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Isoform 16 of Protocadherin-15 AlphaSync

Canonical isoform description: Calcium-dependent cell-adhesion protein. Required for inner ear neuroepithelial cell elaboration and cochlear function. Probably involved in the maintenance of normal retinal function.

AlphaFold DB , UniProt , Accession Q99PJ1-16 (canonical: Q99PJ1), Species MOUSE (Mus musculus, Mouse), Gene Pcdh15, Length 719 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.9	Very low	49.2	Very low	220 Å²	220	146.5 Å²	146.5	100%	1.084	73%	0.726	S	S	*	*				0	48.4	0	-167.7	-172.1	170.2	0	0	111.4
2	F	46.5	Very low	49.5	Very low	170 Å²	170	139.5 Å²	139.5	75%	0.746	70%	0.699	S	S	*	*			trans	-145	1.1	-175.7	-74.5	-67.4	0	0	0	115.9	Q4 F5	F2-Q4 VanDerWaalsContact C-N 3.27Å; F2-Q4 PolarHBondContact O-N 3.03Å; F2-Q4 VanDerWaalsContact O-N 3.1Å; F2-F5 PolarHBondContact O-N 3.21Å
3	L	43.7	Very low	49.9	Very low	176 Å²	176	138.5 Å²	138.5	92%	0.921	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-7.8	-163.8	-140.6	75.4	0	0	0	116.1
4	Q	47.3	Very low	50.3	Low	171 Å²	171	131.4 Å²	131.4	80%	0.799	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	-9.3	179.1	-76.7	177.8	-53.9	0	0	114.6	F2	F2-Q4 VanDerWaalsContact C-N 3.27Å; F2-Q4 PolarHBondContact O-N 3.03Å; F2-Q4 VanDerWaalsContact O-N 3.1Å
5	F	49.4	Very low	51	Low	156 Å²	156	129.9 Å²	129.9	68%	0.684	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-10.5	-171.7	-77.6	-79.2	0	0	0	115.3	F2	F2-F5 PolarHBondContact O-N 3.21Å
6	A	52.4	Low	51.3	Low	70 Å²	70	127.9 Å²	127.9	58%	0.579	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-45.5	178.7	0	0	0	0	0	112.7	W8 K9	A6-W8 PolarHBondContact O-N 3.2Å; A6-K9 PolarHBondContact O-N 3.05Å
7	V	50.3	Low	51.7	Low	100 Å²	100	126.4 Å²	126.4	61%	0.606	65%	0.646	S	S	*	*	H	α-helix	trans	-60.5	-43	-172.1	-176.2	0	0	0	0	111.8	K9 C10 L11	V7-K9 PolarHBondContact O-N 3.04Å; V7-C10 PolarHBondContact O-N 3.31Å; V7-C10 VanDerWaalsContact O-N 3.09Å; V7-L11 HydrophobicContact CG1-CD1 3.95Å; V7-L11 WeakPolarHBondContact O-CD1 3.27Å; V7-L11 PolarHBondContact O-N 3.34Å
8	W	48.5	Very low	52	Low	201 Å²	201	122.2 Å²	122.2	76%	0.761	63%	0.633	S	S	*	*	H	α-helix	trans	-66.6	-20.9	-177.2	-145.8	-19.8	0	0	0	113.5	A6 P12	A6-W8 PolarHBondContact O-N 3.2Å; W8-P12 WeakPolarHBondContact O-CD 3.15Å
9	K	49.2	Very low	52.3	Low	172 Å²	172	118.6 Å²	118.6	75%	0.748	62%	0.62	S	S	*	*	H	α-helix	trans	-82.3	-19	174.5	-74.6	-163.4	171	-169.3	0	114	A6 V7	A6-K9 PolarHBondContact O-N 3.05Å; V7-K9 PolarHBondContact O-N 3.04Å
10	C	52.6	Low	52.4	Low	90 Å²	90	118.6 Å²	118.6	61%	0.608	62%	0.62	S	S	*	*	H	α-helix	trans	-86.3	-28.9	173.9	-64.2	0	0	0	0	112.7	V7 H13 G14	V7-C10 PolarHBondContact O-N 3.31Å; V7-C10 VanDerWaalsContact O-N 3.09Å; C10-H13 PolarHBondContact O-N 3.37Å; C10-G14 PolarHBondContact O-N 3.5Å
11	L	52.4	Low	52.3	Low	85 Å²	85	117.6 Å²	117.6	45%	0.445	61%	0.614	S	S	.	*	H	α-helix	trans	-49.2	-50.8	176.2	-99.3	82.5	0	0	0	114.7	V7 H13 G14 I15	V7-L11 HydrophobicContact CG1-CD1 3.95Å; V7-L11 WeakPolarHBondContact O-CD1 3.27Å; V7-L11 PolarHBondContact O-N 3.34Å; L11-H13 VanDerWaalsContact C-N 3.28Å; L11-H13 PolarHBondContact O-N 3.23Å; L11-G14 PolarHBondContact O-N 3.1Å; L11-I15 WeakPolarHBondContact O-CB 3.5Å; L11-I15 VanDerWaalsContact O-CG1 3.28Å; L11-I15 WeakPolarHBondContact O-CG1 3.44Å; L11-I15 PolarHBondContact O-N 3.24Å
12	P	53.2	Low	52.5	Low	63 Å²	63	112.1 Å²	112.1	41%	0.409	59%	0.593	S	S	.	*	H	α-helix	trans	-64.4	-30.1	-178.2	24	-34.4	0	0	0	113.3	W8 L16	W8-P12 WeakPolarHBondContact O-CD 3.15Å; P12-L16 WeakPolarHBondContact O-CB 3.35Å; P12-L16 WeakPolarHBondContact O-CD1 3.32Å; P12-L16 WeakPolarHBondContact O-CG 3.19Å; P12-L16 PolarHBondContact O-N 3.43Å
13	H	54.5	Low	52.8	Low	126 Å²	126	108.5 Å²	108.5	58%	0.583	59%	0.585	S	S	*	*	H	α-helix	trans	-78.3	-37.6	174.4	-70.1	5.4	0	0	0	111.9	C10 L11 I15 L16 I17	C10-H13 PolarHBondContact O-N 3.37Å; L11-H13 VanDerWaalsContact C-N 3.28Å; L11-H13 PolarHBondContact O-N 3.23Å; H13-I15 VanDerWaalsContact C-N 3.33Å; H13-I15 PolarHBondContact O-N 3.36Å; H13-L16 PolarHBondContact O-N 3.32Å; H13-I17 WeakPolarHBondContact O-CB 3.31Å; H13-I17 VanDerWaalsContact O-CG1 3.3Å; H13-I17 WeakPolarHBondContact O-CG1 3.44Å; H13-I17 PolarHBondContact O-N 2.99Å
14	G	55.9	Low	53.1	Low	40 Å²	40	102.9 Å²	102.9	41%	0.412	56%	0.56	S	S	.	*	H	α-helix	trans	-61.1	-41.2	171.4	0	0	0	0	0	112.4	C10 L11 I17 A18	C10-G14 PolarHBondContact O-N 3.5Å; L11-G14 PolarHBondContact O-N 3.1Å; G14-I17 PolarHBondContact O-N 2.95Å; G14-A18 WeakPolarHBondContact O-CB 3.38Å; G14-A18 PolarHBondContact O-N 3.17Å
15	I	59.7	Low	53.1	Low	109 Å²	109	104 Å²	104	56%	0.559	56%	0.558	S	S	*	*	H	α-helix	trans	-68	-41.4	175.9	-68.5	163.3	0	0	0	111.2	L11 H13 A18 S19	L11-I15 WeakPolarHBondContact O-CB 3.5Å; L11-I15 VanDerWaalsContact O-CG1 3.28Å; L11-I15 WeakPolarHBondContact O-CG1 3.44Å; L11-I15 PolarHBondContact O-N 3.24Å; H13-I15 VanDerWaalsContact C-N 3.33Å; H13-I15 PolarHBondContact O-N 3.36Å; I15-A18 PolarHBondContact O-N 2.74Å; I15-S19 WeakPolarHBondContact O-CB 3.37Å; I15-S19 PolarHBondContact O-N 2.71Å; I15-S19 PolarHBondContact O-OG 2.99Å; I15-S19 VanDerWaalsContact O-OG 3.12Å
16	L	56.8	Low	53.2	Low	97 Å²	97	98.6 Å²	98.6	51%	0.508	55%	0.546	S	S	.	.	H	α-helix	trans	-64.9	-39.5	174.9	-82.8	165.9	0	0	0	113	P12 H13 S19 L20	P12-L16 WeakPolarHBondContact O-CB 3.35Å; P12-L16 WeakPolarHBondContact O-CD1 3.32Å; P12-L16 WeakPolarHBondContact O-CG 3.19Å; P12-L16 PolarHBondContact O-N 3.43Å; H13-L16 PolarHBondContact O-N 3.32Å; L16-S19 PolarHBondContact O-OG 3.21Å; L16-S19 VanDerWaalsContact O-OG 3.14Å; L16-L20 VanDerWaalsContact O-CB 3.31Å; L16-L20 WeakPolarHBondContact O-CB 3.46Å; L16-L20 WeakPolarHBondContact O-CD1 3.46Å; L16-L20 VanDerWaalsContact O-CG 3.24Å; L16-L20 WeakPolarHBondContact O-CG 3.47Å; L16-L20 PolarHBondContact O-N 2.76Å
17	I	58.3	Low	53.3	Low	103 Å²	103	101.5 Å²	101.5	53%	0.528	55%	0.547	S	S	.	.	H	α-helix	trans	-71.5	-40.3	176.9	-67.3	165.5	0	0	0	110.3	H13 G14 L20 L21	H13-I17 WeakPolarHBondContact O-CB 3.31Å; H13-I17 VanDerWaalsContact O-CG1 3.3Å; H13-I17 WeakPolarHBondContact O-CG1 3.44Å; H13-I17 PolarHBondContact O-N 2.99Å; G14-I17 PolarHBondContact O-N 2.95Å; I17-L20 PolarHBondContact O-N 3.34Å; I17-L21 HydrophobicContact CG2-CD1 4Å; I17-L21 WeakPolarHBondContact O-CB 3.5Å; I17-L21 WeakPolarHBondContact O-CG 3.41Å; I17-L21 PolarHBondContact O-N 2.93Å
18	A	56.5	Low	53.6	Low	50 Å²	50	101.9 Å²	101.9	41%	0.413	54%	0.539	S	S	.	.	H	α-helix	trans	-64.3	-41.7	174.9	0	0	0	0	0	112.1	G14 I15 L21 V22	G14-A18 WeakPolarHBondContact O-CB 3.38Å; G14-A18 PolarHBondContact O-N 3.17Å; I15-A18 PolarHBondContact O-N 2.74Å; A18-L21 PolarHBondContact O-N 2.9Å; A18-V22 WeakPolarHBondContact O-CB 3.49Å; A18-V22 VanDerWaalsContact O-CG2 3.28Å; A18-V22 WeakPolarHBondContact O-CG2 3.45Å; A18-V22 PolarHBondContact O-N 2.9Å
19	S	57.9	Low	54.5	Low	54 Å²	54	96.8 Å²	96.8	38%	0.378	53%	0.526	S	S	.	.	H	α-helix	trans	-69.7	-38.2	176.4	65.4	0	0	0	0	112.2	I15 L16 L21 V22 V23	I15-S19 WeakPolarHBondContact O-CB 3.37Å; I15-S19 PolarHBondContact O-N 2.71Å; I15-S19 PolarHBondContact O-OG 2.99Å; I15-S19 VanDerWaalsContact O-OG 3.12Å; L16-S19 PolarHBondContact O-OG 3.21Å; L16-S19 VanDerWaalsContact O-OG 3.14Å; S19-L21 PolarHBondContact O-N 3.16Å; S19-V22 PolarHBondContact O-N 3.13Å; S19-V23 VanDerWaalsContact O-CB 3.31Å; S19-V23 WeakPolarHBondContact O-CB 3.26Å; S19-V23 WeakPolarHBondContact O-CG2 2.96Å; S19-V23 PolarHBondContact O-N 2.93Å
20	L	53.7	Low	56.3	Low	119 Å²	119	91.3 Å²	91.3	62%	0.623	51%	0.505	S	S	*	.	H	α-helix	trans	-61.4	-41.1	171.8	-78.6	166.3	0	0	0	112.4	L16 I17 S24	L16-L20 VanDerWaalsContact O-CB 3.31Å; L16-L20 WeakPolarHBondContact O-CB 3.46Å; L16-L20 WeakPolarHBondContact O-CD1 3.46Å; L16-L20 VanDerWaalsContact O-CG 3.24Å; L16-L20 WeakPolarHBondContact O-CG 3.47Å; L16-L20 PolarHBondContact O-N 2.76Å; I17-L20 PolarHBondContact O-N 3.34Å; L20-S24 VanDerWaalsContact O-CB 3.27Å; L20-S24 WeakPolarHBondContact O-CB 3.33Å; L20-S24 PolarHBondContact O-N 2.77Å
21	L	51.3	Low	58.1	Low	97 Å²	97	88 Å²	88	51%	0.508	48%	0.481	S	S	.	.	H	α-helix	trans	-67.7	-44.8	175.9	-74.6	168	0	0	0	112.1	I17 A18 S19 S24 W25	I17-L21 HydrophobicContact CG2-CD1 4Å; I17-L21 WeakPolarHBondContact O-CB 3.5Å; I17-L21 WeakPolarHBondContact O-CG 3.41Å; I17-L21 PolarHBondContact O-N 2.93Å; A18-L21 PolarHBondContact O-N 2.9Å; S19-L21 PolarHBondContact O-N 3.16Å; L21-S24 PolarHBondContact O-N 2.91Å; L21-W25 PolarHBondContact O-N 3.06Å
22	V	53.4	Low	60	Low	105 Å²	105	83.9 Å²	83.9	64%	0.636	46%	0.46	S	S	*	.	H	α-helix	trans	-63.6	-41.4	177	169.1	0	0	0	0	111.4	A18 S19 W25 G26	A18-V22 WeakPolarHBondContact O-CB 3.49Å; A18-V22 VanDerWaalsContact O-CG2 3.28Å; A18-V22 WeakPolarHBondContact O-CG2 3.45Å; A18-V22 PolarHBondContact O-N 2.9Å; S19-V22 PolarHBondContact O-N 3.13Å; V22-W25 PolarHBondContact O-N 2.66Å; V22-G26 PolarHBondContact O-N 3.26Å
23	V	52.3	Low	62	Low	94 Å²	94	84.7 Å²	84.7	57%	0.57	46%	0.457	S	S	*	.	H	α-helix	trans	-61.4	-46.6	172.8	167.2	0	0	0	0	110.7	S19 W25 Q27	S19-V23 VanDerWaalsContact O-CB 3.31Å; S19-V23 WeakPolarHBondContact O-CB 3.26Å; S19-V23 WeakPolarHBondContact O-CG2 2.96Å; S19-V23 PolarHBondContact O-N 2.93Å; V23-W25 PolarHBondContact O-N 3.06Å; V23-Q27 WeakPolarHBondContact O-CB 3.07Å; V23-Q27 PolarHBondContact O-N 3.02Å
24	S	49.8	Very low	63.8	Low	59 Å²	59	80.5 Å²	80.5	41%	0.413	44%	0.438	S	S	.	.	H	α-helix	trans	-66.8	-17.2	179.1	-174	0	0	0	0	114.4	L20 L21	L20-S24 VanDerWaalsContact O-CB 3.27Å; L20-S24 WeakPolarHBondContact O-CB 3.33Å; L20-S24 PolarHBondContact O-N 2.77Å; L21-S24 PolarHBondContact O-N 2.91Å
25	W	46.4	Very low	65.6	Low	195 Å²	195	81.7 Å²	81.7	74%	0.739	44%	0.444	S	S	*	.	H	α-helix	trans	-96.9	-45.9	177.1	-77.4	35.5	0	0	0	111.4	L21 V22 V23 Q27 Y28	L21-W25 PolarHBondContact O-N 3.06Å; V22-W25 PolarHBondContact O-N 2.66Å; V23-W25 PolarHBondContact O-N 3.06Å; W25-Q27 PolarHBondContact O-N 3.45Å; W25-Q27 VanDerWaalsContact O-N 3.16Å; W25-Y28 PolarHBondContact O-N 3.01Å; W25-Y28 VanDerWaalsContact O-N 3.14Å
26	G	51.7	Low	67.1	Low	42 Å²	42	79.5 Å²	79.5	43%	0.433	43%	0.429	S	S	.	.	H	α-helix	trans	-60.9	-24.4	177.7	0	0	0	0	0	113.6	V22 Y28 D29	V22-G26 PolarHBondContact O-N 3.26Å; G26-Y28 PolarHBondContact O-N 3.13Å; G26-D29 PolarHBondContact O-N 3Å
27	Q	55.1	Low	68.7	Low	131 Å²	131	77.9 Å²	77.9	61%	0.612	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-16.2	177.2	-164.5	167.8	4.1	0	0	114.3	V23 W25	V23-Q27 WeakPolarHBondContact O-CB 3.07Å; V23-Q27 PolarHBondContact O-N 3.02Å; W25-Q27 PolarHBondContact O-N 3.45Å; W25-Q27 VanDerWaalsContact O-N 3.16Å
28	Y	56.7	Low	70.2	Confident	108 Å²	108	76.4 Å²	76.4	42%	0.424	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-21.3	175.8	-61.2	-46.3	0	0	0	114.4	W25 G26 D30 D31 N122 K124	W25-Y28 PolarHBondContact O-N 3.01Å; W25-Y28 VanDerWaalsContact O-N 3.14Å; G26-Y28 PolarHBondContact O-N 3.13Å; Y28-D30 PolarHBondContact O-N 3.46Å; Y28-D31 PolarHBondContact O-N 3.06Å; Y28-N122 PolarHBondContact O-ND2 2.88Å; Y28-K124 HydrophobicContact CD1-CD 3.86Å; Y28-K124 HydrophobicContact CD2-CD 4.45Å; Y28-K124 HydrophobicContact CE1-CD 4.43Å; Y28-K124 HydrophobicContact CG-CD 3.88Å
29	D	68.4	Low	71.9	Confident	94 Å²	94	77.9 Å²	77.9	50%	0.503	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-0.8	171.8	-158.3	38.5	0	0	0	111.7	G26 K33	G26-D29 PolarHBondContact O-N 3Å; D29-K33 WeakPolarHBondContact O-CE 3.31Å; D29-K33 PolarHBondContact O-NZ 3.43Å
30	D	86.4	Confident	73.6	Confident	56 Å²	56	80.4 Å²	80.4	30%	0.299	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-15.5	178.7	-117.7	27.7	0	0	0	113.8	Y28 K33 K63	Y28-D30 PolarHBondContact O-N 3.46Å; D30-K33 WeakPolarHBondContact O-CB 3.19Å; D30-K33 PolarHBondContact O-N 3.16Å; D30-K33 WeakPolarHBondContact OD1-CD 3.46Å; D30-K33 IonicContact OD1-NZ 2.67Å; D30-K33 PolarHBondContact OD1-NZ 2.86Å; D30-K63 HydrophobicContact CB-CD 4.15Å; D30-K63 WeakPolarHBondContact O-CB 3.44Å; D30-K63 VanDerWaalsContact O-CD 3.29Å; D30-K63 WeakPolarHBondContact O-CD 3.16Å; D30-K63 IonicContact OD2-NZ 2.73Å; D30-K63 PolarHBondContact OD2-NZ 2.82Å
31	D	90	Very high	75.6	Confident	20 Å²	20	75.4 Å²	75.4	11%	0.107	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	145.4	174	-84	-9.3	0	0	0	110.6	Y28 K33 G64 T72 I73 N122	Y28-D31 PolarHBondContact O-N 3.06Å; D31-K33 VanDerWaalsContact C-N 3.3Å; D31-K33 PolarHBondContact O-N 3.16Å; D31-G64 WeakPolarHBondContact OD1-CA 3.06Å; D31-G64 PolarHBondContact OD1-N 3.2Å; D31-T72 WeakPolarHBondContact OD2-CB 3.37Å; D31-T72 PolarHBondContact OD2-OG1 3.45Å; D31-I73 HydrophobicContact CB-CG2 3.92Å; D31-N122 VanDerWaalsContact CB-ND2 3.32Å; D31-N122 WeakPolarHBondContact CB-ND2 3.22Å; D31-N122 PolarHBondContact O-ND2 3.16Å
32	C	93.2	Very high	77.7	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	-4.2	-163.7	-71	0	0	0	0	117.8	K63 I73 C120 N122 I129 H131	C32-K63 PolarHBondContact N-O 2.97Å; C32-I73 VanDerWaalsContact SG-CG2 3.53Å; C32-C120 WeakPolarHBondContact CA-SG 3.47Å; C32-C120 HydrophobicContact CB-CB 3.7Å; C32-C120 WeakPolarHBondContact CB-SG 3.46Å; C32-C120 WeakPolarHBondContact SG-CB 3.25Å; C32-C120 CovalentContact SG-SG 2.04Å; C32-C120 PolarHBondContact SG-SG 2.84Å; C32-N122 HydrophobicContact CB-CB 4.39Å; C32-N122 PolarHBondContact SG-N 3.49Å; C32-N122 VanDerWaalsContact SG-N 3.38Å; C32-I129 HydrophobicContact CB-CB 4.41Å; C32-I129 HydrophobicContact CB-CD1 4.01Å; C32-I129 HydrophobicContact CB-CG1 4.43Å; C32-H131 PolarHBondContact O-CE1 3.15Å; C32-H131 PolarHBondContact O-NE2 3.22Å
33	K	93.8	Very high	79.8	Confident	80 Å²	80	71.7 Å²	71.7	35%	0.348	42%	0.419	S	S	.	.	S	Bend	trans	-81.9	157.6	169.2	-57.6	176.2	-163	159	0	111	D29 D30 D31 K63 I129	D29-K33 WeakPolarHBondContact O-CE 3.31Å; D29-K33 PolarHBondContact O-NZ 3.43Å; D30-K33 WeakPolarHBondContact O-CB 3.19Å; D30-K33 PolarHBondContact O-N 3.16Å; D30-K33 WeakPolarHBondContact OD1-CD 3.46Å; D30-K33 IonicContact OD1-NZ 2.67Å; D30-K33 PolarHBondContact OD1-NZ 2.86Å; D31-K33 VanDerWaalsContact C-N 3.3Å; D31-K33 PolarHBondContact O-N 3.16Å; K33-K63 HydrophobicContact CB-CD 4.41Å; K33-K63 WeakPolarHBondContact O-CB 3.45Å; K33-K63 WeakPolarHBondContact O-CG 3.4Å; K33-K63 PolarHBondContact O-N 2.94Å; K33-I129 HydrophobicContact CG-CD1 4.28Å
34	L	93.8	Very high	81.9	Confident	37 Å²	37	68.9 Å²	68.9	19%	0.194	40%	0.402	C	S	.	.	B	Isolated β-bridge	trans	-67.2	140.6	172.4	-67.1	172.9	0	0	0	111.3	R36 I62	L34-R36 HydrophobicContact CB-CG 4.17Å; L34-R36 HydrophobicContact CD1-CG 4.42Å; L34-R36 HydrophobicContact CD2-CG 4.39Å; L34-I62 HydrophobicContact CD2-CG1 4.17Å
35	A	92.7	Very high	84.2	Confident	65 Å²	65	68.3 Å²	68.3	54%	0.537	40%	0.401	S	S	.	.	S	Bend	trans	-95.1	-0.8	170.3	0	0	0	0	0	112.5	L61 K63	A35-L61 WeakPolarHBondContact CB-O 3.34Å; A35-L61 PolarHBondContact N-O 2.92Å; A35-K63 HydrophobicContact CB-CG 3.93Å
36	R	91.5	Very high	86.6	Confident	64 Å²	64	59.8 Å²	59.8	24%	0.242	37%	0.369	C	S	.	.	S	Bend	trans	-102.4	157.6	174	62.5	171.1	-175.4	77.1	-6.6	111.9	L34 P39 P40 A41 T42 L61	L34-R36 HydrophobicContact CB-CG 4.17Å; L34-R36 HydrophobicContact CD1-CG 4.42Å; L34-R36 HydrophobicContact CD2-CG 4.39Å; R36-P39 PolarHBondContact NH1-O 3.22Å; R36-P39 PolarHBondContact NH2-O 3.28Å; R36-P40 PolarHBondContact NH2-O 2.86Å; R36-A41 VanDerWaalsContact NH2-C 3.29Å; R36-A41 PolarHBondContact NH2-O 3.02Å; R36-T42 PolarHBondContact NH2-OG1 3.17Å; R36-L61 HydrophobicContact CB-CB 4.29Å; R36-L61 HydrophobicContact CB-CD1 3.95Å; R36-L61 HydrophobicContact CG-CB 4.39Å
37	G	89.3	Confident	88.8	Confident	63 Å²	63	59.9 Å²	59.9	65%	0.649	36%	0.36	S	S	*	.			trans	-79	-171.4	163.1	0	0	0	0	0	112.5
38	G	90.2	Very high	90.8	Very high	71 Å²	71	54 Å²	54	73%	0.732	33%	0.332	S	S	*	.	S	Bend	trans	88.9	-167.4	178.7	0	0	0	0	0	113.9
39	P	93.6	Very high	92.7	Very high	82 Å²	82	54 Å²	54	53%	0.532	34%	0.337	S	S	.	.			trans	-68	159.9	179	29.5	-35.4	0	0	0	112.1	R36	R36-P39 PolarHBondContact NH1-O 3.22Å; R36-P39 PolarHBondContact NH2-O 3.28Å
40	P	93.5	Very high	94.1	Very high	106 Å²	106	50.5 Å²	50.5	69%	0.688	32%	0.319	S	S	*	.	S	Bend	trans	-65.8	-36.8	179.1	26.4	-34.2	0	0	0	112.7	R36	R36-P40 PolarHBondContact NH2-O 2.86Å
41	A	94.8	Very high	94.6	Very high	15 Å²	15	57.9 Å²	57.9	12%	0.124	34%	0.343	C	S	.	.	S	Bend	trans	-67.4	141.8	172	0	0	0	0	0	111	R36 I43 E132	R36-A41 VanDerWaalsContact NH2-C 3.29Å; R36-A41 PolarHBondContact NH2-O 3.02Å; A41-I43 HydrophobicContact CB-CG1 4.28Å; A41-E132 CarbonylContact C-O 3.59Å; A41-E132 WeakPolarHBondContact CA-O 3.4Å; A41-E132 HydrophobicContact CB-CB 4.18Å; A41-E132 HydrophobicContact CB-CG 4.32Å
42	T	95.8	Very high	94.9	Very high	16 Å²	16	60.8 Å²	60.8	10%	0.098	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	110.8	165.3	-62.3	0	0	0	0	107.3	R36 V44 V57 M60 E132 V133 R134	R36-T42 PolarHBondContact NH2-OG1 3.17Å; T42-V44 HydrophobicContact CG2-CG1 4.3Å; T42-V57 HydrophobicContact CG2-CG1 4.33Å; T42-V57 HydrophobicContact CG2-CG2 3.99Å; T42-M60 HydrophobicContact CG2-SD 4.21Å; T42-E132 PolarHBondContact N-O 3.48Å; T42-V133 HydrophobicContact CG2-CG1 4.5Å; T42-V133 CarbonylContact O-C 3.55Å; T42-V133 VanDerWaalsContact O-CA 3.29Å; T42-V133 WeakPolarHBondContact O-CA 3.3Å; T42-R134 PolarHBondContact O-N 3.25Å
43	I	96.1	Very high	95.1	Very high	107 Å²	107	62.7 Å²	62.7	55%	0.549	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127	179.2	-53.1	179.5	0	0	0	108.2	A41 R134 V136	A41-I43 HydrophobicContact CB-CG1 4.28Å; I43-R134 WeakPolarHBondContact CA-O 3.41Å; I43-R134 HydrophobicContact CG1-CB 4.37Å; I43-V136 HydrophobicContact CG2-CG2 4.46Å
44	V	96.9	Very high	95.2	Very high	36 Å²	36	60.9 Å²	60.9	22%	0.218	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	161.7	178	-65.4	0	0	0	0	109.6	T42 L56 V57 R134 I135 V136	T42-V44 HydrophobicContact CG2-CG1 4.3Å; V44-L56 WeakPolarHBondContact CG1-O 3.24Å; V44-L56 WeakPolarHBondContact CG2-O 3.26Å; V44-V57 HydrophobicContact CG1-CG2 4.11Å; V44-V57 HydrophobicContact CG2-CG2 4.39Å; V44-R134 PolarHBondContact N-O 2.87Å; V44-I135 HydrophobicContact CG2-CB 4.27Å; V44-I135 HydrophobicContact CG2-CG1 3.82Å; V44-I135 HydrophobicContact CG2-CG2 4.39Å; V44-I135 WeakPolarHBondContact O-CA 3.24Å; V44-V136 PolarHBondContact O-N 2.96Å
45	A	97.7	Very high	95.4	Very high	47 Å²	47	62.8 Å²	62.8	39%	0.388	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	132.1	177.5	0	0	0	0	0	110.4	V136 R138	A45-V136 VanDerWaalsContact CA-O 3.29Å; A45-V136 WeakPolarHBondContact CA-O 3.43Å; A45-V136 HydrophobicContact CB-CB 4.17Å; A45-R138 HydrophobicContact CB-CG 4.2Å; A45-R138 PolarHBondContact O-NH1 2.87Å
46	I	97.8	Very high	95.6	Very high	15 Å²	15	60.1 Å²	60.1	8%	0.077	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	160.4	173.4	57.3	169.8	0	0	0	108.9	T54 L56 L96 L103 I135 V136 R138	I46-T54 HydrophobicContact CG2-CG2 4.32Å; I46-L56 HydrophobicContact CD1-CD2 3.72Å; I46-L56 HydrophobicContact CG1-CD2 4.5Å; I46-L56 HydrophobicContact CG2-CD2 3.99Å; I46-L96 HydrophobicContact CD1-CD2 4.09Å; I46-L103 HydrophobicContact CD1-CD2 3.52Å; I46-L103 HydrophobicContact CG1-CD2 4.48Å; I46-I135 HydrophobicContact CD1-CG2 3.97Å; I46-I135 HydrophobicContact CG1-CG2 3.78Å; I46-V136 PolarHBondContact N-O 2.79Å; I46-V136 VanDerWaalsContact N-O 3.12Å; I46-R138 WeakPolarHBondContact O-CB 3.3Å; I46-R138 PolarHBondContact O-N 2.93Å
47	D	97.5	Very high	95.9	Very high	44 Å²	44	57.7 Å²	57.7	24%	0.235	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	154.1	166.1	-50.1	-59.7	0	0	0	109.2	S50 R138 R140	D47-S50 VanDerWaalsContact O-CB 3.29Å; D47-S50 WeakPolarHBondContact O-CB 3.12Å; D47-S50 PolarHBondContact O-OG 3.26Å; D47-R138 WeakPolarHBondContact CA-O 3.18Å; D47-R138 IonicContact OD1-CZ 3.74Å; D47-R138 IonicContact OD1-NE 2.72Å; D47-R138 PolarHBondContact OD1-NE 3.38Å; D47-R138 IonicContact OD1-NH2 3.29Å; D47-R138 PolarHBondContact OD1-NH2 3.4Å; D47-R138 IonicContact OD2-CZ 3.2Å; D47-R138 IonicContact OD2-NH2 2.84Å; D47-R138 PolarHBondContact OD2-NH2 2.84Å; D47-R140 HydrophobicContact CB-CG 4.39Å; D47-R140 IonicContact OD1-CZ 3.34Å; D47-R140 VanDerWaalsContact OD1-CZ 3.29Å; D47-R140 IonicContact OD1-NE 2.67Å; D47-R140 IonicContact OD1-NH1 2.71Å; D47-R140 IonicContact OD1-NH2 2.78Å; D47-R140 PolarHBondContact OD1-NH2 3.24Å; D47-R140 IonicContact OD2-NH1 2.77Å
48	E	97.7	Very high	96.2	Very high	7 Å²	7	60.4 Å²	60.4	3%	0.033	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	179.7	170	75.9	-167.9	91.6	0	0	113	S50 L103 R105 V137 R138 D139 R140	E48-S50 PolarHBondContact O-N 3Å; E48-L103 WeakPolarHBondContact CB-O 3.44Å; E48-R105 HydrophobicContact CB-CB 4.14Å; E48-R105 HydrophobicContact CG-CB 4.47Å; E48-R105 VanDerWaalsContact OE1-CB 3.28Å; E48-R105 WeakPolarHBondContact OE1-CB 3.49Å; E48-R105 VanDerWaalsContact OE1-CD 3.29Å; E48-R105 WeakPolarHBondContact OE1-CD 3.43Å; E48-R105 WeakPolarHBondContact OE2-CA 3.49Å; E48-R105 WeakPolarHBondContact OE2-CB 3.3Å; E48-R105 PolarHBondContact OE2-N 3.42Å; E48-V137 HydrophobicContact CB-CG1 3.57Å; E48-R138 PolarHBondContact N-O 2.87Å; E48-D139 WeakPolarHBondContact OE1-CA 3.5Å; E48-R140 HydrophobicContact CG-CB 3.84Å; E48-R140 HydrophobicContact CG-CG 3.67Å; E48-R140 PolarHBondContact OE1-N 3.05Å; E48-R140 VanDerWaalsContact OE1-N 3.1Å
49	E	96.5	Very high	96.5	Very high	110 Å²	110	60.5 Å²	60.5	51%	0.514	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	8.5	-167.9	-78.1	-113.6	109.4	0	0	113.7	R51 V102 L103	E49-R51 PolarHBondContact O-N 3.39Å; E49-V102 HydrophobicContact CB-CG1 4.45Å; E49-V102 HydrophobicContact CG-CG1 3.79Å; E49-V102 WeakPolarHBondContact OE1-CG1 3.49Å; E49-L103 PolarHBondContact N-O 3.44Å
50	S	97.4	Very high	96.6	Very high	19 Å²	19	56.6 Å²	56.6	13%	0.133	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-55.7	125.7	-169	-96	0	0	0	0	111.9	D47 E48 L96 S98	D47-S50 VanDerWaalsContact O-CB 3.29Å; D47-S50 WeakPolarHBondContact O-CB 3.12Å; D47-S50 PolarHBondContact O-OG 3.26Å; E48-S50 PolarHBondContact O-N 3Å; S50-L96 VanDerWaalsContact CB-CD2 3.42Å; S50-L96 WeakPolarHBondContact O-CD2 3.15Å; S50-S98 PolarHBondContact O-OG 3.16Å
51	R	97	Very high	96.7	Very high	212 Å²	212	55.2 Å²	55.2	80%	0.8	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-57.5	143.7	-174	-63.8	-177	-178.5	-178.6	0.9	111.9	E49 G53 T54	E49-R51 PolarHBondContact O-N 3.39Å; R51-G53 PolarHBondContact O-N 3.47Å; R51-T54 VanDerWaalsContact O-CB 3.3Å; R51-T54 WeakPolarHBondContact O-CB 3.43Å; R51-T54 PolarHBondContact O-N 2.64Å; R51-T54 PolarHBondContact O-OG1 2.67Å
52	N	96.8	Very high	96.7	Very high	81 Å²	81	54.8 Å²	54.8	43%	0.433	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	129.7	177.3	179.5	78.5	0	0	0	111.4	N97 S98 T99	N52-N97 WeakPolarHBondContact OD1-CA 3.29Å; N52-S98 WeakPolarHBondContact CA-OG 3.38Å; N52-S98 PolarHBondContact N-OG 3.38Å; N52-S98 VanDerWaalsContact N-OG 3.07Å; N52-S98 PolarHBondContact OD1-N 3.17Å; N52-T99 PolarHBondContact ND2-OG1 3.24Å; N52-T99 VanDerWaalsContact ND2-OG1 3.15Å; N52-T99 PolarHBondContact OD1-N 2.81Å; N52-T99 PolarHBondContact OD1-OG1 3.2Å
53	G	95.9	Very high	96.6	Very high	39 Å²	39	57.4 Å²	57.4	40%	0.402	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	0.6	-173	0	0	0	0	0	115.2	R51 I55 L96	R51-G53 PolarHBondContact O-N 3.47Å; G53-I55 PolarHBondContact O-N 3.08Å; G53-L96 PolarHBondContact N-O 3.13Å
54	T	97.4	Very high	96.4	Very high	43 Å²	43	53.3 Å²	53.3	26%	0.264	29%	0.286	S	S	.	.			trans	-52.1	132.5	168.6	-74.4	0	0	0	0	110.6	I46 R51 L56 F95 L96	I46-T54 HydrophobicContact CG2-CG2 4.32Å; R51-T54 VanDerWaalsContact O-CB 3.3Å; R51-T54 WeakPolarHBondContact O-CB 3.43Å; R51-T54 PolarHBondContact O-N 2.64Å; R51-T54 PolarHBondContact O-OG1 2.67Å; T54-L56 PolarHBondContact O-N 2.94Å; T54-F95 CarbonylContact O-C 3.58Å; T54-F95 WeakPolarHBondContact O-CA 3.37Å; T54-L96 PolarHBondContact O-N 2.9Å
55	I	97.6	Very high	96.3	Very high	77 Å²	77	55.3 Å²	55.3	40%	0.395	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	122.6	179.8	-56.9	166	0	0	0	108.5	G53 M93 F95	G53-I55 PolarHBondContact O-N 3.08Å; I55-M93 HydrophobicContact CD1-CE 3.67Å; I55-M93 HydrophobicContact CG1-CE 3.94Å; I55-M93 HydrophobicContact CG2-CE 3.85Å; I55-F95 HydrophobicContact CG1-CD1 3.97Å; I55-F95 HydrophobicContact CG1-CE1 3.85Å
56	L	97.5	Very high	96.1	Very high	9 Å²	9	54.3 Å²	54.3	5%	0.047	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-40.2	175.7	-59.6	174.9	0	0	0	110.9	V44 I46 T54 V85 L94 L96 I135	V44-L56 WeakPolarHBondContact CG1-O 3.24Å; V44-L56 WeakPolarHBondContact CG2-O 3.26Å; I46-L56 HydrophobicContact CD1-CD2 3.72Å; I46-L56 HydrophobicContact CG1-CD2 4.5Å; I46-L56 HydrophobicContact CG2-CD2 3.99Å; T54-L56 PolarHBondContact O-N 2.94Å; L56-V85 HydrophobicContact CD1-CB 4.39Å; L56-V85 HydrophobicContact CD1-CG1 4.08Å; L56-V85 HydrophobicContact CD1-CG2 3.86Å; L56-L94 HydrophobicContact CB-CB 4.05Å; L56-L94 PolarHBondContact N-O 2.96Å; L56-L96 HydrophobicContact CD1-CB 4.37Å; L56-L96 HydrophobicContact CD2-CB 4.1Å; L56-L96 HydrophobicContact CG-CB 4.26Å; L56-I135 HydrophobicContact CB-CG1 4.5Å; L56-I135 HydrophobicContact CD1-CG1 4.27Å; L56-I135 HydrophobicContact CD2-CG1 4.35Å; L56-I135 HydrophobicContact CD2-CG2 4.03Å
57	V	97.1	Very high	95.7	Very high	12 Å²	12	54.7 Å²	54.7	7%	0.073	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	119.3	178.1	-178.1	0	0	0	0	109.1	T42 V44 N59 M60 M93 L94 V133	T42-V57 HydrophobicContact CG2-CG1 4.33Å; T42-V57 HydrophobicContact CG2-CG2 3.99Å; V44-V57 HydrophobicContact CG1-CG2 4.11Å; V44-V57 HydrophobicContact CG2-CG2 4.39Å; V57-N59 VanDerWaalsContact C-N 3.35Å; V57-M60 HydrophobicContact CG1-CG 4.21Å; V57-M60 HydrophobicContact CG1-SD 4Å; V57-M60 HydrophobicContact CG2-SD 4.42Å; V57-M93 VanDerWaalsContact O-CA 3.29Å; V57-M93 WeakPolarHBondContact O-CA 3.49Å; V57-L94 HydrophobicContact CB-CB 4.04Å; V57-L94 HydrophobicContact CB-CD1 4.28Å; V57-L94 HydrophobicContact CB-CG 4.23Å; V57-L94 HydrophobicContact CG2-CB 4.28Å; V57-L94 HydrophobicContact CG2-CD1 3.95Å; V57-L94 HydrophobicContact CG2-CG 4.41Å; V57-L94 PolarHBondContact N-O 3.24Å; V57-L94 PolarHBondContact O-N 2.98Å; V57-V133 HydrophobicContact CG2-CG1 4.07Å
58	D	95.8	Very high	95.2	Very high	120 Å²	120	55.6 Å²	55.6	64%	0.642	32%	0.318	S	S	*	.	S	Bend	trans	-67.5	-31.2	178.3	-71.1	-56.5	0	0	0	113.8	M93	D58-M93 WeakPolarHBondContact O-CG 3.38Å
59	N	96	Very high	94.9	Very high	73 Å²	73	61.1 Å²	61.1	39%	0.39	35%	0.354	S	S	.	.			trans	-164.6	122.9	174.9	-161.8	-45.8	0	0	0	109.9	V57 L61	V57-N59 VanDerWaalsContact C-N 3.35Å; N59-L61 HydrophobicContact CB-CD2 4.17Å; N59-L61 HydrophobicContact CB-CG 4.22Å; N59-L61 PolarHBondContact O-N 2.81Å; N59-L61 WeakPolarHBondContact OD1-CA 3.1Å; N59-L61 PolarHBondContact OD1-N 2.8Å
60	M	95.5	Very high	94.7	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.005	36%	0.364	C	S	.	.			trans	-66.4	-16.8	174.6	-76.5	-69.9	-66.7	0	0	113.8	T42 V57 I62 Q92 L94 V118 H131 V133	T42-M60 HydrophobicContact CG2-SD 4.21Å; V57-M60 HydrophobicContact CG1-CG 4.21Å; V57-M60 HydrophobicContact CG1-SD 4Å; V57-M60 HydrophobicContact CG2-SD 4.42Å; M60-I62 VanDerWaalsContact C-N 3.33Å; M60-I62 HydrophobicContact CB-CD1 3.83Å; M60-I62 HydrophobicContact CB-CG1 3.94Å; M60-I62 HydrophobicContact CE-CD1 4.36Å; M60-I62 PolarHBondContact O-N 3.14Å; M60-Q92 HydrophobicContact CB-CB 4.15Å; M60-Q92 PolarHBondContact N-O 3.15Å; M60-L94 HydrophobicContact SD-CD1 4.17Å; M60-V118 HydrophobicContact CE-CB 4.09Å; M60-V118 HydrophobicContact CE-CG2 3.93Å; M60-V118 HydrophobicContact SD-CG2 4.4Å; M60-H131 HydrophobicContact CE-CB 3.61Å; M60-V133 HydrophobicContact CE-CG2 3.6Å; M60-V133 HydrophobicContact SD-CG2 3.63Å
61	L	95.4	Very high	94.4	Very high	77 Å²	77	63.2 Å²	63.2	40%	0.403	37%	0.37	S	S	.	.			trans	55	44.6	-179.2	-62.2	171.5	0	0	0	112.6	A35 R36 N59	A35-L61 WeakPolarHBondContact CB-O 3.34Å; A35-L61 PolarHBondContact N-O 2.92Å; R36-L61 HydrophobicContact CB-CB 4.29Å; R36-L61 HydrophobicContact CB-CD1 3.95Å; R36-L61 HydrophobicContact CG-CB 4.39Å; N59-L61 HydrophobicContact CB-CD2 4.17Å; N59-L61 HydrophobicContact CB-CG 4.22Å; N59-L61 PolarHBondContact O-N 2.81Å; N59-L61 WeakPolarHBondContact OD1-CA 3.1Å; N59-L61 PolarHBondContact OD1-N 2.8Å
62	I	95.4	Very high	94.2	Very high	6 Å²	6	53.8 Å²	53.8	3%	0.031	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-86.8	132.4	173.4	-59.1	165.6	0	0	0	108.9	L34 M60 I73 L75 Q92 V118 C120	L34-I62 HydrophobicContact CD2-CG1 4.17Å; M60-I62 VanDerWaalsContact C-N 3.33Å; M60-I62 HydrophobicContact CB-CD1 3.83Å; M60-I62 HydrophobicContact CB-CG1 3.94Å; M60-I62 HydrophobicContact CE-CD1 4.36Å; M60-I62 PolarHBondContact O-N 3.14Å; I62-I73 HydrophobicContact CG2-CD1 4.27Å; I62-L75 HydrophobicContact CD1-CD2 3.75Å; I62-Q92 PolarHBondContact O-NE2 3.03Å; I62-Q92 PolarHBondContact O-OE1 3.25Å; I62-V118 HydrophobicContact CD1-CG1 3.99Å; I62-C120 HydrophobicContact CG2-CB 4.4Å
63	K	94.3	Very high	94.2	Very high	70 Å²	70	50 Å²	50	30%	0.304	32%	0.315	S	S	.	.	S	Bend	trans	-65.9	135.6	176.6	-70.2	177.2	179.4	170.9	0	111.4	D30 C32 K33 A35	D30-K63 HydrophobicContact CB-CD 4.15Å; D30-K63 WeakPolarHBondContact O-CB 3.44Å; D30-K63 VanDerWaalsContact O-CD 3.29Å; D30-K63 WeakPolarHBondContact O-CD 3.16Å; D30-K63 IonicContact OD2-NZ 2.73Å; D30-K63 PolarHBondContact OD2-NZ 2.82Å; C32-K63 PolarHBondContact N-O 2.97Å; K33-K63 HydrophobicContact CB-CD 4.41Å; K33-K63 WeakPolarHBondContact O-CB 3.45Å; K33-K63 WeakPolarHBondContact O-CG 3.4Å; K33-K63 PolarHBondContact O-N 2.94Å; A35-K63 HydrophobicContact CB-CG 3.93Å
64	G	91.6	Very high	94.1	Very high	22 Å²	22	53.1 Å²	53.1	23%	0.227	32%	0.32	C	S	.	.	S	Bend	trans	111.9	169.5	179.6	0	0	0	0	0	113	D31 T72	D31-G64 WeakPolarHBondContact OD1-CA 3.06Å; D31-G64 PolarHBondContact OD1-N 3.2Å; G64-T72 VanDerWaalsContact CA-OG1 3.28Å; G64-T72 WeakPolarHBondContact CA-OG1 3.39Å
65	T	93.9	Very high	94.1	Very high	78 Å²	78	51.8 Å²	51.8	48%	0.479	31%	0.311	S	S	.	.			trans	-115.1	118.2	-179.7	51	0	0	0	0	110.7	P71 T72 I73	T65-P71 CarbonylContact O-C 3.6Å; T65-P71 WeakPolarHBondContact O-CA 3.24Å; T65-P71 WeakPolarHBondContact O-CB 3.23Å; T65-T72 PolarHBondContact N-OG1 3.18Å; T65-T72 VanDerWaalsContact N-OG1 3.1Å; T65-T72 PolarHBondContact O-N 2.77Å; T65-I73 PolarHBondContact O-N 2.81Å
66	A	93.2	Very high	94.1	Very high	25 Å²	25	50.2 Å²	50.2	21%	0.207	31%	0.306	C	S	.	.	S	Bend	trans	-86.7	-19.7	177.2	0	0	0	0	0	113.4	P71 I73 L75 P89	A66-P71 WeakPolarHBondContact O-CB 3.13Å; A66-I73 HydrophobicContact CB-CD1 4.36Å; A66-I73 HydrophobicContact CB-CG1 3.97Å; A66-L75 HydrophobicContact CB-CD1 4.16Å; A66-L75 HydrophobicContact CB-CG 4.23Å; A66-P89 HydrophobicContact CB-CB 4.25Å; A66-P89 WeakPolarHBondContact CB-O 3.3Å
67	G	89.5	Confident	94.1	Very high	24 Å²	24	51.4 Å²	51.4	25%	0.247	31%	0.313	C	S	.	.	S	Bend	trans	-112.3	175.4	174.4	0	0	0	0	0	113
68	G	88.7	Confident	94.1	Very high	63 Å²	63	55.2 Å²	55.2	65%	0.649	33%	0.329	S	S	*	.	S	Bend	trans	96.1	-177.4	-172.9	0	0	0	0	0	112.7
69	P	91.1	Very high	94.1	Very high	123 Å²	123	54.8 Å²	54.8	80%	0.799	33%	0.326	S	S	*	.	S	Bend	trans	-71.6	-34.5	-179.2	28.5	-34.1	0	0	0	112.9	P71	P69-P71 VanDerWaalsContact C-CD 3.44Å; P69-P71 VanDerWaalsContact O-CD 3.27Å; P69-P71 WeakPolarHBondContact O-CD 3.49Å
70	D	90.7	Very high	94.1	Very high	132 Å²	132	52.5 Å²	52.5	71%	0.706	31%	0.314	S	S	*	.	S	Bend	trans	-119.7	69.1	-175.8	-61.4	-70.2	0	0	0	110.9	T72	D70-T72 PolarHBondContact O-N 2.95Å
71	P	92.4	Very high	94.1	Very high	40 Å²	40	57.3 Å²	57.3	26%	0.26	34%	0.343	S	S	.	.			trans	-66	130.5	-179.6	28.4	-34.8	0	0	0	110.9	T65 A66 P69	T65-P71 CarbonylContact O-C 3.6Å; T65-P71 WeakPolarHBondContact O-CA 3.24Å; T65-P71 WeakPolarHBondContact O-CB 3.23Å; A66-P71 WeakPolarHBondContact O-CB 3.13Å; P69-P71 VanDerWaalsContact C-CD 3.44Å; P69-P71 VanDerWaalsContact O-CD 3.27Å; P69-P71 WeakPolarHBondContact O-CD 3.49Å
72	T	93.3	Very high	94.1	Very high	15 Å²	15	58.5 Å²	58.5	9%	0.092	35%	0.35	C	S	.	.	S	Bend	trans	-91	-21.1	-179.7	74.8	0	0	0	0	112.9	D31 G64 T65 D70 K123	D31-T72 WeakPolarHBondContact OD2-CB 3.37Å; D31-T72 PolarHBondContact OD2-OG1 3.45Å; G64-T72 VanDerWaalsContact CA-OG1 3.28Å; G64-T72 WeakPolarHBondContact CA-OG1 3.39Å; T65-T72 PolarHBondContact N-OG1 3.18Å; T65-T72 VanDerWaalsContact N-OG1 3.1Å; T65-T72 PolarHBondContact O-N 2.77Å; D70-T72 PolarHBondContact O-N 2.95Å; T72-K123 WeakPolarHBondContact O-CB 3.05Å; T72-K123 PolarHBondContact O-N 2.9Å
73	I	95.4	Very high	94.1	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	163.8	177.7	60.9	172.5	0	0	0	111.3	D31 C32 I62 T65 A66 L75 V121	D31-I73 HydrophobicContact CB-CG2 3.92Å; C32-I73 VanDerWaalsContact SG-CG2 3.53Å; I62-I73 HydrophobicContact CG2-CD1 4.27Å; T65-I73 PolarHBondContact O-N 2.81Å; A66-I73 HydrophobicContact CB-CD1 4.36Å; A66-I73 HydrophobicContact CB-CG1 3.97Å; I73-L75 HydrophobicContact CD1-CD1 4.17Å; I73-L75 HydrophobicContact CD1-CD2 4.19Å; I73-L75 HydrophobicContact CD1-CG 4.08Å; I73-V121 CarbonylContact C-O 3.36Å; I73-V121 VanDerWaalsContact CA-O 3.25Å; I73-V121 WeakPolarHBondContact CA-O 3.37Å
74	E	95.4	Very high	94.3	Very high	105 Å²	105	63.7 Å²	63.7	49%	0.491	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	135.7	164.6	-156.2	158.5	109.1	0	0	108.8	C120 V121 K123	E74-C120 CarbonylContact O-C 3.45Å; E74-C120 VanDerWaalsContact O-CA 3.29Å; E74-C120 WeakPolarHBondContact O-CA 3.45Å; E74-V121 HydrophobicContact CB-CB 4.2Å; E74-V121 PolarHBondContact N-O 2.79Å; E74-V121 PolarHBondContact O-N 2.86Å; E74-K123 WeakPolarHBondContact OE2-CE 3.44Å; E74-K123 IonicContact OE2-NZ 2.64Å; E74-K123 PolarHBondContact OE2-NZ 3.34Å
75	L	97.2	Very high	94.6	Very high	16 Å²	16	62.7 Å²	62.7	8%	0.084	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	131.4	179.4	-64.6	176.2	0	0	0	109.8	I62 A66 I73 L87 P89 Q92 V118 Q119 C120	I62-L75 HydrophobicContact CD1-CD2 3.75Å; A66-L75 HydrophobicContact CB-CD1 4.16Å; A66-L75 HydrophobicContact CB-CG 4.23Å; I73-L75 HydrophobicContact CD1-CD1 4.17Å; I73-L75 HydrophobicContact CD1-CD2 4.19Å; I73-L75 HydrophobicContact CD1-CG 4.08Å; L75-L87 HydrophobicContact CB-CD2 4.07Å; L75-P89 HydrophobicContact CB-CB 4.02Å; L75-Q92 HydrophobicContact CD1-CB 4.41Å; L75-Q92 HydrophobicContact CD1-CG 3.78Å; L75-V118 HydrophobicContact CD2-CG1 4.14Å; L75-Q119 WeakPolarHBondContact CA-O 3.49Å; L75-C120 HydrophobicContact CD2-CB 3.63Å; L75-C120 VanDerWaalsContact CD2-SG 3.57Å
76	S	96.8	Very high	94.7	Very high	43 Å²	43	63.2 Å²	63.2	30%	0.301	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	159.6	174.8	64.7	0	0	0	0	111.4	V118 Q119	S76-V118 CarbonylContact O-C 3.53Å; S76-Q119 PolarHBondContact N-O 2.79Å; S76-Q119 PolarHBondContact O-N 2.99Å
77	L	97.7	Very high	95	Very high	35 Å²	35	63.8 Å²	63.8	18%	0.183	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	139.5	175.2	-69.9	169.4	0	0	0	111.1	N80 V85 L87 L94 V116 V118	L77-N80 HydrophobicContact CB-CB 4.24Å; L77-V85 HydrophobicContact CD1-CB 4.13Å; L77-V85 HydrophobicContact CD1-CG1 3.89Å; L77-V85 WeakPolarHBondContact CD1-O 3.42Å; L77-V85 HydrophobicContact CD2-CG1 4.25Å; L77-L87 HydrophobicContact CD1-CB 3.85Å; L77-L87 HydrophobicContact CG-CB 3.97Å; L77-L87 HydrophobicContact CG-CD2 4.26Å; L77-L94 HydrophobicContact CD2-CD2 4.1Å; L77-V116 HydrophobicContact CD2-CB 4.48Å; L77-V116 HydrophobicContact CD2-CG2 4.06Å; L77-V118 HydrophobicContact CD2-CG2 3.92Å
78	K	97.2	Very high	95.3	Very high	92 Å²	92	64.3 Å²	64.3	40%	0.4	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	158.6	166.4	-61.7	-61.5	176	-168.3	0	109.5	N80 Q117 Q119 Y130	K78-N80 PolarHBondContact O-N 3.28Å; K78-Q117 HydrophobicContact CB-CB 4.12Å; K78-Q117 PolarHBondContact N-O 2.86Å; K78-Q117 PolarHBondContact O-N 3.24Å; K78-Q119 HydrophobicContact CG-CB 4.09Å; K78-Y130 HydrophobicContact CG-CE1 4.24Å
79	D	96.2	Very high	95.7	Very high	110 Å²	110	63.6 Å²	63.6	59%	0.588	34%	0.337	S	S	*	.	S	Bend	trans	56.7	22.4	179.3	-43.9	-31.2	0	0	0	113.9	V81 Q117	D79-V81 PolarHBondContact O-N 2.93Å; D79-Q117 VanDerWaalsContact OD2-CG 3.25Å; D79-Q117 WeakPolarHBondContact OD2-CG 3.38Å
80	N	96.2	Very high	95.9	Very high	26 Å²	26	62.5 Å²	62.5	14%	0.139	33%	0.329	C	S	.	.			trans	-79.4	68.8	178.4	-173.4	25	0	0	0	110.8	L77 K78 D82 Y83 W84 V85 V116	L77-N80 HydrophobicContact CB-CB 4.24Å; K78-N80 PolarHBondContact O-N 3.28Å; N80-D82 PolarHBondContact O-N 3.01Å; N80-Y83 PolarHBondContact O-N 3.48Å; N80-Y83 VanDerWaalsContact O-N 3.13Å; N80-W84 PolarHBondContact OD1-N 2.94Å; N80-V85 PolarHBondContact ND2-O 3.02Å; N80-V85 PolarHBondContact OD1-N 3.25Å; N80-V116 HydrophobicContact CB-CG1 4.07Å
81	V	94.7	Very high	96.1	Very high	101 Å²	101	61.8 Å²	61.8	61%	0.612	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-53	136.2	176.7	-176.5	0	0	0	0	109.7	D79 Y83 W84	D79-V81 PolarHBondContact O-N 2.93Å; V81-Y83 PolarHBondContact O-N 2.85Å; V81-W84 VanDerWaalsContact O-CD1 3.28Å; V81-W84 PolarHBondContact O-N 3.24Å
82	D	94.7	Very high	96.3	Very high	102 Å²	102	60.7 Å²	60.7	55%	0.545	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	49	18	-175.4	-51.7	-38.8	0	0	0	116.1	N80 W84 R101	N80-D82 PolarHBondContact O-N 3.01Å; D82-W84 VanDerWaalsContact C-N 3.27Å; D82-W84 PolarHBondContact O-N 3.1Å; D82-R101 VanDerWaalsContact O-CZ 3.25Å; D82-R101 PolarHBondContact O-NH1 2.81Å; D82-R101 PolarHBondContact O-NH2 2.87Å
83	Y	96.7	Very high	96.5	Very high	173 Å²	173	61.3 Å²	61.3	68%	0.678	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	54.5	37.5	-179	-51	-81	0	0	0	114.1	N80 V81 V85 N97 R101	N80-Y83 PolarHBondContact O-N 3.48Å; N80-Y83 VanDerWaalsContact O-N 3.13Å; V81-Y83 PolarHBondContact O-N 2.85Å; Y83-V85 PolarHBondContact O-N 2.88Å; Y83-N97 WeakPolarHBondContact O-CB 3.25Å; Y83-N97 PolarHBondContact O-ND2 2.96Å; Y83-R101 PolarHBondContact O-NH2 3.09Å
84	W	97.2	Very high	96.6	Very high	13 Å²	13	61.3 Å²	61.3	5%	0.049	31%	0.313	C	S	.	.			trans	-61.4	-27.2	177	-75.7	111.6	0	0	0	113.8	N80 V81 D82 L96 N97 R101 V102 L103 M109 I111 I114	N80-W84 PolarHBondContact OD1-N 2.94Å; V81-W84 VanDerWaalsContact O-CD1 3.28Å; V81-W84 PolarHBondContact O-N 3.24Å; D82-W84 VanDerWaalsContact C-N 3.27Å; D82-W84 PolarHBondContact O-N 3.1Å; W84-L96 HydrophobicContact CE3-CD1 4.03Å; W84-N97 PolarHBondContact O-N 2.94Å; W84-R101 HydrophobicContact CH2-CG 3.73Å; W84-R101 HydrophobicContact CZ3-CG 3.94Å; W84-R101 VanDerWaalsContact CZ3-NE 3.3Å; W84-V102 VanDerWaalsContact CH2-O 3.28Å; W84-V102 WeakPolarHBondContact CH2-O 3.42Å; W84-L103 HydrophobicContact CE3-CD1 4.33Å; W84-L103 HydrophobicContact CH2-CB 4.49Å; W84-L103 HydrophobicContact CH2-CD1 4.41Å; W84-L103 HydrophobicContact CZ3-CB 4.08Å; W84-L103 HydrophobicContact CZ3-CD1 4.25Å; W84-M109 HydrophobicContact CH2-CE 4.44Å; W84-M109 HydrophobicContact CZ2-CE 4.28Å; W84-I111 HydrophobicContact CH2-CD1 4.44Å; W84-I111 HydrophobicContact CZ2-CD1 3.65Å; W84-I114 HydrophobicContact CB-CD1 3.83Å; W84-I114 HydrophobicContact CB-CG1 4.41Å; W84-I114 HydrophobicContact CB-CG2 4.23Å; W84-I114 HydrophobicContact CD2-CD1 4.39Å; W84-I114 HydrophobicContact CG-CD1 3.98Å; W84-I114 HydrophobicContact CG-CG1 4.42Å
85	V	97.9	Very high	96.7	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	137	-178.5	-175.1	0	0	0	0	111.5	L56 L77 N80 Y83 L94 F95 I114 V116 I135	L56-V85 HydrophobicContact CD1-CB 4.39Å; L56-V85 HydrophobicContact CD1-CG1 4.08Å; L56-V85 HydrophobicContact CD1-CG2 3.86Å; L77-V85 HydrophobicContact CD1-CB 4.13Å; L77-V85 HydrophobicContact CD1-CG1 3.89Å; L77-V85 WeakPolarHBondContact CD1-O 3.42Å; L77-V85 HydrophobicContact CD2-CG1 4.25Å; N80-V85 PolarHBondContact ND2-O 3.02Å; N80-V85 PolarHBondContact OD1-N 3.25Å; Y83-V85 PolarHBondContact O-N 2.88Å; V85-L94 HydrophobicContact CG1-CB 4.04Å; V85-L94 HydrophobicContact CG1-CD1 4.27Å; V85-L94 HydrophobicContact CG1-CD2 3.9Å; V85-L94 HydrophobicContact CG1-CG 4.29Å; V85-F95 WeakPolarHBondContact CA-O 3.32Å; V85-I114 HydrophobicContact CG2-CG2 4.12Å; V85-V116 HydrophobicContact CB-CG1 4.26Å; V85-V116 HydrophobicContact CB-CG2 4.42Å; V85-V116 HydrophobicContact CG1-CG2 4.38Å; V85-V116 HydrophobicContact CG2-CG1 3.73Å; V85-V116 HydrophobicContact CG2-CG2 4.07Å; V85-I135 HydrophobicContact CG2-CD1 4.16Å
86	L	97.4	Very high	96.8	Very high	89 Å²	89	57.9 Å²	57.9	47%	0.466	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	148.9	167.2	-63.2	172.5	0	0	0	110.2	L94 F95 N97	L86-L94 CarbonylContact O-C 3.56Å; L86-L94 VanDerWaalsContact O-CA 3.28Å; L86-L94 WeakPolarHBondContact O-CA 3.27Å; L86-F95 HydrophobicContact CB-CB 4.46Å; L86-F95 PolarHBondContact N-O 3.5Å; L86-F95 PolarHBondContact O-N 3.08Å; L86-N97 HydrophobicContact CD1-CB 3.95Å; L86-N97 HydrophobicContact CG-CB 3.94Å
87	L	97.7	Very high	96.8	Very high	38 Å²	38	57.4 Å²	57.4	20%	0.199	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	124.6	-177.4	166.7	64.5	0	0	0	110.6	L75 L77 P89 M93 L94	L75-L87 HydrophobicContact CB-CD2 4.07Å; L77-L87 HydrophobicContact CD1-CB 3.85Å; L77-L87 HydrophobicContact CG-CB 3.97Å; L77-L87 HydrophobicContact CG-CD2 4.26Å; L87-P89 HydrophobicContact CG-CB 4.4Å; L87-P89 VanDerWaalsContact O-CD 3.31Å; L87-P89 WeakPolarHBondContact O-CD 3.19Å; L87-M93 WeakPolarHBondContact CA-O 3.24Å; L87-L94 HydrophobicContact CB-CD2 3.79Å; L87-L94 HydrophobicContact CD1-CD2 3.67Å; L87-L94 HydrophobicContact CG-CD2 4.27Å
88	D	97.1	Very high	96.7	Very high	34 Å²	34	56.3 Å²	56.3	18%	0.182	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	102.8	157.5	177.7	-25.2	0	0	0	107.4	V90 K91 Q92 M93 F95	D88-V90 PolarHBondContact O-N 2.83Å; D88-V90 WeakPolarHBondContact OD1-CA 3.46Å; D88-V90 WeakPolarHBondContact OD1-CB 3.48Å; D88-V90 PolarHBondContact OD1-N 2.97Å; D88-K91 HydrophobicContact CB-CB 4.49Å; D88-K91 PolarHBondContact OD1-N 3.13Å; D88-K91 WeakPolarHBondContact OD2-CD 3.41Å; D88-K91 WeakPolarHBondContact OD2-CE 3.35Å; D88-K91 WeakPolarHBondContact OD2-CG 3.47Å; D88-K91 IonicContact OD2-NZ 3.12Å; D88-K91 PolarHBondContact OD2-NZ 3.19Å; D88-Q92 CarbonylContact O-C 3.5Å; D88-Q92 WeakPolarHBondContact O-CA 3.16Å; D88-Q92 PolarHBondContact O-N 2.81Å; D88-M93 HydrophobicContact CB-CB 4.31Å; D88-M93 PolarHBondContact N-O 3.42Å; D88-M93 PolarHBondContact O-N 2.86Å; D88-M93 VanDerWaalsContact O-N 3.12Å; D88-F95 HydrophobicContact CB-CE2 3.93Å
89	P	96.1	Very high	96.6	Very high	48 Å²	48	56.5 Å²	56.5	31%	0.312	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-21.8	-175.9	29.9	-36.1	0	0	0	112.5	A66 L75 L87	A66-P89 HydrophobicContact CB-CB 4.25Å; A66-P89 WeakPolarHBondContact CB-O 3.3Å; L75-P89 HydrophobicContact CB-CB 4.02Å; L87-P89 HydrophobicContact CG-CB 4.4Å; L87-P89 VanDerWaalsContact O-CD 3.31Å; L87-P89 WeakPolarHBondContact O-CD 3.19Å
90	V	95.3	Very high	96.5	Very high	101 Å²	101	55.5 Å²	55.5	61%	0.612	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-40.8	-177.3	-174.8	0	0	0	0	110.6	D88	D88-V90 PolarHBondContact O-N 2.83Å; D88-V90 WeakPolarHBondContact OD1-CA 3.46Å; D88-V90 WeakPolarHBondContact OD1-CB 3.48Å; D88-V90 PolarHBondContact OD1-N 2.97Å
91	K	95.7	Very high	96.4	Very high	117 Å²	117	58 Å²	58	51%	0.509	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-15.3	172.8	-57.6	-174.8	-161.8	110.9	0	113.5	D88 M93	D88-K91 HydrophobicContact CB-CB 4.49Å; D88-K91 PolarHBondContact OD1-N 3.13Å; D88-K91 WeakPolarHBondContact OD2-CD 3.41Å; D88-K91 WeakPolarHBondContact OD2-CE 3.35Å; D88-K91 WeakPolarHBondContact OD2-CG 3.47Å; D88-K91 IonicContact OD2-NZ 3.12Å; D88-K91 PolarHBondContact OD2-NZ 3.19Å; K91-M93 HydrophobicContact CB-CB 4.25Å; K91-M93 HydrophobicContact CB-CG 3.74Å; K91-M93 HydrophobicContact CB-SD 3.99Å; K91-M93 HydrophobicContact CD-CG 4.4Å; K91-M93 HydrophobicContact CD-SD 3.52Å; K91-M93 VanDerWaalsContact CD-SD 3.52Å; K91-M93 HydrophobicContact CG-SD 4.43Å; K91-M93 PolarHBondContact O-N 2.93Å
92	Q	96.1	Very high	96.5	Very high	17 Å²	17	56 Å²	56	8%	0.079	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	34.4	-167.7	-43.3	-173.9	4.8	0	0	113	M60 I62 L75 D88	M60-Q92 HydrophobicContact CB-CB 4.15Å; M60-Q92 PolarHBondContact N-O 3.15Å; I62-Q92 PolarHBondContact O-NE2 3.03Å; I62-Q92 PolarHBondContact O-OE1 3.25Å; L75-Q92 HydrophobicContact CD1-CB 4.41Å; L75-Q92 HydrophobicContact CD1-CG 3.78Å; D88-Q92 CarbonylContact O-C 3.5Å; D88-Q92 WeakPolarHBondContact O-CA 3.16Å; D88-Q92 PolarHBondContact O-N 2.81Å
93	M	97.5	Very high	96.6	Very high	28 Å²	28	51.2 Å²	51.2	14%	0.138	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	143.6	179.2	-75.3	179.1	84.5	0	0	111.5	I55 V57 D58 L87 D88 K91 F95	I55-M93 HydrophobicContact CD1-CE 3.67Å; I55-M93 HydrophobicContact CG1-CE 3.94Å; I55-M93 HydrophobicContact CG2-CE 3.85Å; V57-M93 VanDerWaalsContact O-CA 3.29Å; V57-M93 WeakPolarHBondContact O-CA 3.49Å; D58-M93 WeakPolarHBondContact O-CG 3.38Å; L87-M93 WeakPolarHBondContact CA-O 3.24Å; D88-M93 HydrophobicContact CB-CB 4.31Å; D88-M93 PolarHBondContact N-O 3.42Å; D88-M93 PolarHBondContact O-N 2.86Å; D88-M93 VanDerWaalsContact O-N 3.12Å; K91-M93 HydrophobicContact CB-CB 4.25Å; K91-M93 HydrophobicContact CB-CG 3.74Å; K91-M93 HydrophobicContact CB-SD 3.99Å; K91-M93 HydrophobicContact CD-CG 4.4Å; K91-M93 HydrophobicContact CD-SD 3.52Å; K91-M93 VanDerWaalsContact CD-SD 3.52Å; K91-M93 HydrophobicContact CG-SD 4.43Å; K91-M93 PolarHBondContact O-N 2.93Å; M93-F95 HydrophobicContact CB-CD2 4.41Å; M93-F95 HydrophobicContact CB-CE2 3.54Å; M93-F95 HydrophobicContact CB-CZ 3.68Å; M93-F95 HydrophobicContact CE-CE1 3.82Å; M93-F95 HydrophobicContact CE-CZ 3.69Å; M93-F95 HydrophobicContact CG-CZ 4.35Å; M93-F95 HydrophobicContact SD-CZ 3.82Å
94	L	97.9	Very high	96.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.4	171.1	-60.8	-178.7	0	0	0	110.8	L56 V57 M60 L77 V85 L86 L87 V118 V133	L56-L94 HydrophobicContact CB-CB 4.05Å; L56-L94 PolarHBondContact N-O 2.96Å; V57-L94 HydrophobicContact CB-CB 4.04Å; V57-L94 HydrophobicContact CB-CD1 4.28Å; V57-L94 HydrophobicContact CB-CG 4.23Å; V57-L94 HydrophobicContact CG2-CB 4.28Å; V57-L94 HydrophobicContact CG2-CD1 3.95Å; V57-L94 HydrophobicContact CG2-CG 4.41Å; V57-L94 PolarHBondContact N-O 3.24Å; V57-L94 PolarHBondContact O-N 2.98Å; M60-L94 HydrophobicContact SD-CD1 4.17Å; L77-L94 HydrophobicContact CD2-CD2 4.1Å; V85-L94 HydrophobicContact CG1-CB 4.04Å; V85-L94 HydrophobicContact CG1-CD1 4.27Å; V85-L94 HydrophobicContact CG1-CD2 3.9Å; V85-L94 HydrophobicContact CG1-CG 4.29Å; L86-L94 CarbonylContact O-C 3.56Å; L86-L94 VanDerWaalsContact O-CA 3.28Å; L86-L94 WeakPolarHBondContact O-CA 3.27Å; L87-L94 HydrophobicContact CB-CD2 3.79Å; L87-L94 HydrophobicContact CD1-CD2 3.67Å; L87-L94 HydrophobicContact CG-CD2 4.27Å; L94-V118 HydrophobicContact CD1-CG2 4.16Å; L94-V118 HydrophobicContact CD2-CG2 4.42Å; L94-V133 HydrophobicContact CD1-CB 4.31Å; L94-V133 HydrophobicContact CD1-CG1 3.99Å; L94-V133 HydrophobicContact CD1-CG2 3.86Å
95	F	97.8	Very high	96.7	Very high	48 Å²	48	44.7 Å²	44.7	21%	0.211	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	149.5	-177.9	-54	-94	0	0	0	111.2	T54 I55 V85 L86 D88 M93	T54-F95 CarbonylContact O-C 3.58Å; T54-F95 WeakPolarHBondContact O-CA 3.37Å; I55-F95 HydrophobicContact CG1-CD1 3.97Å; I55-F95 HydrophobicContact CG1-CE1 3.85Å; V85-F95 WeakPolarHBondContact CA-O 3.32Å; L86-F95 HydrophobicContact CB-CB 4.46Å; L86-F95 PolarHBondContact N-O 3.5Å; L86-F95 PolarHBondContact O-N 3.08Å; D88-F95 HydrophobicContact CB-CE2 3.93Å; M93-F95 HydrophobicContact CB-CD2 4.41Å; M93-F95 HydrophobicContact CB-CE2 3.54Å; M93-F95 HydrophobicContact CB-CZ 3.68Å; M93-F95 HydrophobicContact CE-CE1 3.82Å; M93-F95 HydrophobicContact CE-CZ 3.69Å; M93-F95 HydrophobicContact CG-CZ 4.35Å; M93-F95 HydrophobicContact SD-CZ 3.82Å
96	L	98	Very high	96.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	136.3	174.4	-178	62.7	0	0	0	111.6	I46 S50 G53 T54 L56 W84 L103	I46-L96 HydrophobicContact CD1-CD2 4.09Å; S50-L96 VanDerWaalsContact CB-CD2 3.42Å; S50-L96 WeakPolarHBondContact O-CD2 3.15Å; G53-L96 PolarHBondContact N-O 3.13Å; T54-L96 PolarHBondContact O-N 2.9Å; L56-L96 HydrophobicContact CD1-CB 4.37Å; L56-L96 HydrophobicContact CD2-CB 4.1Å; L56-L96 HydrophobicContact CG-CB 4.26Å; W84-L96 HydrophobicContact CE3-CD1 4.03Å; L96-L103 HydrophobicContact CD1-CD2 3.94Å; L96-L103 HydrophobicContact CD2-CB 4.49Å; L96-L103 HydrophobicContact CD2-CD2 3.94Å
97	N	97.3	Very high	96.6	Very high	33 Å²	33	43.8 Å²	43.8	18%	0.176	26%	0.255	C	S	.	.			trans	-113.2	82.1	174.5	175.7	34.3	0	0	0	111.4	N52 Y83 W84 L86 R101	N52-N97 WeakPolarHBondContact OD1-CA 3.29Å; Y83-N97 WeakPolarHBondContact O-CB 3.25Å; Y83-N97 PolarHBondContact O-ND2 2.96Å; W84-N97 PolarHBondContact O-N 2.94Å; L86-N97 HydrophobicContact CD1-CB 3.95Å; L86-N97 HydrophobicContact CG-CB 3.94Å; N97-R101 PolarHBondContact O-NE 3.09Å; N97-R101 VanDerWaalsContact O-NE 3.14Å; N97-R101 PolarHBondContact O-NH2 3.34Å
98	S	96	Very high	96.6	Very high	13 Å²	13	47.3 Å²	47.3	9%	0.091	28%	0.28	C	S	.	.			trans	-103.2	35.8	171.6	40.7	0	0	0	0	111.2	S50 N52 G100 R101	S50-S98 PolarHBondContact O-OG 3.16Å; N52-S98 WeakPolarHBondContact CA-OG 3.38Å; N52-S98 PolarHBondContact N-OG 3.38Å; N52-S98 VanDerWaalsContact N-OG 3.07Å; N52-S98 PolarHBondContact OD1-N 3.17Å; S98-G100 PolarHBondContact O-N 2.92Å; S98-G100 VanDerWaalsContact O-N 3.14Å; S98-R101 CarbonylContact C-O 3.52Å; S98-R101 WeakPolarHBondContact CB-O 3.42Å
99	T	94.4	Very high	96.5	Very high	95 Å²	95	49.5 Å²	49.5	58%	0.583	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	109.2	176.8	-60.9	0	0	0	0	109.9	N52	N52-T99 PolarHBondContact ND2-OG1 3.24Å; N52-T99 VanDerWaalsContact ND2-OG1 3.15Å; N52-T99 PolarHBondContact OD1-N 2.81Å; N52-T99 PolarHBondContact OD1-OG1 3.2Å
100	G	94.4	Very high	96.5	Very high	89 Å²	89	51.3 Å²	51.3	92%	0.918	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	18.3	177.1	0	0	0	0	0	115.1	S98	S98-G100 PolarHBondContact O-N 2.92Å; S98-G100 VanDerWaalsContact O-N 3.14Å
101	R	95.3	Very high	96.6	Very high	80 Å²	80	48 Å²	48	30%	0.302	28%	0.276	S	S	.	.	S	Bend	trans	-155.6	153.2	177.3	61.3	-177.6	179.1	-173.9	-2.9	110.2	D82 Y83 W84 N97 S98	D82-R101 VanDerWaalsContact O-CZ 3.25Å; D82-R101 PolarHBondContact O-NH1 2.81Å; D82-R101 PolarHBondContact O-NH2 2.87Å; Y83-R101 PolarHBondContact O-NH2 3.09Å; W84-R101 HydrophobicContact CH2-CG 3.73Å; W84-R101 HydrophobicContact CZ3-CG 3.94Å; W84-R101 VanDerWaalsContact CZ3-NE 3.3Å; N97-R101 PolarHBondContact O-NE 3.09Å; N97-R101 VanDerWaalsContact O-NE 3.14Å; N97-R101 PolarHBondContact O-NH2 3.34Å; S98-R101 CarbonylContact C-O 3.52Å; S98-R101 WeakPolarHBondContact CB-O 3.42Å
102	V	96	Very high	96.6	Very high	59 Å²	59	47.2 Å²	47.2	36%	0.358	27%	0.274	S	S	.	.			trans	-88.8	143.2	175	-177.4	0	0	0	0	109.5	E49 W84 D104 M109	E49-V102 HydrophobicContact CB-CG1 4.45Å; E49-V102 HydrophobicContact CG-CG1 3.79Å; E49-V102 WeakPolarHBondContact OE1-CG1 3.49Å; W84-V102 VanDerWaalsContact CH2-O 3.28Å; W84-V102 WeakPolarHBondContact CH2-O 3.42Å; V102-D104 VanDerWaalsContact C-N 3.28Å; V102-D104 HydrophobicContact CB-CB 4.28Å; V102-D104 HydrophobicContact CG1-CB 3.92Å; V102-D104 PolarHBondContact O-N 2.82Å; V102-M109 WeakPolarHBondContact O-CE 3.41Å
103	L	96.9	Very high	96.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.292	C	S	.	.			trans	-85	83.2	161.4	176.6	61.5	0	0	0	106.8	I46 E48 E49 W84 L96 I111 I114 V137	I46-L103 HydrophobicContact CD1-CD2 3.52Å; I46-L103 HydrophobicContact CG1-CD2 4.48Å; E48-L103 WeakPolarHBondContact CB-O 3.44Å; E49-L103 PolarHBondContact N-O 3.44Å; W84-L103 HydrophobicContact CE3-CD1 4.33Å; W84-L103 HydrophobicContact CH2-CB 4.49Å; W84-L103 HydrophobicContact CH2-CD1 4.41Å; W84-L103 HydrophobicContact CZ3-CB 4.08Å; W84-L103 HydrophobicContact CZ3-CD1 4.25Å; L96-L103 HydrophobicContact CD1-CD2 3.94Å; L96-L103 HydrophobicContact CD2-CB 4.49Å; L96-L103 HydrophobicContact CD2-CD2 3.94Å; L103-I111 HydrophobicContact CD1-CB 4.15Å; L103-I111 HydrophobicContact CD1-CD1 4.24Å; L103-I111 HydrophobicContact CD1-CG2 3.81Å; L103-I114 HydrophobicContact CD1-CD1 3.77Å; L103-I114 HydrophobicContact CD2-CD1 4.22Å; L103-V137 HydrophobicContact CD1-CG2 4.27Å; L103-V137 HydrophobicContact CD2-CG2 4.05Å; L103-V137 HydrophobicContact CG-CG1 4.48Å; L103-V137 HydrophobicContact CG-CG2 4.31Å
104	D	97.5	Very high	96.7	Very high	33 Å²	33	48.8 Å²	48.8	18%	0.176	29%	0.288	C	S	.	.			trans	-93.9	125.3	-175.6	163.6	13.9	0	0	0	108.8	V102 D106 M109 I111	V102-D104 VanDerWaalsContact C-N 3.28Å; V102-D104 HydrophobicContact CB-CB 4.28Å; V102-D104 HydrophobicContact CG1-CB 3.92Å; V102-D104 PolarHBondContact O-N 2.82Å; D104-D106 PolarHBondContact OD1-N 2.86Å; D104-M109 HydrophobicContact CB-CB 3.87Å; D104-M109 HydrophobicContact CB-CE 4.17Å; D104-M109 HydrophobicContact CB-CG 4.12Å; D104-M109 HydrophobicContact CB-SD 3.81Å; D104-M109 VanDerWaalsContact OD2-CB 3.31Å; D104-M109 WeakPolarHBondContact OD2-CB 3.17Å; D104-M109 VanDerWaalsContact OD2-CG 3.22Å; D104-M109 WeakPolarHBondContact OD2-CG 3.42Å; D104-I111 VanDerWaalsContact O-CB 3.32Å; D104-I111 WeakPolarHBondContact O-CB 3.39Å; D104-I111 WeakPolarHBondContact O-CG1 3.37Å; D104-I111 PolarHBondContact O-N 3.05Å
105	R	97.9	Very high	96.7	Very high	17 Å²	17	51.3 Å²	51.3	6%	0.064	30%	0.304	C	S	.	.			trans	-89.5	-20.4	-178	-165.6	-168.9	156.3	-77	-2.3	112.1	E48 N110 I111 H112 V137 D139 D181	E48-R105 HydrophobicContact CB-CB 4.14Å; E48-R105 HydrophobicContact CG-CB 4.47Å; E48-R105 VanDerWaalsContact OE1-CB 3.28Å; E48-R105 WeakPolarHBondContact OE1-CB 3.49Å; E48-R105 VanDerWaalsContact OE1-CD 3.29Å; E48-R105 WeakPolarHBondContact OE1-CD 3.43Å; E48-R105 WeakPolarHBondContact OE2-CA 3.49Å; E48-R105 WeakPolarHBondContact OE2-CB 3.3Å; E48-R105 PolarHBondContact OE2-N 3.42Å; R105-N110 CarbonylContact O-C 3.6Å; R105-N110 WeakPolarHBondContact O-CA 3.41Å; R105-I111 PolarHBondContact O-N 2.87Å; R105-H112 PolarHBondContact O-CD2 3.02Å; R105-H112 VanDerWaalsContact O-CD2 3.32Å; R105-V137 HydrophobicContact CB-CG1 3.94Å; R105-V137 HydrophobicContact CG-CB 4.32Å; R105-V137 HydrophobicContact CG-CG1 3.96Å; R105-D139 IonicContact CZ-OD1 2.7Å; R105-D139 VanDerWaalsContact CZ-OD1 3.24Å; R105-D139 IonicContact NE-OD1 2.78Å; R105-D139 IonicContact NH1-OD1 3.32Å; R105-D139 PolarHBondContact NH1-OD1 2.68Å; R105-D139 IonicContact NH2-OD1 2.83Å; R105-D181 IonicContact CZ-OD2 3.23Å; R105-D181 VanDerWaalsContact NH1-CB 3.34Å; R105-D181 VanDerWaalsContact NH2-CB 3.27Å; R105-D181 IonicContact NH2-OD2 3.75Å; R105-D181 PolarHBondContact NH2-OD2 2.71Å
106	D	97.4	Very high	96.7	Very high	3 Å²	3	49 Å²	49	2%	0.016	29%	0.294	C	S	.	.	S	Bend	trans	-101.6	176	-162.4	-63.3	-27.8	0	0	0	111.5	D104 P108 M109 N110 N143	D104-D106 PolarHBondContact OD1-N 2.86Å; D106-P108 CarbonylContact O-C 3.56Å; D106-M109 PolarHBondContact O-N 3.08Å; D106-N110 PolarHBondContact O-N 2.77Å; D106-N143 PolarHBondContact OD2-ND2 3.36Å
107	P	97	Very high	96.6	Very high	66 Å²	66	50.5 Å²	50.5	43%	0.429	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	122.5	175.1	-23.3	35.3	0	0	0	111.3	I179	P107-I179 WeakPolarHBondContact CD-O 3.39Å
108	P	96.1	Very high	96.6	Very high	113 Å²	113	49 Å²	49	73%	0.734	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	cis	-101.6	-9.6	22.5	37.5	-36	0	0	0	116.3	D106 N110	D106-P108 CarbonylContact O-C 3.56Å; P108-N110 PolarHBondContact O-ND2 2.85Å
109	M	95.7	Very high	96.7	Very high	80 Å²	80	49.8 Å²	49.8	39%	0.394	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-29.7	-171.8	-67.4	-167.4	38.7	0	0	114.9	W84 V102 D104 D106 I111	W84-M109 HydrophobicContact CH2-CE 4.44Å; W84-M109 HydrophobicContact CZ2-CE 4.28Å; V102-M109 WeakPolarHBondContact O-CE 3.41Å; D104-M109 HydrophobicContact CB-CB 3.87Å; D104-M109 HydrophobicContact CB-CE 4.17Å; D104-M109 HydrophobicContact CB-CG 4.12Å; D104-M109 HydrophobicContact CB-SD 3.81Å; D104-M109 VanDerWaalsContact OD2-CB 3.31Å; D104-M109 WeakPolarHBondContact OD2-CB 3.17Å; D104-M109 VanDerWaalsContact OD2-CG 3.22Å; D104-M109 WeakPolarHBondContact OD2-CG 3.42Å; D106-M109 PolarHBondContact O-N 3.08Å; M109-I111 VanDerWaalsContact C-N 3.28Å; M109-I111 HydrophobicContact CB-CD1 4.48Å; M109-I111 HydrophobicContact CB-CG1 4.2Å; M109-I111 HydrophobicContact CE-CD1 3.51Å; M109-I111 HydrophobicContact CE-CG1 4.36Å; M109-I111 WeakPolarHBondContact O-CG1 3.37Å; M109-I111 PolarHBondContact O-N 2.68Å
110	N	96.5	Very high	96.8	Very high	86 Å²	86	45.2 Å²	45.2	46%	0.46	27%	0.267	S	S	.	.			trans	56.3	28.8	170.1	-65.4	-98.5	0	0	0	115.1	R105 D106 P108 H112	R105-N110 CarbonylContact O-C 3.6Å; R105-N110 WeakPolarHBondContact O-CA 3.41Å; D106-N110 PolarHBondContact O-N 2.77Å; P108-N110 PolarHBondContact O-ND2 2.85Å; N110-H112 VanDerWaalsContact C-N 3.3Å; N110-H112 PolarHBondContact O-CD2 2.69Å; N110-H112 PolarHBondContact O-N 2.63Å
111	I	96.8	Very high	96.9	Very high	30 Å²	30	42.9 Å²	42.9	15%	0.154	24%	0.235	C	C	.	.			trans	-83.1	67.9	-172.2	-47.4	-176.4	0	0	0	111.8	W84 L103 D104 R105 M109 S113 I114 V137	W84-I111 HydrophobicContact CH2-CD1 4.44Å; W84-I111 HydrophobicContact CZ2-CD1 3.65Å; L103-I111 HydrophobicContact CD1-CB 4.15Å; L103-I111 HydrophobicContact CD1-CD1 4.24Å; L103-I111 HydrophobicContact CD1-CG2 3.81Å; D104-I111 VanDerWaalsContact O-CB 3.32Å; D104-I111 WeakPolarHBondContact O-CB 3.39Å; D104-I111 WeakPolarHBondContact O-CG1 3.37Å; D104-I111 PolarHBondContact O-N 3.05Å; R105-I111 PolarHBondContact O-N 2.87Å; M109-I111 VanDerWaalsContact C-N 3.28Å; M109-I111 HydrophobicContact CB-CD1 4.48Å; M109-I111 HydrophobicContact CB-CG1 4.2Å; M109-I111 HydrophobicContact CE-CD1 3.51Å; M109-I111 HydrophobicContact CE-CG1 4.36Å; M109-I111 WeakPolarHBondContact O-CG1 3.37Å; M109-I111 PolarHBondContact O-N 2.68Å; I111-S113 VanDerWaalsContact C-N 3.26Å; I111-S113 PolarHBondContact O-N 2.74Å; I111-I114 HydrophobicContact CG2-CG1 4.02Å; I111-V137 VanDerWaalsContact O-CB 3.26Å; I111-V137 WeakPolarHBondContact O-CB 3.37Å; I111-V137 WeakPolarHBondContact O-CG2 3.29Å
112	H	97	Very high	96.9	Very high	101 Å²	101	39.1 Å²	39.1	47%	0.468	22%	0.22	S	C	.	.			trans	-64.2	-26.4	-178.9	-58.3	-178.2	0	0	0	113.7	R105 N110 V137	R105-H112 PolarHBondContact O-CD2 3.02Å; R105-H112 VanDerWaalsContact O-CD2 3.32Å; N110-H112 VanDerWaalsContact C-N 3.3Å; N110-H112 PolarHBondContact O-CD2 2.69Å; N110-H112 PolarHBondContact O-N 2.63Å; H112-V137 PolarHBondContact O-N 3.21Å
113	S	97.1	Very high	96.8	Very high	67 Å²	67	41 Å²	41	47%	0.469	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	150.1	174.8	69.1	0	0	0	0	113.3	I111 I135	I111-S113 VanDerWaalsContact C-N 3.26Å; I111-S113 PolarHBondContact O-N 2.74Å; S113-I135 CarbonylContact C-O 3.58Å; S113-I135 VanDerWaalsContact CA-O 3.23Å; S113-I135 WeakPolarHBondContact CA-O 3.31Å; S113-I135 WeakPolarHBondContact CB-O 3.34Å
114	I	97.1	Very high	96.4	Very high	11 Å²	11	45.8 Å²	45.8	6%	0.056	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130	170.2	-60.5	155.7	0	0	0	108.1	W84 V85 L103 I111 V116 I135	W84-I114 HydrophobicContact CB-CD1 3.83Å; W84-I114 HydrophobicContact CB-CG1 4.41Å; W84-I114 HydrophobicContact CB-CG2 4.23Å; W84-I114 HydrophobicContact CD2-CD1 4.39Å; W84-I114 HydrophobicContact CG-CD1 3.98Å; W84-I114 HydrophobicContact CG-CG1 4.42Å; V85-I114 HydrophobicContact CG2-CG2 4.12Å; L103-I114 HydrophobicContact CD1-CD1 3.77Å; L103-I114 HydrophobicContact CD2-CD1 4.22Å; I111-I114 HydrophobicContact CG2-CG1 4.02Å; I114-V116 HydrophobicContact CG2-CG1 4.07Å; I114-I135 HydrophobicContact CB-CB 4.28Å; I114-I135 HydrophobicContact CB-CD1 4.28Å; I114-I135 HydrophobicContact CG2-CD1 4.23Å; I114-I135 PolarHBondContact N-O 2.7Å; I114-I135 WeakPolarHBondContact O-CD1 3.32Å; I114-I135 PolarHBondContact O-N 2.87Å
115	V	97.6	Very high	96.1	Very high	53 Å²	53	47.8 Å²	47.8	32%	0.321	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.8	176.2	-176.2	0	0	0	0	109.4	E132 V133 R134	V115-E132 HydrophobicContact CG1-CG 4.19Å; V115-V133 WeakPolarHBondContact CA-O 3.43Å; V115-R134 HydrophobicContact CG1-CG 4.29Å; V115-R134 HydrophobicContact CG2-CG 4.13Å
116	V	97.7	Very high	95.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	156.1	177.3	-56.7	0	0	0	0	111.1	L77 N80 V85 I114 V133	L77-V116 HydrophobicContact CD2-CB 4.48Å; L77-V116 HydrophobicContact CD2-CG2 4.06Å; N80-V116 HydrophobicContact CB-CG1 4.07Å; V85-V116 HydrophobicContact CB-CG1 4.26Å; V85-V116 HydrophobicContact CB-CG2 4.42Å; V85-V116 HydrophobicContact CG1-CG2 4.38Å; V85-V116 HydrophobicContact CG2-CG1 3.73Å; V85-V116 HydrophobicContact CG2-CG2 4.07Å; I114-V116 HydrophobicContact CG2-CG1 4.07Å; V116-V133 HydrophobicContact CG2-CB 3.93Å; V116-V133 PolarHBondContact N-O 3.16Å; V116-V133 PolarHBondContact O-N 2.97Å
117	Q	97.6	Very high	95.5	Very high	32 Å²	32	52.3 Å²	52.3	15%	0.15	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	116.9	177.9	-62.5	-67.5	-19.6	0	0	109.8	K78 D79 Q119 Y130 E132	K78-Q117 HydrophobicContact CB-CB 4.12Å; K78-Q117 PolarHBondContact N-O 2.86Å; K78-Q117 PolarHBondContact O-N 3.24Å; D79-Q117 VanDerWaalsContact OD2-CG 3.25Å; D79-Q117 WeakPolarHBondContact OD2-CG 3.38Å; Q117-Q119 PolarHBondContact O-N 2.76Å; Q117-Y130 HydrophobicContact CB-CD1 4.31Å; Q117-E132 PolarHBondContact NE2-OE2 2.64Å
118	V	97.4	Very high	95.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	99.1	170.4	179.3	0	0	0	0	108.2	M60 I62 L75 S76 L77 L94 C120 H131 V133	M60-V118 HydrophobicContact CE-CB 4.09Å; M60-V118 HydrophobicContact CE-CG2 3.93Å; M60-V118 HydrophobicContact SD-CG2 4.4Å; I62-V118 HydrophobicContact CD1-CG1 3.99Å; L75-V118 HydrophobicContact CD2-CG1 4.14Å; S76-V118 CarbonylContact O-C 3.53Å; L77-V118 HydrophobicContact CD2-CG2 3.92Å; L94-V118 HydrophobicContact CD1-CG2 4.16Å; L94-V118 HydrophobicContact CD2-CG2 4.42Å; V118-C120 PolarHBondContact O-N 3.47Å; V118-H131 HydrophobicContact CB-CB 4.32Å; V118-H131 PolarHBondContact N-O 2.74Å; V118-H131 PolarHBondContact O-N 3.46Å; V118-V133 HydrophobicContact CG2-CG2 3.89Å
119	Q	97.7	Very high	95.4	Very high	30 Å²	30	49.5 Å²	49.5	14%	0.14	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	118.6	173.8	-177.5	-176.7	-4.7	0	0	109.6	L75 S76 K78 Q117 V121 V128 Y130	L75-Q119 WeakPolarHBondContact CA-O 3.49Å; S76-Q119 PolarHBondContact N-O 2.79Å; S76-Q119 PolarHBondContact O-N 2.99Å; K78-Q119 HydrophobicContact CG-CB 4.09Å; Q117-Q119 PolarHBondContact O-N 2.76Å; Q119-V121 HydrophobicContact CG-CG2 4.3Å; Q119-V128 HydrophobicContact CG-CG1 3.69Å; Q119-Y130 HydrophobicContact CB-CD1 3.76Å; Q119-Y130 HydrophobicContact CB-CE1 3.65Å; Q119-Y130 HydrophobicContact CG-CD1 4Å; Q119-Y130 HydrophobicContact CG-CE1 3.52Å
120	C	97.1	Very high	95.5	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.1	168.6	-168.3	0	0	0	0	110.9	C32 I62 E74 L75 V118 V128 I129	C32-C120 WeakPolarHBondContact CA-SG 3.47Å; C32-C120 HydrophobicContact CB-CB 3.7Å; C32-C120 WeakPolarHBondContact CB-SG 3.46Å; C32-C120 WeakPolarHBondContact SG-CB 3.25Å; C32-C120 CovalentContact SG-SG 2.04Å; C32-C120 PolarHBondContact SG-SG 2.84Å; I62-C120 HydrophobicContact CG2-CB 4.4Å; E74-C120 CarbonylContact O-C 3.45Å; E74-C120 VanDerWaalsContact O-CA 3.29Å; E74-C120 WeakPolarHBondContact O-CA 3.45Å; L75-C120 HydrophobicContact CD2-CB 3.63Å; L75-C120 VanDerWaalsContact CD2-SG 3.57Å; V118-C120 PolarHBondContact O-N 3.47Å; C120-V128 WeakPolarHBondContact O-CA 3.49Å; C120-I129 PolarHBondContact N-O 3.15Å; C120-I129 PolarHBondContact O-N 3.39Å
121	V	96.5	Very high	95.5	Very high	39 Å²	39	48.2 Å²	48.2	24%	0.236	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	119.1	173.2	-173.8	0	0	0	0	109.4	I73 E74 Q119 K123 T127 V128	I73-V121 CarbonylContact C-O 3.36Å; I73-V121 VanDerWaalsContact CA-O 3.25Å; I73-V121 WeakPolarHBondContact CA-O 3.37Å; E74-V121 HydrophobicContact CB-CB 4.2Å; E74-V121 PolarHBondContact N-O 2.79Å; E74-V121 PolarHBondContact O-N 2.86Å; Q119-V121 HydrophobicContact CG-CG2 4.3Å; V121-K123 PolarHBondContact O-N 3.07Å; V121-T127 WeakPolarHBondContact CA-O 3.03Å; V121-V128 HydrophobicContact CG1-CG2 4.36Å; V121-V128 HydrophobicContact CG2-CG1 4.43Å; V121-V128 HydrophobicContact CG2-CG2 4.2Å
122	N	94.9	Very high	95.5	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	113	176.2	179.3	-37.9	0	0	0	109.2	Y28 D31 C32 K124 V125 G126 T127	Y28-N122 PolarHBondContact O-ND2 2.88Å; D31-N122 VanDerWaalsContact CB-ND2 3.32Å; D31-N122 WeakPolarHBondContact CB-ND2 3.22Å; D31-N122 PolarHBondContact O-ND2 3.16Å; C32-N122 HydrophobicContact CB-CB 4.39Å; C32-N122 PolarHBondContact SG-N 3.49Å; C32-N122 VanDerWaalsContact SG-N 3.38Å; N122-K124 PolarHBondContact O-N 2.78Å; N122-K124 VanDerWaalsContact O-N 3.14Å; N122-K124 PolarHBondContact OD1-N 3.28Å; N122-V125 HydrophobicContact CB-CG2 4.04Å; N122-V125 VanDerWaalsContact CG-CG2 3.45Å; N122-V125 PolarHBondContact OD1-N 2.65Å; N122-G126 VanDerWaalsContact O-CA 3.29Å; N122-G126 WeakPolarHBondContact O-CA 3.41Å; N122-G126 PolarHBondContact O-N 3.08Å; N122-T127 WeakPolarHBondContact CB-OG1 3.37Å; N122-T127 PolarHBondContact N-O 3.06Å
123	K	92.8	Very high	95.5	Very high	100 Å²	100	44.3 Å²	44.3	44%	0.435	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-8.3	-172.4	-62.2	-165.1	175.1	-166.5	0	114.4	T72 E74 V121	T72-K123 WeakPolarHBondContact O-CB 3.05Å; T72-K123 PolarHBondContact O-N 2.9Å; E74-K123 WeakPolarHBondContact OE2-CE 3.44Å; E74-K123 IonicContact OE2-NZ 2.64Å; E74-K123 PolarHBondContact OE2-NZ 3.34Å; V121-K123 PolarHBondContact O-N 3.07Å
124	K	88.9	Confident	95.6	Very high	99 Å²	99	46.4 Å²	46.4	43%	0.43	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-37.3	-175.4	-61.7	178.1	-177.8	170.1	0	113.1	Y28 N122	Y28-K124 HydrophobicContact CD1-CD 3.86Å; Y28-K124 HydrophobicContact CD2-CD 4.45Å; Y28-K124 HydrophobicContact CE1-CD 4.43Å; Y28-K124 HydrophobicContact CG-CD 3.88Å; N122-K124 PolarHBondContact O-N 2.78Å; N122-K124 VanDerWaalsContact O-N 3.14Å; N122-K124 PolarHBondContact OD1-N 3.28Å
125	V	91.1	Very high	95.6	Very high	76 Å²	76	45.9 Å²	45.9	46%	0.461	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-8.1	177.2	-66.3	0	0	0	0	114	N122 T127	N122-V125 HydrophobicContact CB-CG2 4.04Å; N122-V125 VanDerWaalsContact CG-CG2 3.45Å; N122-V125 PolarHBondContact OD1-N 2.65Å; V125-T127 VanDerWaalsContact C-N 3.26Å; V125-T127 HydrophobicContact CB-CG2 4.5Å; V125-T127 HydrophobicContact CG2-CG2 3.84Å; V125-T127 WeakPolarHBondContact CG2-OG1 3.25Å; V125-T127 PolarHBondContact O-N 3.17Å
126	G	89.5	Confident	95.6	Very high	55 Å²	55	46.3 Å²	46.3	57%	0.567	24%	0.24	S	C	*	.			trans	73.9	11.2	178.5	0	0	0	0	0	114.7	N122	N122-G126 VanDerWaalsContact O-CA 3.29Å; N122-G126 WeakPolarHBondContact O-CA 3.41Å; N122-G126 PolarHBondContact O-N 3.08Å
127	T	93.5	Very high	95.6	Very high	60 Å²	60	46.5 Å²	46.5	37%	0.368	24%	0.241	S	C	.	.			trans	-71.3	145.6	175.9	53.8	0	0	0	0	110.9	V121 N122 V125	V121-T127 WeakPolarHBondContact CA-O 3.03Å; N122-T127 WeakPolarHBondContact CB-OG1 3.37Å; N122-T127 PolarHBondContact N-O 3.06Å; V125-T127 VanDerWaalsContact C-N 3.26Å; V125-T127 HydrophobicContact CB-CG2 4.5Å; V125-T127 HydrophobicContact CG2-CG2 3.84Å; V125-T127 WeakPolarHBondContact CG2-OG1 3.25Å; V125-T127 PolarHBondContact O-N 3.17Å
128	V	95.8	Very high	95.6	Very high	65 Å²	65	49.8 Å²	49.8	39%	0.394	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	127.8	176.3	-174.7	0	0	0	0	108.4	Q119 C120 V121 Y130	Q119-V128 HydrophobicContact CG-CG1 3.69Å; C120-V128 WeakPolarHBondContact O-CA 3.49Å; V121-V128 HydrophobicContact CG1-CG2 4.36Å; V121-V128 HydrophobicContact CG2-CG1 4.43Å; V121-V128 HydrophobicContact CG2-CG2 4.2Å; V128-Y130 HydrophobicContact CG1-CE1 4.46Å; V128-Y130 HydrophobicContact CG1-CE2 3.97Å
129	I	95.6	Very high	95.6	Very high	55 Å²	55	51.2 Å²	51.2	28%	0.282	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	131.4	177.5	-61.8	175.4	0	0	0	107.7	C32 K33 C120	C32-I129 HydrophobicContact CB-CB 4.41Å; C32-I129 HydrophobicContact CB-CD1 4.01Å; C32-I129 HydrophobicContact CB-CG1 4.43Å; K33-I129 HydrophobicContact CG-CD1 4.28Å; C120-I129 PolarHBondContact N-O 3.15Å; C120-I129 PolarHBondContact O-N 3.39Å
130	Y	96.9	Very high	95.6	Very high	128 Å²	128	54.3 Å²	54.3	50%	0.502	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	125.3	173	-60.1	-83.7	0	0	0	108.9	K78 Q117 Q119 V128	K78-Y130 HydrophobicContact CG-CE1 4.24Å; Q117-Y130 HydrophobicContact CB-CD1 4.31Å; Q119-Y130 HydrophobicContact CB-CD1 3.76Å; Q119-Y130 HydrophobicContact CB-CE1 3.65Å; Q119-Y130 HydrophobicContact CG-CD1 4Å; Q119-Y130 HydrophobicContact CG-CE1 3.52Å; V128-Y130 HydrophobicContact CG1-CE1 4.46Å; V128-Y130 HydrophobicContact CG1-CE2 3.97Å
131	H	96.8	Very high	95.6	Very high	11 Å²	11	55 Å²	55	5%	0.051	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	105.6	173.9	-60.4	-81.5	0	0	0	108.5	C32 M60 V118	C32-H131 PolarHBondContact O-CE1 3.15Å; C32-H131 PolarHBondContact O-NE2 3.22Å; M60-H131 HydrophobicContact CE-CB 3.61Å; V118-H131 HydrophobicContact CB-CB 4.32Å; V118-H131 PolarHBondContact N-O 2.74Å; V118-H131 PolarHBondContact O-N 3.46Å
132	E	97.5	Very high	95.6	Very high	48 Å²	48	55.6 Å²	55.6	22%	0.224	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	134.5	178.8	-177.5	173.5	97.6	0	0	110.8	A41 T42 V115 Q117 R134	A41-E132 CarbonylContact C-O 3.59Å; A41-E132 WeakPolarHBondContact CA-O 3.4Å; A41-E132 HydrophobicContact CB-CB 4.18Å; A41-E132 HydrophobicContact CB-CG 4.32Å; T42-E132 PolarHBondContact N-O 3.48Å; V115-E132 HydrophobicContact CG1-CG 4.19Å; Q117-E132 PolarHBondContact NE2-OE2 2.64Å; E132-R134 VanDerWaalsContact CD-NH2 3.34Å; E132-R134 HydrophobicContact CG-CG 4.24Å; E132-R134 IonicContact OE1-CZ 2.72Å; E132-R134 IonicContact OE1-NE 2.65Å; E132-R134 PolarHBondContact OE1-NE 2.99Å; E132-R134 IonicContact OE1-NH2 3.86Å; E132-R134 PolarHBondContact OE1-NH2 3.25Å; E132-R134 IonicContact OE2-NH2 3.18Å; E132-R134 PolarHBondContact OE2-NH2 3.33Å
133	V	97.5	Very high	95.7	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.1	172.4	-171.9	0	0	0	0	108.3	T42 V57 M60 L94 V115 V116 V118 I135	T42-V133 HydrophobicContact CG2-CG1 4.5Å; T42-V133 CarbonylContact O-C 3.55Å; T42-V133 VanDerWaalsContact O-CA 3.29Å; T42-V133 WeakPolarHBondContact O-CA 3.3Å; V57-V133 HydrophobicContact CG2-CG1 4.07Å; M60-V133 HydrophobicContact CE-CG2 3.6Å; M60-V133 HydrophobicContact SD-CG2 3.63Å; L94-V133 HydrophobicContact CD1-CB 4.31Å; L94-V133 HydrophobicContact CD1-CG1 3.99Å; L94-V133 HydrophobicContact CD1-CG2 3.86Å; V115-V133 WeakPolarHBondContact CA-O 3.43Å; V116-V133 HydrophobicContact CG2-CB 3.93Å; V116-V133 PolarHBondContact N-O 3.16Å; V116-V133 PolarHBondContact O-N 2.97Å; V118-V133 HydrophobicContact CG2-CG2 3.89Å; V133-I135 HydrophobicContact CG1-CD1 3.89Å; V133-I135 HydrophobicContact CG1-CG1 4.39Å
134	R	97.8	Very high	96	Very high	111 Å²	111	55.2 Å²	55.2	42%	0.419	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	117.5	172.9	-57.6	-170.1	-175.8	-124.5	-11.7	108.7	T42 I43 V44 V115 E132	T42-R134 PolarHBondContact O-N 3.25Å; I43-R134 WeakPolarHBondContact CA-O 3.41Å; I43-R134 HydrophobicContact CG1-CB 4.37Å; V44-R134 PolarHBondContact N-O 2.87Å; V115-R134 HydrophobicContact CG1-CG 4.29Å; V115-R134 HydrophobicContact CG2-CG 4.13Å; E132-R134 VanDerWaalsContact CD-NH2 3.34Å; E132-R134 HydrophobicContact CG-CG 4.24Å; E132-R134 IonicContact OE1-CZ 2.72Å; E132-R134 IonicContact OE1-NE 2.65Å; E132-R134 PolarHBondContact OE1-NE 2.99Å; E132-R134 IonicContact OE1-NH2 3.86Å; E132-R134 PolarHBondContact OE1-NH2 3.25Å; E132-R134 IonicContact OE2-NH2 3.18Å; E132-R134 PolarHBondContact OE2-NH2 3.33Å
135	I	97.8	Very high	96.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	108.3	171.2	-54.6	89.9	0	0	0	106.3	V44 I46 L56 V85 S113 I114 V133	V44-I135 HydrophobicContact CG2-CB 4.27Å; V44-I135 HydrophobicContact CG2-CG1 3.82Å; V44-I135 HydrophobicContact CG2-CG2 4.39Å; V44-I135 WeakPolarHBondContact O-CA 3.24Å; I46-I135 HydrophobicContact CD1-CG2 3.97Å; I46-I135 HydrophobicContact CG1-CG2 3.78Å; L56-I135 HydrophobicContact CB-CG1 4.5Å; L56-I135 HydrophobicContact CD1-CG1 4.27Å; L56-I135 HydrophobicContact CD2-CG1 4.35Å; L56-I135 HydrophobicContact CD2-CG2 4.03Å; V85-I135 HydrophobicContact CG2-CD1 4.16Å; S113-I135 CarbonylContact C-O 3.58Å; S113-I135 VanDerWaalsContact CA-O 3.23Å; S113-I135 WeakPolarHBondContact CA-O 3.31Å; S113-I135 WeakPolarHBondContact CB-O 3.34Å; I114-I135 HydrophobicContact CB-CB 4.28Å; I114-I135 HydrophobicContact CB-CD1 4.28Å; I114-I135 HydrophobicContact CG2-CD1 4.23Å; I114-I135 PolarHBondContact N-O 2.7Å; I114-I135 WeakPolarHBondContact O-CD1 3.32Å; I114-I135 PolarHBondContact O-N 2.87Å; V133-I135 HydrophobicContact CG1-CD1 3.89Å; V133-I135 HydrophobicContact CG1-CG1 4.39Å
136	V	98	Very high	96.7	Very high	62 Å²	62	50.7 Å²	50.7	38%	0.376	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	129.4	170.1	-177.9	0	0	0	0	107.8	I43 V44 A45 I46	I43-V136 HydrophobicContact CG2-CG2 4.46Å; V44-V136 PolarHBondContact O-N 2.96Å; A45-V136 VanDerWaalsContact CA-O 3.29Å; A45-V136 WeakPolarHBondContact CA-O 3.43Å; A45-V136 HydrophobicContact CB-CB 4.17Å; I46-V136 PolarHBondContact N-O 2.79Å; I46-V136 VanDerWaalsContact N-O 3.12Å
137	V	97.7	Very high	97.1	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.024	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	123.4	172.5	-175.9	0	0	0	0	107.3	E48 L103 R105 I111 H112	E48-V137 HydrophobicContact CB-CG1 3.57Å; L103-V137 HydrophobicContact CD1-CG2 4.27Å; L103-V137 HydrophobicContact CD2-CG2 4.05Å; L103-V137 HydrophobicContact CG-CG1 4.48Å; L103-V137 HydrophobicContact CG-CG2 4.31Å; R105-V137 HydrophobicContact CB-CG1 3.94Å; R105-V137 HydrophobicContact CG-CB 4.32Å; R105-V137 HydrophobicContact CG-CG1 3.96Å; I111-V137 VanDerWaalsContact O-CB 3.26Å; I111-V137 WeakPolarHBondContact O-CB 3.37Å; I111-V137 WeakPolarHBondContact O-CG2 3.29Å; H112-V137 PolarHBondContact O-N 3.21Å
138	R	97.7	Very high	97.3	Very high	101 Å²	101	52.6 Å²	52.6	38%	0.381	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	130.9	177.2	-64.2	-171	-60.9	-97.1	-3.1	109.8	A45 I46 D47 E48	A45-R138 HydrophobicContact CB-CG 4.2Å; A45-R138 PolarHBondContact O-NH1 2.87Å; I46-R138 WeakPolarHBondContact O-CB 3.3Å; I46-R138 PolarHBondContact O-N 2.93Å; D47-R138 WeakPolarHBondContact CA-O 3.18Å; D47-R138 IonicContact OD1-CZ 3.74Å; D47-R138 IonicContact OD1-NE 2.72Å; D47-R138 PolarHBondContact OD1-NE 3.38Å; D47-R138 IonicContact OD1-NH2 3.29Å; D47-R138 PolarHBondContact OD1-NH2 3.4Å; D47-R138 IonicContact OD2-CZ 3.2Å; D47-R138 IonicContact OD2-NH2 2.84Å; D47-R138 PolarHBondContact OD2-NH2 2.84Å; E48-R138 PolarHBondContact N-O 2.87Å
139	D	97.6	Very high	97.4	Very high	30 Å²	30	53.3 Å²	53.3	16%	0.16	25%	0.249	C	C	.	.			trans	-39.7	139.3	166.3	-151.3	73.3	0	0	0	113.4	E48 R105 D181 N184	E48-D139 WeakPolarHBondContact OE1-CA 3.5Å; R105-D139 IonicContact CZ-OD1 2.7Å; R105-D139 VanDerWaalsContact CZ-OD1 3.24Å; R105-D139 IonicContact NE-OD1 2.78Å; R105-D139 IonicContact NH1-OD1 3.32Å; R105-D139 PolarHBondContact NH1-OD1 2.68Å; R105-D139 IonicContact NH2-OD1 2.83Å; D139-D181 VanDerWaalsContact OD1-CB 3.22Å; D139-D181 WeakPolarHBondContact OD1-CB 3.35Å; D139-D181 PolarHBondContact OD1-N 2.88Å; D139-N184 WeakPolarHBondContact OD2-CB 3.42Å; D139-N184 PolarHBondContact OD2-ND2 3.34Å
140	R	96.8	Very high	97.5	Very high	95 Å²	95	59.9 Å²	59.9	36%	0.358	28%	0.279	S	S	.	.			trans	-118	170.9	165.2	-78.2	-64.4	85	150.3	14.3	109.2	D47 E48 D142 N184	D47-R140 HydrophobicContact CB-CG 4.39Å; D47-R140 IonicContact OD1-CZ 3.34Å; D47-R140 VanDerWaalsContact OD1-CZ 3.29Å; D47-R140 IonicContact OD1-NE 2.67Å; D47-R140 IonicContact OD1-NH1 2.71Å; D47-R140 IonicContact OD1-NH2 2.78Å; D47-R140 PolarHBondContact OD1-NH2 3.24Å; D47-R140 IonicContact OD2-NH1 2.77Å; E48-R140 HydrophobicContact CG-CB 3.84Å; E48-R140 HydrophobicContact CG-CG 3.67Å; E48-R140 PolarHBondContact OE1-N 3.05Å; E48-R140 VanDerWaalsContact OE1-N 3.1Å; R140-D142 WeakPolarHBondContact CB-OD1 3.35Å; R140-N184 PolarHBondContact O-ND2 3.02Å
141	N	97.2	Very high	97.5	Very high	15 Å²	15	57.4 Å²	57.4	8%	0.08	28%	0.281	C	S	.	.			trans	-107	64.6	173.6	-157.5	83.6	0	0	0	107.4	D180 N184 D236 A238 E243 R245	N141-D180 WeakPolarHBondContact CA-OD2 3.28Å; N141-N184 HydrophobicContact CB-CB 4.44Å; N141-N184 WeakPolarHBondContact OD1-CA 3.25Å; N141-N184 WeakPolarHBondContact OD1-CB 3.31Å; N141-N184 PolarHBondContact OD1-OD1 2.89Å; N141-D236 PolarHBondContact ND2-OD2 2.71Å; N141-A238 HydrophobicContact CB-CB 4.15Å; N141-A238 WeakPolarHBondContact OD1-CB 3.38Å; N141-E243 PolarHBondContact ND2-O 2.82Å; N141-R245 PolarHBondContact O-NE 2.94Å
142	D	96.6	Very high	97.6	Very high	51 Å²	51	57.6 Å²	57.6	27%	0.273	28%	0.281	S	S	.	.			trans	-111	-6.3	-173.4	70.7	-96.7	0	0	0	117.6	R140 D180 R245	R140-D142 WeakPolarHBondContact CB-OD1 3.35Å; D142-D180 PolarHBondContact N-OD2 3.49Å; D142-D180 VanDerWaalsContact N-OD2 3.11Å; D142-R245 VanDerWaalsContact C-NH1 3.33Å; D142-R245 VanDerWaalsContact CA-NH2 3.26Å; D142-R245 PolarHBondContact O-NH1 3.27Å; D142-R245 PolarHBondContact O-NH2 3.26Å
143	N	97.4	Very high	97.6	Very high	51 Å²	51	61.4 Å²	61.4	27%	0.273	29%	0.294	S	S	.	.	S	Bend	trans	-95.6	175.8	156.9	-57.6	-79.7	0	0	0	111	D106 D178 I179 D180 R245	D106-N143 PolarHBondContact OD2-ND2 3.36Å; N143-D178 WeakPolarHBondContact CB-OD1 3.38Å; N143-I179 HydrophobicContact CB-CD1 4.21Å; N143-I179 HydrophobicContact CB-CG1 3.6Å; N143-I179 WeakPolarHBondContact ND2-CG1 3.3Å; N143-D180 WeakPolarHBondContact CB-OD1 3.33Å; N143-D180 PolarHBondContact N-OD1 2.86Å; N143-D180 PolarHBondContact N-OD2 3.26Å; N143-D180 PolarHBondContact ND2-OD1 3.19Å; N143-R245 VanDerWaalsContact C-NH1 3.3Å; N143-R245 WeakPolarHBondContact O-CD 3.41Å; N143-R245 PolarHBondContact O-NE 2.87Å; N143-R245 PolarHBondContact O-NH1 2.91Å
144	S	97.5	Very high	97.7	Very high	43 Å²	43	61.9 Å²	61.9	30%	0.301	30%	0.298	S	S	.	.			trans	-136.7	153.4	-176.2	-61.3	0	0	0	0	109.2	T146 D178 R245	S144-T146 PolarHBondContact O-N 2.9Å; S144-D178 VanDerWaalsContact CA-OD2 3.31Å; S144-D178 WeakPolarHBondContact CA-OD2 3.24Å; S144-R245 WeakPolarHBondContact OG-CD 3.09Å; S144-R245 PolarHBondContact OG-NH1 3.34Å
145	P	98.1	Very high	97.7	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.299	C	S	.	.			trans	-59.2	128.8	180	-28.8	37.4	0	0	0	111.5	A176 D178 I187 A234 D236 T247	P145-A176 HydrophobicContact CB-CB 4.29Å; P145-D178 WeakPolarHBondContact CD-OD2 3.34Å; P145-D178 WeakPolarHBondContact CG-OD2 2.98Å; P145-I187 HydrophobicContact CB-CD1 3.67Å; P145-I187 HydrophobicContact CG-CD1 3.69Å; P145-A234 HydrophobicContact CB-CB 3.9Å; P145-D236 HydrophobicContact CG-CB 4.4Å; P145-T247 WeakPolarHBondContact O-CB 3.33Å; P145-T247 PolarHBondContact O-OG1 2.69Å
146	T	98.1	Very high	97.7	Very high	80 Å²	80	60.3 Å²	60.3	49%	0.491	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	117.7	179.9	49.7	0	0	0	0	110.2	S144 A176 T177	S144-T146 PolarHBondContact O-N 2.9Å; T146-A176 CarbonylContact O-C 3.54Å; T146-A176 VanDerWaalsContact O-CA 3.23Å; T146-A176 WeakPolarHBondContact O-CA 3.19Å; T146-T177 PolarHBondContact N-O 2.99Å; T146-T177 PolarHBondContact O-N 3.2Å; T146-T177 PolarHBondContact OG1-O 2.84Å
147	F	98.3	Very high	97.7	Very high	33 Å²	33	59.9 Å²	59.9	15%	0.145	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	136.2	170.7	-77	-80.6	0	0	0	110.2	H149 Y152 F170 G175 A176 Y189 A234 T247 T249	F147-H149 VanDerWaalsContact C-N 3.31Å; F147-H149 PolarHBondContact O-N 2.77Å; F147-Y152 HydrophobicContact CB-CE2 4.38Å; F147-Y152 AromaticContact CD1-CE2 3.77Å; F147-Y152 HydrophobicContact CD1-CE2 3.77Å; F147-Y152 HydrophobicContact CE1-CE2 4.44Å; F147-Y152 HydrophobicContact CG-CE2 4.35Å; F147-F170 HydrophobicContact CD1-CE1 4.28Å; F147-F170 HydrophobicContact CE1-CD1 4.3Å; F147-F170 AromaticContact CE1-CE1 3.82Å; F147-F170 HydrophobicContact CE1-CE1 3.82Å; F147-F170 HydrophobicContact CE1-CZ 4.11Å; F147-G175 WeakPolarHBondContact CA-O 3.32Å; F147-A176 HydrophobicContact CD1-CB 3.84Å; F147-A176 HydrophobicContact CD2-CB 4.33Å; F147-A176 HydrophobicContact CE1-CB 3.89Å; F147-A176 HydrophobicContact CE2-CB 4.36Å; F147-A176 HydrophobicContact CG-CB 4.08Å; F147-A176 HydrophobicContact CZ-CB 4.15Å; F147-Y189 HydrophobicContact CE1-CD1 4.32Å; F147-Y189 AromaticContact CE1-CE1 3.77Å; F147-Y189 HydrophobicContact CE1-CE1 3.77Å; F147-Y189 HydrophobicContact CZ-CD1 4.29Å; F147-Y189 HydrophobicContact CZ-CE1 4.09Å; F147-A234 HydrophobicContact CE1-CB 4.47Å; F147-A234 HydrophobicContact CE2-CB 3.75Å; F147-A234 HydrophobicContact CZ-CB 3.64Å; F147-T247 HydrophobicContact CD2-CG2 4.06Å; F147-T249 HydrophobicContact CD1-CG2 3.81Å; F147-T249 HydrophobicContact CD2-CG2 4.14Å; F147-T249 HydrophobicContact CE1-CG2 3.47Å; F147-T249 VanDerWaalsContact CE1-CG2 3.47Å; F147-T249 HydrophobicContact CE2-CG2 3.83Å; F147-T249 HydrophobicContact CG-CG2 4.13Å; F147-T249 HydrophobicContact CZ-CG2 3.48Å; F147-T249 VanDerWaalsContact CZ-CG2 3.48Å
148	K	97.7	Very high	97.7	Very high	121 Å²	121	60 Å²	60	53%	0.526	30%	0.297	S	S	.	.	S	Bend	trans	-69.2	-26.7	179.5	-171.6	-178.2	-170.8	175.6	0	114.2	D173 N174 G175	K148-D173 VanDerWaalsContact CD-O 3.31Å; K148-D173 WeakPolarHBondContact CD-O 3.07Å; K148-D173 PolarHBondContact NZ-O 3.15Å; K148-N174 HydrophobicContact CD-CB 4.43Å; K148-N174 WeakPolarHBondContact CD-OD1 3.47Å; K148-N174 PolarHBondContact NZ-OD1 2.93Å; K148-G175 PolarHBondContact N-O 2.86Å
149	H	97.6	Very high	97.7	Very high	80 Å²	80	59 Å²	59	37%	0.37	30%	0.299	S	S	.	.	S	Bend	trans	-125.3	143.6	177.9	-52	-83.2	0	0	0	109.1	F147 S151 Y152 N174	F147-H149 VanDerWaalsContact C-N 3.31Å; F147-H149 PolarHBondContact O-N 2.77Å; H149-S151 VanDerWaalsContact C-N 3.27Å; H149-S151 WeakPolarHBondContact CB-O 3.32Å; H149-S151 PolarHBondContact O-N 2.68Å; H149-Y152 HydrophobicContact CB-CE1 4.2Å; H149-Y152 HydrophobicContact CB-CE2 4.12Å; H149-Y152 AromaticContact CD2-CE1 3.64Å; H149-Y152 AromaticContact CD2-CZ 3.85Å; H149-Y152 PolarHBondContact N-OH 2.79Å; H149-Y152 WeakPolarHBondContact O-CE2 3.35Å; H149-N174 PolarHBondContact NE2-OD1 2.98Å
150	E	96.7	Very high	97.8	Very high	194 Å²	194	58.9 Å²	58.9	91%	0.907	30%	0.299	S	S	*	.	S	Bend	trans	-68.6	-26.8	-179.9	-59.6	-178.1	161.2	0	0	112.9	T249	E150-T249 PolarHBondContact O-OG1 3.39Å
151	S	97.2	Very high	97.8	Very high	76 Å²	76	58.6 Å²	58.6	53%	0.531	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	160.8	175.7	67.5	0	0	0	0	110.6	H149	H149-S151 VanDerWaalsContact C-N 3.27Å; H149-S151 WeakPolarHBondContact CB-O 3.32Å; H149-S151 PolarHBondContact O-N 2.68Å
152	Y	98.5	Very high	97.9	Very high	15 Å²	15	61.6 Å²	61.6	6%	0.059	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	157.5	177.5	-64.2	-100.4	0	0	0	109.8	F147 H149 F167 F170 N174 G175 T249 T250 L251 T252	F147-Y152 HydrophobicContact CB-CE2 4.38Å; F147-Y152 AromaticContact CD1-CE2 3.77Å; F147-Y152 HydrophobicContact CD1-CE2 3.77Å; F147-Y152 HydrophobicContact CE1-CE2 4.44Å; F147-Y152 HydrophobicContact CG-CE2 4.35Å; H149-Y152 HydrophobicContact CB-CE1 4.2Å; H149-Y152 HydrophobicContact CB-CE2 4.12Å; H149-Y152 AromaticContact CD2-CE1 3.64Å; H149-Y152 AromaticContact CD2-CZ 3.85Å; H149-Y152 PolarHBondContact N-OH 2.79Å; H149-Y152 WeakPolarHBondContact O-CE2 3.35Å; Y152-F167 HydrophobicContact CD1-CE2 4.37Å; Y152-F167 AromaticContact CD1-CZ 3.71Å; Y152-F167 HydrophobicContact CD1-CZ 3.71Å; Y152-F167 HydrophobicContact CG-CZ 4.08Å; Y152-F170 HydrophobicContact CD1-CD1 4.14Å; Y152-F170 AromaticContact CD1-CE1 3.84Å; Y152-F170 HydrophobicContact CD1-CE1 3.84Å; Y152-F170 AromaticContact CD2-CE1 3.77Å; Y152-F170 HydrophobicContact CD2-CE1 3.77Å; Y152-F170 AromaticContact CE1-CD1 3.81Å; Y152-F170 HydrophobicContact CE1-CD1 3.81Å; Y152-F170 AromaticContact CE1-CE1 3.79Å; Y152-F170 HydrophobicContact CE1-CE1 3.79Å; Y152-F170 HydrophobicContact CE2-CD1 4.46Å; Y152-F170 AromaticContact CE2-CE1 3.77Å; Y152-F170 HydrophobicContact CE2-CE1 3.77Å; Y152-F170 AromaticContact CG-CE1 3.82Å; Y152-F170 HydrophobicContact CG-CE1 3.82Å; Y152-F170 AromaticContact CZ-CE1 3.78Å; Y152-N174 WeakPolarHBondContact CE1-O 3.35Å; Y152-N174 PolarHBondContact OH-O 3.42Å; Y152-G175 PolarHBondContact OH-O 3.4Å; Y152-T249 HydrophobicContact CD2-CG2 3.75Å; Y152-T249 WeakPolarHBondContact CD2-OG1 3.48Å; Y152-T249 HydrophobicContact CE2-CG2 3.84Å; Y152-T249 WeakPolarHBondContact CE2-OG1 3.34Å; Y152-T250 PolarHBondContact N-O 3.01Å; Y152-L251 WeakPolarHBondContact O-CA 3.46Å; Y152-T252 PolarHBondContact O-N 3.34Å
153	Y	98.5	Very high	97.9	Very high	128 Å²	128	61.7 Å²	61.7	50%	0.502	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	145.4	-177.2	-174.9	-108.9	0	0	0	111.4	T155 T252 D254	Y153-T155 HydrophobicContact CE1-CG2 3.61Å; Y153-T155 WeakPolarHBondContact OH-CG2 3.24Å; Y153-T252 CarbonylContact C-O 3.53Å; Y153-T252 WeakPolarHBondContact CA-O 3.3Å; Y153-T252 HydrophobicContact CD2-CG2 4.31Å; Y153-T252 HydrophobicContact CE2-CG2 4.45Å; Y153-D254 HydrophobicContact CE2-CB 4.26Å; Y153-D254 VanDerWaalsContact CE2-OD2 3.28Å; Y153-D254 WeakPolarHBondContact CE2-OD2 3.47Å; Y153-D254 PolarHBondContact OH-OD2 2.85Å
154	A	98.3	Very high	98	Very high	10 Å²	10	61.9 Å²	61.9	8%	0.083	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	153.7	170.8	0	0	0	0	0	110.9	F167 L251 T252 V253 D254	A154-F167 HydrophobicContact CB-CB 4.26Å; A154-F167 HydrophobicContact CB-CD2 4.08Å; A154-L251 HydrophobicContact CB-CD1 4.12Å; A154-T252 PolarHBondContact N-O 3.02Å; A154-V253 HydrophobicContact CB-CG2 4.45Å; A154-V253 WeakPolarHBondContact O-CA 3.35Å; A154-D254 PolarHBondContact O-N 3.34Å
155	T	98.1	Very high	98	Very high	71 Å²	71	63.1 Å²	63.1	44%	0.436	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.3	170.4	56.4	0	0	0	0	110	Y153 D254 L256	Y153-T155 HydrophobicContact CE1-CG2 3.61Å; Y153-T155 WeakPolarHBondContact OH-CG2 3.24Å; T155-D254 CarbonylContact C-O 3.48Å; T155-D254 WeakPolarHBondContact CA-O 3.25Å; T155-D254 HydrophobicContact CG2-CB 4.48Å; T155-L256 HydrophobicContact CG2-CD2 4.33Å
156	V	98.4	Very high	98	Very high	6 Å²	6	64.3 Å²	64.3	4%	0.036	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	122.3	179.6	55.4	0	0	0	0	109.7	T160 I166 L220 V253 D254 V255 L256	V156-T160 HydrophobicContact CG2-CG2 3.99Å; V156-T160 WeakPolarHBondContact CG2-OG1 3.24Å; V156-I166 HydrophobicContact CB-CG2 4.39Å; V156-I166 HydrophobicContact CG2-CB 4.43Å; V156-I166 HydrophobicContact CG2-CG2 3.78Å; V156-L220 HydrophobicContact CB-CD1 4.3Å; V156-L220 HydrophobicContact CG1-CD1 3.56Å; V156-L220 HydrophobicContact CG2-CD1 3.76Å; V156-V253 HydrophobicContact CG1-CG1 3.54Å; V156-D254 PolarHBondContact N-O 2.87Å; V156-V255 CarbonylContact O-C 3.46Å; V156-V255 VanDerWaalsContact O-CA 3.25Å; V156-V255 WeakPolarHBondContact O-CA 3.43Å; V156-L256 PolarHBondContact O-N 3.08Å
157	N	98	Very high	98	Very high	53 Å²	53	61.6 Å²	61.6	28%	0.283	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	140.6	172.4	170.1	-94.9	0	0	0	110.2	L159 T160 L256 D257 G258	N157-L159 VanDerWaalsContact C-N 3.25Å; N157-L159 PolarHBondContact O-N 3.47Å; N157-L159 VanDerWaalsContact OD1-CB 3.26Å; N157-L159 WeakPolarHBondContact OD1-CB 3.37Å; N157-L159 VanDerWaalsContact OD1-CG 3.31Å; N157-L159 WeakPolarHBondContact OD1-CG 3.25Å; N157-L159 PolarHBondContact OD1-N 2.82Å; N157-T160 WeakPolarHBondContact O-CB 3.44Å; N157-T160 PolarHBondContact O-N 2.87Å; N157-T160 PolarHBondContact O-OG1 2.85Å; N157-L256 VanDerWaalsContact CA-O 3.32Å; N157-L256 WeakPolarHBondContact CA-O 3.47Å; N157-L256 HydrophobicContact CB-CB 4.28Å; N157-L256 PolarHBondContact ND2-O 3.21Å; N157-L256 VanDerWaalsContact ND2-O 3.15Å; N157-D257 PolarHBondContact ND2-O 3.04Å; N157-G258 VanDerWaalsContact ND2-CA 3.3Å; N157-G258 WeakPolarHBondContact ND2-CA 3.35Å
158	E	98.3	Very high	98	Very high	8 Å²	8	63.5 Å²	63.5	4%	0.037	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-28.8	-169.4	72.3	-162.2	98.6	0	0	114.9	T160 L220 N221 Y222 V255 L256 D257 G258	E158-T160 PolarHBondContact O-N 2.83Å; E158-T160 VanDerWaalsContact O-N 3.09Å; E158-L220 HydrophobicContact CB-CB 3.88Å; E158-N221 VanDerWaalsContact OE2-CA 3.24Å; E158-N221 WeakPolarHBondContact OE2-CA 3.17Å; E158-Y222 WeakPolarHBondContact OE1-CB 3.34Å; E158-Y222 WeakPolarHBondContact OE2-CB 3.35Å; E158-Y222 PolarHBondContact OE2-N 2.83Å; E158-V255 HydrophobicContact CB-CG1 3.73Å; E158-L256 PolarHBondContact N-O 3.2Å; E158-L256 VanDerWaalsContact N-O 3.09Å; E158-D257 WeakPolarHBondContact OE1-CA 3.23Å; E158-G258 PolarHBondContact OE1-N 3.3Å
159	L	97.7	Very high	97.9	Very high	80 Å²	80	58.7 Å²	58.7	42%	0.419	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-7.7	177	-43.6	179.9	0	0	0	112.6	N157 P161 D260	N157-L159 VanDerWaalsContact C-N 3.25Å; N157-L159 PolarHBondContact O-N 3.47Å; N157-L159 VanDerWaalsContact OD1-CB 3.26Å; N157-L159 WeakPolarHBondContact OD1-CB 3.37Å; N157-L159 VanDerWaalsContact OD1-CG 3.31Å; N157-L159 WeakPolarHBondContact OD1-CG 3.25Å; N157-L159 PolarHBondContact OD1-N 2.82Å; L159-P161 WeakPolarHBondContact O-CD 3.11Å; L159-D260 HydrophobicContact CD2-CB 3.72Å
160	T	98	Very high	97.9	Very high	27 Å²	27	55.3 Å²	55.3	17%	0.166	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-52.9	120.8	178.1	-65.3	0	0	0	0	111	V156 N157 E158 T164 I166 L216	V156-T160 HydrophobicContact CG2-CG2 3.99Å; V156-T160 WeakPolarHBondContact CG2-OG1 3.24Å; N157-T160 WeakPolarHBondContact O-CB 3.44Å; N157-T160 PolarHBondContact O-N 2.87Å; N157-T160 PolarHBondContact O-OG1 2.85Å; E158-T160 PolarHBondContact O-N 2.83Å; E158-T160 VanDerWaalsContact O-N 3.09Å; T160-T164 HydrophobicContact CG2-CG2 3.77Å; T160-I166 HydrophobicContact CG2-CG2 4.09Å; T160-L216 HydrophobicContact CG2-CD2 3.81Å; T160-L216 VanDerWaalsContact O-CD2 3.26Å; T160-L216 WeakPolarHBondContact O-CD2 3.5Å
161	P	98.3	Very high	97.9	Very high	89 Å²	89	49.5 Å²	49.5	58%	0.578	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-62.7	139.6	179.8	-26	35.8	0	0	0	113.1	L159 G163 T164	L159-P161 WeakPolarHBondContact O-CD 3.11Å; P161-G163 PolarHBondContact O-N 2.74Å; P161-T164 WeakPolarHBondContact O-CB 3.45Å; P161-T164 PolarHBondContact O-N 2.67Å; P161-T164 PolarHBondContact O-OG1 3.27Å
162	V	98.2	Very high	97.8	Very high	77 Å²	77	49.1 Å²	49.1	47%	0.467	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	133.7	169.1	174.1	0	0	0	0	110.1	R217 K218 R219	V162-R217 WeakPolarHBondContact CG1-O 3.33Å; V162-K218 VanDerWaalsContact CG2-C 3.41Å; V162-R219 HydrophobicContact CG2-CG 3.9Å
163	G	97.4	Very high	97.5	Very high	53 Å²	53	54.6 Å²	54.6	55%	0.546	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.8	-8.1	-170.6	0	0	0	0	0	114.4	P161 L216	P161-G163 PolarHBondContact O-N 2.74Å; G163-L216 PolarHBondContact N-O 2.86Å
164	T	98.2	Very high	97.5	Very high	55 Å²	55	50.8 Å²	50.8	34%	0.337	33%	0.329	S	S	.	.			trans	-71.4	136.8	173.6	-54.7	0	0	0	0	110.9	T160 P161 I166 V215 L216	T160-T164 HydrophobicContact CG2-CG2 3.77Å; P161-T164 WeakPolarHBondContact O-CB 3.45Å; P161-T164 PolarHBondContact O-N 2.67Å; P161-T164 PolarHBondContact O-OG1 3.27Å; T164-I166 PolarHBondContact O-N 2.87Å; T164-V215 WeakPolarHBondContact O-CA 3.38Å; T164-L216 PolarHBondContact O-N 2.67Å
165	T	98.4	Very high	97.4	Very high	69 Å²	69	50.4 Å²	50.4	42%	0.423	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	116.7	170.6	-57.9	0	0	0	0	109.1	T168 N213 V214	T165-T168 HydrophobicContact CG2-CG2 3.71Å; T165-N213 HydrophobicContact CG2-CB 3.96Å; T165-V214 CarbonylContact C-O 3.27Å; T165-V214 WeakPolarHBondContact CA-O 3.16Å
166	I	97.8	Very high	97.4	Very high	26 Å²	26	47.4 Å²	47.4	13%	0.133	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-14.1	-173.6	61.6	83.1	0	0	0	113.4	V156 T160 T164 F204 V214 L216 V253	V156-I166 HydrophobicContact CB-CG2 4.39Å; V156-I166 HydrophobicContact CG2-CB 4.43Å; V156-I166 HydrophobicContact CG2-CG2 3.78Å; T160-I166 HydrophobicContact CG2-CG2 4.09Å; T164-I166 PolarHBondContact O-N 2.87Å; I166-F204 HydrophobicContact CD1-CD1 4.02Å; I166-F204 HydrophobicContact CD1-CE1 3.93Å; I166-F204 HydrophobicContact CG1-CD1 4.05Å; I166-F204 HydrophobicContact CG1-CE1 4Å; I166-V214 HydrophobicContact CD1-CB 4.2Å; I166-V214 HydrophobicContact CD1-CG1 3.94Å; I166-V214 HydrophobicContact CG1-CG1 4.36Å; I166-V214 PolarHBondContact N-O 2.82Å; I166-L216 HydrophobicContact CG2-CB 3.97Å; I166-V253 HydrophobicContact CD1-CG1 4.45Å; I166-V253 HydrophobicContact CD1-CG2 4.47Å
167	F	98.5	Very high	97.4	Very high	22 Å²	22	49.7 Å²	49.7	10%	0.096	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	135.4	175.7	174.2	-93	0	0	0	111.9	Y152 A154 G169 F170 N213 V214 L251	Y152-F167 HydrophobicContact CD1-CE2 4.37Å; Y152-F167 AromaticContact CD1-CZ 3.71Å; Y152-F167 HydrophobicContact CD1-CZ 3.71Å; Y152-F167 HydrophobicContact CG-CZ 4.08Å; A154-F167 HydrophobicContact CB-CB 4.26Å; A154-F167 HydrophobicContact CB-CD2 4.08Å; F167-G169 VanDerWaalsContact CZ-CA 3.41Å; F167-F170 HydrophobicContact CD1-CE2 4.44Å; F167-F170 AromaticContact CE1-CD1 3.82Å; F167-F170 HydrophobicContact CE1-CD1 3.82Å; F167-F170 AromaticContact CE1-CD2 3.83Å; F167-F170 HydrophobicContact CE1-CD2 3.83Å; F167-F170 AromaticContact CE1-CE1 3.79Å; F167-F170 HydrophobicContact CE1-CE1 3.79Å; F167-F170 AromaticContact CE1-CE2 3.78Å; F167-F170 HydrophobicContact CE1-CE2 3.78Å; F167-F170 AromaticContact CE1-CG 3.87Å; F167-F170 HydrophobicContact CE1-CG 3.87Å; F167-F170 AromaticContact CE1-CZ 3.78Å; F167-F170 HydrophobicContact CE1-CZ 3.78Å; F167-F170 HydrophobicContact CZ-CD1 4.1Å; F167-F170 HydrophobicContact CZ-CE1 4.04Å; F167-F170 HydrophobicContact CZ-CZ 4.39Å; F167-N213 WeakPolarHBondContact O-CA 3.27Å; F167-V214 HydrophobicContact CB-CB 4.2Å; F167-V214 HydrophobicContact CD1-CG2 4.11Å; F167-V214 PolarHBondContact N-O 3.28Å; F167-V214 PolarHBondContact O-N 3.08Å; F167-L251 HydrophobicContact CB-CD2 4.2Å; F167-L251 HydrophobicContact CD1-CD2 4.01Å; F167-L251 HydrophobicContact CD2-CD1 3.9Å; F167-L251 HydrophobicContact CE1-CD2 4.5Å; F167-L251 HydrophobicContact CE2-CD1 3.92Å; F167-L251 HydrophobicContact CG-CD1 4.23Å; F167-L251 HydrophobicContact CG-CD2 4.01Å; F167-L251 HydrophobicContact CZ-CD1 4.28Å
168	T	98	Very high	97.4	Very high	73 Å²	73	48.1 Å²	48.1	45%	0.448	31%	0.314	S	S	.	.			trans	-130.4	10.2	179.6	56.6	0	0	0	0	112.5	T165 F170 S171	T165-T168 HydrophobicContact CG2-CG2 3.71Å; T168-F170 PolarHBondContact O-N 3.03Å; T168-S171 WeakPolarHBondContact O-CB 3.16Å; T168-S171 PolarHBondContact O-N 2.91Å; T168-S171 PolarHBondContact O-OG 3.03Å
169	G	96.7	Very high	97.4	Very high	21 Å²	21	51 Å²	51	22%	0.216	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	0.5	-167.9	0	0	0	0	0	116.2	F167 N174	F167-G169 VanDerWaalsContact CZ-CA 3.41Å; G169-N174 WeakPolarHBondContact O-CB 3.18Å; G169-N174 PolarHBondContact O-ND2 3.43Å
170	F	97.8	Very high	97.4	Very high	8 Å²	8	47.6 Å²	47.6	4%	0.035	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-13.6	170.1	-59.8	-35.5	0	0	0	113.8	F147 Y152 F167 T168 G175 Y189 G212 I232 T249	F147-F170 HydrophobicContact CD1-CE1 4.28Å; F147-F170 HydrophobicContact CE1-CD1 4.3Å; F147-F170 AromaticContact CE1-CE1 3.82Å; F147-F170 HydrophobicContact CE1-CE1 3.82Å; F147-F170 HydrophobicContact CE1-CZ 4.11Å; Y152-F170 HydrophobicContact CD1-CD1 4.14Å; Y152-F170 AromaticContact CD1-CE1 3.84Å; Y152-F170 HydrophobicContact CD1-CE1 3.84Å; Y152-F170 AromaticContact CD2-CE1 3.77Å; Y152-F170 HydrophobicContact CD2-CE1 3.77Å; Y152-F170 AromaticContact CE1-CD1 3.81Å; Y152-F170 HydrophobicContact CE1-CD1 3.81Å; Y152-F170 AromaticContact CE1-CE1 3.79Å; Y152-F170 HydrophobicContact CE1-CE1 3.79Å; Y152-F170 HydrophobicContact CE2-CD1 4.46Å; Y152-F170 AromaticContact CE2-CE1 3.77Å; Y152-F170 HydrophobicContact CE2-CE1 3.77Å; Y152-F170 AromaticContact CG-CE1 3.82Å; Y152-F170 HydrophobicContact CG-CE1 3.82Å; Y152-F170 AromaticContact CZ-CE1 3.78Å; F167-F170 HydrophobicContact CD1-CE2 4.44Å; F167-F170 AromaticContact CE1-CD1 3.82Å; F167-F170 HydrophobicContact CE1-CD1 3.82Å; F167-F170 AromaticContact CE1-CD2 3.83Å; F167-F170 HydrophobicContact CE1-CD2 3.83Å; F167-F170 AromaticContact CE1-CE1 3.79Å; F167-F170 HydrophobicContact CE1-CE1 3.79Å; F167-F170 AromaticContact CE1-CE2 3.78Å; F167-F170 HydrophobicContact CE1-CE2 3.78Å; F167-F170 AromaticContact CE1-CG 3.87Å; F167-F170 HydrophobicContact CE1-CG 3.87Å; F167-F170 AromaticContact CE1-CZ 3.78Å; F167-F170 HydrophobicContact CE1-CZ 3.78Å; F167-F170 HydrophobicContact CZ-CD1 4.1Å; F167-F170 HydrophobicContact CZ-CE1 4.04Å; F167-F170 HydrophobicContact CZ-CZ 4.39Å; T168-F170 PolarHBondContact O-N 3.03Å; F170-G175 PolarHBondContact O-N 3.31Å; F170-G175 VanDerWaalsContact O-N 3.09Å; F170-Y189 HydrophobicContact CB-CE1 4.43Å; F170-Y189 HydrophobicContact CB-CE2 4.42Å; F170-Y189 HydrophobicContact CD2-CD1 4.11Å; F170-Y189 HydrophobicContact CD2-CE1 4.06Å; F170-Y189 HydrophobicContact CD2-CG 4.46Å; F170-Y189 HydrophobicContact CE2-CD1 4.26Å; F170-Y189 HydrophobicContact CE2-CE1 4.46Å; F170-Y189 HydrophobicContact CG-CE1 4.15Å; F170-G212 WeakPolarHBondContact CD2-O 3.19Å; F170-I232 HydrophobicContact CE2-CD1 3.79Å; F170-I232 HydrophobicContact CE2-CG2 3.9Å; F170-I232 HydrophobicContact CZ-CB 4.36Å; F170-I232 HydrophobicContact CZ-CD1 3.79Å; F170-I232 HydrophobicContact CZ-CG2 4.09Å; F170-T249 HydrophobicContact CE1-CG2 4.28Å; F170-T249 HydrophobicContact CZ-CG2 4.16Å
171	S	96.5	Very high	97.3	Very high	72 Å²	72	50.6 Å²	50.6	50%	0.503	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	156.4	178.1	61	0	0	0	0	113	T168 N174	T168-S171 WeakPolarHBondContact O-CB 3.16Å; T168-S171 PolarHBondContact O-N 2.91Å; T168-S171 PolarHBondContact O-OG 3.03Å; S171-N174 VanDerWaalsContact O-CB 3.3Å; S171-N174 WeakPolarHBondContact O-CB 3.43Å; S171-N174 PolarHBondContact O-N 3Å
172	G	93.8	Very high	97.2	Very high	69 Å²	69	47.8 Å²	47.8	71%	0.711	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	48.5	175.3	0	0	0	0	0	114	N174	G172-N174 PolarHBondContact O-N 2.76Å; G172-N174 VanDerWaalsContact O-N 3.15Å
173	D	93.6	Very high	97.1	Very high	129 Å²	129	46.3 Å²	46.3	69%	0.69	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	41.5	-179.3	-48.5	-24.8	0	0	0	112	K148 T177	K148-D173 VanDerWaalsContact CD-O 3.31Å; K148-D173 WeakPolarHBondContact CD-O 3.07Å; K148-D173 PolarHBondContact NZ-O 3.15Å; D173-T177 HydrophobicContact CB-CG2 4.4Å
174	N	97.2	Very high	97.1	Very high	49 Å²	49	44.6 Å²	44.6	26%	0.262	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-8.9	177.7	-160.4	70.6	0	0	0	113.8	K148 H149 Y152 G169 S171 G172	K148-N174 HydrophobicContact CD-CB 4.43Å; K148-N174 WeakPolarHBondContact CD-OD1 3.47Å; K148-N174 PolarHBondContact NZ-OD1 2.93Å; H149-N174 PolarHBondContact NE2-OD1 2.98Å; Y152-N174 WeakPolarHBondContact CE1-O 3.35Å; Y152-N174 PolarHBondContact OH-O 3.42Å; G169-N174 WeakPolarHBondContact O-CB 3.18Å; G169-N174 PolarHBondContact O-ND2 3.43Å; S171-N174 VanDerWaalsContact O-CB 3.3Å; S171-N174 WeakPolarHBondContact O-CB 3.43Å; S171-N174 PolarHBondContact O-N 3Å; G172-N174 PolarHBondContact O-N 2.76Å; G172-N174 VanDerWaalsContact O-N 3.15Å
175	G	96.8	Very high	97.1	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.01	28%	0.279	C	S	.	.	S	Bend	trans	-92.4	-126.3	171.8	0	0	0	0	0	112.8	F147 K148 Y152 F170	F147-G175 WeakPolarHBondContact CA-O 3.32Å; K148-G175 PolarHBondContact N-O 2.86Å; Y152-G175 PolarHBondContact OH-O 3.4Å; F170-G175 PolarHBondContact O-N 3.31Å; F170-G175 VanDerWaalsContact O-N 3.09Å
176	A	97.7	Very high	97	Very high	8 Å²	8	43.5 Å²	43.5	7%	0.066	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	141.7	171.1	0	0	0	0	0	111.9	P145 T146 F147 I187 Y189 A234	P145-A176 HydrophobicContact CB-CB 4.29Å; T146-A176 CarbonylContact O-C 3.54Å; T146-A176 VanDerWaalsContact O-CA 3.23Å; T146-A176 WeakPolarHBondContact O-CA 3.19Å; F147-A176 HydrophobicContact CD1-CB 3.84Å; F147-A176 HydrophobicContact CD2-CB 4.33Å; F147-A176 HydrophobicContact CE1-CB 3.89Å; F147-A176 HydrophobicContact CE2-CB 4.36Å; F147-A176 HydrophobicContact CG-CB 4.08Å; F147-A176 HydrophobicContact CZ-CB 4.15Å; A176-I187 HydrophobicContact CB-CG1 4.47Å; A176-I187 HydrophobicContact CB-CG2 4.44Å; A176-Y189 HydrophobicContact CB-CE1 3.93Å; A176-Y189 PolarHBondContact N-OH 3.29Å; A176-Y189 PolarHBondContact O-OH 3.39Å; A176-A234 HydrophobicContact CB-CB 3.48Å; A176-A234 VanDerWaalsContact CB-CB 3.48Å
177	T	97.8	Very high	97	Very high	54 Å²	54	43.3 Å²	43.3	33%	0.331	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	138.6	171.5	47.9	0	0	0	0	109.8	T146 D173	T146-T177 PolarHBondContact N-O 2.99Å; T146-T177 PolarHBondContact O-N 3.2Å; T146-T177 PolarHBondContact OG1-O 2.84Å; D173-T177 HydrophobicContact CB-CG2 4.4Å
178	D	98.2	Very high	97	Very high	20 Å²	20	43.7 Å²	43.7	11%	0.107	28%	0.277	C	S	.	.			trans	-113	159.4	165.6	-148.4	-39.8	0	0	0	109	N143 S144 P145 I187	N143-D178 WeakPolarHBondContact CB-OD1 3.38Å; S144-D178 VanDerWaalsContact CA-OD2 3.31Å; S144-D178 WeakPolarHBondContact CA-OD2 3.24Å; P145-D178 WeakPolarHBondContact CD-OD2 3.34Å; P145-D178 WeakPolarHBondContact CG-OD2 2.98Å; D178-I187 HydrophobicContact CB-CD1 3.99Å
179	I	97.9	Very high	97	Very high	69 Å²	69	40.9 Å²	40.9	35%	0.354	26%	0.258	S	S	.	.			trans	-111.8	-12.6	-172.5	71.1	172.1	0	0	0	114.2	P107 N143	P107-I179 WeakPolarHBondContact CD-O 3.39Å; N143-I179 HydrophobicContact CB-CD1 4.21Å; N143-I179 HydrophobicContact CB-CG1 3.6Å; N143-I179 WeakPolarHBondContact ND2-CG1 3.3Å
180	D	98.1	Very high	97.1	Very high	8 Å²	8	41.8 Å²	41.8	4%	0.043	26%	0.26	C	S	.	.	S	Bend	trans	-63	165.2	169.9	-57.7	-5.7	0	0	0	110.5	N141 D142 N143 N184 G185	N141-D180 WeakPolarHBondContact CA-OD2 3.28Å; D142-D180 PolarHBondContact N-OD2 3.49Å; D142-D180 VanDerWaalsContact N-OD2 3.11Å; N143-D180 WeakPolarHBondContact CB-OD1 3.33Å; N143-D180 PolarHBondContact N-OD1 2.86Å; N143-D180 PolarHBondContact N-OD2 3.26Å; N143-D180 PolarHBondContact ND2-OD1 3.19Å; D180-N184 HydrophobicContact CB-CB 3.48Å; D180-N184 VanDerWaalsContact CB-CB 3.48Å; D180-G185 WeakPolarHBondContact O-CA 3.4Å; D180-G185 PolarHBondContact O-N 2.81Å
181	D	96.9	Very high	97.1	Very high	91 Å²	91	42.7 Å²	42.7	49%	0.487	27%	0.265	S	S	.	.			trans	-96.3	165.3	-177	-175.3	26.5	0	0	0	114.1	R105 D139 N184 G185	R105-D181 IonicContact CZ-OD2 3.23Å; R105-D181 VanDerWaalsContact NH1-CB 3.34Å; R105-D181 VanDerWaalsContact NH2-CB 3.27Å; R105-D181 IonicContact NH2-OD2 3.75Å; R105-D181 PolarHBondContact NH2-OD2 2.71Å; D139-D181 VanDerWaalsContact OD1-CB 3.22Å; D139-D181 WeakPolarHBondContact OD1-CB 3.35Å; D139-D181 PolarHBondContact OD1-N 2.88Å; D181-N184 WeakPolarHBondContact O-CB 3.47Å; D181-N184 PolarHBondContact O-N 2.03Å; D181-G185 PolarHBondContact O-N 2.86Å
182	G	95.9	Very high	97.2	Very high	30 Å²	30	42.9 Å²	42.9	31%	0.309	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	-125.7	167.6	0	0	0	0	0	111.9	N184 Q186	G182-N184 VanDerWaalsContact C-N 3.33Å; G182-Q186 VanDerWaalsContact C-NE2 3.34Å; G182-Q186 VanDerWaalsContact O-CD 3.29Å; G182-Q186 VanDerWaalsContact O-CG 3.23Å; G182-Q186 WeakPolarHBondContact O-CG 3.24Å; G182-Q186 PolarHBondContact O-NE2 2.85Å
183	P	97	Very high	97.4	Very high	46 Å²	46	45.9 Å²	45.9	30%	0.299	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-26.1	176.1	-17.5	32.5	0	0	0	114.2	Q186 R237	P183-Q186 PolarHBondContact O-N 3.1Å; P183-R237 HydrophobicContact CB-CB 4.34Å; P183-R237 VanDerWaalsContact CB-O 3.31Å; P183-R237 WeakPolarHBondContact CB-O 3.36Å; P183-R237 CarbonylContact O-C 3.58Å; P183-R237 VanDerWaalsContact O-C 3.27Å; P183-R237 VanDerWaalsContact O-CA 3.23Å; P183-R237 WeakPolarHBondContact O-CA 3.12Å; P183-R237 VanDerWaalsContact O-CB 3.23Å; P183-R237 WeakPolarHBondContact O-CB 3.49Å; P183-R237 PolarHBondContact O-N 2.73Å
184	N	97.3	Very high	97.6	Very high	17 Å²	17	40 Å²	40	9%	0.091	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-44.1	-178.2	-62.3	3.6	0	0	0	108.6	D139 R140 N141 D180 D181 G182 Q186 D236 A238	D139-N184 WeakPolarHBondContact OD2-CB 3.42Å; D139-N184 PolarHBondContact OD2-ND2 3.34Å; R140-N184 PolarHBondContact O-ND2 3.02Å; N141-N184 HydrophobicContact CB-CB 4.44Å; N141-N184 WeakPolarHBondContact OD1-CA 3.25Å; N141-N184 WeakPolarHBondContact OD1-CB 3.31Å; N141-N184 PolarHBondContact OD1-OD1 2.89Å; D180-N184 HydrophobicContact CB-CB 3.48Å; D180-N184 VanDerWaalsContact CB-CB 3.48Å; D181-N184 WeakPolarHBondContact O-CB 3.47Å; D181-N184 PolarHBondContact O-N 2.03Å; G182-N184 VanDerWaalsContact C-N 3.33Å; N184-Q186 PolarHBondContact O-N 3.22Å; N184-Q186 VanDerWaalsContact O-N 3.07Å; N184-D236 VanDerWaalsContact O-CB 3.29Å; N184-D236 WeakPolarHBondContact O-CB 3.46Å; N184-A238 WeakPolarHBondContact OD1-CA 3.25Å
185	G	96.3	Very high	97.6	Very high	24 Å²	24	42.2 Å²	42.2	25%	0.247	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-3.6	170.3	0	0	0	0	0	117.7	D180 D181	D180-G185 WeakPolarHBondContact O-CA 3.4Å; D180-G185 PolarHBondContact O-N 2.81Å; D181-G185 PolarHBondContact O-N 2.86Å
186	Q	97.3	Very high	97.6	Very high	77 Å²	77	50.6 Å²	50.6	36%	0.36	27%	0.273	S	S	.	.			trans	-99.1	134.1	-174.4	-80.1	165.3	45.1	0	0	112.3	G182 P183 N184 D236 R237	G182-Q186 VanDerWaalsContact C-NE2 3.34Å; G182-Q186 VanDerWaalsContact O-CD 3.29Å; G182-Q186 VanDerWaalsContact O-CG 3.23Å; G182-Q186 WeakPolarHBondContact O-CG 3.24Å; G182-Q186 PolarHBondContact O-NE2 2.85Å; P183-Q186 PolarHBondContact O-N 3.1Å; N184-Q186 PolarHBondContact O-N 3.22Å; N184-Q186 VanDerWaalsContact O-N 3.07Å; Q186-D236 CarbonylContact O-C 3.55Å; Q186-D236 VanDerWaalsContact O-CA 3.26Å; Q186-D236 WeakPolarHBondContact O-CA 3.31Å; Q186-R237 HydrophobicContact CB-CB 4.27Å; Q186-R237 VanDerWaalsContact CB-CD 3.44Å; Q186-R237 HydrophobicContact CB-CG 4Å; Q186-R237 WeakPolarHBondContact O-CG 3.44Å; Q186-R237 PolarHBondContact O-N 3.02Å; Q186-R237 VanDerWaalsContact O-N 3.17Å
187	I	98	Very high	97.6	Very high	21 Å²	21	50.5 Å²	50.5	11%	0.108	27%	0.271	C	S	.	.			trans	-96.5	133.1	179.9	-52.4	-52.1	0	0	0	112.7	P145 A176 D178 Y189 L210 A234	P145-I187 HydrophobicContact CB-CD1 3.67Å; P145-I187 HydrophobicContact CG-CD1 3.69Å; A176-I187 HydrophobicContact CB-CG1 4.47Å; A176-I187 HydrophobicContact CB-CG2 4.44Å; D178-I187 HydrophobicContact CB-CD1 3.99Å; I187-Y189 HydrophobicContact CB-CE2 4.28Å; I187-Y189 HydrophobicContact CG2-CD1 4.08Å; I187-Y189 HydrophobicContact CG2-CD2 3.92Å; I187-Y189 HydrophobicContact CG2-CE1 3.85Å; I187-Y189 HydrophobicContact CG2-CE2 3.68Å; I187-Y189 HydrophobicContact CG2-CG 4.11Å; I187-L210 WeakPolarHBondContact O-CD2 3.27Å; I187-A234 HydrophobicContact CG2-CB 3.78Å
188	E	98	Very high	97.6	Very high	31 Å²	31	51.2 Å²	51.2	15%	0.145	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.5	157.9	-80.7	168.2	172.6	0	0	108.9	M209 L210 N235 R237 R244	E188-M209 HydrophobicContact CB-CB 4.2Å; E188-M209 HydrophobicContact CG-CB 4.19Å; E188-L210 HydrophobicContact CG-CD2 3.89Å; E188-N235 WeakPolarHBondContact CB-ND2 3.46Å; E188-N235 PolarHBondContact N-O 3.48Å; E188-N235 PolarHBondContact O-N 3.22Å; E188-N235 PolarHBondContact O-ND2 3.02Å; E188-R237 HydrophobicContact CB-CG 4.46Å; E188-R237 VanDerWaalsContact CD-NE 3.25Å; E188-R237 HydrophobicContact CG-CG 3.81Å; E188-R237 IonicContact OE1-CZ 3.17Å; E188-R237 VanDerWaalsContact OE1-CZ 3.29Å; E188-R237 IonicContact OE1-NE 2.72Å; E188-R237 PolarHBondContact OE1-NE 2.93Å; E188-R237 IonicContact OE1-NH2 2.69Å; E188-R237 PolarHBondContact OE1-NH2 2.93Å; E188-R237 IonicContact OE2-NE 2.66Å; E188-R244 IonicContact OE2-CZ 2.76Å; E188-R244 IonicContact OE2-NH1 3.42Å; E188-R244 PolarHBondContact OE2-NH1 2.91Å; E188-R244 IonicContact OE2-NH2 3.98Å; E188-R244 PolarHBondContact OE2-NH2 2.88Å; E188-R244 VanDerWaalsContact OE2-NH2 3.12Å
189	Y	98.5	Very high	97.5	Very high	13 Å²	13	53.1 Å²	53.1	5%	0.051	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	133.9	175.6	-63.2	-83.2	0	0	0	111.6	F147 F170 A176 I187 M209 G212 I232 Q233 A234	F147-Y189 HydrophobicContact CE1-CD1 4.32Å; F147-Y189 AromaticContact CE1-CE1 3.77Å; F147-Y189 HydrophobicContact CE1-CE1 3.77Å; F147-Y189 HydrophobicContact CZ-CD1 4.29Å; F147-Y189 HydrophobicContact CZ-CE1 4.09Å; F170-Y189 HydrophobicContact CB-CE1 4.43Å; F170-Y189 HydrophobicContact CB-CE2 4.42Å; F170-Y189 HydrophobicContact CD2-CD1 4.11Å; F170-Y189 HydrophobicContact CD2-CE1 4.06Å; F170-Y189 HydrophobicContact CD2-CG 4.46Å; F170-Y189 HydrophobicContact CE2-CD1 4.26Å; F170-Y189 HydrophobicContact CE2-CE1 4.46Å; F170-Y189 HydrophobicContact CG-CE1 4.15Å; A176-Y189 HydrophobicContact CB-CE1 3.93Å; A176-Y189 PolarHBondContact N-OH 3.29Å; A176-Y189 PolarHBondContact O-OH 3.39Å; I187-Y189 HydrophobicContact CB-CE2 4.28Å; I187-Y189 HydrophobicContact CG2-CD1 4.08Å; I187-Y189 HydrophobicContact CG2-CD2 3.92Å; I187-Y189 HydrophobicContact CG2-CE1 3.85Å; I187-Y189 HydrophobicContact CG2-CE2 3.68Å; I187-Y189 HydrophobicContact CG2-CG 4.11Å; Y189-M209 WeakPolarHBondContact CD2-O 3.49Å; Y189-M209 PolarHBondContact N-O 3.22Å; Y189-M209 WeakPolarHBondContact O-CG 3.45Å; Y189-G212 VanDerWaalsContact CD2-CA 3.44Å; Y189-I232 HydrophobicContact CD1-CG2 4.32Å; Y189-Q233 CarbonylContact C-O 3.58Å; Y189-Q233 WeakPolarHBondContact CA-O 3.44Å; Y189-A234 HydrophobicContact CD1-CB 4.13Å; Y189-A234 HydrophobicContact CE1-CB 4.09Å
190	V	98.2	Very high	97.5	Very high	41 Å²	41	49.8 Å²	49.8	25%	0.248	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	132.1	-178.2	-176.6	0	0	0	0	110	M209 Q233	V190-M209 HydrophobicContact CG2-CE 4.26Å; V190-M209 HydrophobicContact CG2-SD 4.36Å; V190-Q233 PolarHBondContact N-O 2.84Å; V190-Q233 PolarHBondContact O-N 3.08Å
191	I	98.3	Very high	97.4	Very high	27 Å²	27	51.4 Å²	51.4	14%	0.138	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	129.7	170.3	-59.9	-177.5	0	0	0	109.1	N201 F204 I206 V214 V230 I231 I232	I191-N201 HydrophobicContact CG2-CB 3.79Å; I191-F204 HydrophobicContact CD1-CB 3.94Å; I191-I206 HydrophobicContact CD1-CD1 4.45Å; I191-I206 HydrophobicContact CD1-CG1 4.07Å; I191-I206 HydrophobicContact CG1-CD1 3.76Å; I191-I206 HydrophobicContact CG1-CG1 3.86Å; I191-V214 HydrophobicContact CD1-CG1 4.29Å; I191-V230 HydrophobicContact CB-CG1 4.47Å; I191-V230 HydrophobicContact CD1-CG1 3.82Å; I191-V230 HydrophobicContact CG1-CG1 4.04Å; I191-V230 HydrophobicContact CG2-CG1 3.66Å; I191-I231 WeakPolarHBondContact CA-O 3.49Å; I191-I232 HydrophobicContact CG1-CG1 4.34Å
192	Q	98	Very high	97.5	Very high	75 Å²	75	50.2 Å²	50.2	35%	0.35	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	155.8	175.7	-71.8	-64.3	-13.6	0	0	111.6	N194 I231 Q233	Q192-N194 PolarHBondContact O-N 2.98Å; Q192-I231 HydrophobicContact CB-CB 4.32Å; Q192-I231 HydrophobicContact CB-CG2 4.06Å; Q192-I231 PolarHBondContact N-O 3.17Å; Q192-Q233 HydrophobicContact CG-CB 3.86Å
193	Y	98.2	Very high	97.6	Very high	132 Å²	132	49 Å²	49	52%	0.518	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-65.7	125	170.7	171.9	-99.1	0	0	0	110	P195 P198 N201	Y193-P195 HydrophobicContact CD1-CG 4.25Å; Y193-P195 HydrophobicContact CE1-CB 4.2Å; Y193-P195 HydrophobicContact CE1-CG 4.01Å; Y193-P198 HydrophobicContact CE2-CB 3.85Å; Y193-N201 VanDerWaalsContact CD2-OD1 3.3Å; Y193-N201 WeakPolarHBondContact CD2-OD1 3.33Å
194	N	98	Very high	97.6	Very high	6 Å²	6	46.9 Å²	46.9	3%	0.032	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-96	116.5	172.9	-173.3	-5.6	0	0	0	110.2	Q192 E196 D197 P198 Y229 I231	Q192-N194 PolarHBondContact O-N 2.98Å; N194-E196 PolarHBondContact O-N 2.78Å; N194-E196 WeakPolarHBondContact OD1-CB 3.27Å; N194-E196 PolarHBondContact OD1-N 3.01Å; N194-D197 HydrophobicContact CB-CB 4.37Å; N194-D197 CarbonylContact O-C 3.48Å; N194-D197 PolarHBondContact O-N 2.97Å; N194-P198 WeakPolarHBondContact O-CA 3.3Å; N194-P198 VanDerWaalsContact O-N 3.17Å; N194-Y229 PolarHBondContact ND2-O 2.67Å; N194-I231 HydrophobicContact CB-CD1 3.8Å; N194-I231 HydrophobicContact CB-CG1 3.99Å
195	P	97.4	Very high	97.7	Very high	95 Å²	95	49.7 Å²	49.7	62%	0.617	26%	0.26	S	S	*	.	S	Bend	trans	-63	-27.2	174.3	-21.6	34	0	0	0	114.1	Y193	Y193-P195 HydrophobicContact CD1-CG 4.25Å; Y193-P195 HydrophobicContact CE1-CB 4.2Å; Y193-P195 HydrophobicContact CE1-CG 4.01Å
196	E	97	Very high	97.8	Very high	177 Å²	177	49.4 Å²	49.4	83%	0.827	25%	0.252	S	S	*	.	S	Bend	trans	-84.4	-22.5	178.8	-58.1	-179.3	169.8	0	0	112.2	N194	N194-E196 PolarHBondContact O-N 2.78Å; N194-E196 WeakPolarHBondContact OD1-CB 3.27Å; N194-E196 PolarHBondContact OD1-N 3.01Å
197	D	97.4	Very high	97.8	Very high	7 Å²	7	49.2 Å²	49.2	4%	0.037	26%	0.258	C	S	.	.	S	Bend	trans	-135.4	76	171.6	-171	4.1	0	0	0	112.1	N194 T199 S200 K225 Y228 Y229	N194-D197 HydrophobicContact CB-CB 4.37Å; N194-D197 CarbonylContact O-C 3.48Å; N194-D197 PolarHBondContact O-N 2.97Å; D197-T199 PolarHBondContact O-N 3.09Å; D197-T199 PolarHBondContact OD1-OG1 2.84Å; D197-T199 VanDerWaalsContact OD1-OG1 3.05Å; D197-S200 WeakPolarHBondContact O-CB 3.37Å; D197-S200 PolarHBondContact O-N 3.08Å; D197-S200 PolarHBondContact O-OG 2.84Å; D197-K225 WeakPolarHBondContact OD1-CE 3.22Å; D197-K225 IonicContact OD1-NZ 3.01Å; D197-K225 PolarHBondContact OD1-NZ 3.2Å; D197-K225 WeakPolarHBondContact OD2-CE 3.45Å; D197-K225 IonicContact OD2-NZ 3.19Å; D197-K225 PolarHBondContact OD2-NZ 3.23Å; D197-Y228 WeakPolarHBondContact OD2-CA 3.11Å; D197-Y229 PolarHBondContact OD2-N 2.64Å
198	P	97.1	Very high	97.8	Very high	68 Å²	68	53.6 Å²	53.6	44%	0.442	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-5.7	-172.8	-27.9	38.3	0	0	0	116.3	Y193 N194	Y193-P198 HydrophobicContact CE2-CB 3.85Å; N194-P198 WeakPolarHBondContact O-CA 3.3Å; N194-P198 VanDerWaalsContact O-N 3.17Å
199	T	97.2	Very high	97.7	Very high	60 Å²	60	56.5 Å²	56.5	37%	0.368	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-18.1	178.6	63	0	0	0	0	113.2	D197 N201 D202 T203 K225 Y228	D197-T199 PolarHBondContact O-N 3.09Å; D197-T199 PolarHBondContact OD1-OG1 2.84Å; D197-T199 VanDerWaalsContact OD1-OG1 3.05Å; T199-N201 PolarHBondContact O-N 3.1Å; T199-D202 CarbonylContact O-C 3.51Å; T199-D202 WeakPolarHBondContact O-CA 3.39Å; T199-D202 WeakPolarHBondContact O-CB 3.25Å; T199-D202 PolarHBondContact O-N 2.69Å; T199-T203 PolarHBondContact O-N 2.72Å; T199-T203 PolarHBondContact O-OG1 2.83Å; T199-K225 WeakPolarHBondContact OG1-CE 3.36Å; T199-Y228 WeakPolarHBondContact OG1-CE1 3.31Å
200	S	97.7	Very high	97.6	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-52.7	-58	-176	56.4	0	0	0	0	113.8	D197 D202 T203 F204	D197-S200 WeakPolarHBondContact O-CB 3.37Å; D197-S200 PolarHBondContact O-N 3.08Å; D197-S200 PolarHBondContact O-OG 2.84Å; S200-D202 PolarHBondContact O-N 2.96Å; S200-D202 VanDerWaalsContact O-N 3.08Å; S200-T203 PolarHBondContact O-N 2.97Å; S200-F204 WeakPolarHBondContact O-CD2 3.44Å; S200-F204 PolarHBondContact O-N 2.58Å
201	N	96.3	Very high	97.6	Very high	42 Å²	42	61.7 Å²	61.7	23%	0.225	32%	0.324	C	S	.	.	H	α-helix	trans	-67.1	-7	177.8	71.1	-87.8	0	0	0	114.3	I191 Y193 T199	I191-N201 HydrophobicContact CG2-CB 3.79Å; Y193-N201 VanDerWaalsContact CD2-OD1 3.3Å; Y193-N201 WeakPolarHBondContact CD2-OD1 3.33Å; T199-N201 PolarHBondContact O-N 3.1Å
202	D	97.5	Very high	97.5	Very high	65 Å²	65	60.5 Å²	60.5	35%	0.348	32%	0.318	S	S	.	.	H	α-helix	trans	-105.3	-21.9	-179.9	-136.6	40.6	0	0	0	111.5	T199 S200 R217 K218	T199-D202 CarbonylContact O-C 3.51Å; T199-D202 WeakPolarHBondContact O-CA 3.39Å; T199-D202 WeakPolarHBondContact O-CB 3.25Å; T199-D202 PolarHBondContact O-N 2.69Å; S200-D202 PolarHBondContact O-N 2.96Å; S200-D202 VanDerWaalsContact O-N 3.08Å; D202-R217 IonicContact OD1-NH1 2.74Å; D202-R217 PolarHBondContact OD1-NH1 2.78Å; D202-K218 VanDerWaalsContact O-CD 3.31Å; D202-K218 WeakPolarHBondContact O-CD 3.26Å; D202-K218 WeakPolarHBondContact O-CE 3.31Å; D202-K218 WeakPolarHBondContact O-CG 3.32Å; D202-K218 WeakPolarHBondContact OD2-CE 3.11Å; D202-K218 IonicContact OD2-NZ 3.87Å; D202-K218 PolarHBondContact OD2-NZ 3.39Å
203	T	98.3	Very high	97.5	Very high	6 Å²	6	59 Å²	59	4%	0.037	31%	0.313	C	S	.	.	H	α-helix	trans	-92.2	-24.2	173.8	-65.1	0	0	0	0	113.3	T199 S200 L216 R217 K218 L220 Y228	T199-T203 PolarHBondContact O-N 2.72Å; T199-T203 PolarHBondContact O-OG1 2.83Å; S200-T203 PolarHBondContact O-N 2.97Å; T203-L216 HydrophobicContact CG2-CD1 4.07Å; T203-R217 WeakPolarHBondContact O-CA 3.47Å; T203-R217 WeakPolarHBondContact O-CB 3.18Å; T203-R217 PolarHBondContact O-N 2.87Å; T203-K218 HydrophobicContact CG2-CB 4.47Å; T203-K218 PolarHBondContact O-N 2.89Å; T203-L220 HydrophobicContact CG2-CD2 3.63Å; T203-Y228 HydrophobicContact CG2-CE1 3.98Å
204	F	98.6	Very high	97.5	Very high	1 Å²	1	52.8 Å²	52.8	0%	0.004	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	151.4	179.3	-57.7	-78.8	0	0	0	112.3	I166 I191 S200 V214 V215 L216 L220 Y228 V230 V253	I166-F204 HydrophobicContact CD1-CD1 4.02Å; I166-F204 HydrophobicContact CD1-CE1 3.93Å; I166-F204 HydrophobicContact CG1-CD1 4.05Å; I166-F204 HydrophobicContact CG1-CE1 4Å; I191-F204 HydrophobicContact CD1-CB 3.94Å; S200-F204 WeakPolarHBondContact O-CD2 3.44Å; S200-F204 PolarHBondContact O-N 2.58Å; F204-V214 HydrophobicContact CB-CG1 3.8Å; F204-V214 HydrophobicContact CD1-CG1 4.1Å; F204-V214 HydrophobicContact CG-CG1 4.25Å; F204-V215 WeakPolarHBondContact CA-O 3.45Å; F204-L216 HydrophobicContact CD1-CD1 4.09Å; F204-L216 HydrophobicContact CE1-CD1 3.67Å; F204-L216 HydrophobicContact CZ-CD1 4.33Å; F204-L220 HydrophobicContact CZ-CD2 4.5Å; F204-Y228 AromaticContact CE2-CD1 3.91Å; F204-Y228 HydrophobicContact CE2-CD1 3.91Å; F204-Y228 HydrophobicContact CE2-CD2 4.06Å; F204-Y228 HydrophobicContact CE2-CE1 4.48Å; F204-Y228 AromaticContact CE2-CG 3.67Å; F204-Y228 HydrophobicContact CE2-CG 3.67Å; F204-Y228 HydrophobicContact CZ-CD2 4.31Å; F204-Y228 HydrophobicContact CZ-CG 4.36Å; F204-V230 HydrophobicContact CD2-CG2 3.57Å; F204-V230 HydrophobicContact CE2-CG2 4.04Å; F204-V230 HydrophobicContact CG-CG2 4.24Å; F204-V253 HydrophobicContact CE1-CG1 4.14Å; F204-V253 HydrophobicContact CE2-CB 4.44Å; F204-V253 HydrophobicContact CE2-CG2 4.48Å; F204-V253 HydrophobicContact CZ-CB 4.09Å; F204-V253 HydrophobicContact CZ-CG1 3.75Å; F204-V253 HydrophobicContact CZ-CG2 4.29Å
205	E	98.2	Very high	97.5	Very high	75 Å²	75	53 Å²	53	35%	0.35	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	158.7	171.6	57.1	-178.8	-139	0	0	113	V215 R217	E205-V215 HydrophobicContact CG-CB 4.44Å; E205-V215 PolarHBondContact N-O 2.79Å; E205-V215 PolarHBondContact O-N 2.93Å; E205-R217 HydrophobicContact CG-CB 4.1Å; E205-R217 HydrophobicContact CG-CG 4.06Å; E205-R217 WeakPolarHBondContact OE2-CD 3.41Å; E205-R217 WeakPolarHBondContact OE2-CG 3.43Å; E205-R217 IonicContact OE2-NE 3.83Å; E205-R217 PolarHBondContact OE2-NE 3.33Å
206	I	98.5	Very high	97.6	Very high	18 Å²	18	48.6 Å²	48.6	9%	0.092	26%	0.261	C	S	.	.			trans	-111.9	96.7	167.4	-65.5	170.1	0	0	0	107.1	I191 L208 V214 I232	I191-I206 HydrophobicContact CD1-CD1 4.45Å; I191-I206 HydrophobicContact CD1-CG1 4.07Å; I191-I206 HydrophobicContact CG1-CD1 3.76Å; I191-I206 HydrophobicContact CG1-CG1 3.86Å; I206-L208 VanDerWaalsContact C-N 3.29Å; I206-L208 PolarHBondContact O-N 2.87Å; I206-V214 HydrophobicContact CD1-CG2 4.2Å; I206-V214 HydrophobicContact CG1-CG2 3.91Å; I206-I232 HydrophobicContact CD1-CD1 4.4Å; I206-I232 HydrophobicContact CD1-CG2 3.95Å
207	P	97.7	Very high	97.6	Very high	74 Å²	74	45.3 Å²	45.3	48%	0.481	24%	0.241	S	C	.	.	S	Bend	trans	-75.7	-17.7	-177.2	29.4	-34.7	0	0	0	113.1	V215	P207-V215 HydrophobicContact CG-CB 4.32Å; P207-V215 HydrophobicContact CG-CG2 3.73Å
208	L	97.1	Very high	97.7	Very high	113 Å²	113	49 Å²	49	59%	0.592	26%	0.257	S	S	*	.			trans	-125.1	89.3	177.1	-67.6	177.5	0	0	0	109.9	I206 L210 T211 G212	I206-L208 VanDerWaalsContact C-N 3.29Å; I206-L208 PolarHBondContact O-N 2.87Å; L208-L210 PolarHBondContact O-N 2.66Å; L208-T211 HydrophobicContact CB-CG2 4.23Å; L208-T211 PolarHBondContact O-N 2.85Å; L208-T211 PolarHBondContact O-OG1 2.99Å; L208-G212 PolarHBondContact O-N 3.36Å
209	M	97.1	Very high	97.7	Very high	92 Å²	92	56 Å²	56	45%	0.453	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-29.5	-175.6	-63.7	174.7	173.3	0	0	113.9	E188 Y189 V190 T211	E188-M209 HydrophobicContact CB-CB 4.2Å; E188-M209 HydrophobicContact CG-CB 4.19Å; Y189-M209 WeakPolarHBondContact CD2-O 3.49Å; Y189-M209 PolarHBondContact N-O 3.22Å; Y189-M209 WeakPolarHBondContact O-CG 3.45Å; V190-M209 HydrophobicContact CG2-CE 4.26Å; V190-M209 HydrophobicContact CG2-SD 4.36Å; M209-T211 VanDerWaalsContact C-N 3.32Å; M209-T211 PolarHBondContact O-N 2.96Å
210	L	96.6	Very high	97.7	Very high	110 Å²	110	54 Å²	54	58%	0.576	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-12.6	178.4	-59.7	178.8	0	0	0	114.3	I187 E188 L208	I187-L210 WeakPolarHBondContact O-CD2 3.27Å; E188-L210 HydrophobicContact CG-CD2 3.89Å; L208-L210 PolarHBondContact O-N 2.66Å
211	T	96.6	Very high	97.8	Very high	53 Å²	53	55.8 Å²	55.8	33%	0.325	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-28.9	176.7	67.7	0	0	0	0	112.6	L208 M209 N213	L208-T211 HydrophobicContact CB-CG2 4.23Å; L208-T211 PolarHBondContact O-N 2.85Å; L208-T211 PolarHBondContact O-OG1 2.99Å; M209-T211 VanDerWaalsContact C-N 3.32Å; M209-T211 PolarHBondContact O-N 2.96Å; T211-N213 PolarHBondContact O-N 3.02Å; T211-N213 PolarHBondContact OG1-N 3.02Å
212	G	96.6	Very high	97.9	Very high	1 Å²	1	56 Å²	56	1%	0.01	27%	0.269	C	S	.	.			trans	69	7.5	-173.8	0	0	0	0	0	114.3	F170 Y189 L208 V214	F170-G212 WeakPolarHBondContact CD2-O 3.19Å; Y189-G212 VanDerWaalsContact CD2-CA 3.44Å; L208-G212 PolarHBondContact O-N 3.36Å; G212-V214 PolarHBondContact O-N 2.73Å
213	N	98.1	Very high	97.8	Very high	45 Å²	45	56 Å²	56	24%	0.241	27%	0.267	C	S	.	.			trans	-61.3	123.2	176.6	-73.1	-0.8	0	0	0	110.1	T165 F167 T211	T165-N213 HydrophobicContact CG2-CB 3.96Å; F167-N213 WeakPolarHBondContact O-CA 3.27Å; T211-N213 PolarHBondContact O-N 3.02Å; T211-N213 PolarHBondContact OG1-N 3.02Å
214	V	98.4	Very high	97.7	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	133	-180	-175.9	0	0	0	0	109.6	T165 I166 F167 I191 F204 I206 G212 I232 L251	T165-V214 CarbonylContact C-O 3.27Å; T165-V214 WeakPolarHBondContact CA-O 3.16Å; I166-V214 HydrophobicContact CD1-CB 4.2Å; I166-V214 HydrophobicContact CD1-CG1 3.94Å; I166-V214 HydrophobicContact CG1-CG1 4.36Å; I166-V214 PolarHBondContact N-O 2.82Å; F167-V214 HydrophobicContact CB-CB 4.2Å; F167-V214 HydrophobicContact CD1-CG2 4.11Å; F167-V214 PolarHBondContact N-O 3.28Å; F167-V214 PolarHBondContact O-N 3.08Å; I191-V214 HydrophobicContact CD1-CG1 4.29Å; F204-V214 HydrophobicContact CB-CG1 3.8Å; F204-V214 HydrophobicContact CD1-CG1 4.1Å; F204-V214 HydrophobicContact CG-CG1 4.25Å; I206-V214 HydrophobicContact CD1-CG2 4.2Å; I206-V214 HydrophobicContact CG1-CG2 3.91Å; G212-V214 PolarHBondContact O-N 2.73Å; V214-I232 HydrophobicContact CG2-CD1 3.87Å; V214-L251 HydrophobicContact CB-CD2 4.46Å; V214-L251 HydrophobicContact CG2-CD2 3.9Å
215	V	98.5	Very high	97.7	Very high	12 Å²	12	63.8 Å²	63.8	7%	0.073	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	139.7	-176.1	175.1	0	0	0	0	109.8	T164 F204 E205 P207 R217	T164-V215 WeakPolarHBondContact O-CA 3.38Å; F204-V215 WeakPolarHBondContact CA-O 3.45Å; E205-V215 HydrophobicContact CG-CB 4.44Å; E205-V215 PolarHBondContact N-O 2.79Å; E205-V215 PolarHBondContact O-N 2.93Å; P207-V215 HydrophobicContact CG-CB 4.32Å; P207-V215 HydrophobicContact CG-CG2 3.73Å; V215-R217 PolarHBondContact O-N 3.33Å
216	L	98.6	Very high	97.7	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	121.7	176.5	-175.5	65.6	0	0	0	110.5	T160 G163 T164 I166 T203 F204 K218 L220	T160-L216 HydrophobicContact CG2-CD2 3.81Å; T160-L216 VanDerWaalsContact O-CD2 3.26Å; T160-L216 WeakPolarHBondContact O-CD2 3.5Å; G163-L216 PolarHBondContact N-O 2.86Å; T164-L216 PolarHBondContact O-N 2.67Å; I166-L216 HydrophobicContact CG2-CB 3.97Å; T203-L216 HydrophobicContact CG2-CD1 4.07Å; F204-L216 HydrophobicContact CD1-CD1 4.09Å; F204-L216 HydrophobicContact CE1-CD1 3.67Å; F204-L216 HydrophobicContact CZ-CD1 4.33Å; L216-K218 VanDerWaalsContact CD1-O 3.24Å; L216-K218 WeakPolarHBondContact CD1-O 3.42Å; L216-K218 WeakPolarHBondContact CG-O 3.38Å; L216-L220 HydrophobicContact CD1-CD1 4.04Å; L216-L220 HydrophobicContact CD1-CD2 3.94Å; L216-L220 HydrophobicContact CD1-CG 3.89Å; L216-L220 HydrophobicContact CD2-CD1 4.19Å; L216-L220 HydrophobicContact CD2-CG 4.3Å
217	R	98.3	Very high	97.7	Very high	109 Å²	109	67.8 Å²	67.8	41%	0.411	32%	0.324	S	S	.	.			trans	-104.8	-28.6	-170.2	-166.1	-176.6	-174	-132.8	-12.6	113.7	V162 D202 T203 E205 V215	V162-R217 WeakPolarHBondContact CG1-O 3.33Å; D202-R217 IonicContact OD1-NH1 2.74Å; D202-R217 PolarHBondContact OD1-NH1 2.78Å; T203-R217 WeakPolarHBondContact O-CA 3.47Å; T203-R217 WeakPolarHBondContact O-CB 3.18Å; T203-R217 PolarHBondContact O-N 2.87Å; E205-R217 HydrophobicContact CG-CB 4.1Å; E205-R217 HydrophobicContact CG-CG 4.06Å; E205-R217 WeakPolarHBondContact OE2-CD 3.41Å; E205-R217 WeakPolarHBondContact OE2-CG 3.43Å; E205-R217 IonicContact OE2-NE 3.83Å; E205-R217 PolarHBondContact OE2-NE 3.33Å; V215-R217 PolarHBondContact O-N 3.33Å
218	K	98	Very high	97.7	Very high	84 Å²	84	65 Å²	65	37%	0.365	30%	0.304	S	S	.	.	S	Bend	trans	-123.3	157.5	172.7	-69.1	178.4	-179.2	173.7	0	109.5	V162 D202 T203 L216	V162-K218 VanDerWaalsContact CG2-C 3.41Å; D202-K218 VanDerWaalsContact O-CD 3.31Å; D202-K218 WeakPolarHBondContact O-CD 3.26Å; D202-K218 WeakPolarHBondContact O-CE 3.31Å; D202-K218 WeakPolarHBondContact O-CG 3.32Å; D202-K218 WeakPolarHBondContact OD2-CE 3.11Å; D202-K218 IonicContact OD2-NZ 3.87Å; D202-K218 PolarHBondContact OD2-NZ 3.39Å; T203-K218 HydrophobicContact CG2-CB 4.47Å; T203-K218 PolarHBondContact O-N 2.89Å; L216-K218 VanDerWaalsContact CD1-O 3.24Å; L216-K218 WeakPolarHBondContact CD1-O 3.42Å; L216-K218 WeakPolarHBondContact CG-O 3.38Å
219	R	98	Very high	97.8	Very high	216 Å²	216	64.2 Å²	64.2	82%	0.815	29%	0.294	S	S	*	.			trans	-64	150.8	165.9	-69.7	-174.7	-179.8	179.5	-3	109.5	V162	V162-R219 HydrophobicContact CG2-CG 3.9Å
220	L	98.2	Very high	97.9	Very high	17 Å²	17	59.8 Å²	59.8	9%	0.089	27%	0.272	C	S	.	.			trans	-95.5	167.5	173.1	-59	169.9	0	0	0	108.9	V156 E158 T203 F204 L216 Y228 V255	V156-L220 HydrophobicContact CB-CD1 4.3Å; V156-L220 HydrophobicContact CG1-CD1 3.56Å; V156-L220 HydrophobicContact CG2-CD1 3.76Å; E158-L220 HydrophobicContact CB-CB 3.88Å; T203-L220 HydrophobicContact CG2-CD2 3.63Å; F204-L220 HydrophobicContact CZ-CD2 4.5Å; L216-L220 HydrophobicContact CD1-CD1 4.04Å; L216-L220 HydrophobicContact CD1-CD2 3.94Å; L216-L220 HydrophobicContact CD1-CG 3.89Å; L216-L220 HydrophobicContact CD2-CD1 4.19Å; L216-L220 HydrophobicContact CD2-CG 4.3Å; L220-Y228 HydrophobicContact CD2-CE2 3.81Å; L220-V255 HydrophobicContact CB-CG1 4.26Å; L220-V255 HydrophobicContact CD1-CG1 4.2Å; L220-V255 HydrophobicContact CD1-CG2 4.15Å; L220-V255 HydrophobicContact CD2-CG2 4.25Å
221	N	97.9	Very high	97.9	Very high	38 Å²	38	56.3 Å²	56.3	20%	0.203	25%	0.254	C	S	.	.			trans	-153.8	129.2	162.4	171.6	-113.2	0	0	0	107.6	E158 E223 D224 K225	E158-N221 VanDerWaalsContact OE2-CA 3.24Å; E158-N221 WeakPolarHBondContact OE2-CA 3.17Å; N221-E223 PolarHBondContact ND2-OE2 2.85Å; N221-D224 HydrophobicContact CB-CB 4.26Å; N221-D224 PolarHBondContact O-N 2.82Å; N221-D224 WeakPolarHBondContact OD1-CB 3.24Å; N221-D224 PolarHBondContact OD1-N 2.71Å; N221-D224 PolarHBondContact OD1-OD1 3.1Å; N221-K225 PolarHBondContact O-N 2.7Å; N221-K225 VanDerWaalsContact O-N 3.08Å
222	Y	98.3	Very high	98	Very high	46 Å²	46	53.8 Å²	53.8	18%	0.18	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-36	-171.2	-176.7	-98.5	0	0	0	111.9	E158 D224 K225 T226 V255 D257 N312	E158-Y222 WeakPolarHBondContact OE1-CB 3.34Å; E158-Y222 WeakPolarHBondContact OE2-CB 3.35Å; E158-Y222 PolarHBondContact OE2-N 2.83Å; Y222-D224 PolarHBondContact O-N 3.03Å; Y222-K225 PolarHBondContact O-N 3.05Å; Y222-T226 HydrophobicContact CD1-CG2 4.21Å; Y222-T226 HydrophobicContact CD2-CG2 3.59Å; Y222-T226 HydrophobicContact CE1-CG2 4.07Å; Y222-T226 HydrophobicContact CE2-CG2 3.43Å; Y222-T226 VanDerWaalsContact CE2-CG2 3.43Å; Y222-T226 HydrophobicContact CG-CG2 3.96Å; Y222-T226 VanDerWaalsContact O-CG2 3.25Å; Y222-T226 WeakPolarHBondContact O-CG2 3.21Å; Y222-V255 HydrophobicContact CD2-CB 4.24Å; Y222-V255 HydrophobicContact CD2-CG1 4.18Å; Y222-V255 WeakPolarHBondContact CE2-O 3.45Å; Y222-D257 HydrophobicContact CD1-CB 3.84Å; Y222-D257 WeakPolarHBondContact CD1-OD2 3.34Å; Y222-D257 HydrophobicContact CD2-CB 4.04Å; Y222-D257 HydrophobicContact CE1-CB 3.76Å; Y222-D257 WeakPolarHBondContact CE1-OD2 3.36Å; Y222-D257 HydrophobicContact CE2-CB 3.98Å; Y222-D257 HydrophobicContact CG-CB 4Å; Y222-N312 HydrophobicContact CE1-CB 4.32Å; Y222-N312 PolarHBondContact OH-ND2 2.77Å
223	E	97	Very high	98.1	Very high	64 Å²	64	55.6 Å²	55.6	30%	0.299	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-17.7	177.2	-61.2	60.5	-105.6	0	0	112.5	N221 L261 R275	N221-E223 PolarHBondContact ND2-OE2 2.85Å; E223-L261 HydrophobicContact CG-CD1 4.44Å; E223-R275 PolarHBondContact O-NH2 2.84Å
224	D	96.3	Very high	98.1	Very high	115 Å²	115	53.4 Å²	53.4	62%	0.615	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-48.2	175.5	-83.6	10.4	0	0	0	112.4	N221 Y222 R275	N221-D224 HydrophobicContact CB-CB 4.26Å; N221-D224 PolarHBondContact O-N 2.82Å; N221-D224 WeakPolarHBondContact OD1-CB 3.24Å; N221-D224 PolarHBondContact OD1-N 2.71Å; N221-D224 PolarHBondContact OD1-OD1 3.1Å; Y222-D224 PolarHBondContact O-N 3.03Å; D224-R275 IonicContact OD1-CZ 2.74Å; D224-R275 VanDerWaalsContact OD1-CZ 3.23Å; D224-R275 IonicContact OD1-NH1 4Å; D224-R275 PolarHBondContact OD1-NH1 2.89Å; D224-R275 IonicContact OD1-NH2 3.75Å; D224-R275 PolarHBondContact OD1-NH2 3.33Å
225	K	97.5	Very high	98.1	Very high	56 Å²	56	54.4 Å²	54.4	24%	0.243	24%	0.24	C	C	.	.			trans	-160.2	106.9	-177.6	-175.6	166.2	158	74.4	0	114.3	D197 T199 N221 Y222 R227 Y228 V255	D197-K225 WeakPolarHBondContact OD1-CE 3.22Å; D197-K225 IonicContact OD1-NZ 3.01Å; D197-K225 PolarHBondContact OD1-NZ 3.2Å; D197-K225 WeakPolarHBondContact OD2-CE 3.45Å; D197-K225 IonicContact OD2-NZ 3.19Å; D197-K225 PolarHBondContact OD2-NZ 3.23Å; T199-K225 WeakPolarHBondContact OG1-CE 3.36Å; N221-K225 PolarHBondContact O-N 2.7Å; N221-K225 VanDerWaalsContact O-N 3.08Å; Y222-K225 PolarHBondContact O-N 3.05Å; K225-R227 VanDerWaalsContact CE-O 3.27Å; K225-R227 WeakPolarHBondContact CE-O 3.3Å; K225-R227 PolarHBondContact NZ-O 2.79Å; K225-Y228 HydrophobicContact CB-CE2 4.39Å; K225-Y228 HydrophobicContact CD-CD1 4.14Å; K225-Y228 HydrophobicContact CD-CE1 3.68Å; K225-Y228 HydrophobicContact CD-CE2 4.14Å; K225-Y228 HydrophobicContact CG-CD2 4.4Å; K225-Y228 HydrophobicContact CG-CE1 4.38Å; K225-Y228 HydrophobicContact CG-CE2 3.93Å; K225-V255 WeakPolarHBondContact O-CG2 3.26Å
226	T	98.1	Very high	98.1	Very high	68 Å²	68	53.8 Å²	53.8	42%	0.417	24%	0.237	S	C	.	.	S	Bend	trans	-81.9	-16	-177.7	62.3	0	0	0	0	116	Y222 V255	Y222-T226 HydrophobicContact CD1-CG2 4.21Å; Y222-T226 HydrophobicContact CD2-CG2 3.59Å; Y222-T226 HydrophobicContact CE1-CG2 4.07Å; Y222-T226 HydrophobicContact CE2-CG2 3.43Å; Y222-T226 VanDerWaalsContact CE2-CG2 3.43Å; Y222-T226 HydrophobicContact CG-CG2 3.96Å; Y222-T226 VanDerWaalsContact O-CG2 3.25Å; Y222-T226 WeakPolarHBondContact O-CG2 3.21Å; T226-V255 PolarHBondContact O-N 3.49Å
227	R	98.4	Very high	98	Very high	109 Å²	109	57.5 Å²	57.5	41%	0.411	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	138	-176.8	175.5	168.9	-71.5	168.6	-1.6	112.7	K225 Y229 T252 V253 D254	K225-R227 VanDerWaalsContact CE-O 3.27Å; K225-R227 WeakPolarHBondContact CE-O 3.3Å; K225-R227 PolarHBondContact NZ-O 2.79Å; R227-Y229 VanDerWaalsContact CD-OH 3.31Å; R227-Y229 WeakPolarHBondContact CD-OH 3.42Å; R227-Y229 HydrophobicContact CG-CE1 4.32Å; R227-Y229 HydrophobicContact CG-CE2 4.38Å; R227-T252 HydrophobicContact CG-CG2 4.14Å; R227-V253 WeakPolarHBondContact CA-O 3.42Å; R227-D254 IonicContact CZ-OD1 2.65Å; R227-D254 IonicContact CZ-OD2 3.28Å; R227-D254 IonicContact NE-OD1 2.71Å; R227-D254 PolarHBondContact NE-OD1 2.84Å; R227-D254 IonicContact NE-OD2 3.84Å; R227-D254 VanDerWaalsContact NH2-CG 3.34Å; R227-D254 IonicContact NH2-OD1 2.68Å; R227-D254 PolarHBondContact NH2-OD1 3.23Å; R227-D254 VanDerWaalsContact NH2-OD1 3.12Å; R227-D254 IonicContact NH2-OD2 3.56Å; R227-D254 PolarHBondContact NH2-OD2 2.78Å
228	Y	98.6	Very high	97.9	Very high	16 Å²	16	52.4 Å²	52.4	6%	0.063	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	147.6	174.7	-67.1	-101.6	0	0	0	112.5	D197 T199 T203 F204 L220 K225 T252 V253 V255	D197-Y228 WeakPolarHBondContact OD2-CA 3.11Å; T199-Y228 WeakPolarHBondContact OG1-CE1 3.31Å; T203-Y228 HydrophobicContact CG2-CE1 3.98Å; F204-Y228 AromaticContact CE2-CD1 3.91Å; F204-Y228 HydrophobicContact CE2-CD1 3.91Å; F204-Y228 HydrophobicContact CE2-CD2 4.06Å; F204-Y228 HydrophobicContact CE2-CE1 4.48Å; F204-Y228 AromaticContact CE2-CG 3.67Å; F204-Y228 HydrophobicContact CE2-CG 3.67Å; F204-Y228 HydrophobicContact CZ-CD2 4.31Å; F204-Y228 HydrophobicContact CZ-CG 4.36Å; L220-Y228 HydrophobicContact CD2-CE2 3.81Å; K225-Y228 HydrophobicContact CB-CE2 4.39Å; K225-Y228 HydrophobicContact CD-CD1 4.14Å; K225-Y228 HydrophobicContact CD-CE1 3.68Å; K225-Y228 HydrophobicContact CD-CE2 4.14Å; K225-Y228 HydrophobicContact CG-CD2 4.4Å; K225-Y228 HydrophobicContact CG-CE1 4.38Å; K225-Y228 HydrophobicContact CG-CE2 3.93Å; Y228-T252 WeakPolarHBondContact O-CA 3.18Å; Y228-V253 PolarHBondContact N-O 3.09Å; Y228-V253 PolarHBondContact O-N 3.12Å; Y228-V255 HydrophobicContact CD2-CG2 4.15Å; Y228-V255 HydrophobicContact CE2-CG2 3.89Å
229	Y	98.6	Very high	97.8	Very high	96 Å²	96	56.8 Å²	56.8	38%	0.376	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	94.4	174.9	-62.8	-66.1	0	0	0	110.5	N194 D197 R227 T250 T252	N194-Y229 PolarHBondContact ND2-O 2.67Å; D197-Y229 PolarHBondContact OD2-N 2.64Å; R227-Y229 VanDerWaalsContact CD-OH 3.31Å; R227-Y229 WeakPolarHBondContact CD-OH 3.42Å; R227-Y229 HydrophobicContact CG-CE1 4.32Å; R227-Y229 HydrophobicContact CG-CE2 4.38Å; Y229-T250 HydrophobicContact CD1-CG2 4.24Å; Y229-T252 HydrophobicContact CD1-CG2 4.06Å; Y229-T252 HydrophobicContact CE1-CG2 3.8Å
230	V	98.5	Very high	97.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	110.2	-175.5	-173.1	0	0	0	0	109.5	I191 F204 I232 L251 V253	I191-V230 HydrophobicContact CB-CG1 4.47Å; I191-V230 HydrophobicContact CD1-CG1 3.82Å; I191-V230 HydrophobicContact CG1-CG1 4.04Å; I191-V230 HydrophobicContact CG2-CG1 3.66Å; F204-V230 HydrophobicContact CD2-CG2 3.57Å; F204-V230 HydrophobicContact CE2-CG2 4.04Å; F204-V230 HydrophobicContact CG-CG2 4.24Å; V230-I232 HydrophobicContact CG1-CD1 4.21Å; V230-I232 HydrophobicContact CG1-CG1 3.9Å; V230-I232 PolarHBondContact O-N 2.99Å; V230-L251 HydrophobicContact CB-CB 4.29Å; V230-L251 PolarHBondContact N-O 2.62Å; V230-L251 PolarHBondContact O-N 2.87Å; V230-V253 HydrophobicContact CG2-CG2 4.07Å
231	I	98.4	Very high	97.4	Very high	37 Å²	37	54.8 Å²	54.8	19%	0.19	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	123.1	173	-59.5	177.5	0	0	0	108.6	I191 Q192 N194 T248	I191-I231 WeakPolarHBondContact CA-O 3.49Å; Q192-I231 HydrophobicContact CB-CB 4.32Å; Q192-I231 HydrophobicContact CB-CG2 4.06Å; Q192-I231 PolarHBondContact N-O 3.17Å; N194-I231 HydrophobicContact CB-CD1 3.8Å; N194-I231 HydrophobicContact CB-CG1 3.99Å; I231-T248 HydrophobicContact CG2-CG2 4.19Å
232	I	98.5	Very high	97.3	Very high	0 Å²	0	60 Å²	60	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	120.4	-179.7	-55.9	-177.5	0	0	0	109	F170 Y189 I191 I206 V214 V230 T248 T249 L251	F170-I232 HydrophobicContact CE2-CD1 3.79Å; F170-I232 HydrophobicContact CE2-CG2 3.9Å; F170-I232 HydrophobicContact CZ-CB 4.36Å; F170-I232 HydrophobicContact CZ-CD1 3.79Å; F170-I232 HydrophobicContact CZ-CG2 4.09Å; Y189-I232 HydrophobicContact CD1-CG2 4.32Å; I191-I232 HydrophobicContact CG1-CG1 4.34Å; I206-I232 HydrophobicContact CD1-CD1 4.4Å; I206-I232 HydrophobicContact CD1-CG2 3.95Å; V214-I232 HydrophobicContact CG2-CD1 3.87Å; V230-I232 HydrophobicContact CG1-CD1 4.21Å; V230-I232 HydrophobicContact CG1-CG1 3.9Å; V230-I232 PolarHBondContact O-N 2.99Å; I232-T248 CarbonylContact O-C 3.32Å; I232-T248 WeakPolarHBondContact O-CA 3.34Å; I232-T249 HydrophobicContact CB-CG2 4.23Å; I232-T249 PolarHBondContact N-O 2.96Å; I232-T249 PolarHBondContact O-N 3.43Å; I232-L251 HydrophobicContact CD1-CB 3.81Å; I232-L251 HydrophobicContact CD1-CD2 3.88Å; I232-L251 HydrophobicContact CG1-CB 4.49Å
233	Q	98.3	Very high	97.1	Very high	38 Å²	38	62.6 Å²	62.6	18%	0.178	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.7	175.4	-171.9	179	45.8	0	0	109.8	Y189 V190 Q192 T246 T247 T248	Y189-Q233 CarbonylContact C-O 3.58Å; Y189-Q233 WeakPolarHBondContact CA-O 3.44Å; V190-Q233 PolarHBondContact N-O 2.84Å; V190-Q233 PolarHBondContact O-N 3.08Å; Q192-Q233 HydrophobicContact CG-CB 3.86Å; Q233-T246 HydrophobicContact CG-CG2 4.39Å; Q233-T246 PolarHBondContact NE2-OG1 3.06Å; Q233-T247 CarbonylContact C-O 3.55Å; Q233-T247 WeakPolarHBondContact CA-O 3.45Å; Q233-T248 HydrophobicContact CB-CG2 4.01Å; Q233-T248 HydrophobicContact CG-CG2 4.1Å
234	A	98.4	Very high	97.1	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	134.3	158.3	0	0	0	0	0	108.4	P145 F147 A176 I187 Y189 T246 T247	P145-A234 HydrophobicContact CB-CB 3.9Å; F147-A234 HydrophobicContact CE1-CB 4.47Å; F147-A234 HydrophobicContact CE2-CB 3.75Å; F147-A234 HydrophobicContact CZ-CB 3.64Å; A176-A234 HydrophobicContact CB-CB 3.48Å; A176-A234 VanDerWaalsContact CB-CB 3.48Å; I187-A234 HydrophobicContact CG2-CB 3.78Å; Y189-A234 HydrophobicContact CD1-CB 4.13Å; Y189-A234 HydrophobicContact CE1-CB 4.09Å; A234-T246 CarbonylContact O-C 3.58Å; A234-T246 VanDerWaalsContact O-CA 3.25Å; A234-T246 WeakPolarHBondContact O-CA 3.44Å; A234-T247 PolarHBondContact N-O 3.05Å; A234-T247 PolarHBondContact O-N 2.9Å
235	N	97.5	Very high	97.2	Very high	20 Å²	20	61.3 Å²	61.3	11%	0.107	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	145.7	169.1	78.1	126.5	0	0	0	110.4	E188 R244 R245 T246	E188-N235 WeakPolarHBondContact CB-ND2 3.46Å; E188-N235 PolarHBondContact N-O 3.48Å; E188-N235 PolarHBondContact O-N 3.22Å; E188-N235 PolarHBondContact O-ND2 3.02Å; N235-R244 PolarHBondContact OD1-NH1 2.84Å; N235-R245 WeakPolarHBondContact CA-O 3.45Å; N235-T246 HydrophobicContact CB-CG2 3.7Å
236	D	97.8	Very high	97.2	Very high	0 Å²	0	62 Å²	62	0%	0	29%	0.293	C	S	.	.			trans	-69.5	178	173.8	68.3	58.7	0	0	0	111.9	N141 P145 N184 Q186 A238 R244 R245	N141-D236 PolarHBondContact ND2-OD2 2.71Å; P145-D236 HydrophobicContact CG-CB 4.4Å; N184-D236 VanDerWaalsContact O-CB 3.29Å; N184-D236 WeakPolarHBondContact O-CB 3.46Å; Q186-D236 CarbonylContact O-C 3.55Å; Q186-D236 VanDerWaalsContact O-CA 3.26Å; Q186-D236 WeakPolarHBondContact O-CA 3.31Å; D236-A238 WeakPolarHBondContact OD1-CB 3.36Å; D236-A238 PolarHBondContact OD1-N 3.08Å; D236-R244 WeakPolarHBondContact O-CD 3.35Å; D236-R244 VanDerWaalsContact O-CZ 3.24Å; D236-R244 PolarHBondContact O-NE 3.22Å; D236-R244 PolarHBondContact O-NH1 3.43Å; D236-R244 WeakPolarHBondContact OD1-CA 3.21Å; D236-R244 VanDerWaalsContact OD1-CG 3.31Å; D236-R244 WeakPolarHBondContact OD1-CG 3.34Å; D236-R244 WeakPolarHBondContact OD2-CA 3.38Å; D236-R245 PolarHBondContact N-O 2.74Å; D236-R245 WeakPolarHBondContact OD2-CA 3.04Å; D236-R245 WeakPolarHBondContact OD2-CB 3.49Å; D236-R245 PolarHBondContact OD2-N 2.88Å
237	R	97.3	Very high	97.2	Very high	78 Å²	78	61.1 Å²	61.1	29%	0.294	29%	0.287	S	S	.	.			trans	-113.9	31.2	178	-53.1	172.7	86.3	-124.9	-7	113.4	P183 Q186 E188 Q239	P183-R237 HydrophobicContact CB-CB 4.34Å; P183-R237 VanDerWaalsContact CB-O 3.31Å; P183-R237 WeakPolarHBondContact CB-O 3.36Å; P183-R237 CarbonylContact O-C 3.58Å; P183-R237 VanDerWaalsContact O-C 3.27Å; P183-R237 VanDerWaalsContact O-CA 3.23Å; P183-R237 WeakPolarHBondContact O-CA 3.12Å; P183-R237 VanDerWaalsContact O-CB 3.23Å; P183-R237 WeakPolarHBondContact O-CB 3.49Å; P183-R237 PolarHBondContact O-N 2.73Å; Q186-R237 HydrophobicContact CB-CB 4.27Å; Q186-R237 VanDerWaalsContact CB-CD 3.44Å; Q186-R237 HydrophobicContact CB-CG 4Å; Q186-R237 WeakPolarHBondContact O-CG 3.44Å; Q186-R237 PolarHBondContact O-N 3.02Å; Q186-R237 VanDerWaalsContact O-N 3.17Å; E188-R237 HydrophobicContact CB-CG 4.46Å; E188-R237 VanDerWaalsContact CD-NE 3.25Å; E188-R237 HydrophobicContact CG-CG 3.81Å; E188-R237 IonicContact OE1-CZ 3.17Å; E188-R237 VanDerWaalsContact OE1-CZ 3.29Å; E188-R237 IonicContact OE1-NE 2.72Å; E188-R237 PolarHBondContact OE1-NE 2.93Å; E188-R237 IonicContact OE1-NH2 2.69Å; E188-R237 PolarHBondContact OE1-NH2 2.93Å; E188-R237 IonicContact OE2-NE 2.66Å; R237-Q239 PolarHBondContact O-N 3.17Å
238	A	96.5	Very high	97.1	Very high	2 Å²	2	59.8 Å²	59.8	2%	0.017	29%	0.291	C	S	.	.			trans	-48.4	139.2	175.3	0	0	0	0	0	111.9	N141 N184 D236 N240 E243 R244	N141-A238 HydrophobicContact CB-CB 4.15Å; N141-A238 WeakPolarHBondContact OD1-CB 3.38Å; N184-A238 WeakPolarHBondContact OD1-CA 3.25Å; D236-A238 WeakPolarHBondContact OD1-CB 3.36Å; D236-A238 PolarHBondContact OD1-N 3.08Å; A238-N240 VanDerWaalsContact C-N 3.27Å; A238-N240 PolarHBondContact O-N 3.44Å; A238-E243 HydrophobicContact CB-CB 4.45Å; A238-R244 HydrophobicContact CB-CG 3.86Å; A238-R244 PolarHBondContact O-NE 3.22Å
239	Q	95.4	Very high	97.1	Very high	176 Å²	176	59.3 Å²	59.3	82%	0.822	29%	0.29	S	S	*	.	S	Bend	trans	-68.4	-27.9	-173.1	-60.9	-175	24.8	0	0	112.7	R237	R237-Q239 PolarHBondContact O-N 3.17Å
240	N	94	Very high	97.1	Very high	58 Å²	58	57.2 Å²	57.2	31%	0.31	29%	0.288	S	S	.	.	S	Bend	trans	-95.3	116.8	170.1	-179.8	4.3	0	0	0	109	A238 N242 E243 R244	A238-N240 VanDerWaalsContact C-N 3.27Å; A238-N240 PolarHBondContact O-N 3.44Å; N240-N242 PolarHBondContact O-N 3.15Å; N240-N242 PolarHBondContact OD1-N 2.97Å; N240-N242 VanDerWaalsContact OD1-N 3.1Å; N240-N242 PolarHBondContact OD1-ND2 2.95Å; N240-E243 HydrophobicContact CB-CB 4.11Å; N240-E243 HydrophobicContact CB-CG 4.08Å; N240-E243 VanDerWaalsContact ND2-CD 3.26Å; N240-E243 PolarHBondContact ND2-OE1 2.91Å; N240-E243 PolarHBondContact O-N 2.82Å; N240-R244 PolarHBondContact O-N 3.09Å
241	L	94.3	Very high	97.1	Very high	134 Å²	134	57.2 Å²	57.2	70%	0.702	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-16.1	179.4	-60.8	178.2	0	0	0	114.1
242	N	95.2	Very high	97.1	Very high	148 Å²	148	56.7 Å²	56.7	79%	0.791	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-9.7	175.5	-49.2	-86.1	0	0	0	113.3	N240	N240-N242 PolarHBondContact O-N 3.15Å; N240-N242 PolarHBondContact OD1-N 2.97Å; N240-N242 VanDerWaalsContact OD1-N 3.1Å; N240-N242 PolarHBondContact OD1-ND2 2.95Å
243	E	95.1	Very high	97.1	Very high	99 Å²	99	56.7 Å²	56.7	46%	0.463	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-17.5	174.4	-73.5	159.1	-152.6	0	0	111.4	N141 A238 N240	N141-E243 PolarHBondContact ND2-O 2.82Å; A238-E243 HydrophobicContact CB-CB 4.45Å; N240-E243 HydrophobicContact CB-CB 4.11Å; N240-E243 HydrophobicContact CB-CG 4.08Å; N240-E243 VanDerWaalsContact ND2-CD 3.26Å; N240-E243 PolarHBondContact ND2-OE1 2.91Å; N240-E243 PolarHBondContact O-N 2.82Å
244	R	96.6	Very high	97.1	Very high	65 Å²	65	55.9 Å²	55.9	25%	0.245	28%	0.283	C	S	.	.			trans	-55.6	135.7	172.3	-70.3	-160.7	173.1	-157.8	-4.2	111.7	E188 N235 D236 A238 N240	E188-R244 IonicContact OE2-CZ 2.76Å; E188-R244 IonicContact OE2-NH1 3.42Å; E188-R244 PolarHBondContact OE2-NH1 2.91Å; E188-R244 IonicContact OE2-NH2 3.98Å; E188-R244 PolarHBondContact OE2-NH2 2.88Å; E188-R244 VanDerWaalsContact OE2-NH2 3.12Å; N235-R244 PolarHBondContact OD1-NH1 2.84Å; D236-R244 WeakPolarHBondContact O-CD 3.35Å; D236-R244 VanDerWaalsContact O-CZ 3.24Å; D236-R244 PolarHBondContact O-NE 3.22Å; D236-R244 PolarHBondContact O-NH1 3.43Å; D236-R244 WeakPolarHBondContact OD1-CA 3.21Å; D236-R244 VanDerWaalsContact OD1-CG 3.31Å; D236-R244 WeakPolarHBondContact OD1-CG 3.34Å; D236-R244 WeakPolarHBondContact OD2-CA 3.38Å; A238-R244 HydrophobicContact CB-CG 3.86Å; A238-R244 PolarHBondContact O-NE 3.22Å; N240-R244 PolarHBondContact O-N 3.09Å
245	R	97.7	Very high	97.2	Very high	87 Å²	87	56.1 Å²	56.1	33%	0.328	29%	0.285	S	S	.	.			trans	-116	157.2	178.1	-66.6	160.7	164.2	-126.3	4.6	109.6	N141 D142 N143 S144 N235 D236	N141-R245 PolarHBondContact O-NE 2.94Å; D142-R245 VanDerWaalsContact C-NH1 3.33Å; D142-R245 VanDerWaalsContact CA-NH2 3.26Å; D142-R245 PolarHBondContact O-NH1 3.27Å; D142-R245 PolarHBondContact O-NH2 3.26Å; N143-R245 VanDerWaalsContact C-NH1 3.3Å; N143-R245 WeakPolarHBondContact O-CD 3.41Å; N143-R245 PolarHBondContact O-NE 2.87Å; N143-R245 PolarHBondContact O-NH1 2.91Å; S144-R245 WeakPolarHBondContact OG-CD 3.09Å; S144-R245 PolarHBondContact OG-NH1 3.34Å; N235-R245 WeakPolarHBondContact CA-O 3.45Å; D236-R245 PolarHBondContact N-O 2.74Å; D236-R245 WeakPolarHBondContact OD2-CA 3.04Å; D236-R245 WeakPolarHBondContact OD2-CB 3.49Å; D236-R245 PolarHBondContact OD2-N 2.88Å
246	T	97.5	Very high	97.2	Very high	71 Å²	71	58.7 Å²	58.7	44%	0.436	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	142.6	-171.5	75.9	0	0	0	0	111.6	Q233 A234 N235	Q233-T246 HydrophobicContact CG-CG2 4.39Å; Q233-T246 PolarHBondContact NE2-OG1 3.06Å; A234-T246 CarbonylContact O-C 3.58Å; A234-T246 VanDerWaalsContact O-CA 3.25Å; A234-T246 WeakPolarHBondContact O-CA 3.44Å; N235-T246 HydrophobicContact CB-CG2 3.7Å
247	T	98	Very high	97.2	Very high	49 Å²	49	59 Å²	59	30%	0.301	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	151.2	171	-57.6	0	0	0	0	109.1	P145 F147 Q233 A234	P145-T247 WeakPolarHBondContact O-CB 3.33Å; P145-T247 PolarHBondContact O-OG1 2.69Å; F147-T247 HydrophobicContact CD2-CG2 4.06Å; Q233-T247 CarbonylContact C-O 3.55Å; Q233-T247 WeakPolarHBondContact CA-O 3.45Å; A234-T247 PolarHBondContact N-O 3.05Å; A234-T247 PolarHBondContact O-N 2.9Å
248	T	98.1	Very high	97.2	Very high	81 Å²	81	55.4 Å²	55.4	50%	0.497	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	142.6	-177.1	48.6	0	0	0	0	111.8	I231 I232 Q233	I231-T248 HydrophobicContact CG2-CG2 4.19Å; I232-T248 CarbonylContact O-C 3.32Å; I232-T248 WeakPolarHBondContact O-CA 3.34Å; Q233-T248 HydrophobicContact CB-CG2 4.01Å; Q233-T248 HydrophobicContact CG-CG2 4.1Å
249	T	98.2	Very high	97.2	Very high	7 Å²	7	57 Å²	57	4%	0.043	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	158.4	166.4	-170.1	0	0	0	0	110	F147 E150 Y152 F170 I232	F147-T249 HydrophobicContact CD1-CG2 3.81Å; F147-T249 HydrophobicContact CD2-CG2 4.14Å; F147-T249 HydrophobicContact CE1-CG2 3.47Å; F147-T249 VanDerWaalsContact CE1-CG2 3.47Å; F147-T249 HydrophobicContact CE2-CG2 3.83Å; F147-T249 HydrophobicContact CG-CG2 4.13Å; F147-T249 HydrophobicContact CZ-CG2 3.48Å; F147-T249 VanDerWaalsContact CZ-CG2 3.48Å; E150-T249 PolarHBondContact O-OG1 3.39Å; Y152-T249 HydrophobicContact CD2-CG2 3.75Å; Y152-T249 WeakPolarHBondContact CD2-OG1 3.48Å; Y152-T249 HydrophobicContact CE2-CG2 3.84Å; Y152-T249 WeakPolarHBondContact CE2-OG1 3.34Å; F170-T249 HydrophobicContact CE1-CG2 4.28Å; F170-T249 HydrophobicContact CZ-CG2 4.16Å; I232-T249 HydrophobicContact CB-CG2 4.23Å; I232-T249 PolarHBondContact N-O 2.96Å; I232-T249 PolarHBondContact O-N 3.43Å
250	T	98.3	Very high	97.3	Very high	52 Å²	52	52.3 Å²	52.3	32%	0.319	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	129.2	166.3	-57.9	0	0	0	0	109.9	Y152 Y229	Y152-T250 PolarHBondContact N-O 3.01Å; Y229-T250 HydrophobicContact CD1-CG2 4.24Å
251	L	98.6	Very high	97.5	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	112.9	162	169.9	64.5	0	0	0	107.9	Y152 A154 F167 V214 V230 I232 V253	Y152-L251 WeakPolarHBondContact O-CA 3.46Å; A154-L251 HydrophobicContact CB-CD1 4.12Å; F167-L251 HydrophobicContact CB-CD2 4.2Å; F167-L251 HydrophobicContact CD1-CD2 4.01Å; F167-L251 HydrophobicContact CD2-CD1 3.9Å; F167-L251 HydrophobicContact CE1-CD2 4.5Å; F167-L251 HydrophobicContact CE2-CD1 3.92Å; F167-L251 HydrophobicContact CG-CD1 4.23Å; F167-L251 HydrophobicContact CG-CD2 4.01Å; F167-L251 HydrophobicContact CZ-CD1 4.28Å; V214-L251 HydrophobicContact CB-CD2 4.46Å; V214-L251 HydrophobicContact CG2-CD2 3.9Å; V230-L251 HydrophobicContact CB-CB 4.29Å; V230-L251 PolarHBondContact N-O 2.62Å; V230-L251 PolarHBondContact O-N 2.87Å; I232-L251 HydrophobicContact CD1-CB 3.81Å; I232-L251 HydrophobicContact CD1-CD2 3.88Å; I232-L251 HydrophobicContact CG1-CB 4.49Å; L251-V253 HydrophobicContact CD1-CG2 4.48Å; L251-V253 HydrophobicContact CD2-CG2 4.04Å; L251-V253 HydrophobicContact CG-CG2 3.81Å
252	T	98.6	Very high	97.6	Very high	26 Å²	26	46 Å²	46	16%	0.16	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	126.5	170.9	-55.5	0	0	0	0	108.4	Y152 Y153 A154 R227 Y228 Y229	Y152-T252 PolarHBondContact O-N 3.34Å; Y153-T252 CarbonylContact C-O 3.53Å; Y153-T252 WeakPolarHBondContact CA-O 3.3Å; Y153-T252 HydrophobicContact CD2-CG2 4.31Å; Y153-T252 HydrophobicContact CE2-CG2 4.45Å; A154-T252 PolarHBondContact N-O 3.02Å; R227-T252 HydrophobicContact CG-CG2 4.14Å; Y228-T252 WeakPolarHBondContact O-CA 3.18Å; Y229-T252 HydrophobicContact CD1-CG2 4.06Å; Y229-T252 HydrophobicContact CE1-CG2 3.8Å
253	V	98.7	Very high	97.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	115.2	178.7	-172.9	0	0	0	0	109.1	A154 V156 I166 F204 R227 Y228 V230 L251	A154-V253 HydrophobicContact CB-CG2 4.45Å; A154-V253 WeakPolarHBondContact O-CA 3.35Å; V156-V253 HydrophobicContact CG1-CG1 3.54Å; I166-V253 HydrophobicContact CD1-CG1 4.45Å; I166-V253 HydrophobicContact CD1-CG2 4.47Å; F204-V253 HydrophobicContact CE1-CG1 4.14Å; F204-V253 HydrophobicContact CE2-CB 4.44Å; F204-V253 HydrophobicContact CE2-CG2 4.48Å; F204-V253 HydrophobicContact CZ-CB 4.09Å; F204-V253 HydrophobicContact CZ-CG1 3.75Å; F204-V253 HydrophobicContact CZ-CG2 4.29Å; R227-V253 WeakPolarHBondContact CA-O 3.42Å; Y228-V253 PolarHBondContact N-O 3.09Å; Y228-V253 PolarHBondContact O-N 3.12Å; V230-V253 HydrophobicContact CG2-CG2 4.07Å; L251-V253 HydrophobicContact CD1-CG2 4.48Å; L251-V253 HydrophobicContact CD2-CG2 4.04Å; L251-V253 HydrophobicContact CG-CG2 3.81Å
254	D	98.5	Very high	97.8	Very high	20 Å²	20	35.6 Å²	35.6	11%	0.107	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	132.2	173.4	-72.8	-7.7	0	0	0	110.1	Y153 A154 T155 V156 R227	Y153-D254 HydrophobicContact CE2-CB 4.26Å; Y153-D254 VanDerWaalsContact CE2-OD2 3.28Å; Y153-D254 WeakPolarHBondContact CE2-OD2 3.47Å; Y153-D254 PolarHBondContact OH-OD2 2.85Å; A154-D254 PolarHBondContact O-N 3.34Å; T155-D254 CarbonylContact C-O 3.48Å; T155-D254 WeakPolarHBondContact CA-O 3.25Å; T155-D254 HydrophobicContact CG2-CB 4.48Å; V156-D254 PolarHBondContact N-O 2.87Å; R227-D254 IonicContact CZ-OD1 2.65Å; R227-D254 IonicContact CZ-OD2 3.28Å; R227-D254 IonicContact NE-OD1 2.71Å; R227-D254 PolarHBondContact NE-OD1 2.84Å; R227-D254 IonicContact NE-OD2 3.84Å; R227-D254 VanDerWaalsContact NH2-CG 3.34Å; R227-D254 IonicContact NH2-OD1 2.68Å; R227-D254 PolarHBondContact NH2-OD1 3.23Å; R227-D254 VanDerWaalsContact NH2-OD1 3.12Å; R227-D254 IonicContact NH2-OD2 3.56Å; R227-D254 PolarHBondContact NH2-OD2 2.78Å
255	V	98.5	Very high	97.9	Very high	6 Å²	6	33.1 Å²	33.1	4%	0.036	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	132.8	170.3	-172.4	0	0	0	0	108.1	V156 E158 L220 Y222 K225 T226 Y228	V156-V255 CarbonylContact O-C 3.46Å; V156-V255 VanDerWaalsContact O-CA 3.25Å; V156-V255 WeakPolarHBondContact O-CA 3.43Å; E158-V255 HydrophobicContact CB-CG1 3.73Å; L220-V255 HydrophobicContact CB-CG1 4.26Å; L220-V255 HydrophobicContact CD1-CG1 4.2Å; L220-V255 HydrophobicContact CD1-CG2 4.15Å; L220-V255 HydrophobicContact CD2-CG2 4.25Å; Y222-V255 HydrophobicContact CD2-CB 4.24Å; Y222-V255 HydrophobicContact CD2-CG1 4.18Å; Y222-V255 WeakPolarHBondContact CE2-O 3.45Å; K225-V255 WeakPolarHBondContact O-CG2 3.26Å; T226-V255 PolarHBondContact O-N 3.49Å; Y228-V255 HydrophobicContact CD2-CG2 4.15Å; Y228-V255 HydrophobicContact CE2-CG2 3.89Å
256	L	98.3	Very high	97.9	Very high	73 Å²	73	30.6 Å²	30.6	38%	0.382	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	122.7	170	-52.5	178.3	0	0	0	108.8	T155 V156 N157 E158	T155-L256 HydrophobicContact CG2-CD2 4.33Å; V156-L256 PolarHBondContact O-N 3.08Å; N157-L256 VanDerWaalsContact CA-O 3.32Å; N157-L256 WeakPolarHBondContact CA-O 3.47Å; N157-L256 HydrophobicContact CB-CB 4.28Å; N157-L256 PolarHBondContact ND2-O 3.21Å; N157-L256 VanDerWaalsContact ND2-O 3.15Å; E158-L256 PolarHBondContact N-O 3.2Å; E158-L256 VanDerWaalsContact N-O 3.09Å
257	D	98.3	Very high	97.8	Very high	7 Å²	7	30.7 Å²	30.7	4%	0.037	18%	0.177	C	C	.	.			trans	-40.1	134	164.8	-165.2	-56	0	0	0	110.4	N157 E158 Y222 D310 R311 N312 I313	N157-D257 PolarHBondContact ND2-O 3.04Å; E158-D257 WeakPolarHBondContact OE1-CA 3.23Å; Y222-D257 HydrophobicContact CD1-CB 3.84Å; Y222-D257 WeakPolarHBondContact CD1-OD2 3.34Å; Y222-D257 HydrophobicContact CD2-CB 4.04Å; Y222-D257 HydrophobicContact CE1-CB 3.76Å; Y222-D257 WeakPolarHBondContact CE1-OD2 3.36Å; Y222-D257 HydrophobicContact CE2-CB 3.98Å; Y222-D257 HydrophobicContact CG-CB 4Å; D257-D310 WeakPolarHBondContact OD1-CB 3.23Å; D257-R311 PolarHBondContact OD2-N 3.27Å; D257-N312 HydrophobicContact CB-CB 4.12Å; D257-N312 VanDerWaalsContact CG-C 3.45Å; D257-N312 VanDerWaalsContact OD2-CA 3.24Å; D257-N312 WeakPolarHBondContact OD2-CA 3.22Å; D257-N312 VanDerWaalsContact OD2-CB 3.25Å; D257-N312 WeakPolarHBondContact OD2-CB 3.46Å; D257-N312 PolarHBondContact OD2-N 3.25Å; D257-I313 VanDerWaalsContact OD1-CD1 3.3Å; D257-I313 WeakPolarHBondContact OD1-CD1 3.48Å; D257-I313 PolarHBondContact OD1-N 3.01Å
258	G	97	Very high	97.7	Very high	3 Å²	3	30.1 Å²	30.1	3%	0.031	18%	0.175	C	C	.	.			trans	-150.1	147.2	-175	0	0	0	0	0	113.8	N157 E158 D260 I313	N157-G258 VanDerWaalsContact ND2-CA 3.3Å; N157-G258 WeakPolarHBondContact ND2-CA 3.35Å; E158-G258 PolarHBondContact OE1-N 3.3Å; G258-D260 PolarHBondContact O-N 2.79Å; G258-I313 VanDerWaalsContact CA-CD1 3.5Å
259	D	97.4	Very high	97.6	Very high	36 Å²	36	30.2 Å²	30.2	19%	0.193	18%	0.175	C	C	.	.	S	Bend	trans	-55.2	87.3	-178.6	-178.7	11.8	0	0	0	113.8	D310 Q369 N371 H373	D259-D310 WeakPolarHBondContact CA-OD2 3.06Å; D259-Q369 PolarHBondContact OD1-NE2 2.85Å; D259-N371 PolarHBondContact OD2-ND2 3.02Å; D259-H373 IonicContact OD2-CG 3.47Å
260	D	97.5	Very high	97.5	Very high	76 Å²	76	34.6 Å²	34.6	41%	0.406	20%	0.198	S	C	.	.			trans	-132.5	-5.2	162	94	-20.7	0	0	0	115.5	L159 G258 D310	L159-D260 HydrophobicContact CD2-CB 3.72Å; G258-D260 PolarHBondContact O-N 2.79Å; D260-D310 PolarHBondContact N-OD2 3.25Å; D260-D310 VanDerWaalsContact N-OD2 3.17Å
261	L	97.4	Very high	97.4	Very high	52 Å²	52	34.5 Å²	34.5	27%	0.272	20%	0.197	S	C	.	.	S	Bend	trans	-110.7	143.9	173	-47.8	-179.8	0	0	0	112.7	E223 Q309 D310	E223-L261 HydrophobicContact CG-CD1 4.44Å; L261-Q309 HydrophobicContact CB-CB 3.57Å; L261-Q309 HydrophobicContact CD1-CB 3.99Å; L261-Q309 HydrophobicContact CG-CB 4.45Å; L261-D310 WeakPolarHBondContact CB-OD1 3.45Å; L261-D310 WeakPolarHBondContact CD1-OD1 3.17Å; L261-D310 VanDerWaalsContact CG-OD1 3.25Å; L261-D310 WeakPolarHBondContact CG-OD1 3.34Å; L261-D310 PolarHBondContact N-OD2 2.92Å; L261-D310 VanDerWaalsContact N-OD2 3.08Å
262	G	96.7	Very high	97.3	Very high	9 Å²	9	38.7 Å²	38.7	9%	0.093	22%	0.224	C	C	.	.			trans	-80.1	174.9	179.8	0	0	0	0	0	115	Q309 L375	G262-Q309 VanDerWaalsContact O-CB 3.27Å; G262-Q309 WeakPolarHBondContact O-CB 3.32Å; G262-Q309 WeakPolarHBondContact O-CG 2.98Å; G262-Q309 PolarHBondContact O-N 2.92Å; G262-Q309 PolarHBondContact O-NE2 2.81Å; G262-L375 VanDerWaalsContact CA-CB 3.5Å; G262-L375 WeakPolarHBondContact CA-O 3.31Å
263	P	97.7	Very high	97.1	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.006	26%	0.261	C	S	.	.			trans	-59.9	151.5	168.8	-20.7	34	0	0	0	111.9	A306 I307 I322 A367 Q369 L375 A377	P263-A306 HydrophobicContact CB-CB 4.15Å; P263-I307 CarbonylContact C-O 3.32Å; P263-I307 WeakPolarHBondContact CA-O 3.37Å; P263-I322 HydrophobicContact CB-CD1 4.03Å; P263-I322 HydrophobicContact CB-CG1 4.28Å; P263-I322 HydrophobicContact CG-CD1 4.37Å; P263-I322 HydrophobicContact CG-CG1 4.09Å; P263-A367 HydrophobicContact CB-CB 4.35Å; P263-Q369 HydrophobicContact CG-CG 4.03Å; P263-L375 WeakPolarHBondContact CD-O 3.35Å; P263-A377 WeakPolarHBondContact O-CB 3.29Å
264	M	97.1	Very high	96.9	Very high	26 Å²	26	48.6 Å²	48.6	13%	0.128	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	133.1	170.6	54.8	169.9	-103.1	0	0	111.5	L266 C268 A306 I307 Q309 R311	M264-L266 HydrophobicContact CE-CD2 3.49Å; M264-L266 VanDerWaalsContact CE-CD2 3.49Å; M264-C268 HydrophobicContact CE-CB 3.38Å; M264-A306 CarbonylContact O-C 3.59Å; M264-A306 WeakPolarHBondContact O-CA 3.35Å; M264-A306 WeakPolarHBondContact O-CB 3.28Å; M264-I307 HydrophobicContact CE-CD1 4.5Å; M264-I307 HydrophobicContact CE-CG1 4.48Å; M264-I307 HydrophobicContact CG-CG1 4.18Å; M264-I307 PolarHBondContact N-O 3.06Å; M264-I307 PolarHBondContact O-N 3.09Å; M264-Q309 HydrophobicContact CB-CG 3.79Å; M264-Q309 HydrophobicContact CG-CG 3.55Å; M264-Q309 HydrophobicContact SD-CG 3.8Å; M264-R311 PolarHBondContact SD-NH2 3.26Å
265	F	98	Very high	96.6	Very high	14 Å²	14	54.5 Å²	54.5	6%	0.061	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	148.6	175.6	-75.8	-71.3	0	0	0	112.3	L280 Y282 I304 Q305 A306 Y324 I365 A367 A377 A379	F265-L280 HydrophobicContact CB-CD2 4.33Å; F265-Y282 HydrophobicContact CD1-CE2 4.06Å; F265-Y282 VanDerWaalsContact CD1-OH 3.25Å; F265-Y282 WeakPolarHBondContact CD1-OH 3.16Å; F265-Y282 HydrophobicContact CE1-CE2 4.39Å; F265-Y282 HydrophobicContact CG-CE2 4.47Å; F265-I304 HydrophobicContact CD1-CG2 4.43Å; F265-I304 HydrophobicContact CE1-CG2 4Å; F265-Q305 WeakPolarHBondContact CA-O 3.48Å; F265-A306 HydrophobicContact CD1-CB 3.91Å; F265-A306 HydrophobicContact CE1-CB 4.26Å; F265-A306 HydrophobicContact CG-CB 4.38Å; F265-Y324 HydrophobicContact CE1-CD1 4.24Å; F265-Y324 HydrophobicContact CE1-CE1 4.12Å; F265-I365 HydrophobicContact CE1-CG2 4.34Å; F265-I365 HydrophobicContact CZ-CB 4.36Å; F265-I365 HydrophobicContact CZ-CG2 4Å; F265-A367 HydrophobicContact CE1-CB 3.88Å; F265-A367 HydrophobicContact CE2-CB 3.98Å; F265-A367 HydrophobicContact CZ-CB 3.5Å; F265-A367 VanDerWaalsContact CZ-CB 3.5Å; F265-A377 HydrophobicContact CD2-CB 4.35Å; F265-A377 HydrophobicContact CE2-CB 4.43Å; F265-A379 HydrophobicContact CB-CB 4.48Å; F265-A379 HydrophobicContact CD1-CB 4.42Å; F265-A379 HydrophobicContact CD2-CB 3.52Å; F265-A379 HydrophobicContact CE2-CB 3.69Å; F265-A379 HydrophobicContact CG-CB 3.91Å; F265-A379 HydrophobicContact CZ-CB 4.19Å
266	L	97.1	Very high	96.4	Very high	34 Å²	34	58.8 Å²	58.8	18%	0.178	32%	0.322	C	S	.	.	S	Bend	trans	-114.3	145.1	177.8	-53.5	179.5	0	0	0	111.9	M264 C268 L280 Y282 Q305 I307	M264-L266 HydrophobicContact CE-CD2 3.49Å; M264-L266 VanDerWaalsContact CE-CD2 3.49Å; L266-C268 HydrophobicContact CD2-CB 4.35Å; L266-L280 WeakPolarHBondContact O-CD2 3.09Å; L266-Y282 PolarHBondContact O-OH 3.18Å; L266-Q305 HydrophobicContact CB-CG 3.82Å; L266-Q305 HydrophobicContact CD1-CG 4.07Å; L266-Q305 HydrophobicContact CG-CG 4.24Å; L266-Q305 PolarHBondContact N-O 3.47Å; L266-I307 HydrophobicContact CD1-CD1 4.03Å; L266-I307 HydrophobicContact CD1-CG1 4.14Å; L266-I307 HydrophobicContact CD1-CG2 4.08Å; L266-I307 HydrophobicContact CD2-CD1 4.1Å; L266-I307 HydrophobicContact CD2-CG1 4.11Å; L266-I307 HydrophobicContact CG-CG1 4.3Å
267	P	96.9	Very high	96.2	Very high	72 Å²	72	57.1 Å²	57.1	47%	0.468	32%	0.316	S	S	.	.	S	Bend	cis	-77.1	126.7	1.9	30.5	-34.5	0	0	0	112.7	L280 P302	P267-L280 HydrophobicContact CG-CD1 4.48Å; P267-P302 HydrophobicContact CG-CG 4.32Å
268	C	95.4	Very high	96	Very high	37 Å²	37	63.2 Å²	63.2	25%	0.25	34%	0.338	C	S	.	.			trans	-82.4	122.8	170.4	173.7	0	0	0	0	109.9	M264 L266 C277	M264-C268 HydrophobicContact CE-CB 3.38Å; L266-C268 HydrophobicContact CD2-CB 4.35Å; C268-C277 HydrophobicContact CB-CB 3.9Å; C268-C277 WeakPolarHBondContact CB-SG 3.25Å; C268-C277 VanDerWaalsContact SG-CA 3.56Å; C268-C277 WeakPolarHBondContact SG-CB 3.48Å; C268-C277 CovalentContact SG-SG 2.03Å; C268-C277 PolarHBondContact SG-SG 3.33Å
269	V	95.9	Very high	95.9	Very high	83 Å²	83	69.1 Å²	69.1	50%	0.503	38%	0.376	S	S	.	.			trans	-116.3	114.5	169.6	178.4	0	0	0	0	107.1	R278	V269-R278 WeakPolarHBondContact O-CB 3.46Å; V269-R278 VanDerWaalsContact O-CG 3.25Å; V269-R278 WeakPolarHBondContact O-CG 3.4Å; V269-R278 PolarHBondContact O-N 3.39Å
270	L	95.5	Very high	95.7	Very high	99 Å²	99	69 Å²	69	52%	0.518	38%	0.375	S	S	.	.	B	Isolated β-bridge	trans	-62.4	146.9	-174.8	-65.9	177.3	0	0	0	113	R275 D276	L270-R275 WeakPolarHBondContact CD2-O 3.43Å; L270-D276 CarbonylContact C-O 3.56Å; L270-D276 WeakPolarHBondContact CA-O 3.42Å
271	V	96.6	Very high	95.7	Very high	51 Å²	51	68.8 Å²	68.8	31%	0.309	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-77	132.7	168.3	176.8	0	0	0	0	109	N273 T274 D276 R278	V271-N273 PolarHBondContact O-N 3.49Å; V271-T274 HydrophobicContact CG1-CG2 4.43Å; V271-T274 PolarHBondContact O-N 2.64Å; V271-T274 VanDerWaalsContact O-N 3.1Å; V271-D276 PolarHBondContact N-O 3Å; V271-R278 HydrophobicContact CG2-CG 3.7Å
272	P	95.8	Very high	95.7	Very high	88 Å²	88	66.3 Å²	66.3	57%	0.571	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	125.1	-178.2	-27.2	35.9	0	0	0	113.1
273	N	94.4	Very high	95.8	Very high	172 Å²	172	70.1 Å²	70.1	92%	0.92	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	18.1	-176.4	-38.9	-84.8	0	0	0	116.1	V271	V271-N273 PolarHBondContact O-N 3.49Å
274	T	95.1	Very high	95.8	Very high	61 Å²	61	70.4 Å²	70.4	37%	0.374	38%	0.382	S	S	.	.	S	Bend	trans	-133	172.3	168.4	82.6	0	0	0	0	111.6	V271 D276	V271-T274 HydrophobicContact CG1-CG2 4.43Å; V271-T274 PolarHBondContact O-N 2.64Å; V271-T274 VanDerWaalsContact O-N 3.1Å; T274-D276 VanDerWaalsContact C-N 3.33Å; T274-D276 WeakPolarHBondContact CB-OD2 3.43Å; T274-D276 WeakPolarHBondContact OG1-CB 3.46Å; T274-D276 PolarHBondContact OG1-N 3.39Å; T274-D276 VanDerWaalsContact OG1-N 3.1Å; T274-D276 PolarHBondContact OG1-OD2 3.05Å
275	R	92.9	Very high	95.7	Very high	145 Å²	145	71.7 Å²	71.7	55%	0.547	40%	0.397	S	S	.	.	S	Bend	trans	-88.7	1.8	170.5	-71.5	-176.8	174.5	138.1	5.3	112.3	E223 D224 L270	E223-R275 PolarHBondContact O-NH2 2.84Å; D224-R275 IonicContact OD1-CZ 2.74Å; D224-R275 VanDerWaalsContact OD1-CZ 3.23Å; D224-R275 IonicContact OD1-NH1 4Å; D224-R275 PolarHBondContact OD1-NH1 2.89Å; D224-R275 IonicContact OD1-NH2 3.75Å; D224-R275 PolarHBondContact OD1-NH2 3.33Å; L270-R275 WeakPolarHBondContact CD2-O 3.43Å
276	D	93.8	Very high	95.6	Very high	96 Å²	96	71.1 Å²	71.1	51%	0.513	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-82.2	136.1	-171.3	-38.4	-58.8	0	0	0	112.4	L270 V271 T274	L270-D276 CarbonylContact C-O 3.56Å; L270-D276 WeakPolarHBondContact CA-O 3.42Å; V271-D276 PolarHBondContact N-O 3Å; T274-D276 VanDerWaalsContact C-N 3.33Å; T274-D276 WeakPolarHBondContact CB-OD2 3.43Å; T274-D276 WeakPolarHBondContact OG1-CB 3.46Å; T274-D276 PolarHBondContact OG1-N 3.39Å; T274-D276 VanDerWaalsContact OG1-N 3.1Å; T274-D276 PolarHBondContact OG1-OD2 3.05Å
277	C	94.6	Very high	95.5	Very high	38 Å²	38	71.1 Å²	71.1	26%	0.257	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-68.9	137.3	164.9	-57.5	0	0	0	0	110.8	C268	C268-C277 HydrophobicContact CB-CB 3.9Å; C268-C277 WeakPolarHBondContact CB-SG 3.25Å; C268-C277 VanDerWaalsContact SG-CA 3.56Å; C268-C277 WeakPolarHBondContact SG-CB 3.48Å; C268-C277 CovalentContact SG-SG 2.03Å; C268-C277 PolarHBondContact SG-SG 3.33Å
278	R	94.3	Very high	95.3	Very high	134 Å²	134	67.8 Å²	67.8	51%	0.506	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-58.7	141.9	168.3	-74.6	174.5	-170.7	-146.2	2.4	110.6	V269 V271 L280	V269-R278 WeakPolarHBondContact O-CB 3.46Å; V269-R278 VanDerWaalsContact O-CG 3.25Å; V269-R278 WeakPolarHBondContact O-CG 3.4Å; V269-R278 PolarHBondContact O-N 3.39Å; V271-R278 HydrophobicContact CG2-CG 3.7Å; R278-L280 PolarHBondContact O-N 3.13Å
279	P	93.2	Very high	95.1	Very high	128 Å²	128	69.7 Å²	69.7	83%	0.831	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-53.3	130.5	173	-27.3	35.4	0	0	0	112
280	L	94.2	Very high	94.9	Very high	32 Å²	32	69.9 Å²	69.9	17%	0.168	37%	0.374	C	S	.	.			trans	-104.4	134.8	-177.6	-177.7	61.7	0	0	0	110.3	F265 L266 P267 R278 Y282 S380	F265-L280 HydrophobicContact CB-CD2 4.33Å; L266-L280 WeakPolarHBondContact O-CD2 3.09Å; P267-L280 HydrophobicContact CG-CD1 4.48Å; R278-L280 PolarHBondContact O-N 3.13Å; L280-Y282 HydrophobicContact CD2-CD1 4.36Å; L280-Y282 HydrophobicContact CD2-CE1 3.72Å; L280-Y282 HydrophobicContact CD2-CE2 3.96Å; L280-Y282 VanDerWaalsContact CD2-CZ 3.49Å; L280-Y282 HydrophobicContact CG-CE1 4.42Å; L280-Y282 HydrophobicContact CG-CE2 4.4Å; L280-S380 PolarHBondContact O-N 2.82Å
281	T	97.1	Very high	94.8	Very high	73 Å²	73	67.4 Å²	67.4	45%	0.448	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	102	171.9	-50.7	0	0	0	0	109.2	S380 H382	T281-S380 CarbonylContact C-O 3.6Å; T281-S380 WeakPolarHBondContact CA-O 3.35Å; T281-H382 HydrophobicContact CG2-CB 4.31Å
282	Y	97.8	Very high	94.8	Very high	0 Å²	0	66 Å²	66	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	152.4	169.8	-64.4	-73.3	0	0	0	111.2	F265 L266 L280 V300 P302 I304 Q305 A379 S380 H382	F265-Y282 HydrophobicContact CD1-CE2 4.06Å; F265-Y282 VanDerWaalsContact CD1-OH 3.25Å; F265-Y282 WeakPolarHBondContact CD1-OH 3.16Å; F265-Y282 HydrophobicContact CE1-CE2 4.39Å; F265-Y282 HydrophobicContact CG-CE2 4.47Å; L266-Y282 PolarHBondContact O-OH 3.18Å; L280-Y282 HydrophobicContact CD2-CD1 4.36Å; L280-Y282 HydrophobicContact CD2-CE1 3.72Å; L280-Y282 HydrophobicContact CD2-CE2 3.96Å; L280-Y282 VanDerWaalsContact CD2-CZ 3.49Å; L280-Y282 HydrophobicContact CG-CE1 4.42Å; L280-Y282 HydrophobicContact CG-CE2 4.4Å; Y282-V300 HydrophobicContact CD1-CG1 4.16Å; Y282-V300 HydrophobicContact CG-CG1 4.19Å; Y282-P302 HydrophobicContact CD1-CG 3.95Å; Y282-P302 WeakPolarHBondContact CD1-O 3.39Å; Y282-P302 HydrophobicContact CE1-CG 3.95Å; Y282-I304 HydrophobicContact CD1-CG1 3.98Å; Y282-I304 HydrophobicContact CD2-CG1 4.15Å; Y282-I304 HydrophobicContact CE1-CB 4.29Å; Y282-I304 HydrophobicContact CE1-CG1 4.02Å; Y282-I304 HydrophobicContact CE2-CB 4.49Å; Y282-I304 HydrophobicContact CE2-CG1 4.2Å; Y282-I304 HydrophobicContact CE2-CG2 4.03Å; Y282-I304 HydrophobicContact CG-CG1 4.03Å; Y282-Q305 PolarHBondContact OH-O 2.77Å; Y282-A379 HydrophobicContact CD2-CB 4.01Å; Y282-A379 HydrophobicContact CE2-CB 3.64Å; Y282-S380 WeakPolarHBondContact CD2-O 3.17Å; Y282-S380 PolarHBondContact N-O 2.97Å; Y282-H382 PolarHBondContact O-N 3.34Å
283	Q	98	Very high	94.7	Very high	88 Å²	88	69.4 Å²	69.4	41%	0.411	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	138.4	-178.4	-58.3	-64	-40.5	0	0	110.5	V300 T301 H382	Q283-V300 WeakPolarHBondContact O-CA 3.31Å; Q283-T301 PolarHBondContact N-O 2.87Å; Q283-T301 PolarHBondContact O-N 3.49Å; Q283-H382 CarbonylContact C-O 3.51Å; Q283-H382 WeakPolarHBondContact CA-O 2.8Å; Q283-H382 PolarHBondContact OE1-CD2 2.87Å
284	A	97.6	Very high	94.7	Very high	8 Å²	8	66.7 Å²	66.7	7%	0.066	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	154.4	167.8	0	0	0	0	0	109.8	I298 V300 L381 H382 I383 E384	A284-I298 HydrophobicContact CB-CG2 4.02Å; A284-V300 HydrophobicContact CB-CG2 4.4Å; A284-L381 HydrophobicContact CB-CD1 4.39Å; A284-H382 PolarHBondContact N-O 3.46Å; A284-I383 HydrophobicContact CB-CG1 4.38Å; A284-I383 HydrophobicContact CB-CG2 4.4Å; A284-I383 WeakPolarHBondContact O-CA 3.29Å; A284-E384 PolarHBondContact O-N 3.41Å
285	A	96.3	Very high	94.7	Very high	53 Å²	53	65.7 Å²	65.7	44%	0.438	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	135.1	177.4	0	0	0	0	0	110.1	E384 L386	A285-E384 WeakPolarHBondContact CA-O 3.26Å; A285-L386 HydrophobicContact CB-CD1 3.97Å; A285-L386 HydrophobicContact CB-CD2 4.28Å; A285-L386 HydrophobicContact CB-CG 4.12Å
286	I	95.8	Very high	94.8	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	114.1	-170.4	-64.3	-174.2	0	0	0	108.8	E288 L295 I298 F338 L349 V353 I383 E384 I385 L386	I286-E288 PolarHBondContact O-N 2.99Å; I286-L295 HydrophobicContact CG2-CD1 3.76Å; I286-I298 HydrophobicContact CD1-CD1 4.01Å; I286-I298 HydrophobicContact CD1-CG1 4.22Å; I286-I298 HydrophobicContact CD1-CG2 4.1Å; I286-I298 HydrophobicContact CG1-CD1 4.24Å; I286-I298 HydrophobicContact CG1-CG2 4.15Å; I286-F338 HydrophobicContact CD1-CE1 3.54Å; I286-F338 HydrophobicContact CD1-CZ 4Å; I286-L349 HydrophobicContact CD1-CD1 4.44Å; I286-V353 HydrophobicContact CG2-CG2 4.41Å; I286-I383 HydrophobicContact CD1-CG2 3.61Å; I286-I383 HydrophobicContact CG1-CG2 3.92Å; I286-E384 PolarHBondContact N-O 2.97Å; I286-I385 HydrophobicContact CB-CD1 3.92Å; I286-I385 HydrophobicContact CG2-CD1 4.25Å; I286-I385 CarbonylContact O-C 3.37Å; I286-I385 WeakPolarHBondContact O-CA 3.33Å; I286-L386 PolarHBondContact O-N 3.37Å
287	P	94	Very high	94.8	Very high	34 Å²	34	60.8 Å²	60.8	22%	0.221	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	133.2	169.9	-20.2	32.5	0	0	0	111	R290 E388	P287-R290 HydrophobicContact CB-CG 3.93Å; P287-E388 HydrophobicContact CB-CG 4.14Å
288	E	92.6	Very high	94.9	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.009	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	161.3	-179.1	74.1	171.1	122.5	0	0	113.4	I286 R290 V353 R355 I385 L386 E388 N390	I286-E288 PolarHBondContact O-N 2.99Å; E288-R290 PolarHBondContact O-N 2.86Å; E288-V353 CarbonylContact C-O 3.5Å; E288-V353 WeakPolarHBondContact CA-O 3.35Å; E288-V353 WeakPolarHBondContact CB-O 3.41Å; E288-R355 HydrophobicContact CB-CB 4.14Å; E288-R355 HydrophobicContact CG-CB 4.3Å; E288-R355 VanDerWaalsContact OE1-CB 3.24Å; E288-R355 WeakPolarHBondContact OE1-CB 3.4Å; E288-R355 VanDerWaalsContact OE2-CB 3.25Å; E288-R355 WeakPolarHBondContact OE2-CB 3.49Å; E288-R355 PolarHBondContact OE2-N 3.39Å; E288-I385 HydrophobicContact CB-CG2 3.93Å; E288-L386 PolarHBondContact N-O 2.96Å; E288-L386 VanDerWaalsContact N-O 3.08Å; E288-E388 HydrophobicContact CG-CB 4.23Å; E288-N390 VanDerWaalsContact CD-ND2 3.27Å; E288-N390 PolarHBondContact OE1-ND2 3.31Å
289	L	91.3	Very high	95	Very high	77 Å²	77	59.6 Å²	59.6	40%	0.403	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	-5.6	178.3	-53.2	-179.9	0	0	0	116.6	V353 N354 N390	L289-V353 PolarHBondContact N-O 3.47Å; L289-N354 HydrophobicContact CD2-CB 3.82Å; L289-N390 HydrophobicContact CD1-CB 4.11Å
290	R	92.2	Very high	95.2	Very high	87 Å²	87	54.1 Å²	54.1	33%	0.328	29%	0.29	S	S	.	.			trans	-70.9	151.8	175.5	-58.9	-46.5	-163	81.4	18.8	112.7	P287 E288 E294 L295 P352 E388	P287-R290 HydrophobicContact CB-CG 3.93Å; E288-R290 PolarHBondContact O-N 2.86Å; R290-E294 WeakPolarHBondContact CD-OE2 3.16Å; R290-E294 IonicContact CZ-OE2 3.48Å; R290-E294 IonicContact NE-OE2 3.42Å; R290-E294 IonicContact NH1-OE2 2.87Å; R290-E294 PolarHBondContact NH1-OE2 2.87Å; R290-L295 HydrophobicContact CB-CD1 3.81Å; R290-L295 HydrophobicContact CB-CD2 4.26Å; R290-L295 HydrophobicContact CB-CG 3.91Å; R290-P352 WeakPolarHBondContact O-CA 3.35Å; R290-P352 VanDerWaalsContact O-CB 3.3Å; R290-P352 WeakPolarHBondContact O-CB 3.38Å; R290-E388 IonicContact CZ-OE1 3.22Å; R290-E388 VanDerWaalsContact CZ-OE1 3.27Å; R290-E388 IonicContact CZ-OE2 2.94Å; R290-E388 VanDerWaalsContact NE-CD 3.29Å; R290-E388 IonicContact NE-OE1 3.58Å; R290-E388 PolarHBondContact NE-OE1 2.67Å; R290-E388 IonicContact NE-OE2 3.06Å; R290-E388 PolarHBondContact NE-OE2 3.41Å; R290-E388 IonicContact NH2-OE1 2.79Å; R290-E388 PolarHBondContact NH2-OE1 2.81Å; R290-E388 IonicContact NH2-OE2 3.63Å
291	T	94.3	Very high	95.3	Very high	48 Å²	48	56.7 Å²	56.7	29%	0.294	31%	0.307	S	S	.	.			trans	-86.6	154.2	-175.8	82.8	0	0	0	0	112.4	E293 E294 L295	T291-E293 WeakPolarHBondContact CB-OE2 3.31Å; T291-E293 PolarHBondContact O-N 2.95Å; T291-E293 VanDerWaalsContact O-N 3.15Å; T291-E293 PolarHBondContact OG1-N 3.04Å; T291-E293 PolarHBondContact OG1-OE2 3.42Å; T291-E294 PolarHBondContact O-N 2.9Å; T291-L295 PolarHBondContact O-N 2.94Å
292	P	95.3	Very high	95.3	Very high	20 Å²	20	55.1 Å²	55.1	13%	0.13	30%	0.299	C	S	.	.	H	α-helix	trans	-48.9	-35.6	171.2	-32.2	38.9	0	0	0	114.2	E294 L295 N296 L349 L350	P292-E294 VanDerWaalsContact C-N 3.32Å; P292-E294 PolarHBondContact O-N 2.83Å; P292-L295 PolarHBondContact O-N 2.83Å; P292-N296 WeakPolarHBondContact O-CB 3.22Å; P292-N296 VanDerWaalsContact O-CG 3.24Å; P292-N296 PolarHBondContact O-N 2.6Å; P292-N296 PolarHBondContact O-ND2 2.84Å; P292-L349 WeakPolarHBondContact CB-O 3.35Å; P292-L350 WeakPolarHBondContact CG-O 3.39Å
293	E	94.7	Very high	95.3	Very high	161 Å²	161	59.3 Å²	59.3	75%	0.752	33%	0.326	S	S	*	.	H	α-helix	trans	-72.2	-20.3	179.5	-56.6	82.5	177.5	0	0	114.1	T291	T291-E293 WeakPolarHBondContact CB-OE2 3.31Å; T291-E293 PolarHBondContact O-N 2.95Å; T291-E293 VanDerWaalsContact O-N 3.15Å; T291-E293 PolarHBondContact OG1-N 3.04Å; T291-E293 PolarHBondContact OG1-OE2 3.42Å
294	E	93.5	Very high	95.2	Very high	115 Å²	115	55.9 Å²	55.9	54%	0.537	31%	0.31	S	S	.	.	H	α-helix	trans	-88.4	-27.3	175.3	-71.2	-177.5	-160.5	0	0	112.9	R290 T291 P292	R290-E294 WeakPolarHBondContact CD-OE2 3.16Å; R290-E294 IonicContact CZ-OE2 3.48Å; R290-E294 IonicContact NE-OE2 3.42Å; R290-E294 IonicContact NH1-OE2 2.87Å; R290-E294 PolarHBondContact NH1-OE2 2.87Å; T291-E294 PolarHBondContact O-N 2.9Å; P292-E294 VanDerWaalsContact C-N 3.32Å; P292-E294 PolarHBondContact O-N 2.83Å
295	L	94.5	Very high	95.2	Very high	39 Å²	39	60 Å²	60	20%	0.204	33%	0.328	C	S	.	.	H	α-helix	trans	-111.4	-21.2	-170.1	-61.6	-171.1	0	0	0	115.5	I286 R290 T291 P292 P297 I298 L349	I286-L295 HydrophobicContact CG2-CD1 3.76Å; R290-L295 HydrophobicContact CB-CD1 3.81Å; R290-L295 HydrophobicContact CB-CD2 4.26Å; R290-L295 HydrophobicContact CB-CG 3.91Å; T291-L295 PolarHBondContact O-N 2.94Å; P292-L295 PolarHBondContact O-N 2.83Å; L295-P297 CarbonylContact O-C 3.57Å; L295-P297 VanDerWaalsContact O-C 3.32Å; L295-I298 HydrophobicContact CB-CD1 3.75Å; L295-L349 HydrophobicContact CD1-CD2 4.12Å
296	N	95.1	Very high	95.3	Very high	60 Å²	60	57.9 Å²	57.9	32%	0.321	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-79.7	140.7	-173.9	-75.8	-27.4	0	0	0	113.7	P292 T348 L349	P292-N296 WeakPolarHBondContact O-CB 3.22Å; P292-N296 VanDerWaalsContact O-CG 3.24Å; P292-N296 PolarHBondContact O-N 2.6Å; P292-N296 PolarHBondContact O-ND2 2.84Å; N296-T348 WeakPolarHBondContact OD1-CA 3.29Å; N296-L349 PolarHBondContact ND2-O 2.98Å; N296-L349 PolarHBondContact OD1-N 3.47Å
297	P	95.2	Very high	95.3	Very high	79 Å²	79	60.8 Å²	60.8	51%	0.513	33%	0.325	S	S	.	.	S	Bend	cis	-77.4	144.2	-5.3	32	-35	0	0	0	112.5	L295 L299 E346	L295-P297 CarbonylContact O-C 3.57Å; L295-P297 VanDerWaalsContact O-C 3.32Å; P297-L299 PolarHBondContact O-N 3.07Å; P297-E346 HydrophobicContact CB-CG 3.54Å; P297-E346 HydrophobicContact CG-CG 4.45Å
298	I	96.4	Very high	95.5	Very high	13 Å²	13	60.5 Å²	60.5	7%	0.067	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-66.1	120.8	179.2	-56.2	-59.3	0	0	0	109.6	A284 I286 L295 V300 L347 L349	A284-I298 HydrophobicContact CB-CG2 4.02Å; I286-I298 HydrophobicContact CD1-CD1 4.01Å; I286-I298 HydrophobicContact CD1-CG1 4.22Å; I286-I298 HydrophobicContact CD1-CG2 4.1Å; I286-I298 HydrophobicContact CG1-CD1 4.24Å; I286-I298 HydrophobicContact CG1-CG2 4.15Å; L295-I298 HydrophobicContact CB-CD1 3.75Å; I298-V300 PolarHBondContact O-N 2.91Å; I298-L347 HydrophobicContact CB-CB 4.23Å; I298-L347 HydrophobicContact CB-CD2 4.04Å; I298-L347 HydrophobicContact CB-CG 4.17Å; I298-L347 WeakPolarHBondContact CB-O 3.3Å; I298-L347 HydrophobicContact CG1-CG 4.5Å; I298-L347 HydrophobicContact CG2-CD2 3.95Å; I298-L347 PolarHBondContact N-O 3.06Å; I298-L349 HydrophobicContact CD1-CB 4.03Å; I298-L349 HydrophobicContact CG1-CB 4.22Å
299	L	96.3	Very high	95.7	Very high	134 Å²	134	63.2 Å²	63.2	70%	0.702	34%	0.335	S	S	*	.			trans	-71.5	113.7	178.7	-179.4	61.7	0	0	0	110.8	P297	P297-L299 PolarHBondContact O-N 3.07Å
300	V	97.6	Very high	96	Very high	12 Å²	12	59.9 Å²	59.9	7%	0.073	32%	0.317	C	S	.	.			trans	-98.1	136.7	173.1	-172	0	0	0	0	110.1	Y282 Q283 A284 I298 P302 I304 L347 L381	Y282-V300 HydrophobicContact CD1-CG1 4.16Å; Y282-V300 HydrophobicContact CG-CG1 4.19Å; Q283-V300 WeakPolarHBondContact O-CA 3.31Å; A284-V300 HydrophobicContact CB-CG2 4.4Å; I298-V300 PolarHBondContact O-N 2.91Å; V300-P302 CarbonylContact C-O 3.09Å; V300-P302 CarbonylContact O-C 3.53Å; V300-P302 VanDerWaalsContact O-C 3.26Å; V300-I304 HydrophobicContact CB-CD1 4.35Å; V300-I304 HydrophobicContact CB-CG1 4.07Å; V300-I304 HydrophobicContact CG1-CD1 4.01Å; V300-I304 HydrophobicContact CG1-CG1 3.69Å; V300-I304 HydrophobicContact CG2-CD1 4.11Å; V300-I304 HydrophobicContact CG2-CG1 4.35Å; V300-L347 HydrophobicContact CG2-CB 4.23Å; V300-L347 HydrophobicContact CG2-CD2 4Å; V300-L381 HydrophobicContact CG1-CD1 3.74Å; V300-L381 HydrophobicContact CG2-CD1 4.43Å
301	T	96.2	Very high	96.2	Very high	87 Å²	87	62.1 Å²	62.1	53%	0.534	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-119.2	123.5	-179.3	-59.3	0	0	0	0	110.8	Q283	Q283-T301 PolarHBondContact N-O 2.87Å; Q283-T301 PolarHBondContact O-N 3.49Å
302	P	96.7	Very high	96.3	Very high	40 Å²	40	63 Å²	63	26%	0.26	33%	0.328	S	S	.	.	S	Bend	cis	-62.1	169.2	-16.8	28.4	-33.3	0	0	0	111.6	P267 Y282 V300 I304	P267-P302 HydrophobicContact CG-CG 4.32Å; Y282-P302 HydrophobicContact CD1-CG 3.95Å; Y282-P302 WeakPolarHBondContact CD1-O 3.39Å; Y282-P302 HydrophobicContact CE1-CG 3.95Å; V300-P302 CarbonylContact C-O 3.09Å; V300-P302 CarbonylContact O-C 3.53Å; V300-P302 VanDerWaalsContact O-C 3.26Å; P302-I304 PolarHBondContact O-N 3.15Å
303	P	96.9	Very high	96.5	Very high	88 Å²	88	62.7 Å²	62.7	57%	0.571	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-57.7	133.6	175.5	-24.9	35.1	0	0	0	111.6	Q305	P303-Q305 PolarHBondContact O-N 2.81Å
304	I	97.8	Very high	96.5	Very high	16 Å²	16	59.8 Å²	59.8	8%	0.082	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-70.1	116.9	179.1	-52.9	178.7	0	0	0	109.1	F265 Y282 V300 P302 Y324 M340 A345 L381	F265-I304 HydrophobicContact CD1-CG2 4.43Å; F265-I304 HydrophobicContact CE1-CG2 4Å; Y282-I304 HydrophobicContact CD1-CG1 3.98Å; Y282-I304 HydrophobicContact CD2-CG1 4.15Å; Y282-I304 HydrophobicContact CE1-CB 4.29Å; Y282-I304 HydrophobicContact CE1-CG1 4.02Å; Y282-I304 HydrophobicContact CE2-CB 4.49Å; Y282-I304 HydrophobicContact CE2-CG1 4.2Å; Y282-I304 HydrophobicContact CE2-CG2 4.03Å; Y282-I304 HydrophobicContact CG-CG1 4.03Å; V300-I304 HydrophobicContact CB-CD1 4.35Å; V300-I304 HydrophobicContact CB-CG1 4.07Å; V300-I304 HydrophobicContact CG1-CD1 4.01Å; V300-I304 HydrophobicContact CG1-CG1 3.69Å; V300-I304 HydrophobicContact CG2-CD1 4.11Å; V300-I304 HydrophobicContact CG2-CG1 4.35Å; P302-I304 PolarHBondContact O-N 3.15Å; I304-Y324 HydrophobicContact CG2-CD1 4.48Å; I304-M340 HydrophobicContact CD1-CE 3.62Å; I304-A345 HydrophobicContact CB-CB 3.7Å; I304-A345 HydrophobicContact CG2-CB 3.55Å; I304-L381 HydrophobicContact CD1-CD2 4.36Å
305	Q	96.9	Very high	96.6	Very high	94 Å²	94	57.3 Å²	57.3	44%	0.439	31%	0.306	S	S	.	.			trans	-151.7	145.3	172.7	65	-172.3	-27.8	0	0	109.5	F265 L266 Y282 P303	F265-Q305 WeakPolarHBondContact CA-O 3.48Å; L266-Q305 HydrophobicContact CB-CG 3.82Å; L266-Q305 HydrophobicContact CD1-CG 4.07Å; L266-Q305 HydrophobicContact CG-CG 4.24Å; L266-Q305 PolarHBondContact N-O 3.47Å; Y282-Q305 PolarHBondContact OH-O 2.77Å; P303-Q305 PolarHBondContact O-N 2.81Å
306	A	97.4	Very high	96.7	Very high	8 Å²	8	59.5 Å²	59.5	7%	0.066	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	155.1	166.9	0	0	0	0	0	109.2	P263 M264 F265 I322 Y324 A367	P263-A306 HydrophobicContact CB-CB 4.15Å; M264-A306 CarbonylContact O-C 3.59Å; M264-A306 WeakPolarHBondContact O-CA 3.35Å; M264-A306 WeakPolarHBondContact O-CB 3.28Å; F265-A306 HydrophobicContact CD1-CB 3.91Å; F265-A306 HydrophobicContact CE1-CB 4.26Å; F265-A306 HydrophobicContact CG-CB 4.38Å; A306-I322 HydrophobicContact CB-CD1 4.32Å; A306-I322 HydrophobicContact CB-CG2 4.47Å; A306-I322 VanDerWaalsContact O-CD1 3.31Å; A306-I322 WeakPolarHBondContact O-CD1 3.12Å; A306-Y324 HydrophobicContact CB-CE1 3.94Å; A306-Y324 PolarHBondContact N-OH 3.47Å; A306-Y324 PolarHBondContact O-OH 3.05Å; A306-A367 HydrophobicContact CB-CB 3.82Å
307	I	97.2	Very high	96.8	Very high	63 Å²	63	61.2 Å²	61.2	32%	0.323	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	156.6	172.2	58.3	174.2	0	0	0	109	P263 M264 L266 R311	P263-I307 CarbonylContact C-O 3.32Å; P263-I307 WeakPolarHBondContact CA-O 3.37Å; M264-I307 HydrophobicContact CE-CD1 4.5Å; M264-I307 HydrophobicContact CE-CG1 4.48Å; M264-I307 HydrophobicContact CG-CG1 4.18Å; M264-I307 PolarHBondContact N-O 3.06Å; M264-I307 PolarHBondContact O-N 3.09Å; L266-I307 HydrophobicContact CD1-CD1 4.03Å; L266-I307 HydrophobicContact CD1-CG1 4.14Å; L266-I307 HydrophobicContact CD1-CG2 4.08Å; L266-I307 HydrophobicContact CD2-CD1 4.1Å; L266-I307 HydrophobicContact CD2-CG1 4.11Å; L266-I307 HydrophobicContact CG-CG1 4.3Å; I307-R311 VanDerWaalsContact CD1-NH1 3.33Å
308	D	97.2	Very high	96.8	Very high	27 Å²	27	62.2 Å²	62.2	14%	0.144	34%	0.34	C	S	.	.			trans	-55.1	145.5	172.7	-148.9	-32.8	0	0	0	111.4	D310 R311 P320	D308-D310 PolarHBondContact OD1-N 3Å; D308-R311 PolarHBondContact O-NE 3.23Å; D308-R311 VanDerWaalsContact O-NE 3.08Å; D308-P320 WeakPolarHBondContact OD2-CD 3.23Å; D308-P320 WeakPolarHBondContact OD2-CG 3.23Å
309	Q	97.2	Very high	96.9	Very high	60 Å²	60	66.8 Å²	66.8	28%	0.28	36%	0.356	S	S	.	.	S	Bend	trans	-80.2	-27.7	168.2	-79.1	179.8	114.8	0	0	110.9	L261 G262 M264 R311	L261-Q309 HydrophobicContact CB-CB 3.57Å; L261-Q309 HydrophobicContact CD1-CB 3.99Å; L261-Q309 HydrophobicContact CG-CB 4.45Å; G262-Q309 VanDerWaalsContact O-CB 3.27Å; G262-Q309 WeakPolarHBondContact O-CB 3.32Å; G262-Q309 WeakPolarHBondContact O-CG 2.98Å; G262-Q309 PolarHBondContact O-N 2.92Å; G262-Q309 PolarHBondContact O-NE2 2.81Å; M264-Q309 HydrophobicContact CB-CG 3.79Å; M264-Q309 HydrophobicContact CG-CG 3.55Å; M264-Q309 HydrophobicContact SD-CG 3.8Å; Q309-R311 WeakPolarHBondContact O-CD 2.91Å; Q309-R311 VanDerWaalsContact O-CG 3.24Å; Q309-R311 WeakPolarHBondContact O-CG 3.37Å; Q309-R311 PolarHBondContact O-N 2.87Å; Q309-R311 PolarHBondContact O-NE 3.27Å
310	D	97.7	Very high	96.9	Very high	6 Å²	6	61.5 Å²	61.5	3%	0.032	33%	0.33	C	S	.	.			trans	-85.3	101.1	-176.7	-64.9	-15.5	0	0	0	109.7	D257 D259 D260 L261 D308 I313	D257-D310 WeakPolarHBondContact OD1-CB 3.23Å; D259-D310 WeakPolarHBondContact CA-OD2 3.06Å; D260-D310 PolarHBondContact N-OD2 3.25Å; D260-D310 VanDerWaalsContact N-OD2 3.17Å; L261-D310 WeakPolarHBondContact CB-OD1 3.45Å; L261-D310 WeakPolarHBondContact CD1-OD1 3.17Å; L261-D310 VanDerWaalsContact CG-OD1 3.25Å; L261-D310 WeakPolarHBondContact CG-OD1 3.34Å; L261-D310 PolarHBondContact N-OD2 2.92Å; L261-D310 VanDerWaalsContact N-OD2 3.08Å; D308-D310 PolarHBondContact OD1-N 3Å; D310-I313 HydrophobicContact CB-CD1 3.86Å; D310-I313 HydrophobicContact CB-CG1 3.77Å
311	R	96.2	Very high	96.8	Very high	134 Å²	134	62 Å²	62	51%	0.506	34%	0.338	S	S	.	.			trans	-86.5	-22.1	-157.7	-57.9	-44.6	-178.4	114.1	-11.4	114.4	D257 M264 I307 D308 Q309	D257-R311 PolarHBondContact OD2-N 3.27Å; M264-R311 PolarHBondContact SD-NH2 3.26Å; I307-R311 VanDerWaalsContact CD1-NH1 3.33Å; D308-R311 PolarHBondContact O-NE 3.23Å; D308-R311 VanDerWaalsContact O-NE 3.08Å; Q309-R311 WeakPolarHBondContact O-CD 2.91Å; Q309-R311 VanDerWaalsContact O-CG 3.24Å; Q309-R311 WeakPolarHBondContact O-CG 3.37Å; Q309-R311 PolarHBondContact O-N 2.87Å; Q309-R311 PolarHBondContact O-NE 3.27Å
312	N	97.5	Very high	96.9	Very high	67 Å²	67	59.1 Å²	59.1	36%	0.358	32%	0.319	S	S	.	.			trans	-131.6	29.5	-171.6	-168.3	37.7	0	0	0	112	Y222 D257 Q314	Y222-N312 HydrophobicContact CE1-CB 4.32Å; Y222-N312 PolarHBondContact OH-ND2 2.77Å; D257-N312 HydrophobicContact CB-CB 4.12Å; D257-N312 VanDerWaalsContact CG-C 3.45Å; D257-N312 VanDerWaalsContact OD2-CA 3.24Å; D257-N312 WeakPolarHBondContact OD2-CA 3.22Å; D257-N312 VanDerWaalsContact OD2-CB 3.25Å; D257-N312 WeakPolarHBondContact OD2-CB 3.46Å; D257-N312 PolarHBondContact OD2-N 3.25Å; N312-Q314 WeakPolarHBondContact O-CG 3.08Å; N312-Q314 PolarHBondContact O-N 2.91Å; N312-Q314 VanDerWaalsContact O-N 3.1Å; N312-Q314 PolarHBondContact OD1-NE2 2.92Å
313	I	97.4	Very high	97	Very high	14 Å²	14	59.7 Å²	59.7	7%	0.072	32%	0.32	C	S	.	.			trans	-46.9	121.5	163.2	-61.2	-64.8	0	0	0	109.2	D257 G258 D310 D318 R319	D257-I313 VanDerWaalsContact OD1-CD1 3.3Å; D257-I313 WeakPolarHBondContact OD1-CD1 3.48Å; D257-I313 PolarHBondContact OD1-N 3.01Å; G258-I313 VanDerWaalsContact CA-CD1 3.5Å; D310-I313 HydrophobicContact CB-CD1 3.86Å; D310-I313 HydrophobicContact CB-CG1 3.77Å; I313-D318 HydrophobicContact CG2-CB 4.29Å; I313-R319 HydrophobicContact CB-CG 3.85Å; I313-R319 HydrophobicContact CG2-CG 3.83Å; I313-R319 VanDerWaalsContact O-CZ 3.32Å; I313-R319 PolarHBondContact O-NE 2.76Å; I313-R319 PolarHBondContact O-NH2 3.45Å
314	Q	94.9	Very high	97.1	Very high	99 Å²	99	56.5 Å²	56.5	46%	0.463	30%	0.296	S	S	.	.	S	Bend	trans	-127.5	138.1	177.6	-65.5	-55.7	-27.6	0	0	109.9	N312	N312-Q314 WeakPolarHBondContact O-CG 3.08Å; N312-Q314 PolarHBondContact O-N 2.91Å; N312-Q314 VanDerWaalsContact O-N 3.1Å; N312-Q314 PolarHBondContact OD1-NE2 2.92Å
315	P	96.9	Very high	97.1	Very high	64 Å²	64	57.4 Å²	57.4	42%	0.416	30%	0.304	S	S	.	.	S	Bend	cis	-71.9	164	-3.4	30.2	-35.9	0	0	0	113	S317 D318	P315-S317 WeakPolarHBondContact CG-OG 3.38Å; P315-S317 PolarHBondContact O-N 2.81Å; P315-D318 PolarHBondContact O-N 2.86Å
316	P	96.5	Very high	97.1	Very high	85 Å²	85	54.3 Å²	54.3	55%	0.552	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-7.7	-178.8	-22.5	35.4	0	0	0	115.4	D318	P316-D318 VanDerWaalsContact C-N 3.25Å
317	S	96.7	Very high	97.1	Very high	96 Å²	96	57.7 Å²	57.7	67%	0.671	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-21.4	170.7	47.1	0	0	0	0	113.6	P315	P315-S317 WeakPolarHBondContact CG-OG 3.38Å; P315-S317 PolarHBondContact O-N 2.81Å
318	D	96	Very high	97.1	Very high	100 Å²	100	58.7 Å²	58.7	54%	0.535	32%	0.315	S	S	.	.	S	Bend	trans	-98.3	-0.1	-169.9	-59.8	19.9	0	0	0	110.6	I313 P315 P316	I313-D318 HydrophobicContact CG2-CB 4.29Å; P315-D318 PolarHBondContact O-N 2.86Å; P316-D318 VanDerWaalsContact C-N 3.25Å
319	R	97	Very high	97.1	Very high	108 Å²	108	57.9 Å²	57.9	41%	0.408	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-71	126.3	173.8	-69.2	172.6	-173.3	-151.7	-6.5	110.2	I313	I313-R319 HydrophobicContact CB-CG 3.85Å; I313-R319 HydrophobicContact CG2-CG 3.83Å; I313-R319 VanDerWaalsContact O-CZ 3.32Å; I313-R319 PolarHBondContact O-NE 2.76Å; I313-R319 PolarHBondContact O-NH2 3.45Å
320	P	96.8	Very high	97.1	Very high	23 Å²	23	59 Å²	59	15%	0.149	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-69.5	153.1	-178.6	29	-35.3	0	0	0	112.5	D308 Q369 N371	D308-P320 WeakPolarHBondContact OD2-CD 3.23Å; D308-P320 WeakPolarHBondContact OD2-CG 3.23Å; P320-Q369 HydrophobicContact CB-CB 3.78Å; P320-Q369 HydrophobicContact CB-CG 3.79Å; P320-Q369 HydrophobicContact CG-CB 4.21Å; P320-Q369 HydrophobicContact CG-CG 3.63Å; P320-N371 HydrophobicContact CB-CB 4.23Å
321	G	96.7	Very high	97	Very high	23 Å²	23	61.2 Å²	61.2	24%	0.237	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-82	149.2	161	0	0	0	0	0	110.6	Q369 D370	G321-Q369 CarbonylContact O-C 3.36Å; G321-Q369 WeakPolarHBondContact O-CA 3.5Å; G321-D370 WeakPolarHBondContact CA-OD1 3.48Å; G321-D370 PolarHBondContact N-OD1 3.46Å; G321-D370 VanDerWaalsContact O-CG 3.3Å; G321-D370 PolarHBondContact O-N 2.74Å
322	I	98.1	Very high	97	Very high	27 Å²	27	63.1 Å²	63.1	14%	0.138	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	136.6	176.1	-62.6	168.7	0	0	0	110	P263 A306 Y324 A367 E368	P263-I322 HydrophobicContact CB-CD1 4.03Å; P263-I322 HydrophobicContact CB-CG1 4.28Å; P263-I322 HydrophobicContact CG-CD1 4.37Å; P263-I322 HydrophobicContact CG-CG1 4.09Å; A306-I322 HydrophobicContact CB-CD1 4.32Å; A306-I322 HydrophobicContact CB-CG2 4.47Å; A306-I322 VanDerWaalsContact O-CD1 3.31Å; A306-I322 WeakPolarHBondContact O-CD1 3.12Å; I322-Y324 HydrophobicContact CB-CE2 4.37Å; I322-Y324 HydrophobicContact CG2-CD2 4.34Å; I322-Y324 HydrophobicContact CG2-CE1 4.03Å; I322-Y324 HydrophobicContact CG2-CE2 3.82Å; I322-A367 HydrophobicContact CG2-CB 3.98Å; I322-E368 CarbonylContact C-O 3.26Å; I322-E368 WeakPolarHBondContact CA-O 3.36Å
323	L	98.2	Very high	96.9	Very high	51 Å²	51	62.2 Å²	62.2	27%	0.267	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.3	172.8	-65.8	172.6	0	0	0	110.8	P342 R343 A367 E368 D370	L323-P342 CarbonylContact C-O 3.58Å; L323-P342 VanDerWaalsContact CA-O 3.3Å; L323-P342 WeakPolarHBondContact CA-O 3.16Å; L323-R343 HydrophobicContact CD2-CG 4.16Å; L323-A367 WeakPolarHBondContact O-CA 3.38Å; L323-E368 HydrophobicContact CB-CG 4.2Å; L323-E368 PolarHBondContact N-O 3.07Å; L323-E368 PolarHBondContact O-N 2.93Å; L323-D370 HydrophobicContact CD1-CB 3.67Å; L323-D370 HydrophobicContact CG-CB 3.89Å
324	Y	98.4	Very high	96.9	Very high	22 Å²	22	63.1 Å²	63.1	9%	0.086	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	142.2	177.5	-58.6	-86.6	0	0	0	110.9	F265 I304 A306 I322 P342 A345 K366 A367	F265-Y324 HydrophobicContact CE1-CD1 4.24Å; F265-Y324 HydrophobicContact CE1-CE1 4.12Å; I304-Y324 HydrophobicContact CG2-CD1 4.48Å; A306-Y324 HydrophobicContact CB-CE1 3.94Å; A306-Y324 PolarHBondContact N-OH 3.47Å; A306-Y324 PolarHBondContact O-OH 3.05Å; I322-Y324 HydrophobicContact CB-CE2 4.37Å; I322-Y324 HydrophobicContact CG2-CD2 4.34Å; I322-Y324 HydrophobicContact CG2-CE1 4.03Å; I322-Y324 HydrophobicContact CG2-CE2 3.82Å; Y324-P342 PolarHBondContact N-O 2.68Å; Y324-P342 WeakPolarHBondContact O-CA 3.38Å; Y324-A345 HydrophobicContact CD1-CB 3.78Å; Y324-A345 HydrophobicContact CD2-CB 3.99Å; Y324-A345 HydrophobicContact CE1-CB 4.14Å; Y324-A345 HydrophobicContact CE2-CB 4.35Å; Y324-A345 HydrophobicContact CG-CB 3.68Å; Y324-K366 WeakPolarHBondContact CA-O 3.17Å; Y324-A367 HydrophobicContact CD1-CB 4.06Å; Y324-A367 HydrophobicContact CE1-CB 4.03Å
325	S	98.1	Very high	97	Very high	34 Å²	34	62 Å²	62	24%	0.238	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	148.8	177	51.2	0	0	0	0	111.5	I365 K366	S325-I365 CarbonylContact O-C 3.58Å; S325-I365 WeakPolarHBondContact O-CA 3.49Å; S325-K366 PolarHBondContact N-O 3.02Å; S325-K366 PolarHBondContact O-N 3.07Å; S325-K366 WeakPolarHBondContact OG-CE 3.21Å
326	I	98.1	Very high	97	Very high	30 Å²	30	65 Å²	65	15%	0.154	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	121.4	163.4	-51	163.3	0	0	0	106.3	Y334 F338 M340 L347 L363 I365	I326-Y334 HydrophobicContact CB-CE2 3.93Å; I326-Y334 HydrophobicContact CD1-CD2 4.41Å; I326-Y334 HydrophobicContact CD1-CE2 4.35Å; I326-Y334 HydrophobicContact CG2-CD2 3.92Å; I326-Y334 HydrophobicContact CG2-CE2 3.3Å; I326-F338 HydrophobicContact CD1-CB 4.05Å; I326-M340 HydrophobicContact CD1-CB 4.22Å; I326-M340 HydrophobicContact CG1-CB 4.07Å; I326-M340 HydrophobicContact CG1-CE 4.45Å; I326-L347 HydrophobicContact CD1-CD1 4.49Å; I326-L363 HydrophobicContact CD1-CD1 4.27Å; I326-L363 HydrophobicContact CG2-CB 4.19Å; I326-L363 HydrophobicContact CG2-CD1 4.27Å; I326-I365 HydrophobicContact CB-CD1 4.28Å; I326-I365 HydrophobicContact CG1-CD1 3.76Å; I326-I365 HydrophobicContact CG2-CD1 4.31Å
327	L	97.1	Very high	97.1	Very high	79 Å²	79	61.1 Å²	61.1	41%	0.414	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-50.4	-174.6	179.5	68	0	0	0	111.7	V364 K366 F378	L327-V364 HydrophobicContact CD2-CG1 4.47Å; L327-V364 PolarHBondContact N-O 3.35Å; L327-K366 HydrophobicContact CB-CB 4.28Å; L327-K366 HydrophobicContact CD1-CD 4.47Å; L327-F378 HydrophobicContact CD2-CD1 3.92Å; L327-F378 HydrophobicContact CD2-CE1 3.72Å
328	V	97.1	Very high	97.1	Very high	83 Å²	83	56.9 Å²	56.9	50%	0.503	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	164	179.6	-72	0	0	0	0	108.7	V364	V328-V364 HydrophobicContact CG2-CB 3.82Å; V328-V364 HydrophobicContact CG2-CG2 3.86Å; V328-V364 PolarHBondContact O-N 3.24Å
329	G	96.5	Very high	97.2	Very high	10 Å²	10	56.6 Å²	56.6	10%	0.103	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	160.5	175.7	0	0	0	0	0	112.6	Y334 D362	G329-Y334 VanDerWaalsContact N-CE1 3.31Å; G329-D362 CarbonylContact C-O 3.58Å; G329-D362 WeakPolarHBondContact CA-O 3.44Å
330	T	96.8	Very high	97.2	Very high	85 Å²	85	52 Å²	52	52%	0.521	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	129.6	176.1	52.4	0	0	0	0	110.2	F361 D362	T330-F361 WeakPolarHBondContact O-CA 3.5Å; T330-D362 PolarHBondContact N-O 2.85Å; T330-D362 PolarHBondContact O-N 2.87Å
331	P	96.5	Very high	97.3	Very high	52 Å²	52	55 Å²	55	34%	0.338	29%	0.29	S	S	.	.	S	Bend	cis	-55.3	151.3	-7.1	-26.8	36.3	0	0	0	115.4	D333 Y334 K360 F361	P331-D333 WeakPolarHBondContact CB-OD1 3.45Å; P331-D333 PolarHBondContact O-N 3.14Å; P331-Y334 WeakPolarHBondContact O-CD1 3.26Å; P331-Y334 PolarHBondContact O-N 3.33Å; P331-K360 WeakPolarHBondContact CD-O 3.28Å; P331-F361 HydrophobicContact CG-CD1 4.47Å; P331-F361 HydrophobicContact CG-CE1 4.44Å
332	E	95.3	Very high	97.3	Very high	173 Å²	173	56.6 Å²	56.6	81%	0.808	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-18.5	-176.2	-65.2	-172	159.3	0	0	113.7	Y334 P335	E332-Y334 PolarHBondContact O-N 2.87Å; E332-P335 VanDerWaalsContact O-CD 3.24Å; E332-P335 WeakPolarHBondContact O-CD 3.29Å
333	D	96.5	Very high	97.2	Very high	49 Å²	49	62 Å²	62	26%	0.262	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	11.8	179.8	79.3	-41.9	0	0	0	114	P331 P335 R336 H358	P331-D333 WeakPolarHBondContact CB-OD1 3.45Å; P331-D333 PolarHBondContact O-N 3.14Å; D333-P335 WeakPolarHBondContact O-CD 2.9Å; D333-P335 VanDerWaalsContact O-N 3.09Å; D333-R336 WeakPolarHBondContact O-CB 3.22Å; D333-R336 WeakPolarHBondContact O-CG 3.28Å; D333-R336 PolarHBondContact O-N 3.11Å; D333-R336 IonicContact OD2-CZ 3.38Å; D333-R336 IonicContact OD2-NH1 2.64Å; D333-R336 PolarHBondContact OD2-NH1 3.25Å; D333-H358 IonicContact OD1-CE1 2.69Å; D333-H358 PolarHBondContact OD1-CE1 3.26Å; D333-H358 IonicContact OD1-ND1 3.69Å; D333-H358 IonicContact OD2-CE1 2.71Å; D333-H358 PolarHBondContact OD2-CE1 3.17Å
334	Y	97.1	Very high	97.2	Very high	33 Å²	33	63.2 Å²	63.2	13%	0.129	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-45	-32.6	168.8	80	-94.2	0	0	0	115.7	I326 G329 P331 E332 R336 F337 F338 L363	I326-Y334 HydrophobicContact CB-CE2 3.93Å; I326-Y334 HydrophobicContact CD1-CD2 4.41Å; I326-Y334 HydrophobicContact CD1-CE2 4.35Å; I326-Y334 HydrophobicContact CG2-CD2 3.92Å; I326-Y334 HydrophobicContact CG2-CE2 3.3Å; G329-Y334 VanDerWaalsContact N-CE1 3.31Å; P331-Y334 WeakPolarHBondContact O-CD1 3.26Å; P331-Y334 PolarHBondContact O-N 3.33Å; E332-Y334 PolarHBondContact O-N 2.87Å; Y334-R336 PolarHBondContact O-N 3.34Å; Y334-R336 VanDerWaalsContact O-N 3.15Å; Y334-F337 PolarHBondContact O-N 2.83Å; Y334-F338 PolarHBondContact O-N 3.17Å; Y334-L363 HydrophobicContact CD1-CD2 4.15Å; Y334-L363 HydrophobicContact CD2-CD2 3.98Å; Y334-L363 HydrophobicContact CG-CD2 3.66Å
335	P	97.2	Very high	97.1	Very high	75 Å²	75	62.3 Å²	62.3	49%	0.487	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-68	-11.2	178.7	-19.2	33.5	0	0	0	114.2	E332 D333	E332-P335 VanDerWaalsContact O-CD 3.24Å; E332-P335 WeakPolarHBondContact O-CD 3.29Å; D333-P335 WeakPolarHBondContact O-CD 2.9Å; D333-P335 VanDerWaalsContact O-N 3.09Å
336	R	96.7	Very high	97.1	Very high	126 Å²	126	65 Å²	65	48%	0.475	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-74.5	-36.1	169.6	-66.1	172	52.9	-156.6	-4.5	112.3	D333 Y334 L350 E351	D333-R336 WeakPolarHBondContact O-CB 3.22Å; D333-R336 WeakPolarHBondContact O-CG 3.28Å; D333-R336 PolarHBondContact O-N 3.11Å; D333-R336 IonicContact OD2-CZ 3.38Å; D333-R336 IonicContact OD2-NH1 2.64Å; D333-R336 PolarHBondContact OD2-NH1 3.25Å; Y334-R336 PolarHBondContact O-N 3.34Å; Y334-R336 VanDerWaalsContact O-N 3.15Å; R336-L350 VanDerWaalsContact O-CB 3.29Å; R336-L350 WeakPolarHBondContact O-CB 3.48Å; R336-E351 IonicContact CZ-OE1 3.12Å; R336-E351 IonicContact NE-OE1 3.29Å; R336-E351 PolarHBondContact NE-OE1 3.1Å; R336-E351 IonicContact NH2-OE1 2.76Å; R336-E351 PolarHBondContact NH2-OE1 2.85Å
337	F	97.5	Very high	97	Very high	5 Å²	5	63.7 Å²	63.7	2%	0.022	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-34.1	-172.8	-61.3	-76.8	0	0	0	112.2	Y334 L349 L350 E351 V353 H358 F361	Y334-F337 PolarHBondContact O-N 2.83Å; F337-L349 HydrophobicContact CB-CD1 4.47Å; F337-L349 CarbonylContact O-C 3.57Å; F337-L349 VanDerWaalsContact O-CA 3.3Å; F337-L349 WeakPolarHBondContact O-CA 3.37Å; F337-L350 PolarHBondContact O-N 2.89Å; F337-E351 HydrophobicContact CD1-CG 3.66Å; F337-E351 HydrophobicContact CE1-CG 3.79Å; F337-V353 HydrophobicContact CD1-CG2 3.92Å; F337-V353 HydrophobicContact CE1-CG2 4.44Å; F337-H358 AromaticContact CE2-CE1 3.58Å; F337-H358 AromaticContact CE2-ND1 3.94Å; F337-H358 AromaticContact CE2-NE2 3.67Å; F337-H358 AromaticContact CZ-CD2 3.63Å; F337-H358 AromaticContact CZ-CE1 3.82Å; F337-H358 AromaticContact CZ-NE2 3.39Å; F337-H358 WeakPolarHBondContact CZ-NE2 3.44Å; F337-F361 HydrophobicContact CB-CZ 4.46Å; F337-F361 AromaticContact CD2-CE1 3.76Å; F337-F361 HydrophobicContact CD2-CE1 3.76Å; F337-F361 AromaticContact CD2-CZ 3.51Å; F337-F361 HydrophobicContact CD2-CZ 3.51Å; F337-F361 HydrophobicContact CE2-CE1 4.21Å; F337-F361 AromaticContact CE2-CZ 3.87Å; F337-F361 HydrophobicContact CE2-CZ 3.87Å; F337-F361 AromaticContact CG-CZ 3.99Å; F337-F361 HydrophobicContact CG-CZ 3.99Å
338	F	97.8	Very high	97.1	Very high	7 Å²	7	61.2 Å²	61.2	3%	0.031	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133.3	-169.5	-56.6	-67.6	0	0	0	113.6	I286 I326 Y334 L347 L349 F361 L363 I383	I286-F338 HydrophobicContact CD1-CE1 3.54Å; I286-F338 HydrophobicContact CD1-CZ 4Å; I326-F338 HydrophobicContact CD1-CB 4.05Å; Y334-F338 PolarHBondContact O-N 3.17Å; F338-L347 HydrophobicContact CB-CD1 4.17Å; F338-L347 HydrophobicContact CD1-CD1 4.24Å; F338-L347 HydrophobicContact CD1-CG 4.47Å; F338-L349 HydrophobicContact CD1-CD1 4.39Å; F338-L349 HydrophobicContact CE1-CD1 3.82Å; F338-L349 HydrophobicContact CZ-CD1 4.36Å; F338-F361 HydrophobicContact CE2-CB 4.21Å; F338-F361 AromaticContact CE2-CD1 3.92Å; F338-F361 HydrophobicContact CE2-CD1 3.92Å; F338-F361 AromaticContact CE2-CD2 3.53Å; F338-F361 HydrophobicContact CE2-CD2 3.53Å; F338-F361 HydrophobicContact CE2-CE1 4.13Å; F338-F361 AromaticContact CE2-CE2 3.75Å; F338-F361 HydrophobicContact CE2-CE2 3.75Å; F338-F361 AromaticContact CE2-CG 3.62Å; F338-F361 HydrophobicContact CE2-CG 3.62Å; F338-F361 HydrophobicContact CE2-CZ 4.04Å; F338-F361 AromaticContact CZ-CD2 3.89Å; F338-F361 HydrophobicContact CZ-CD2 3.89Å; F338-F361 HydrophobicContact CZ-CE2 4.06Å; F338-F361 HydrophobicContact CZ-CG 4.39Å; F338-L363 HydrophobicContact CD2-CD1 4.34Å; F338-I383 HydrophobicContact CD1-CD1 4.09Å; F338-I383 HydrophobicContact CD2-CD1 4.23Å; F338-I383 HydrophobicContact CE1-CD1 3.81Å; F338-I383 HydrophobicContact CE1-CG2 4.49Å; F338-I383 HydrophobicContact CE2-CD1 3.97Å; F338-I383 HydrophobicContact CG-CD1 4.29Å; F338-I383 HydrophobicContact CZ-CD1 3.75Å; F338-I383 HydrophobicContact CZ-CG2 4.15Å
339	H	97.4	Very high	97.1	Very high	93 Å²	93	57.4 Å²	57.4	43%	0.431	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	145.1	164.7	167.1	-89.4	0	0	0	109.1	T348 L350	H339-T348 PolarHBondContact N-O 2.76Å; H339-T348 PolarHBondContact ND1-OG1 3.31Å; H339-T348 PolarHBondContact O-N 2.74Å; H339-T348 PolarHBondContact O-OG1 3.12Å; H339-T348 VanDerWaalsContact O-OG1 3.08Å; H339-L350 HydrophobicContact CB-CD1 4.06Å; H339-L350 HydrophobicContact CB-CD2 3.92Å; H339-L350 HydrophobicContact CB-CG 4.17Å
340	M	97.8	Very high	97.1	Very high	13 Å²	13	61 Å²	61	6%	0.064	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.4	177.9	176.5	172.7	-77.5	0	0	109.7	I304 I326 A345 E346 L347 I365	I304-M340 HydrophobicContact CD1-CE 3.62Å; I326-M340 HydrophobicContact CD1-CB 4.22Å; I326-M340 HydrophobicContact CG1-CB 4.07Å; I326-M340 HydrophobicContact CG1-CE 4.45Å; M340-A345 HydrophobicContact SD-CB 4.48Å; M340-E346 CarbonylContact C-O 3.58Å; M340-E346 WeakPolarHBondContact CA-O 3.31Å; M340-L347 HydrophobicContact CE-CD1 4.45Å; M340-I365 HydrophobicContact CE-CD1 3.59Å; M340-I365 HydrophobicContact CE-CG1 4.08Å; M340-I365 HydrophobicContact CE-CG2 4.08Å; M340-I365 HydrophobicContact SD-CD1 4.26Å; M340-I365 HydrophobicContact SD-CG2 3.8Å
341	H	97.6	Very high	97	Very high	84 Å²	84	60.2 Å²	60.2	39%	0.389	30%	0.296	S	S	.	.			trans	-73.3	121.6	-179.4	-177.9	-104.9	0	0	0	111.3	R343 T344 A345 E346	H341-R343 VanDerWaalsContact C-N 3.26Å; H341-R343 PolarHBondContact O-N 2.87Å; H341-T344 PolarHBondContact ND1-OG1 3.46Å; H341-T344 PolarHBondContact O-N 2.79Å; H341-A345 PolarHBondContact O-N 2.98Å; H341-E346 HydrophobicContact CB-CB 4.11Å; H341-E346 PolarHBondContact N-O 2.81Å
342	P	97.6	Very high	96.9	Very high	57 Å²	57	60.6 Å²	60.6	37%	0.37	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-8.9	-159.3	26	-36.2	0	0	0	115.8	L323 Y324	L323-P342 CarbonylContact C-O 3.58Å; L323-P342 VanDerWaalsContact CA-O 3.3Å; L323-P342 WeakPolarHBondContact CA-O 3.16Å; Y324-P342 PolarHBondContact N-O 2.68Å; Y324-P342 WeakPolarHBondContact O-CA 3.38Å
343	R	96.7	Very high	96.9	Very high	140 Å²	140	52.4 Å²	52.4	53%	0.528	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-6.9	176.4	-70.1	-166.6	180	-79.7	8.2	115.3	L323 H341 D370	L323-R343 HydrophobicContact CD2-CG 4.16Å; H341-R343 VanDerWaalsContact C-N 3.26Å; H341-R343 PolarHBondContact O-N 2.87Å; R343-D370 IonicContact CZ-OD2 3.99Å; R343-D370 IonicContact NH1-OD2 3.24Å; R343-D370 PolarHBondContact NH1-OD2 3.3Å; R343-D370 IonicContact NH2-OD2 3.97Å; R343-D370 PolarHBondContact NH2-OD2 2.77Å
344	T	96.9	Very high	96.7	Very high	77 Å²	77	52.2 Å²	52.2	47%	0.472	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-4.1	179.9	59.3	0	0	0	0	113.4	H341 E346	H341-T344 PolarHBondContact ND1-OG1 3.46Å; H341-T344 PolarHBondContact O-N 2.79Å; T344-E346 PolarHBondContact O-N 3.34Å; T344-E346 WeakPolarHBondContact OG1-CB 3.47Å
345	A	97.2	Very high	96.5	Very high	4 Å²	4	53.7 Å²	53.7	3%	0.033	27%	0.265	C	S	.	.			trans	55.8	13.1	-172.2	0	0	0	0	0	115	I304 Y324 M340 H341 L347	I304-A345 HydrophobicContact CB-CB 3.7Å; I304-A345 HydrophobicContact CG2-CB 3.55Å; Y324-A345 HydrophobicContact CD1-CB 3.78Å; Y324-A345 HydrophobicContact CD2-CB 3.99Å; Y324-A345 HydrophobicContact CE1-CB 4.14Å; Y324-A345 HydrophobicContact CE2-CB 4.35Å; Y324-A345 HydrophobicContact CG-CB 3.68Å; M340-A345 HydrophobicContact SD-CB 4.48Å; H341-A345 PolarHBondContact O-N 2.98Å; A345-L347 PolarHBondContact O-N 3.2Å
346	E	96.9	Very high	96	Very high	90 Å²	90	53.9 Å²	53.9	42%	0.421	26%	0.262	S	S	.	.			trans	-63.2	124.5	179.9	-172.4	-177.4	131.1	0	0	110.3	P297 M340 H341 T344	P297-E346 HydrophobicContact CB-CG 3.54Å; P297-E346 HydrophobicContact CG-CG 4.45Å; M340-E346 CarbonylContact C-O 3.58Å; M340-E346 WeakPolarHBondContact CA-O 3.31Å; H341-E346 HydrophobicContact CB-CB 4.11Å; H341-E346 PolarHBondContact N-O 2.81Å; T344-E346 PolarHBondContact O-N 3.34Å; T344-E346 WeakPolarHBondContact OG1-CB 3.47Å
347	L	97.6	Very high	95.8	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.2	-177.2	-175.4	68.9	0	0	0	109.9	I298 V300 I326 F338 M340 A345 L381 I383	I298-L347 HydrophobicContact CB-CB 4.23Å; I298-L347 HydrophobicContact CB-CD2 4.04Å; I298-L347 HydrophobicContact CB-CG 4.17Å; I298-L347 WeakPolarHBondContact CB-O 3.3Å; I298-L347 HydrophobicContact CG1-CG 4.5Å; I298-L347 HydrophobicContact CG2-CD2 3.95Å; I298-L347 PolarHBondContact N-O 3.06Å; V300-L347 HydrophobicContact CG2-CB 4.23Å; V300-L347 HydrophobicContact CG2-CD2 4Å; I326-L347 HydrophobicContact CD1-CD1 4.49Å; F338-L347 HydrophobicContact CB-CD1 4.17Å; F338-L347 HydrophobicContact CD1-CD1 4.24Å; F338-L347 HydrophobicContact CD1-CG 4.47Å; M340-L347 HydrophobicContact CE-CD1 4.45Å; A345-L347 PolarHBondContact O-N 3.2Å; L347-L381 HydrophobicContact CD2-CD2 3.98Å; L347-I383 HydrophobicContact CD2-CD1 4.05Å
348	T	97.5	Very high	95.6	Very high	27 Å²	27	56.4 Å²	56.4	17%	0.166	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	125.5	179.5	54.3	0	0	0	0	110.8	N296 H339	N296-T348 WeakPolarHBondContact OD1-CA 3.29Å; H339-T348 PolarHBondContact N-O 2.76Å; H339-T348 PolarHBondContact ND1-OG1 3.31Å; H339-T348 PolarHBondContact O-N 2.74Å; H339-T348 PolarHBondContact O-OG1 3.12Å; H339-T348 VanDerWaalsContact O-OG1 3.08Å
349	L	97.5	Very high	95.4	Very high	3 Å²	3	62.5 Å²	62.5	2%	0.016	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	139.6	166.5	-173.1	72.5	0	0	0	110	I286 P292 L295 N296 I298 F337 F338 E351 V353	I286-L349 HydrophobicContact CD1-CD1 4.44Å; P292-L349 WeakPolarHBondContact CB-O 3.35Å; L295-L349 HydrophobicContact CD1-CD2 4.12Å; N296-L349 PolarHBondContact ND2-O 2.98Å; N296-L349 PolarHBondContact OD1-N 3.47Å; I298-L349 HydrophobicContact CD1-CB 4.03Å; I298-L349 HydrophobicContact CG1-CB 4.22Å; F337-L349 HydrophobicContact CB-CD1 4.47Å; F337-L349 CarbonylContact O-C 3.57Å; F337-L349 VanDerWaalsContact O-CA 3.3Å; F337-L349 WeakPolarHBondContact O-CA 3.37Å; F338-L349 HydrophobicContact CD1-CD1 4.39Å; F338-L349 HydrophobicContact CE1-CD1 3.82Å; F338-L349 HydrophobicContact CZ-CD1 4.36Å; L349-E351 WeakPolarHBondContact CD1-O 3.29Å; L349-E351 WeakPolarHBondContact CG-O 3.23Å; L349-V353 HydrophobicContact CD1-CG2 3.78Å
350	L	97.1	Very high	95.4	Very high	87 Å²	87	62.6 Å²	62.6	46%	0.455	31%	0.305	S	S	.	.			trans	-107.9	-37	-175.5	-64	177.3	0	0	0	113.2	P292 R336 F337 H339	P292-L350 WeakPolarHBondContact CG-O 3.39Å; R336-L350 VanDerWaalsContact O-CB 3.29Å; R336-L350 WeakPolarHBondContact O-CB 3.48Å; F337-L350 PolarHBondContact O-N 2.89Å; H339-L350 HydrophobicContact CB-CD1 4.06Å; H339-L350 HydrophobicContact CB-CD2 3.92Å; H339-L350 HydrophobicContact CB-CG 4.17Å
351	E	94.7	Very high	95.4	Very high	67 Å²	67	62 Å²	62	31%	0.313	30%	0.302	S	S	.	.	S	Bend	trans	-141.9	151.1	175.2	66	-176.7	-179.9	0	0	111	R336 F337 L349 V353	R336-E351 IonicContact CZ-OE1 3.12Å; R336-E351 IonicContact NE-OE1 3.29Å; R336-E351 PolarHBondContact NE-OE1 3.1Å; R336-E351 IonicContact NH2-OE1 2.76Å; R336-E351 PolarHBondContact NH2-OE1 2.85Å; F337-E351 HydrophobicContact CD1-CG 3.66Å; F337-E351 HydrophobicContact CE1-CG 3.79Å; L349-E351 WeakPolarHBondContact CD1-O 3.29Å; L349-E351 WeakPolarHBondContact CG-O 3.23Å; E351-V353 PolarHBondContact O-N 3.01Å
352	P	95.3	Very high	95.4	Very high	60 Å²	60	60.8 Å²	60.8	39%	0.39	30%	0.298	S	S	.	.			trans	-57.4	130.4	178.2	-24.2	33.7	0	0	0	112.4	R290	R290-P352 WeakPolarHBondContact O-CA 3.35Å; R290-P352 VanDerWaalsContact O-CB 3.3Å; R290-P352 WeakPolarHBondContact O-CB 3.38Å
353	V	94.9	Very high	95.4	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.006	28%	0.281	C	S	.	.			trans	-83.1	137	175.6	-165.2	0	0	0	0	109.5	I286 E288 L289 F337 L349 E351 H358 F361 I385	I286-V353 HydrophobicContact CG2-CG2 4.41Å; E288-V353 CarbonylContact C-O 3.5Å; E288-V353 WeakPolarHBondContact CA-O 3.35Å; E288-V353 WeakPolarHBondContact CB-O 3.41Å; L289-V353 PolarHBondContact N-O 3.47Å; F337-V353 HydrophobicContact CD1-CG2 3.92Å; F337-V353 HydrophobicContact CE1-CG2 4.44Å; L349-V353 HydrophobicContact CD1-CG2 3.78Å; E351-V353 PolarHBondContact O-N 3.01Å; V353-H358 HydrophobicContact CG1-CB 3.74Å; V353-F361 HydrophobicContact CG1-CE2 4.07Å; V353-I385 HydrophobicContact CB-CD1 4.21Å; V353-I385 HydrophobicContact CB-CG2 4.34Å; V353-I385 HydrophobicContact CG1-CD1 3.92Å; V353-I385 HydrophobicContact CG1-CG1 3.93Å; V353-I385 HydrophobicContact CG1-CG2 4.05Å; V353-I385 HydrophobicContact CG2-CD1 4.14Å
354	N	92.4	Very high	95.5	Very high	46 Å²	46	53.5 Å²	53.5	25%	0.246	27%	0.268	C	S	.	.			trans	-110.2	128.9	170	174.5	-52.5	0	0	0	109.1	L289 D356 F357 H358	L289-N354 HydrophobicContact CD2-CB 3.82Å; N354-D356 PolarHBondContact O-N 2.83Å; N354-D356 WeakPolarHBondContact OD1-CB 3.32Å; N354-D356 PolarHBondContact OD1-N 2.82Å; N354-F357 HydrophobicContact CB-CD2 4.06Å; N354-F357 PolarHBondContact O-N 2.91Å; N354-F357 WeakPolarHBondContact OD1-CD2 3.31Å; N354-H358 PolarHBondContact O-N 3.14Å
355	R	91.3	Very high	95.5	Very high	64 Å²	64	49.9 Å²	49.9	24%	0.242	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-21.8	-169.1	-166.3	174	171.5	-96.2	9.5	114.5	E288 F357 Q359 I385 D387	E288-R355 HydrophobicContact CB-CB 4.14Å; E288-R355 HydrophobicContact CG-CB 4.3Å; E288-R355 VanDerWaalsContact OE1-CB 3.24Å; E288-R355 WeakPolarHBondContact OE1-CB 3.4Å; E288-R355 VanDerWaalsContact OE2-CB 3.25Å; E288-R355 WeakPolarHBondContact OE2-CB 3.49Å; E288-R355 PolarHBondContact OE2-N 3.39Å; R355-F357 PolarHBondContact O-N 3.19Å; R355-Q359 HydrophobicContact CG-CG 4.48Å; R355-Q359 WeakPolarHBondContact O-CG 3.44Å; R355-I385 HydrophobicContact CB-CG2 4.05Å; R355-I385 VanDerWaalsContact CD-O 3.27Å; R355-I385 WeakPolarHBondContact CD-O 3.08Å; R355-I385 HydrophobicContact CG-CB 4.48Å; R355-I385 HydrophobicContact CG-CG2 4.16Å; R355-I385 PolarHBondContact NE-O 2.92Å; R355-D387 IonicContact CZ-OD2 2.91Å; R355-D387 IonicContact NH1-OD2 3.49Å; R355-D387 PolarHBondContact NH1-OD2 3.39Å; R355-D387 IonicContact NH2-OD2 3.54Å
356	D	87.1	Confident	95.6	Very high	79 Å²	79	51.2 Å²	51.2	42%	0.422	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-28.1	171.2	-86.1	-29.1	0	0	0	111.8	N354 Q391 K431	N354-D356 PolarHBondContact O-N 2.83Å; N354-D356 WeakPolarHBondContact OD1-CB 3.32Å; N354-D356 PolarHBondContact OD1-N 2.82Å; D356-Q391 PolarHBondContact OD1-NE2 3.32Å; D356-Q391 PolarHBondContact OD2-NE2 2.71Å; D356-Q391 VanDerWaalsContact OD2-NE2 3.17Å; D356-K431 VanDerWaalsContact CG-NZ 3.33Å; D356-K431 IonicContact OD1-NZ 3.27Å; D356-K431 PolarHBondContact OD1-NZ 2.97Å; D356-K431 IonicContact OD2-NZ 3.75Å; D356-K431 PolarHBondContact OD2-NZ 2.83Å
357	F	92.1	Very high	95.6	Very high	158 Å²	158	46.9 Å²	46.9	69%	0.693	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-38.3	-178.9	-57.7	-80	0	0	0	112.8	N354 R355	N354-F357 HydrophobicContact CB-CD2 4.06Å; N354-F357 PolarHBondContact O-N 2.91Å; N354-F357 WeakPolarHBondContact OD1-CD2 3.31Å; R355-F357 PolarHBondContact O-N 3.19Å
358	H	94.3	Very high	95.7	Very high	25 Å²	25	48.8 Å²	48.8	12%	0.116	24%	0.239	C	C	.	.			trans	-133	99.2	-175.4	-51.1	-90.2	0	0	0	110.2	D333 F337 V353 N354 F361 I385	D333-H358 IonicContact OD1-CE1 2.69Å; D333-H358 PolarHBondContact OD1-CE1 3.26Å; D333-H358 IonicContact OD1-ND1 3.69Å; D333-H358 IonicContact OD2-CE1 2.71Å; D333-H358 PolarHBondContact OD2-CE1 3.17Å; F337-H358 AromaticContact CE2-CE1 3.58Å; F337-H358 AromaticContact CE2-ND1 3.94Å; F337-H358 AromaticContact CE2-NE2 3.67Å; F337-H358 AromaticContact CZ-CD2 3.63Å; F337-H358 AromaticContact CZ-CE1 3.82Å; F337-H358 AromaticContact CZ-NE2 3.39Å; F337-H358 WeakPolarHBondContact CZ-NE2 3.44Å; V353-H358 HydrophobicContact CG1-CB 3.74Å; N354-H358 PolarHBondContact O-N 3.14Å; H358-F361 HydrophobicContact CB-CE2 3.81Å; H358-F361 HydrophobicContact CB-CZ 3.66Å; H358-F361 AromaticContact CG-CZ 3.78Å; H358-F361 AromaticContact ND1-CZ 3.71Å; H358-I385 WeakPolarHBondContact O-CB 3.02Å; H358-I385 VanDerWaalsContact O-CG1 3.29Å; H358-I385 WeakPolarHBondContact O-CG1 3.27Å
359	Q	93.5	Very high	95.7	Very high	135 Å²	135	47.8 Å²	47.8	63%	0.631	23%	0.233	S	C	*	.	S	Bend	trans	-81.5	-26.9	-179.9	-65.3	169.7	1.9	0	0	112.9	R355 I385	R355-Q359 HydrophobicContact CG-CG 4.48Å; R355-Q359 WeakPolarHBondContact O-CG 3.44Å; Q359-I385 WeakPolarHBondContact O-CB 3.4Å; Q359-I385 PolarHBondContact O-N 3.29Å
360	K	96.5	Very high	95.7	Very high	96 Å²	96	50.5 Å²	50.5	42%	0.417	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	166.3	179.4	58	158.2	-175.4	158.4	0	111.5	P331 D362 I383	P331-K360 WeakPolarHBondContact CD-O 3.28Å; K360-D362 WeakPolarHBondContact CE-OD2 3.47Å; K360-D362 IonicContact NZ-OD2 2.92Å; K360-D362 PolarHBondContact NZ-OD2 2.96Å; K360-I383 CarbonylContact C-O 3.47Å; K360-I383 WeakPolarHBondContact CA-O 3.29Å; K360-I383 VanDerWaalsContact CB-O 3.32Å; K360-I383 WeakPolarHBondContact CB-O 3.4Å
361	F	98.1	Very high	95.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	132.6	167.4	-60	-100.7	0	0	0	110.2	T330 P331 F337 F338 V353 H358 L363 I383 I385	T330-F361 WeakPolarHBondContact O-CA 3.5Å; P331-F361 HydrophobicContact CG-CD1 4.47Å; P331-F361 HydrophobicContact CG-CE1 4.44Å; F337-F361 HydrophobicContact CB-CZ 4.46Å; F337-F361 AromaticContact CD2-CE1 3.76Å; F337-F361 HydrophobicContact CD2-CE1 3.76Å; F337-F361 AromaticContact CD2-CZ 3.51Å; F337-F361 HydrophobicContact CD2-CZ 3.51Å; F337-F361 HydrophobicContact CE2-CE1 4.21Å; F337-F361 AromaticContact CE2-CZ 3.87Å; F337-F361 HydrophobicContact CE2-CZ 3.87Å; F337-F361 AromaticContact CG-CZ 3.99Å; F337-F361 HydrophobicContact CG-CZ 3.99Å; F338-F361 HydrophobicContact CE2-CB 4.21Å; F338-F361 AromaticContact CE2-CD1 3.92Å; F338-F361 HydrophobicContact CE2-CD1 3.92Å; F338-F361 AromaticContact CE2-CD2 3.53Å; F338-F361 HydrophobicContact CE2-CD2 3.53Å; F338-F361 HydrophobicContact CE2-CE1 4.13Å; F338-F361 AromaticContact CE2-CE2 3.75Å; F338-F361 HydrophobicContact CE2-CE2 3.75Å; F338-F361 AromaticContact CE2-CG 3.62Å; F338-F361 HydrophobicContact CE2-CG 3.62Å; F338-F361 HydrophobicContact CE2-CZ 4.04Å; F338-F361 AromaticContact CZ-CD2 3.89Å; F338-F361 HydrophobicContact CZ-CD2 3.89Å; F338-F361 HydrophobicContact CZ-CE2 4.06Å; F338-F361 HydrophobicContact CZ-CG 4.39Å; V353-F361 HydrophobicContact CG1-CE2 4.07Å; H358-F361 HydrophobicContact CB-CE2 3.81Å; H358-F361 HydrophobicContact CB-CZ 3.66Å; H358-F361 AromaticContact CG-CZ 3.78Å; H358-F361 AromaticContact ND1-CZ 3.71Å; F361-L363 HydrophobicContact CB-CD2 4.12Å; F361-L363 HydrophobicContact CB-CG 4.37Å; F361-I383 HydrophobicContact CB-CB 4.28Å; F361-I383 PolarHBondContact N-O 3.38Å; F361-I383 PolarHBondContact O-N 3.5Å; F361-I385 HydrophobicContact CD2-CD1 4.22Å; F361-I385 HydrophobicContact CD2-CG1 4.4Å; F361-I385 HydrophobicContact CE2-CD1 4.14Å; F361-I385 HydrophobicContact CE2-CG1 4.26Å
362	D	98.2	Very high	95.6	Very high	58 Å²	58	49.3 Å²	49.3	31%	0.31	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	107.2	172.2	-70.6	-66.9	0	0	0	108.6	G329 T330 K360 H382	G329-D362 CarbonylContact C-O 3.58Å; G329-D362 WeakPolarHBondContact CA-O 3.44Å; T330-D362 PolarHBondContact N-O 2.85Å; T330-D362 PolarHBondContact O-N 2.87Å; K360-D362 WeakPolarHBondContact CE-OD2 3.47Å; K360-D362 IonicContact NZ-OD2 2.92Å; K360-D362 PolarHBondContact NZ-OD2 2.96Å; D362-H382 IonicContact OD1-CE1 3.72Å; D362-H382 IonicContact OD1-CG 3.05Å; D362-H382 IonicContact OD1-ND1 2.85Å; D362-H382 PolarHBondContact OD1-ND1 2.73Å
363	L	98.1	Very high	95.6	Very high	2 Å²	2	52 Å²	52	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	156.1	-174.3	-51.1	-175.1	0	0	0	111.8	I326 Y334 F338 F361 I365 S380 L381 I383	I326-L363 HydrophobicContact CD1-CD1 4.27Å; I326-L363 HydrophobicContact CG2-CB 4.19Å; I326-L363 HydrophobicContact CG2-CD1 4.27Å; Y334-L363 HydrophobicContact CD1-CD2 4.15Å; Y334-L363 HydrophobicContact CD2-CD2 3.98Å; Y334-L363 HydrophobicContact CG-CD2 3.66Å; F338-L363 HydrophobicContact CD2-CD1 4.34Å; F361-L363 HydrophobicContact CB-CD2 4.12Å; F361-L363 HydrophobicContact CB-CG 4.37Å; L363-I365 HydrophobicContact CB-CD1 4.5Å; L363-S380 CarbonylContact O-C 3.55Å; L363-S380 WeakPolarHBondContact O-CA 3.03Å; L363-L381 HydrophobicContact CB-CB 4.29Å; L363-L381 HydrophobicContact CD1-CD2 4.24Å; L363-L381 PolarHBondContact N-O 3.47Å; L363-L381 PolarHBondContact O-N 3.49Å; L363-I383 HydrophobicContact CD1-CD1 3.71Å; L363-I383 HydrophobicContact CG-CD1 4.39Å
364	V	98.1	Very high	95.7	Very high	43 Å²	43	54.6 Å²	54.6	26%	0.261	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	120.9	169.3	-178.6	0	0	0	0	109.2	L327 V328 F378	L327-V364 HydrophobicContact CD2-CG1 4.47Å; L327-V364 PolarHBondContact N-O 3.35Å; V328-V364 HydrophobicContact CG2-CB 3.82Å; V328-V364 HydrophobicContact CG2-CG2 3.86Å; V328-V364 PolarHBondContact O-N 3.24Å; V364-F378 HydrophobicContact CG1-CB 4.31Å
365	I	97.8	Very high	95.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	133.8	177.4	-49.9	-50.8	0	0	0	109	F265 S325 I326 M340 L363 F378 A379 L381	F265-I365 HydrophobicContact CE1-CG2 4.34Å; F265-I365 HydrophobicContact CZ-CB 4.36Å; F265-I365 HydrophobicContact CZ-CG2 4Å; S325-I365 CarbonylContact O-C 3.58Å; S325-I365 WeakPolarHBondContact O-CA 3.49Å; I326-I365 HydrophobicContact CB-CD1 4.28Å; I326-I365 HydrophobicContact CG1-CD1 3.76Å; I326-I365 HydrophobicContact CG2-CD1 4.31Å; M340-I365 HydrophobicContact CE-CD1 3.59Å; M340-I365 HydrophobicContact CE-CG1 4.08Å; M340-I365 HydrophobicContact CE-CG2 4.08Å; M340-I365 HydrophobicContact SD-CD1 4.26Å; M340-I365 HydrophobicContact SD-CG2 3.8Å; L363-I365 HydrophobicContact CB-CD1 4.5Å; I365-F378 WeakPolarHBondContact O-CA 3.34Å; I365-A379 PolarHBondContact N-O 3.2Å; I365-A379 PolarHBondContact O-N 2.71Å; I365-L381 HydrophobicContact CD1-CB 4.24Å; I365-L381 HydrophobicContact CD1-CD2 4.04Å; I365-L381 HydrophobicContact CG1-CB 3.91Å; I365-L381 HydrophobicContact CG1-CD2 4.33Å
366	K	98.1	Very high	96.2	Very high	32 Å²	32	55.2 Å²	55.2	14%	0.139	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	134.2	173.1	-178.6	-172	66.7	160.4	0	109.9	Y324 S325 L327 E368 P376 A377 F378	Y324-K366 WeakPolarHBondContact CA-O 3.17Å; S325-K366 PolarHBondContact N-O 3.02Å; S325-K366 PolarHBondContact O-N 3.07Å; S325-K366 WeakPolarHBondContact OG-CE 3.21Å; L327-K366 HydrophobicContact CB-CB 4.28Å; L327-K366 HydrophobicContact CD1-CD 4.47Å; K366-E368 VanDerWaalsContact CE-CD 3.44Å; K366-E368 WeakPolarHBondContact CE-OE1 3.08Å; K366-E368 WeakPolarHBondContact CE-OE2 3.29Å; K366-E368 IonicContact NZ-OE1 3.82Å; K366-E368 PolarHBondContact NZ-OE1 2.86Å; K366-E368 IonicContact NZ-OE2 3.92Å; K366-E368 PolarHBondContact NZ-OE2 2.78Å; K366-P376 HydrophobicContact CD-CB 3.81Å; K366-P376 HydrophobicContact CG-CB 3.77Å; K366-A377 WeakPolarHBondContact CA-O 3.46Å; K366-F378 HydrophobicContact CB-CD1 4.07Å; K366-F378 HydrophobicContact CB-CE1 4.12Å; K366-F378 HydrophobicContact CD-CE1 4.04Å; K366-F378 HydrophobicContact CG-CD1 4.09Å; K366-F378 HydrophobicContact CG-CE1 3.73Å
367	A	98.3	Very high	96.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130.5	165.4	0	0	0	0	0	109.3	P263 F265 A306 I322 L323 Y324 P376 A377	P263-A367 HydrophobicContact CB-CB 4.35Å; F265-A367 HydrophobicContact CE1-CB 3.88Å; F265-A367 HydrophobicContact CE2-CB 3.98Å; F265-A367 HydrophobicContact CZ-CB 3.5Å; F265-A367 VanDerWaalsContact CZ-CB 3.5Å; A306-A367 HydrophobicContact CB-CB 3.82Å; I322-A367 HydrophobicContact CG2-CB 3.98Å; L323-A367 WeakPolarHBondContact O-CA 3.38Å; Y324-A367 HydrophobicContact CD1-CB 4.06Å; Y324-A367 HydrophobicContact CE1-CB 4.03Å; A367-P376 WeakPolarHBondContact O-CA 3.49Å; A367-A377 PolarHBondContact N-O 3.15Å; A367-A377 PolarHBondContact O-N 3.07Å
368	E	98.1	Very high	97	Very high	42 Å²	42	50.3 Å²	50.3	20%	0.196	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	157.2	-177.3	74.4	-171.9	157.7	0	0	112.3	I322 L323 K366 P374 P376	I322-E368 CarbonylContact C-O 3.26Å; I322-E368 WeakPolarHBondContact CA-O 3.36Å; L323-E368 HydrophobicContact CB-CG 4.2Å; L323-E368 PolarHBondContact N-O 3.07Å; L323-E368 PolarHBondContact O-N 2.93Å; K366-E368 VanDerWaalsContact CE-CD 3.44Å; K366-E368 WeakPolarHBondContact CE-OE1 3.08Å; K366-E368 WeakPolarHBondContact CE-OE2 3.29Å; K366-E368 IonicContact NZ-OE1 3.82Å; K366-E368 PolarHBondContact NZ-OE1 2.86Å; K366-E368 IonicContact NZ-OE2 3.92Å; K366-E368 PolarHBondContact NZ-OE2 2.78Å; E368-P374 CarbonylContact C-O 3.42Å; E368-P374 VanDerWaalsContact CA-O 3.24Å; E368-P374 WeakPolarHBondContact CA-O 3.35Å; E368-P374 HydrophobicContact CB-CB 3.95Å; E368-P374 VanDerWaalsContact CB-O 3.25Å; E368-P374 WeakPolarHBondContact CB-O 3.37Å; E368-P374 HydrophobicContact CG-CB 4.31Å; E368-P376 HydrophobicContact CB-CB 4.08Å
369	Q	98.3	Very high	97.1	Very high	5 Å²	5	49.4 Å²	49.4	2%	0.023	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	145.8	178.6	-67.5	149.7	-95.2	0	0	112.8	D259 P263 P320 G321 H373 P374	D259-Q369 PolarHBondContact OD1-NE2 2.85Å; P263-Q369 HydrophobicContact CG-CG 4.03Å; P320-Q369 HydrophobicContact CB-CB 3.78Å; P320-Q369 HydrophobicContact CB-CG 3.79Å; P320-Q369 HydrophobicContact CG-CB 4.21Å; P320-Q369 HydrophobicContact CG-CG 3.63Å; G321-Q369 CarbonylContact O-C 3.36Å; G321-Q369 WeakPolarHBondContact O-CA 3.5Å; Q369-H373 PolarHBondContact OE1-O 3.1Å; Q369-P374 PolarHBondContact N-O 2.92Å
370	D	97	Very high	97.4	Very high	61 Å²	61	45.5 Å²	45.5	33%	0.326	26%	0.256	S	S	.	.	S	Bend	trans	-94.1	3.1	-179.2	71.8	2.6	0	0	0	116	G321 L323 R343 G372	G321-D370 WeakPolarHBondContact CA-OD1 3.48Å; G321-D370 PolarHBondContact N-OD1 3.46Å; G321-D370 VanDerWaalsContact O-CG 3.3Å; G321-D370 PolarHBondContact O-N 2.74Å; L323-D370 HydrophobicContact CD1-CB 3.67Å; L323-D370 HydrophobicContact CG-CB 3.89Å; R343-D370 IonicContact CZ-OD2 3.99Å; R343-D370 IonicContact NH1-OD2 3.24Å; R343-D370 PolarHBondContact NH1-OD2 3.3Å; R343-D370 IonicContact NH2-OD2 3.97Å; R343-D370 PolarHBondContact NH2-OD2 2.77Å; D370-G372 VanDerWaalsContact C-N 3.34Å
371	N	95.9	Very high	97.4	Very high	68 Å²	68	41 Å²	41	36%	0.364	24%	0.237	S	C	.	.	S	Bend	trans	-79.8	-10.5	178.6	67.8	-1.1	0	0	0	114.4	D259 P320 H373	D259-N371 PolarHBondContact OD2-ND2 3.02Å; P320-N371 HydrophobicContact CB-CB 4.23Å; N371-H373 PolarHBondContact OD1-N 3.04Å
372	G	94.7	Very high	97.4	Very high	61 Å²	61	42.9 Å²	42.9	63%	0.629	25%	0.246	S	C	*	.	S	Bend	trans	104.8	-5.1	-176	0	0	0	0	0	115.1	D370 P374	D370-G372 VanDerWaalsContact C-N 3.34Å; G372-P374 VanDerWaalsContact O-CD 3.27Å; G372-P374 WeakPolarHBondContact O-CD 3.25Å
373	H	95.5	Very high	97.4	Very high	116 Å²	116	40.1 Å²	40.1	54%	0.537	23%	0.231	S	C	.	.			trans	-110.7	76.1	173.4	-72.6	-120.1	0	0	0	108.4	D259 Q369 N371 L375	D259-H373 IonicContact OD2-CG 3.47Å; Q369-H373 PolarHBondContact OE1-O 3.1Å; N371-H373 PolarHBondContact OD1-N 3.04Å; H373-L375 PolarHBondContact O-N 2.92Å
374	P	96.3	Very high	97.4	Very high	56 Å²	56	45 Å²	45	36%	0.364	25%	0.253	S	S	.	.			trans	-68.7	-27.3	-158.4	24.8	-35.8	0	0	0	115.7	E368 Q369 G372 P376	E368-P374 CarbonylContact C-O 3.42Å; E368-P374 VanDerWaalsContact CA-O 3.24Å; E368-P374 WeakPolarHBondContact CA-O 3.35Å; E368-P374 HydrophobicContact CB-CB 3.95Å; E368-P374 VanDerWaalsContact CB-O 3.25Å; E368-P374 WeakPolarHBondContact CB-O 3.37Å; E368-P374 HydrophobicContact CG-CB 4.31Å; Q369-P374 PolarHBondContact N-O 2.92Å; G372-P374 VanDerWaalsContact O-CD 3.27Å; G372-P374 WeakPolarHBondContact O-CD 3.25Å; P374-P376 VanDerWaalsContact O-N 3.11Å
375	L	97	Very high	97.2	Very high	68 Å²	68	43.1 Å²	43.1	36%	0.356	24%	0.242	S	C	.	.			trans	29.3	62	-179.2	-54.7	170.3	0	0	0	113.8	G262 P263 H373	G262-L375 VanDerWaalsContact CA-CB 3.5Å; G262-L375 WeakPolarHBondContact CA-O 3.31Å; P263-L375 WeakPolarHBondContact CD-O 3.35Å; H373-L375 PolarHBondContact O-N 2.92Å
376	P	97.5	Very high	97	Very high	55 Å²	55	46.4 Å²	46.4	36%	0.357	26%	0.259	S	S	.	.			trans	-72.7	138.9	-161.6	28	-36.4	0	0	0	114.1	K366 A367 E368 P374 F378	K366-P376 HydrophobicContact CD-CB 3.81Å; K366-P376 HydrophobicContact CG-CB 3.77Å; A367-P376 WeakPolarHBondContact O-CA 3.49Å; E368-P376 HydrophobicContact CB-CB 4.08Å; P374-P376 VanDerWaalsContact O-N 3.11Å; P376-F378 HydrophobicContact CB-CE1 4.22Å; P376-F378 HydrophobicContact CB-CZ 3.89Å; P376-F378 HydrophobicContact CG-CE2 4.49Å; P376-F378 HydrophobicContact CG-CZ 3.85Å; P376-F378 WeakPolarHBondContact O-CE2 3.35Å
377	A	97.6	Very high	96.5	Very high	23 Å²	23	47.4 Å²	47.4	19%	0.19	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	158.5	165.8	0	0	0	0	0	112.2	P263 F265 K366 A367	P263-A377 WeakPolarHBondContact O-CB 3.29Å; F265-A377 HydrophobicContact CD2-CB 4.35Å; F265-A377 HydrophobicContact CE2-CB 4.43Å; K366-A377 WeakPolarHBondContact CA-O 3.46Å; A367-A377 PolarHBondContact N-O 3.15Å; A367-A377 PolarHBondContact O-N 3.07Å
378	F	97.8	Very high	95.7	Very high	111 Å²	111	50.3 Å²	50.3	49%	0.487	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	141.7	-173.1	-49.3	-76.3	0	0	0	111.8	L327 V364 I365 K366 P376	L327-F378 HydrophobicContact CD2-CD1 3.92Å; L327-F378 HydrophobicContact CD2-CE1 3.72Å; V364-F378 HydrophobicContact CG1-CB 4.31Å; I365-F378 WeakPolarHBondContact O-CA 3.34Å; K366-F378 HydrophobicContact CB-CD1 4.07Å; K366-F378 HydrophobicContact CB-CE1 4.12Å; K366-F378 HydrophobicContact CD-CE1 4.04Å; K366-F378 HydrophobicContact CG-CD1 4.09Å; K366-F378 HydrophobicContact CG-CE1 3.73Å; P376-F378 HydrophobicContact CB-CE1 4.22Å; P376-F378 HydrophobicContact CB-CZ 3.89Å; P376-F378 HydrophobicContact CG-CE2 4.49Å; P376-F378 HydrophobicContact CG-CZ 3.85Å; P376-F378 WeakPolarHBondContact O-CE2 3.35Å
379	A	97.9	Very high	94.7	Very high	5 Å²	5	54.3 Å²	54.3	4%	0.041	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	154	171.3	0	0	0	0	0	110.3	F265 Y282 I365	F265-A379 HydrophobicContact CB-CB 4.48Å; F265-A379 HydrophobicContact CD1-CB 4.42Å; F265-A379 HydrophobicContact CD2-CB 3.52Å; F265-A379 HydrophobicContact CE2-CB 3.69Å; F265-A379 HydrophobicContact CG-CB 3.91Å; F265-A379 HydrophobicContact CZ-CB 4.19Å; Y282-A379 HydrophobicContact CD2-CB 4.01Å; Y282-A379 HydrophobicContact CE2-CB 3.64Å; I365-A379 PolarHBondContact N-O 3.2Å; I365-A379 PolarHBondContact O-N 2.71Å
380	S	97.9	Very high	93.6	Very high	53 Å²	53	57.3 Å²	57.3	37%	0.371	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	148.9	174.7	-62.2	0	0	0	0	110.8	L280 T281 Y282 L363	L280-S380 PolarHBondContact O-N 2.82Å; T281-S380 CarbonylContact C-O 3.6Å; T281-S380 WeakPolarHBondContact CA-O 3.35Å; Y282-S380 WeakPolarHBondContact CD2-O 3.17Å; Y282-S380 PolarHBondContact N-O 2.97Å; L363-S380 CarbonylContact O-C 3.55Å; L363-S380 WeakPolarHBondContact O-CA 3.03Å
381	L	98.2	Very high	92.5	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	114.7	170.6	167.1	63.1	0	0	0	108.5	A284 V300 I304 L347 L363 I365 I383	A284-L381 HydrophobicContact CB-CD1 4.39Å; V300-L381 HydrophobicContact CG1-CD1 3.74Å; V300-L381 HydrophobicContact CG2-CD1 4.43Å; I304-L381 HydrophobicContact CD1-CD2 4.36Å; L347-L381 HydrophobicContact CD2-CD2 3.98Å; L363-L381 HydrophobicContact CB-CB 4.29Å; L363-L381 HydrophobicContact CD1-CD2 4.24Å; L363-L381 PolarHBondContact N-O 3.47Å; L363-L381 PolarHBondContact O-N 3.49Å; I365-L381 HydrophobicContact CD1-CB 4.24Å; I365-L381 HydrophobicContact CD1-CD2 4.04Å; I365-L381 HydrophobicContact CG1-CB 3.91Å; I365-L381 HydrophobicContact CG1-CD2 4.33Å; L381-I383 HydrophobicContact CD1-CG1 4.32Å; L381-I383 HydrophobicContact CD2-CD1 4.21Å; L381-I383 HydrophobicContact CD2-CG1 4.35Å; L381-I383 HydrophobicContact CG-CD1 4.37Å; L381-I383 HydrophobicContact CG-CG1 3.99Å
382	H	98.1	Very high	91.5	Very high	41 Å²	41	58 Å²	58	19%	0.19	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.3	173.2	-172.2	75.2	0	0	0	109.4	T281 Y282 Q283 A284 D362	T281-H382 HydrophobicContact CG2-CB 4.31Å; Y282-H382 PolarHBondContact O-N 3.34Å; Q283-H382 CarbonylContact C-O 3.51Å; Q283-H382 WeakPolarHBondContact CA-O 2.8Å; Q283-H382 PolarHBondContact OE1-CD2 2.87Å; A284-H382 PolarHBondContact N-O 3.46Å; D362-H382 IonicContact OD1-CE1 3.72Å; D362-H382 IonicContact OD1-CG 3.05Å; D362-H382 IonicContact OD1-ND1 2.85Å; D362-H382 PolarHBondContact OD1-ND1 2.73Å
383	I	97.9	Very high	90.9	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	112.4	177.6	-48.8	-178.1	0	0	0	108.2	A284 I286 F338 L347 K360 F361 L363 L381 I385	A284-I383 HydrophobicContact CB-CG1 4.38Å; A284-I383 HydrophobicContact CB-CG2 4.4Å; A284-I383 WeakPolarHBondContact O-CA 3.29Å; I286-I383 HydrophobicContact CD1-CG2 3.61Å; I286-I383 HydrophobicContact CG1-CG2 3.92Å; F338-I383 HydrophobicContact CD1-CD1 4.09Å; F338-I383 HydrophobicContact CD2-CD1 4.23Å; F338-I383 HydrophobicContact CE1-CD1 3.81Å; F338-I383 HydrophobicContact CE1-CG2 4.49Å; F338-I383 HydrophobicContact CE2-CD1 3.97Å; F338-I383 HydrophobicContact CG-CD1 4.29Å; F338-I383 HydrophobicContact CZ-CD1 3.75Å; F338-I383 HydrophobicContact CZ-CG2 4.15Å; L347-I383 HydrophobicContact CD2-CD1 4.05Å; K360-I383 CarbonylContact C-O 3.47Å; K360-I383 WeakPolarHBondContact CA-O 3.29Å; K360-I383 VanDerWaalsContact CB-O 3.32Å; K360-I383 WeakPolarHBondContact CB-O 3.4Å; F361-I383 HydrophobicContact CB-CB 4.28Å; F361-I383 PolarHBondContact N-O 3.38Å; F361-I383 PolarHBondContact O-N 3.5Å; L363-I383 HydrophobicContact CD1-CD1 3.71Å; L363-I383 HydrophobicContact CG-CD1 4.39Å; L381-I383 HydrophobicContact CD1-CG1 4.32Å; L381-I383 HydrophobicContact CD2-CD1 4.21Å; L381-I383 HydrophobicContact CD2-CG1 4.35Å; L381-I383 HydrophobicContact CG-CD1 4.37Å; L381-I383 HydrophobicContact CG-CG1 3.99Å; I383-I385 HydrophobicContact CG2-CD1 4.29Å
384	E	96.8	Very high	90.2	Very high	104 Å²	104	58 Å²	58	49%	0.486	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	135.2	175.8	-173.8	172	-148.4	0	0	110.6	A284 A285 I286 L386	A284-E384 PolarHBondContact O-N 3.41Å; A285-E384 WeakPolarHBondContact CA-O 3.26Å; I286-E384 PolarHBondContact N-O 2.97Å; E384-L386 HydrophobicContact CG-CD2 4.13Å
385	I	95.7	Very high	89.5	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.015	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	110.6	175	-51.5	-56	0	0	0	108.5	I286 E288 V353 R355 H358 Q359 F361 I383	I286-I385 HydrophobicContact CB-CD1 3.92Å; I286-I385 HydrophobicContact CG2-CD1 4.25Å; I286-I385 CarbonylContact O-C 3.37Å; I286-I385 WeakPolarHBondContact O-CA 3.33Å; E288-I385 HydrophobicContact CB-CG2 3.93Å; V353-I385 HydrophobicContact CB-CD1 4.21Å; V353-I385 HydrophobicContact CB-CG2 4.34Å; V353-I385 HydrophobicContact CG1-CD1 3.92Å; V353-I385 HydrophobicContact CG1-CG1 3.93Å; V353-I385 HydrophobicContact CG1-CG2 4.05Å; V353-I385 HydrophobicContact CG2-CD1 4.14Å; R355-I385 HydrophobicContact CB-CG2 4.05Å; R355-I385 VanDerWaalsContact CD-O 3.27Å; R355-I385 WeakPolarHBondContact CD-O 3.08Å; R355-I385 HydrophobicContact CG-CB 4.48Å; R355-I385 HydrophobicContact CG-CG2 4.16Å; R355-I385 PolarHBondContact NE-O 2.92Å; H358-I385 WeakPolarHBondContact O-CB 3.02Å; H358-I385 VanDerWaalsContact O-CG1 3.29Å; H358-I385 WeakPolarHBondContact O-CG1 3.27Å; Q359-I385 WeakPolarHBondContact O-CB 3.4Å; Q359-I385 PolarHBondContact O-N 3.29Å; F361-I385 HydrophobicContact CD2-CD1 4.22Å; F361-I385 HydrophobicContact CD2-CG1 4.4Å; F361-I385 HydrophobicContact CE2-CD1 4.14Å; F361-I385 HydrophobicContact CE2-CG1 4.26Å; I383-I385 HydrophobicContact CG2-CD1 4.29Å
386	L	92.4	Very high	88.8	Confident	70 Å²	70	58.6 Å²	58.6	37%	0.366	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	137.4	-175.5	-55.2	177.4	0	0	0	110.5	A285 I286 E288 E384	A285-L386 HydrophobicContact CB-CD1 3.97Å; A285-L386 HydrophobicContact CB-CD2 4.28Å; A285-L386 HydrophobicContact CB-CG 4.12Å; I286-L386 PolarHBondContact O-N 3.37Å; E288-L386 PolarHBondContact N-O 2.96Å; E288-L386 VanDerWaalsContact N-O 3.08Å; E384-L386 HydrophobicContact CG-CD2 4.13Å
387	D	87.1	Confident	88	Confident	52 Å²	52	60.8 Å²	60.8	28%	0.278	32%	0.321	S	S	.	.			trans	-67.5	126.2	175.8	-159.5	-53.1	0	0	0	110.3	R355	R355-D387 IonicContact CZ-OD2 2.91Å; R355-D387 IonicContact NH1-OD2 3.49Å; R355-D387 PolarHBondContact NH1-OD2 3.39Å; R355-D387 IonicContact NH2-OD2 3.54Å
388	E	81.7	Confident	87.1	Confident	62 Å²	62	64.3 Å²	64.3	29%	0.29	34%	0.342	S	S	.	.			trans	-110.7	123.3	162.6	-67.5	-148.2	145.4	0	0	108.1	P287 E288 R290 N390	P287-E388 HydrophobicContact CB-CG 4.14Å; E288-E388 HydrophobicContact CG-CB 4.23Å; R290-E388 IonicContact CZ-OE1 3.22Å; R290-E388 VanDerWaalsContact CZ-OE1 3.27Å; R290-E388 IonicContact CZ-OE2 2.94Å; R290-E388 VanDerWaalsContact NE-CD 3.29Å; R290-E388 IonicContact NE-OE1 3.58Å; R290-E388 PolarHBondContact NE-OE1 2.67Å; R290-E388 IonicContact NE-OE2 3.06Å; R290-E388 PolarHBondContact NE-OE2 3.41Å; R290-E388 IonicContact NH2-OE1 2.79Å; R290-E388 PolarHBondContact NH2-OE1 2.81Å; R290-E388 IonicContact NH2-OE2 3.63Å; E388-N390 VanDerWaalsContact C-N 3.33Å; E388-N390 VanDerWaalsContact O-CB 3.24Å; E388-N390 WeakPolarHBondContact O-CB 3.45Å; E388-N390 PolarHBondContact O-N 2.83Å; E388-N390 PolarHBondContact O-ND2 3.3Å
389	N	78.5	Confident	86.2	Confident	125 Å²	125	60.9 Å²	60.9	67%	0.668	33%	0.332	S	S	*	.	S	Bend	trans	-53.6	87.3	-176.3	-171.9	131.7	0	0	0	112.3	D432	N389-D432 WeakPolarHBondContact CA-OD2 3.47Å; N389-D432 HydrophobicContact CB-CB 4.23Å; N389-D432 PolarHBondContact ND2-OD2 2.8Å
390	N	74.7	Confident	85.5	Confident	68 Å²	68	61.7 Å²	61.7	36%	0.364	33%	0.334	S	S	.	.			trans	-122.8	-11.7	-169.9	74.8	75.7	0	0	0	114.1	E288 L289 E388 D432	E288-N390 VanDerWaalsContact CD-ND2 3.27Å; E288-N390 PolarHBondContact OE1-ND2 3.31Å; L289-N390 HydrophobicContact CD1-CB 4.11Å; E388-N390 VanDerWaalsContact C-N 3.33Å; E388-N390 VanDerWaalsContact O-CB 3.24Å; E388-N390 WeakPolarHBondContact O-CB 3.45Å; E388-N390 PolarHBondContact O-N 2.83Å; E388-N390 PolarHBondContact O-ND2 3.3Å; N390-D432 PolarHBondContact N-OD2 2.89Å
391	Q	73.4	Confident	84.7	Confident	49 Å²	49	64.5 Å²	64.5	23%	0.229	34%	0.341	C	S	.	.			trans	-93	177.6	-178.7	-48.9	-163.1	30.6	0	0	111.3	D356 D432	D356-Q391 PolarHBondContact OD1-NE2 3.32Å; D356-Q391 PolarHBondContact OD2-NE2 2.71Å; D356-Q391 VanDerWaalsContact OD2-NE2 3.17Å; Q391-D432 WeakPolarHBondContact CB-OD1 3.38Å; Q391-D432 VanDerWaalsContact CG-OD1 3.23Å; Q391-D432 WeakPolarHBondContact CG-OD1 3.32Å; Q391-D432 PolarHBondContact N-OD1 2.8Å; Q391-D432 VanDerWaalsContact N-OD1 3.16Å; Q391-D432 PolarHBondContact N-OD2 3.24Å
392	S	75.7	Confident	84.1	Confident	94 Å²	94	64.4 Å²	64.4	66%	0.657	34%	0.341	S	S	*	.			trans	-123	133.2	-177.5	67.6	0	0	0	0	110.6	Y394	S392-Y394 PolarHBondContact O-N 2.89Å
393	P	81.6	Confident	83.3	Confident	80 Å²	80	64.7 Å²	64.7	52%	0.519	34%	0.341	S	S	.	.			trans	-50.4	133.1	179	-26.7	26.8	0	0	0	113.8	A428 L429 D430	P393-A428 HydrophobicContact CB-CB 4.37Å; P393-L429 CarbonylContact C-O 3.6Å; P393-L429 VanDerWaalsContact CA-O 3.24Å; P393-L429 WeakPolarHBondContact CA-O 3.15Å; P393-D430 HydrophobicContact CB-CB 4.46Å; P393-D430 WeakPolarHBondContact CD-OD2 3.42Å; P393-D430 HydrophobicContact CG-CB 4.27Å; P393-D430 VanDerWaalsContact CG-OD2 3.31Å; P393-D430 WeakPolarHBondContact CG-OD2 3.36Å
394	Y	79.7	Confident	82.7	Confident	99 Å²	99	66.3 Å²	66.3	39%	0.388	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.7	-178.3	70.5	-81	0	0	0	112	S392 A428 L429 K431	S392-Y394 PolarHBondContact O-N 2.89Å; Y394-A428 CarbonylContact O-C 3.58Å; Y394-A428 VanDerWaalsContact O-CA 3.26Å; Y394-A428 WeakPolarHBondContact O-CA 3.41Å; Y394-L429 HydrophobicContact CD1-CB 4.37Å; Y394-L429 WeakPolarHBondContact CD1-O 3.38Å; Y394-L429 HydrophobicContact CE1-CB 3.71Å; Y394-L429 HydrophobicContact CE2-CB 4.31Å; Y394-L429 HydrophobicContact CE2-CD1 4.44Å; Y394-L429 PolarHBondContact N-O 2.78Å; Y394-L429 PolarHBondContact O-N 2.81Å; Y394-K431 HydrophobicContact CE1-CD 4.33Å; Y394-K431 HydrophobicContact CE1-CG 3.91Å
395	F	81.5	Confident	81.9	Confident	74 Å²	74	65 Å²	65	33%	0.325	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	136	172.8	-64.1	-72.3	0	0	0	111.4	M397 Y400 I426 A428 K462	F395-M397 VanDerWaalsContact C-N 3.25Å; F395-M397 PolarHBondContact O-N 3.04Å; F395-Y400 HydrophobicContact CB-CE2 4.17Å; F395-Y400 HydrophobicContact CD1-CE2 4.2Å; F395-Y400 HydrophobicContact CG-CE2 4.46Å; F395-I426 HydrophobicContact CD1-CG2 3.68Å; F395-I426 HydrophobicContact CE1-CG2 3.65Å; F395-A428 HydrophobicContact CD1-CB 4.29Å; F395-A428 HydrophobicContact CE1-CB 4.39Å; F395-K462 HydrophobicContact CB-CD 4.46Å; F395-K462 HydrophobicContact CD2-CD 4.37Å; F395-K462 HydrophobicContact CD2-CG 4.02Å
396	T	82.4	Confident	81	Confident	62 Å²	62	72.1 Å²	72.1	38%	0.38	38%	0.378	S	S	.	.	S	Bend	trans	-67.4	-21.7	178.8	57.9	0	0	0	0	114.2	Y400 V427 L429	T396-Y400 PolarHBondContact N-OH 3.02Å; T396-Y400 VanDerWaalsContact N-OH 3.09Å; T396-Y400 PolarHBondContact OG1-OH 2.77Å; T396-V427 HydrophobicContact CG2-CB 4Å; T396-V427 HydrophobicContact CG2-CG1 3.81Å; T396-V427 PolarHBondContact N-O 2.8Å; T396-V427 VanDerWaalsContact N-O 3.08Å; T396-V427 PolarHBondContact OG1-O 3.04Å; T396-L429 HydrophobicContact CG2-CD1 3.78Å; T396-L429 HydrophobicContact CG2-CG 3.82Å
397	M	81.1	Confident	80.4	Confident	101 Å²	101	73.7 Å²	73.7	50%	0.498	40%	0.395	S	S	.	.	S	Bend	trans	-127.8	148.8	-179.8	-61.2	-65.2	-72.9	0	0	111.1	F395 S399 Y400	F395-M397 VanDerWaalsContact C-N 3.25Å; F395-M397 PolarHBondContact O-N 3.04Å; M397-S399 VanDerWaalsContact C-N 3.25Å; M397-S399 PolarHBondContact O-N 2.83Å; M397-Y400 HydrophobicContact CB-CD1 4.32Å; M397-Y400 HydrophobicContact CB-CE1 3.82Å; M397-Y400 HydrophobicContact CB-CE2 4.08Å; M397-Y400 HydrophobicContact CG-CD1 4.44Å; M397-Y400 HydrophobicContact CG-CE1 3.85Å; M397-Y400 PolarHBondContact N-OH 2.87Å; M397-Y400 VanDerWaalsContact N-OH 3.09Å
398	P	78.6	Confident	80	Confident	97 Å²	97	72.9 Å²	72.9	63%	0.63	40%	0.395	S	S	*	.	S	Bend	trans	-72.6	-17.9	174.4	30.7	-35.8	0	0	0	113.1	K462	P398-K462 WeakPolarHBondContact O-CB 3.35Å; P398-K462 PolarHBondContact O-N 3.24Å
399	S	80.4	Confident	80.1	Confident	38 Å²	38	74.8 Å²	74.8	27%	0.266	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	149.1	170.6	61.3	0	0	0	0	110.1	M397 V460	M397-S399 VanDerWaalsContact C-N 3.25Å; M397-S399 PolarHBondContact O-N 2.83Å; S399-V460 CarbonylContact C-O 3.54Å; S399-V460 VanDerWaalsContact CA-O 3.3Å; S399-V460 WeakPolarHBondContact CA-O 3.39Å
400	Y	83.1	Confident	80.3	Confident	23 Å²	23	76.5 Å²	76.5	9%	0.09	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	122.2	173	-60.6	-93	0	0	0	108.7	F395 T396 M397 I426 V427 V460	F395-Y400 HydrophobicContact CB-CE2 4.17Å; F395-Y400 HydrophobicContact CD1-CE2 4.2Å; F395-Y400 HydrophobicContact CG-CE2 4.46Å; T396-Y400 PolarHBondContact N-OH 3.02Å; T396-Y400 VanDerWaalsContact N-OH 3.09Å; T396-Y400 PolarHBondContact OG1-OH 2.77Å; M397-Y400 HydrophobicContact CB-CD1 4.32Å; M397-Y400 HydrophobicContact CB-CE1 3.82Å; M397-Y400 HydrophobicContact CB-CE2 4.08Å; M397-Y400 HydrophobicContact CG-CD1 4.44Å; M397-Y400 HydrophobicContact CG-CE1 3.85Å; M397-Y400 PolarHBondContact N-OH 2.87Å; M397-Y400 VanDerWaalsContact N-OH 3.09Å; Y400-I426 HydrophobicContact CD1-CG1 4.38Å; Y400-I426 HydrophobicContact CD2-CG1 4.1Å; Y400-I426 HydrophobicContact CD2-CG2 4.24Å; Y400-I426 HydrophobicContact CE2-CG2 3.89Å; Y400-I426 HydrophobicContact CG-CG1 4.01Å; Y400-V427 PolarHBondContact OH-O 2.92Å; Y400-V460 PolarHBondContact N-O 2.71Å; Y400-V460 WeakPolarHBondContact O-CA 3.36Å; Y400-V460 WeakPolarHBondContact O-CB 3.29Å; Y400-V460 PolarHBondContact O-N 3.27Å
401	Q	81.3	Confident	80.7	Confident	111 Å²	111	75.9 Å²	75.9	52%	0.519	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	140.9	176.9	-68.1	178.7	2.1	0	0	110.1	L424 T459	Q401-L424 VanDerWaalsContact O-CD1 3.26Å; Q401-L424 WeakPolarHBondContact O-CD1 3.15Å; Q401-T459 HydrophobicContact CG-CG2 4.28Å
402	G	84.6	Confident	81.1	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	175.3	173.5	0	0	0	0	0	113.2	S415 V458	G402-S415 CarbonylContact C-O 3.57Å; G402-S415 WeakPolarHBondContact CA-O 3.49Å; G402-V458 PolarHBondContact N-O 2.97Å; G402-V458 PolarHBondContact O-N 2.93Å
403	Y	81.8	Confident	81.5	Confident	47 Å²	47	76.4 Å²	76.4	18%	0.184	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	143	-168.5	-56	-87.8	0	0	0	111.1	S415 S417 L418 V457	Y403-S415 PolarHBondContact N-O 2.72Å; Y403-S415 PolarHBondContact O-N 2.77Å; Y403-S417 VanDerWaalsContact CD2-C 3.48Å; Y403-L418 HydrophobicContact CD1-CD2 4.32Å; Y403-L418 HydrophobicContact CD1-CG 3.8Å; Y403-L418 HydrophobicContact CD2-CG 4.38Å; Y403-L418 HydrophobicContact CE1-CD1 3.96Å; Y403-L418 HydrophobicContact CE1-CD2 4Å; Y403-L418 HydrophobicContact CE1-CG 3.56Å; Y403-L418 HydrophobicContact CE2-CD1 4.09Å; Y403-L418 HydrophobicContact CE2-CG 4.19Å; Y403-L418 HydrophobicContact CG-CG 4.21Å; Y403-V457 HydrophobicContact CD1-CG2 4.15Å; Y403-V457 HydrophobicContact CE1-CG2 3.86Å
404	I	84	Confident	81.7	Confident	34 Å²	34	74.8 Å²	74.8	17%	0.174	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	150.6	174.2	-159.7	165.7	0	0	0	110.5	A408 A412 I414 V456 V458	I404-A408 HydrophobicContact CD1-CB 3.83Å; I404-A408 HydrophobicContact CG1-CB 3.66Å; I404-A412 HydrophobicContact CD1-CB 4.27Å; I404-I414 HydrophobicContact CD1-CG1 4.41Å; I404-V456 HydrophobicContact CG2-CB 4.4Å; I404-V456 PolarHBondContact N-O 2.85Å; I404-V456 VanDerWaalsContact N-O 3.13Å; I404-V456 PolarHBondContact O-N 3.31Å; I404-V458 HydrophobicContact CG2-CG2 3.71Å
405	L	79.9	Confident	81.9	Confident	75 Å²	75	70.3 Å²	70.3	39%	0.393	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	140	171.3	-66.1	166.3	0	0	0	110.1	S407 A408 L420 E455	L405-S407 PolarHBondContact O-N 2.88Å; L405-A408 HydrophobicContact CB-CB 4.49Å; L405-A408 WeakPolarHBondContact O-CB 3.38Å; L405-A408 PolarHBondContact O-N 2.63Å; L405-L420 HydrophobicContact CD1-CD1 3.87Å; L405-L420 HydrophobicContact CD2-CD1 3.76Å; L405-L420 HydrophobicContact CG-CD1 3.53Å; L405-E455 HydrophobicContact CD2-CG 4.15Å
406	E	76.8	Confident	82	Confident	154 Å²	154	71.9 Å²	71.9	72%	0.72	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-29.9	173.6	-169.9	178.1	156.1	0	0	112	A408 V456	E406-A408 VanDerWaalsContact C-N 3.26Å; E406-A408 PolarHBondContact O-N 2.98Å; E406-V456 HydrophobicContact CB-CG2 4.08Å; E406-V456 HydrophobicContact CG-CG2 4.46Å
407	S	79.6	Confident	82	Confident	102 Å²	102	70.4 Å²	70.4	71%	0.713	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	5.7	177	58.2	0	0	0	0	115.1	L405	L405-S407 PolarHBondContact O-N 2.88Å
408	A	80.2	Confident	81.8	Confident	36 Å²	36	70.1 Å²	70.1	30%	0.298	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-69.9	132.8	-175	0	0	0	0	0	113.1	I404 L405 E406 A412	I404-A408 HydrophobicContact CD1-CB 3.83Å; I404-A408 HydrophobicContact CG1-CB 3.66Å; L405-A408 HydrophobicContact CB-CB 4.49Å; L405-A408 WeakPolarHBondContact O-CB 3.38Å; L405-A408 PolarHBondContact O-N 2.63Å; E406-A408 VanDerWaalsContact C-N 3.26Å; E406-A408 PolarHBondContact O-N 2.98Å; A408-A412 HydrophobicContact CB-CB 3.96Å
409	P	83.8	Confident	81.8	Confident	102 Å²	102	71.7 Å²	71.7	66%	0.662	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-74.1	156.3	176.6	31.3	-35.7	0	0	0	112.2	G411 A412	P409-G411 PolarHBondContact O-N 2.87Å; P409-A412 VanDerWaalsContact O-CB 3.27Å; P409-A412 WeakPolarHBondContact O-CB 3.29Å; P409-A412 PolarHBondContact O-N 2.84Å
410	V	82.3	Confident	81.8	Confident	161 Å²	161	73 Å²	73	98%	0.976	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	123.1	177.2	-179.3	0	0	0	0	111.1
411	G	82	Confident	81.5	Confident	55 Å²	55	76.8 Å²	76.8	57%	0.567	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.1	15.5	-178	0	0	0	0	0	115.4	P409	P409-G411 PolarHBondContact O-N 2.87Å
412	A	83.6	Confident	81.6	Confident	45 Å²	45	74.2 Å²	74.2	37%	0.372	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-65.5	164.1	160.7	0	0	0	0	0	112.3	I404 A408 P409	I404-A412 HydrophobicContact CD1-CB 4.27Å; A408-A412 HydrophobicContact CB-CB 3.96Å; P409-A412 VanDerWaalsContact O-CB 3.27Å; P409-A412 WeakPolarHBondContact O-CB 3.29Å; P409-A412 PolarHBondContact O-N 2.84Å
413	T	83.5	Confident	81.6	Confident	108 Å²	108	78 Å²	78	66%	0.663	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-101.3	132.4	-175.3	-52.4	0	0	0	0	110.8	P423	T413-P423 HydrophobicContact CG2-CB 3.8Å
414	I	85.1	Confident	81.7	Confident	47 Å²	47	77.3 Å²	77.3	24%	0.241	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-74.9	137.2	173.8	-57.7	170.2	0	0	0	109.4	I404 L424 V458 V460	I404-I414 HydrophobicContact CD1-CG1 4.41Å; I414-L424 HydrophobicContact CB-CB 4.44Å; I414-L424 HydrophobicContact CG2-CB 4.23Å; I414-L424 HydrophobicContact CG2-CD2 4.02Å; I414-L424 PolarHBondContact O-N 2.84Å; I414-V458 HydrophobicContact CD1-CB 4.41Å; I414-V458 HydrophobicContact CD1-CG1 3.96Å; I414-V460 HydrophobicContact CD1-CG2 4.46Å
415	S	84.7	Confident	81.6	Confident	4 Å²	4	84.1 Å²	84.1	3%	0.028	49%	0.486	C	S	.	.	B	Isolated β-bridge	trans	-93.3	148.8	177.7	-177	0	0	0	0	112.6	G402 Y403 S417 L420 T422	G402-S415 CarbonylContact C-O 3.57Å; G402-S415 WeakPolarHBondContact CA-O 3.49Å; Y403-S415 PolarHBondContact N-O 2.72Å; Y403-S415 PolarHBondContact O-N 2.77Å; S415-S417 VanDerWaalsContact C-N 3.35Å; S415-S417 VanDerWaalsContact CB-O 3.31Å; S415-S417 WeakPolarHBondContact CB-O 3.47Å; S415-S417 PolarHBondContact OG-N 3.4Å; S415-S417 PolarHBondContact OG-O 3.4Å; S415-S417 PolarHBondContact OG-OG 3.13Å; S415-L420 VanDerWaalsContact OG-CA 3.32Å; S415-L420 WeakPolarHBondContact OG-CA 3.25Å; S415-T422 CarbonylContact C-O 3.44Å; S415-T422 WeakPolarHBondContact CA-O 3.07Å; S415-T422 PolarHBondContact OG-O 2.85Å; S415-T422 VanDerWaalsContact OG-O 3.06Å
416	E	84.4	Confident	81.7	Confident	107 Å²	107	84.4 Å²	84.4	50%	0.5	49%	0.488	S	S	.	.	S	Bend	trans	-74.6	-26.4	165.8	-172	179.4	-129.1	0	0	111.9	T422 L424	E416-T422 PolarHBondContact N-O 3.12Å; E416-L424 HydrophobicContact CB-CD1 4.42Å
417	S	80.7	Confident	81.9	Confident	31 Å²	31	78.4 Å²	78.4	22%	0.217	46%	0.461	C	S	.	.	S	Bend	trans	-116.3	148.9	-176.2	69.9	0	0	0	0	112.9	Y403 S415 N419 L420 T421 T422	Y403-S417 VanDerWaalsContact CD2-C 3.48Å; S415-S417 VanDerWaalsContact C-N 3.35Å; S415-S417 VanDerWaalsContact CB-O 3.31Å; S415-S417 WeakPolarHBondContact CB-O 3.47Å; S415-S417 PolarHBondContact OG-N 3.4Å; S415-S417 PolarHBondContact OG-O 3.4Å; S415-S417 PolarHBondContact OG-OG 3.13Å; S417-N419 PolarHBondContact O-N 2.88Å; S417-L420 PolarHBondContact O-N 2.94Å; S417-T421 PolarHBondContact OG-N 2.77Å; S417-T421 PolarHBondContact OG-OG1 3.03Å; S417-T422 PolarHBondContact OG-OG1 3.34Å
418	L	78	Confident	81.8	Confident	96 Å²	96	76.1 Å²	76.1	50%	0.503	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-31.1	172.8	-69.3	100.2	0	0	0	112.3	Y403 L420	Y403-L418 HydrophobicContact CD1-CD2 4.32Å; Y403-L418 HydrophobicContact CD1-CG 3.8Å; Y403-L418 HydrophobicContact CD2-CG 4.38Å; Y403-L418 HydrophobicContact CE1-CD1 3.96Å; Y403-L418 HydrophobicContact CE1-CD2 4Å; Y403-L418 HydrophobicContact CE1-CG 3.56Å; Y403-L418 HydrophobicContact CE2-CD1 4.09Å; Y403-L418 HydrophobicContact CE2-CG 4.19Å; Y403-L418 HydrophobicContact CG-CG 4.21Å; L418-L420 PolarHBondContact O-N 2.96Å
419	N	78.5	Confident	81.8	Confident	130 Å²	130	76.9 Å²	76.9	70%	0.695	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	3	178.9	-63.2	-4.6	0	0	0	113.4	S417 T421	S417-N419 PolarHBondContact O-N 2.88Å; N419-T421 HydrophobicContact CB-CG2 3.91Å; N419-T421 WeakPolarHBondContact O-CG2 3.28Å; N419-T421 PolarHBondContact O-N 2.88Å; N419-T421 VanDerWaalsContact O-N 3.13Å
420	L	79.3	Confident	81.5	Confident	66 Å²	66	73.5 Å²	73.5	35%	0.346	42%	0.424	S	S	.	.	S	Bend	trans	57.8	24.2	-180	-56.3	168.7	0	0	0	114	L405 S415 S417 L418	L405-L420 HydrophobicContact CD1-CD1 3.87Å; L405-L420 HydrophobicContact CD2-CD1 3.76Å; L405-L420 HydrophobicContact CG-CD1 3.53Å; S415-L420 VanDerWaalsContact OG-CA 3.32Å; S415-L420 WeakPolarHBondContact OG-CA 3.25Å; S417-L420 PolarHBondContact O-N 2.94Å; L418-L420 PolarHBondContact O-N 2.96Å
421	T	78.2	Confident	81	Confident	102 Å²	102	70.4 Å²	70.4	63%	0.626	40%	0.397	S	S	*	.			trans	-91	-22.5	-170.7	52.8	0	0	0	0	115.2	S417 N419	S417-T421 PolarHBondContact OG-N 2.77Å; S417-T421 PolarHBondContact OG-OG1 3.03Å; N419-T421 HydrophobicContact CB-CG2 3.91Å; N419-T421 WeakPolarHBondContact O-CG2 3.28Å; N419-T421 PolarHBondContact O-N 2.88Å; N419-T421 VanDerWaalsContact O-N 3.13Å
422	T	82.1	Confident	80.6	Confident	57 Å²	57	68.7 Å²	68.7	35%	0.35	38%	0.375	S	S	.	.	S	Bend	trans	-133.7	124.6	-170.6	45.8	0	0	0	0	110.3	S415 E416 S417	S415-T422 CarbonylContact C-O 3.44Å; S415-T422 WeakPolarHBondContact CA-O 3.07Å; S415-T422 PolarHBondContact OG-O 2.85Å; S415-T422 VanDerWaalsContact OG-O 3.06Å; E416-T422 PolarHBondContact N-O 3.12Å; S417-T422 PolarHBondContact OG-OG1 3.34Å
423	P	84.8	Confident	79.9	Confident	78 Å²	78	71.7 Å²	71.7	51%	0.506	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-66.5	143.6	-179.9	29.2	-35.4	0	0	0	111.3	T413 R425	T413-P423 HydrophobicContact CG2-CB 3.8Å; P423-R425 PolarHBondContact O-N 3.43Å
424	L	85	Confident	78.8	Confident	34 Å²	34	73.9 Å²	73.9	18%	0.178	39%	0.387	C	S	.	.			trans	-57.6	117.3	-179.3	-178.2	60.7	0	0	0	111.8	Q401 I414 E416 I426 V460	Q401-L424 VanDerWaalsContact O-CD1 3.26Å; Q401-L424 WeakPolarHBondContact O-CD1 3.15Å; I414-L424 HydrophobicContact CB-CB 4.44Å; I414-L424 HydrophobicContact CG2-CB 4.23Å; I414-L424 HydrophobicContact CG2-CD2 4.02Å; I414-L424 PolarHBondContact O-N 2.84Å; E416-L424 HydrophobicContact CB-CD1 4.42Å; L424-I426 PolarHBondContact O-N 2.81Å; L424-V460 HydrophobicContact CD2-CG2 4.28Å
425	R	81.9	Confident	77.4	Confident	176 Å²	176	77.6 Å²	77.6	66%	0.664	41%	0.407	S	S	*	.			trans	-93	96.4	180	-171.2	177.5	-174.1	-106.5	-1.7	111.5	P423 V427	P423-R425 PolarHBondContact O-N 3.43Å; R425-V427 HydrophobicContact CG-CG2 4.14Å; R425-V427 VanDerWaalsContact NH1-CG2 3.31Å
426	I	81.7	Confident	75.7	Confident	81 Å²	81	83.5 Å²	83.5	42%	0.415	44%	0.443	S	S	.	.			trans	-74.8	139.5	164.8	-60.7	175.2	0	0	0	108.6	F395 Y400 L424 V460	F395-I426 HydrophobicContact CD1-CG2 3.68Å; F395-I426 HydrophobicContact CE1-CG2 3.65Å; Y400-I426 HydrophobicContact CD1-CG1 4.38Å; Y400-I426 HydrophobicContact CD2-CG1 4.1Å; Y400-I426 HydrophobicContact CD2-CG2 4.24Å; Y400-I426 HydrophobicContact CE2-CG2 3.89Å; Y400-I426 HydrophobicContact CG-CG1 4.01Å; L424-I426 PolarHBondContact O-N 2.81Å; I426-V460 HydrophobicContact CD1-CG1 4.47Å
427	V	80.7	Confident	74	Confident	28 Å²	28	86.5 Å²	86.5	17%	0.17	46%	0.457	C	S	.	.			trans	-127.3	118.9	177.7	-174.1	0	0	0	0	108.7	T396 Y400 R425 L429	T396-V427 HydrophobicContact CG2-CB 4Å; T396-V427 HydrophobicContact CG2-CG1 3.81Å; T396-V427 PolarHBondContact N-O 2.8Å; T396-V427 VanDerWaalsContact N-O 3.08Å; T396-V427 PolarHBondContact OG1-O 3.04Å; Y400-V427 PolarHBondContact OH-O 2.92Å; R425-V427 HydrophobicContact CG-CG2 4.14Å; R425-V427 VanDerWaalsContact NH1-CG2 3.31Å; V427-L429 HydrophobicContact CG1-CD2 4.18Å; V427-L429 HydrophobicContact CG1-CG 4.44Å
428	A	78.2	Confident	72.4	Confident	54 Å²	54	90.6 Å²	90.6	45%	0.446	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	139.8	160.4	0	0	0	0	0	108.2	P393 Y394 F395	P393-A428 HydrophobicContact CB-CB 4.37Å; Y394-A428 CarbonylContact O-C 3.58Å; Y394-A428 VanDerWaalsContact O-CA 3.26Å; Y394-A428 WeakPolarHBondContact O-CA 3.41Å; F395-A428 HydrophobicContact CD1-CB 4.29Å; F395-A428 HydrophobicContact CE1-CB 4.39Å
429	L	78.8	Confident	70.7	Confident	52 Å²	52	94.9 Å²	94.9	27%	0.272	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	160.8	167.9	-61.6	175.9	0	0	0	108	P393 Y394 T396 V427	P393-L429 CarbonylContact C-O 3.6Å; P393-L429 VanDerWaalsContact CA-O 3.24Å; P393-L429 WeakPolarHBondContact CA-O 3.15Å; Y394-L429 HydrophobicContact CD1-CB 4.37Å; Y394-L429 WeakPolarHBondContact CD1-O 3.38Å; Y394-L429 HydrophobicContact CE1-CB 3.71Å; Y394-L429 HydrophobicContact CE2-CB 4.31Å; Y394-L429 HydrophobicContact CE2-CD1 4.44Å; Y394-L429 PolarHBondContact N-O 2.78Å; Y394-L429 PolarHBondContact O-N 2.81Å; T396-L429 HydrophobicContact CG2-CD1 3.78Å; T396-L429 HydrophobicContact CG2-CG 3.82Å; V427-L429 HydrophobicContact CG1-CD2 4.18Å; V427-L429 HydrophobicContact CG1-CG 4.44Å
430	D	78.1	Confident	68.7	Low	32 Å²	32	98.1 Å²	98.1	17%	0.171	51%	0.508	C	S	.	.			trans	-133.7	138.5	175.1	-153.1	-4	0	0	0	108.4	P393 I433	P393-D430 HydrophobicContact CB-CB 4.46Å; P393-D430 WeakPolarHBondContact CD-OD2 3.42Å; P393-D430 HydrophobicContact CG-CB 4.27Å; P393-D430 VanDerWaalsContact CG-OD2 3.31Å; P393-D430 WeakPolarHBondContact CG-OD2 3.36Å; D430-I433 HydrophobicContact CB-CD1 4.01Å; D430-I433 HydrophobicContact CB-CG1 4.15Å
431	K	72.9	Confident	67	Low	95 Å²	95	101.3 Å²	101.3	41%	0.413	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-27.7	-172.6	-75.8	170.7	73.6	-131.3	0	112.2	D356 Y394 I433	D356-K431 VanDerWaalsContact CG-NZ 3.33Å; D356-K431 IonicContact OD1-NZ 3.27Å; D356-K431 PolarHBondContact OD1-NZ 2.97Å; D356-K431 IonicContact OD2-NZ 3.75Å; D356-K431 PolarHBondContact OD2-NZ 2.83Å; Y394-K431 HydrophobicContact CE1-CD 4.33Å; Y394-K431 HydrophobicContact CE1-CG 3.91Å; K431-I433 PolarHBondContact O-N 2.91Å
432	D	72.9	Confident	65	Low	20 Å²	20	105.8 Å²	105.8	11%	0.107	54%	0.541	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-6.8	174.9	-51.3	-2.2	0	0	0	113	N389 N390 Q391	N389-D432 WeakPolarHBondContact CA-OD2 3.47Å; N389-D432 HydrophobicContact CB-CB 4.23Å; N389-D432 PolarHBondContact ND2-OD2 2.8Å; N390-D432 PolarHBondContact N-OD2 2.89Å; Q391-D432 WeakPolarHBondContact CB-OD1 3.38Å; Q391-D432 VanDerWaalsContact CG-OD1 3.23Å; Q391-D432 WeakPolarHBondContact CG-OD1 3.32Å; Q391-D432 PolarHBondContact N-OD1 2.8Å; Q391-D432 VanDerWaalsContact N-OD1 3.16Å; Q391-D432 PolarHBondContact N-OD2 3.24Å
433	I	68.3	Low	62.8	Low	108 Å²	108	112.6 Å²	112.6	55%	0.554	57%	0.566	S	S	*	*	S	Bend	trans	-113.9	111.5	179.6	-58	-180	0	0	0	107.8	D430 K431 D435	D430-I433 HydrophobicContact CB-CD1 4.01Å; D430-I433 HydrophobicContact CB-CG1 4.15Å; K431-I433 PolarHBondContact O-N 2.91Å; I433-D435 PolarHBondContact O-N 2.94Å
434	E	59.8	Low	60.5	Low	153 Å²	153	115 Å²	115	72%	0.715	58%	0.581	S	S	*	*			trans	-55.5	126.1	174.6	-62.2	-168.9	140.7	0	0	111	V436	E434-V436 VanDerWaalsContact C-N 3.31Å; E434-V436 PolarHBondContact O-N 2.89Å
435	D	55.8	Low	58	Low	125 Å²	125	123 Å²	123	67%	0.668	62%	0.615	S	S	*	*			trans	-70	81.4	-177	-108.3	-33.3	0	0	0	110.9	I433 E437	I433-D435 PolarHBondContact O-N 2.94Å; D435-E437 PolarHBondContact O-N 2.94Å
436	V	50.5	Low	55.9	Low	129 Å²	129	121.7 Å²	121.7	78%	0.782	63%	0.626	S	S	*	*			trans	-64.6	104.4	171.8	-176.3	0	0	0	0	108.8	E434 P438	E434-V436 VanDerWaalsContact C-N 3.31Å; E434-V436 PolarHBondContact O-N 2.89Å; V436-P438 WeakPolarHBondContact O-CD 2.99Å; V436-P438 VanDerWaalsContact O-N 3.15Å
437	E	47.7	Very low	53.7	Low	170 Å²	170	125.4 Å²	125.4	79%	0.794	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-48.8	118.8	-175.8	-78.5	-154.4	135.7	0	0	112	D435 E439	D435-E437 PolarHBondContact O-N 2.94Å; E437-E439 PolarHBondContact O-N 2.95Å
438	P	46.4	Very low	51.4	Low	117 Å²	117	130.8 Å²	130.8	76%	0.76	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-74.2	126.7	-178.1	27.7	-33.5	0	0	0	111.5	V436	V436-P438 WeakPolarHBondContact O-CD 2.99Å; V436-P438 VanDerWaalsContact O-N 3.15Å
439	E	43.7	Very low	49.4	Very low	185 Å²	185	139.9 Å²	139.9	86%	0.864	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-52.6	138.4	-179.4	-66.9	-168.2	133.5	0	0	113.2	E437 V441	E437-E439 PolarHBondContact O-N 2.95Å; E439-V441 PolarHBondContact O-N 3.33Å
440	K	36.7	Very low	47.8	Very low	198 Å²	198	146 Å²	146	86%	0.861	72%	0.718	S	S	*	*			trans	-75.5	78.1	-170.3	-69.5	172.2	-179	163.5	0	113	K442	K440-K442 PolarHBondContact O-N 3.12Å
441	V	42.7	Very low	46.2	Very low	134 Å²	134	150.5 Å²	150.5	81%	0.812	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-63.4	121.7	174.5	-178.8	0	0	0	0	111.6	E439	E439-V441 PolarHBondContact O-N 3.33Å
442	K	35.8	Very low	45.1	Very low	196 Å²	196	151.4 Å²	151.4	85%	0.852	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-71.8	134.9	179.9	-69.1	177.5	176.9	175.5	0	112	K440	K440-K442 PolarHBondContact O-N 3.12Å
443	K	36.1	Very low	43.8	Very low	200 Å²	200	159.4 Å²	159.4	87%	0.87	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-84.5	133.4	178	-63.9	-177.7	179.5	-178.6	0	112.1
444	P	37.6	Very low	43	Very low	129 Å²	129	161.5 Å²	161.5	84%	0.838	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-77.1	162.5	167.4	32.7	-34.4	0	0	0	112.1
445	K	31.7	Very low	42.5	Very low	202 Å²	202	158.2 Å²	158.2	88%	0.878	80%	0.796	S	S	*	*			trans	-139.4	120.3	-173.2	178.3	-174.6	178.1	-177.4	0	111.3
446	V	38.7	Very low	42.4	Very low	148 Å²	148	155.2 Å²	155.2	90%	0.897	78%	0.781	S	S	*	*			trans	-143.7	155.8	173.4	-173.1	0	0	0	0	109.8
447	E	33.8	Very low	42.7	Very low	159 Å²	159	153 Å²	153	74%	0.743	77%	0.768	S	S	*	*			trans	-100.9	139.2	-159.4	-67.5	176.9	111	0	0	117.2
448	I	33.8	Very low	43.4	Very low	141 Å²	141	147 Å²	147	72%	0.723	74%	0.743	S	S	*	*				48.6	120.1	127.9	-51.5	167	0	0	0	119.6
449	R	35.8	Very low	44.1	Very low	245 Å²	245	144.5 Å²	144.5	93%	0.925	73%	0.726	S	S	*	*				-149.2	147	129.8	-132.5	172.8	179.8	131.3	1.5	111.3
450	E	44.1	Very low	45	Very low	181 Å²	181	138.1 Å²	138.1	85%	0.846	70%	0.699	S	S	*	*			trans	-85.2	162.1	-171.6	-82.3	-177.9	162	0	0	114.2
451	P	45.3	Very low	45.9	Very low	125 Å²	125	135.8 Å²	135.8	81%	0.812	69%	0.691	S	S	*	*			trans	-105.1	-177.9	-147.8	41.1	-38.2	0	0	0	115.6
452	S	49.5	Very low	46.5	Very low	114 Å²	114	133.6 Å²	133.6	80%	0.797	67%	0.671	S	S	*	*			trans	-144.8	104.1	160.1	62.6	0	0	0	0	111.7
453	E	47.1	Very low	47.6	Very low	189 Å²	189	128.2 Å²	128.2	88%	0.883	66%	0.656	S	S	*	*			trans	5.1	114.8	158.2	-58.8	171.4	160.2	0	0	119
454	E	49.9	Very low	48.5	Very low	151 Å²	151	124.5 Å²	124.5	71%	0.706	65%	0.652	S	S	*	*				170.6	94.4	116.8	-91.5	177.3	171.1	0	0	109.4
455	E	49.3	Very low	49.1	Very low	85 Å²	85	122 Å²	122	40%	0.397	64%	0.643	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130	146.8	-170.3	-69.8	-176.5	178.7	0	0	113.3	L405	L405-E455 HydrophobicContact CD2-CG 4.15Å
456	V	54.2	Low	50.1	Low	61 Å²	61	116.9 Å²	116.9	37%	0.37	64%	0.638	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.7	127.8	-177.7	-177.8	0	0	0	0	110.1	I404 E406	I404-V456 HydrophobicContact CG2-CB 4.4Å; I404-V456 PolarHBondContact N-O 2.85Å; I404-V456 VanDerWaalsContact N-O 3.13Å; I404-V456 PolarHBondContact O-N 3.31Å; E406-V456 HydrophobicContact CB-CG2 4.08Å; E406-V456 HydrophobicContact CG-CG2 4.46Å
457	V	57.6	Low	50.4	Low	82 Å²	82	117.6 Å²	117.6	50%	0.497	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79	124.6	171.3	-177.2	0	0	0	0	109.2	Y403	Y403-V457 HydrophobicContact CD1-CG2 4.15Å; Y403-V457 HydrophobicContact CE1-CG2 3.86Å
458	V	61.3	Low	50.7	Low	45 Å²	45	114.2 Å²	114.2	27%	0.273	62%	0.623	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109	108.7	174.1	-178.2	0	0	0	0	108.6	G402 I404 I414 V460	G402-V458 PolarHBondContact N-O 2.97Å; G402-V458 PolarHBondContact O-N 2.93Å; I404-V458 HydrophobicContact CG2-CG2 3.71Å; I414-V458 HydrophobicContact CD1-CB 4.41Å; I414-V458 HydrophobicContact CD1-CG1 3.96Å; V458-V460 HydrophobicContact CG1-CG2 4.3Å
459	T	61.3	Low	50.8	Low	65 Å²	65	113.5 Å²	113.5	40%	0.399	63%	0.626	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.5	115.6	168.4	-52.6	0	0	0	0	109	Q401 E461	Q401-T459 HydrophobicContact CG-CG2 4.28Å; T459-E461 HydrophobicContact CG2-CG 3.76Å
460	V	63.1	Low	50.7	Low	50 Å²	50	109.8 Å²	109.8	30%	0.303	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.9	93.7	168.3	-175.4	0	0	0	0	107.4	S399 Y400 I414 L424 I426 V458	S399-V460 CarbonylContact C-O 3.54Å; S399-V460 VanDerWaalsContact CA-O 3.3Å; S399-V460 WeakPolarHBondContact CA-O 3.39Å; Y400-V460 PolarHBondContact N-O 2.71Å; Y400-V460 WeakPolarHBondContact O-CA 3.36Å; Y400-V460 WeakPolarHBondContact O-CB 3.29Å; Y400-V460 PolarHBondContact O-N 3.27Å; I414-V460 HydrophobicContact CD1-CG2 4.46Å; L424-V460 HydrophobicContact CD2-CG2 4.28Å; I426-V460 HydrophobicContact CD1-CG1 4.47Å; V458-V460 HydrophobicContact CG1-CG2 4.3Å
461	E	54.3	Low	50.3	Low	149 Å²	149	106 Å²	106	70%	0.696	60%	0.604	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.3	144.4	175.2	-60.8	-171.5	153.4	0	0	110.5	T459	T459-E461 HydrophobicContact CG2-CG 3.76Å
462	K	56.9	Low	49.6	Very low	88 Å²	88	104.7 Å²	104.7	38%	0.383	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-57.2	127.4	169.3	176	176.9	175.3	176.8	0	107.1	F395 P398	F395-K462 HydrophobicContact CB-CD 4.46Å; F395-K462 HydrophobicContact CD2-CD 4.37Å; F395-K462 HydrophobicContact CD2-CG 4.02Å; P398-K462 WeakPolarHBondContact O-CB 3.35Å; P398-K462 PolarHBondContact O-N 3.24Å
463	P	57.6	Low	48.8	Very low	83 Å²	83	110 Å²	110	54%	0.539	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-55	140.4	174	24.5	-33.5	0	0	0	108.4	A465	P463-A465 PolarHBondContact O-N 3.34Å; P463-A465 VanDerWaalsContact O-N 3.16Å
464	P	55.7	Low	48	Very low	122 Å²	122	110.3 Å²	110.3	79%	0.792	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-50.9	130	-178.3	22.6	-33.6	0	0	0	108.1	A466	P464-A466 PolarHBondContact O-N 2.99Å
465	A	51.1	Low	47.3	Very low	78 Å²	78	114.2 Å²	114.2	65%	0.645	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-52	118.1	-175.5	0	0	0	0	0	107.7	P463 E467	P463-A465 PolarHBondContact O-N 3.34Å; P463-A465 VanDerWaalsContact O-N 3.16Å; A465-E467 PolarHBondContact O-N 2.78Å
466	A	50.9	Low	46.7	Very low	93 Å²	93	113 Å²	113	77%	0.769	61%	0.607	S	S	*	*			trans	-58.6	110.9	175.1	0	0	0	0	0	105.6	P464	P464-A466 PolarHBondContact O-N 2.99Å
467	E	45.7	Very low	46.1	Very low	163 Å²	163	121 Å²	121	76%	0.762	63%	0.631	S	S	*	*			trans	-48.4	130.7	174.5	-67.3	-174.9	157.6	0	0	106.5	A465 T469	A465-E467 PolarHBondContact O-N 2.78Å; E467-T469 PolarHBondContact O-N 3.23Å; E467-T469 PolarHBondContact O-OG1 2.83Å
468	P	39.6	Very low	45.4	Very low	89 Å²	89	121.9 Å²	121.9	58%	0.578	63%	0.632	S	S	*	*			trans	-60.1	94.7	178.3	24.3	-32.6	0	0	0	106.6	Y470	P468-Y470 HydrophobicContact CB-CE2 4.35Å; P468-Y470 HydrophobicContact CG-CE2 4.13Å; P468-Y470 WeakPolarHBondContact O-CD2 3.41Å; P468-Y470 WeakPolarHBondContact O-CE2 3.27Å; P468-Y470 PolarHBondContact O-N 2.88Å
469	T	35.8	Very low	44.4	Very low	125 Å²	125	127 Å²	127	77%	0.767	65%	0.651	S	S	*	*			trans	-81.5	72.8	-177	-59.4	0	0	0	0	104.2	E467	E467-T469 PolarHBondContact O-N 3.23Å; E467-T469 PolarHBondContact O-OG1 2.83Å
470	Y	34.8	Very low	43.8	Very low	168 Å²	168	128 Å²	128	66%	0.659	66%	0.658	S	S	*	*			trans	-42.8	129.9	171.7	-55.8	-82.1	0	0	0	106.4	P468 T472	P468-Y470 HydrophobicContact CB-CE2 4.35Å; P468-Y470 HydrophobicContact CG-CE2 4.13Å; P468-Y470 WeakPolarHBondContact O-CD2 3.41Å; P468-Y470 WeakPolarHBondContact O-CE2 3.27Å; P468-Y470 PolarHBondContact O-N 2.88Å; Y470-T472 PolarHBondContact O-N 2.81Å; Y470-T472 PolarHBondContact O-OG1 2.72Å; Y470-T472 VanDerWaalsContact O-OG1 3.08Å
471	P	35.8	Very low	43	Very low	102 Å²	102	132.9 Å²	132.9	66%	0.662	68%	0.68	S	S	*	*			trans	-70.8	53.5	169.6	30.6	-34.3	0	0	0	110.6	W473	P471-W473 VanDerWaalsContact O-CD1 3.31Å; P471-W473 PolarHBondContact O-N 2.91Å
472	T	30.8	Very low	43	Very low	97 Å²	97	129.6 Å²	129.6	60%	0.595	67%	0.666	S	S	*	*				-40.9	99.8	128.9	62.6	0	0	0	0	106.7	Y470 K474	Y470-T472 PolarHBondContact O-N 2.81Å; Y470-T472 PolarHBondContact O-OG1 2.72Å; Y470-T472 VanDerWaalsContact O-OG1 3.08Å; T472-K474 PolarHBondContact O-N 2.8Å
473	W	31.2	Very low	42.9	Very low	226 Å²	226	130.1 Å²	130.1	86%	0.856	67%	0.669	S	S	*	*			trans	-69.7	82.5	176.3	-62	-35.2	0	0	0	107.5	P471 R475	P471-W473 VanDerWaalsContact O-CD1 3.31Å; P471-W473 PolarHBondContact O-N 2.91Å; W473-R475 PolarHBondContact O-N 2.89Å
474	K	30.5	Very low	43.3	Very low	194 Å²	194	134.2 Å²	134.2	84%	0.843	68%	0.678	S	S	*	*			trans	-63.1	68.5	166.8	-78.5	-176.1	177.1	172.7	0	108.3	T472 A476	T472-K474 PolarHBondContact O-N 2.8Å; K474-A476 PolarHBondContact O-N 3.49Å
475	R	35.8	Very low	43.6	Very low	233 Å²	233	136.2 Å²	136.2	88%	0.879	67%	0.674	S	S	*	*			trans	-9.7	83.8	-164.4	-77.6	175.1	-114.7	-176.2	-4.3	113	W473 R477	W473-R475 PolarHBondContact O-N 2.89Å; R475-R477 PolarHBondContact O-N 2.98Å
476	A	36.1	Very low	44.1	Very low	59 Å²	59	135 Å²	135	49%	0.488	66%	0.659	S	S	.	*			trans	-54.1	128.9	-177	0	0	0	0	0	109.2	K474 I478 F479	K474-A476 PolarHBondContact O-N 3.49Å; A476-I478 HydrophobicContact CB-CD1 4.38Å; A476-I478 HydrophobicContact CB-CG1 4.44Å; A476-I478 PolarHBondContact O-N 3.26Å; A476-F479 PolarHBondContact O-N 2.65Å; A476-F479 VanDerWaalsContact O-N 3.1Å
477	R	42.9	Very low	45	Very low	229 Å²	229	136.7 Å²	136.7	86%	0.864	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	8.7	-173.1	-71.9	179.1	171.3	170.8	-2.7	114.4	R475 P480	R475-R477 PolarHBondContact O-N 2.98Å; R477-P480 WeakPolarHBondContact O-CD 3.31Å
478	I	41.2	Very low	46.2	Very low	101 Å²	101	130.8 Å²	130.8	52%	0.518	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.7	-41.9	165.1	-56.6	172.7	0	0	0	110.8	A476 M481 I482	A476-I478 HydrophobicContact CB-CD1 4.38Å; A476-I478 HydrophobicContact CB-CG1 4.44Å; A476-I478 PolarHBondContact O-N 3.26Å; I478-M481 PolarHBondContact O-N 2.88Å; I478-I482 HydrophobicContact CG2-CD1 3.64Å; I478-I482 HydrophobicContact CG2-CG1 4.12Å; I478-I482 PolarHBondContact O-N 2.8Å
479	F	42.4	Very low	47.5	Very low	152 Å²	152	131.5 Å²	131.5	67%	0.667	63%	0.626	S	S	*	*	H	α-helix	trans	-54.6	-48.4	-175.4	-122.2	-89.3	0	0	0	113.1	A476 M481 I482 F483	A476-F479 PolarHBondContact O-N 2.65Å; A476-F479 VanDerWaalsContact O-N 3.1Å; F479-M481 VanDerWaalsContact C-N 3.28Å; F479-M481 PolarHBondContact O-N 2.91Å; F479-I482 PolarHBondContact O-N 3.39Å; F479-F483 HydrophobicContact CD1-CD2 4.47Å; F479-F483 HydrophobicContact CE1-CD2 4.46Å; F479-F483 WeakPolarHBondContact O-CB 3.21Å; F479-F483 PolarHBondContact O-N 2.92Å
480	P	47.6	Very low	48.8	Very low	86 Å²	86	125.9 Å²	125.9	56%	0.558	59%	0.593	S	S	*	*	H	α-helix	trans	-57.6	-30	175.3	-28.8	36.4	0	0	0	115.8	R477 K484	R477-P480 WeakPolarHBondContact O-CD 3.31Å; P480-K484 WeakPolarHBondContact O-CB 3.32Å; P480-K484 PolarHBondContact O-N 2.04Å
481	M	46.1	Very low	50.5	Low	153 Å²	153	124.2 Å²	124.2	75%	0.754	59%	0.591	S	S	*	*	H	α-helix	trans	-78.1	-46.9	178	-68.2	-158.1	-177	0	0	111.7	I478 F479 K484 K485	I478-M481 PolarHBondContact O-N 2.88Å; F479-M481 VanDerWaalsContact C-N 3.28Å; F479-M481 PolarHBondContact O-N 2.91Å; M481-K484 PolarHBondContact O-N 2.86Å; M481-K485 PolarHBondContact O-N 2.97Å
482	I	55.1	Low	52.2	Low	80 Å²	80	127.8 Å²	127.8	41%	0.41	60%	0.596	S	S	.	*	H	α-helix	trans	-62.7	-51.1	176.7	-62.8	-178.8	0	0	0	109.7	I478 F479 K484 K485 V486	I478-I482 HydrophobicContact CG2-CD1 3.64Å; I478-I482 HydrophobicContact CG2-CG1 4.12Å; I478-I482 PolarHBondContact O-N 2.8Å; F479-I482 PolarHBondContact O-N 3.39Å; I482-K484 VanDerWaalsContact C-N 3.28Å; I482-K484 PolarHBondContact O-N 2.83Å; I482-K485 PolarHBondContact O-N 3.38Å; I482-V486 HydrophobicContact CG2-CG2 3.95Å; I482-V486 WeakPolarHBondContact O-CG2 3.43Å; I482-V486 PolarHBondContact O-N 3.31Å
483	F	54.7	Low	54	Low	99 Å²	99	131.7 Å²	131.7	43%	0.434	60%	0.6	S	S	.	*	H	α-helix	trans	-60.7	-35.3	-177.6	-155.4	-87.1	0	0	0	112.4	F479 R487	F479-F483 HydrophobicContact CD1-CD2 4.47Å; F479-F483 HydrophobicContact CE1-CD2 4.46Å; F479-F483 WeakPolarHBondContact O-CB 3.21Å; F479-F483 PolarHBondContact O-N 2.92Å; F483-R487 WeakPolarHBondContact O-CB 3.28Å; F483-R487 PolarHBondContact O-N 2.81Å
484	K	64.8	Low	55.7	Low	170 Å²	170	124.4 Å²	124.4	74%	0.739	60%	0.595	S	S	*	*	H	α-helix	trans	-68.8	-32	175.5	-167.3	174.7	-171.5	178.5	0	112.9	P480 M481 I482 G488	P480-K484 WeakPolarHBondContact O-CB 3.32Å; P480-K484 PolarHBondContact O-N 2.04Å; M481-K484 PolarHBondContact O-N 2.86Å; I482-K484 VanDerWaalsContact C-N 3.28Å; I482-K484 PolarHBondContact O-N 2.83Å; K484-G488 PolarHBondContact O-N 3.42Å
485	K	61.6	Low	57.4	Low	164 Å²	164	119 Å²	119	71%	0.713	58%	0.575	S	S	*	*	H	α-helix	trans	-81.3	-40	177.5	-159.1	172.4	-178.8	-175.8	0	111.9	M481 I482 G488 L489	M481-K485 PolarHBondContact O-N 2.97Å; I482-K485 PolarHBondContact O-N 3.38Å; K485-G488 PolarHBondContact O-N 2.74Å; K485-L489 PolarHBondContact O-N 2.82Å
486	V	63.3	Low	58.8	Low	52 Å²	52	113.5 Å²	113.5	32%	0.315	56%	0.563	S	S	.	*	H	α-helix	trans	-63.6	-47	172.4	173.2	0	0	0	0	110.8	I482 G488 L489 A490 L497	I482-V486 HydrophobicContact CG2-CG2 3.95Å; I482-V486 WeakPolarHBondContact O-CG2 3.43Å; I482-V486 PolarHBondContact O-N 3.31Å; V486-G488 VanDerWaalsContact C-N 3.33Å; V486-G488 PolarHBondContact O-N 2.78Å; V486-L489 WeakPolarHBondContact O-CA 3.31Å; V486-L489 WeakPolarHBondContact O-CB 3.39Å; V486-L489 PolarHBondContact O-N 2.87Å; V486-A490 PolarHBondContact O-N 3.14Å; V486-L497 HydrophobicContact CG1-CD1 4.19Å; V486-L497 HydrophobicContact CG1-CD2 4.44Å
487	R	68.2	Low	59.9	Low	128 Å²	128	112.8 Å²	112.8	48%	0.483	55%	0.551	S	S	.	*	H	α-helix	trans	-58.1	-42.9	174.4	-176.4	175.4	-177.9	133.9	12.9	112.3	F483 L489 A490 E491 L497	F483-R487 WeakPolarHBondContact O-CB 3.28Å; F483-R487 PolarHBondContact O-N 2.81Å; R487-L489 PolarHBondContact O-N 3.46Å; R487-A490 PolarHBondContact O-N 2.87Å; R487-E491 HydrophobicContact CG-CG 4.23Å; R487-E491 WeakPolarHBondContact CG-OE1 3.45Å; R487-E491 IonicContact CZ-OE1 3.65Å; R487-E491 IonicContact NE-OE1 2.64Å; R487-E491 PolarHBondContact NE-OE1 3.4Å; R487-E491 IonicContact NH2-OE1 2.84Å; R487-E491 WeakPolarHBondContact O-CB 3.24Å; R487-E491 WeakPolarHBondContact O-CG 3.43Å; R487-E491 PolarHBondContact O-N 2.88Å; R487-L497 HydrophobicContact CB-CD1 4.46Å
488	G	71.9	Confident	60.9	Low	39 Å²	39	110.5 Å²	110.5	40%	0.402	55%	0.55	S	S	.	.	H	α-helix	trans	-65.8	-19.2	175.1	0	0	0	0	0	115	K484 K485 V486 K492	K484-G488 PolarHBondContact O-N 3.42Å; K485-G488 PolarHBondContact O-N 2.74Å; V486-G488 VanDerWaalsContact C-N 3.33Å; V486-G488 PolarHBondContact O-N 2.78Å; G488-K492 WeakPolarHBondContact O-CB 3.21Å
489	L	66.3	Low	61.8	Low	104 Å²	104	107.5 Å²	107.5	55%	0.545	54%	0.544	S	S	.	.	H	α-helix	trans	-87.2	-39.7	170.3	-72.6	167.5	0	0	0	111.7	K485 V486 R487 K492 R493	K485-L489 PolarHBondContact O-N 2.82Å; V486-L489 WeakPolarHBondContact O-CA 3.31Å; V486-L489 WeakPolarHBondContact O-CB 3.39Å; V486-L489 PolarHBondContact O-N 2.87Å; R487-L489 PolarHBondContact O-N 3.46Å; L489-K492 CarbonylContact O-C 3.58Å; L489-K492 WeakPolarHBondContact O-CB 3.3Å; L489-K492 PolarHBondContact O-N 3.38Å; L489-K492 VanDerWaalsContact O-N 3.16Å; L489-R493 PolarHBondContact O-N 3.48Å
490	A	64.2	Low	62.6	Low	8 Å²	8	107.6 Å²	107.6	7%	0.066	55%	0.546	C	S	.	.	H	α-helix	trans	-64.3	-46.9	176.9	0	0	0	0	0	112	V486 R487 K492 R493 G494 I495 L497	V486-A490 PolarHBondContact O-N 3.14Å; R487-A490 PolarHBondContact O-N 2.87Å; A490-K492 PolarHBondContact O-N 2.9Å; A490-K492 VanDerWaalsContact O-N 3.16Å; A490-R493 CarbonylContact O-C 3.59Å; A490-R493 PolarHBondContact O-N 3.18Å; A490-G494 PolarHBondContact O-N 3.21Å; A490-I495 HydrophobicContact CB-CB 4.29Å; A490-I495 PolarHBondContact O-N 3.38Å; A490-I495 VanDerWaalsContact O-N 3.15Å; A490-L497 HydrophobicContact CB-CD1 3.62Å; A490-L497 HydrophobicContact CB-CD2 4.23Å; A490-L497 HydrophobicContact CB-CG 3.83Å
491	E	68.9	Low	63.1	Low	133 Å²	133	109.4 Å²	109.4	62%	0.621	55%	0.547	S	S	*	.	H	α-helix	trans	-60.1	-24.3	172.6	-71.9	174.5	-176.7	0	0	112.3	R487	R487-E491 HydrophobicContact CG-CG 4.23Å; R487-E491 WeakPolarHBondContact CG-OE1 3.45Å; R487-E491 IonicContact CZ-OE1 3.65Å; R487-E491 IonicContact NE-OE1 2.64Å; R487-E491 PolarHBondContact NE-OE1 3.4Å; R487-E491 IonicContact NH2-OE1 2.84Å; R487-E491 WeakPolarHBondContact O-CB 3.24Å; R487-E491 WeakPolarHBondContact O-CG 3.43Å; R487-E491 PolarHBondContact O-N 2.88Å
492	K	73	Confident	64	Low	177 Å²	177	106.6 Å²	106.6	77%	0.77	53%	0.529	S	S	*	.	H	α-helix	trans	-90.1	-18	177	-167.8	176.6	179.2	-175.2	0	114	G488 L489 A490	G488-K492 WeakPolarHBondContact O-CB 3.21Å; L489-K492 CarbonylContact O-C 3.58Å; L489-K492 WeakPolarHBondContact O-CB 3.3Å; L489-K492 PolarHBondContact O-N 3.38Å; L489-K492 VanDerWaalsContact O-N 3.16Å; A490-K492 PolarHBondContact O-N 2.9Å; A490-K492 VanDerWaalsContact O-N 3.16Å
493	R	68.4	Low	64.1	Low	178 Å²	178	111 Å²	111	67%	0.672	54%	0.54	S	S	*	.	H	α-helix	trans	-108	-8.9	177.3	-78.7	-176	169.1	175.8	-3.2	113.8	L489 A490 I495 D510	L489-R493 PolarHBondContact O-N 3.48Å; A490-R493 CarbonylContact O-C 3.59Å; A490-R493 PolarHBondContact O-N 3.18Å; R493-I495 HydrophobicContact CB-CD1 3.86Å; R493-I495 HydrophobicContact CB-CG1 4Å; R493-D510 IonicContact NH1-OD2 3.77Å
494	G	67.6	Low	64.4	Low	74 Å²	74	116.7 Å²	116.7	76%	0.763	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.2	32.7	-177	0	0	0	0	0	113.5	A490	A490-G494 PolarHBondContact O-N 3.21Å
495	I	64.9	Low	64.2	Low	79 Å²	79	117.1 Å²	117.1	41%	0.405	56%	0.556	S	S	.	*			trans	-98.7	129	-179.8	-60.1	172.1	0	0	0	108.6	A490 R493	A490-I495 HydrophobicContact CB-CB 4.29Å; A490-I495 PolarHBondContact O-N 3.38Å; A490-I495 VanDerWaalsContact O-N 3.15Å; R493-I495 HydrophobicContact CB-CD1 3.86Å; R493-I495 HydrophobicContact CB-CG1 4Å
496	D	64.9	Low	64.1	Low	119 Å²	119	111.6 Å²	111.6	64%	0.636	53%	0.533	S	S	*	.			trans	-80.1	140.6	169.5	-162.8	-16.9	0	0	0	110.1	E498	D496-E498 PolarHBondContact OD1-N 2.84Å
497	L	60.3	Low	64.1	Low	43 Å²	43	115 Å²	115	23%	0.225	55%	0.55	C	S	.	*			trans	-112.5	-4	-178.4	-67.1	175.7	0	0	0	112.8	V486 R487 A490 W502	V486-L497 HydrophobicContact CG1-CD1 4.19Å; V486-L497 HydrophobicContact CG1-CD2 4.44Å; R487-L497 HydrophobicContact CB-CD1 4.46Å; A490-L497 HydrophobicContact CB-CD1 3.62Å; A490-L497 HydrophobicContact CB-CD2 4.23Å; A490-L497 HydrophobicContact CB-CG 3.83Å; L497-W502 HydrophobicContact CD2-CG 4.33Å
498	E	63.3	Low	63.7	Low	181 Å²	181	115.5 Å²	115.5	85%	0.846	56%	0.558	S	S	*	*	S	Bend	trans	-87.2	-7.5	-175.4	-61.5	-168.7	167.1	0	0	113.9	D496	D496-E498 PolarHBondContact OD1-N 2.84Å
499	G	60.8	Low	63	Low	39 Å²	39	121.7 Å²	121.7	40%	0.402	58%	0.576	S	S	.	*	S	Bend	trans	-116.5	148.4	174.8	0	0	0	0	0	113.6	E501	G499-E501 PolarHBondContact O-N 3.41Å
500	E	59.5	Low	62.9	Low	153 Å²	153	119.8 Å²	119.8	72%	0.715	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-61.3	-17.8	-175.7	-58.2	-164.7	125.4	0	0	114.9	W502 R503	E500-W502 PolarHBondContact O-N 2.67Å; E500-W502 VanDerWaalsContact O-N 3.15Å; E500-R503 WeakPolarHBondContact O-CB 3.47Å; E500-R503 PolarHBondContact O-N 3.1Å
501	E	58.3	Low	62.6	Low	124 Å²	124	123.8 Å²	123.8	58%	0.579	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-60.6	-24.5	-175	-162.2	-175.3	-111.9	0	0	113.5	G499 R503 R504 R505	G499-E501 PolarHBondContact O-N 3.41Å; E501-R503 PolarHBondContact O-N 3.22Å; E501-R503 VanDerWaalsContact O-N 3.13Å; E501-R504 PolarHBondContact O-N 2.82Å; E501-R505 IonicContact OE2-NH1 2.67Å
502	W	63.5	Low	61.9	Low	95 Å²	95	122.1 Å²	122.1	36%	0.36	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-58.6	-29.4	177.9	71.2	-106.6	0	0	0	112.6	L497 E500 R504 R505 L506	L497-W502 HydrophobicContact CD2-CG 4.33Å; E500-W502 PolarHBondContact O-N 2.67Å; E500-W502 VanDerWaalsContact O-N 3.15Å; W502-R504 PolarHBondContact O-N 3.38Å; W502-R505 PolarHBondContact O-N 3.25Å; W502-L506 HydrophobicContact CE3-CD1 3.95Å; W502-L506 HydrophobicContact CZ3-CD1 4.42Å; W502-L506 WeakPolarHBondContact O-CD1 3.5Å
503	R	58.7	Low	60.7	Low	173 Å²	173	121.8 Å²	121.8	65%	0.653	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-62.8	-23.8	175	-72.3	177.3	162.6	176.1	-8.1	113.6	E500 E501	E500-R503 WeakPolarHBondContact O-CB 3.47Å; E500-R503 PolarHBondContact O-N 3.1Å; E501-R503 PolarHBondContact O-N 3.22Å; E501-R503 VanDerWaalsContact O-N 3.13Å
504	R	59.5	Low	59.7	Low	218 Å²	218	117.8 Å²	117.8	82%	0.823	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-91.1	0.3	175.1	-69.4	-171.3	172.8	103.1	-0.2	113.4	E501 W502	E501-R504 PolarHBondContact O-N 2.82Å; W502-R504 PolarHBondContact O-N 3.38Å
505	R	61.4	Low	58.7	Low	179 Å²	179	121.3 Å²	121.3	68%	0.675	56%	0.561	S	S	*	*	S	Bend	trans	-120.8	8.1	-172.7	-60.9	-176	68.7	156.9	0.7	114.3	E501 W502	E501-R505 IonicContact OE2-NH1 2.67Å; W502-R505 PolarHBondContact O-N 3.25Å
506	L	60.3	Low	57.6	Low	47 Å²	47	124 Å²	124	25%	0.246	58%	0.575	C	S	.	*	S	Bend	trans	-92	126.6	161.1	-85.9	71.1	0	0	0	108.5	W502 D510 L514	W502-L506 HydrophobicContact CE3-CD1 3.95Å; W502-L506 HydrophobicContact CZ3-CD1 4.42Å; W502-L506 WeakPolarHBondContact O-CD1 3.5Å; L506-D510 HydrophobicContact CB-CB 4.17Å; L506-D510 HydrophobicContact CD2-CB 4.15Å; L506-D510 HydrophobicContact CG-CB 4.07Å; L506-L514 HydrophobicContact CD2-CD1 3.94Å
507	D	61.9	Low	56.4	Low	124 Å²	124	123.2 Å²	123.2	66%	0.663	58%	0.575	S	S	*	*			trans	-65.2	160.1	167.3	-62.9	-51.4	0	0	0	110.2	E509 D510 K511	D507-E509 PolarHBondContact O-N 3.48Å; D507-D510 PolarHBondContact O-N 2.71Å; D507-K511 PolarHBondContact O-N 2.99Å
508	E	59.8	Low	55.5	Low	139 Å²	139	126.9 Å²	126.9	65%	0.65	60%	0.595	S	S	*	*	H	α-helix	trans	-56.3	-39.1	-175.8	-136.9	98.2	-100.2	0	0	112.3	D510 K511 D512	E508-D510 VanDerWaalsContact C-N 3.32Å; E508-D510 PolarHBondContact O-N 2.64Å; E508-K511 WeakPolarHBondContact O-CB 3.33Å; E508-K511 PolarHBondContact O-N 3.43Å; E508-K511 VanDerWaalsContact O-N 3.08Å; E508-K511 IonicContact OE1-NZ 2.93Å; E508-K511 PolarHBondContact OE1-NZ 3.04Å; E508-D512 PolarHBondContact O-N 3.03Å
509	E	57.7	Low	54.2	Low	169 Å²	169	124.7 Å²	124.7	79%	0.79	59%	0.589	S	S	*	*	H	α-helix	trans	-62.8	-32.6	178	-58.7	-176.3	172.1	0	0	113.3	D507 K511 Y513	D507-E509 PolarHBondContact O-N 3.48Å; E509-K511 VanDerWaalsContact C-N 3.29Å; E509-K511 PolarHBondContact O-N 3.26Å; E509-Y513 PolarHBondContact O-N 3.29Å
510	D	63.1	Low	53	Low	63 Å²	63	131.3 Å²	131.3	34%	0.337	61%	0.609	S	S	.	*	H	α-helix	trans	-75.1	-18.7	177.1	-95.7	-14.5	0	0	0	111.5	R493 L506 D507 E508	R493-D510 IonicContact NH1-OD2 3.77Å; L506-D510 HydrophobicContact CB-CB 4.17Å; L506-D510 HydrophobicContact CD2-CB 4.15Å; L506-D510 HydrophobicContact CG-CB 4.07Å; D507-D510 PolarHBondContact O-N 2.71Å; E508-D510 VanDerWaalsContact C-N 3.32Å; E508-D510 PolarHBondContact O-N 2.64Å
511	K	58.2	Low	52.2	Low	92 Å²	92	133.2 Å²	133.2	40%	0.4	62%	0.618	S	S	.	*	H	α-helix	trans	-76.2	-50.6	175.6	-56.7	173.6	-168.5	169.1	0	110.9	D507 E508 E509 Y513 L514	D507-K511 PolarHBondContact O-N 2.99Å; E508-K511 WeakPolarHBondContact O-CB 3.33Å; E508-K511 PolarHBondContact O-N 3.43Å; E508-K511 VanDerWaalsContact O-N 3.08Å; E508-K511 IonicContact OE1-NZ 2.93Å; E508-K511 PolarHBondContact OE1-NZ 3.04Å; E509-K511 VanDerWaalsContact C-N 3.29Å; E509-K511 PolarHBondContact O-N 3.26Å; K511-Y513 VanDerWaalsContact C-N 3.27Å; K511-Y513 PolarHBondContact O-N 3.16Å; K511-L514 WeakPolarHBondContact O-CB 3.43Å; K511-L514 PolarHBondContact O-N 3.22Å; K511-L514 VanDerWaalsContact O-N 3.1Å
512	D	55.4	Low	51.2	Low	99 Å²	99	137 Å²	137	53%	0.529	64%	0.636	S	S	.	*	H	α-helix	trans	-60.1	-37.2	178.1	-81.6	2.9	0	0	0	111.8	E508 L514 Q515 L516	E508-D512 PolarHBondContact O-N 3.03Å; D512-L514 PolarHBondContact O-N 2.89Å; D512-Q515 PolarHBondContact O-N 2.73Å; D512-L516 HydrophobicContact CB-CD1 4.24Å; D512-L516 WeakPolarHBondContact O-CB 3.39Å; D512-L516 WeakPolarHBondContact O-CG 3.28Å; D512-L516 PolarHBondContact O-N 3.14Å
513	Y	47.4	Very low	49.8	Very low	169 Å²	169	137.2 Å²	137.2	66%	0.663	66%	0.658	S	S	*	*	H	α-helix	trans	-63.2	-25.8	178.3	-163.2	-89.7	0	0	0	113.5	E509 K511	E509-Y513 PolarHBondContact O-N 3.29Å; K511-Y513 VanDerWaalsContact C-N 3.27Å; K511-Y513 PolarHBondContact O-N 3.16Å
514	L	46.8	Very low	48.8	Very low	95 Å²	95	135.2 Å²	135.2	50%	0.497	67%	0.665	S	S	.	*	H	α-helix	trans	-79.8	-20.7	173.5	-78	163.8	0	0	0	113.1	L506 K511 D512	L506-L514 HydrophobicContact CD2-CD1 3.94Å; K511-L514 WeakPolarHBondContact O-CB 3.43Å; K511-L514 PolarHBondContact O-N 3.22Å; K511-L514 VanDerWaalsContact O-N 3.1Å; D512-L514 PolarHBondContact O-N 2.89Å
515	Q	47.3	Very low	47.7	Very low	148 Å²	148	134 Å²	134	69%	0.692	67%	0.668	S	S	*	*	H	α-helix	trans	-93.3	-33.3	-178.4	-166.2	162.6	-17.7	0	0	112.1	D512 T517	D512-Q515 PolarHBondContact O-N 2.73Å; Q515-T517 PolarHBondContact O-N 3.23Å
516	L	40.6	Very low	46.4	Very low	134 Å²	134	130.8 Å²	130.8	70%	0.702	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-3.7	-172.3	-80.3	165.1	0	0	0	117	D512	D512-L516 HydrophobicContact CB-CD1 4.24Å; D512-L516 WeakPolarHBondContact O-CB 3.39Å; D512-L516 WeakPolarHBondContact O-CG 3.28Å; D512-L516 PolarHBondContact O-N 3.14Å
517	T	40.4	Very low	45.1	Very low	104 Å²	104	135 Å²	135	64%	0.638	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	27.7	-178.2	72.6	0	0	0	0	114.2	Q515	Q515-T517 PolarHBondContact O-N 3.23Å
518	L	41.4	Very low	43.7	Very low	120 Å²	120	135.1 Å²	135.1	63%	0.628	71%	0.707	S	S	*	*			trans	-123.7	-2.8	-175.3	-93.5	163.2	0	0	0	115.4
519	D	37.1	Very low	42.6	Very low	135 Å²	135	137.8 Å²	137.8	72%	0.722	72%	0.719	S	S	*	*	S	Bend	trans	-92.4	121.5	-179.3	-79.7	-50.1	0	0	0	114
520	Q	33.9	Very low	41.5	Very low	177 Å²	177	134.8 Å²	134.8	83%	0.827	72%	0.717	S	S	*	*	S	Bend	trans	38.7	93.6	146	-53.9	-173.9	15.8	0	0	119.2
521	E	42.8	Very low	40.3	Very low	194 Å²	194	141.3 Å²	141.3	91%	0.907	75%	0.745	S	S	*	*	S	Bend		-173.8	-24.2	128.9	-108.7	177	-167.2	0	0	113.7	A523	E521-A523 PolarHBondContact O-N 3.31Å
522	E	38.5	Very low	39.2	Very low	203 Å²	203	146.2 Å²	146.2	95%	0.949	77%	0.769	S	S	*	*			trans	-90.2	30.2	-160.2	-147.1	175.2	-143.6	0	0	116.9
523	A	33.3	Very low	38.2	Very low	100 Å²	100	151 Å²	151	83%	0.826	79%	0.789	S	S	*	*			trans	-127.7	59.1	-171.5	0	0	0	0	0	115.2	E521	E521-A523 PolarHBondContact O-N 3.31Å
524	T	37.6	Very low	37.3	Very low	131 Å²	131	148.1 Å²	148.1	80%	0.804	79%	0.793	S	S	*	*			trans	-104	109.9	177.1	50.7	0	0	0	0	114.2
525	E	36.4	Very low	36.7	Very low	191 Å²	191	148.8 Å²	148.8	89%	0.893	81%	0.806	S	S	*	*			trans	37.2	102.3	142.6	-166.5	171	-137.2	0	0	120.2
526	S	34.3	Very low	36	Very low	112 Å²	112	148.5 Å²	148.5	78%	0.783	81%	0.809	S	S	*	*			trans	170.3	148.4	139.9	43	0	0	0	0	109.5
527	T	32.4	Very low	36	Very low	136 Å²	136	152.9 Å²	152.9	83%	0.834	82%	0.818	S	S	*	*			cis	-140.1	158	1.7	-29.1	0	0	0	0	109.1
528	V	34.1	Very low	35.7	Very low	127 Å²	127	153.2 Å²	153.2	77%	0.77	82%	0.82	S	S	*	*			trans	-78.5	124.6	170.5	177.9	0	0	0	0	110.3
529	E	36.7	Very low	35.6	Very low	195 Å²	195	153.6 Å²	153.6	91%	0.911	82%	0.819	S	S	*	*			trans	-127.4	126.1	149.5	-72.5	-168	148.5	0	0	108.3
530	S	33.2	Very low	35.6	Very low	106 Å²	106	156.1 Å²	156.1	74%	0.741	82%	0.819	S	S	*	*			trans	-108.6	128.5	179.9	54.9	0	0	0	0	109.3
531	E	38.1	Very low	35.9	Very low	200 Å²	200	152.6 Å²	152.6	94%	0.935	81%	0.81	S	S	*	*			trans	-142.5	126.1	161.7	-115.4	165.3	-158	0	0	109.3
532	E	35.9	Very low	35.6	Very low	194 Å²	194	152 Å²	152	91%	0.907	81%	0.807	S	S	*	*			trans	-86.5	133.5	172.8	-55.2	174.3	130.4	0	0	108
533	E	33.4	Very low	35.7	Very low	200 Å²	200	149.2 Å²	149.2	94%	0.935	80%	0.804	S	S	*	*			trans	-145.5	134.5	149.8	-138.5	173.8	-166.4	0	0	112.7
534	S	29.3	Very low	36	Very low	108 Å²	108	153.6 Å²	153.6	76%	0.755	81%	0.808	S	S	*	*			trans	-88.8	146.3	-177.3	166.2	0	0	0	0	111.3
535	S	34.4	Very low	36.1	Very low	110 Å²	110	152.2 Å²	152.2	77%	0.769	80%	0.803	S	S	*	*			trans	-154.6	119.5	145.2	65.2	0	0	0	0	111.9
536	D	33	Very low	36.3	Very low	141 Å²	141	151.3 Å²	151.3	75%	0.754	80%	0.799	S	S	*	*			trans	-55.9	154.1	161.6	-81.2	-59.1	0	0	0	112.1
537	Y	39.1	Very low	36.3	Very low	226 Å²	226	155 Å²	155	89%	0.886	80%	0.802	S	S	*	*			trans	-153.7	130.4	135.6	-106.5	-70.3	0	0	0	111.4
538	T	35.5	Very low	36.4	Very low	111 Å²	111	152.9 Å²	152.9	68%	0.681	79%	0.792	S	S	*	*			trans	-75.8	177.3	168.8	58.2	0	0	0	0	110.3
539	E	37.9	Very low	36.4	Very low	129 Å²	129	156 Å²	156	60%	0.603	80%	0.798	S	S	*	*			cis	-161.1	166.6	18.3	-142	168.4	138.3	0	0	106.1
540	Y	38.9	Very low	36.7	Very low	187 Å²	187	152.4 Å²	152.4	73%	0.733	80%	0.795	S	S	*	*				-178	135.2	75.4	-84.9	-66.9	0	0	0	112.6
541	T	38.8	Very low	36.8	Very low	103 Å²	103	155.9 Å²	155.9	63%	0.632	80%	0.799	S	S	*	*			trans	20	124.1	144	58.6	0	0	0	0	120.3
542	E	37.8	Very low	36.5	Very low	181 Å²	181	152 Å²	152	85%	0.846	79%	0.789	S	S	*	*				77.6	126.6	58.1	-71.8	-179.1	173.1	0	0	116.5
543	T	40.6	Very low	36.2	Very low	146 Å²	146	148 Å²	148	90%	0.896	78%	0.778	S	S	*	*			trans	-157.7	141.7	136.8	43.2	0	0	0	0	111.6
544	E	39.6	Very low	36.4	Very low	192 Å²	192	146.9 Å²	146.9	90%	0.897	77%	0.773	S	S	*	*			trans	-85.3	168.6	-165.7	-52.3	146.6	113	0	0	116.6
545	S	39.1	Very low	36.6	Very low	101 Å²	101	150.2 Å²	150.2	71%	0.706	78%	0.776	S	S	*	*			trans	168.7	107.9	135.3	-167.9	0	0	0	0	109
546	E	40.6	Very low	36.6	Very low	172 Å²	172	149.4 Å²	149.4	80%	0.804	77%	0.771	S	S	*	*				63.1	140.1	89.8	-73.4	-169.1	140.8	0	0	114.6
547	F	34	Very low	36.8	Very low	191 Å²	191	150.8 Å²	150.8	84%	0.838	77%	0.773	S	S	*	*			cis	-168.1	158.3	0.9	-155.1	-132.2	0	0	0	106.9
548	S	35.4	Very low	36.5	Very low	90 Å²	90	145 Å²	145	63%	0.629	77%	0.766	S	S	*	*			cis	-160.8	176.3	-1.6	48.2	0	0	0	0	110.7
549	E	33.8	Very low	36.5	Very low	194 Å²	194	148.5 Å²	148.5	91%	0.907	77%	0.774	S	S	*	*			trans	-87.1	167.8	175.5	-58.2	165.2	109.9	0	0	115.1
550	S	43.6	Very low	36.3	Very low	119 Å²	119	148.5 Å²	148.5	83%	0.832	78%	0.783	S	S	*	*			trans	-160.1	128.8	145.3	63.5	0	0	0	0	113.4
551	E	35.2	Very low	36.2	Very low	179 Å²	179	144.6 Å²	144.6	84%	0.836	78%	0.781	S	S	*	*			trans	-68.7	173.8	166	-56.8	170.5	96.3	0	0	111.1
552	T	31.2	Very low	35.8	Very low	117 Å²	117	144.8 Å²	144.8	72%	0.718	79%	0.786	S	S	*	*			cis	-166.7	143.3	45.7	47.2	0	0	0	0	114.5
553	T	29.4	Very low	35.7	Very low	112 Å²	112	144.1 Å²	144.1	69%	0.687	78%	0.783	S	S	*	*				36.5	125.9	128.6	-29.5	0	0	0	0	123.6
554	E	37.2	Very low	35.2	Very low	176 Å²	176	145.9 Å²	145.9	82%	0.822	78%	0.781	S	S	*	*				-175.5	121.2	120.2	-97.4	172	-159.6	0	0	107.3
555	E	33.7	Very low	34.9	Very low	177 Å²	177	140.4 Å²	140.4	83%	0.827	77%	0.769	S	S	*	*				63.6	133.9	91.4	-67.9	-168.6	-170.8	0	0	114.4
556	S	35.2	Very low	34.7	Very low	93 Å²	93	144.5 Å²	144.5	65%	0.65	78%	0.777	S	S	*	*			cis	-161.1	168.3	11.8	54.3	0	0	0	0	114.8
557	E	35.9	Very low	34.3	Very low	171 Å²	171	145.2 Å²	145.2	80%	0.799	78%	0.78	S	S	*	*			trans	47.1	114.7	141.7	-69.3	172.2	157.3	0	0	121.4
558	S	32.8	Very low	34.2	Very low	105 Å²	105	141.8 Å²	141.8	73%	0.734	78%	0.78	S	S	*	*				79.1	154.8	83.8	83.6	0	0	0	0	114.9
559	E	36.6	Very low	34.3	Very low	184 Å²	184	142 Å²	142	86%	0.86	78%	0.781	S	S	*	*			cis	-140.1	178.1	10.8	-59.3	-175	119.8	0	0	112.8
560	T	33.1	Very low	34.3	Very low	128 Å²	128	138.8 Å²	138.8	79%	0.785	78%	0.775	S	S	*	*			trans	-103.9	-164.4	167.5	56.4	0	0	0	0	110.5
561	P	37.9	Very low	34.2	Very low	106 Å²	106	137.7 Å²	137.7	69%	0.688	77%	0.765	S	S	*	*			cis	-141.2	-168.7	-4.6	43.7	-23.9	0	0	0	116.6
562	S	30.3	Very low	34.1	Very low	107 Å²	107	137.2 Å²	137.2	75%	0.748	76%	0.763	S	S	*	*			trans	69.8	163.5	150.6	71.7	0	0	0	0	118.8
563	E	35.2	Very low	34.4	Very low	167 Å²	167	137 Å²	137	78%	0.78	77%	0.766	S	S	*	*			cis	-136.9	161.5	6.9	-79.1	-175.2	138.6	0	0	112.7
564	E	30.7	Very low	34.7	Very low	182 Å²	182	140.2 Å²	140.2	85%	0.85	77%	0.773	S	S	*	*			trans	10.4	158.1	133.7	-61.5	-170.9	-171.6	0	0	121.7
565	A	32	Very low	34.6	Very low	78 Å²	78	140.2 Å²	140.2	65%	0.645	77%	0.773	S	S	*	*			cis	-168.8	-177.7	-5.3	0	0	0	0	0	110.7
566	E	35	Very low	34.7	Very low	187 Å²	187	136.9 Å²	136.9	87%	0.874	77%	0.77	S	S	*	*			trans	146.8	145	138.2	-79.1	-68.6	110.8	0	0	113.6
567	E	32.5	Very low	34.6	Very low	186 Å²	186	140.6 Å²	140.6	87%	0.869	78%	0.777	S	S	*	*			trans	-106.7	168.6	-173.1	-57.2	-176	127	0	0	114
568	S	32.5	Very low	34.6	Very low	120 Å²	120	137.1 Å²	137.1	84%	0.839	77%	0.771	S	S	*	*			trans	-155.3	143.4	147.9	-125.9	0	0	0	0	115.6
569	S	36.4	Very low	34.8	Very low	93 Å²	93	137.8 Å²	137.8	65%	0.65	77%	0.771	S	S	*	*			trans	-44.8	150.5	-179.1	49.6	0	0	0	0	117.8
570	T	34	Very low	34.7	Very low	128 Å²	128	137.6 Å²	137.6	79%	0.785	77%	0.77	S	S	*	*			cis	69.2	157.3	40.2	73.2	0	0	0	0	115.4
571	P	42	Very low	34.9	Very low	96 Å²	96	137.4 Å²	137.4	62%	0.623	77%	0.774	S	S	*	*			cis	-142.5	-167.1	-18.3	30	-4.7	0	0	0	116.3
572	E	31.8	Very low	34.7	Very low	169 Å²	169	142 Å²	142	79%	0.79	79%	0.786	S	S	*	*			trans	82.4	113	133.5	-88.8	146.6	-131.1	0	0	125.6
573	S	38.1	Very low	34.8	Very low	111 Å²	111	140.6 Å²	140.6	78%	0.776	79%	0.789	S	S	*	*				-179.1	130	121.3	18.3	0	0	0	0	108.2
574	E	36.8	Very low	34.6	Very low	181 Å²	181	139.9 Å²	139.9	85%	0.846	79%	0.786	S	S	*	*				67.2	134.7	65.9	-61.4	-168.4	150.9	0	0	112.5
575	E	35.3	Very low	34.8	Very low	175 Å²	175	139.6 Å²	139.6	82%	0.818	78%	0.781	S	S	*	*			cis	-142.8	149	27.7	-62.8	178.6	109	0	0	111.6
576	S	34.4	Very low	34.6	Very low	107 Å²	107	140.5 Å²	140.5	75%	0.748	79%	0.789	S	S	*	*				69.6	153.6	90.6	106.7	0	0	0	0	116.5
577	E	32.7	Very low	34.4	Very low	172 Å²	172	143.1 Å²	143.1	80%	0.804	79%	0.791	S	S	*	*			cis	-161.3	-178.7	-2.6	-173.7	164.9	-160.5	0	0	110.6
578	S	37.1	Very low	34.4	Very low	97 Å²	97	142.6 Å²	142.6	68%	0.678	79%	0.786	S	S	*	*			trans	93.4	105.3	164.3	71.4	0	0	0	0	117.4
579	T	37.1	Very low	34.2	Very low	120 Å²	120	143.6 Å²	143.6	74%	0.736	78%	0.782	S	S	*	*				76.5	141.9	71.7	67.7	0	0	0	0	113.8
580	E	33.9	Very low	33.9	Very low	179 Å²	179	146.2 Å²	146.2	84%	0.836	79%	0.787	S	S	*	*			cis	-162.5	171.6	-6.5	-123.3	-176.8	161.6	0	0	110.8
581	S	38.1	Very low	33.7	Very low	124 Å²	124	146.7 Å²	146.7	87%	0.867	79%	0.789	S	S	*	*			trans	125.1	143.6	150.7	72	0	0	0	0	117.5
582	E	33.8	Very low	33.1	Very low	203 Å²	203	148.6 Å²	148.6	95%	0.949	79%	0.793	S	S	*	*			trans	-92.9	151.7	-167	-54.7	-177.2	112.3	0	0	114.1
583	G	30.5	Very low	33	Very low	78 Å²	78	144.5 Å²	144.5	80%	0.804	79%	0.789	S	S	*	*			trans	-171.1	90	175.3	0	0	0	0	0	117.3
584	E	32.2	Very low	32.6	Very low	152 Å²	152	149.7 Å²	149.7	71%	0.71	79%	0.791	S	S	*	*			trans	75.1	96.2	141.8	-164	135.4	-152.8	0	0	122.2
585	K	35.1	Very low	32.4	Very low	175 Å²	175	152 Å²	152	76%	0.761	79%	0.792	S	S	*	*			trans	58.5	80.5	134.4	-58.8	170.3	-161.5	155.3	0	120.3
586	A	27.7	Very low	32.1	Very low	97 Å²	97	154.4 Å²	154.4	80%	0.802	79%	0.794	S	S	*	*				20.8	116.9	129.1	0	0	0	0	0	120.5
587	R	30.7	Very low	31.9	Very low	243 Å²	243	154.6 Å²	154.6	92%	0.917	79%	0.793	S	S	*	*			trans	-159	119.1	136.7	-114.7	170.5	-170.5	-155.9	1.3	114.5
588	K	32.9	Very low	31.7	Very low	174 Å²	174	152.7 Å²	152.7	76%	0.757	79%	0.793	S	S	*	*			trans	47.8	116.9	151.3	-65.5	-163.2	170.2	-158.1	0	120.4	I590	K588-I590 PolarHBondContact O-N 3Å
589	N	26.7	Very low	31.3	Very low	141 Å²	141	153.6 Å²	153.6	75%	0.754	79%	0.793	S	S	*	*			trans	-36.5	115.4	159.3	-47.3	3.8	0	0	0	113.9
590	I	31	Very low	31	Very low	148 Å²	148	155.7 Å²	155.7	76%	0.759	80%	0.795	S	S	*	*			trans	-155.2	112.6	130.5	-94	151.8	0	0	0	103.9	K588 L592	K588-I590 PolarHBondContact O-N 3Å; I590-L592 VanDerWaalsContact C-N 3.29Å; I590-L592 HydrophobicContact CG2-CB 4.13Å; I590-L592 PolarHBondContact O-N 2.86Å; I590-L592 VanDerWaalsContact O-N 3.16Å
591	V	30	Very low	30.7	Very low	139 Å²	139	155.2 Å²	155.2	84%	0.842	79%	0.793	S	S	*	*			trans	-89.2	76.9	176.2	-174.9	0	0	0	0	107.6	A593	V591-A593 HydrophobicContact CG1-CB 4.37Å; V591-A593 PolarHBondContact O-N 3.25Å
592	L	29.1	Very low	30.2	Very low	135 Å²	135	156.3 Å²	156.3	71%	0.707	79%	0.788	S	S	*	*			trans	-72.8	86.8	168.1	-161.5	81.7	0	0	0	107.4	I590 R594	I590-L592 VanDerWaalsContact C-N 3.29Å; I590-L592 HydrophobicContact CG2-CB 4.13Å; I590-L592 PolarHBondContact O-N 2.86Å; I590-L592 VanDerWaalsContact O-N 3.16Å; L592-R594 PolarHBondContact O-N 2.93Å
593	A	29.4	Very low	30	Very low	84 Å²	84	154 Å²	154	69%	0.694	78%	0.777	S	S	*	*			trans	-72.7	54.9	-176.5	0	0	0	0	0	112	V591 R595	V591-A593 HydrophobicContact CG1-CB 4.37Å; V591-A593 PolarHBondContact O-N 3.25Å; A593-R595 PolarHBondContact O-N 3.42Å
594	R	29.1	Very low	29.8	Very low	219 Å²	219	158 Å²	158	83%	0.826	77%	0.774	S	S	*	*			trans	-72.6	73.1	178.5	-157.3	177.5	-162.8	-175.5	5.7	109.3	L592 R596	L592-R594 PolarHBondContact O-N 2.93Å; R594-R596 PolarHBondContact O-N 2.9Å
595	R	34	Very low	29.8	Very low	231 Å²	231	156.7 Å²	156.7	87%	0.872	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-50.2	124.8	162.4	-75.9	-174.4	173.9	-178.6	-2.4	106.3	A593	A593-R595 PolarHBondContact O-N 3.42Å
596	R	29.2	Very low	29.4	Very low	224 Å²	224	157.1 Å²	157.1	85%	0.845	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-62.8	146.3	165.7	-65.6	-179.9	178.1	-172.3	-2.2	106.8	R594 V598	R594-R596 PolarHBondContact O-N 2.9Å; R596-V598 PolarHBondContact O-N 3.41Å
597	P	30.5	Very low	29.6	Very low	112 Å²	112	155.1 Å²	155.1	73%	0.727	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-53.8	129.5	161.3	25.8	-32.8	0	0	0	107.3	V599	P597-V599 PolarHBondContact O-N 2.93Å
598	V	28	Very low	29.6	Very low	132 Å²	132	152 Å²	152	80%	0.8	76%	0.76	S	S	*	*			trans	-72.5	90.2	163.7	178.5	0	0	0	0	104.8	R596 E600	R596-V598 PolarHBondContact O-N 3.41Å; V598-E600 PolarHBondContact O-N 3.5Å; V598-E600 VanDerWaalsContact O-N 3.14Å
599	V	28.4	Very low	29.4	Very low	115 Å²	115	153.8 Å²	153.8	70%	0.697	76%	0.762	S	S	*	*			trans	-58.7	113.8	153.7	177.1	0	0	0	0	104.4	P597 E601	P597-V599 PolarHBondContact O-N 2.93Å; V599-E601 VanDerWaalsContact C-N 3.31Å; V599-E601 PolarHBondContact O-N 3.45Å
600	E	31.4	Very low	29.7	Very low	164 Å²	164	154.7 Å²	154.7	77%	0.766	76%	0.762	S	S	*	*			trans	-61.3	105.1	162.8	-73.5	-152.8	131.6	0	0	106.6	V598 I602	V598-E600 PolarHBondContact O-N 3.5Å; V598-E600 VanDerWaalsContact O-N 3.14Å; E600-I602 PolarHBondContact O-N 2.96Å
601	E	25.9	Very low	29.8	Very low	169 Å²	169	154 Å²	154	79%	0.79	76%	0.755	S	S	*	*			trans	-70	81.8	169.9	-166.9	173.7	-130.1	0	0	106.2	V599 Q603	V599-E601 VanDerWaalsContact C-N 3.31Å; V599-E601 PolarHBondContact O-N 3.45Å; E601-Q603 VanDerWaalsContact C-N 3.3Å; E601-Q603 PolarHBondContact O-N 3.14Å
602	I	29.2	Very low	30.2	Very low	148 Å²	148	152.6 Å²	152.6	76%	0.759	75%	0.75	S	S	*	*			trans	-53.1	103.1	168.7	-61.6	172.9	0	0	0	105	E600 E604	E600-I602 PolarHBondContact O-N 2.96Å; I602-E604 PolarHBondContact O-N 3.12Å
603	Q	28.8	Very low	30.5	Very low	155 Å²	155	151 Å²	151	72%	0.724	75%	0.747	S	S	*	*			trans	-63.9	114.2	-178.5	-70.6	-170.8	-10.2	0	0	107.3	E601 V605	E601-Q603 VanDerWaalsContact C-N 3.3Å; E601-Q603 PolarHBondContact O-N 3.14Å; Q603-V605 PolarHBondContact O-N 2.83Å
604	E	26.9	Very low	30.7	Very low	161 Å²	161	153 Å²	153	75%	0.752	75%	0.75	S	S	*	*			trans	-59.2	85.1	161.4	-77	-164.2	150	0	0	108.1	I602 K606	I602-E604 PolarHBondContact O-N 3.12Å; E604-K606 VanDerWaalsContact C-N 3.34Å; E604-K606 PolarHBondContact O-N 2.91Å
605	V	31.9	Very low	30.8	Very low	124 Å²	124	150.9 Å²	150.9	75%	0.752	75%	0.75	S	S	*	*			trans	-61.9	104.1	165.5	177.1	0	0	0	0	105.3	Q603 G607	Q603-V605 PolarHBondContact O-N 2.83Å; V605-G607 PolarHBondContact O-N 3.5Å
606	K	27.5	Very low	30.9	Very low	184 Å²	184	147.6 Å²	147.6	80%	0.8	74%	0.744	S	S	*	*			trans	-71.5	57.7	172.3	-74.8	176.6	176.9	165.7	0	110.7	E604	E604-K606 VanDerWaalsContact C-N 3.34Å; E604-K606 PolarHBondContact O-N 2.91Å
607	G	31.3	Very low	31.1	Very low	55 Å²	55	146.4 Å²	146.4	57%	0.567	75%	0.749	S	S	*	*			trans	-58.3	150.7	153.5	0	0	0	0	0	108.9	V605	V605-G607 PolarHBondContact O-N 3.5Å
608	K	29.6	Very low	31.3	Very low	179 Å²	179	149.7 Å²	149.7	78%	0.778	75%	0.754	S	S	*	*			trans	-68.2	146	178.6	-68.1	175.6	-179.5	171.9	0	109.7	E610	K608-E610 VanDerWaalsContact C-N 3.27Å; K608-E610 PolarHBondContact O-N 3.36Å
609	R	29.1	Very low	31.8	Very low	210 Å²	210	151.9 Å²	151.9	79%	0.792	76%	0.756	S	S	*	*			trans	-63.2	93	153.1	175.7	-179.3	173.8	158.5	-1.9	108.1	E611	R609-E611 HydrophobicContact CG-CG 4.23Å; R609-E611 IonicContact CZ-OE1 2.93Å; R609-E611 VanDerWaalsContact CZ-OE1 3.22Å; R609-E611 IonicContact NE-OE1 3.92Å; R609-E611 PolarHBondContact NE-OE1 3.45Å; R609-E611 IonicContact NH2-OE1 2.64Å; R609-E611 PolarHBondContact NH2-OE1 3.49Å
610	E	32.5	Very low	32.4	Very low	161 Å²	161	152.1 Å²	152.1	75%	0.752	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-97.2	129.2	149.5	-75	172.3	164.1	0	0	105.5	K608	K608-E610 VanDerWaalsContact C-N 3.27Å; K608-E610 PolarHBondContact O-N 3.36Å
611	E	34.6	Very low	32.6	Very low	132 Å²	132	149.8 Å²	149.8	62%	0.617	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-79.9	138.7	-178.3	-71.7	164.1	161.5	0	0	108.2	R609	R609-E611 HydrophobicContact CG-CG 4.23Å; R609-E611 IonicContact CZ-OE1 2.93Å; R609-E611 VanDerWaalsContact CZ-OE1 3.22Å; R609-E611 IonicContact NE-OE1 3.92Å; R609-E611 PolarHBondContact NE-OE1 3.45Å; R609-E611 IonicContact NH2-OE1 2.64Å; R609-E611 PolarHBondContact NH2-OE1 3.49Å
612	P	37.1	Very low	33.1	Very low	111 Å²	111	150.3 Å²	150.3	72%	0.721	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-60	134.8	168.4	27.8	-32.9	0	0	0	107.6	V614	P612-V614 PolarHBondContact O-N 2.88Å
613	P	35.8	Very low	33.4	Very low	100 Å²	100	151.9 Å²	151.9	65%	0.649	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-59.8	142.5	170.7	27.4	-33	0	0	0	108.8	E615	P613-E615 HydrophobicContact CG-CG 4.45Å; P613-E615 PolarHBondContact O-N 2.9Å; P613-E615 VanDerWaalsContact O-N 3.13Å
614	V	33.5	Very low	33.5	Very low	127 Å²	127	154.1 Å²	154.1	77%	0.77	78%	0.78	S	S	*	*			trans	-73.1	102.2	162.4	-179.7	0	0	0	0	105.6	P612 E616	P612-V614 PolarHBondContact O-N 2.88Å; V614-E616 HydrophobicContact CG1-CG 3.95Å; V614-E616 PolarHBondContact O-N 3.04Å
615	E	32.7	Very low	33.9	Very low	174 Å²	174	154.6 Å²	154.6	81%	0.813	78%	0.783	S	S	*	*			trans	-77.7	98.3	165.2	-68.9	-177.1	162.2	0	0	106.6	P613	P613-E615 HydrophobicContact CG-CG 4.45Å; P613-E615 PolarHBondContact O-N 2.9Å; P613-E615 VanDerWaalsContact O-N 3.13Å
616	E	34.6	Very low	33.8	Very low	163 Å²	163	158.2 Å²	158.2	76%	0.762	79%	0.791	S	S	*	*			trans	-69.7	138.5	167.1	-62.7	-177.4	126.7	0	0	108.2	V614 E618	V614-E616 HydrophobicContact CG1-CG 3.95Å; V614-E616 PolarHBondContact O-N 3.04Å; E616-E618 VanDerWaalsContact C-N 3.26Å; E616-E618 PolarHBondContact O-N 3.22Å
617	E	34.8	Very low	34.2	Very low	199 Å²	199	159.9 Å²	159.9	93%	0.93	79%	0.792	S	S	*	*			trans	-73.6	77.9	177.4	-66.3	-178.9	134.7	0	0	110.2	E619	E617-E619 PolarHBondContact O-N 3.17Å
618	E	34.6	Very low	34.3	Very low	180 Å²	180	161.9 Å²	161.9	84%	0.841	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-70.4	117	164.8	-74.5	-163.9	132.4	0	0	109.6	E616	E616-E618 VanDerWaalsContact C-N 3.26Å; E616-E618 PolarHBondContact O-N 3.22Å
619	E	38.5	Very low	34.6	Very low	179 Å²	179	162.5 Å²	162.5	84%	0.836	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-60.8	133.2	169.8	-65.3	-172.3	135.8	0	0	110	E617 P621	E617-E619 PolarHBondContact O-N 3.17Å; E619-P621 WeakPolarHBondContact O-CD 3.21Å
620	P	39.7	Very low	34.9	Very low	120 Å²	120	162.3 Å²	162.3	78%	0.779	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-67.8	125.2	-178.7	26.8	-33.6	0	0	0	110.8
621	P	37.2	Very low	34.8	Very low	114 Å²	114	158 Å²	158	74%	0.74	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-61.9	143	174.4	-22.7	34	0	0	0	112	E619 E623	E619-P621 WeakPolarHBondContact O-CD 3.21Å; P621-E623 PolarHBondContact O-N 2.84Å; P621-E623 VanDerWaalsContact O-N 3.16Å
622	L	34.6	Very low	34.9	Very low	181 Å²	181	161.3 Å²	161.3	95%	0.948	83%	0.832	S	S	*	*			trans	-72.5	102	169.3	-69.3	168.5	0	0	0	109.6
623	E	37.3	Very low	34.8	Very low	180 Å²	180	164.7 Å²	164.7	84%	0.841	84%	0.838	S	S	*	*			trans	-119.4	122.3	164.8	-68.5	-164.3	154.5	0	0	110.4	P621	P621-E623 PolarHBondContact O-N 2.84Å; P621-E623 VanDerWaalsContact O-N 3.16Å
624	E	30	Very low	34.8	Very low	203 Å²	203	165.5 Å²	165.5	95%	0.949	85%	0.846	S	S	*	*			trans	-85.6	112.2	174.6	-61	176.8	129.3	0	0	109.7
625	E	35.9	Very low	35	Very low	171 Å²	171	168.6 Å²	168.6	80%	0.799	85%	0.853	S	S	*	*			trans	-114.5	110.8	160	-87.6	-148.4	148.2	0	0	110.5
626	E	30.1	Very low	35.2	Very low	200 Å²	200	165.1 Å²	165.1	94%	0.935	85%	0.853	S	S	*	*			trans	-61.1	134.8	162.2	-65.9	-173.4	117	0	0	110.2
627	R	34.6	Very low	35.5	Very low	218 Å²	218	161.7 Å²	161.7	82%	0.823	85%	0.853	S	S	*	*			trans	-127.8	109.9	164.7	-155.1	176.3	-156.7	85.1	3.4	110.5
628	A	33.1	Very low	35.6	Very low	98 Å²	98	158.2 Å²	158.2	81%	0.81	85%	0.848	S	S	*	*			trans	-62.1	137.9	-175.1	0	0	0	0	0	113.2
629	E	35.6	Very low	36	Very low	191 Å²	191	157.6 Å²	157.6	89%	0.893	85%	0.847	S	S	*	*			trans	-82	144.5	159.2	-67.7	-162.1	127.6	0	0	110.6	G631	E629-G631 PolarHBondContact O-N 3.3Å
630	E	35.5	Very low	35.9	Very low	206 Å²	206	156.1 Å²	156.1	96%	0.963	85%	0.845	S	S	*	*			trans	-86.3	87.3	-175.9	-67.2	-172.1	122.4	0	0	112.8
631	G	31.5	Very low	36.1	Very low	72 Å²	72	159.8 Å²	159.8	74%	0.742	85%	0.852	S	S	*	*			trans	73.2	120	138.6	0	0	0	0	0	121	E629	E629-G631 PolarHBondContact O-N 3.3Å
632	E	36.1	Very low	36.2	Very low	200 Å²	200	159 Å²	159	94%	0.935	85%	0.848	S	S	*	*			trans	-140	170.4	137.6	-116	173.2	-167.7	0	0	109.9
633	E	34.9	Very low	36.4	Very low	182 Å²	182	156.3 Å²	156.3	85%	0.85	84%	0.84	S	S	*	*			trans	-86.2	148.8	-145.6	-53.9	178	114.1	0	0	118.5
634	S	36.8	Very low	36.3	Very low	117 Å²	117	154.7 Å²	154.7	82%	0.818	84%	0.837	S	S	*	*			trans	69.9	152.8	158.3	71.7	0	0	0	0	119
635	E	37.1	Very low	36.9	Very low	193 Å²	193	152.4 Å²	152.4	90%	0.902	83%	0.831	S	S	*	*			cis	-148.9	180	-1.6	-138.6	177.6	159.9	0	0	110.3
636	A	37.9	Very low	37	Very low	100 Å²	100	152.9 Å²	152.9	83%	0.826	83%	0.833	S	S	*	*			trans	-96.7	177	-168.2	0	0	0	0	0	115.3
637	A	38.8	Very low	37.4	Very low	92 Å²	92	147.7 Å²	147.7	76%	0.76	82%	0.824	S	S	*	*			cis	-162.3	168.9	14.7	0	0	0	0	0	113.6
638	P	39	Very low	37.6	Very low	125 Å²	125	146.5 Å²	146.5	81%	0.812	83%	0.828	S	S	*	*			trans	-124.1	171.9	-177.2	43	-31.5	0	0	0	117.7
639	M	41.2	Very low	37.9	Very low	167 Å²	167	149 Å²	149	82%	0.823	83%	0.828	S	S	*	*			trans	-159.3	120.8	164.7	-70.6	-163.7	73	0	0	109.4
640	D	37.4	Very low	38.2	Very low	148 Å²	148	146.2 Å²	146.2	79%	0.791	82%	0.823	S	S	*	*				84.3	111	82.2	-73.6	-34.6	0	0	0	117.5
641	E	43.7	Very low	38.7	Very low	198 Å²	198	141.4 Å²	141.4	93%	0.925	81%	0.81	S	S	*	*			trans	-173.2	177.3	130.1	-161.8	140.8	-140.7	0	0	110.6
642	S	39.1	Very low	39	Very low	96 Å²	96	145.8 Å²	145.8	67%	0.671	81%	0.811	S	S	*	*			trans	-155	178.8	-148.9	61.9	0	0	0	0	119.7
643	T	38.7	Very low	39.1	Very low	126 Å²	126	144.8 Å²	144.8	77%	0.773	81%	0.806	S	S	*	*			trans	88.2	144.3	162.8	69.7	0	0	0	0	120.4
644	D	36.1	Very low	39.3	Very low	146 Å²	146	139.5 Å²	139.5	78%	0.781	80%	0.801	S	S	*	*			cis	161.1	145.4	-30	-113.1	-24.9	0	0	0	108.4
645	L	42.4	Very low	39.3	Very low	155 Å²	155	139.8 Å²	139.8	81%	0.812	80%	0.803	S	S	*	*			trans	69	153.8	164	-57.5	166.7	0	0	0	118.3
646	E	37.5	Very low	39.4	Very low	181 Å²	181	135.3 Å²	135.3	85%	0.846	80%	0.799	S	S	*	*			cis	-149.5	167.6	6.3	-146.3	167.8	-174.9	0	0	110.7
647	A	37.8	Very low	39.3	Very low	90 Å²	90	139.5 Å²	139.5	74%	0.744	80%	0.801	S	S	*	*			trans	-135.5	158	-169.5	0	0	0	0	0	115.8
648	Q	40.2	Very low	39.3	Very low	193 Å²	193	140.3 Å²	140.3	90%	0.902	80%	0.801	S	S	*	*			trans	-165	138.8	161	-131.1	150.3	83.8	0	0	116.4
649	D	37.9	Very low	39.2	Very low	152 Å²	152	140.6 Å²	140.6	81%	0.813	80%	0.801	S	S	*	*			trans	-77.2	-176.1	176.7	-47.8	-85.7	0	0	0	114.1
650	V	42.4	Very low	39	Very low	132 Å²	132	137.7 Å²	137.7	80%	0.8	80%	0.797	S	S	*	*			cis	-157.9	169.4	5.5	97.3	0	0	0	0	109.1
651	P	45.5	Very low	39	Very low	104 Å²	104	138.1 Å²	138.1	68%	0.675	80%	0.796	S	S	*	*			trans	-116	-165.7	-154.2	43.6	-37	0	0	0	118.9
652	E	38.5	Very low	38.7	Very low	165 Å²	165	135 Å²	135	77%	0.771	78%	0.781	S	S	*	*			trans	107.7	146.3	148.2	-80.2	-62.2	170.9	0	0	124.3
653	E	38.8	Very low	38.6	Very low	178 Å²	178	140.7 Å²	140.7	83%	0.832	79%	0.788	S	S	*	*			trans	70.1	144.7	160.5	-81.4	-71.7	-170.3	0	0	123
654	G	38.9	Very low	38.5	Very low	72 Å²	72	137.9 Å²	137.9	74%	0.742	78%	0.784	S	S	*	*			trans	130.3	76.9	160.9	0	0	0	0	0	120.2
655	S	36.2	Very low	38.9	Very low	123 Å²	123	138 Å²	138	86%	0.86	79%	0.789	S	S	*	*			trans	-67.3	146.1	173.6	176.1	0	0	0	0	116.5
656	A	39.8	Very low	38.6	Very low	98 Å²	98	139.1 Å²	139.1	81%	0.81	79%	0.791	S	S	*	*			trans	178.5	158.8	135.8	0	0	0	0	0	114.6
657	E	34.7	Very low	38.7	Very low	188 Å²	188	135.6 Å²	135.6	88%	0.879	79%	0.786	S	S	*	*			trans	-88.4	157.3	-175.5	-55.4	163.7	85.3	0	0	115.4
658	S	39.4	Very low	38.8	Very low	110 Å²	110	140 Å²	140	77%	0.769	79%	0.791	S	S	*	*				155.9	128.2	108.8	56.4	0	0	0	0	118.4
659	V	37.6	Very low	38.6	Very low	131 Å²	131	139.2 Å²	139.2	79%	0.794	79%	0.788	S	S	*	*			trans	64.7	108.4	133.6	-178.7	0	0	0	0	123.2
660	S	36.4	Very low	38.9	Very low	106 Å²	106	137.9 Å²	137.9	74%	0.741	79%	0.79	S	S	*	*			trans	57.4	153	143	81.5	0	0	0	0	121.5
661	M	37	Very low	38.6	Very low	156 Å²	156	140.1 Å²	140.1	77%	0.768	79%	0.792	S	S	*	*			cis	-174.6	161.2	46.5	-164.7	167.4	-175.7	0	0	112.8
662	E	38.1	Very low	38.3	Very low	134 Å²	134	140.8 Å²	140.8	63%	0.626	80%	0.799	S	S	*	*			trans	-26.3	160	176.2	-47.6	179.1	171.2	0	0	121
663	R	37.4	Very low	38.2	Very low	215 Å²	215	141.1 Å²	141.1	81%	0.811	80%	0.8	S	S	*	*				171.2	147	63.6	-176.7	168.7	-71.3	178	-3.9	116
664	G	37.1	Very low	38.2	Very low	67 Å²	67	140 Å²	140	69%	0.691	80%	0.799	S	S	*	*			trans	88.5	158.5	153.9	0	0	0	0	0	117.4
665	V	43.9	Very low	38.1	Very low	147 Å²	147	141.1 Å²	141.1	89%	0.891	80%	0.796	S	S	*	*			cis	-147.4	160.4	5.9	178.4	0	0	0	0	110.5
666	E	35	Very low	38	Very low	179 Å²	179	140.9 Å²	140.9	84%	0.836	79%	0.794	S	S	*	*			trans	-95.9	-162.5	-172.2	-57	158.3	101.1	0	0	115.2
667	S	40.5	Very low	37.9	Very low	107 Å²	107	142.2 Å²	142.2	75%	0.748	80%	0.798	S	S	*	*			trans	85.6	143.4	172.3	75.8	0	0	0	0	117.2
668	E	38.7	Very low	37.8	Very low	184 Å²	184	139 Å²	139	86%	0.86	80%	0.796	S	S	*	*			cis	-154.8	176.7	-1	-129.7	162.8	-141.2	0	0	113
669	E	37.1	Very low	37.5	Very low	176 Å²	176	139.8 Å²	139.8	82%	0.822	80%	0.801	S	S	*	*			trans	-98.2	172.1	-157	-54.4	164.9	120.9	0	0	116.8
670	S	43.9	Very low	37.2	Very low	123 Å²	123	139.8 Å²	139.8	86%	0.86	80%	0.802	S	S	*	*			trans	-157.7	127.2	151.9	67.7	0	0	0	0	113.2
671	E	35.5	Very low	37	Very low	180 Å²	180	139.3 Å²	139.3	84%	0.841	80%	0.798	S	S	*	*			trans	-106.6	157.9	-175.4	-52.2	174.9	99.5	0	0	114.3
672	S	39.9	Very low	36.7	Very low	117 Å²	117	140.9 Å²	140.9	82%	0.818	80%	0.804	S	S	*	*			trans	-166	86.2	145	66.9	0	0	0	0	115.5
673	E	36.9	Very low	36.2	Very low	173 Å²	173	140.1 Å²	140.1	81%	0.808	81%	0.813	S	S	*	*			trans	34.8	149.5	137.7	-62.3	-154.8	106.7	0	0	126.3
674	L	38.3	Very low	36	Very low	154 Å²	154	138.2 Å²	138.2	81%	0.806	82%	0.818	S	S	*	*			trans	77.6	135.9	154.4	-66.1	148.2	0	0	0	119.3
675	S	36	Very low	35.6	Very low	96 Å²	96	141 Å²	141	67%	0.671	83%	0.827	S	S	*	*			cis	-157.5	121.5	-5.1	60.3	0	0	0	0	115
676	S	35.7	Very low	34.9	Very low	118 Å²	118	137.7 Å²	137.7	83%	0.825	82%	0.823	S	S	*	*			trans	22.2	123.5	148.3	64.1	0	0	0	0	122.7
677	S	36.8	Very low	34.7	Very low	126 Å²	126	132.1 Å²	132.1	88%	0.881	81%	0.814	S	S	*	*				-151.5	155.6	114.2	67.6	0	0	0	0	109.9
678	S	32.3	Very low	34.2	Very low	121 Å²	121	133.3 Å²	133.3	85%	0.846	82%	0.819	S	S	*	*			trans	-125.9	136.7	-155.5	58.6	0	0	0	0	115.9
679	S	33.6	Very low	33.9	Very low	125 Å²	125	136.4 Å²	136.4	87%	0.874	82%	0.823	S	S	*	*			trans	-144.2	132.8	156	52.3	0	0	0	0	109.8
680	T	30.4	Very low	33.5	Very low	131 Å²	131	131.3 Å²	131.3	80%	0.804	82%	0.817	S	S	*	*			trans	-85.8	159.9	-165.2	29	0	0	0	0	115.7
681	S	32.1	Very low	33	Very low	96 Å²	96	135.4 Å²	135.4	67%	0.671	82%	0.82	S	S	*	*			trans	60.4	137.3	148	54	0	0	0	0	119
682	E	31.1	Very low	32.7	Very low	190 Å²	190	135.8 Å²	135.8	89%	0.888	82%	0.822	S	S	*	*			cis	-156.3	146.6	-3.3	-111.5	158.7	148.2	0	0	107.4
683	S	28.8	Very low	32.7	Very low	118 Å²	118	136.5 Å²	136.5	83%	0.825	82%	0.821	S	S	*	*			trans	-116.9	117.4	176	44.7	0	0	0	0	110.5
684	L	31.9	Very low	32.7	Very low	174 Å²	174	133.6 Å²	133.6	91%	0.911	82%	0.817	S	S	*	*			trans	-119.1	107.3	170.7	-81.2	171.1	0	0	0	109.2
685	S	28.6	Very low	32.4	Very low	126 Å²	126	135.5 Å²	135.5	88%	0.881	82%	0.822	S	S	*	*			trans	-74.9	126.7	162.7	52.8	0	0	0	0	109.6
686	G	30.1	Very low	32.4	Very low	78 Å²	78	141.7 Å²	141.7	80%	0.804	83%	0.832	S	S	*	*			trans	169.2	124.9	167.9	0	0	0	0	0	116.7
687	G	30.6	Very low	32.3	Very low	62 Å²	62	141.4 Å²	141.4	64%	0.639	82%	0.821	S	S	*	*			trans	93.9	137.8	150.2	0	0	0	0	0	117.2
688	P	30.5	Very low	32.1	Very low	132 Å²	132	146.9 Å²	146.9	86%	0.857	82%	0.822	S	S	*	*			trans	-72.3	153.2	162	33	-33.8	0	0	0	110.5	G690	P688-G690 PolarHBondContact O-N 3.09Å
689	W	30.7	Very low	32.4	Very low	249 Å²	249	150.5 Å²	150.5	94%	0.943	82%	0.817	S	S	*	*			trans	-83.3	104.6	-177.9	-77	62.6	0	0	0	111.4
690	G	30.4	Very low	32.5	Very low	68 Å²	68	153.1 Å²	153.1	70%	0.701	81%	0.813	S	S	*	*			trans	-88.5	134.7	162.7	0	0	0	0	0	110.8	P688	P688-G690 PolarHBondContact O-N 3.09Å
691	F	32.3	Very low	32.7	Very low	209 Å²	209	153.5 Å²	153.5	92%	0.917	81%	0.81	S	S	*	*			trans	-72.9	129	176.4	-87.6	-101.2	0	0	0	111.4
692	Q	30	Very low	32.9	Very low	189 Å²	189	158.4 Å²	158.4	88%	0.883	82%	0.823	S	S	*	*			trans	-97.6	110.5	165.6	-70.5	-170.3	-91.1	0	0	110
693	V	39.2	Very low	33	Very low	132 Å²	132	158 Å²	158	80%	0.8	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-74	131.2	167.8	-177.8	0	0	0	0	108.9
694	P	37.2	Very low	33.5	Very low	111 Å²	111	158 Å²	158	72%	0.721	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-69.3	139.1	178.8	-20.6	33.3	0	0	0	113.4
695	E	32.9	Very low	33.9	Very low	195 Å²	195	159 Å²	159	91%	0.911	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-63.8	132.7	171.8	-69.7	-175.7	112.7	0	0	112	D697	E695-D697 PolarHBondContact O-N 3.21Å
696	Y	34.5	Very low	34	Very low	226 Å²	226	163 Å²	163	89%	0.886	82%	0.816	S	S	*	*			trans	-95.1	82.1	179.3	-138	-80.5	0	0	0	111.1	R698	Y696-R698 PolarHBondContact O-N 3.33Å
697	D	34.9	Very low	34.5	Very low	111 Å²	111	164.8 Å²	164.8	59%	0.594	82%	0.817	S	S	*	*			trans	-65.5	106.1	-176.2	-169.4	12.4	0	0	0	112.3	E695 R699	E695-D697 PolarHBondContact O-N 3.21Å; D697-R699 VanDerWaalsContact CG-NE 3.25Å; D697-R699 PolarHBondContact O-N 3.1Å; D697-R699 VanDerWaalsContact O-N 3.13Å; D697-R699 WeakPolarHBondContact OD1-CG 3.34Å; D697-R699 IonicContact OD1-CZ 2.89Å; D697-R699 IonicContact OD1-NE 3.73Å; D697-R699 PolarHBondContact OD1-NE 3.17Å; D697-R699 IonicContact OD1-NH2 3.71Å; D697-R699 IonicContact OD2-CZ 3.93Å; D697-R699 IonicContact OD2-NE 2.87Å; D697-R699 PolarHBondContact OD2-NE 3.34Å; D697-R699 IonicContact OD2-NH2 2.67Å; D697-R699 PolarHBondContact OD2-NH2 3.36Å
698	R	32.8	Very low	34.7	Very low	241 Å²	241	168 Å²	168	91%	0.909	83%	0.826	S	S	*	*			trans	-89.5	77	-167.6	-156.3	176.2	-170.8	177.3	3.7	111.6	Y696	Y696-R698 PolarHBondContact O-N 3.33Å
699	R	37.9	Very low	34.9	Very low	197 Å²	197	165.5 Å²	165.5	74%	0.743	82%	0.824	S	S	*	*			trans	-120.2	104.3	-176.9	-63.5	-174.3	-161.7	-145.3	2.9	115.4	D697	D697-R699 VanDerWaalsContact CG-NE 3.25Å; D697-R699 PolarHBondContact O-N 3.1Å; D697-R699 VanDerWaalsContact O-N 3.13Å; D697-R699 WeakPolarHBondContact OD1-CG 3.34Å; D697-R699 IonicContact OD1-CZ 2.89Å; D697-R699 IonicContact OD1-NE 3.73Å; D697-R699 PolarHBondContact OD1-NE 3.17Å; D697-R699 IonicContact OD1-NH2 3.71Å; D697-R699 IonicContact OD2-CZ 3.93Å; D697-R699 IonicContact OD2-NE 2.87Å; D697-R699 PolarHBondContact OD2-NE 3.34Å; D697-R699 IonicContact OD2-NH2 2.67Å; D697-R699 PolarHBondContact OD2-NH2 3.36Å
700	K	36.1	Very low	35.1	Very low	181 Å²	181	158.5 Å²	158.5	79%	0.787	82%	0.82	S	S	*	*			trans	43.5	116.7	139.1	-63	-167.8	173.4	-171.4	0	120.6
701	D	33.4	Very low	35.4	Very low	139 Å²	139	163 Å²	163	74%	0.743	83%	0.828	S	S	*	*				46.9	93	117.3	-38.1	-38.8	0	0	0	119.1
702	E	37.4	Very low	35.5	Very low	199 Å²	199	157.2 Å²	157.2	93%	0.93	81%	0.813	S	S	*	*			trans	-161.7	131.4	139.8	-116.6	171.7	-154.5	0	0	112.3
703	E	33.5	Very low	35.9	Very low	182 Å²	182	156.9 Å²	156.9	85%	0.85	81%	0.812	S	S	*	*			trans	-76.1	152.6	174.4	-76	-163.8	124.6	0	0	112.5
704	P	39.4	Very low	35.6	Very low	118 Å²	118	153.6 Å²	153.6	77%	0.766	81%	0.805	S	S	*	*				-142.1	111.2	129	32.3	-15.9	0	0	0	116.5
705	K	39.1	Very low	35.6	Very low	194 Å²	194	159 Å²	159	84%	0.843	81%	0.812	S	S	*	*			trans	49.4	113.6	134.6	-67.3	172.5	-179.3	165.3	0	120.4
706	K	31.3	Very low	35.5	Very low	209 Å²	209	157.4 Å²	157.4	91%	0.909	81%	0.81	S	S	*	*			trans	-49.4	146.7	165.3	-67.4	171.8	174.8	170.5	0	115.5
707	S	39.9	Very low	35.6	Very low	117 Å²	117	153.4 Å²	153.4	82%	0.818	81%	0.809	S	S	*	*			trans	-138.6	153.9	135	65.8	0	0	0	0	109.7
708	P	35.9	Very low	35.4	Very low	128 Å²	128	152.6 Å²	152.6	83%	0.831	82%	0.818	S	S	*	*			trans	-119.2	151.6	-154.1	39.2	-28.3	0	0	0	116.9
709	G	33.3	Very low	35.4	Very low	80 Å²	80	153 Å²	153	83%	0.825	84%	0.837	S	S	*	*			trans	118.3	105.8	137.3	0	0	0	0	0	118.1
710	A	36.9	Very low	35.2	Very low	103 Å²	103	150.8 Å²	150.8	85%	0.851	84%	0.842	S	S	*	*			trans	-172.2	144.9	130.4	0	0	0	0	0	112.4
711	N	35.1	Very low	35.2	Very low	161 Å²	161	149.2 Å²	149.2	86%	0.861	85%	0.845	S	S	*	*			trans	-44.4	161.7	166	-56.7	-1.7	0	0	0	114.5
712	S	35.8	Very low	35.3	Very low	88 Å²	88	149.8 Å²	149.8	62%	0.615	85%	0.85	S	S	*	*			cis	-159.1	172.6	5.9	33.2	0	0	0	0	110.9
713	E	37.5	Very low	35.2	Very low	183 Å²	183	146.9 Å²	146.9	86%	0.855	85%	0.845	S	S	*	*			trans	62.5	119.3	157.8	-70.7	147	-124.2	0	0	117.7
714	G	32.5	Very low	35.3	Very low	63 Å²	63	144.7 Å²	144.7	65%	0.649	85%	0.845	S	S	*	*			cis	128.4	61.1	-5.4	0	0	0	0	0	114.4
715	Y	37.6	Very low	35	Very low	225 Å²	225	146.5 Å²	146.5	88%	0.882	85%	0.85	S	S	*	*			trans	-134.1	110.8	161.5	-83.4	-79.3	0	0	0	109.9
716	N	30.4	Very low	34.7	Very low	160 Å²	160	143.1 Å²	143.1	86%	0.856	85%	0.851	S	S	*	*			trans	-94.4	138.1	163	-66.3	-7.3	0	0	0	107.6
717	T	37.3	Very low	35	Very low	142 Å²	142	138 Å²	138	87%	0.871	85%	0.846	S	S	*	*			trans	-144.2	130.2	157.7	-52.3	0	0	0	0	106.2
718	A	31	Very low	34.5	Very low	95 Å²	95	139.8 Å²	139.8	79%	0.785	85%	0.849	S	S	*	*			trans	-119.5	124	-175.9	0	0	0	0	0	109.3
719	L	31.4	Very low	34.4	Very low	249 Å²	249	140.8 Å²	140.8	100%	1.304	85%	0.85	S	S	*	*			trans	-155.9	0	138.4	-106	164.8	0	0	0	107

Retrieved 719 of 719 residues in 531.7 ms (Link to these results)

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