Å; T254-R262 PolarHBondContact OG1-O 3.41Å; T254-R262 VanDerWaalsContact OG1-O 3.06Å; T254-F264 HydrophobicContact CG2-CD2 4.18Å; T254-F264 HydrophobicContact CG2-CE2 3.96Å; T254-F264 VanDerWaalsContact OG1-CE2 3.32Å; T254-F264 WeakPolarHBondContact OG1-CE2 3.16Å
255	G	98.5	Very high	97.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.9	170.4	0	0	0	0	0	110.1	N241 S242 C284	N241-G255 PolarHBondContact N-O 3.34Å; S242-G255 PolarHBondContact N-O 3.3Å; S242-G255 PolarHBondContact O-N 3.44Å; G255-C284 CarbonylContact C-O 3.47Å
256	S	98.6	Very high	97.1	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	162.4	-171.8	175.9	0	0	0	0	113.7	H236 S238 D239 D258 A259 T260 C284	H236-S256 WeakPolarHBondContact CE1-CB 3.41Å; H236-S256 WeakPolarHBondContact ND1-CB 3.45Å; S238-S256 PolarHBondContact O-OG 2.98Å; S238-S256 VanDerWaalsContact O-OG 3.13Å; D239-S256 WeakPolarHBondContact O-CA 3.49Å; D239-S256 VanDerWaalsContact O-CB 3.24Å; D239-S256 WeakPolarHBondContact O-CB 3.18Å; D239-S256 PolarHBondContact O-OG 3.5Å; S256-D258 WeakPolarHBondContact CB-OD1 3.36Å; S256-D258 PolarHBondContact O-N 2.81Å; S256-D258 PolarHBondContact OG-N 3.05Å; S256-D258 PolarHBondContact OG-OD1 3.05Å; S256-A259 PolarHBondContact O-N 2.8Å; S256-T260 PolarHBondContact N-O 3.02Å; S256-C284 PolarHBondContact O-N 2.88Å
257	D	98.4	Very high	96.9	Very high	63 Å²	63	28.7 Å²	28.7	34%	0.337	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-17.5	168.3	-87.5	1.3	0	0	0	113.8	S238 D239 N241 A259 A283	S238-D257 VanDerWaalsContact OG-CB 3.29Å; S238-D257 WeakPolarHBondContact OG-CB 3.43Å; D239-D257 PolarHBondContact O-N 3.33Å; D239-D257 VanDerWaalsContact O-N 3.08Å; N241-D257 PolarHBondContact ND2-N 3.45Å; N241-D257 PolarHBondContact ND2-OD1 2.89Å; D257-A259 PolarHBondContact O-N 3.09Å; D257-A259 VanDerWaalsContact O-N 3.07Å; D257-A283 HydrophobicContact CB-CB 4.29Å; D257-A283 WeakPolarHBondContact OD1-CB 3.33Å
258	D	98	Very high	96.9	Very high	33 Å²	33	28.3 Å²	28.3	18%	0.176	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	9.5	174	72.8	9.3	0	0	0	114.3	H236 D237 S256 T260 R262	H236-D258 WeakPolarHBondContact CA-OD2 3.49Å; H236-D258 IonicContact CE1-OD1 3.51Å; H236-D258 IonicContact CE1-OD2 3.18Å; H236-D258 IonicContact CG-OD2 3.46Å; H236-D258 IonicContact ND1-OD1 2.8Å; H236-D258 PolarHBondContact ND1-OD1 2.82Å; H236-D258 IonicContact ND1-OD2 3.64Å; H236-D258 PolarHBondContact ND1-OD2 2.86Å; D237-D258 HydrophobicContact CB-CB 4.05Å; D237-D258 PolarHBondContact N-OD2 3.32Å; S256-D258 WeakPolarHBondContact CB-OD1 3.36Å; S256-D258 PolarHBondContact O-N 2.81Å; S256-D258 PolarHBondContact OG-N 3.05Å; S256-D258 PolarHBondContact OG-OD1 3.05Å; D258-T260 VanDerWaalsContact CG-OG1 3.26Å; D258-T260 PolarHBondContact O-N 3.24Å; D258-T260 WeakPolarHBondContact OD1-CA 3.36Å; D258-T260 VanDerWaalsContact OD1-CB 3.28Å; D258-T260 WeakPolarHBondContact OD1-CB 3.36Å; D258-T260 PolarHBondContact OD1-N 2.84Å; D258-T260 PolarHBondContact OD1-OG1 3.2Å; D258-T260 PolarHBondContact OD2-OG1 3.05Å; D258-R262 IonicContact OD2-NH2 2.67Å
259	A	97.9	Very high	97	Very high	7 Å²	7	26.9 Å²	26.9	6%	0.058	14%	0.139	C	C	.	.	S	Bend	trans	64.3	11.9	-177.7	0	0	0	0	0	115	S256 D257 V280 I281 F282	S256-A259 PolarHBondContact O-N 2.8Å; D257-A259 PolarHBondContact O-N 3.09Å; D257-A259 VanDerWaalsContact O-N 3.07Å; A259-V280 WeakPolarHBondContact CB-O 3.35Å; A259-I281 VanDerWaalsContact CB-C 3.49Å; A259-F282 WeakPolarHBondContact CA-O 3.22Å; A259-F282 WeakPolarHBondContact CB-O 3.46Å
260	T	98.2	Very high	97	Very high	15 Å²	15	30 Å²	30	9%	0.092	15%	0.148	C	C	.	.			trans	-106.9	156.6	176.6	76	0	0	0	0	112.3	H236 S256 D258 V274 K276	H236-T260 PolarHBondContact CE1-OG1 2.89Å; H236-T260 VanDerWaalsContact CE1-OG1 3.25Å; H236-T260 PolarHBondContact ND1-OG1 3.45Å; S256-T260 PolarHBondContact N-O 3.02Å; D258-T260 VanDerWaalsContact CG-OG1 3.26Å; D258-T260 PolarHBondContact O-N 3.24Å; D258-T260 WeakPolarHBondContact OD1-CA 3.36Å; D258-T260 VanDerWaalsContact OD1-CB 3.28Å; D258-T260 WeakPolarHBondContact OD1-CB 3.36Å; D258-T260 PolarHBondContact OD1-N 2.84Å; D258-T260 PolarHBondContact OD1-OG1 3.2Å; D258-T260 PolarHBondContact OD2-OG1 3.05Å; T260-V274 HydrophobicContact CG2-CG1 4.23Å; T260-K276 HydrophobicContact CG2-CB 3.99Å
261	I	98.6	Very high	97.1	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	137.1	160.9	-59.3	167.9	0	0	0	106.9	A253 T254 Y275 C284 V287 L296 Y300	A253-I261 HydrophobicContact CB-CG2 4.28Å; T254-I261 CarbonylContact O-C 3.51Å; T254-I261 WeakPolarHBondContact O-CA 3.35Å; T254-I261 WeakPolarHBondContact O-CG2 3.46Å; I261-Y275 HydrophobicContact CB-CD2 3.89Å; I261-Y275 HydrophobicContact CB-CG 4.48Å; I261-Y275 HydrophobicContact CG2-CD2 3.76Å; I261-Y275 HydrophobicContact CG2-CE2 4.32Å; I261-Y275 PolarHBondContact N-O 3.47Å; I261-Y275 VanDerWaalsContact N-O 3.14Å; I261-Y275 VanDerWaalsContact O-CD2 3.3Å; I261-Y275 WeakPolarHBondContact O-CD2 3.43Å; I261-Y275 PolarHBondContact O-N 2.99Å; I261-C284 HydrophobicContact CG1-CB 4.27Å; I261-V287 HydrophobicContact CD1-CG1 3.8Å; I261-V287 HydrophobicContact CG1-CG1 3.84Å; I261-V287 HydrophobicContact CG2-CG1 4.04Å; I261-L296 HydrophobicContact CG2-CD2 3.51Å; I261-L296 HydrophobicContact CG2-CG 4.24Å; I261-Y300 HydrophobicContact CD1-CE2 4.38Å; I261-Y300 WeakPolarHBondContact CD1-OH 3.49Å
262	R	98.5	Very high	97.1	Very high	28 Å²	28	31.4 Å²	31.4	11%	0.106	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	140.8	177.4	-64.3	172.8	-180	-135.4	13.3	110.6	G235 H236 A253 T254 D258 F264 E271 C273 V274	G235-R262 PolarHBondContact O-NH1 3.47Å; G235-R262 PolarHBondContact O-NH2 3.49Å; H236-R262 VanDerWaalsContact CE1-CD 3.41Å; H236-R262 WeakPolarHBondContact CE1-CD 3.31Å; H236-R262 PolarHBondContact ND1-NE 2.78Å; A253-R262 CarbonylContact C-O 3.47Å; A253-R262 WeakPolarHBondContact CA-O 3.41Å; T254-R262 PolarHBondContact N-O 2.91Å; T254-R262 PolarHBondContact O-N 3.17Å; T254-R262 WeakPolarHBondContact OG1-CB 3.48Å; T254-R262 PolarHBondContact OG1-O 3.41Å; T254-R262 VanDerWaalsContact OG1-O 3.06Å; D258-R262 IonicContact OD2-NH2 2.67Å; R262-F264 HydrophobicContact CB-CD2 4.44Å; R262-F264 HydrophobicContact CB-CE2 3.72Å; R262-F264 HydrophobicContact CB-CZ 3.99Å; R262-E271 WeakPolarHBondContact CD-OE2 3.26Å; R262-E271 IonicContact CZ-OE2 3.53Å; R262-E271 IonicContact NE-OE2 3Å; R262-E271 IonicContact NH1-OE1 2.91Å; R262-E271 IonicContact NH1-OE2 2.67Å; R262-E271 PolarHBondContact NH1-OE2 2.9Å; R262-C273 WeakPolarHBondContact CA-O 3.33Å; R262-V274 HydrophobicContact CG-CG1 4.3Å; R262-V274 HydrophobicContact CG-CG2 4.25Å
263	L	98.4	Very high	97.1	Very high	8 Å²	8	31.9 Å²	31.9	4%	0.042	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	128.8	172.4	-176	71.1	0	0	0	109.1	L38 A251 A253 V272 C273 Y275 F289 V310	L38-L263 HydrophobicContact CD2-CD2 3.88Å; A251-L263 HydrophobicContact CB-CD1 4.32Å; A253-L263 HydrophobicContact CB-CD1 4.48Å; L263-V272 HydrophobicContact CB-CG2 3.97Å; L263-V272 HydrophobicContact CD2-CG2 3.63Å; L263-V272 HydrophobicContact CG-CG2 3.62Å; L263-V272 VanDerWaalsContact O-CG2 3.31Å; L263-V272 WeakPolarHBondContact O-CG2 3.46Å; L263-V272 PolarHBondContact O-N 3.4Å; L263-C273 HydrophobicContact CB-CB 4.12Å; L263-C273 PolarHBondContact N-O 3.48Å; L263-C273 PolarHBondContact O-N 3.13Å; L263-Y275 HydrophobicContact CB-CE2 3.93Å; L263-F289 HydrophobicContact CD1-CE1 4.41Å; L263-F289 HydrophobicContact CD1-CZ 3.83Å; L263-V310 HydrophobicContact CD2-CG1 3.94Å
264	F	97.6	Very high	97	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.018	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.9	176.6	-63.7	-81.5	0	0	0	109.8	F233 A251 F252 T254 R262 R270 E271	F233-F264 HydrophobicContact CB-CD1 3.93Å; F233-F264 HydrophobicContact CB-CE1 3.92Å; F233-F264 HydrophobicContact CB-CG 4.26Å; F233-F264 HydrophobicContact CB-CZ 4.24Å; F233-F264 HydrophobicContact CD1-CB 3.94Å; F233-F264 AromaticContact CD1-CD1 3.34Å; F233-F264 HydrophobicContact CD1-CD1 3.34Å; F233-F264 HydrophobicContact CD1-CE1 4.03Å; F233-F264 AromaticContact CD1-CG 3.83Å; F233-F264 HydrophobicContact CD1-CG 3.83Å; F233-F264 HydrophobicContact CE1-CB 4.06Å; F233-F264 HydrophobicContact CE1-CD1 4.12Å; F233-F264 HydrophobicContact CE1-CG 4.43Å; F233-F264 HydrophobicContact CG-CB 4.39Å; F233-F264 AromaticContact CG-CD1 3.92Å; F233-F264 HydrophobicContact CG-CD1 3.92Å; F233-F264 HydrophobicContact CG-CE1 4.39Å; F233-F264 HydrophobicContact CG-CG 4.14Å; A251-F264 CarbonylContact C-O 3.52Å; A251-F264 WeakPolarHBondContact CA-O 3.45Å; A251-F264 WeakPolarHBondContact CB-O 3.19Å; F252-F264 HydrophobicContact CD1-CB 4.01Å; F252-F264 HydrophobicContact CD2-CB 4.48Å; F252-F264 HydrophobicContact CD2-CD2 4.18Å; F252-F264 HydrophobicContact CE1-CB 3.48Å; F252-F264 VanDerWaalsContact CE1-CB 3.48Å; F252-F264 HydrophobicContact CE1-CD2 4.48Å; F252-F264 HydrophobicContact CE1-CG 4.24Å; F252-F264 HydrophobicContact CE2-CB 4.01Å; F252-F264 AromaticContact CE2-CD2 3.46Å; F252-F264 HydrophobicContact CE2-CD2 3.46Å; F252-F264 VanDerWaalsContact CE2-CD2 3.46Å; F252-F264 HydrophobicContact CE2-CE2 4.27Å; F252-F264 HydrophobicContact CE2-CG 4.02Å; F252-F264 HydrophobicContact CG-CB 4.48Å; F252-F264 HydrophobicContact CZ-CB 3.48Å; F252-F264 VanDerWaalsContact CZ-CB 3.48Å; F252-F264 AromaticContact CZ-CD2 3.65Å; F252-F264 HydrophobicContact CZ-CD2 3.65Å; F252-F264 AromaticContact CZ-CG 3.71Å; F252-F264 HydrophobicContact CZ-CG 3.71Å; F252-F264 PolarHBondContact N-O 2.83Å; F252-F264 PolarHBondContact O-N 2.86Å; T254-F264 HydrophobicContact CG2-CD2 4.18Å; T254-F264 HydrophobicContact CG2-CE2 3.96Å; T254-F264 VanDerWaalsContact OG1-CE2 3.32Å; T254-F264 WeakPolarHBondContact OG1-CE2 3.16Å; R262-F264 HydrophobicContact CB-CD2 4.44Å; R262-F264 HydrophobicContact CB-CE2 3.72Å; R262-F264 HydrophobicContact CB-CZ 3.99Å; F264-R270 WeakPolarHBondContact CA-O 3.18Å; F264-E271 HydrophobicContact CD1-CB 3.85Å; F264-E271 HydrophobicContact CD1-CG 4.4Å; F264-E271 HydrophobicContact CE1-CB 3.65Å; F264-E271 HydrophobicContact CE1-CG 4.08Å
265	D	96.3	Very high	97	Very high	32 Å²	32	33.9 Å²	33.9	17%	0.171	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	125.1	171.9	-174.7	-46.8	0	0	0	108.6	R267 A268 D269 R270 V272	D265-R267 WeakPolarHBondContact OD1-CA 3.42Å; D265-R267 WeakPolarHBondContact OD1-CB 3.33Å; D265-R267 PolarHBondContact OD1-N 3.49Å; D265-A268 HydrophobicContact CB-CB 4.07Å; D265-A268 PolarHBondContact OD1-N 2.94Å; D265-D269 WeakPolarHBondContact O-CA 3.33Å; D265-D269 PolarHBondContact O-N 3.11Å; D265-R270 PolarHBondContact N-O 2.94Å; D265-R270 PolarHBondContact O-N 2.78Å; D265-V272 HydrophobicContact CB-CG1 3.67Å; D265-V272 HydrophobicContact CB-CG2 4.45Å
266	L	94.7	Very high	96.9	Very high	27 Å²	27	40.8 Å²	40.8	14%	0.141	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-30.1	-177.2	-64.5	173	0	0	0	112.3	V221 Q231 F233 G249 D250 F252	V221-L266 HydrophobicContact CG2-CD2 3.66Å; Q231-L266 PolarHBondContact NE2-O 2.86Å; F233-L266 HydrophobicContact CE2-CD2 3.86Å; F233-L266 HydrophobicContact CZ-CD2 4.01Å; G249-L266 WeakPolarHBondContact O-CD1 3.46Å; D250-L266 VanDerWaalsContact O-CB 3.28Å; D250-L266 WeakPolarHBondContact O-CB 3.27Å; D250-L266 PolarHBondContact O-N 2.79Å; F252-L266 HydrophobicContact CD1-CD2 3.62Å; F252-L266 HydrophobicContact CD1-CG 4.08Å; F252-L266 HydrophobicContact CE1-CD2 3.55Å; F252-L266 HydrophobicContact CE1-CG 4.4Å
267	R	94.1	Very high	96.8	Very high	187 Å²	187	45.2 Å²	45.2	71%	0.706	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-38.6	-178.6	-56.6	179	-59.5	171.5	3.8	111.3	D250 D265 D269	D250-R267 HydrophobicContact CB-CG 4.37Å; D265-R267 WeakPolarHBondContact OD1-CA 3.42Å; D265-R267 WeakPolarHBondContact OD1-CB 3.33Å; D265-R267 PolarHBondContact OD1-N 3.49Å; R267-D269 VanDerWaalsContact C-N 3.3Å
268	A	94	Very high	96.6	Very high	47 Å²	47	49.9 Å²	49.9	39%	0.388	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-10.7	173.9	0	0	0	0	0	112.9	D265 R270	D265-A268 HydrophobicContact CB-CB 4.07Å; D265-A268 PolarHBondContact OD1-N 2.94Å; A268-R270 VanDerWaalsContact C-N 3.29Å; A268-R270 HydrophobicContact CB-CG 3.86Å; A268-R270 PolarHBondContact O-N 2.92Å
269	D	95.3	Very high	96.4	Very high	33 Å²	33	51.9 Å²	51.9	18%	0.176	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	41.6	174.8	-165.4	34.1	0	0	0	113.2	R30 Q231 D265 R267	R30-D269 WeakPolarHBondContact CD-O 3.34Å; R30-D269 IonicContact CZ-OD1 3.97Å; R30-D269 IonicContact CZ-OD2 3.36Å; R30-D269 VanDerWaalsContact NE-CG 3.34Å; R30-D269 PolarHBondContact NE-O 3.2Å; R30-D269 IonicContact NE-OD1 2.83Å; R30-D269 IonicContact NE-OD2 3.62Å; R30-D269 PolarHBondContact NE-OD2 2.88Å; R30-D269 IonicContact NH2-OD1 3.5Å; R30-D269 PolarHBondContact NH2-OD1 3.35Å; R30-D269 IonicContact NH2-OD2 3.83Å; R30-D269 PolarHBondContact NH2-OD2 2.93Å; Q231-D269 PolarHBondContact NE2-OD1 3.34Å; D265-D269 WeakPolarHBondContact O-CA 3.33Å; D265-D269 PolarHBondContact O-N 3.11Å; R267-D269 VanDerWaalsContact C-N 3.3Å
270	R	94.6	Very high	96.2	Very high	77 Å²	77	52 Å²	52	29%	0.291	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	165.7	-174.8	66	176.7	-66.6	175.8	11.7	113.6	S34 F264 D265 A268 V272	S34-R270 VanDerWaalsContact CA-NH1 3.29Å; S34-R270 PolarHBondContact OG-NH1 2.81Å; S34-R270 PolarHBondContact OG-NH2 3.06Å; F264-R270 WeakPolarHBondContact CA-O 3.18Å; D265-R270 PolarHBondContact N-O 2.94Å; D265-R270 PolarHBondContact O-N 2.78Å; A268-R270 VanDerWaalsContact C-N 3.29Å; A268-R270 HydrophobicContact CB-CG 3.86Å; A268-R270 PolarHBondContact O-N 2.92Å; R270-V272 HydrophobicContact CG-CG1 4.06Å
271	E	96.5	Very high	96.1	Very high	59 Å²	59	57.2 Å²	57.2	28%	0.276	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	133.4	161.3	-171.1	-178.1	102.4	0	0	110.3	R262 F264 V274	R262-E271 WeakPolarHBondContact CD-OE2 3.26Å; R262-E271 IonicContact CZ-OE2 3.53Å; R262-E271 IonicContact NE-OE2 3Å; R262-E271 IonicContact NH1-OE1 2.91Å; R262-E271 IonicContact NH1-OE2 2.67Å; R262-E271 PolarHBondContact NH1-OE2 2.9Å; F264-E271 HydrophobicContact CD1-CB 3.85Å; F264-E271 HydrophobicContact CD1-CG 4.4Å; F264-E271 HydrophobicContact CE1-CB 3.65Å; F264-E271 HydrophobicContact CE1-CG 4.08Å; E271-V274 HydrophobicContact CG-CG2 4.4Å; E271-V274 WeakPolarHBondContact OE1-CG2 3.34Å
272	V	96.3	Very high	96.1	Very high	39 Å²	39	62 Å²	62	24%	0.236	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-21.4	-179.9	-65.2	0	0	0	0	113.5	L38 L263 D265 R270	L38-V272 HydrophobicContact CD2-CG2 4.34Å; L263-V272 HydrophobicContact CB-CG2 3.97Å; L263-V272 HydrophobicContact CD2-CG2 3.63Å; L263-V272 HydrophobicContact CG-CG2 3.62Å; L263-V272 VanDerWaalsContact O-CG2 3.31Å; L263-V272 WeakPolarHBondContact O-CG2 3.46Å; L263-V272 PolarHBondContact O-N 3.4Å; D265-V272 HydrophobicContact CB-CG1 3.67Å; D265-V272 HydrophobicContact CB-CG2 4.45Å; R270-V272 HydrophobicContact CG-CG1 4.06Å
273	C	96.9	Very high	96	Very high	10 Å²	10	61.3 Å²	61.3	7%	0.068	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	144.8	177.6	-163.1	0	0	0	0	112.1	L38 R262 L263 Y275	L38-C273 HydrophobicContact CD2-CB 4.01Å; R262-C273 WeakPolarHBondContact CA-O 3.33Å; L263-C273 HydrophobicContact CB-CB 4.12Å; L263-C273 PolarHBondContact N-O 3.48Å; L263-C273 PolarHBondContact O-N 3.13Å; C273-Y275 HydrophobicContact CB-CE2 4.42Å
274	V	97.7	Very high	96	Very high	43 Å²	43	61 Å²	61	26%	0.261	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	118.1	171	-173.8	0	0	0	0	109	T260 R262 E271 K276	T260-V274 HydrophobicContact CG2-CG1 4.23Å; R262-V274 HydrophobicContact CG-CG1 4.3Å; R262-V274 HydrophobicContact CG-CG2 4.25Å; E271-V274 HydrophobicContact CG-CG2 4.4Å; E271-V274 WeakPolarHBondContact OE1-CG2 3.34Å; V274-K276 HydrophobicContact CG1-CB 4.36Å; V274-K276 HydrophobicContact CG1-CD 4.15Å; V274-K276 HydrophobicContact CG1-CG 4.27Å
275	Y	97.9	Very high	96	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	104.5	174.2	-46.4	-84.5	0	0	0	109	I261 L263 C273 L296 W308 V310	I261-Y275 HydrophobicContact CB-CD2 3.89Å; I261-Y275 HydrophobicContact CB-CG 4.48Å; I261-Y275 HydrophobicContact CG2-CD2 3.76Å; I261-Y275 HydrophobicContact CG2-CE2 4.32Å; I261-Y275 PolarHBondContact N-O 3.47Å; I261-Y275 VanDerWaalsContact N-O 3.14Å; I261-Y275 VanDerWaalsContact O-CD2 3.3Å; I261-Y275 WeakPolarHBondContact O-CD2 3.43Å; I261-Y275 PolarHBondContact O-N 2.99Å; L263-Y275 HydrophobicContact CB-CE2 3.93Å; C273-Y275 HydrophobicContact CB-CE2 4.42Å; Y275-L296 HydrophobicContact CD2-CD2 3.62Å; Y275-L296 HydrophobicContact CE1-CD2 4.47Å; Y275-L296 HydrophobicContact CE2-CD2 3.31Å; Y275-L296 HydrophobicContact CG-CD2 4.34Å; Y275-W308 HydrophobicContact CD1-CB 3.76Å; Y275-W308 HydrophobicContact CD1-CD2 4.34Å; Y275-W308 HydrophobicContact CD1-CE3 4.24Å; Y275-W308 HydrophobicContact CD1-CG 4.16Å; Y275-W308 HydrophobicContact CE1-CB 4.28Å; Y275-W308 HydrophobicContact CG-CB 4.25Å; Y275-W308 HydrophobicContact CG-CD2 4.34Å; Y275-W308 HydrophobicContact CG-CE3 4.45Å; Y275-W308 HydrophobicContact CG-CG 4.24Å; Y275-V310 WeakPolarHBondContact OH-CA 3.44Å; Y275-V310 WeakPolarHBondContact OH-CG1 3.23Å; Y275-V310 PolarHBondContact OH-O 3.14Å
276	K	96.2	Very high	96.1	Very high	144 Å²	144	60.2 Å²	60.2	63%	0.626	30%	0.301	S	S	*	.			trans	-142.7	158.1	178.7	66.9	179.8	-179.2	-177.5	0	110.7	T260 V274	T260-K276 HydrophobicContact CG2-CB 3.99Å; V274-K276 HydrophobicContact CG1-CB 4.36Å; V274-K276 HydrophobicContact CG1-CD 4.15Å; V274-K276 HydrophobicContact CG1-CG 4.27Å
277	K	96.3	Very high	96.3	Very high	93 Å²	93	58.9 Å²	58.9	40%	0.404	30%	0.295	S	S	.	.			trans	-154.1	141.6	171.3	-171.2	169.7	-173.7	168.4	0	108.8	S279 V280 W308 R315	K277-S279 PolarHBondContact O-N 2.79Å; K277-V280 HydrophobicContact CB-CG2 4.27Å; K277-V280 PolarHBondContact O-N 2.91Å; K277-W308 HydrophobicContact CB-CH2 4.03Å; K277-R315 VanDerWaalsContact NZ-NH2 3.12Å
278	D	94	Very high	96.5	Very high	161 Å²	161	51 Å²	51	86%	0.861	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-25.4	-175.3	-55.7	-20.4	0	0	0	114.3	V280	D278-V280 VanDerWaalsContact C-N 3.33Å
279	S	94.2	Very high	96.7	Very high	76 Å²	76	49.2 Å²	49.2	53%	0.531	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-7.1	176.1	55.9	0	0	0	0	114.9	K277	K277-S279 PolarHBondContact O-N 2.79Å
280	V	93.9	Very high	96.8	Very high	10 Å²	10	48.2 Å²	48.2	6%	0.061	25%	0.246	C	C	.	.			trans	-106.6	98.3	179.1	-177.4	0	0	0	0	107.6	A259 K277 D278 Y300	A259-V280 WeakPolarHBondContact CB-O 3.35Å; K277-V280 HydrophobicContact CB-CG2 4.27Å; K277-V280 PolarHBondContact O-N 2.91Å; D278-V280 VanDerWaalsContact C-N 3.33Å; V280-Y300 HydrophobicContact CG1-CD1 3.61Å; V280-Y300 HydrophobicContact CG1-CE1 3.24Å; V280-Y300 HydrophobicContact CG1-CG 4.48Å
281	I	96.1	Very high	96.9	Very high	123 Å²	123	50 Å²	50	63%	0.631	26%	0.26	S	S	*	.			trans	-115.3	-1.8	-176.1	62.9	172.1	0	0	0	113	A259	A259-I281 VanDerWaalsContact CB-C 3.49Å
282	F	97.6	Very high	96.9	Very high	101 Å²	101	51.4 Å²	51.4	44%	0.443	28%	0.277	S	S	.	.	S	Bend	trans	-100.5	150.6	-176.4	-65.3	-86.9	0	0	0	110.2	A259 Y300 D302	A259-F282 WeakPolarHBondContact CA-O 3.22Å; A259-F282 WeakPolarHBondContact CB-O 3.46Å; F282-Y300 VanDerWaalsContact O-CD1 3.31Å; F282-Y300 WeakPolarHBondContact O-CD1 3.14Å; F282-D302 HydrophobicContact CB-CB 4.07Å; F282-D302 HydrophobicContact CD2-CB 3.47Å; F282-D302 VanDerWaalsContact CD2-CB 3.47Å; F282-D302 HydrophobicContact CE2-CB 3.96Å; F282-D302 HydrophobicContact CG-CB 3.8Å
283	A	97.8	Very high	96.9	Very high	14 Å²	14	49.6 Å²	49.6	12%	0.116	27%	0.266	C	S	.	.			trans	-52.1	139.1	178.2	0	0	0	0	0	113.9	D257 Y300 S301	D257-A283 HydrophobicContact CB-CB 4.29Å; D257-A283 WeakPolarHBondContact OD1-CB 3.33Å; A283-Y300 CarbonylContact O-C 3.58Å; A283-Y300 WeakPolarHBondContact O-CA 3.42Å; A283-S301 PolarHBondContact O-N 2.89Å
284	C	98.3	Very high	96.9	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	114.5	167	-170.5	0	0	0	0	109.4	N241 G255 S256 I261 Y300	N241-C284 PolarHBondContact ND2-O 2.96Å; G255-C284 CarbonylContact C-O 3.47Å; S256-C284 PolarHBondContact O-N 2.88Å; I261-C284 HydrophobicContact CG1-CB 4.27Å; C284-Y300 HydrophobicContact CB-CD1 4.01Å; C284-Y300 HydrophobicContact CB-CE1 3.7Å
285	N	98.1	Very high	97	Very high	18 Å²	18	51.2 Å²	51.2	10%	0.096	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-25.5	-174.6	-52.1	-62.3	0	0	0	112.9	S242 G299 S301 R325 I326	S242-N285 WeakPolarHBondContact CB-O 3.5Å; N285-G299 PolarHBondContact N-O 3.48Å; N285-S301 PolarHBondContact ND2-N 2.89Å; N285-S301 PolarHBondContact ND2-OG 3.35Å; N285-S301 PolarHBondContact OD1-OG 2.79Å; N285-R325 VanDerWaalsContact ND2-CG 3.27Å; N285-R325 WeakPolarHBondContact ND2-CG 3.32Å; N285-I326 VanDerWaalsContact CB-O 3.3Å; N285-I326 WeakPolarHBondContact CB-O 3.18Å; N285-I326 PolarHBondContact ND2-O 2.81Å
286	A	97.9	Very high	97	Very high	2 Å²	2	51.2 Å²	51.2	2%	0.017	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	134.3	-176.6	0	0	0	0	0	110.9	G298 G299 L329	A286-G298 CarbonylContact O-C 3.58Å; A286-G298 WeakPolarHBondContact O-CA 3.2Å; A286-G299 PolarHBondContact N-O 3.39Å; A286-G299 PolarHBondContact O-N 2.9Å; A286-L329 HydrophobicContact CB-CB 3.73Å
287	V	98.4	Very high	97.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	151	173.4	-62.7	0	0	0	0	110.5	S242 R244 I261 L296 F297	S242-V287 WeakPolarHBondContact OG-CG2 3.41Å; S242-V287 PolarHBondContact OG-N 2.96Å; R244-V287 HydrophobicContact CB-CG2 4.21Å; R244-V287 HydrophobicContact CG-CG2 4.24Å; R244-V287 WeakPolarHBondContact CG-O 3.42Å; I261-V287 HydrophobicContact CD1-CG1 3.8Å; I261-V287 HydrophobicContact CG1-CG1 3.84Å; I261-V287 HydrophobicContact CG2-CG1 4.04Å; V287-L296 HydrophobicContact CB-CD1 4.29Å; V287-F297 CarbonylContact C-O 3.49Å; V287-F297 VanDerWaalsContact CA-O 3.26Å; V287-F297 WeakPolarHBondContact CA-O 3.08Å
288	D	98.5	Very high	97.1	Very high	22 Å²	22	40.2 Å²	40.2	12%	0.118	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	156.6	166.7	-151.8	3.1	0	0	0	112.9	R244 F297 L329 R330 V331	R244-D288 HydrophobicContact CG-CB 4.48Å; D288-F297 PolarHBondContact N-O 2.98Å; D288-F297 WeakPolarHBondContact O-CD2 3.32Å; D288-F297 PolarHBondContact O-N 3.28Å; D288-L329 HydrophobicContact CB-CD2 3.58Å; D288-R330 WeakPolarHBondContact OD2-CA 3.35Å; D288-V331 HydrophobicContact CB-CG2 4.1Å; D288-V331 PolarHBondContact OD2-N 3.1Å
289	F	98.4	Very high	97.3	Very high	8 Å²	8	32.6 Å²	32.6	4%	0.035	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	147.5	-179.5	-71.1	-77.5	0	0	0	112.3	R244 F246 P247 A253 L263 L295 L296 V310 V331	R244-F289 HydrophobicContact CB-CD2 4.35Å; R244-F289 HydrophobicContact CB-CE2 4.47Å; F246-F289 HydrophobicContact CB-CE2 4.21Å; F246-F289 HydrophobicContact CB-CZ 4.38Å; F246-F289 HydrophobicContact CD2-CD1 4.02Å; F246-F289 AromaticContact CD2-CE1 3.73Å; F246-F289 HydrophobicContact CD2-CE1 3.73Å; F246-F289 HydrophobicContact CD2-CE2 4.3Å; F246-F289 HydrophobicContact CD2-CG 4.41Å; F246-F289 AromaticContact CD2-CZ 3.87Å; F246-F289 HydrophobicContact CD2-CZ 3.87Å; F246-F289 HydrophobicContact CE2-CD1 4.41Å; F246-F289 HydrophobicContact CE2-CE1 4.3Å; P247-F289 HydrophobicContact CG-CB 4.4Å; A253-F289 HydrophobicContact CB-CE1 4.35Å; A253-F289 HydrophobicContact CB-CE2 3.67Å; A253-F289 HydrophobicContact CB-CZ 3.41Å; A253-F289 VanDerWaalsContact CB-CZ 3.41Å; L263-F289 HydrophobicContact CD1-CE1 4.41Å; L263-F289 HydrophobicContact CD1-CZ 3.83Å; F289-L295 WeakPolarHBondContact CA-O 3.14Å; F289-L296 HydrophobicContact CD1-CB 4.27Å; F289-L296 HydrophobicContact CD1-CD1 3.97Å; F289-L296 HydrophobicContact CE1-CB 4.23Å; F289-L296 HydrophobicContact CE1-CD1 3.83Å; F289-L296 HydrophobicContact CE1-CD2 4.31Å; F289-L296 HydrophobicContact CE1-CG 4.37Å; F289-L296 HydrophobicContact CE2-CD1 4.49Å; F289-L296 HydrophobicContact CG-CD1 4.37Å; F289-L296 HydrophobicContact CZ-CD1 4.13Å; F289-V310 HydrophobicContact CD1-CG2 4.06Å; F289-V310 HydrophobicContact CE1-CG1 4.34Å; F289-V310 HydrophobicContact CE1-CG2 3.81Å; F289-V331 WeakPolarHBondContact O-CG2 3.08Å
290	S	97.8	Very high	97.5	Very high	13 Å²	13	29 Å²	29	9%	0.091	15%	0.154	C	C	.	.			trans	-60.4	160.5	159	59.3	0	0	0	0	111.5	S292 G293 R294 L295	S290-S292 PolarHBondContact O-N 2.97Å; S290-S292 VanDerWaalsContact O-N 3.14Å; S290-G293 WeakPolarHBondContact O-CA 3.4Å; S290-G293 PolarHBondContact O-N 3.49Å; S290-R294 PolarHBondContact OG-N 2.88Å; S290-L295 PolarHBondContact N-O 3.15Å; S290-L295 PolarHBondContact OG-N 2.79Å; S290-L295 PolarHBondContact OG-O 2.8Å
291	L	96.5	Very high	97.7	Very high	114 Å²	114	29.1 Å²	29.1	60%	0.597	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-36.8	-179.4	-173.6	67.4	0	0	0	114	G293	L291-G293 VanDerWaalsContact C-N 3.31Å
292	S	96.3	Very high	97.7	Very high	89 Å²	89	25.5 Å²	25.5	62%	0.622	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-10	176.5	63.5	0	0	0	0	113.9	S290 R294	S290-S292 PolarHBondContact O-N 2.97Å; S290-S292 VanDerWaalsContact O-N 3.14Å; S292-R294 PolarHBondContact O-N 2.89Å; S292-R294 PolarHBondContact OG-N 2.8Å
293	G	96.9	Very high	97.7	Very high	1 Å²	1	24 Å²	24	1%	0.01	13%	0.131	C	C	.	.	S	Bend	trans	75.6	-1.4	-171.5	0	0	0	0	0	114.7	F246 S290 L291 L295 V310	F246-G293 VanDerWaalsContact CE2-CA 3.43Å; F246-G293 WeakPolarHBondContact CE2-O 3.22Å; S290-G293 WeakPolarHBondContact O-CA 3.4Å; S290-G293 PolarHBondContact O-N 3.49Å; L291-G293 VanDerWaalsContact C-N 3.31Å; G293-L295 PolarHBondContact O-N 2.85Å; G293-V310 WeakPolarHBondContact O-CB 3.11Å; G293-V310 WeakPolarHBondContact O-CG2 3.24Å
294	R	97.2	Very high	97.6	Very high	60 Å²	60	23.3 Å²	23.3	23%	0.226	13%	0.126	C	C	.	.			trans	-70.6	-33.5	-176.6	-177.7	58.2	-176.6	-83.4	0.3	113.6	D46 V48 S290 S292 D309 V310	D46-R294 PolarHBondContact O-NH2 2.83Å; V48-R294 HydrophobicContact CG2-CG 3.9Å; V48-R294 VanDerWaalsContact CG2-CZ 3.48Å; S290-R294 PolarHBondContact OG-N 2.88Å; S292-R294 PolarHBondContact O-N 2.89Å; S292-R294 PolarHBondContact OG-N 2.8Å; R294-D309 IonicContact CZ-OD1 3.96Å; R294-D309 IonicContact CZ-OD2 3.85Å; R294-D309 IonicContact NE-OD1 3.49Å; R294-D309 PolarHBondContact NE-OD1 2.86Å; R294-D309 IonicContact NE-OD2 3.59Å; R294-D309 PolarHBondContact NE-OD2 3.02Å; R294-D309 IonicContact NH2-OD1 2.8Å; R294-D309 IonicContact NH2-OD2 3.22Å; R294-D309 PolarHBondContact NH2-OD2 2.62Å; R294-V310 WeakPolarHBondContact O-CG2 3.41Å; R294-V310 PolarHBondContact O-N 3.47Å
295	L	97.7	Very high	97.6	Very high	26 Å²	26	23.4 Å²	23.4	14%	0.136	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	138.6	177.2	-51.9	176.3	0	0	0	110.4	V48 L51 F289 S290 G293 F297 I307 W308 I316	V48-L295 HydrophobicContact CG1-CD2 4.08Å; V48-L295 HydrophobicContact CG2-CD2 4.36Å; L51-L295 HydrophobicContact CD1-CD1 3.53Å; L51-L295 HydrophobicContact CD1-CD2 3.97Å; L51-L295 HydrophobicContact CD1-CG 4.42Å; F289-L295 WeakPolarHBondContact CA-O 3.14Å; S290-L295 PolarHBondContact N-O 3.15Å; S290-L295 PolarHBondContact OG-N 2.79Å; S290-L295 PolarHBondContact OG-O 2.8Å; G293-L295 PolarHBondContact O-N 2.85Å; L295-F297 HydrophobicContact CB-CE1 4.4Å; L295-F297 HydrophobicContact CB-CE2 4.15Å; L295-F297 HydrophobicContact CB-CZ 3.86Å; L295-F297 HydrophobicContact CD1-CE1 4.44Å; L295-F297 HydrophobicContact CD1-CZ 3.91Å; L295-I307 HydrophobicContact CB-CG2 4.35Å; L295-I307 HydrophobicContact CD2-CG2 4.34Å; L295-W308 WeakPolarHBondContact CA-O 3.47Å; L295-I316 HydrophobicContact CD2-CD1 3.37Å
296	L	98.4	Very high	97.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	120.9	171.7	176.7	59	0	0	0	109.3	A253 I261 Y275 V287 F289 W308 V310	A253-L296 HydrophobicContact CB-CD1 3.94Å; A253-L296 HydrophobicContact CB-CD2 4.1Å; I261-L296 HydrophobicContact CG2-CD2 3.51Å; I261-L296 HydrophobicContact CG2-CG 4.24Å; Y275-L296 HydrophobicContact CD2-CD2 3.62Å; Y275-L296 HydrophobicContact CE1-CD2 4.47Å; Y275-L296 HydrophobicContact CE2-CD2 3.31Å; Y275-L296 HydrophobicContact CG-CD2 4.34Å; V287-L296 HydrophobicContact CB-CD1 4.29Å; F289-L296 HydrophobicContact CD1-CB 4.27Å; F289-L296 HydrophobicContact CD1-CD1 3.97Å; F289-L296 HydrophobicContact CE1-CB 4.23Å; F289-L296 HydrophobicContact CE1-CD1 3.83Å; F289-L296 HydrophobicContact CE1-CD2 4.31Å; F289-L296 HydrophobicContact CE1-CG 4.37Å; F289-L296 HydrophobicContact CE2-CD1 4.49Å; F289-L296 HydrophobicContact CG-CD1 4.37Å; F289-L296 HydrophobicContact CZ-CD1 4.13Å; L296-W308 HydrophobicContact CB-CB 4.33Å; L296-W308 PolarHBondContact N-O 2.83Å; L296-W308 PolarHBondContact O-N 2.95Å; L296-V310 HydrophobicContact CB-CG2 3.47Å; L296-V310 VanDerWaalsContact CB-CG2 3.47Å; L296-V310 HydrophobicContact CD2-CG2 4.45Å
297	F	98.2	Very high	97.6	Very high	7 Å²	7	22.5 Å²	22.5	3%	0.031	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	126.1	179.6	-55.1	-75.7	0	0	0	108.8	I53 V287 D288 L295 V305 I307 L329 V331 I338	I53-F297 HydrophobicContact CD1-CE1 4.39Å; V287-F297 CarbonylContact C-O 3.49Å; V287-F297 VanDerWaalsContact CA-O 3.26Å; V287-F297 WeakPolarHBondContact CA-O 3.08Å; D288-F297 PolarHBondContact N-O 2.98Å; D288-F297 WeakPolarHBondContact O-CD2 3.32Å; D288-F297 PolarHBondContact O-N 3.28Å; L295-F297 HydrophobicContact CB-CE1 4.4Å; L295-F297 HydrophobicContact CB-CE2 4.15Å; L295-F297 HydrophobicContact CB-CZ 3.86Å; L295-F297 HydrophobicContact CD1-CE1 4.44Å; L295-F297 HydrophobicContact CD1-CZ 3.91Å; F297-V305 HydrophobicContact CB-CG1 4.39Å; F297-I307 HydrophobicContact CD1-CB 4.4Å; F297-I307 HydrophobicContact CD1-CD1 4.18Å; F297-I307 HydrophobicContact CD1-CG1 3.9Å; F297-I307 HydrophobicContact CD1-CG2 3.98Å; F297-I307 HydrophobicContact CE1-CD1 3.95Å; F297-I307 HydrophobicContact CE1-CG1 4.12Å; F297-I307 HydrophobicContact CE1-CG2 3.77Å; F297-L329 HydrophobicContact CB-CD1 3.91Å; F297-L329 HydrophobicContact CB-CD2 3.66Å; F297-L329 HydrophobicContact CB-CG 4.47Å; F297-V331 HydrophobicContact CD2-CG2 3.62Å; F297-V331 HydrophobicContact CE2-CG2 3.74Å; F297-I338 HydrophobicContact CD1-CD1 3.47Å; F297-I338 VanDerWaalsContact CD1-CD1 3.47Å; F297-I338 HydrophobicContact CD2-CD1 4.07Å; F297-I338 HydrophobicContact CE1-CD1 3.19Å; F297-I338 HydrophobicContact CE1-CG1 4.39Å; F297-I338 HydrophobicContact CE2-CD1 3.81Å; F297-I338 HydrophobicContact CE2-CG1 4.24Å; F297-I338 HydrophobicContact CG-CD1 3.91Å; F297-I338 HydrophobicContact CZ-CD1 3.38Å; F297-I338 HydrophobicContact CZ-CG1 4.19Å
298	G	98.1	Very high	97.5	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	125	171.8	0	0	0	0	0	110.9	A286 Y300 V305 N306	A286-G298 CarbonylContact O-C 3.58Å; A286-G298 WeakPolarHBondContact O-CA 3.2Å; G298-Y300 WeakPolarHBondContact O-CD2 3.37Å; G298-Y300 VanDerWaalsContact O-CE2 3.28Å; G298-Y300 WeakPolarHBondContact O-CE2 3.35Å; G298-V305 CarbonylContact O-C 3.53Å; G298-V305 VanDerWaalsContact O-CA 3.24Å; G298-V305 WeakPolarHBondContact O-CA 3.5Å; G298-V305 WeakPolarHBondContact O-CG1 3.39Å; G298-N306 PolarHBondContact N-O 2.81Å; G298-N306 PolarHBondContact O-N 2.87Å
299	G	97.9	Very high	97.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	123.1	171.7	0	0	0	0	0	111	N285 A286	N285-G299 PolarHBondContact N-O 3.48Å; A286-G299 PolarHBondContact N-O 3.39Å; A286-G299 PolarHBondContact O-N 2.9Å
300	Y	98.1	Very high	97.4	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	163.8	-168.5	-72.3	-101	0	0	0	113	I261 V280 F282 A283 C284 G298 D302 H303 A304 N306 I326	I261-Y300 HydrophobicContact CD1-CE2 4.38Å; I261-Y300 WeakPolarHBondContact CD1-OH 3.49Å; V280-Y300 HydrophobicContact CG1-CD1 3.61Å; V280-Y300 HydrophobicContact CG1-CE1 3.24Å; V280-Y300 HydrophobicContact CG1-CG 4.48Å; F282-Y300 VanDerWaalsContact O-CD1 3.31Å; F282-Y300 WeakPolarHBondContact O-CD1 3.14Å; A283-Y300 CarbonylContact O-C 3.58Å; A283-Y300 WeakPolarHBondContact O-CA 3.42Å; C284-Y300 HydrophobicContact CB-CD1 4.01Å; C284-Y300 HydrophobicContact CB-CE1 3.7Å; G298-Y300 WeakPolarHBondContact O-CD2 3.37Å; G298-Y300 VanDerWaalsContact O-CE2 3.28Å; G298-Y300 WeakPolarHBondContact O-CE2 3.35Å; Y300-D302 WeakPolarHBondContact CB-OD1 3.44Å; Y300-D302 PolarHBondContact O-N 2.8Å; Y300-H303 PolarHBondContact O-N 3.05Å; Y300-A304 PolarHBondContact N-O 3.18Å; Y300-N306 HydrophobicContact CD2-CB 4.23Å; Y300-N306 WeakPolarHBondContact CD2-ND2 3.4Å; Y300-N306 HydrophobicContact CE2-CB 3.69Å; Y300-N306 WeakPolarHBondContact CE2-ND2 3.25Å; Y300-I326 PolarHBondContact O-N 2.82Å
301	S	97.4	Very high	97.4	Very high	14 Å²	14	23.3 Å²	23.3	10%	0.098	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-15.5	176.7	-75.3	0	0	0	0	114.2	A283 N285 H303 R325	A283-S301 PolarHBondContact O-N 2.89Å; N285-S301 PolarHBondContact ND2-N 2.89Å; N285-S301 PolarHBondContact ND2-OG 3.35Å; N285-S301 PolarHBondContact OD1-OG 2.79Å; S301-H303 PolarHBondContact O-CE1 3.11Å; S301-H303 VanDerWaalsContact O-CE1 3.25Å; S301-H303 PolarHBondContact O-N 2.88Å; S301-H303 PolarHBondContact O-ND1 3.43Å; S301-R325 PolarHBondContact OG-NE 3.41Å
302	D	96.5	Very high	97.3	Very high	47 Å²	47	19.6 Å²	19.6	25%	0.251	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	10.1	171.2	69.4	-7.9	0	0	0	114.1	F282 Y300 A304	F282-D302 HydrophobicContact CB-CB 4.07Å; F282-D302 HydrophobicContact CD2-CB 3.47Å; F282-D302 VanDerWaalsContact CD2-CB 3.47Å; F282-D302 HydrophobicContact CE2-CB 3.96Å; F282-D302 HydrophobicContact CG-CB 3.8Å; Y300-D302 WeakPolarHBondContact CB-OD1 3.44Å; Y300-D302 PolarHBondContact O-N 2.8Å; D302-A304 PolarHBondContact O-N 3.02Å; D302-A304 WeakPolarHBondContact OD1-CB 3.43Å; D302-A304 PolarHBondContact OD1-N 3.27Å; D302-A304 VanDerWaalsContact OD1-N 3.09Å
303	H	97.1	Very high	97.2	Very high	68 Å²	68	16.2 Å²	16.2	32%	0.315	8%	0.083	S	C	.	.	S	Bend	trans	75	5.4	174.6	-31.5	-23.6	0	0	0	113.7	Y300 S301 H322 N324 R325 I326	Y300-H303 PolarHBondContact O-N 3.05Å; S301-H303 PolarHBondContact O-CE1 3.11Å; S301-H303 VanDerWaalsContact O-CE1 3.25Å; S301-H303 PolarHBondContact O-N 2.88Å; S301-H303 PolarHBondContact O-ND1 3.43Å; H303-H322 HydrophobicContact CB-CB 4.42Å; H303-H322 VanDerWaalsContact CB-O 3.29Å; H303-H322 WeakPolarHBondContact CB-O 3.43Å; H303-N324 WeakPolarHBondContact CB-O 3.42Å; H303-N324 WeakPolarHBondContact ND1-CA 3.41Å; H303-N324 PolarHBondContact ND1-O 3.49Å; H303-R325 PolarHBondContact ND1-N 2.79Å; H303-I326 WeakPolarHBondContact O-CD1 3.49Å
304	A	97	Very high	97.1	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	152.2	179	0	0	0	0	0	112.6	Y300 D302 I318 L319 Y320 I326	Y300-A304 PolarHBondContact N-O 3.18Å; D302-A304 PolarHBondContact O-N 3.02Å; D302-A304 WeakPolarHBondContact OD1-CB 3.43Å; D302-A304 PolarHBondContact OD1-N 3.27Å; D302-A304 VanDerWaalsContact OD1-N 3.09Å; A304-I318 HydrophobicContact CB-CG2 3.87Å; A304-L319 WeakPolarHBondContact CA-O 3.38Å; A304-Y320 HydrophobicContact CB-CD1 4.28Å; A304-Y320 HydrophobicContact CB-CE1 4.33Å; A304-I326 VanDerWaalsContact C-CD1 3.46Å; A304-I326 WeakPolarHBondContact O-CD1 3.48Å
305	V	97.4	Very high	97.1	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.012	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	120.9	165.1	-176.6	0	0	0	0	108.3	F297 G298 I318 L319 I326 L329 T340	F297-V305 HydrophobicContact CB-CG1 4.39Å; G298-V305 CarbonylContact O-C 3.53Å; G298-V305 VanDerWaalsContact O-CA 3.24Å; G298-V305 WeakPolarHBondContact O-CA 3.5Å; G298-V305 WeakPolarHBondContact O-CG1 3.39Å; V305-I318 CarbonylContact O-C 3.46Å; V305-I318 WeakPolarHBondContact O-CA 3.43Å; V305-L319 HydrophobicContact CB-CB 4.1Å; V305-L319 HydrophobicContact CB-CD1 4.31Å; V305-L319 HydrophobicContact CB-CG 4.38Å; V305-L319 HydrophobicContact CG1-CD1 4.49Å; V305-L319 PolarHBondContact N-O 3.4Å; V305-L319 PolarHBondContact O-N 3.02Å; V305-I326 HydrophobicContact CG2-CD1 3.59Å; V305-L329 HydrophobicContact CG1-CD1 3.78Å; V305-L329 HydrophobicContact CG2-CD1 4.16Å; V305-T340 HydrophobicContact CG2-CG2 3.84Å
306	N	97.3	Very high	97	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.011	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	134.5	169.5	-66.7	-87.6	0	0	0	109.2	G298 Y300 W308 R315	G298-N306 PolarHBondContact N-O 2.81Å; G298-N306 PolarHBondContact O-N 2.87Å; Y300-N306 HydrophobicContact CD2-CB 4.23Å; Y300-N306 WeakPolarHBondContact CD2-ND2 3.4Å; Y300-N306 HydrophobicContact CE2-CB 3.69Å; Y300-N306 WeakPolarHBondContact CE2-ND2 3.25Å; N306-W308 HydrophobicContact CB-CZ2 4Å; N306-R315 WeakPolarHBondContact OD1-CD 3.42Å; N306-R315 PolarHBondContact OD1-NH1 2.61Å; N306-R315 VanDerWaalsContact OD1-NH1 3.1Å
307	I	97.6	Very high	96.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	126.5	177.8	-46.9	-176.8	0	0	0	108.7	L51 I53 L295 F297 R315 I316 N317 L319	L51-I307 HydrophobicContact CD1-CG2 4.21Å; I53-I307 HydrophobicContact CD1-CD1 3.63Å; L295-I307 HydrophobicContact CB-CG2 4.35Å; L295-I307 HydrophobicContact CD2-CG2 4.34Å; F297-I307 HydrophobicContact CD1-CB 4.4Å; F297-I307 HydrophobicContact CD1-CD1 4.18Å; F297-I307 HydrophobicContact CD1-CG1 3.9Å; F297-I307 HydrophobicContact CD1-CG2 3.98Å; F297-I307 HydrophobicContact CE1-CD1 3.95Å; F297-I307 HydrophobicContact CE1-CG1 4.12Å; F297-I307 HydrophobicContact CE1-CG2 3.77Å; I307-R315 CarbonylContact O-C 3.56Å; I307-R315 WeakPolarHBondContact O-CA 3.43Å; I307-R315 WeakPolarHBondContact O-CG 3.34Å; I307-I316 HydrophobicContact CG2-CD1 4.49Å; I307-I316 PolarHBondContact O-N 2.72Å; I307-N317 HydrophobicContact CD1-CB 4.22Å; I307-N317 PolarHBondContact N-O 2.88Å; I307-N317 PolarHBondContact O-N 3.32Å; I307-L319 HydrophobicContact CD1-CD1 4.08Å; I307-L319 HydrophobicContact CD1-CD2 4.25Å; I307-L319 HydrophobicContact CD1-CG 4.08Å
308	W	97.8	Very high	96.7	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.008	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	142	-175.5	-53.7	90.7	0	0	0	111.3	Y275 K277 L295 L296 N306 Q314 R315	Y275-W308 HydrophobicContact CD1-CB 3.76Å; Y275-W308 HydrophobicContact CD1-CD2 4.34Å; Y275-W308 HydrophobicContact CD1-CE3 4.24Å; Y275-W308 HydrophobicContact CD1-CG 4.16Å; Y275-W308 HydrophobicContact CE1-CB 4.28Å; Y275-W308 HydrophobicContact CG-CB 4.25Å; Y275-W308 HydrophobicContact CG-CD2 4.34Å; Y275-W308 HydrophobicContact CG-CE3 4.45Å; Y275-W308 HydrophobicContact CG-CG 4.24Å; K277-W308 HydrophobicContact CB-CH2 4.03Å; L295-W308 WeakPolarHBondContact CA-O 3.47Å; L296-W308 HydrophobicContact CB-CB 4.33Å; L296-W308 PolarHBondContact N-O 2.83Å; L296-W308 PolarHBondContact O-N 2.95Å; N306-W308 HydrophobicContact CB-CZ2 4Å; W308-Q314 WeakPolarHBondContact CA-O 3.46Å; W308-R315 HydrophobicContact CD2-CB 4.23Å; W308-R315 HydrophobicContact CD2-CG 4.41Å; W308-R315 HydrophobicContact CE3-CB 3.66Å; W308-R315 HydrophobicContact CE3-CG 4.32Å; W308-R315 HydrophobicContact CH2-CB 4.03Å; W308-R315 HydrophobicContact CH2-CG 4.45Å; W308-R315 HydrophobicContact CZ3-CB 3.57Å; W308-R315 HydrophobicContact CZ3-CG 4.37Å
309	D	97.6	Very high	96.6	Very high	4 Å²	4	26.6 Å²	26.6	2%	0.021	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	113.5	164.6	-171.9	-29.4	0	0	0	107.9	V48 R294 L311 K312 G313 Q314 I316	V48-D309 WeakPolarHBondContact CG2-OD2 3.27Å; R294-D309 IonicContact CZ-OD1 3.96Å; R294-D309 IonicContact CZ-OD2 3.85Å; R294-D309 IonicContact NE-OD1 3.49Å; R294-D309 PolarHBondContact NE-OD1 2.86Å; R294-D309 IonicContact NE-OD2 3.59Å; R294-D309 PolarHBondContact NE-OD2 3.02Å; R294-D309 IonicContact NH2-OD1 2.8Å; R294-D309 IonicContact NH2-OD2 3.22Å; R294-D309 PolarHBondContact NH2-OD2 2.62Å; D309-L311 VanDerWaalsContact C-N 3.28Å; D309-L311 PolarHBondContact O-N 3.01Å; D309-L311 PolarHBondContact OD1-N 3.11Å; D309-L311 VanDerWaalsContact OD1-N 3.09Å; D309-K312 HydrophobicContact CB-CB 4.13Å; D309-K312 PolarHBondContact OD1-N 2.81Å; D309-G313 WeakPolarHBondContact O-CA 3.46Å; D309-G313 PolarHBondContact O-N 2.86Å; D309-Q314 PolarHBondContact N-O 2.83Å; D309-I316 HydrophobicContact CB-CD1 3.81Å; D309-I316 HydrophobicContact CB-CG1 3.95Å
310	V	97.7	Very high	96.3	Very high	2 Å²	2	35 Å²	35	1%	0.012	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-36.2	-174.6	170.9	0	0	0	0	112.4	L38 F246 L263 Y275 F289 G293 R294 L296	L38-V310 WeakPolarHBondContact CD2-O 3.35Å; F246-V310 HydrophobicContact CE2-CG1 4.27Å; L263-V310 HydrophobicContact CD2-CG1 3.94Å; Y275-V310 WeakPolarHBondContact OH-CA 3.44Å; Y275-V310 WeakPolarHBondContact OH-CG1 3.23Å; Y275-V310 PolarHBondContact OH-O 3.14Å; F289-V310 HydrophobicContact CD1-CG2 4.06Å; F289-V310 HydrophobicContact CE1-CG1 4.34Å; F289-V310 HydrophobicContact CE1-CG2 3.81Å; G293-V310 WeakPolarHBondContact O-CB 3.11Å; G293-V310 WeakPolarHBondContact O-CG2 3.24Å; R294-V310 WeakPolarHBondContact O-CG2 3.41Å; R294-V310 PolarHBondContact O-N 3.47Å; L296-V310 HydrophobicContact CB-CG2 3.47Å; L296-V310 VanDerWaalsContact CB-CG2 3.47Å; L296-V310 HydrophobicContact CD2-CG2 4.45Å
311	L	96.8	Very high	95.5	Very high	51 Å²	51	36 Å²	36	27%	0.267	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-40.3	-175.4	-58.2	178.8	0	0	0	110.8	L38 S42 L45 D309	L38-L311 HydrophobicContact CD1-CD2 4.24Å; S42-L311 PolarHBondContact OG-O 3.29Å; L45-L311 HydrophobicContact CD1-CB 4.5Å; L45-L311 HydrophobicContact CD1-CD1 3.42Å; L45-L311 VanDerWaalsContact CD1-CD1 3.42Å; D309-L311 VanDerWaalsContact C-N 3.28Å; D309-L311 PolarHBondContact O-N 3.01Å; D309-L311 PolarHBondContact OD1-N 3.11Å; D309-L311 VanDerWaalsContact OD1-N 3.09Å
312	K	94.9	Very high	95.4	Very high	36 Å²	36	35.9 Å²	35.9	16%	0.157	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-12.1	-176.5	-62.4	-159.4	171.7	-151.9	0	114.7	L45 D309 Q314	L45-K312 WeakPolarHBondContact O-CE 3.45Å; L45-K312 PolarHBondContact O-NZ 3.29Å; D309-K312 HydrophobicContact CB-CB 4.13Å; D309-K312 PolarHBondContact OD1-N 2.81Å; K312-Q314 HydrophobicContact CB-CG 4.39Å; K312-Q314 PolarHBondContact O-N 2.83Å
313	G	94.4	Very high	95.4	Very high	19 Å²	19	41.2 Å²	41.2	20%	0.196	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	16.5	-177.7	0	0	0	0	0	114.4	D309	D309-G313 WeakPolarHBondContact O-CA 3.46Å; D309-G313 PolarHBondContact O-N 2.86Å
314	Q	94.4	Very high	95.4	Very high	121 Å²	121	40.8 Å²	40.8	57%	0.565	20%	0.195	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.4	143.4	-172.7	-68.8	177.4	11.5	0	0	112	W308 D309 K312 I316	W308-Q314 WeakPolarHBondContact CA-O 3.46Å; D309-Q314 PolarHBondContact N-O 2.83Å; K312-Q314 HydrophobicContact CB-CG 4.39Å; K312-Q314 PolarHBondContact O-N 2.83Å; Q314-I316 PolarHBondContact O-N 3.19Å
315	R	96.1	Very high	95.4	Very high	57 Å²	57	44.8 Å²	44.8	22%	0.215	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	118.8	170.8	-168.4	178.2	66.8	-169.3	-0.5	110.4	K277 N306 I307 W308	K277-R315 VanDerWaalsContact NZ-NH2 3.12Å; N306-R315 WeakPolarHBondContact OD1-CD 3.42Å; N306-R315 PolarHBondContact OD1-NH1 2.61Å; N306-R315 VanDerWaalsContact OD1-NH1 3.1Å; I307-R315 CarbonylContact O-C 3.56Å; I307-R315 WeakPolarHBondContact O-CA 3.43Å; I307-R315 WeakPolarHBondContact O-CG 3.34Å; W308-R315 HydrophobicContact CD2-CB 4.23Å; W308-R315 HydrophobicContact CD2-CG 4.41Å; W308-R315 HydrophobicContact CE3-CB 3.66Å; W308-R315 HydrophobicContact CE3-CG 4.32Å; W308-R315 HydrophobicContact CH2-CB 4.03Å; W308-R315 HydrophobicContact CH2-CG 4.45Å; W308-R315 HydrophobicContact CZ3-CB 3.57Å; W308-R315 HydrophobicContact CZ3-CG 4.37Å
316	I	95.4	Very high	95.5	Very high	39 Å²	39	44.7 Å²	44.7	20%	0.2	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-50.6	178.2	-57.8	167	0	0	0	110.3	V48 L51 L295 I307 D309 Q314	V48-I316 HydrophobicContact CB-CD1 3.74Å; V48-I316 HydrophobicContact CB-CG1 4.4Å; V48-I316 HydrophobicContact CG1-CD1 3.89Å; V48-I316 HydrophobicContact CG2-CD1 4.06Å; L51-I316 HydrophobicContact CD1-CG2 4.34Å; L51-I316 HydrophobicContact CG-CG2 4.29Å; L295-I316 HydrophobicContact CD2-CD1 3.37Å; I307-I316 HydrophobicContact CG2-CD1 4.49Å; I307-I316 PolarHBondContact O-N 2.72Å; D309-I316 HydrophobicContact CB-CD1 3.81Å; D309-I316 HydrophobicContact CB-CG1 3.95Å; Q314-I316 PolarHBondContact O-N 3.19Å
317	N	94.8	Very high	95.5	Very high	51 Å²	51	45.6 Å²	45.6	27%	0.273	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	167.2	-173.6	-156.2	0.9	0	0	0	112.6	L51 I307	L51-N317 PolarHBondContact O-ND2 3.41Å; I307-N317 HydrophobicContact CD1-CB 4.22Å; I307-N317 PolarHBondContact N-O 2.88Å; I307-N317 PolarHBondContact O-N 3.32Å
318	I	95.6	Very high	95.5	Very high	33 Å²	33	45.7 Å²	45.7	17%	0.169	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	130.6	173.4	-46.3	171	0	0	0	108.1	A304 V305 Y320	A304-I318 HydrophobicContact CB-CG2 3.87Å; V305-I318 CarbonylContact O-C 3.46Å; V305-I318 WeakPolarHBondContact O-CA 3.43Å; I318-Y320 HydrophobicContact CB-CE2 4.08Å; I318-Y320 HydrophobicContact CD1-CE2 4.48Å; I318-Y320 WeakPolarHBondContact CD1-OH 3.31Å; I318-Y320 HydrophobicContact CG2-CD1 4.47Å; I318-Y320 HydrophobicContact CG2-CD2 4.31Å; I318-Y320 HydrophobicContact CG2-CE1 4.01Å; I318-Y320 HydrophobicContact CG2-CE2 3.84Å
319	L	96	Very high	95.5	Very high	11 Å²	11	45.6 Å²	45.6	6%	0.058	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	110.2	173	-47.6	178	0	0	0	109.1	I53 A304 V305 I307 W350	I53-L319 HydrophobicContact CB-CD1 4.41Å; I53-L319 HydrophobicContact CB-CD2 4.16Å; I53-L319 HydrophobicContact CG2-CD1 4.01Å; A304-L319 WeakPolarHBondContact CA-O 3.38Å; V305-L319 HydrophobicContact CB-CB 4.1Å; V305-L319 HydrophobicContact CB-CD1 4.31Å; V305-L319 HydrophobicContact CB-CG 4.38Å; V305-L319 HydrophobicContact CG1-CD1 4.49Å; V305-L319 PolarHBondContact N-O 3.4Å; V305-L319 PolarHBondContact O-N 3.02Å; I307-L319 HydrophobicContact CD1-CD1 4.08Å; I307-L319 HydrophobicContact CD1-CD2 4.25Å; I307-L319 HydrophobicContact CD1-CG 4.08Å; L319-W350 HydrophobicContact CB-CH2 4.39Å; L319-W350 HydrophobicContact CB-CZ3 4.15Å; L319-W350 HydrophobicContact CD1-CD2 4.17Å; L319-W350 HydrophobicContact CD1-CE3 3.88Å; L319-W350 HydrophobicContact CD1-CZ3 4.28Å
320	Y	93.4	Very high	95.5	Very high	177 Å²	177	47.3 Å²	47.3	69%	0.694	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	125.2	172.2	-63.4	-76.9	0	0	0	109.6	A304 I318	A304-Y320 HydrophobicContact CB-CD1 4.28Å; A304-Y320 HydrophobicContact CB-CE1 4.33Å; I318-Y320 HydrophobicContact CB-CE2 4.08Å; I318-Y320 HydrophobicContact CD1-CE2 4.48Å; I318-Y320 WeakPolarHBondContact CD1-OH 3.31Å; I318-Y320 HydrophobicContact CG2-CD1 4.47Å; I318-Y320 HydrophobicContact CG2-CD2 4.31Å; I318-Y320 HydrophobicContact CG2-CE1 4.01Å; I318-Y320 HydrophobicContact CG2-CE2 3.84Å
321	C	79.5	Confident	95.6	Very high	19 Å²	19	48 Å²	48	13%	0.128	23%	0.228	C	C	.	.			trans	-154.1	-67.3	-168.8	64.5	0	0	0	0	114.6	I55 R348 W350	I55-C321 HydrophobicContact CD1-CB 4.43Å; C321-R348 PolarHBondContact O-NH1 2.71Å; C321-R348 PolarHBondContact O-NH2 3.1Å; C321-W350 HydrophobicContact CB-CH2 3.09Å; C321-W350 HydrophobicContact CB-CZ2 3.14Å; C321-W350 HydrophobicContact CB-CZ3 4.38Å; C321-W350 WeakPolarHBondContact SG-CZ2 3.35Å
322	H	96.3	Very high	95.6	Very high	12 Å²	12	45.9 Å²	45.9	6%	0.056	22%	0.217	C	C	.	.			trans	-75.8	153.6	-171.6	-76.7	-71.5	0	0	0	110.1	H303 N324 I326 T340 S342 D344 T346	H303-H322 HydrophobicContact CB-CB 4.42Å; H303-H322 VanDerWaalsContact CB-O 3.29Å; H303-H322 WeakPolarHBondContact CB-O 3.43Å; H322-N324 VanDerWaalsContact C-N 3.28Å; H322-N324 WeakPolarHBondContact CB-O 3.46Å; H322-I326 HydrophobicContact CB-CG1 4.29Å; H322-T340 PolarHBondContact NE2-OG1 2.96Å; H322-S342 WeakPolarHBondContact CB-OG 3.44Å; H322-S342 VanDerWaalsContact CE1-CB 3.48Å; H322-S342 WeakPolarHBondContact CE1-CB 3.49Å; H322-S342 WeakPolarHBondContact ND1-CB 3.41Å; H322-D344 VanDerWaalsContact CA-OD2 3.31Å; H322-D344 WeakPolarHBondContact CA-OD2 3.33Å; H322-D344 WeakPolarHBondContact CB-OD2 3.42Å; H322-D344 IonicContact CE1-OD1 3.24Å; H322-D344 IonicContact CE1-OD2 3.41Å; H322-D344 IonicContact CG-OD2 3.77Å; H322-D344 VanDerWaalsContact ND1-CG 3.34Å; H322-D344 IonicContact ND1-OD1 3.68Å; H322-D344 PolarHBondContact ND1-OD1 2.77Å; H322-D344 IonicContact ND1-OD2 3.67Å; H322-D344 PolarHBondContact ND1-OD2 3.23Å; H322-T346 PolarHBondContact CE1-OG1 3.01Å; H322-T346 PolarHBondContact ND1-OG1 3.35Å
323	E	96.7	Very high	95.6	Very high	159 Å²	159	46.5 Å²	46.5	74%	0.743	23%	0.225	S	C	*	.	S	Bend	trans	-93	2.7	177.7	-63.7	175.6	-173.7	0	0	111.3	D344	E323-D344 HydrophobicContact CB-CB 4.09Å; E323-D344 PolarHBondContact N-OD2 2.92Å
324	N	97.6	Very high	95.7	Very high	59 Å²	59	47.9 Å²	47.9	32%	0.316	23%	0.227	S	C	.	.	S	Bend	trans	-156.8	174.9	179.3	-148.4	-37.2	0	0	0	111	H303 H322 I326 S342 W343 D344	H303-N324 WeakPolarHBondContact CB-O 3.42Å; H303-N324 WeakPolarHBondContact ND1-CA 3.41Å; H303-N324 PolarHBondContact ND1-O 3.49Å; H322-N324 VanDerWaalsContact C-N 3.28Å; H322-N324 WeakPolarHBondContact CB-O 3.46Å; N324-I326 PolarHBondContact O-N 2.48Å; N324-S342 PolarHBondContact O-OG 3.17Å; N324-W343 HydrophobicContact CB-CB 3.83Å; N324-D344 HydrophobicContact CB-CB 4Å
325	R	97.1	Very high	95.8	Very high	84 Å²	84	43.6 Å²	43.6	32%	0.317	22%	0.216	S	C	.	.			trans	-43.1	130.4	-178.8	174	-177.9	-63.2	-163.2	1.1	111.8	N285 S301 H303 S327 S342 W343	N285-R325 VanDerWaalsContact ND2-CG 3.27Å; N285-R325 WeakPolarHBondContact ND2-CG 3.32Å; S301-R325 PolarHBondContact OG-NE 3.41Å; H303-R325 PolarHBondContact ND1-N 2.79Å; R325-S327 PolarHBondContact O-N 3.05Å; R325-S342 CarbonylContact O-C 3.55Å; R325-S342 VanDerWaalsContact O-CA 3.25Å; R325-S342 WeakPolarHBondContact O-CA 3.4Å; R325-S342 WeakPolarHBondContact O-CB 3.27Å; R325-S342 PolarHBondContact O-OG 3.39Å; R325-W343 HydrophobicContact CB-CB 4.33Å; R325-W343 HydrophobicContact CB-CD2 3.99Å; R325-W343 HydrophobicContact CB-CE3 4.18Å; R325-W343 HydrophobicContact CB-CG 4.05Å; R325-W343 HydrophobicContact CG-CD2 4.4Å; R325-W343 PolarHBondContact O-N 2.8Å
326	I	98.1	Very high	95.9	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	117.6	167.1	-65.1	160.7	0	0	0	107.4	N285 Y300 H303 A304 V305 H322 N324	N285-I326 VanDerWaalsContact CB-O 3.3Å; N285-I326 WeakPolarHBondContact CB-O 3.18Å; N285-I326 PolarHBondContact ND2-O 2.81Å; Y300-I326 PolarHBondContact O-N 2.82Å; H303-I326 WeakPolarHBondContact O-CD1 3.49Å; A304-I326 VanDerWaalsContact C-CD1 3.46Å; A304-I326 WeakPolarHBondContact O-CD1 3.48Å; V305-I326 HydrophobicContact CG2-CD1 3.59Å; H322-I326 HydrophobicContact CB-CG1 4.29Å; N324-I326 PolarHBondContact O-N 2.48Å
327	S	97.9	Very high	95.9	Very high	21 Å²	21	43.7 Å²	43.7	15%	0.147	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	-31.3	-177.8	48.9	0	0	0	0	112.3	V66 R325 G341	V66-S327 WeakPolarHBondContact O-CB 3.07Å; V66-S327 PolarHBondContact O-OG 3.38Å; R325-S327 PolarHBondContact O-N 3.05Å; S327-G341 PolarHBondContact N-O 2.92Å; S327-G341 PolarHBondContact OG-O 3.45Å
328	A	97.6	Very high	96	Very high	3 Å²	3	41.8 Å²	41.8	3%	0.025	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	145.3	-177	0	0	0	0	0	111.5	L69 T340 G341	L69-A328 HydrophobicContact CD2-CB 3.76Å; L69-A328 HydrophobicContact CG-CB 3.86Å; A328-T340 CarbonylContact O-C 3.54Å; A328-T340 WeakPolarHBondContact O-CA 3.48Å; A328-G341 PolarHBondContact N-O 3.17Å; A328-G341 PolarHBondContact O-N 3.41Å
329	L	97.9	Very high	96.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	128.9	178.9	-174.5	153.5	0	0	0	108.7	A286 D288 F297 V305 I338 C339 T340	A286-L329 HydrophobicContact CB-CB 3.73Å; D288-L329 HydrophobicContact CB-CD2 3.58Å; F297-L329 HydrophobicContact CB-CD1 3.91Å; F297-L329 HydrophobicContact CB-CD2 3.66Å; F297-L329 HydrophobicContact CB-CG 4.47Å; V305-L329 HydrophobicContact CG1-CD1 3.78Å; V305-L329 HydrophobicContact CG2-CD1 4.16Å; L329-I338 HydrophobicContact CD1-CG2 4.41Å; L329-I338 HydrophobicContact CD2-CG2 3.88Å; L329-I338 HydrophobicContact CG-CG2 3.93Å; L329-C339 WeakPolarHBondContact CA-O 3.37Å; L329-T340 HydrophobicContact CD1-CG2 3.92Å; L329-T340 HydrophobicContact CG-CG2 4.07Å
330	R	98.2	Very high	96.3	Very high	40 Å²	40	39.7 Å²	39.7	15%	0.151	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	137.6	171.7	-59.1	-68.1	174.8	-113	1.6	112.3	L69 W71 D288 C339	L69-R330 HydrophobicContact CD1-CB 3.6Å; L69-R330 HydrophobicContact CD1-CG 3.48Å; L69-R330 VanDerWaalsContact CD1-CG 3.48Å; L69-R330 HydrophobicContact CG-CG 4.33Å; W71-R330 PolarHBondContact NE1-O 3.11Å; D288-R330 WeakPolarHBondContact OD2-CA 3.35Å; R330-C339 PolarHBondContact N-O 3.15Å; R330-C339 PolarHBondContact O-N 2.83Å
331	V	98	Very high	96.5	Very high	17 Å²	17	31.3 Å²	31.3	10%	0.103	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	144.3	168	-176	0	0	0	0	109.2	W71 D288 F289 F297 A337 I338	W71-V331 VanDerWaalsContact CD1-O 3.31Å; D288-V331 HydrophobicContact CB-CG2 4.1Å; D288-V331 PolarHBondContact OD2-N 3.1Å; F289-V331 WeakPolarHBondContact O-CG2 3.08Å; F297-V331 HydrophobicContact CD2-CG2 3.62Å; F297-V331 HydrophobicContact CE2-CG2 3.74Å; V331-A337 WeakPolarHBondContact CA-O 3.48Å; V331-I338 HydrophobicContact CG2-CG1 4.27Å
332	S	97.7	Very high	97.4	Very high	5 Å²	5	30.4 Å²	30.4	4%	0.035	17%	0.166	C	C	.	.			trans	-63.5	151.5	175	64	0	0	0	0	110.3	D334 G335 T336 A337	S332-D334 WeakPolarHBondContact CB-OD1 3.29Å; S332-D334 PolarHBondContact O-N 2.79Å; S332-D334 PolarHBondContact OG-OD1 3.15Å; S332-G335 PolarHBondContact O-N 3.03Å; S332-T336 PolarHBondContact OG-N 3.23Å; S332-T336 VanDerWaalsContact OG-N 3.11Å; S332-T336 PolarHBondContact OG-OG1 3.38Å; S332-A337 PolarHBondContact N-O 2.89Å; S332-A337 PolarHBondContact OG-N 2.96Å; S332-A337 PolarHBondContact OG-O 3.32Å
333	P	95.9	Very high	97.5	Very high	50 Å²	50	32.5 Å²	32.5	33%	0.325	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-24	-177.7	-25.8	32.3	0	0	0	115	W71 S72 L73 K75	W71-P333 HydrophobicContact CB-CG 4.15Å; S72-P333 VanDerWaalsContact O-CG 3.31Å; S72-P333 WeakPolarHBondContact O-CG 3.41Å; L73-P333 HydrophobicContact CD2-CB 4.25Å; L73-P333 HydrophobicContact CD2-CG 4.18Å; K75-P333 HydrophobicContact CG-CB 4.3Å
334	D	96.4	Very high	97.6	Very high	48 Å²	48	26.1 Å²	26.1	26%	0.257	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	1.4	176.4	64.1	-1.1	0	0	0	114.2	K75 S332 T336	K75-D334 HydrophobicContact CD-CB 3.82Å; K75-D334 HydrophobicContact CG-CB 3.99Å; S332-D334 WeakPolarHBondContact CB-OD1 3.29Å; S332-D334 PolarHBondContact O-N 2.79Å; S332-D334 PolarHBondContact OG-OD1 3.15Å; D334-T336 HydrophobicContact CB-CG2 4.28Å; D334-T336 VanDerWaalsContact CG-CG2 3.47Å; D334-T336 VanDerWaalsContact CG-OG1 3.28Å; D334-T336 PolarHBondContact O-N 3.24Å; D334-T336 WeakPolarHBondContact OD1-CB 3.44Å; D334-T336 PolarHBondContact OD1-N 3.41Å; D334-T336 VanDerWaalsContact OD1-N 3.13Å; D334-T336 PolarHBondContact OD1-OG1 3.43Å; D334-T336 WeakPolarHBondContact OD2-CG2 3.34Å; D334-T336 PolarHBondContact OD2-OG1 2.84Å
335	G	96.2	Very high	97.6	Very high	31 Å²	31	25.6 Å²	25.6	32%	0.32	14%	0.143	S	C	.	.	S	Bend	trans	72.6	6.4	179.9	0	0	0	0	0	115.6	S332	S332-G335 PolarHBondContact O-N 3.03Å
336	T	96.8	Very high	97.6	Very high	85 Å²	85	22.2 Å²	22.2	52%	0.521	13%	0.132	S	C	.	.	S	Bend	trans	-80.6	-23.8	-174.8	62.6	0	0	0	0	113.9	S332 D334	S332-T336 PolarHBondContact OG-N 3.23Å; S332-T336 VanDerWaalsContact OG-N 3.11Å; S332-T336 PolarHBondContact OG-OG1 3.38Å; D334-T336 HydrophobicContact CB-CG2 4.28Å; D334-T336 VanDerWaalsContact CG-CG2 3.47Å; D334-T336 VanDerWaalsContact CG-OG1 3.28Å; D334-T336 PolarHBondContact O-N 3.24Å; D334-T336 WeakPolarHBondContact OD1-CB 3.44Å; D334-T336 PolarHBondContact OD1-N 3.41Å; D334-T336 VanDerWaalsContact OD1-N 3.13Å; D334-T336 PolarHBondContact OD1-OG1 3.43Å; D334-T336 WeakPolarHBondContact OD2-CG2 3.34Å; D334-T336 PolarHBondContact OD2-OG1 2.84Å
337	A	97	Very high	97.6	Very high	13 Å²	13	22.2 Å²	22.2	11%	0.107	13%	0.132	C	C	.	.			trans	-143.7	165.6	-176	0	0	0	0	0	112.3	V331 S332 I349 W350	V331-A337 WeakPolarHBondContact CA-O 3.48Å; S332-A337 PolarHBondContact N-O 2.89Å; S332-A337 PolarHBondContact OG-N 2.96Å; S332-A337 PolarHBondContact OG-O 3.32Å; A337-I349 HydrophobicContact CB-CG2 3.89Å; A337-W350 CarbonylContact C-O 3.59Å; A337-W350 WeakPolarHBondContact CA-O 3.48Å; A337-W350 WeakPolarHBondContact CB-O 3.12Å
338	I	97.3	Very high	97.6	Very high	10 Å²	10	22.7 Å²	22.7	5%	0.051	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138	172.7	-47.6	162.1	0	0	0	107.3	F297 L329 V331 I349 W350	F297-I338 HydrophobicContact CD1-CD1 3.47Å; F297-I338 VanDerWaalsContact CD1-CD1 3.47Å; F297-I338 HydrophobicContact CD2-CD1 4.07Å; F297-I338 HydrophobicContact CE1-CD1 3.19Å; F297-I338 HydrophobicContact CE1-CG1 4.39Å; F297-I338 HydrophobicContact CE2-CD1 3.81Å; F297-I338 HydrophobicContact CE2-CG1 4.24Å; F297-I338 HydrophobicContact CG-CD1 3.91Å; F297-I338 HydrophobicContact CZ-CD1 3.38Å; F297-I338 HydrophobicContact CZ-CG1 4.19Å; L329-I338 HydrophobicContact CD1-CG2 4.41Å; L329-I338 HydrophobicContact CD2-CG2 3.88Å; L329-I338 HydrophobicContact CG-CG2 3.93Å; V331-I338 HydrophobicContact CG2-CG1 4.27Å; I338-I349 CarbonylContact O-C 3.56Å; I338-I349 WeakPolarHBondContact O-CA 3.41Å; I338-W350 HydrophobicContact CB-CB 4.17Å; I338-W350 PolarHBondContact N-O 2.76Å; I338-W350 VanDerWaalsContact O-CD1 3.31Å; I338-W350 PolarHBondContact O-N 3.13Å
339	C	98	Very high	97.6	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.1	169.5	-169.6	0	0	0	0	110	L69 W71 I78 L329 R330 R348	L69-C339 HydrophobicContact CD1-CB 4.04Å; L69-C339 HydrophobicContact CD2-CB 4.47Å; W71-C339 HydrophobicContact CZ2-CB 3.58Å; I78-C339 HydrophobicContact CD1-CB 4.37Å; L329-C339 WeakPolarHBondContact CA-O 3.37Å; R330-C339 PolarHBondContact N-O 3.15Å; R330-C339 PolarHBondContact O-N 2.83Å; C339-R348 WeakPolarHBondContact CA-O 3.19Å
340	T	98.4	Very high	97.6	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.006	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.5	172.9	56.4	0	0	0	0	109.9	V305 H322 A328 L329 L347 R348 W350	V305-T340 HydrophobicContact CG2-CG2 3.84Å; H322-T340 PolarHBondContact NE2-OG1 2.96Å; A328-T340 CarbonylContact O-C 3.54Å; A328-T340 WeakPolarHBondContact O-CA 3.48Å; L329-T340 HydrophobicContact CD1-CG2 3.92Å; L329-T340 HydrophobicContact CG-CG2 4.07Å; T340-L347 CarbonylContact O-C 3.49Å; T340-L347 WeakPolarHBondContact O-CA 3.18Å; T340-R348 PolarHBondContact N-O 3.27Å; T340-R348 PolarHBondContact O-N 3.18Å; T340-W350 PolarHBondContact OG1-NE1 2.82Å
341	G	98	Very high	97.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	139.9	172	0	0	0	0	0	110.3	L69 S327 A328	L69-G341 VanDerWaalsContact CD2-N 3.32Å; S327-G341 PolarHBondContact N-O 2.92Å; S327-G341 PolarHBondContact OG-O 3.45Å; A328-G341 PolarHBondContact N-O 3.17Å; A328-G341 PolarHBondContact O-N 3.41Å
342	S	98.5	Very high	97.3	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	160.2	-174.8	171.9	0	0	0	0	113.4	V66 H322 N324 R325 D344 T345 T346	V66-S342 WeakPolarHBondContact CB-O 3.28Å; V66-S342 PolarHBondContact N-O 3.39Å; H322-S342 WeakPolarHBondContact CB-OG 3.44Å; H322-S342 VanDerWaalsContact CE1-CB 3.48Å; H322-S342 WeakPolarHBondContact CE1-CB 3.49Å; H322-S342 WeakPolarHBondContact ND1-CB 3.41Å; N324-S342 PolarHBondContact O-OG 3.17Å; R325-S342 CarbonylContact O-C 3.55Å; R325-S342 VanDerWaalsContact O-CA 3.25Å; R325-S342 WeakPolarHBondContact O-CA 3.4Å; R325-S342 WeakPolarHBondContact O-CB 3.27Å; R325-S342 PolarHBondContact O-OG 3.39Å; S342-D344 WeakPolarHBondContact CB-OD1 3.22Å; S342-D344 PolarHBondContact O-N 2.9Å; S342-D344 PolarHBondContact OG-N 2.87Å; S342-D344 VanDerWaalsContact OG-N 3.09Å; S342-D344 PolarHBondContact OG-OD1 3.35Å; S342-T345 PolarHBondContact O-N 2.75Å; S342-T346 PolarHBondContact N-O 3.37Å; S342-T346 VanDerWaalsContact N-O 3.16Å
343	W	98.3	Very high	97.3	Very high	57 Å²	57	26 Å²	26	22%	0.216	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-7	168.9	-72.7	16.4	0	0	0	113.6	K65 N324 R325 T345	K65-W343 HydrophobicContact CB-CB 4.15Å; K65-W343 HydrophobicContact CB-CG 3.91Å; K65-W343 HydrophobicContact CD-CB 4.16Å; K65-W343 HydrophobicContact CD-CD2 3.52Å; K65-W343 HydrophobicContact CD-CE3 3.8Å; K65-W343 HydrophobicContact CD-CG 3.7Å; K65-W343 HydrophobicContact CD-CZ2 4.39Å; K65-W343 HydrophobicContact CD-CZ3 4.35Å; K65-W343 HydrophobicContact CG-CB 3.89Å; K65-W343 HydrophobicContact CG-CD2 4.22Å; K65-W343 HydrophobicContact CG-CG 3.86Å; K65-W343 VanDerWaalsContact NZ-CZ3 3.29Å; N324-W343 HydrophobicContact CB-CB 3.83Å; R325-W343 HydrophobicContact CB-CB 4.33Å; R325-W343 HydrophobicContact CB-CD2 3.99Å; R325-W343 HydrophobicContact CB-CE3 4.18Å; R325-W343 HydrophobicContact CB-CG 4.05Å; R325-W343 HydrophobicContact CG-CD2 4.4Å; R325-W343 PolarHBondContact O-N 2.8Å; W343-T345 PolarHBondContact O-N 3.19Å
344	D	97.8	Very high	97.4	Very high	24 Å²	24	24.7 Å²	24.7	13%	0.128	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	12.6	169.5	75.7	4.1	0	0	0	113.6	H322 E323 N324 S342 T346 R348	H322-D344 VanDerWaalsContact CA-OD2 3.31Å; H322-D344 WeakPolarHBondContact CA-OD2 3.33Å; H322-D344 WeakPolarHBondContact CB-OD2 3.42Å; H322-D344 IonicContact CE1-OD1 3.24Å; H322-D344 IonicContact CE1-OD2 3.41Å; H322-D344 IonicContact CG-OD2 3.77Å; H322-D344 VanDerWaalsContact ND1-CG 3.34Å; H322-D344 IonicContact ND1-OD1 3.68Å; H322-D344 PolarHBondContact ND1-OD1 2.77Å; H322-D344 IonicContact ND1-OD2 3.67Å; H322-D344 PolarHBondContact ND1-OD2 3.23Å; E323-D344 HydrophobicContact CB-CB 4.09Å; E323-D344 PolarHBondContact N-OD2 2.92Å; N324-D344 HydrophobicContact CB-CB 4Å; S342-D344 WeakPolarHBondContact CB-OD1 3.22Å; S342-D344 PolarHBondContact O-N 2.9Å; S342-D344 PolarHBondContact OG-N 2.87Å; S342-D344 VanDerWaalsContact OG-N 3.09Å; S342-D344 PolarHBondContact OG-OD1 3.35Å; D344-T346 VanDerWaalsContact CG-OG1 3.29Å; D344-T346 PolarHBondContact O-N 3.13Å; D344-T346 WeakPolarHBondContact OD1-CB 3.39Å; D344-T346 PolarHBondContact OD1-N 2.95Å; D344-T346 PolarHBondContact OD1-OG1 3.34Å; D344-T346 PolarHBondContact OD2-OG1 3.24Å; D344-R348 IonicContact OD2-NH2 3.57Å
345	T	98	Very high	97.4	Very high	49 Å²	49	23.3 Å²	23.3	30%	0.301	14%	0.144	S	C	.	.	S	Bend	trans	65.4	10.9	-180	87	0	0	0	0	114.8	G64 S342 W343	G64-T345 VanDerWaalsContact O-CB 3.3Å; G64-T345 WeakPolarHBondContact O-CB 3.44Å; G64-T345 VanDerWaalsContact O-CG2 3.28Å; G64-T345 WeakPolarHBondContact O-CG2 3.39Å; S342-T345 PolarHBondContact O-N 2.75Å; W343-T345 PolarHBondContact O-N 3.19Å
346	T	98	Very high	97.5	Very high	13 Å²	13	22.8 Å²	22.8	8%	0.08	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	155.4	179.6	74.5	0	0	0	0	112.6	V58 K60 H322 S342 D344	V58-T346 HydrophobicContact CG1-CG2 4.41Å; K60-T346 HydrophobicContact CG-CG2 4.21Å; H322-T346 PolarHBondContact CE1-OG1 3.01Å; H322-T346 PolarHBondContact ND1-OG1 3.35Å; S342-T346 PolarHBondContact N-O 3.37Å; S342-T346 VanDerWaalsContact N-O 3.16Å; D344-T346 VanDerWaalsContact CG-OG1 3.29Å; D344-T346 PolarHBondContact O-N 3.13Å; D344-T346 WeakPolarHBondContact OD1-CB 3.39Å; D344-T346 PolarHBondContact OD1-N 2.95Å; D344-T346 PolarHBondContact OD1-OG1 3.34Å; D344-T346 PolarHBondContact OD2-OG1 3.24Å
347	L	98.2	Very high	97.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	148.1	159.4	-56.8	90.4	0	0	0	109.7	V58 L59 V66 L69 S80 W90 T340	V58-L347 CarbonylContact C-O 3.49Å; V58-L347 WeakPolarHBondContact CA-O 3.46Å; L59-L347 HydrophobicContact CB-CB 4.08Å; L59-L347 HydrophobicContact CB-CD1 4.47Å; L59-L347 HydrophobicContact CD1-CB 4.14Å; L59-L347 HydrophobicContact CG-CB 4.35Å; L59-L347 PolarHBondContact N-O 3.38Å; L59-L347 PolarHBondContact O-N 2.88Å; L59-L347 VanDerWaalsContact O-N 3.11Å; V66-L347 HydrophobicContact CG1-CD1 4.19Å; V66-L347 HydrophobicContact CG1-CD2 4.22Å; V66-L347 HydrophobicContact CG1-CG 4.09Å; V66-L347 HydrophobicContact CG2-CD1 3.84Å; V66-L347 HydrophobicContact CG2-CG 4.27Å; L69-L347 HydrophobicContact CB-CD2 3.95Å; L69-L347 HydrophobicContact CD2-CD2 3.99Å; S80-L347 WeakPolarHBondContact OG-CD1 3.4Å; W90-L347 HydrophobicContact CZ2-CD1 4.17Å; T340-L347 CarbonylContact O-C 3.49Å; T340-L347 WeakPolarHBondContact O-CA 3.18Å
348	R	98	Very high	97.6	Very high	31 Å²	31	19.1 Å²	19.1	12%	0.117	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	135.7	178.6	-63.4	179.9	-174.3	-162.8	14.5	110.1	I55 R57 V58 C321 C339 T340 D344 W350	I55-R348 VanDerWaalsContact CD1-NH1 3.34Å; I55-R348 HydrophobicContact CG2-CB 4.49Å; R57-R348 WeakPolarHBondContact O-CA 3.49Å; V58-R348 HydrophobicContact CG1-CG 4.35Å; V58-R348 HydrophobicContact CG2-CG 4.33Å; C321-R348 PolarHBondContact O-NH1 2.71Å; C321-R348 PolarHBondContact O-NH2 3.1Å; C339-R348 WeakPolarHBondContact CA-O 3.19Å; T340-R348 PolarHBondContact N-O 3.27Å; T340-R348 PolarHBondContact O-N 3.18Å; D344-R348 IonicContact OD2-NH2 3.57Å; R348-W350 HydrophobicContact CB-CZ2 4.08Å; R348-W350 PolarHBondContact O-NE1 2.94Å
349	I	97.7	Very high	97.6	Very high	12 Å²	12	19.8 Å²	19.8	6%	0.062	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.5	175.4	-55.8	175.3	0	0	0	108.5	R56 R57 L59 W71 I78 G92 A337 I338	R56-I349 PolarHBondContact N-O 2.61Å; R57-I349 HydrophobicContact CB-CB 4.09Å; R57-I349 HydrophobicContact CB-CD1 4.16Å; R57-I349 HydrophobicContact CB-CG1 4.32Å; R57-I349 HydrophobicContact CG-CD1 4.47Å; R57-I349 PolarHBondContact N-O 2.63Å; R57-I349 PolarHBondContact O-N 2.59Å; L59-I349 HydrophobicContact CD1-CD1 4.41Å; W71-I349 HydrophobicContact CH2-CD1 4.21Å; W71-I349 HydrophobicContact CH2-CG2 4.29Å; I78-I349 HydrophobicContact CD1-CD1 3.7Å; I78-I349 HydrophobicContact CD1-CG1 4.17Å; G92-I349 WeakPolarHBondContact O-CD1 3.09Å; A337-I349 HydrophobicContact CB-CG2 3.89Å; I338-I349 CarbonylContact O-C 3.56Å; I338-I349 WeakPolarHBondContact O-CA 3.41Å
350	W	96.3	Very high	97.6	Very high	9 Å²	9	21.4 Å²	21.4	3%	0.034	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.4	-172.4	-57.5	87.8	0	0	0	110.5	I53 R54 I55 L319 C321 A337 I338 T340 R348	I53-W350 HydrophobicContact CG2-CB 3.67Å; I53-W350 HydrophobicContact CG2-CE3 4.1Å; R54-W350 WeakPolarHBondContact O-CA 3.2Å; I55-W350 HydrophobicContact CB-CH2 4.46Å; I55-W350 HydrophobicContact CB-CZ3 4.4Å; I55-W350 HydrophobicContact CD1-CH2 3.56Å; I55-W350 HydrophobicContact CD1-CZ2 4.07Å; I55-W350 HydrophobicContact CD1-CZ3 4.17Å; I55-W350 HydrophobicContact CG1-CD2 4.27Å; I55-W350 HydrophobicContact CG1-CE3 3.85Å; I55-W350 HydrophobicContact CG1-CH2 3.07Å; I55-W350 HydrophobicContact CG1-CZ2 3.59Å; I55-W350 HydrophobicContact CG1-CZ3 3.29Å; L319-W350 HydrophobicContact CB-CH2 4.39Å; L319-W350 HydrophobicContact CB-CZ3 4.15Å; L319-W350 HydrophobicContact CD1-CD2 4.17Å; L319-W350 HydrophobicContact CD1-CE3 3.88Å; L319-W350 HydrophobicContact CD1-CZ3 4.28Å; C321-W350 HydrophobicContact CB-CH2 3.09Å; C321-W350 HydrophobicContact CB-CZ2 3.14Å; C321-W350 HydrophobicContact CB-CZ3 4.38Å; C321-W350 WeakPolarHBondContact SG-CZ2 3.35Å; A337-W350 CarbonylContact C-O 3.59Å; A337-W350 WeakPolarHBondContact CA-O 3.48Å; A337-W350 WeakPolarHBondContact CB-O 3.12Å; I338-W350 HydrophobicContact CB-CB 4.17Å; I338-W350 PolarHBondContact N-O 2.76Å; I338-W350 VanDerWaalsContact O-CD1 3.31Å; I338-W350 PolarHBondContact O-N 3.13Å; T340-W350 PolarHBondContact OG1-NE1 2.82Å; R348-W350 HydrophobicContact CB-CZ2 4.08Å; R348-W350 PolarHBondContact O-NE1 2.94Å
351	A	93.7	Very high	97.5	Very high	61 Å²	61	23.3 Å²	23.3	50%	0.504	13%	0.131	S	C	.	.			trans	-157	0	170.6	0	0	0	0	0	112.3	R54 R56	R54-A351 PolarHBondContact N-O 2.87Å; R54-A351 VanDerWaalsContact N-O 3.15Å; R54-A351 PolarHBondContact O-N 2.79Å; R54-A351 VanDerWaalsContact O-N 3.1Å; R56-A351 HydrophobicContact CG-CB 3.89Å; R56-A351 VanDerWaalsContact CZ-O 3.27Å; R56-A351 PolarHBondContact NE-O 3.3Å; R56-A351 PolarHBondContact NH2-O 3.11Å

Retrieved 351 of 351 residues in 124 ms (Link to these results)

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